A0A060XQY0_ONCMY Loading...

MPN domain-containing protein

Probable protease. Acts as a sensor of N(6)-methyladenosine methylation on DNA (m6A): recognizes and binds m6A DNA, leading to its degradation. Binds only double strand DNA (dsDNA) in a sequence-independent manner.

AlphaFold DB , UniProt , Accession A0A060XQY0, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene mpnd, Length 469 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	48.4	Very low	35.8	Very low	75 Å²	75	106.5 Å²	106.5	37%	0.369	57%	0.568	S	S	.	*				0	-119.8	0	-172.3	166.9	-92.5	0	0	108.4	Y264 E298 I301 C302 L305 L312	M1-Y264 HydrophobicContact CG-CE2 4.28Å; M1-Y264 HydrophobicContact SD-CD2 3.42Å; M1-Y264 WeakPolarHBondContact SD-CD2 3Å; M1-Y264 HydrophobicContact SD-CE2 3.6Å; M1-Y264 HydrophobicContact SD-CG 3.93Å; M1-E298 WeakPolarHBondContact CA-OE2 3.17Å; M1-E298 HydrophobicContact CB-CB 3.82Å; M1-E298 HydrophobicContact CB-CG 3.89Å; M1-E298 WeakPolarHBondContact CB-OE2 3.19Å; M1-E298 PolarHBondContact N-OE2 2.84Å; M1-I301 HydrophobicContact CE-CB 4.48Å; M1-I301 HydrophobicContact CE-CG2 4.11Å; M1-I301 HydrophobicContact SD-CB 4.37Å; M1-I301 HydrophobicContact SD-CG2 4.05Å; M1-C302 VanDerWaalsContact CE-CA 3.4Å; M1-C302 HydrophobicContact CE-CB 3.71Å; M1-L305 HydrophobicContact CE-CD1 3.63Å; M1-L312 HydrophobicContact CE-CD2 4.36Å; M1-L312 HydrophobicContact CG-CD2 3.71Å; M1-L312 HydrophobicContact SD-CD1 4.36Å; M1-L312 HydrophobicContact SD-CD2 4.18Å
2	F	40.3	Very low	35	Very low	8 Å²	8	103.8 Å²	103.8	4%	0.035	58%	0.584	C	S	.	*	P	Polyproline II helix	trans	-98.3	123.5	169.2	-64.2	-54.4	0	0	0	108.1	M4 Y264 E298 L312 H337 R340 L341	F2-M4 PolarHBondContact O-N 2.9Å; F2-Y264 HydrophobicContact CB-CE1 4.11Å; F2-Y264 AromaticContact CD2-CD1 3.98Å; F2-Y264 HydrophobicContact CD2-CD1 3.98Å; F2-Y264 AromaticContact CD2-CE1 3.71Å; F2-Y264 HydrophobicContact CD2-CE1 3.71Å; F2-Y264 HydrophobicContact CG-CE1 4.41Å; F2-Y264 PolarHBondContact O-OH 3.03Å; F2-E298 PolarHBondContact N-OE2 2.87Å; F2-E298 VanDerWaalsContact O-CD 3.28Å; F2-L312 HydrophobicContact CD2-CD2 3.81Å; F2-L312 HydrophobicContact CE1-CD2 4.33Å; F2-L312 HydrophobicContact CE2-CD1 4.19Å; F2-L312 HydrophobicContact CE2-CD2 3.51Å; F2-L312 HydrophobicContact CE2-CG 3.86Å; F2-L312 HydrophobicContact CG-CD2 4.37Å; F2-L312 HydrophobicContact CZ-CD2 3.82Å; F2-L312 HydrophobicContact CZ-CG 4.25Å; F2-H337 VanDerWaalsContact CB-CE1 3.47Å; F2-H337 WeakPolarHBondContact CB-CE1 3.33Å; F2-H337 AromaticContact CD1-ND1 3.26Å; F2-H337 VanDerWaalsContact CD1-ND1 3.26Å; F2-H337 WeakPolarHBondContact CD1-ND1 3.39Å; F2-H337 AromaticContact CD2-CE1 3.51Å; F2-H337 AromaticContact CD2-ND1 3.13Å; F2-H337 WeakPolarHBondContact CD2-ND1 3.33Å; F2-H337 HydrophobicContact CE1-CB 4.13Å; F2-H337 AromaticContact CE1-ND1 3.43Å; F2-H337 WeakPolarHBondContact CE1-ND1 3.38Å; F2-H337 HydrophobicContact CE2-CB 4.43Å; F2-H337 AromaticContact CE2-ND1 3.29Å; F2-H337 VanDerWaalsContact CE2-ND1 3.29Å; F2-H337 WeakPolarHBondContact CE2-ND1 3.46Å; F2-H337 AromaticContact CG-CE1 3.46Å; F2-H337 VanDerWaalsContact CG-CE1 3.46Å; F2-H337 WeakPolarHBondContact CG-CE1 3.4Å; F2-H337 AromaticContact CG-ND1 3.09Å; F2-H337 WeakPolarHBondContact CG-ND1 3.21Å; F2-H337 HydrophobicContact CZ-CB 3.94Å; F2-H337 AromaticContact CZ-ND1 3.42Å; F2-H337 WeakPolarHBondContact CZ-ND1 3.31Å; F2-R340 HydrophobicContact CD1-CB 4.43Å; F2-R340 HydrophobicContact CE1-CB 3.94Å; F2-L341 HydrophobicContact CE1-CG 4.22Å; F2-L341 HydrophobicContact CZ-CD1 3.8Å; F2-L341 HydrophobicContact CZ-CD2 4.36Å; F2-L341 HydrophobicContact CZ-CG 3.81Å
3	P	38.2	Very low	34.5	Very low	83 Å²	83	104.6 Å²	104.6	54%	0.539	60%	0.601	S	S	.	*	P	Polyproline II helix	trans	-65.9	133.8	-175.3	28.3	-34.8	0	0	0	111.5	G5	P3-G5 PolarHBondContact O-N 3.11Å
4	M	45.6	Very low	34.1	Very low	42 Å²	42	111.4 Å²	111.4	21%	0.207	62%	0.624	C	S	.	*	P	Polyproline II helix	trans	-54.5	135.4	165.3	-82.8	-172.1	158.7	0	0	111.2	F2 V262 T286 L288 A294	F2-M4 PolarHBondContact O-N 2.9Å; M4-V262 HydrophobicContact CE-CG2 3.58Å; M4-T286 HydrophobicContact CE-CG2 3.67Å; M4-L288 HydrophobicContact CE-CD2 4.08Å; M4-A294 HydrophobicContact SD-CB 3.73Å
5	G	37.1	Very low	34.7	Very low	59 Å²	59	111.2 Å²	111.2	61%	0.608	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-61.2	139	177.7	0	0	0	0	0	112.2	P3	P3-G5 PolarHBondContact O-N 3.11Å
6	M	31.8	Very low	34.9	Very low	139 Å²	139	111.2 Å²	111.2	69%	0.685	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-84.8	135.9	-174.5	-53	-159.9	-159.2	0	0	112.5	R291	M6-R291 PolarHBondContact SD-NH1 2.99Å; M6-R291 VanDerWaalsContact SD-NH1 3.42Å; M6-R291 PolarHBondContact SD-NH2 2.78Å
7	A	31.6	Very low	34.6	Very low	99 Å²	99	114.6 Å²	114.6	82%	0.818	65%	0.65	S	S	*	*			trans	-107.4	124.8	159.8	0	0	0	0	0	110.4
8	E	31.8	Very low	34.4	Very low	126 Å²	126	114.3 Å²	114.3	59%	0.589	66%	0.657	S	S	*	*			trans	-137.3	151.9	170.5	-73.8	-146.4	138.5	0	0	107.2
9	R	32.1	Very low	34.7	Very low	164 Å²	164	114.3 Å²	114.3	62%	0.619	66%	0.661	S	S	*	*			cis	-167.1	153.9	-5.3	-115.6	-176.6	-155.9	175.7	16.6	108.4
10	T	29.1	Very low	34.4	Very low	151 Å²	151	117.6 Å²	117.6	93%	0.926	67%	0.67	S	S	*	*			trans	-141.5	164.3	144	43.5	0	0	0	0	109.5
11	R	28.3	Very low	34.2	Very low	225 Å²	225	117.9 Å²	117.9	85%	0.849	67%	0.674	S	S	*	*			trans	-131.5	147.4	-163.9	-92	-177.9	163.4	-172.7	-5.7	114.2
12	G	26.1	Very low	33.3	Very low	74 Å²	74	120.6 Å²	120.6	76%	0.763	69%	0.694	S	S	*	*			trans	149.5	143.7	159.4	0	0	0	0	0	112.1
13	S	27.9	Very low	32.8	Very low	115 Å²	115	128 Å²	128	80%	0.804	73%	0.729	S	S	*	*			cis	-169	120.3	-11.6	47.8	0	0	0	0	112
14	E	29.9	Very low	32.4	Very low	199 Å²	199	132.6 Å²	132.6	93%	0.93	74%	0.743	S	S	*	*			trans	57.4	159.7	156.1	-71	-163.1	138.1	0	0	122.3
15	P	42.8	Very low	31.4	Very low	109 Å²	109	134 Å²	134	71%	0.708	77%	0.769	S	S	*	*			trans	-109.8	-171	-157.2	42.9	-34.7	0	0	0	114.8
16	P	38.2	Very low	30.9	Very low	111 Å²	111	134.9 Å²	134.9	72%	0.721	77%	0.77	S	S	*	*				-149.4	149.3	109.8	37.7	-21.6	0	0	0	118.4
17	L	28.9	Very low	30.8	Very low	169 Å²	169	135.8 Å²	135.8	89%	0.885	77%	0.773	S	S	*	*			trans	58.2	136.2	137.8	-63	168.7	0	0	0	123.7
18	S	31	Very low	30.6	Very low	110 Å²	110	139 Å²	139	77%	0.769	77%	0.771	S	S	*	*			trans	-102.8	173.2	158.3	-44.2	0	0	0	0	110.7
19	P	39.8	Very low	30.5	Very low	113 Å²	113	140.9 Å²	140.9	73%	0.734	78%	0.78	S	S	*	*				-151.7	147.4	110.3	37.6	-21.1	0	0	0	117.3
20	Q	29.7	Very low	30.3	Very low	181 Å²	181	141.3 Å²	141.3	85%	0.846	79%	0.789	S	S	*	*			trans	46.5	152.9	135.5	-69	176.2	-32.7	0	0	121.9
21	V	29.6	Very low	30.3	Very low	124 Å²	124	142.1 Å²	142.1	75%	0.752	78%	0.782	S	S	*	*			cis	151	119.2	-14.3	146.5	0	0	0	0	106.8
22	V	29.6	Very low	30.1	Very low	131 Å²	131	139.3 Å²	139.3	79%	0.794	78%	0.779	S	S	*	*			trans	-168.1	137.8	148.7	-129.1	0	0	0	0	104.8
23	E	29.5	Very low	30.1	Very low	163 Å²	163	142 Å²	142	76%	0.762	78%	0.775	S	S	*	*			cis	66.5	138	47.6	-87.3	170.4	-176	0	0	113.5
24	E	29.2	Very low	29.9	Very low	180 Å²	180	142.1 Å²	142.1	84%	0.841	78%	0.776	S	S	*	*			cis	-161.8	164.2	15.4	-153.1	175.6	-160.6	0	0	112.8
25	G	25.2	Very low	29.7	Very low	72 Å²	72	136.6 Å²	136.6	74%	0.742	77%	0.772	S	S	*	*			trans	71.3	159.1	157.8	0	0	0	0	0	120.6
26	A	27.5	Very low	28.8	Very low	78 Å²	78	135.2 Å²	135.2	65%	0.645	78%	0.778	S	S	*	*			cis	-166.2	150.9	-11.1	0	0	0	0	0	110.7
27	E	28.2	Very low	28.3	Very low	158 Å²	158	139.5 Å²	139.5	74%	0.738	79%	0.788	S	S	*	*				42.1	146.1	116.9	-68.7	65.5	-87	0	0	119.6
28	E	28.7	Very low	28.1	Very low	166 Å²	166	140.8 Å²	140.8	78%	0.776	79%	0.789	S	S	*	*			cis	-163.5	172.6	13	-94.2	143.3	-155.1	0	0	107.9
29	E	28.6	Very low	27.9	Very low	165 Å²	165	141 Å²	141	77%	0.771	79%	0.791	S	S	*	*			cis	-166.7	157.6	-28.7	-102.3	-172.4	153.8	0	0	111.2
30	E	28.6	Very low	27.2	Very low	174 Å²	174	143.1 Å²	143.1	81%	0.813	80%	0.796	S	S	*	*			trans	56	174.4	160	-57	-169.9	146.1	0	0	121.6
31	E	28.4	Very low	27	Very low	168 Å²	168	142.5 Å²	142.5	79%	0.785	80%	0.798	S	S	*	*			cis	-135.4	150.2	7.4	-85.1	-173.5	139.8	0	0	110.5
32	E	25.1	Very low	27.2	Very low	166 Å²	166	147.9 Å²	147.9	78%	0.776	81%	0.805	S	S	*	*				49.6	148.3	91.7	-63.4	-135.4	140.6	0	0	117.5
33	L	25.9	Very low	27	Very low	131 Å²	131	147 Å²	147	69%	0.686	80%	0.8	S	S	*	*			cis	-161.6	157.7	6.2	-129.6	174.7	0	0	0	113.2
34	S	23.6	Very low	27.1	Very low	117 Å²	117	145.1 Å²	145.1	82%	0.818	80%	0.802	S	S	*	*			trans	75	156.8	148.4	82.1	0	0	0	0	122.4
35	G	25.3	Very low	27.1	Very low	82 Å²	82	142.4 Å²	142.4	85%	0.845	80%	0.802	S	S	*	*			trans	120.2	103	165.8	0	0	0	0	0	114.6
36	G	23.6	Very low	27.2	Very low	81 Å²	81	142.3 Å²	142.3	84%	0.835	80%	0.801	S	S	*	*			trans	-149.7	153.2	177.8	0	0	0	0	0	113.8
37	E	27.2	Very low	27.3	Very low	200 Å²	200	150.9 Å²	150.9	94%	0.935	82%	0.817	S	S	*	*			trans	-148.2	159.4	171	-111	174.9	-170.4	0	0	109.5
38	E	26.2	Very low	27.4	Very low	196 Å²	196	146.4 Å²	146.4	92%	0.916	81%	0.814	S	S	*	*			trans	-86	146.5	-159.7	-61.3	-179.1	97.5	0	0	115.8
39	S	25.4	Very low	27.6	Very low	115 Å²	115	142.5 Å²	142.5	80%	0.804	81%	0.805	S	S	*	*			trans	-160.6	138.3	143	39.6	0	0	0	0	113.6
40	D	26.4	Very low	28	Very low	158 Å²	158	140.8 Å²	140.8	85%	0.845	80%	0.8	S	S	*	*			trans	40	78.2	161.2	-69.5	-21.6	0	0	0	120.4	R42	D40-R42 VanDerWaalsContact C-N 3.31Å; D40-R42 PolarHBondContact O-N 2.96Å
41	L	24.9	Very low	28.3	Very low	167 Å²	167	135.1 Å²	135.1	87%	0.874	78%	0.775	S	S	*	*			trans	-70.5	80.4	159.7	-85	171	0	0	0	112.6
42	R	34.6	Very low	29.2	Very low	237 Å²	237	131.7 Å²	131.7	89%	0.894	77%	0.766	S	S	*	*			trans	-129	52.1	162.3	-81.7	-165.8	170.2	-162.5	-0.4	112.8	D40	D40-R42 VanDerWaalsContact C-N 3.31Å; D40-R42 PolarHBondContact O-N 2.96Å
43	T	24.5	Very low	30.1	Very low	113 Å²	113	132 Å²	132	69%	0.693	76%	0.76	S	S	*	*			trans	-81.8	125.6	177.5	-19.6	0	0	0	0	111.7	S45	T43-S45 PolarHBondContact O-N 2.68Å
44	P	32.9	Very low	30.9	Very low	123 Å²	123	132.8 Å²	132.8	80%	0.799	75%	0.754	S	S	*	*			trans	-83.6	107.2	-175.6	31.4	-34.1	0	0	0	112.7	G46	P44-G46 PolarHBondContact O-N 3.28Å
45	S	27.3	Very low	32.3	Very low	123 Å²	123	128.7 Å²	128.7	86%	0.86	73%	0.73	S	S	*	*			trans	-81.4	97.9	-176.8	39.8	0	0	0	0	114.1	T43	T43-S45 PolarHBondContact O-N 2.68Å
46	G	28.5	Very low	34.4	Very low	70 Å²	70	124.9 Å²	124.9	72%	0.722	69%	0.69	S	S	*	*			trans	76	90.5	151.8	0	0	0	0	0	117.5	P44 G48	P44-G46 PolarHBondContact O-N 3.28Å; G46-G48 PolarHBondContact O-N 3.01Å
47	R	29.9	Very low	37	Very low	258 Å²	258	124.2 Å²	124.2	97%	0.974	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-63.2	119.9	160.5	-77.7	-177.4	171.9	172.7	-2.1	109.3
48	G	29.2	Very low	39.3	Very low	65 Å²	65	115 Å²	115	67%	0.67	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-67.3	143.2	-170.7	0	0	0	0	0	114.5	G46	G46-G48 PolarHBondContact O-N 3.01Å
49	S	34.1	Very low	41.7	Very low	83 Å²	83	112.9 Å²	112.9	58%	0.58	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-70.6	126	166.9	-179.7	0	0	0	0	110	L51	S49-L51 PolarHBondContact O-N 2.89Å
50	L	35.8	Very low	44.4	Very low	129 Å²	129	108.9 Å²	108.9	68%	0.675	58%	0.581	S	S	*	*			trans	-75.8	71	178.8	-73.7	169.8	0	0	0	111.3	T52	L50-T52 PolarHBondContact O-N 2.96Å
51	L	36.3	Very low	46.9	Very low	55 Å²	55	101.3 Å²	101.3	29%	0.288	54%	0.541	S	S	.	.			trans	-68.4	110.1	175	-69.7	175.1	0	0	0	110.8	S49 V60 W143	S49-L51 PolarHBondContact O-N 2.89Å; L51-V60 HydrophobicContact CD1-CG1 4.23Å; L51-V60 HydrophobicContact CD1-CG2 4.49Å; L51-W143 HydrophobicContact CB-CH2 3.85Å; L51-W143 HydrophobicContact CB-CZ3 4.16Å; L51-W143 HydrophobicContact CD1-CH2 3.76Å; L51-W143 HydrophobicContact CD1-CZ2 4.06Å; L51-W143 HydrophobicContact CG-CH2 4.29Å
52	T	46.8	Very low	49.5	Very low	97 Å²	97	94.9 Å²	94.9	60%	0.595	51%	0.508	S	S	*	.			trans	-62.1	165.3	173.8	71.8	0	0	0	0	112	L50 R54 G55	L50-T52 PolarHBondContact O-N 2.96Å; T52-R54 PolarHBondContact O-N 3.5Å; T52-G55 PolarHBondContact O-N 3.24Å
53	R	42.7	Very low	51.6	Low	171 Å²	171	92.2 Å²	92.2	65%	0.645	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-18	177.9	-118.2	-173.4	178.8	-167.7	0.9	114.9	K140 L144	R53-K140 WeakPolarHBondContact O-CE 3.44Å; R53-K140 PolarHBondContact O-NZ 2.99Å; R53-L144 HydrophobicContact CG-CD1 3.43Å; R53-L144 VanDerWaalsContact CG-CD1 3.43Å
54	R	43.2	Very low	54	Low	148 Å²	148	89.9 Å²	89.9	56%	0.558	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-24.9	175.8	-65.4	-173.9	-174.6	136.5	11.4	114.1	T52 I56 S344 S345	T52-R54 PolarHBondContact O-N 3.5Å; R54-I56 PolarHBondContact O-N 2.95Å; R54-S344 PolarHBondContact NH2-O 3.39Å; R54-S345 PolarHBondContact NH2-OG 3.03Å; R54-S345 VanDerWaalsContact NH2-OG 3.14Å
55	G	52.9	Low	56.1	Low	32 Å²	32	86.9 Å²	86.9	33%	0.33	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-21.3	-176.2	0	0	0	0	0	116	T52 T57	T52-G55 PolarHBondContact O-N 3.24Å; G55-T57 PolarHBondContact O-N 2.86Å
56	I	69.3	Low	58.6	Low	1 Å²	1	83.9 Å²	83.9	1%	0.005	45%	0.451	C	S	.	.			trans	-72.8	111.3	-178.7	-55.4	160	0	0	0	110.2	R54 V60 L61 W126 K140 W143 L144	R54-I56 PolarHBondContact O-N 2.95Å; I56-V60 HydrophobicContact CG2-CG1 4.45Å; I56-L61 HydrophobicContact CG2-CD1 4.47Å; I56-L61 HydrophobicContact CG2-CD2 3.89Å; I56-L61 HydrophobicContact CG2-CG 4Å; I56-W126 WeakPolarHBondContact O-CH2 3.47Å; I56-W126 WeakPolarHBondContact O-CZ2 3.37Å; I56-K140 HydrophobicContact CB-CD 4.16Å; I56-K140 HydrophobicContact CB-CG 4.24Å; I56-K140 HydrophobicContact CD1-CG 3.87Å; I56-K140 HydrophobicContact CG2-CD 4.24Å; I56-K140 HydrophobicContact CG2-CG 4.13Å; I56-K140 PolarHBondContact O-NZ 3.1Å; I56-W143 HydrophobicContact CD1-CD2 4.22Å; I56-W143 HydrophobicContact CD1-CE3 3.36Å; I56-W143 HydrophobicContact CD1-CZ3 3.75Å; I56-W143 HydrophobicContact CG1-CD2 4.44Å; I56-W143 HydrophobicContact CG1-CE3 3.8Å; I56-W143 HydrophobicContact CG1-CZ3 3.88Å; I56-L144 HydrophobicContact CD1-CD1 4.03Å; I56-L144 HydrophobicContact CD1-CD2 3.75Å; I56-L144 HydrophobicContact CD1-CG 3.62Å
57	T	79.1	Confident	61.2	Low	68 Å²	68	80.6 Å²	80.6	42%	0.417	42%	0.417	S	S	.	.			trans	-104.7	171.3	174.5	66.5	0	0	0	0	111.4	G55 R59 V60 L61	G55-T57 PolarHBondContact O-N 2.86Å; T57-R59 PolarHBondContact O-N 3.5Å; T57-R59 PolarHBondContact OG1-N 3.26Å; T57-V60 PolarHBondContact O-N 3.13Å; T57-V60 PolarHBondContact OG1-N 3.38Å; T57-L61 PolarHBondContact O-N 3.45Å
58	L	75	Confident	63.8	Low	5 Å²	5	73.3 Å²	73.3	3%	0.026	39%	0.394	C	S	.	.	H	α-helix	trans	-58.9	-35.7	171.4	-83.6	173.3	0	0	0	112.1	V60 L61 L62 L87 I93 P105 L136	L58-V60 VanDerWaalsContact C-N 3.31Å; L58-V60 PolarHBondContact O-N 3.5Å; L58-L61 PolarHBondContact O-N 3.18Å; L58-L62 WeakPolarHBondContact O-CB 3.48Å; L58-L62 WeakPolarHBondContact O-CG 3.49Å; L58-L62 PolarHBondContact O-N 2.87Å; L58-L87 HydrophobicContact CD1-CD1 3.86Å; L58-L87 HydrophobicContact CD2-CD1 4.49Å; L58-L87 HydrophobicContact CD2-CD2 4.49Å; L58-I93 HydrophobicContact CD1-CD1 3.93Å; L58-I93 HydrophobicContact CD1-CG1 3.86Å; L58-P105 HydrophobicContact CD1-CG 3.66Å; L58-P105 HydrophobicContact CG-CG 3.9Å; L58-L136 HydrophobicContact CD2-CD1 4Å; L58-L136 HydrophobicContact CD2-CD2 4.15Å
59	R	77.4	Confident	66.6	Low	153 Å²	153	72.7 Å²	72.7	58%	0.577	38%	0.378	S	S	*	.	H	α-helix	trans	-63.4	-34.1	176.6	-173.3	178.5	-69.1	-172.5	-4.1	112.7	T57 K63 D90	T57-R59 PolarHBondContact O-N 3.5Å; T57-R59 PolarHBondContact OG1-N 3.26Å; R59-K63 WeakPolarHBondContact O-CB 3.38Å; R59-K63 PolarHBondContact O-N 3.36Å; R59-D90 VanDerWaalsContact CZ-O 3.28Å; R59-D90 PolarHBondContact NE-O 3.1Å; R59-D90 PolarHBondContact NH2-O 2.92Å
60	V	81.5	Confident	69.2	Low	30 Å²	30	70 Å²	70	18%	0.182	36%	0.363	C	S	.	.	H	α-helix	trans	-66.7	-45.9	172.8	175.3	0	0	0	0	110.4	L51 I56 T57 L58 L62 K63 D64 W143	L51-V60 HydrophobicContact CD1-CG1 4.23Å; L51-V60 HydrophobicContact CD1-CG2 4.49Å; I56-V60 HydrophobicContact CG2-CG1 4.45Å; T57-V60 PolarHBondContact O-N 3.13Å; T57-V60 PolarHBondContact OG1-N 3.38Å; L58-V60 VanDerWaalsContact C-N 3.31Å; L58-V60 PolarHBondContact O-N 3.5Å; V60-L62 VanDerWaalsContact C-N 3.32Å; V60-L62 PolarHBondContact O-N 2.96Å; V60-K63 PolarHBondContact O-N 3.22Å; V60-D64 PolarHBondContact O-N 2.83Å; V60-W143 HydrophobicContact CG1-CZ2 4.29Å
61	L	78.8	Confident	71.6	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-67.3	-30.5	179.2	-61.7	177.1	0	0	0	113.3	I56 T57 L58 G65 L66 V67 W126 W143	I56-L61 HydrophobicContact CG2-CD1 4.47Å; I56-L61 HydrophobicContact CG2-CD2 3.89Å; I56-L61 HydrophobicContact CG2-CG 4Å; T57-L61 PolarHBondContact O-N 3.45Å; L58-L61 PolarHBondContact O-N 3.18Å; L61-G65 PolarHBondContact O-N 2.88Å; L61-L66 HydrophobicContact CD2-CB 4.39Å; L61-L66 HydrophobicContact CD2-CD1 3.9Å; L61-L66 PolarHBondContact O-N 2.89Å; L61-V67 HydrophobicContact CB-CB 4.16Å; L61-V67 HydrophobicContact CB-CG2 3.8Å; L61-V67 HydrophobicContact CD1-CG2 4.15Å; L61-V67 PolarHBondContact O-N 3.27Å; L61-W126 HydrophobicContact CD1-CH2 4.28Å; L61-W126 HydrophobicContact CD1-CZ3 3.9Å; L61-W143 HydrophobicContact CD2-CB 4.23Å; L61-W143 HydrophobicContact CD2-CG 4.33Å
62	L	80.8	Confident	73.9	Confident	32 Å²	32	69 Å²	69	17%	0.168	37%	0.367	C	S	.	.	H	α-helix	trans	-68.3	-49.5	170.4	-81.1	156.4	0	0	0	111.6	L58 V60 D64 G65 V67 P69 L87	L58-L62 WeakPolarHBondContact O-CB 3.48Å; L58-L62 WeakPolarHBondContact O-CG 3.49Å; L58-L62 PolarHBondContact O-N 2.87Å; V60-L62 VanDerWaalsContact C-N 3.32Å; V60-L62 PolarHBondContact O-N 2.96Å; L62-D64 VanDerWaalsContact C-N 3.26Å; L62-D64 PolarHBondContact O-N 3Å; L62-G65 PolarHBondContact O-N 2.72Å; L62-G65 VanDerWaalsContact O-N 3.15Å; L62-V67 WeakPolarHBondContact CA-O 3.31Å; L62-V67 VanDerWaalsContact CD2-O 3.25Å; L62-V67 WeakPolarHBondContact CD2-O 3.31Å; L62-P69 HydrophobicContact CD2-CB 4.2Å; L62-P69 HydrophobicContact CD2-CG 4.28Å; L62-L87 HydrophobicContact CD1-CD1 4.23Å; L62-L87 HydrophobicContact CD1-CD2 4.37Å; L62-L87 HydrophobicContact CD1-CG 4.38Å; L62-L87 HydrophobicContact CD2-CD2 4.17Å; L62-L87 HydrophobicContact CG-CD2 4.35Å
63	K	77.6	Confident	75.8	Confident	181 Å²	181	65.4 Å²	65.4	79%	0.787	35%	0.345	S	S	*	.	H	α-helix	trans	-59.7	-37.6	-179.6	-173.3	-178.7	178.7	-176.4	0	112.3	R59 V60 G65	R59-K63 WeakPolarHBondContact O-CB 3.38Å; R59-K63 PolarHBondContact O-N 3.36Å; V60-K63 PolarHBondContact O-N 3.22Å; K63-G65 VanDerWaalsContact C-N 3.34Å
64	D	76.1	Confident	78	Confident	64 Å²	64	57.2 Å²	57.2	34%	0.342	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	11.1	-178.1	-63.6	5.1	0	0	0	112.9	V60 L62 L66 W143	V60-D64 PolarHBondContact O-N 2.83Å; L62-D64 VanDerWaalsContact C-N 3.26Å; L62-D64 PolarHBondContact O-N 3Å; D64-L66 VanDerWaalsContact C-N 3.3Å; D64-L66 PolarHBondContact O-N 2.65Å; D64-W143 PolarHBondContact OD2-NE1 3.08Å
65	G	76.4	Confident	80.2	Confident	60 Å²	60	50.9 Å²	50.9	62%	0.619	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	14.1	171.4	0	0	0	0	0	116.4	L61 L62 K63	L61-G65 PolarHBondContact O-N 2.88Å; L62-G65 PolarHBondContact O-N 2.72Å; L62-G65 VanDerWaalsContact O-N 3.15Å; K63-G65 VanDerWaalsContact C-N 3.34Å
66	L	78.9	Confident	81.8	Confident	59 Å²	59	49.3 Å²	49.3	31%	0.309	28%	0.277	S	S	.	.	S	Bend	trans	-81.2	-19.2	178	-76	-178.3	0	0	0	113.7	L61 D64 W143	L61-L66 HydrophobicContact CD2-CB 4.39Å; L61-L66 HydrophobicContact CD2-CD1 3.9Å; L61-L66 PolarHBondContact O-N 2.89Å; D64-L66 VanDerWaalsContact C-N 3.3Å; D64-L66 PolarHBondContact O-N 2.65Å; L66-W143 HydrophobicContact CD1-CB 3.68Å; L66-W143 HydrophobicContact CD1-CG 4.04Å
67	V	84.2	Confident	82.6	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.012	30%	0.296	C	S	.	.	S	Bend	trans	-143.3	123.2	-177.2	-179.1	0	0	0	0	107.4	L61 L62 L87 Y131 Y139	L61-V67 HydrophobicContact CB-CB 4.16Å; L61-V67 HydrophobicContact CB-CG2 3.8Å; L61-V67 HydrophobicContact CD1-CG2 4.15Å; L61-V67 PolarHBondContact O-N 3.27Å; L62-V67 WeakPolarHBondContact CA-O 3.31Å; L62-V67 VanDerWaalsContact CD2-O 3.25Å; L62-V67 WeakPolarHBondContact CD2-O 3.31Å; V67-L87 HydrophobicContact CG1-CD2 3.33Å; V67-Y131 HydrophobicContact CG1-CD1 4.15Å; V67-Y131 HydrophobicContact CG1-CD2 3.62Å; V67-Y131 HydrophobicContact CG1-CE1 4.01Å; V67-Y131 HydrophobicContact CG1-CE2 3.44Å; V67-Y131 VanDerWaalsContact CG1-CE2 3.44Å; V67-Y131 HydrophobicContact CG1-CG 3.96Å; V67-Y139 HydrophobicContact CG2-CD1 4.49Å; V67-Y139 HydrophobicContact CG2-CG 4.49Å
68	E	83.1	Confident	82.7	Confident	104 Å²	104	51.9 Å²	51.9	49%	0.486	28%	0.283	S	S	.	.			trans	-94.8	146	178.2	-57.5	170.2	142	0	0	110.8	Y131 R132	E68-Y131 WeakPolarHBondContact CA-OH 3.38Å; E68-Y131 WeakPolarHBondContact CB-OH 3.46Å; E68-Y131 PolarHBondContact N-OH 2.86Å; E68-Y131 WeakPolarHBondContact O-CE2 3.24Å; E68-Y131 PolarHBondContact O-OH 3.19Å; E68-R132 IonicContact OE2-CZ 3.43Å; E68-R132 IonicContact OE2-NH1 2.66Å; E68-R132 PolarHBondContact OE2-NH1 3.4Å; E68-R132 IonicContact OE2-NH2 3.47Å; E68-R132 PolarHBondContact OE2-NH2 3.42Å
69	P	88.4	Confident	82.8	Confident	53 Å²	53	57.2 Å²	57.2	34%	0.344	31%	0.31	S	S	.	.			trans	-67.3	163	170.9	32.9	-34.5	0	0	0	111	L62 L87 N89	L62-P69 HydrophobicContact CD2-CB 4.2Å; L62-P69 HydrophobicContact CD2-CG 4.28Å; P69-L87 CarbonylContact C-O 3.4Å; P69-L87 VanDerWaalsContact CA-O 3.3Å; P69-L87 WeakPolarHBondContact CA-O 3.41Å; P69-L87 VanDerWaalsContact CB-O 3.26Å; P69-L87 WeakPolarHBondContact CB-O 3.37Å; P69-N89 VanDerWaalsContact CB-OD1 3.31Å; P69-N89 WeakPolarHBondContact CB-OD1 3.31Å
70	G	88.3	Confident	82.7	Confident	25 Å²	25	54.2 Å²	54.2	26%	0.258	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	149.8	168.8	177.3	0	0	0	0	0	114	V73 D86 L87	G70-V73 VanDerWaalsContact O-CG2 3.24Å; G70-V73 WeakPolarHBondContact O-CG2 3.4Å; G70-D86 WeakPolarHBondContact O-CA 3.39Å; G70-L87 PolarHBondContact N-O 2.97Å; G70-L87 PolarHBondContact O-N 3.4Å
71	D	86.3	Confident	82.7	Confident	128 Å²	128	58.3 Å²	58.3	68%	0.684	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82	140.6	-172.7	-53.7	-46.3	0	0	0	112.3	V73 D86	D71-V73 PolarHBondContact O-N 3.33Å; D71-D86 WeakPolarHBondContact CA-OD1 3.46Å
72	G	84.9	Confident	83.1	Confident	36 Å²	36	64.3 Å²	64.3	37%	0.371	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	61.8	4.9	179.7	0	0	0	0	0	117	L74 G85 D86	G72-L74 VanDerWaalsContact C-N 3.26Å; G72-L74 PolarHBondContact O-N 2.56Å; G72-G85 CarbonylContact C-O 3.54Å; G72-D86 PolarHBondContact N-OD1 3.43Å
73	V	87.2	Confident	83.5	Confident	21 Å²	21	63.4 Å²	63.4	13%	0.127	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	-18.9	-172.7	-59.7	0	0	0	0	114.2	G70 D71 G85 L87 Y131 R132	G70-V73 VanDerWaalsContact O-CG2 3.24Å; G70-V73 WeakPolarHBondContact O-CG2 3.4Å; D71-V73 PolarHBondContact O-N 3.33Å; V73-G85 PolarHBondContact N-O 3.13Å; V73-L87 HydrophobicContact CG2-CB 3.66Å; V73-Y131 HydrophobicContact CB-CD2 4Å; V73-Y131 HydrophobicContact CB-CE2 3.62Å; V73-Y131 HydrophobicContact CG1-CE2 4.43Å; V73-Y131 HydrophobicContact CG2-CD2 3.88Å; V73-Y131 HydrophobicContact CG2-CE2 3.5Å; V73-Y131 VanDerWaalsContact CG2-CE2 3.5Å; V73-Y131 WeakPolarHBondContact O-CA 3.31Å; V73-R132 PolarHBondContact O-N 2.95Å
74	L	88.9	Confident	84.1	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	143.5	177.2	-63.5	169.3	0	0	0	111.5	G72 V84 G85 L87 I93 W108 V129 R130 Y131 L136	G72-L74 VanDerWaalsContact C-N 3.26Å; G72-L74 PolarHBondContact O-N 2.56Å; L74-V84 WeakPolarHBondContact O-CA 3.24Å; L74-G85 WeakPolarHBondContact CB-O 3.41Å; L74-G85 PolarHBondContact N-O 3.39Å; L74-G85 PolarHBondContact O-N 3.39Å; L74-L87 HydrophobicContact CD1-CB 4.02Å; L74-L87 HydrophobicContact CD1-CD1 4.35Å; L74-L87 HydrophobicContact CG-CB 4.41Å; L74-I93 HydrophobicContact CD1-CB 4.29Å; L74-I93 HydrophobicContact CD1-CD1 3.91Å; L74-I93 HydrophobicContact CD1-CG1 3.67Å; L74-I93 HydrophobicContact CD1-CG2 3.82Å; L74-W108 HydrophobicContact CB-CH2 4Å; L74-W108 HydrophobicContact CB-CZ3 3.8Å; L74-V129 HydrophobicContact CB-CG1 4.45Å; L74-V129 HydrophobicContact CD2-CG1 3.83Å; L74-R130 CarbonylContact C-O 3.53Å; L74-R130 VanDerWaalsContact CA-O 3.3Å; L74-R130 WeakPolarHBondContact CA-O 3.45Å; L74-Y131 HydrophobicContact CD2-CD2 3.82Å; L74-Y131 HydrophobicContact CD2-CG 4.38Å; L74-Y131 HydrophobicContact CG-CD2 4.44Å; L74-L136 HydrophobicContact CD2-CD1 4.4Å
75	S	89.1	Confident	84.8	Confident	14 Å²	14	53.6 Å²	53.6	10%	0.098	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	152.3	173.7	62	0	0	0	0	114.3	F83 R130	S75-F83 CarbonylContact C-O 3.54Å; S75-F83 VanDerWaalsContact CA-O 3.22Å; S75-F83 WeakPolarHBondContact CA-O 3.32Å; S75-F83 WeakPolarHBondContact CB-O 3.41Å; S75-R130 PolarHBondContact N-O 2.81Å; S75-R130 PolarHBondContact O-N 2.85Å
76	I	87.6	Confident	85.3	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	137.1	172.5	-58.3	-179.1	0	0	0	107.9	K82 F83 W108 A109 C112 V129	I76-K82 CarbonylContact O-C 3.6Å; I76-K82 WeakPolarHBondContact O-CA 3.09Å; I76-F83 HydrophobicContact CB-CB 4.43Å; I76-F83 HydrophobicContact CB-CD2 4.47Å; I76-F83 PolarHBondContact N-O 2.85Å; I76-F83 PolarHBondContact O-N 2.96Å; I76-W108 HydrophobicContact CD1-CD2 3.92Å; I76-W108 HydrophobicContact CD1-CE3 3.64Å; I76-W108 HydrophobicContact CD1-CH2 4.32Å; I76-W108 HydrophobicContact CD1-CZ3 3.86Å; I76-W108 HydrophobicContact CG1-CE3 4.01Å; I76-W108 HydrophobicContact CG1-CH2 3.99Å; I76-W108 HydrophobicContact CG1-CZ3 3.68Å; I76-A109 VanDerWaalsContact CD1-CA 3.46Å; I76-A109 HydrophobicContact CD1-CB 3.68Å; I76-C112 HydrophobicContact CD1-CB 4.19Å; I76-V129 HydrophobicContact CD1-CG2 3.82Å; I76-V129 HydrophobicContact CG1-CG2 3.88Å
77	H	84.2	Confident	85.8	Confident	88 Å²	88	48.7 Å²	48.7	41%	0.407	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	123	173.1	-60.1	65.9	0	0	0	107.7	K81 K82	H77-K81 CarbonylContact C-O 3.57Å; H77-K81 WeakPolarHBondContact CA-O 3.38Å; H77-K82 WeakPolarHBondContact NE2-CD 3.44Å
78	Y	81.3	Confident	85.9	Confident	35 Å²	35	50 Å²	50	14%	0.137	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	124.2	-175.4	-173.1	-109.2	0	0	0	110.9	G80 K81 K113 V116 K120	Y78-G80 PolarHBondContact O-N 3.05Å; Y78-K81 PolarHBondContact N-O 3.19Å; Y78-K81 PolarHBondContact O-N 2.94Å; Y78-K113 HydrophobicContact CD1-CB 4.32Å; Y78-K113 HydrophobicContact CD1-CG 3.83Å; Y78-K113 HydrophobicContact CD2-CD 4.16Å; Y78-K113 HydrophobicContact CD2-CG 4.07Å; Y78-K113 HydrophobicContact CE1-CB 4.14Å; Y78-K113 HydrophobicContact CE1-CG 3.96Å; Y78-K113 HydrophobicContact CE2-CD 4.06Å; Y78-K113 HydrophobicContact CE2-CG 4.2Å; Y78-K113 HydrophobicContact CG-CD 4.47Å; Y78-K113 HydrophobicContact CG-CG 3.89Å; Y78-V116 HydrophobicContact CD1-CB 4.05Å; Y78-V116 HydrophobicContact CD1-CG1 4.45Å; Y78-V116 HydrophobicContact CD1-CG2 4.33Å; Y78-V116 HydrophobicContact CE1-CB 4.27Å; Y78-K120 VanDerWaalsContact OH-CD 3.24Å; Y78-K120 WeakPolarHBondContact OH-CD 3.4Å; Y78-K120 PolarHBondContact OH-NZ 2.85Å
79	L	78.1	Confident	85.8	Confident	116 Å²	116	51.7 Å²	51.7	61%	0.607	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.7	55.2	-179.6	-59.6	176.3	0	0	0	112.6	K81 V116	L79-K81 PolarHBondContact O-N 2.96Å; L79-V116 HydrophobicContact CB-CG1 4Å; L79-V116 HydrophobicContact CD1-CG1 4.13Å
80	G	75.9	Confident	85.3	Confident	90 Å²	90	51.6 Å²	51.6	93%	0.928	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.8	-22.1	-179.5	0	0	0	0	0	115.9	Y78	Y78-G80 PolarHBondContact O-N 3.05Å
81	K	81.2	Confident	84.9	Confident	116 Å²	116	50.9 Å²	50.9	50%	0.504	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	141.9	179	-66.8	-174.1	178.2	-177.1	0	112.1	H77 Y78 L79 F83 V116	H77-K81 CarbonylContact C-O 3.57Å; H77-K81 WeakPolarHBondContact CA-O 3.38Å; Y78-K81 PolarHBondContact N-O 3.19Å; Y78-K81 PolarHBondContact O-N 2.94Å; L79-K81 PolarHBondContact O-N 2.96Å; K81-F83 HydrophobicContact CB-CE2 4.12Å; K81-F83 HydrophobicContact CB-CZ 4.3Å; K81-V116 HydrophobicContact CD-CG1 4.37Å; K81-V116 HydrophobicContact CD-CG2 3.95Å
82	K	86.1	Confident	85	Confident	127 Å²	127	48.2 Å²	48.2	55%	0.552	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.5	127.7	173.6	179.1	-176.5	-179.3	-174.2	0	109.3	I76 H77 V84	I76-K82 CarbonylContact O-C 3.6Å; I76-K82 WeakPolarHBondContact O-CA 3.09Å; H77-K82 WeakPolarHBondContact NE2-CD 3.44Å; K82-V84 HydrophobicContact CD-CG2 4.5Å; K82-V84 HydrophobicContact CG-CG2 4.36Å
83	F	88.9	Confident	85.1	Confident	12 Å²	12	46.5 Å²	46.5	5%	0.053	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	146.2	172.1	-55.4	-88.1	0	0	0	109.2	S75 I76 K81 W95 W108 C112 L115 V116	S75-F83 CarbonylContact C-O 3.54Å; S75-F83 VanDerWaalsContact CA-O 3.22Å; S75-F83 WeakPolarHBondContact CA-O 3.32Å; S75-F83 WeakPolarHBondContact CB-O 3.41Å; I76-F83 HydrophobicContact CB-CB 4.43Å; I76-F83 HydrophobicContact CB-CD2 4.47Å; I76-F83 PolarHBondContact N-O 2.85Å; I76-F83 PolarHBondContact O-N 2.96Å; K81-F83 HydrophobicContact CB-CE2 4.12Å; K81-F83 HydrophobicContact CB-CZ 4.3Å; F83-W95 HydrophobicContact CD1-CZ2 4.19Å; F83-W95 HydrophobicContact CE1-CZ2 4.46Å; F83-W108 HydrophobicContact CB-CZ2 4.48Å; F83-C112 HydrophobicContact CB-CB 4.47Å; F83-C112 HydrophobicContact CD1-CB 4.25Å; F83-C112 HydrophobicContact CD2-CB 3.72Å; F83-C112 HydrophobicContact CE1-CB 4.42Å; F83-C112 HydrophobicContact CE2-CB 3.92Å; F83-C112 HydrophobicContact CG-CB 3.89Å; F83-C112 HydrophobicContact CZ-CB 4.26Å; F83-C112 WeakPolarHBondContact CZ-O 3.49Å; F83-L115 HydrophobicContact CE1-CD1 4.44Å; F83-V116 HydrophobicContact CE2-CG2 4Å; F83-V116 HydrophobicContact CZ-CG2 3.68Å
84	V	90.3	Very high	85.1	Confident	39 Å²	39	49.7 Å²	49.7	24%	0.236	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	140.6	-175.5	-179.8	0	0	0	0	110.4	L74 K82 V96	L74-V84 WeakPolarHBondContact O-CA 3.24Å; K82-V84 HydrophobicContact CD-CG2 4.5Å; K82-V84 HydrophobicContact CG-CG2 4.36Å; V84-V96 HydrophobicContact CB-CG2 4.49Å; V84-V96 HydrophobicContact CG1-CG2 4.08Å; V84-V96 PolarHBondContact O-N 3.14Å; V84-V96 VanDerWaalsContact O-N 3.14Å
85	G	90.5	Very high	85.2	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	151.4	-176.9	0	0	0	0	0	113.5	G72 V73 L74 R94	G72-G85 CarbonylContact C-O 3.54Å; V73-G85 PolarHBondContact N-O 3.13Å; L74-G85 WeakPolarHBondContact CB-O 3.41Å; L74-G85 PolarHBondContact N-O 3.39Å; L74-G85 PolarHBondContact O-N 3.39Å; G85-R94 CarbonylContact C-O 3.55Å; G85-R94 WeakPolarHBondContact CA-O 3.38Å
86	D	88.6	Confident	85	Confident	13 Å²	13	53.6 Å²	53.6	7%	0.07	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	146.2	176.2	-38.8	-46.4	0	0	0	109.3	G70 D71 G72 I93 R94 V96	G70-D86 WeakPolarHBondContact O-CA 3.39Å; D71-D86 WeakPolarHBondContact CA-OD1 3.46Å; G72-D86 PolarHBondContact N-OD1 3.43Å; D86-I93 WeakPolarHBondContact O-CA 3.43Å; D86-R94 HydrophobicContact CB-CB 4.13Å; D86-R94 PolarHBondContact N-O 3.04Å; D86-R94 PolarHBondContact O-N 3.03Å; D86-R94 WeakPolarHBondContact OD2-CD 3.27Å; D86-R94 IonicContact OD2-NH1 3.43Å; D86-V96 WeakPolarHBondContact OD1-CG2 3.08Å
87	L	88.6	Confident	84.6	Confident	3 Å²	3	59 Å²	59	2%	0.016	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	117.6	171.7	179.4	56.4	0	0	0	109.8	L58 L62 V67 P69 G70 V73 L74 Y131	L58-L87 HydrophobicContact CD1-CD1 3.86Å; L58-L87 HydrophobicContact CD2-CD1 4.49Å; L58-L87 HydrophobicContact CD2-CD2 4.49Å; L62-L87 HydrophobicContact CD1-CD1 4.23Å; L62-L87 HydrophobicContact CD1-CD2 4.37Å; L62-L87 HydrophobicContact CD1-CG 4.38Å; L62-L87 HydrophobicContact CD2-CD2 4.17Å; L62-L87 HydrophobicContact CG-CD2 4.35Å; V67-L87 HydrophobicContact CG1-CD2 3.33Å; P69-L87 CarbonylContact C-O 3.4Å; P69-L87 VanDerWaalsContact CA-O 3.3Å; P69-L87 WeakPolarHBondContact CA-O 3.41Å; P69-L87 VanDerWaalsContact CB-O 3.26Å; P69-L87 WeakPolarHBondContact CB-O 3.37Å; G70-L87 PolarHBondContact N-O 2.97Å; G70-L87 PolarHBondContact O-N 3.4Å; V73-L87 HydrophobicContact CG2-CB 3.66Å; L74-L87 HydrophobicContact CD1-CB 4.02Å; L74-L87 HydrophobicContact CD1-CD1 4.35Å; L74-L87 HydrophobicContact CG-CB 4.41Å; L87-Y131 HydrophobicContact CD2-CE2 4.31Å
88	L	87	Confident	84.5	Confident	31 Å²	31	58.8 Å²	58.8	16%	0.162	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-85	151.3	178.9	-54.5	-177.9	0	0	0	111.2	D90 G91 K92 R94 I101	L88-D90 PolarHBondContact O-N 3.38Å; L88-G91 PolarHBondContact O-N 3.38Å; L88-K92 HydrophobicContact CD1-CB 4.27Å; L88-K92 PolarHBondContact N-O 2.91Å; L88-R94 HydrophobicContact CD2-CB 4.47Å; L88-I101 HydrophobicContact CD1-CD1 4.21Å; L88-I101 HydrophobicContact CD1-CG2 4.26Å
89	N	79.5	Confident	84.5	Confident	138 Å²	138	59 Å²	59	74%	0.738	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-23.3	-176.1	-57.4	12.7	0	0	0	113.8	P69	P69-N89 VanDerWaalsContact CB-OD1 3.31Å; P69-N89 WeakPolarHBondContact CB-OD1 3.31Å
90	D	78.8	Confident	84.9	Confident	51 Å²	51	57.4 Å²	57.4	27%	0.273	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-3.6	178.7	76.6	-19.7	0	0	0	114.1	R59 L88 K92	R59-D90 VanDerWaalsContact CZ-O 3.28Å; R59-D90 PolarHBondContact NE-O 3.1Å; R59-D90 PolarHBondContact NH2-O 2.92Å; L88-D90 PolarHBondContact O-N 3.38Å; D90-K92 WeakPolarHBondContact OD1-CB 3.37Å; D90-K92 WeakPolarHBondContact OD1-CG 3.47Å; D90-K92 PolarHBondContact OD1-N 3.31Å; D90-K92 VanDerWaalsContact OD2-CD 3.26Å; D90-K92 WeakPolarHBondContact OD2-CD 3.49Å; D90-K92 WeakPolarHBondContact OD2-CE 3.3Å; D90-K92 WeakPolarHBondContact OD2-CG 3.46Å; D90-K92 IonicContact OD2-NZ 3.7Å; D90-K92 PolarHBondContact OD2-NZ 3.22Å
91	G	80.4	Confident	85.5	Confident	10 Å²	10	57.3 Å²	57.3	10%	0.103	29%	0.294	C	S	.	.	S	Bend	trans	92.8	4.4	-177.8	0	0	0	0	0	115.7	L88	L88-G91 PolarHBondContact O-N 3.38Å
92	K	87.3	Confident	85.7	Confident	73 Å²	73	52.5 Å²	52.5	32%	0.317	27%	0.273	S	S	.	.			trans	-81.9	160.7	171.6	-62.7	-179	-171.9	121.5	0	111.8	L88 D90 I101 N103	L88-K92 HydrophobicContact CD1-CB 4.27Å; L88-K92 PolarHBondContact N-O 2.91Å; D90-K92 WeakPolarHBondContact OD1-CB 3.37Å; D90-K92 WeakPolarHBondContact OD1-CG 3.47Å; D90-K92 PolarHBondContact OD1-N 3.31Å; D90-K92 VanDerWaalsContact OD2-CD 3.26Å; D90-K92 WeakPolarHBondContact OD2-CD 3.49Å; D90-K92 WeakPolarHBondContact OD2-CE 3.3Å; D90-K92 WeakPolarHBondContact OD2-CG 3.46Å; D90-K92 IonicContact OD2-NZ 3.7Å; D90-K92 PolarHBondContact OD2-NZ 3.22Å; K92-I101 HydrophobicContact CB-CG2 3.83Å; K92-I101 HydrophobicContact CD-CG2 3.71Å; K92-I101 HydrophobicContact CG-CG2 4.36Å; K92-N103 VanDerWaalsContact CD-OD1 3.31Å; K92-N103 WeakPolarHBondContact CD-OD1 3.26Å; K92-N103 WeakPolarHBondContact CE-OD1 3.24Å
93	I	88.4	Confident	85.5	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	129	178.4	-54.1	173.7	0	0	0	109.1	L58 L74 D86 I101 F102 P105 W108	L58-I93 HydrophobicContact CD1-CD1 3.93Å; L58-I93 HydrophobicContact CD1-CG1 3.86Å; L74-I93 HydrophobicContact CD1-CB 4.29Å; L74-I93 HydrophobicContact CD1-CD1 3.91Å; L74-I93 HydrophobicContact CD1-CG1 3.67Å; L74-I93 HydrophobicContact CD1-CG2 3.82Å; D86-I93 WeakPolarHBondContact O-CA 3.43Å; I93-I101 CarbonylContact O-C 3.58Å; I93-I101 WeakPolarHBondContact O-CA 3.48Å; I93-F102 PolarHBondContact N-O 3.4Å; I93-F102 PolarHBondContact O-N 3.25Å; I93-P105 HydrophobicContact CD1-CB 4.3Å; I93-P105 HydrophobicContact CD1-CG 4.19Å; I93-W108 HydrophobicContact CD1-CB 4.27Å; I93-W108 HydrophobicContact CD1-CD2 4.47Å; I93-W108 HydrophobicContact CD1-CE3 3.94Å; I93-W108 HydrophobicContact CG2-CD2 3.81Å; I93-W108 HydrophobicContact CG2-CE3 3.88Å; I93-W108 HydrophobicContact CG2-CG 4.17Å; I93-W108 HydrophobicContact CG2-CZ3 4.3Å
94	R	86.9	Confident	85.2	Confident	87 Å²	87	54 Å²	54	33%	0.328	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	136.5	167.6	-170.7	-171.7	-68.2	134.6	-7.8	109.1	G85 D86 L88 G99 Q100 I101	G85-R94 CarbonylContact C-O 3.55Å; G85-R94 WeakPolarHBondContact CA-O 3.38Å; D86-R94 HydrophobicContact CB-CB 4.13Å; D86-R94 PolarHBondContact N-O 3.04Å; D86-R94 PolarHBondContact O-N 3.03Å; D86-R94 WeakPolarHBondContact OD2-CD 3.27Å; D86-R94 IonicContact OD2-NH1 3.43Å; L88-R94 HydrophobicContact CD2-CB 4.47Å; R94-G99 WeakPolarHBondContact CG-O 3.37Å; R94-Q100 CarbonylContact C-O 3.57Å; R94-Q100 WeakPolarHBondContact CA-O 3.45Å; R94-I101 HydrophobicContact CB-CG1 4.5Å; R94-I101 HydrophobicContact CG-CG1 4.32Å
95	W	90.1	Very high	84.7	Confident	18 Å²	18	52.4 Å²	52.4	7%	0.068	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	119.9	174.4	179.9	24.8	0	0	0	110.2	F83 E97 T98 G99 Q100 F102 W108 H111 L115	F83-W95 HydrophobicContact CD1-CZ2 4.19Å; F83-W95 HydrophobicContact CE1-CZ2 4.46Å; W95-E97 VanDerWaalsContact C-N 3.31Å; W95-E97 HydrophobicContact CZ2-CB 3.89Å; W95-E97 HydrophobicContact CZ2-CG 4.44Å; W95-E97 WeakPolarHBondContact CZ2-OE2 3.19Å; W95-E97 PolarHBondContact NE1-OE1 3.38Å; W95-E97 PolarHBondContact O-N 3.46Å; W95-T98 HydrophobicContact CD2-CG2 4.43Å; W95-T98 HydrophobicContact CE3-CG2 3.87Å; W95-T98 HydrophobicContact CH2-CG2 3.72Å; W95-T98 HydrophobicContact CZ2-CG2 4.34Å; W95-T98 HydrophobicContact CZ3-CG2 3.47Å; W95-T98 VanDerWaalsContact CZ3-CG2 3.47Å; W95-T98 WeakPolarHBondContact CZ3-OG1 3.15Å; W95-T98 PolarHBondContact O-N 3.33Å; W95-G99 WeakPolarHBondContact O-CA 3.28Å; W95-G99 PolarHBondContact O-N 3.46Å; W95-Q100 PolarHBondContact N-O 3.17Å; W95-F102 HydrophobicContact CB-CD2 4.49Å; W95-F102 HydrophobicContact CB-CE2 3.9Å; W95-W108 AromaticContact CD1-NE1 3.87Å; W95-W108 AromaticContact CG-NE1 3.71Å; W95-H111 AromaticContact CZ3-CE1 3.71Å; W95-H111 AromaticContact CZ3-ND1 3.93Å; W95-L115 HydrophobicContact CH2-CD1 3.46Å; W95-L115 VanDerWaalsContact CH2-CD1 3.46Å; W95-L115 HydrophobicContact CZ2-CD1 4.05Å; W95-L115 HydrophobicContact CZ3-CD1 4Å
96	V	85.9	Confident	84.2	Confident	78 Å²	78	54.6 Å²	54.6	47%	0.473	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-36.2	-169.6	175.4	0	0	0	0	113.1	V84 D86 T98	V84-V96 HydrophobicContact CB-CG2 4.49Å; V84-V96 HydrophobicContact CG1-CG2 4.08Å; V84-V96 PolarHBondContact O-N 3.14Å; V84-V96 VanDerWaalsContact O-N 3.14Å; D86-V96 WeakPolarHBondContact OD1-CG2 3.08Å; V96-T98 VanDerWaalsContact C-N 3.27Å; V96-T98 PolarHBondContact O-N 3.3Å
97	E	79	Confident	84	Confident	114 Å²	114	56 Å²	56	53%	0.533	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-17.2	-174.7	-65	155.8	-111.8	0	0	114	W95	W95-E97 VanDerWaalsContact C-N 3.31Å; W95-E97 HydrophobicContact CZ2-CB 3.89Å; W95-E97 HydrophobicContact CZ2-CG 4.44Å; W95-E97 WeakPolarHBondContact CZ2-OE2 3.19Å; W95-E97 PolarHBondContact NE1-OE1 3.38Å; W95-E97 PolarHBondContact O-N 3.46Å
98	T	82.5	Confident	83.8	Confident	83 Å²	83	55.9 Å²	55.9	51%	0.509	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.2	-7.4	-174	60.4	0	0	0	0	115.1	W95 V96 Q100	W95-T98 HydrophobicContact CD2-CG2 4.43Å; W95-T98 HydrophobicContact CE3-CG2 3.87Å; W95-T98 HydrophobicContact CH2-CG2 3.72Å; W95-T98 HydrophobicContact CZ2-CG2 4.34Å; W95-T98 HydrophobicContact CZ3-CG2 3.47Å; W95-T98 VanDerWaalsContact CZ3-CG2 3.47Å; W95-T98 WeakPolarHBondContact CZ3-OG1 3.15Å; W95-T98 PolarHBondContact O-N 3.33Å; V96-T98 VanDerWaalsContact C-N 3.27Å; V96-T98 PolarHBondContact O-N 3.3Å; T98-Q100 PolarHBondContact O-N 3.43Å; T98-Q100 WeakPolarHBondContact OG1-CB 3.32Å; T98-Q100 PolarHBondContact OG1-N 3.28Å
99	G	81.4	Confident	83.6	Confident	39 Å²	39	54.4 Å²	54.4	40%	0.402	30%	0.302	S	S	.	.			trans	71.1	-0.6	-172.7	0	0	0	0	0	115.1	R94 W95 I101	R94-G99 WeakPolarHBondContact CG-O 3.37Å; W95-G99 WeakPolarHBondContact O-CA 3.28Å; W95-G99 PolarHBondContact O-N 3.46Å; G99-I101 PolarHBondContact O-N 3.01Å
100	Q	86.5	Confident	83.8	Confident	84 Å²	84	48.9 Å²	48.9	39%	0.393	27%	0.273	S	S	.	.			trans	-65.1	133.4	-175.6	-170.9	179.3	16.7	0	0	111.9	R94 W95 T98 F102 H111	R94-Q100 CarbonylContact C-O 3.57Å; R94-Q100 WeakPolarHBondContact CA-O 3.45Å; W95-Q100 PolarHBondContact N-O 3.17Å; T98-Q100 PolarHBondContact O-N 3.43Å; T98-Q100 WeakPolarHBondContact OG1-CB 3.32Å; T98-Q100 PolarHBondContact OG1-N 3.28Å; Q100-F102 HydrophobicContact CB-CE2 3.91Å; Q100-F102 HydrophobicContact CB-CZ 4.3Å; Q100-F102 VanDerWaalsContact CD-CZ 3.43Å; Q100-F102 HydrophobicContact CG-CE2 3.79Å; Q100-F102 HydrophobicContact CG-CZ 3.82Å; Q100-F102 WeakPolarHBondContact O-CD2 3.46Å; Q100-F102 WeakPolarHBondContact O-CE2 3.44Å; Q100-F102 VanDerWaalsContact OE1-CZ 3.28Å; Q100-H111 PolarHBondContact OE1-CE1 2.94Å; Q100-H111 VanDerWaalsContact OE1-CE1 3.24Å
101	I	87.9	Confident	84	Confident	87 Å²	87	49.2 Å²	49.2	45%	0.446	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	135	-177	-56.9	177.5	0	0	0	110.9	L88 K92 I93 R94 G99	L88-I101 HydrophobicContact CD1-CD1 4.21Å; L88-I101 HydrophobicContact CD1-CG2 4.26Å; K92-I101 HydrophobicContact CB-CG2 3.83Å; K92-I101 HydrophobicContact CD-CG2 3.71Å; K92-I101 HydrophobicContact CG-CG2 4.36Å; I93-I101 CarbonylContact O-C 3.58Å; I93-I101 WeakPolarHBondContact O-CA 3.48Å; R94-I101 HydrophobicContact CB-CG1 4.5Å; R94-I101 HydrophobicContact CG-CG1 4.32Å; G99-I101 PolarHBondContact O-N 3.01Å
102	F	86.1	Confident	84.1	Confident	16 Å²	16	48.8 Å²	48.8	7%	0.07	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	130.1	-177.7	-63.7	-92.3	0	0	0	111.5	I93 W95 Q100 S104 A107 W108 H111	I93-F102 PolarHBondContact N-O 3.4Å; I93-F102 PolarHBondContact O-N 3.25Å; W95-F102 HydrophobicContact CB-CD2 4.49Å; W95-F102 HydrophobicContact CB-CE2 3.9Å; Q100-F102 HydrophobicContact CB-CE2 3.91Å; Q100-F102 HydrophobicContact CB-CZ 4.3Å; Q100-F102 VanDerWaalsContact CD-CZ 3.43Å; Q100-F102 HydrophobicContact CG-CE2 3.79Å; Q100-F102 HydrophobicContact CG-CZ 3.82Å; Q100-F102 WeakPolarHBondContact O-CD2 3.46Å; Q100-F102 WeakPolarHBondContact O-CE2 3.44Å; Q100-F102 VanDerWaalsContact OE1-CZ 3.28Å; F102-S104 VanDerWaalsContact C-N 3.26Å; F102-S104 PolarHBondContact O-N 3.32Å; F102-A107 HydrophobicContact CD1-CB 4.25Å; F102-W108 HydrophobicContact CB-CB 3.93Å; F102-W108 HydrophobicContact CD1-CB 4.21Å; F102-W108 HydrophobicContact CD2-CB 4.18Å; F102-W108 AromaticContact CD2-CD1 3.54Å; F102-W108 HydrophobicContact CD2-CG 4.13Å; F102-W108 AromaticContact CE2-CD1 3.59Å; F102-W108 HydrophobicContact CG-CB 3.84Å; F102-W108 HydrophobicContact CG-CG 4.3Å; F102-H111 HydrophobicContact CE1-CB 3.64Å; F102-H111 AromaticContact CE1-CG 3.71Å; F102-H111 HydrophobicContact CZ-CB 3.98Å; F102-H111 AromaticContact CZ-CG 3.71Å; F102-H111 AromaticContact CZ-ND1 3.57Å
103	N	81.7	Confident	83.8	Confident	127 Å²	127	46.5 Å²	46.5	68%	0.679	26%	0.259	S	S	*	.	S	Bend	trans	-77	-1.8	-177.9	-65.3	-30.9	0	0	0	114.6	K92	K92-N103 VanDerWaalsContact CD-OD1 3.31Å; K92-N103 WeakPolarHBondContact CD-OD1 3.26Å; K92-N103 WeakPolarHBondContact CE-OD1 3.24Å
104	S	81.3	Confident	83.4	Confident	42 Å²	42	52.7 Å²	52.7	29%	0.294	28%	0.282	S	S	.	.	S	Bend	trans	-160.6	157.6	173.5	71.3	0	0	0	0	113.9	F102 S106 A107 W108	F102-S104 VanDerWaalsContact C-N 3.26Å; F102-S104 PolarHBondContact O-N 3.32Å; S104-S106 PolarHBondContact O-N 2.74Å; S104-A107 PolarHBondContact O-N 2.71Å; S104-A107 WeakPolarHBondContact OG-CB 3.34Å; S104-A107 PolarHBondContact OG-N 2.84Å; S104-A107 VanDerWaalsContact OG-N 3.11Å; S104-W108 PolarHBondContact O-N 3.48Å
105	P	81.1	Confident	83.1	Confident	7 Å²	7	52.8 Å²	52.8	5%	0.045	29%	0.289	C	S	.	.	H	α-helix	trans	-55.5	-33.8	170.2	-25.8	33.7	0	0	0	114.1	L58 I93 A109 W126 V129 L136	L58-P105 HydrophobicContact CD1-CG 3.66Å; L58-P105 HydrophobicContact CG-CG 3.9Å; I93-P105 HydrophobicContact CD1-CB 4.3Å; I93-P105 HydrophobicContact CD1-CG 4.19Å; P105-A109 WeakPolarHBondContact O-CB 3.41Å; P105-A109 PolarHBondContact O-N 3.02Å; P105-W126 HydrophobicContact CG-CZ2 4.27Å; P105-V129 HydrophobicContact CB-CG2 4.18Å; P105-L136 HydrophobicContact CB-CD1 4.31Å; P105-L136 HydrophobicContact CG-CD1 4.13Å
106	S	80.1	Confident	82.6	Confident	46 Å²	46	53.8 Å²	53.8	32%	0.322	30%	0.297	S	S	.	.	H	α-helix	trans	-73.7	-36.5	180	-60.7	0	0	0	0	112.5	S104 T110	S104-S106 PolarHBondContact O-N 2.74Å; S106-T110 VanDerWaalsContact O-CB 3.29Å; S106-T110 WeakPolarHBondContact O-CB 3.28Å; S106-T110 PolarHBondContact O-N 3.25Å; S106-T110 PolarHBondContact O-OG1 2.98Å
107	A	82.8	Confident	82.1	Confident	42 Å²	42	53 Å²	53	35%	0.347	29%	0.29	S	S	.	.	H	α-helix	trans	-64.5	-51.3	174.3	0	0	0	0	0	110.9	F102 S104 A109 T110 H111	F102-A107 HydrophobicContact CD1-CB 4.25Å; S104-A107 PolarHBondContact O-N 2.71Å; S104-A107 WeakPolarHBondContact OG-CB 3.34Å; S104-A107 PolarHBondContact OG-N 2.84Å; S104-A107 VanDerWaalsContact OG-N 3.11Å; A107-A109 PolarHBondContact O-N 2.7Å; A107-T110 PolarHBondContact O-N 3.1Å; A107-H111 PolarHBondContact O-N 3.22Å
108	W	85.1	Confident	81.7	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-60	-47.6	177.9	-174.7	49.3	0	0	0	112.1	L74 I76 F83 I93 W95 F102 S104 T110 H111 C112 V129	L74-W108 HydrophobicContact CB-CH2 4Å; L74-W108 HydrophobicContact CB-CZ3 3.8Å; I76-W108 HydrophobicContact CD1-CD2 3.92Å; I76-W108 HydrophobicContact CD1-CE3 3.64Å; I76-W108 HydrophobicContact CD1-CH2 4.32Å; I76-W108 HydrophobicContact CD1-CZ3 3.86Å; I76-W108 HydrophobicContact CG1-CE3 4.01Å; I76-W108 HydrophobicContact CG1-CH2 3.99Å; I76-W108 HydrophobicContact CG1-CZ3 3.68Å; F83-W108 HydrophobicContact CB-CZ2 4.48Å; I93-W108 HydrophobicContact CD1-CB 4.27Å; I93-W108 HydrophobicContact CD1-CD2 4.47Å; I93-W108 HydrophobicContact CD1-CE3 3.94Å; I93-W108 HydrophobicContact CG2-CD2 3.81Å; I93-W108 HydrophobicContact CG2-CE3 3.88Å; I93-W108 HydrophobicContact CG2-CG 4.17Å; I93-W108 HydrophobicContact CG2-CZ3 4.3Å; W95-W108 AromaticContact CD1-NE1 3.87Å; W95-W108 AromaticContact CG-NE1 3.71Å; F102-W108 HydrophobicContact CB-CB 3.93Å; F102-W108 HydrophobicContact CD1-CB 4.21Å; F102-W108 HydrophobicContact CD2-CB 4.18Å; F102-W108 AromaticContact CD2-CD1 3.54Å; F102-W108 HydrophobicContact CD2-CG 4.13Å; F102-W108 AromaticContact CE2-CD1 3.59Å; F102-W108 HydrophobicContact CG-CB 3.84Å; F102-W108 HydrophobicContact CG-CG 4.3Å; S104-W108 PolarHBondContact O-N 3.48Å; W108-T110 VanDerWaalsContact C-N 3.31Å; W108-T110 PolarHBondContact O-N 2.95Å; W108-H111 WeakPolarHBondContact O-CB 3.49Å; W108-H111 PolarHBondContact O-N 2.67Å; W108-H111 VanDerWaalsContact O-N 3.15Å; W108-C112 PolarHBondContact NE1-SG 3.23Å; W108-C112 PolarHBondContact O-N 3.42Å; W108-C112 PolarHBondContact O-SG 3.22Å; W108-V129 HydrophobicContact CE3-CG1 4.4Å; W108-V129 HydrophobicContact CE3-CG2 3.87Å; W108-V129 HydrophobicContact CZ3-CG1 3.99Å; W108-V129 HydrophobicContact CZ3-CG2 4.09Å
109	A	83.7	Confident	80.6	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-67.6	-27.4	179.7	0	0	0	0	0	114.5	I76 P105 A107 K113 V129	I76-A109 VanDerWaalsContact CD1-CA 3.46Å; I76-A109 HydrophobicContact CD1-CB 3.68Å; P105-A109 WeakPolarHBondContact O-CB 3.41Å; P105-A109 PolarHBondContact O-N 3.02Å; A107-A109 PolarHBondContact O-N 2.7Å; A109-K113 WeakPolarHBondContact O-CB 3.2Å; A109-K113 WeakPolarHBondContact O-CG 3.38Å; A109-K113 PolarHBondContact O-N 2.77Å; A109-V129 HydrophobicContact CB-CG2 4.16Å
110	T	82.6	Confident	79.5	Confident	23 Å²	23	55.8 Å²	55.8	14%	0.141	31%	0.309	C	S	.	.	H	α-helix	trans	-73.5	-40.6	172.3	-58.4	0	0	0	0	110.5	S106 A107 W108 K113 R114	S106-T110 VanDerWaalsContact O-CB 3.29Å; S106-T110 WeakPolarHBondContact O-CB 3.28Å; S106-T110 PolarHBondContact O-N 3.25Å; S106-T110 PolarHBondContact O-OG1 2.98Å; A107-T110 PolarHBondContact O-N 3.1Å; W108-T110 VanDerWaalsContact C-N 3.31Å; W108-T110 PolarHBondContact O-N 2.95Å; T110-K113 PolarHBondContact O-N 3.08Å; T110-R114 WeakPolarHBondContact O-CG 3.44Å; T110-R114 PolarHBondContact O-N 3.24Å
111	H	82.3	Confident	77.7	Confident	58 Å²	58	60.1 Å²	60.1	27%	0.269	33%	0.327	S	S	.	.	H	α-helix	trans	-59.9	-55.9	175.7	-165.7	-104.8	0	0	0	111.9	W95 Q100 F102 A107 W108 K113 R114 L115	W95-H111 AromaticContact CZ3-CE1 3.71Å; W95-H111 AromaticContact CZ3-ND1 3.93Å; Q100-H111 PolarHBondContact OE1-CE1 2.94Å; Q100-H111 VanDerWaalsContact OE1-CE1 3.24Å; F102-H111 HydrophobicContact CE1-CB 3.64Å; F102-H111 AromaticContact CE1-CG 3.71Å; F102-H111 HydrophobicContact CZ-CB 3.98Å; F102-H111 AromaticContact CZ-CG 3.71Å; F102-H111 AromaticContact CZ-ND1 3.57Å; A107-H111 PolarHBondContact O-N 3.22Å; W108-H111 WeakPolarHBondContact O-CB 3.49Å; W108-H111 PolarHBondContact O-N 2.67Å; W108-H111 VanDerWaalsContact O-N 3.15Å; H111-K113 PolarHBondContact O-N 3.4Å; H111-K113 VanDerWaalsContact O-N 3.17Å; H111-R114 PolarHBondContact O-N 2.75Å; H111-R114 VanDerWaalsContact O-N 3.14Å; H111-L115 PolarHBondContact O-N 3.34Å
112	C	82.6	Confident	76	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-58.3	-31.1	178.8	-66.2	0	0	0	0	113.3	I76 F83 W108	I76-C112 HydrophobicContact CD1-CB 4.19Å; F83-C112 HydrophobicContact CB-CB 4.47Å; F83-C112 HydrophobicContact CD1-CB 4.25Å; F83-C112 HydrophobicContact CD2-CB 3.72Å; F83-C112 HydrophobicContact CE1-CB 4.42Å; F83-C112 HydrophobicContact CE2-CB 3.92Å; F83-C112 HydrophobicContact CG-CB 3.89Å; F83-C112 HydrophobicContact CZ-CB 4.26Å; F83-C112 WeakPolarHBondContact CZ-O 3.49Å; W108-C112 PolarHBondContact NE1-SG 3.23Å; W108-C112 PolarHBondContact O-N 3.42Å; W108-C112 PolarHBondContact O-SG 3.22Å
113	K	81.4	Confident	74.6	Confident	26 Å²	26	60.8 Å²	60.8	11%	0.113	35%	0.345	C	S	.	.	H	α-helix	trans	-77.1	-37.2	177.1	-73.5	-179.7	-175.9	-174.8	0	113.1	Y78 A109 T110 H111 L115 V116 N117 S128	Y78-K113 HydrophobicContact CD1-CB 4.32Å; Y78-K113 HydrophobicContact CD1-CG 3.83Å; Y78-K113 HydrophobicContact CD2-CD 4.16Å; Y78-K113 HydrophobicContact CD2-CG 4.07Å; Y78-K113 HydrophobicContact CE1-CB 4.14Å; Y78-K113 HydrophobicContact CE1-CG 3.96Å; Y78-K113 HydrophobicContact CE2-CD 4.06Å; Y78-K113 HydrophobicContact CE2-CG 4.2Å; Y78-K113 HydrophobicContact CG-CD 4.47Å; Y78-K113 HydrophobicContact CG-CG 3.89Å; A109-K113 WeakPolarHBondContact O-CB 3.2Å; A109-K113 WeakPolarHBondContact O-CG 3.38Å; A109-K113 PolarHBondContact O-N 2.77Å; T110-K113 PolarHBondContact O-N 3.08Å; H111-K113 PolarHBondContact O-N 3.4Å; H111-K113 VanDerWaalsContact O-N 3.17Å; K113-L115 VanDerWaalsContact C-N 3.28Å; K113-L115 PolarHBondContact O-N 3.31Å; K113-V116 PolarHBondContact O-N 2.77Å; K113-V116 VanDerWaalsContact O-N 3.09Å; K113-N117 PolarHBondContact O-N 2.8Å; K113-S128 PolarHBondContact NZ-OG 2.89Å
114	R	81.6	Confident	73.7	Confident	130 Å²	130	58.6 Å²	58.6	49%	0.491	34%	0.339	S	S	.	.	H	α-helix	trans	-63.8	-33.7	175.6	-72.7	176.2	-173.2	172.3	3.8	112.3	T110 H111 V116 N117 K121	T110-R114 WeakPolarHBondContact O-CG 3.44Å; T110-R114 PolarHBondContact O-N 3.24Å; H111-R114 PolarHBondContact O-N 2.75Å; H111-R114 VanDerWaalsContact O-N 3.14Å; R114-V116 PolarHBondContact O-N 2.72Å; R114-V116 VanDerWaalsContact O-N 3.13Å; R114-N117 CarbonylContact O-C 3.43Å; R114-K121 PolarHBondContact NH2-O 2.96Å
115	L	79.3	Confident	72.8	Confident	89 Å²	89	56.6 Å²	56.6	47%	0.466	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-8.1	172.6	-66.8	173.9	0	0	0	114.6	F83 W95 H111 K113	F83-L115 HydrophobicContact CE1-CD1 4.44Å; W95-L115 HydrophobicContact CH2-CD1 3.46Å; W95-L115 VanDerWaalsContact CH2-CD1 3.46Å; W95-L115 HydrophobicContact CZ2-CD1 4.05Å; W95-L115 HydrophobicContact CZ3-CD1 4Å; H111-L115 PolarHBondContact O-N 3.34Å; K113-L115 VanDerWaalsContact C-N 3.28Å; K113-L115 PolarHBondContact O-N 3.31Å
116	V	79.7	Confident	72.4	Confident	39 Å²	39	58.3 Å²	58.3	24%	0.236	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.3	-28.4	177.7	-163.4	0	0	0	0	112.4	Y78 L79 K81 F83 K113 R114	Y78-V116 HydrophobicContact CD1-CB 4.05Å; Y78-V116 HydrophobicContact CD1-CG1 4.45Å; Y78-V116 HydrophobicContact CD1-CG2 4.33Å; Y78-V116 HydrophobicContact CE1-CB 4.27Å; L79-V116 HydrophobicContact CB-CG1 4Å; L79-V116 HydrophobicContact CD1-CG1 4.13Å; K81-V116 HydrophobicContact CD-CG1 4.37Å; K81-V116 HydrophobicContact CD-CG2 3.95Å; F83-V116 HydrophobicContact CE2-CG2 4Å; F83-V116 HydrophobicContact CZ-CG2 3.68Å; K113-V116 PolarHBondContact O-N 2.77Å; K113-V116 VanDerWaalsContact O-N 3.09Å; R114-V116 PolarHBondContact O-N 2.72Å; R114-V116 VanDerWaalsContact O-N 3.13Å
117	N	75.3	Confident	71.8	Confident	61 Å²	61	58.2 Å²	58.2	33%	0.326	33%	0.333	S	S	.	.			trans	-141	101.2	170.4	-178	-31.5	0	0	0	109.7	K113 R114 A119 K120	K113-N117 PolarHBondContact O-N 2.8Å; R114-N117 CarbonylContact O-C 3.43Å; N117-A119 VanDerWaalsContact C-N 3.27Å; N117-A119 PolarHBondContact O-N 3.34Å; N117-A119 WeakPolarHBondContact OD1-CB 3.2Å; N117-A119 PolarHBondContact OD1-N 2.92Å; N117-K120 HydrophobicContact CB-CB 4.49Å; N117-K120 PolarHBondContact O-N 3.18Å
118	P	70	Confident	71.5	Confident	118 Å²	118	57.1 Å²	57.1	77%	0.766	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-26.7	-178	-27.4	36.5	0	0	0	115.2	K120	P118-K120 PolarHBondContact O-N 3Å
119	A	60	Low	71.4	Confident	84 Å²	84	57.1 Å²	57.1	69%	0.694	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-14.4	-179.1	0	0	0	0	0	113.2	N117 K121	N117-A119 VanDerWaalsContact C-N 3.27Å; N117-A119 PolarHBondContact O-N 3.34Å; N117-A119 WeakPolarHBondContact OD1-CB 3.2Å; N117-A119 PolarHBondContact OD1-N 2.92Å; A119-K121 PolarHBondContact O-N 2.89Å; A119-K121 VanDerWaalsContact O-N 3.13Å
120	K	58.8	Low	71.6	Confident	92 Å²	92	60.6 Å²	60.6	40%	0.4	34%	0.336	S	S	.	.			trans	-82.8	95	-171.8	-159.5	156.1	-165.9	151.5	0	112.5	Y78 N117 P118 S122	Y78-K120 VanDerWaalsContact OH-CD 3.24Å; Y78-K120 WeakPolarHBondContact OH-CD 3.4Å; Y78-K120 PolarHBondContact OH-NZ 2.85Å; N117-K120 HydrophobicContact CB-CB 4.49Å; N117-K120 PolarHBondContact O-N 3.18Å; P118-K120 PolarHBondContact O-N 3Å; K120-S122 PolarHBondContact O-N 2.87Å
121	K	49.5	Very low	71.8	Confident	175 Å²	175	59.8 Å²	59.8	76%	0.761	33%	0.33	S	S	*	.			trans	-62	-36.7	-176.6	-64.5	179.7	-178.7	175.6	0	113.8	R114 A119	R114-K121 PolarHBondContact NH2-O 2.96Å; A119-K121 PolarHBondContact O-N 2.89Å; A119-K121 VanDerWaalsContact O-N 3.13Å
122	S	51.8	Low	71.9	Confident	95 Å²	95	63.8 Å²	63.8	66%	0.664	34%	0.343	S	S	*	.			trans	-133.7	156.8	-169.5	-58.1	0	0	0	0	114.4	K120	K120-S122 PolarHBondContact O-N 2.87Å
123	G	55.2	Low	71.6	Confident	23 Å²	23	66.1 Å²	66.1	24%	0.237	37%	0.367	C	S	.	.			trans	-163.3	137.6	172.8	0	0	0	0	0	115.3	G125	G123-G125 PolarHBondContact O-N 2.9Å
124	C	62.8	Low	71.7	Confident	81 Å²	81	69.9 Å²	69.9	55%	0.547	39%	0.385	S	S	.	.			trans	-71.1	107.1	177.6	-179.3	0	0	0	0	112	A127 S128	C124-A127 HydrophobicContact CB-CB 4.48Å; C124-S128 WeakPolarHBondContact O-CB 3.09Å; C124-S128 PolarHBondContact O-N 3.27Å; C124-S128 PolarHBondContact O-OG 3.32Å
125	G	64.1	Low	71.8	Confident	0 Å²	0	68 Å²	68	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-62.5	-51.8	-178.7	0	0	0	0	0	113.9	G123 A127 S128 V129	G123-G125 PolarHBondContact O-N 2.9Å; G125-A127 VanDerWaalsContact C-N 3.28Å; G125-A127 PolarHBondContact O-N 3.23Å; G125-S128 PolarHBondContact O-N 3.48Å; G125-V129 WeakPolarHBondContact O-CG2 3.25Å; G125-V129 PolarHBondContact O-N 2.82Å
126	W	72.7	Confident	71.8	Confident	42 Å²	42	63.8 Å²	63.8	16%	0.159	36%	0.358	C	S	.	.	H	α-helix	trans	-60.7	-30.2	-174.2	-69.2	93.9	0	0	0	114.9	I56 L61 P105 L136 V137 K140	I56-W126 WeakPolarHBondContact O-CH2 3.47Å; I56-W126 WeakPolarHBondContact O-CZ2 3.37Å; L61-W126 HydrophobicContact CD1-CH2 4.28Å; L61-W126 HydrophobicContact CD1-CZ3 3.9Å; P105-W126 HydrophobicContact CG-CZ2 4.27Å; W126-L136 HydrophobicContact CE3-CB 3.75Å; W126-L136 HydrophobicContact CE3-CD1 4.42Å; W126-L136 HydrophobicContact CZ3-CB 4.13Å; W126-L136 HydrophobicContact CZ3-CD1 4.39Å; W126-V137 PolarHBondContact O-N 2.82Å; W126-K140 HydrophobicContact CD2-CD 3.99Å; W126-K140 HydrophobicContact CE3-CB 4.44Å; W126-K140 HydrophobicContact CE3-CD 3.71Å; W126-K140 HydrophobicContact CH2-CD 4.41Å; W126-K140 HydrophobicContact CZ3-CD 3.95Å
127	A	67.6	Low	71.7	Confident	45 Å²	45	64.4 Å²	64.4	37%	0.372	36%	0.362	S	S	.	.	H	α-helix	trans	-85.1	-18.8	175.2	0	0	0	0	0	113.5	C124 G125	C124-A127 HydrophobicContact CB-CB 4.48Å; G125-A127 VanDerWaalsContact C-N 3.28Å; G125-A127 PolarHBondContact O-N 3.23Å
128	S	75.1	Confident	71.9	Confident	18 Å²	18	65.9 Å²	65.9	13%	0.126	37%	0.367	C	S	.	.	H	α-helix	trans	-96.9	-37.3	-174.8	-54.7	0	0	0	0	113.3	K113 C124 G125	K113-S128 PolarHBondContact NZ-OG 2.89Å; C124-S128 WeakPolarHBondContact O-CB 3.09Å; C124-S128 PolarHBondContact O-N 3.27Å; C124-S128 PolarHBondContact O-OG 3.32Å; G125-S128 PolarHBondContact O-N 3.48Å
129	V	84.3	Confident	72.3	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	130.7	179.3	177.6	0	0	0	0	110	L74 I76 P105 W108 A109 G125 L136	L74-V129 HydrophobicContact CB-CG1 4.45Å; L74-V129 HydrophobicContact CD2-CG1 3.83Å; I76-V129 HydrophobicContact CD1-CG2 3.82Å; I76-V129 HydrophobicContact CG1-CG2 3.88Å; P105-V129 HydrophobicContact CB-CG2 4.18Å; W108-V129 HydrophobicContact CE3-CG1 4.4Å; W108-V129 HydrophobicContact CE3-CG2 3.87Å; W108-V129 HydrophobicContact CZ3-CG1 3.99Å; W108-V129 HydrophobicContact CZ3-CG2 4.09Å; A109-V129 HydrophobicContact CB-CG2 4.16Å; G125-V129 WeakPolarHBondContact O-CG2 3.25Å; G125-V129 PolarHBondContact O-N 2.82Å; V129-L136 HydrophobicContact CB-CD1 3.89Å; V129-L136 HydrophobicContact CB-CG 4.35Å; V129-L136 HydrophobicContact CG1-CD1 3.48Å; V129-L136 VanDerWaalsContact CG1-CD1 3.48Å; V129-L136 HydrophobicContact CG1-CG 3.96Å; V129-L136 PolarHBondContact O-N 3.43Å
130	R	86.7	Confident	72.9	Confident	74 Å²	74	59.1 Å²	59.1	28%	0.279	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	139.1	170.7	-67.5	169.2	171.1	89.6	-14.9	110.2	L74 S75 G133 Q134 K135	L74-R130 CarbonylContact C-O 3.53Å; L74-R130 VanDerWaalsContact CA-O 3.3Å; L74-R130 WeakPolarHBondContact CA-O 3.45Å; S75-R130 PolarHBondContact N-O 2.81Å; S75-R130 PolarHBondContact O-N 2.85Å; R130-G133 WeakPolarHBondContact CD-O 3.46Å; R130-Q134 CarbonylContact C-O 3.07Å; R130-Q134 WeakPolarHBondContact CA-O 3.39Å; R130-Q134 WeakPolarHBondContact CB-O 3.22Å; R130-K135 HydrophobicContact CG-CG 4.29Å
131	Y	86.9	Confident	73.6	Confident	5 Å²	5	57.6 Å²	57.6	2%	0.02	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	128.3	166.2	177.2	-99.4	0	0	0	108.8	V67 E68 V73 L74 L87 G133 Q134 Y139	V67-Y131 HydrophobicContact CG1-CD1 4.15Å; V67-Y131 HydrophobicContact CG1-CD2 3.62Å; V67-Y131 HydrophobicContact CG1-CE1 4.01Å; V67-Y131 HydrophobicContact CG1-CE2 3.44Å; V67-Y131 VanDerWaalsContact CG1-CE2 3.44Å; V67-Y131 HydrophobicContact CG1-CG 3.96Å; E68-Y131 WeakPolarHBondContact CA-OH 3.38Å; E68-Y131 WeakPolarHBondContact CB-OH 3.46Å; E68-Y131 PolarHBondContact N-OH 2.86Å; E68-Y131 WeakPolarHBondContact O-CE2 3.24Å; E68-Y131 PolarHBondContact O-OH 3.19Å; V73-Y131 HydrophobicContact CB-CD2 4Å; V73-Y131 HydrophobicContact CB-CE2 3.62Å; V73-Y131 HydrophobicContact CG1-CE2 4.43Å; V73-Y131 HydrophobicContact CG2-CD2 3.88Å; V73-Y131 HydrophobicContact CG2-CE2 3.5Å; V73-Y131 VanDerWaalsContact CG2-CE2 3.5Å; V73-Y131 WeakPolarHBondContact O-CA 3.31Å; L74-Y131 HydrophobicContact CD2-CD2 3.82Å; L74-Y131 HydrophobicContact CD2-CG 4.38Å; L74-Y131 HydrophobicContact CG-CD2 4.44Å; L87-Y131 HydrophobicContact CD2-CE2 4.31Å; Y131-G133 PolarHBondContact O-N 3.33Å; Y131-Q134 PolarHBondContact N-O 3.29Å; Y131-Q134 PolarHBondContact O-N 2.88Å; Y131-Y139 HydrophobicContact CD1-CE2 4.14Å; Y131-Y139 AromaticContact CD1-CZ 3.91Å
132	R	83.8	Confident	74.7	Confident	142 Å²	142	52.8 Å²	52.8	54%	0.536	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.2	35.1	-176.3	-64.3	-175.8	178.1	160.6	3.8	114	E68 V73	E68-R132 IonicContact OE2-CZ 3.43Å; E68-R132 IonicContact OE2-NH1 2.66Å; E68-R132 PolarHBondContact OE2-NH1 3.4Å; E68-R132 IonicContact OE2-NH2 3.47Å; E68-R132 PolarHBondContact OE2-NH2 3.42Å; V73-R132 PolarHBondContact O-N 2.95Å
133	G	77.3	Confident	75.8	Confident	50 Å²	50	49 Å²	49	52%	0.515	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.2	-27.3	-180	0	0	0	0	0	116.5	R130 Y131	R130-G133 WeakPolarHBondContact CD-O 3.46Å; Y131-G133 PolarHBondContact O-N 3.33Å
134	Q	82.4	Confident	76.5	Confident	104 Å²	104	48.9 Å²	48.9	49%	0.486	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	147.8	179.7	-62.7	-174.4	8.4	0	0	111.7	R130 Y131 Y139	R130-Q134 CarbonylContact C-O 3.07Å; R130-Q134 WeakPolarHBondContact CA-O 3.39Å; R130-Q134 WeakPolarHBondContact CB-O 3.22Å; Y131-Q134 PolarHBondContact N-O 3.29Å; Y131-Q134 PolarHBondContact O-N 2.88Å; Q134-Y139 HydrophobicContact CB-CE2 3.73Å
135	K	84	Confident	76.7	Confident	91 Å²	91	50.5 Å²	50.5	40%	0.396	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	139	-178	-60.4	178.3	-179.1	174.7	0	110.6	R130 V137 Q138	R130-K135 HydrophobicContact CG-CG 4.29Å; K135-V137 HydrophobicContact CB-CG1 3.87Å; K135-V137 HydrophobicContact CD-CG1 4.32Å; K135-V137 PolarHBondContact O-N 3.37Å; K135-V137 VanDerWaalsContact O-N 3.1Å; K135-Q138 HydrophobicContact CB-CG 4.31Å; K135-Q138 WeakPolarHBondContact O-CB 3.41Å; K135-Q138 PolarHBondContact O-N 3.49Å
136	L	79.1	Confident	76.5	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-58.9	-26.8	178.5	-78	-177.2	0	0	0	113.8	L58 L74 P105 W126 V129 Q138 Y139 K140	L58-L136 HydrophobicContact CD2-CD1 4Å; L58-L136 HydrophobicContact CD2-CD2 4.15Å; L74-L136 HydrophobicContact CD2-CD1 4.4Å; P105-L136 HydrophobicContact CB-CD1 4.31Å; P105-L136 HydrophobicContact CG-CD1 4.13Å; W126-L136 HydrophobicContact CE3-CB 3.75Å; W126-L136 HydrophobicContact CE3-CD1 4.42Å; W126-L136 HydrophobicContact CZ3-CB 4.13Å; W126-L136 HydrophobicContact CZ3-CD1 4.39Å; V129-L136 HydrophobicContact CB-CD1 3.89Å; V129-L136 HydrophobicContact CB-CG 4.35Å; V129-L136 HydrophobicContact CG1-CD1 3.48Å; V129-L136 VanDerWaalsContact CG1-CD1 3.48Å; V129-L136 HydrophobicContact CG1-CG 3.96Å; V129-L136 PolarHBondContact O-N 3.43Å; L136-Q138 PolarHBondContact O-N 2.98Å; L136-Y139 HydrophobicContact CD2-CD2 4.44Å; L136-K140 WeakPolarHBondContact O-CB 3.42Å; L136-K140 PolarHBondContact O-N 3.32Å; L136-K140 VanDerWaalsContact O-N 3.11Å
137	V	79	Confident	76	Confident	53 Å²	53	61.7 Å²	61.7	32%	0.321	31%	0.307	S	S	.	.	H	α-helix	trans	-61.5	-26.2	172.4	71.1	0	0	0	0	113.6	W126 K135 T141	W126-V137 PolarHBondContact O-N 2.82Å; K135-V137 HydrophobicContact CB-CG1 3.87Å; K135-V137 HydrophobicContact CD-CG1 4.32Å; K135-V137 PolarHBondContact O-N 3.37Å; K135-V137 VanDerWaalsContact O-N 3.1Å; V137-T141 WeakPolarHBondContact O-CB 3.42Å; V137-T141 PolarHBondContact O-N 3.48Å; V137-T141 PolarHBondContact O-OG1 3Å
138	Q	79	Confident	75.5	Confident	92 Å²	92	63.6 Å²	63.6	43%	0.43	31%	0.309	S	S	.	.	H	α-helix	trans	-72.2	-55	178.5	-63.9	173.1	-83.2	0	0	110	K135 L136 K140 T141 S142	K135-Q138 HydrophobicContact CB-CG 4.31Å; K135-Q138 WeakPolarHBondContact O-CB 3.41Å; K135-Q138 PolarHBondContact O-N 3.49Å; L136-Q138 PolarHBondContact O-N 2.98Å; Q138-K140 PolarHBondContact O-N 3.45Å; Q138-T141 WeakPolarHBondContact O-CA 3.33Å; Q138-T141 PolarHBondContact O-N 3.16Å; Q138-S142 PolarHBondContact O-N 2.81Å; Q138-S142 PolarHBondContact O-OG 3.06Å
139	Y	77.7	Confident	73.9	Confident	40 Å²	40	67.8 Å²	67.8	16%	0.157	34%	0.336	C	S	.	.	H	α-helix	trans	-51.9	-41.6	172.4	-64	-83.3	0	0	0	112.6	V67 Y131 Q134 L136 T141 S142 W143	V67-Y139 HydrophobicContact CG2-CD1 4.49Å; V67-Y139 HydrophobicContact CG2-CG 4.49Å; Y131-Y139 HydrophobicContact CD1-CE2 4.14Å; Y131-Y139 AromaticContact CD1-CZ 3.91Å; Q134-Y139 HydrophobicContact CB-CE2 3.73Å; L136-Y139 HydrophobicContact CD2-CD2 4.44Å; Y139-T141 PolarHBondContact O-N 3.45Å; Y139-S142 PolarHBondContact O-N 3.32Å; Y139-W143 WeakPolarHBondContact O-CB 3.45Å; Y139-W143 PolarHBondContact O-N 3.24Å
140	K	73.5	Confident	71.7	Confident	20 Å²	20	73 Å²	73	9%	0.087	37%	0.372	C	S	.	.	H	α-helix	trans	-64.9	-35.6	177	-177	158.6	176.8	153.2	0	113.2	R53 I56 W126 L136 Q138 L144	R53-K140 WeakPolarHBondContact O-CE 3.44Å; R53-K140 PolarHBondContact O-NZ 2.99Å; I56-K140 HydrophobicContact CB-CD 4.16Å; I56-K140 HydrophobicContact CB-CG 4.24Å; I56-K140 HydrophobicContact CD1-CG 3.87Å; I56-K140 HydrophobicContact CG2-CD 4.24Å; I56-K140 HydrophobicContact CG2-CG 4.13Å; I56-K140 PolarHBondContact O-NZ 3.1Å; W126-K140 HydrophobicContact CD2-CD 3.99Å; W126-K140 HydrophobicContact CE3-CB 4.44Å; W126-K140 HydrophobicContact CE3-CD 3.71Å; W126-K140 HydrophobicContact CH2-CD 4.41Å; W126-K140 HydrophobicContact CZ3-CD 3.95Å; L136-K140 WeakPolarHBondContact O-CB 3.42Å; L136-K140 PolarHBondContact O-N 3.32Å; L136-K140 VanDerWaalsContact O-N 3.11Å; Q138-K140 PolarHBondContact O-N 3.45Å; K140-L144 WeakPolarHBondContact O-CD1 3.25Å; K140-L144 WeakPolarHBondContact O-CG 3.39Å; K140-L144 PolarHBondContact O-N 3.04Å
141	T	73.4	Confident	69.5	Low	59 Å²	59	72.9 Å²	72.9	36%	0.362	39%	0.387	S	S	.	.	H	α-helix	trans	-75.4	-40.5	174.9	-57.6	0	0	0	0	111.4	V137 Q138 Y139 W143 L144 H145	V137-T141 WeakPolarHBondContact O-CB 3.42Å; V137-T141 PolarHBondContact O-N 3.48Å; V137-T141 PolarHBondContact O-OG1 3Å; Q138-T141 WeakPolarHBondContact O-CA 3.33Å; Q138-T141 PolarHBondContact O-N 3.16Å; Y139-T141 PolarHBondContact O-N 3.45Å; T141-W143 VanDerWaalsContact C-N 3.34Å; T141-W143 PolarHBondContact O-N 3.11Å; T141-L144 PolarHBondContact O-N 2.97Å; T141-H145 PolarHBondContact O-N 2.61Å
142	S	72.8	Confident	66.8	Low	75 Å²	75	78.4 Å²	78.4	52%	0.524	42%	0.417	S	S	.	.	H	α-helix	trans	-62.7	-38.2	174.9	-56.3	0	0	0	0	112.6	Q138 Y139 K146	Q138-S142 PolarHBondContact O-N 2.81Å; Q138-S142 PolarHBondContact O-OG 3.06Å; Y139-S142 PolarHBondContact O-N 3.32Å; S142-K146 WeakPolarHBondContact O-CB 3.37Å; S142-K146 PolarHBondContact O-N 2.99Å
143	W	74.1	Confident	64.2	Low	16 Å²	16	78.8 Å²	78.8	6%	0.061	43%	0.426	C	S	.	.	H	α-helix	trans	-61.1	-49.8	172	-172.7	92.9	0	0	0	111	L51 I56 V60 L61 D64 L66 Y139 T141 H145 K146 Y147	L51-W143 HydrophobicContact CB-CH2 3.85Å; L51-W143 HydrophobicContact CB-CZ3 4.16Å; L51-W143 HydrophobicContact CD1-CH2 3.76Å; L51-W143 HydrophobicContact CD1-CZ2 4.06Å; L51-W143 HydrophobicContact CG-CH2 4.29Å; I56-W143 HydrophobicContact CD1-CD2 4.22Å; I56-W143 HydrophobicContact CD1-CE3 3.36Å; I56-W143 HydrophobicContact CD1-CZ3 3.75Å; I56-W143 HydrophobicContact CG1-CD2 4.44Å; I56-W143 HydrophobicContact CG1-CE3 3.8Å; I56-W143 HydrophobicContact CG1-CZ3 3.88Å; V60-W143 HydrophobicContact CG1-CZ2 4.29Å; L61-W143 HydrophobicContact CD2-CB 4.23Å; L61-W143 HydrophobicContact CD2-CG 4.33Å; D64-W143 PolarHBondContact OD2-NE1 3.08Å; L66-W143 HydrophobicContact CD1-CB 3.68Å; L66-W143 HydrophobicContact CD1-CG 4.04Å; Y139-W143 WeakPolarHBondContact O-CB 3.45Å; Y139-W143 PolarHBondContact O-N 3.24Å; T141-W143 VanDerWaalsContact C-N 3.34Å; T141-W143 PolarHBondContact O-N 3.11Å; W143-H145 PolarHBondContact O-N 3.06Å; W143-K146 PolarHBondContact O-N 3.44Å; W143-K146 VanDerWaalsContact O-N 3.15Å; W143-Y147 AromaticContact CD1-CE2 3.98Å; W143-Y147 HydrophobicContact CD2-CD2 4.02Å; W143-Y147 AromaticContact CE2-CD2 3.74Å; W143-Y147 HydrophobicContact CG-CD2 4.26Å; W143-Y147 HydrophobicContact CZ2-CD2 4.08Å; W143-Y147 HydrophobicContact CZ2-CG 4.4Å; W143-Y147 AromaticContact NE1-CD2 3.82Å; W143-Y147 AromaticContact NE1-CE2 3.68Å; W143-Y147 WeakPolarHBondContact O-CD2 3.44Å; W143-Y147 PolarHBondContact O-N 2.96Å; W143-Y147 VanDerWaalsContact O-N 3.13Å
144	L	70.6	Confident	61.8	Low	20 Å²	20	82 Å²	82	11%	0.105	44%	0.441	C	S	.	.	H	α-helix	trans	-57.6	-48.4	177.8	-74.2	161	0	0	0	111.9	R53 I56 K140 T141 K146 Y147 Q148	R53-L144 HydrophobicContact CG-CD1 3.43Å; R53-L144 VanDerWaalsContact CG-CD1 3.43Å; I56-L144 HydrophobicContact CD1-CD1 4.03Å; I56-L144 HydrophobicContact CD1-CD2 3.75Å; I56-L144 HydrophobicContact CD1-CG 3.62Å; K140-L144 WeakPolarHBondContact O-CD1 3.25Å; K140-L144 WeakPolarHBondContact O-CG 3.39Å; K140-L144 PolarHBondContact O-N 3.04Å; T141-L144 PolarHBondContact O-N 2.97Å; L144-K146 VanDerWaalsContact C-N 3.26Å; L144-K146 PolarHBondContact O-N 3.39Å; L144-Y147 PolarHBondContact O-N 3.34Å; L144-Q148 WeakPolarHBondContact O-CA 3.25Å; L144-Q148 WeakPolarHBondContact O-CB 3.48Å; L144-Q148 PolarHBondContact O-N 3.44Å
145	H	65.9	Low	59.3	Low	115 Å²	115	84.3 Å²	84.3	53%	0.532	46%	0.456	S	S	.	.	H	α-helix	trans	-64.1	-30.5	179.4	-169.8	-50.5	0	0	0	112.5	T141 W143	T141-H145 PolarHBondContact O-N 2.61Å; W143-H145 PolarHBondContact O-N 3.06Å
146	K	61.2	Low	56.6	Low	148 Å²	148	87 Å²	87	64%	0.643	48%	0.48	S	S	*	.	H	α-helix	trans	-72.8	-33.3	176.8	-171.5	-179.8	178.1	-171.1	0	112.8	S142 W143 L144	S142-K146 WeakPolarHBondContact O-CB 3.37Å; S142-K146 PolarHBondContact O-N 2.99Å; W143-K146 PolarHBondContact O-N 3.44Å; W143-K146 VanDerWaalsContact O-N 3.15Å; L144-K146 VanDerWaalsContact C-N 3.26Å; L144-K146 PolarHBondContact O-N 3.39Å
147	Y	61.4	Low	54.1	Low	128 Å²	128	92.3 Å²	92.3	50%	0.502	52%	0.517	S	S	.	.	H	α-helix	trans	-104.5	-9.2	-177	-71.7	-83.3	0	0	0	114.5	W143 L144	W143-Y147 AromaticContact CD1-CE2 3.98Å; W143-Y147 HydrophobicContact CD2-CD2 4.02Å; W143-Y147 AromaticContact CE2-CD2 3.74Å; W143-Y147 HydrophobicContact CG-CD2 4.26Å; W143-Y147 HydrophobicContact CZ2-CD2 4.08Å; W143-Y147 HydrophobicContact CZ2-CG 4.4Å; W143-Y147 AromaticContact NE1-CD2 3.82Å; W143-Y147 AromaticContact NE1-CE2 3.68Å; W143-Y147 WeakPolarHBondContact O-CD2 3.44Å; W143-Y147 PolarHBondContact O-N 2.96Å; W143-Y147 VanDerWaalsContact O-N 3.13Å; L144-Y147 PolarHBondContact O-N 3.34Å
148	Q	56.3	Low	51.9	Low	85 Å²	85	99.2 Å²	99.2	40%	0.397	55%	0.545	S	S	.	.			trans	-144.8	78.7	179.2	-167.2	172.6	19.1	0	0	111.5	L144 S150	L144-Q148 WeakPolarHBondContact O-CA 3.25Å; L144-Q148 WeakPolarHBondContact O-CB 3.48Å; L144-Q148 PolarHBondContact O-N 3.44Å; Q148-S150 PolarHBondContact O-N 3.5Å; Q148-S150 VanDerWaalsContact O-N 3.1Å
149	P	42.4	Very low	49.4	Very low	107 Å²	107	97.8 Å²	97.8	70%	0.695	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-4.6	-171.8	-21.2	34.6	0	0	0	116.3
150	S	37.7	Very low	47	Very low	109 Å²	109	104.6 Å²	104.6	76%	0.762	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	24.3	-171.2	69.2	0	0	0	0	113.9	Q148	Q148-S150 PolarHBondContact O-N 3.5Å; Q148-S150 VanDerWaalsContact O-N 3.1Å
151	A	40	Very low	44.7	Very low	72 Å²	72	110.4 Å²	110.4	60%	0.595	62%	0.621	S	S	*	*			trans	-136.9	76	-173	0	0	0	0	0	111.4
152	D	31.7	Very low	42.6	Very low	121 Å²	121	114.9 Å²	114.9	65%	0.647	64%	0.642	S	S	*	*			trans	-143	163.9	173.9	-157.7	9.4	0	0	0	112.8
153	M	29.3	Very low	40.4	Very low	149 Å²	149	119.2 Å²	119.2	73%	0.734	66%	0.655	S	S	*	*			trans	68.6	79	172	-65.1	-62.2	-72.7	0	0	118.7
154	S	26.9	Very low	38	Very low	119 Å²	119	125.5 Å²	125.5	83%	0.832	69%	0.686	S	S	*	*				-145.1	115.8	120	58.6	0	0	0	0	111.2
155	L	28.6	Very low	36	Very low	151 Å²	151	128.2 Å²	128.2	79%	0.791	72%	0.719	S	S	*	*			trans	-138.6	87.3	-178.1	-83.2	175.4	0	0	0	111.1
156	V	28.1	Very low	34	Very low	148 Å²	148	129.2 Å²	129.2	90%	0.897	73%	0.728	S	S	*	*			trans	-173.3	146.9	159	-98.3	0	0	0	0	107.2
157	S	26.5	Very low	32.5	Very low	111 Å²	111	131.9 Å²	131.9	78%	0.776	74%	0.743	S	S	*	*			cis	-143.4	151.3	-14.9	-169.4	0	0	0	0	108
158	E	31.8	Very low	30.9	Very low	198 Å²	198	134.2 Å²	134.2	93%	0.925	76%	0.759	S	S	*	*			trans	-86.6	151.7	164.4	-66.1	177.5	147.3	0	0	109.3
159	G	27.1	Very low	29.6	Very low	62 Å²	62	138.8 Å²	138.8	64%	0.639	78%	0.78	S	S	*	*			trans	-167.2	133.7	170	0	0	0	0	0	106.2
160	E	27.5	Very low	29	Very low	183 Å²	183	142.1 Å²	142.1	86%	0.855	79%	0.786	S	S	*	*				63.6	117.5	53	-59	-179.2	-179.3	0	0	111.4
161	D	25.8	Very low	28.4	Very low	142 Å²	142	143.8 Å²	143.8	76%	0.759	78%	0.782	S	S	*	*			cis	-158.5	-145	-18	-115.9	-13.6	0	0	0	107.7
162	D	28.1	Very low	27.7	Very low	153 Å²	153	144 Å²	144	82%	0.818	79%	0.792	S	S	*	*			trans	70.3	158	170.2	-54.3	-17.3	0	0	0	118.6
163	E	26.9	Very low	27.4	Very low	167 Å²	167	145.3 Å²	145.3	78%	0.78	79%	0.791	S	S	*	*				-164.1	154.4	-57.1	-127	-166.1	-177.1	0	0	108.9
164	M	25.1	Very low	27.1	Very low	148 Å²	148	144.4 Å²	144.4	73%	0.729	80%	0.795	S	S	*	*			trans	47.2	139.1	155.3	-63.8	-58.3	-65.4	0	0	122.7
165	G	26.8	Very low	27	Very low	76 Å²	76	143.2 Å²	143.2	78%	0.784	79%	0.792	S	S	*	*			trans	173	56.9	171.9	0	0	0	0	0	115.3
166	D	24.7	Very low	26.9	Very low	136 Å²	136	142.2 Å²	142.2	73%	0.727	79%	0.792	S	S	*	*			trans	-81.5	135.2	171.3	-62.1	-60.9	0	0	0	111.4
167	E	30.1	Very low	26.9	Very low	205 Å²	205	141 Å²	141	96%	0.958	79%	0.787	S	S	*	*			trans	-144.3	155.4	150.9	-73.4	-160.9	155.7	0	0	109.2
168	E	27.5	Very low	26.8	Very low	177 Å²	177	141.3 Å²	141.3	83%	0.827	78%	0.784	S	S	*	*			trans	-118.3	163.7	-157	-59.9	179.3	118.1	0	0	115.2
169	E	29.3	Very low	26.5	Very low	181 Å²	181	138 Å²	138	85%	0.846	77%	0.773	S	S	*	*			trans	65	165.1	154.9	-75.5	-178.7	171.2	0	0	119.3
170	E	28.6	Very low	26.4	Very low	177 Å²	177	140 Å²	140	83%	0.827	77%	0.769	S	S	*	*			cis	-137.1	-177.4	10.2	-146.7	-155.8	156.7	0	0	113.2
171	E	25.8	Very low	26.3	Very low	143 Å²	143	139.1 Å²	139.1	67%	0.668	76%	0.762	S	S	*	*			trans	-81.3	166	-177.5	-73.1	-164.3	133.6	0	0	116	K173	E171-K173 IonicContact OE1-NZ 3.61Å; E171-K173 PolarHBondContact OE1-NZ 2.84Å; E171-K173 IonicContact OE2-NZ 3.66Å; E171-K173 PolarHBondContact OE2-NZ 2.97Å
172	G	25.9	Very low	26.4	Very low	78 Å²	78	139.9 Å²	139.9	80%	0.804	77%	0.766	S	S	*	*			trans	-153.3	93.8	163	0	0	0	0	0	114
173	K	24.4	Very low	26.4	Very low	148 Å²	148	142.6 Å²	142.6	64%	0.643	77%	0.765	S	S	*	*			trans	-81	163.3	168.3	-52.1	-173.9	173.3	89	0	108.9	E171	E171-K173 IonicContact OE1-NZ 3.61Å; E171-K173 PolarHBondContact OE1-NZ 2.84Å; E171-K173 IonicContact OE2-NZ 3.66Å; E171-K173 PolarHBondContact OE2-NZ 2.97Å
174	T	23.1	Very low	26.3	Very low	130 Å²	130	144 Å²	144	80%	0.798	77%	0.768	S	S	*	*			cis	-172.9	162	42.1	-17.5	0	0	0	0	111.9
175	A	25	Very low	26.2	Very low	94 Å²	94	143 Å²	143	78%	0.777	77%	0.766	S	S	*	*			trans	74.8	144.9	143.9	0	0	0	0	0	122.3
176	V	26.9	Very low	26.1	Very low	130 Å²	130	148.4 Å²	148.4	79%	0.788	77%	0.768	S	S	*	*			trans	-128.1	156.3	174.6	179.1	0	0	0	0	107.2
177	P	28.5	Very low	26.3	Very low	123 Å²	123	147 Å²	147	80%	0.799	77%	0.766	S	S	*	*			trans	-131.7	165.2	138.5	37.3	-27.9	0	0	0	114.1
178	T	23.8	Very low	25.9	Very low	116 Å²	116	146.2 Å²	146.2	71%	0.712	76%	0.763	S	S	*	*			trans	-78.7	-176.1	175.6	57.8	0	0	0	0	110.3
179	D	25.9	Very low	25.8	Very low	129 Å²	129	146 Å²	146	69%	0.69	77%	0.767	S	S	*	*			cis	-167.2	168.1	28.3	-137.2	-41.1	0	0	0	115.3
180	D	25.3	Very low	25.7	Very low	104 Å²	104	146.6 Å²	146.6	56%	0.556	77%	0.769	S	S	*	*			trans	64.1	126.7	144.3	-111.9	9.1	0	0	0	127.1
181	K	25.7	Very low	25.5	Very low	165 Å²	165	145.4 Å²	145.4	72%	0.717	77%	0.768	S	S	*	*			trans	35.3	125.7	137.4	-67.8	170.6	-166	83.9	0	120.7
182	N	26.1	Very low	26.2	Very low	157 Å²	157	146.3 Å²	146.3	84%	0.84	78%	0.776	S	S	*	*				-153.4	161.6	105	-134.3	-50.3	0	0	0	114.3
183	R	28.4	Very low	26.4	Very low	211 Å²	211	148 Å²	148	80%	0.796	78%	0.775	S	S	*	*			trans	-148.6	124.4	-174.2	179.5	-177.1	179.7	-175.4	3.1	111
184	K	26.1	Very low	26.9	Very low	195 Å²	195	148.7 Å²	148.7	85%	0.848	79%	0.785	S	S	*	*			trans	-136.4	129.1	170.1	-75.6	-174.5	176.7	177	0	111.6
185	N	22.3	Very low	27.1	Very low	127 Å²	127	149 Å²	149	68%	0.679	79%	0.787	S	S	*	*			trans	-80.1	173	163	-52.4	-16.2	0	0	0	107.7
186	K	24.8	Very low	27.4	Very low	190 Å²	190	149.2 Å²	149.2	83%	0.826	78%	0.78	S	S	*	*			cis	174.2	-178.7	48.7	-153.9	-173.3	178.5	-172.7	0	107.5
187	P	28.5	Very low	27.8	Very low	107 Å²	107	153.9 Å²	153.9	70%	0.695	78%	0.784	S	S	*	*				-101.8	174.9	-78.6	36.6	-23	0	0	0	113.5
188	E	22.8	Very low	28.1	Very low	189 Å²	189	160.8 Å²	160.8	88%	0.883	79%	0.793	S	S	*	*			trans	-115.6	167.1	160.7	-69.9	-173	131.5	0	0	111.5
189	L	25.3	Very low	28.8	Very low	173 Å²	173	158.5 Å²	158.5	91%	0.906	79%	0.793	S	S	*	*			trans	-80.5	161.7	-177.1	-95.7	66.1	0	0	0	112.4
190	H	26.4	Very low	29.6	Very low	192 Å²	192	158.4 Å²	158.4	89%	0.889	79%	0.793	S	S	*	*			trans	-65.6	132.1	167.9	-85	-89.3	0	0	0	111.5
191	D	25.1	Very low	30.9	Very low	153 Å²	153	164.2 Å²	164.2	82%	0.818	81%	0.807	S	S	*	*			trans	-129	157.4	144.6	-160.2	0.7	0	0	0	109
192	I	40.5	Very low	32.5	Very low	162 Å²	162	163.5 Å²	163.5	83%	0.831	81%	0.806	S	S	*	*			trans	-100.6	95.9	-164.3	-56.6	176.5	0	0	0	109.8
193	S	28.8	Very low	34.8	Very low	112 Å²	112	161.4 Å²	161.4	78%	0.783	79%	0.786	S	S	*	*			trans	-114.9	152.6	175.9	-168.1	0	0	0	0	112.8
194	L	35.9	Very low	37.5	Very low	163 Å²	163	157.9 Å²	157.9	85%	0.853	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-67.1	128.3	-170.7	-67	160.6	0	0	0	111.5	P196	L194-P196 WeakPolarHBondContact O-CD 3.41Å
195	V	27.5	Very low	40.7	Very low	138 Å²	138	150.3 Å²	150.3	84%	0.836	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-70.6	116.4	-179.5	-179.3	0	0	0	0	110.5
196	P	31.6	Very low	44.1	Very low	98 Å²	98	146.4 Å²	146.4	64%	0.636	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-66.9	139.2	172.9	-17.7	32.8	0	0	0	110.3	L194	L194-P196 WeakPolarHBondContact O-CD 3.41Å
197	R	34.5	Very low	47.4	Very low	228 Å²	228	144.4 Å²	144.4	86%	0.86	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-65	143.1	170.4	-68.6	-173.4	176.9	-160.2	0.9	108.8	G199 D200	R197-G199 PolarHBondContact O-N 3.19Å; R197-D200 PolarHBondContact O-N 3.33Å
198	R	34.7	Very low	50.3	Low	267 Å²	267	140.8 Å²	140.8	100%	1.008	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	10.5	-169.2	-71.6	-171.2	173.4	-148.3	1.4	117.1
199	G	39.5	Very low	53.4	Low	69 Å²	69	137 Å²	137	71%	0.711	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	-31.1	173.5	0	0	0	0	0	114.5	R197 R201	R197-G199 PolarHBondContact O-N 3.19Å; G199-R201 VanDerWaalsContact C-N 3.28Å; G199-R201 PolarHBondContact O-N 3.32Å
200	D	42.5	Very low	56.4	Low	127 Å²	127	133.2 Å²	133.2	68%	0.679	67%	0.671	S	S	*	*			trans	-85.6	60.2	-170.9	-96.5	-23	0	0	0	112.8	R197	R197-D200 PolarHBondContact O-N 3.33Å
201	R	51.5	Low	59.3	Low	226 Å²	226	124.4 Å²	124.4	85%	0.853	63%	0.63	S	S	*	*			trans	-87	110.9	156.5	-84.8	-173.9	167.9	-172.7	-4.8	108	G199 R203	G199-R201 VanDerWaalsContact C-N 3.28Å; G199-R201 PolarHBondContact O-N 3.32Å; R201-R203 PolarHBondContact O-N 3.29Å
202	E	59	Low	62	Low	150 Å²	150	118.8 Å²	118.8	70%	0.701	61%	0.608	S	S	*	*			trans	-50.6	112.5	170.9	-174.8	168.7	-146.8	0	0	109.5	I204	E202-I204 VanDerWaalsContact C-N 3.31Å; E202-I204 PolarHBondContact O-N 2.9Å
203	R	74.8	Confident	64.2	Low	112 Å²	112	114.8 Å²	114.8	42%	0.423	59%	0.592	S	S	.	*			trans	-76	84	-176.8	-69.2	-173.3	-175.6	161.1	2	109.1	R201 P205 L223	R201-R203 PolarHBondContact O-N 3.29Å; R203-P205 WeakPolarHBondContact O-CD 3.44Å; R203-P205 VanDerWaalsContact O-N 3.13Å; R203-L223 HydrophobicContact CB-CD1 3.74Å; R203-L223 HydrophobicContact CB-CG 4Å
204	I	86.3	Confident	66.9	Low	137 Å²	137	114.4 Å²	114.4	70%	0.703	57%	0.573	S	S	*	*			trans	-53.1	115.8	174.9	-56.9	176.4	0	0	0	108.6	E202	E202-I204 VanDerWaalsContact C-N 3.31Å; E202-I204 PolarHBondContact O-N 2.9Å
205	P	92.3	Very high	69.3	Low	37 Å²	37	110.4 Å²	110.4	24%	0.24	55%	0.552	C	S	.	*			trans	-65.8	146.1	178.3	-20.4	33.7	0	0	0	111.3	R203 L223 E225 P323 L325	R203-P205 WeakPolarHBondContact O-CD 3.44Å; R203-P205 VanDerWaalsContact O-N 3.13Å; P205-L223 CarbonylContact C-O 3.49Å; P205-L223 WeakPolarHBondContact CA-O 3.29Å; P205-L223 HydrophobicContact CB-CB 4.34Å; P205-L223 HydrophobicContact CG-CB 4.5Å; P205-E225 HydrophobicContact CB-CG 4.18Å; P205-P323 HydrophobicContact CG-CG 4.34Å; P205-L325 HydrophobicContact CB-CD1 3.81Å; P205-L325 HydrophobicContact CG-CD1 3.57Å
206	V	94.7	Very high	71.9	Confident	44 Å²	44	109.1 Å²	109.1	27%	0.267	56%	0.556	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.3	150.7	176.3	-55	0	0	0	0	111.2	L211 T222 L223 V224 E225	V206-L211 HydrophobicContact CG2-CD2 3.63Å; V206-L211 HydrophobicContact CG2-CG 4.37Å; V206-T222 HydrophobicContact CG1-CG2 4.19Å; V206-T222 HydrophobicContact CG2-CG2 3.79Å; V206-L223 PolarHBondContact N-O 3.09Å; V206-V224 HydrophobicContact CG2-CG2 4.4Å; V206-V224 CarbonylContact O-C 3.15Å; V206-V224 VanDerWaalsContact O-CA 3.32Å; V206-V224 WeakPolarHBondContact O-CA 3.5Å; V206-E225 PolarHBondContact O-N 3.45Å
207	R	93.1	Very high	74.5	Confident	148 Å²	148	108.7 Å²	108.7	56%	0.558	56%	0.561	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-74.6	139	174.1	-76.4	179	175.3	174.6	3.2	111	C209 T210 E225	R207-C209 PolarHBondContact O-N 3.15Å; R207-C209 VanDerWaalsContact O-N 3.12Å; R207-T210 HydrophobicContact CB-CG2 4.36Å; R207-T210 PolarHBondContact O-N 2.6Å; R207-T210 PolarHBondContact O-OG1 2.89Å; R207-E225 HydrophobicContact CG-CB 4.41Å; R207-E225 VanDerWaalsContact CG-CD 3.41Å; R207-E225 HydrophobicContact CG-CG 4.24Å; R207-E225 WeakPolarHBondContact CG-OE2 3.14Å; R207-E225 IonicContact CZ-OE2 3.72Å; R207-E225 IonicContact NE-OE1 2.74Å; R207-E225 PolarHBondContact NE-OE1 3.04Å; R207-E225 IonicContact NE-OE2 3.87Å; R207-E225 PolarHBondContact NE-OE2 2.95Å; R207-E225 IonicContact NH2-OE2 2.7Å
208	Y	89.5	Confident	77.1	Confident	32 Å²	32	101.1 Å²	101.1	13%	0.125	53%	0.532	C	S	.	.	G	3₁₀ helix	trans	-49.6	-41	174.8	175.5	-90	0	0	0	112.4	T210 L211 Y386 G387 I388	Y208-T210 PolarHBondContact O-N 3.17Å; Y208-T210 VanDerWaalsContact O-N 3.11Å; Y208-L211 HydrophobicContact CD2-CD1 3.91Å; Y208-L211 HydrophobicContact CE2-CD1 4.42Å; Y208-L211 WeakPolarHBondContact O-CB 3.4Å; Y208-L211 PolarHBondContact O-N 3Å; Y208-Y386 WeakPolarHBondContact CE2-O 3.49Å; Y208-Y386 PolarHBondContact OH-O 2.87Å; Y208-G387 WeakPolarHBondContact CE2-O 3.3Å; Y208-I388 HydrophobicContact CD1-CG1 4.35Å; Y208-I388 HydrophobicContact CD1-CG2 4.17Å; Y208-I388 HydrophobicContact CD2-CB 4.46Å; Y208-I388 HydrophobicContact CD2-CG2 4.3Å; Y208-I388 HydrophobicContact CE1-CD1 4.43Å; Y208-I388 HydrophobicContact CE1-CG1 3.82Å; Y208-I388 HydrophobicContact CE1-CG2 4.49Å; Y208-I388 HydrophobicContact CE2-CB 4.31Å; Y208-I388 HydrophobicContact CE2-CG1 4.01Å; Y208-I388 HydrophobicContact CG-CG2 4.1Å
209	C	87	Confident	79.9	Confident	108 Å²	108	92.6 Å²	92.6	73%	0.73	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-63.9	-15.4	178.4	61.5	0	0	0	0	115.1	R207	R207-C209 PolarHBondContact O-N 3.15Å; R207-C209 VanDerWaalsContact O-N 3.12Å
210	T	89.3	Confident	82.4	Confident	95 Å²	95	92.5 Å²	92.5	58%	0.583	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-92.6	-7.1	174.3	63.2	0	0	0	0	113.7	R207 Y208	R207-T210 HydrophobicContact CB-CG2 4.36Å; R207-T210 PolarHBondContact O-N 2.6Å; R207-T210 PolarHBondContact O-OG1 2.89Å; Y208-T210 PolarHBondContact O-N 3.17Å; Y208-T210 VanDerWaalsContact O-N 3.11Å
211	L	86.9	Confident	84.8	Confident	7 Å²	7	90.3 Å²	90.3	4%	0.037	48%	0.479	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-46.3	179.2	-64.9	175.9	0	0	0	112.3	V206 Y208 R218 V224 L328 Y386	V206-L211 HydrophobicContact CG2-CD2 3.63Å; V206-L211 HydrophobicContact CG2-CG 4.37Å; Y208-L211 HydrophobicContact CD2-CD1 3.91Å; Y208-L211 HydrophobicContact CE2-CD1 4.42Å; Y208-L211 WeakPolarHBondContact O-CB 3.4Å; Y208-L211 PolarHBondContact O-N 3Å; L211-R218 VanDerWaalsContact O-CZ 3.26Å; L211-R218 PolarHBondContact O-NH1 3.15Å; L211-R218 PolarHBondContact O-NH2 2.92Å; L211-V224 HydrophobicContact CD1-CG1 4.09Å; L211-V224 HydrophobicContact CD1-CG2 4.11Å; L211-L328 HydrophobicContact CD1-CD2 3.82Å; L211-L328 HydrophobicContact CD2-CD2 4Å; L211-Y386 HydrophobicContact CB-CD2 4.37Å; L211-Y386 HydrophobicContact CD1-CD2 4.37Å
212	G	82.8	Confident	86.9	Confident	34 Å²	34	81 Å²	81	35%	0.351	45%	0.447	S	S	.	.			trans	58.2	-152	-168.4	0	0	0	0	0	112.8
213	T	85.8	Confident	88.7	Confident	79 Å²	79	74 Å²	74	49%	0.485	42%	0.415	S	S	.	.	B	Isolated β-bridge	trans	-66.2	152.7	179.6	-53.4	0	0	0	0	112.5	N384 D385	T213-N384 HydrophobicContact CG2-CB 3.74Å; T213-N384 WeakPolarHBondContact CG2-O 3.48Å; T213-D385 WeakPolarHBondContact CA-OD1 3.44Å; T213-D385 WeakPolarHBondContact CB-OD1 3.46Å; T213-D385 PolarHBondContact OG1-OD1 3.4Å
214	R	87	Confident	89.7	Confident	104 Å²	104	68.7 Å²	68.7	39%	0.392	40%	0.395	S	S	.	.			trans	-64.3	133.8	-175.2	-65.5	165.9	78.3	91.3	17.6	111.5	D332 N384 D385 Y386	R214-D332 IonicContact CZ-OD1 3.75Å; R214-D332 VanDerWaalsContact CZ-OD1 3.28Å; R214-D332 IonicContact CZ-OD2 2.78Å; R214-D332 IonicContact NH1-OD1 2.68Å; R214-D332 PolarHBondContact NH1-OD1 3.14Å; R214-D332 IonicContact NH1-OD2 3.26Å; R214-D332 IonicContact NH2-OD1 2.58Å; R214-D332 PolarHBondContact NH2-OD1 3.01Å; R214-D332 IonicContact NH2-OD2 2.79Å; R214-D332 PolarHBondContact NH2-OD2 3.43Å; R214-N384 VanDerWaalsContact CB-O 3.25Å; R214-N384 WeakPolarHBondContact CB-O 3.49Å; R214-N384 VanDerWaalsContact CD-O 3.23Å; R214-N384 WeakPolarHBondContact CD-O 3.34Å; R214-N384 WeakPolarHBondContact CG-O 3.23Å; R214-N384 PolarHBondContact N-O 2.93Å; R214-D385 WeakPolarHBondContact CD-O 3.28Å; R214-Y386 HydrophobicContact CB-CE2 4.08Å; R214-Y386 HydrophobicContact CG-CD1 4.03Å; R214-Y386 HydrophobicContact CG-CD2 3.73Å; R214-Y386 HydrophobicContact CG-CE1 4Å; R214-Y386 HydrophobicContact CG-CE2 3.7Å; R214-Y386 HydrophobicContact CG-CG 3.9Å
215	D	85.9	Confident	90.3	Very high	79 Å²	79	65.6 Å²	65.6	42%	0.422	38%	0.377	S	S	.	.			trans	-128.5	125.4	179.5	174.6	13.1	0	0	0	108.9	A217 R218	D215-A217 PolarHBondContact O-N 3.23Å; D215-A217 WeakPolarHBondContact OD1-CB 3.4Å; D215-A217 PolarHBondContact OD1-N 3.31Å; D215-R218 WeakPolarHBondContact O-CB 3.44Å; D215-R218 PolarHBondContact O-N 3.13Å
216	A	81.4	Confident	90.5	Very high	111 Å²	111	65.6 Å²	65.6	92%	0.917	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-11.7	179.6	0	0	0	0	0	113.5
217	A	86.9	Confident	90.5	Very high	88 Å²	88	64.8 Å²	64.8	73%	0.727	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-7.1	172.9	0	0	0	0	0	113.5	D215	D215-A217 PolarHBondContact O-N 3.23Å; D215-A217 WeakPolarHBondContact OD1-CB 3.4Å; D215-A217 PolarHBondContact OD1-N 3.31Å
218	R	88.9	Confident	90.6	Very high	70 Å²	70	60 Å²	60	26%	0.264	36%	0.364	S	S	.	.	S	Bend	trans	-82.7	134.5	179.8	-168.7	173.1	-65.7	159.1	-1.3	111.3	L211 D215 P220 L328	L211-R218 VanDerWaalsContact O-CZ 3.26Å; L211-R218 PolarHBondContact O-NH1 3.15Å; L211-R218 PolarHBondContact O-NH2 2.92Å; D215-R218 WeakPolarHBondContact O-CB 3.44Å; D215-R218 PolarHBondContact O-N 3.13Å; R218-P220 WeakPolarHBondContact O-CD 3.43Å; R218-L328 VanDerWaalsContact CD-CD1 3.47Å; R218-L328 HydrophobicContact CG-CD1 3.77Å
219	D	92	Very high	90.8	Very high	88 Å²	88	59.3 Å²	59.3	47%	0.471	36%	0.361	S	S	.	.			trans	-59.9	118.6	178	-178.5	-4.9	0	0	0	111	H221 T222	D219-H221 PolarHBondContact O-N 2.87Å; D219-H221 VanDerWaalsContact O-N 3.12Å; D219-H221 WeakPolarHBondContact OD1-CB 3.33Å; D219-H221 IonicContact OD1-CD2 2.79Å; D219-H221 PolarHBondContact OD1-CD2 2.89Å; D219-H221 IonicContact OD1-CG 3.64Å; D219-H221 PolarHBondContact OD1-N 3.19Å; D219-T222 VanDerWaalsContact O-CB 3.29Å; D219-T222 WeakPolarHBondContact O-CB 3.44Å; D219-T222 PolarHBondContact O-N 3.5Å; D219-T222 PolarHBondContact O-OG1 3.31Å
220	P	93.1	Very high	91.1	Very high	67 Å²	67	58.4 Å²	58.4	44%	0.435	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-25.3	177.1	-25.1	35.2	0	0	0	114	R218 T222 S327 L328 Q329	R218-P220 WeakPolarHBondContact O-CD 3.43Å; P220-T222 VanDerWaalsContact C-N 3.27Å; P220-T222 PolarHBondContact O-N 3.05Å; P220-S327 WeakPolarHBondContact O-CB 3.38Å; P220-L328 PolarHBondContact O-N 3.2Å; P220-L328 VanDerWaalsContact O-N 3.15Å; P220-Q329 HydrophobicContact CB-CB 4.11Å; P220-Q329 PolarHBondContact O-N 3.41Å
221	H	93.4	Very high	91.2	Very high	80 Å²	80	57.5 Å²	57.5	37%	0.37	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	5.6	179.1	-53.7	-57.8	0	0	0	113.8	D219 L223 Q329	D219-H221 PolarHBondContact O-N 2.87Å; D219-H221 VanDerWaalsContact O-N 3.12Å; D219-H221 WeakPolarHBondContact OD1-CB 3.33Å; D219-H221 IonicContact OD1-CD2 2.79Å; D219-H221 PolarHBondContact OD1-CD2 2.89Å; D219-H221 IonicContact OD1-CG 3.64Å; D219-H221 PolarHBondContact OD1-N 3.19Å; H221-L223 PolarHBondContact O-N 2.93Å; H221-Q329 PolarHBondContact CE1-OE1 3.36Å; H221-Q329 VanDerWaalsContact CE1-OE1 3.22Å
222	T	94.8	Very high	91.4	Very high	32 Å²	32	59 Å²	59	20%	0.196	37%	0.366	C	S	.	.			trans	-59.9	117.6	170.8	-56.9	0	0	0	0	109.7	V206 D219 P220 S327 L328	V206-T222 HydrophobicContact CG1-CG2 4.19Å; V206-T222 HydrophobicContact CG2-CG2 3.79Å; D219-T222 VanDerWaalsContact O-CB 3.29Å; D219-T222 WeakPolarHBondContact O-CB 3.44Å; D219-T222 PolarHBondContact O-N 3.5Å; D219-T222 PolarHBondContact O-OG1 3.31Å; P220-T222 VanDerWaalsContact C-N 3.27Å; P220-T222 PolarHBondContact O-N 3.05Å; T222-S327 CarbonylContact O-C 3.58Å; T222-S327 VanDerWaalsContact O-CA 3.25Å; T222-S327 WeakPolarHBondContact O-CA 3.44Å; T222-L328 PolarHBondContact O-N 3.19Å; T222-L328 VanDerWaalsContact O-N 3.09Å
223	L	96.7	Very high	91.8	Very high	3 Å²	3	65 Å²	65	2%	0.016	39%	0.39	C	S	.	.	B	Isolated β-bridge	trans	-78.7	145.1	178.8	-56.1	-173.3	0	0	0	111.5	R203 P205 V206 H221 P323	R203-L223 HydrophobicContact CB-CD1 3.74Å; R203-L223 HydrophobicContact CB-CG 4Å; P205-L223 CarbonylContact C-O 3.49Å; P205-L223 WeakPolarHBondContact CA-O 3.29Å; P205-L223 HydrophobicContact CB-CB 4.34Å; P205-L223 HydrophobicContact CG-CB 4.5Å; V206-L223 PolarHBondContact N-O 3.09Å; H221-L223 PolarHBondContact O-N 2.93Å; L223-P323 HydrophobicContact CD1-CG 3.69Å
224	V	96.7	Very high	92.1	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	133.1	-174	-171.7	0	0	0	0	111.3	V206 L211 L226 P326 L328 I331 P389	V206-V224 HydrophobicContact CG2-CG2 4.4Å; V206-V224 CarbonylContact O-C 3.15Å; V206-V224 VanDerWaalsContact O-CA 3.32Å; V206-V224 WeakPolarHBondContact O-CA 3.5Å; L211-V224 HydrophobicContact CD1-CG1 4.09Å; L211-V224 HydrophobicContact CD1-CG2 4.11Å; V224-L226 PolarHBondContact O-N 3.32Å; V224-P326 PolarHBondContact N-O 2.85Å; V224-L328 HydrophobicContact CG2-CD2 3.75Å; V224-L328 HydrophobicContact CG2-CG 4.35Å; V224-I331 HydrophobicContact CB-CD1 4.01Å; V224-I331 HydrophobicContact CG1-CD1 4.35Å; V224-I331 HydrophobicContact CG2-CD1 3.77Å; V224-P389 HydrophobicContact CB-CG 4.3Å; V224-P389 HydrophobicContact CG1-CG 3.8Å
225	E	97.1	Very high	92.3	Very high	71 Å²	71	71.6 Å²	71.6	33%	0.332	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	130.8	171.8	-69.8	-176	-161	0	0	110.9	P205 V206 R207	P205-E225 HydrophobicContact CB-CG 4.18Å; V206-E225 PolarHBondContact O-N 3.45Å; R207-E225 HydrophobicContact CG-CB 4.41Å; R207-E225 VanDerWaalsContact CG-CD 3.41Å; R207-E225 HydrophobicContact CG-CG 4.24Å; R207-E225 WeakPolarHBondContact CG-OE2 3.14Å; R207-E225 IonicContact CZ-OE2 3.72Å; R207-E225 IonicContact NE-OE1 2.74Å; R207-E225 PolarHBondContact NE-OE1 3.04Å; R207-E225 IonicContact NE-OE2 3.87Å; R207-E225 PolarHBondContact NE-OE2 2.95Å; R207-E225 IonicContact NH2-OE2 2.7Å
226	L	97.1	Very high	92.7	Very high	37 Å²	37	70 Å²	70	19%	0.194	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-70.6	135.5	173.5	-65.4	-173.1	0	0	0	111.4	V224 L325 P326 T371 F373 P389 A391	V224-L226 PolarHBondContact O-N 3.32Å; L226-L325 HydrophobicContact CD1-CD2 4.47Å; L226-L325 HydrophobicContact CG-CD2 3.97Å; L226-P326 HydrophobicContact CD2-CG 3.58Å; L226-T371 HydrophobicContact CD1-CG2 3.28Å; L226-F373 HydrophobicContact CD1-CB 4.05Å; L226-F373 HydrophobicContact CD2-CB 4.04Å; L226-P389 HydrophobicContact CD2-CB 3.67Å; L226-P389 HydrophobicContact CD2-CG 4.34Å; L226-A391 HydrophobicContact CB-CB 4.16Å; L226-A391 HydrophobicContact CD1-CB 3.97Å
227	S	95.8	Very high	93.2	Very high	28 Å²	28	67.4 Å²	67.4	20%	0.196	38%	0.376	C	S	.	.	B	Isolated β-bridge	trans	-86.9	146.3	170.4	-61.3	0	0	0	0	111.1	P389 V390 A391	S227-P389 PolarHBondContact N-O 3.24Å; S227-V390 CarbonylContact O-C 3.6Å; S227-V390 WeakPolarHBondContact O-CA 3.3Å; S227-V390 WeakPolarHBondContact O-CB 3.46Å; S227-A391 PolarHBondContact O-N 3.49Å
228	A	94.4	Very high	93.6	Very high	48 Å²	48	63.4 Å²	63.4	40%	0.397	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-74.1	146.9	163.3	0	0	0	0	0	109.8	S230 A231	A228-S230 PolarHBondContact O-N 2.77Å; A228-A231 HydrophobicContact CB-CB 4.22Å; A228-A231 WeakPolarHBondContact O-CB 3.26Å; A228-A231 PolarHBondContact O-N 2.92Å
229	F	93.2	Very high	94	Very high	16 Å²	16	64.8 Å²	64.8	7%	0.07	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-41.2	174.3	-80.5	-85.1	0	0	0	112	A231 I232 N233 R234 F235 Q236 W374 V376 V390 A391 V392	F229-A231 VanDerWaalsContact C-N 3.33Å; F229-A231 PolarHBondContact O-N 2.86Å; F229-I232 WeakPolarHBondContact O-CG1 3.35Å; F229-I232 PolarHBondContact O-N 3.4Å; F229-N233 PolarHBondContact O-N 2.91Å; F229-R234 CarbonylContact C-O 3.59Å; F229-R234 HydrophobicContact CD1-CB 4.36Å; F229-R234 CarbonylContact O-C 3.59Å; F229-R234 PolarHBondContact O-N 3.43Å; F229-F235 WeakPolarHBondContact CD1-O 3.35Å; F229-Q236 HydrophobicContact CD2-CB 3.76Å; F229-Q236 HydrophobicContact CD2-CG 4.15Å; F229-Q236 HydrophobicContact CE2-CB 3.75Å; F229-Q236 HydrophobicContact CE2-CG 3.61Å; F229-Q236 HydrophobicContact CG-CB 4.18Å; F229-Q236 HydrophobicContact CZ-CB 4.15Å; F229-Q236 HydrophobicContact CZ-CG 3.9Å; F229-W374 AromaticContact CE1-CE3 3.93Å; F229-W374 HydrophobicContact CE1-CE3 3.93Å; F229-W374 HydrophobicContact CE1-CZ3 4.16Å; F229-W374 AromaticContact CZ-CE3 3.86Å; F229-W374 HydrophobicContact CZ-CE3 3.86Å; F229-W374 HydrophobicContact CZ-CZ3 4.49Å; F229-V376 HydrophobicContact CE1-CG2 4.4Å; F229-V390 HydrophobicContact CD1-CG2 4.4Å; F229-V390 HydrophobicContact CD2-CB 4.37Å; F229-V390 HydrophobicContact CD2-CG2 4.4Å; F229-V390 HydrophobicContact CE1-CG2 3.78Å; F229-V390 HydrophobicContact CE2-CB 4.17Å; F229-V390 HydrophobicContact CE2-CG2 3.78Å; F229-V390 HydrophobicContact CZ-CB 4.25Å; F229-V390 HydrophobicContact CZ-CG2 3.43Å; F229-V390 VanDerWaalsContact CZ-CG2 3.43Å; F229-A391 WeakPolarHBondContact CD2-O 3.15Å; F229-A391 VanDerWaalsContact CE2-O 3.29Å; F229-A391 WeakPolarHBondContact CE2-O 3.32Å; F229-V392 HydrophobicContact CE2-CG2 4.46Å
230	S	93.4	Very high	94.3	Very high	90 Å²	90	60.8 Å²	60.8	63%	0.629	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-61.7	-36.1	176.1	52.3	0	0	0	0	113.3	A228 I232 N233 R234	A228-S230 PolarHBondContact O-N 2.77Å; S230-I232 PolarHBondContact O-N 2.91Å; S230-N233 PolarHBondContact O-N 2.85Å; S230-R234 PolarHBondContact N-O 2.95Å
231	A	92.3	Very high	94.5	Very high	76 Å²	76	58 Å²	58	63%	0.628	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-68.2	-16.3	178.7	0	0	0	0	0	113.5	A228 F229	A228-A231 HydrophobicContact CB-CB 4.22Å; A228-A231 WeakPolarHBondContact O-CB 3.26Å; A228-A231 PolarHBondContact O-N 2.92Å; F229-A231 VanDerWaalsContact C-N 3.33Å; F229-A231 PolarHBondContact O-N 2.86Å
232	I	90.1	Very high	94.8	Very high	38 Å²	38	54.3 Å²	54.3	20%	0.195	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-109	17.7	172.9	64.1	167.1	0	0	0	112.8	F229 S230 R234 V376 I388 V390	F229-I232 WeakPolarHBondContact O-CG1 3.35Å; F229-I232 PolarHBondContact O-N 3.4Å; S230-I232 PolarHBondContact O-N 2.91Å; I232-R234 VanDerWaalsContact C-N 3.3Å; I232-R234 HydrophobicContact CD1-CB 4.42Å; I232-R234 HydrophobicContact CD1-CG 4.32Å; I232-R234 HydrophobicContact CG1-CB 4.2Å; I232-R234 HydrophobicContact CG1-CG 4.24Å; I232-R234 PolarHBondContact O-N 2.68Å; I232-V376 HydrophobicContact CD1-CB 4.45Å; I232-V376 HydrophobicContact CD1-CG2 3.85Å; I232-I388 HydrophobicContact CD1-CD1 4.48Å; I232-I388 HydrophobicContact CG2-CD1 4.48Å; I232-I388 HydrophobicContact CG2-CG2 4.32Å; I232-V390 HydrophobicContact CD1-CG1 3.76Å
233	N	91.3	Very high	94.9	Very high	159 Å²	159	53.2 Å²	53.2	85%	0.85	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	39.7	-177.2	-58.4	-57.5	0	0	0	113.8	F229 S230	F229-N233 PolarHBondContact O-N 2.91Å; S230-N233 PolarHBondContact O-N 2.85Å
234	R	91.8	Very high	95	Very high	131 Å²	131	53.6 Å²	53.6	49%	0.494	30%	0.295	S	S	.	.			trans	-126.3	167.8	173.8	-63	-170.4	-178.1	-152.5	0.5	110.9	F229 S230 I232 V376	F229-R234 CarbonylContact C-O 3.59Å; F229-R234 HydrophobicContact CD1-CB 4.36Å; F229-R234 CarbonylContact O-C 3.59Å; F229-R234 PolarHBondContact O-N 3.43Å; S230-R234 PolarHBondContact N-O 2.95Å; I232-R234 VanDerWaalsContact C-N 3.3Å; I232-R234 HydrophobicContact CD1-CB 4.42Å; I232-R234 HydrophobicContact CD1-CG 4.32Å; I232-R234 HydrophobicContact CG1-CB 4.2Å; I232-R234 HydrophobicContact CG1-CG 4.24Å; I232-R234 PolarHBondContact O-N 2.68Å; R234-V376 VanDerWaalsContact NH1-CG1 3.33Å
235	F	92.6	Very high	95	Very high	191 Å²	191	53.9 Å²	53.9	84%	0.838	30%	0.297	S	S	*	.			trans	-107.5	157.9	166.5	-59.6	-77	0	0	0	109.3	F229 P237	F229-F235 WeakPolarHBondContact CD1-O 3.35Å; F235-P237 WeakPolarHBondContact O-CD 3.31Å
236	Q	94.6	Very high	95.1	Very high	46 Å²	46	50.6 Å²	50.6	22%	0.215	28%	0.282	C	S	.	.			trans	-66	122.1	171.4	-173.7	171	-66.6	0	0	109.1	F229 F238 E393	F229-Q236 HydrophobicContact CD2-CB 3.76Å; F229-Q236 HydrophobicContact CD2-CG 4.15Å; F229-Q236 HydrophobicContact CE2-CB 3.75Å; F229-Q236 HydrophobicContact CE2-CG 3.61Å; F229-Q236 HydrophobicContact CG-CB 4.18Å; F229-Q236 HydrophobicContact CZ-CB 4.15Å; F229-Q236 HydrophobicContact CZ-CG 3.9Å; Q236-F238 VanDerWaalsContact C-N 3.27Å; Q236-F238 WeakPolarHBondContact CG-O 3.46Å; Q236-F238 PolarHBondContact NE2-O 3.25Å; Q236-F238 PolarHBondContact O-N 2.79Å; Q236-E393 PolarHBondContact NE2-O 2.61Å
237	P	91.1	Very high	95.1	Very high	57 Å²	57	49.2 Å²	49.2	37%	0.37	27%	0.274	S	S	.	.	S	Bend	trans	-80.8	-1	-168.7	26.1	-27.9	0	0	0	114.8	F235 W374	F235-P237 WeakPolarHBondContact O-CD 3.31Å; P237-W374 HydrophobicContact CG-CE3 4.37Å; P237-W374 HydrophobicContact CG-CH2 3.76Å; P237-W374 HydrophobicContact CG-CZ2 4.49Å; P237-W374 HydrophobicContact CG-CZ3 3.68Å
238	F	94.7	Very high	95.2	Very high	4 Å²	4	47.9 Å²	47.9	2%	0.018	27%	0.265	C	S	.	.	S	Bend	trans	-154.3	148.7	178.9	52.1	-86.9	0	0	0	111	Q236 V240 W269 Q274 L276 F348 P350 W374	Q236-F238 VanDerWaalsContact C-N 3.27Å; Q236-F238 WeakPolarHBondContact CG-O 3.46Å; Q236-F238 PolarHBondContact NE2-O 3.25Å; Q236-F238 PolarHBondContact O-N 2.79Å; F238-V240 HydrophobicContact CD2-CG2 3.58Å; F238-V240 HydrophobicContact CE2-CG2 3.52Å; F238-W269 HydrophobicContact CB-CH2 3.73Å; F238-W269 HydrophobicContact CB-CZ3 3.79Å; F238-Q274 CarbonylContact C-O 3.56Å; F238-Q274 WeakPolarHBondContact CA-O 3.33Å; F238-L276 HydrophobicContact CD2-CB 4.5Å; F238-F348 HydrophobicContact CB-CE1 4.36Å; F238-F348 AromaticContact CD1-CE1 3.64Å; F238-F348 HydrophobicContact CD1-CE1 3.64Å; F238-F348 AromaticContact CD1-CZ 3.63Å; F238-F348 HydrophobicContact CD1-CZ 3.63Å; F238-F348 HydrophobicContact CE1-CE1 4.35Å; F238-F348 AromaticContact CE1-CZ 3.92Å; F238-F348 HydrophobicContact CE1-CZ 3.92Å; F238-F348 HydrophobicContact CG-CE1 4.28Å; F238-P350 HydrophobicContact CB-CG 4.47Å; F238-P350 HydrophobicContact CD1-CB 3.72Å; F238-P350 HydrophobicContact CD1-CG 4.32Å; F238-P350 HydrophobicContact CD2-CB 3.84Å; F238-P350 HydrophobicContact CD2-CG 4.01Å; F238-P350 HydrophobicContact CE1-CB 3.64Å; F238-P350 HydrophobicContact CE2-CB 3.74Å; F238-P350 HydrophobicContact CE2-CG 4.34Å; F238-P350 HydrophobicContact CG-CB 3.83Å; F238-P350 HydrophobicContact CG-CG 4.01Å; F238-P350 HydrophobicContact CZ-CB 3.65Å; F238-W374 HydrophobicContact CE1-CD2 4.01Å; F238-W374 AromaticContact CE1-CE2 3.8Å; F238-W374 HydrophobicContact CE1-CG 4.28Å; F238-W374 HydrophobicContact CE1-CZ2 4.18Å; F238-W374 AromaticContact CE1-NE1 3.92Å; F238-W374 AromaticContact CZ-CD1 3.87Å; F238-W374 HydrophobicContact CZ-CD2 4.25Å; F238-W374 HydrophobicContact CZ-CG 4.03Å
239	N	97	Very high	95.4	Very high	99 Å²	99	45.7 Å²	45.7	53%	0.529	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	148.1	170.4	-64.8	-60.2	0	0	0	109.8	Q274 L275 L276	N239-Q274 PolarHBondContact N-O 3.18Å; N239-L275 HydrophobicContact CB-CD1 3.69Å; N239-L276 PolarHBondContact O-N 2.87Å
240	V	98.4	Very high	95.7	Very high	3 Å²	3	45 Å²	45	2%	0.018	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	131.8	174.4	-178.5	0	0	0	0	109.8	F238 V242 L276 L352 V392 V394 T395	F238-V240 HydrophobicContact CD2-CG2 3.58Å; F238-V240 HydrophobicContact CE2-CG2 3.52Å; V240-V242 HydrophobicContact CG1-CG2 3.89Å; V240-L276 CarbonylContact C-O 3.48Å; V240-L276 WeakPolarHBondContact CA-O 3.19Å; V240-L276 HydrophobicContact CG2-CB 4.37Å; V240-L352 HydrophobicContact CG1-CD2 3.91Å; V240-V392 HydrophobicContact CB-CG1 4.41Å; V240-V392 HydrophobicContact CG2-CG1 3.72Å; V240-V394 HydrophobicContact CB-CB 4.35Å; V240-V394 HydrophobicContact CB-CG1 3.91Å; V240-V394 HydrophobicContact CG1-CB 4.21Å; V240-V394 HydrophobicContact CG1-CG1 3.69Å; V240-T395 PolarHBondContact O-N 3.01Å
241	A	98.6	Very high	95.9	Very high	10 Å²	10	40.7 Å²	40.7	8%	0.083	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	130.6	169.4	0	0	0	0	0	109.7	L275 L276 T277 V278 T395 V397	A241-L275 HydrophobicContact CB-CD1 4.08Å; A241-L276 PolarHBondContact N-O 3.4Å; A241-T277 HydrophobicContact CB-CG2 4.34Å; A241-T277 CarbonylContact O-C 3.53Å; A241-T277 WeakPolarHBondContact O-CA 3.37Å; A241-V278 PolarHBondContact O-N 3.23Å; A241-T395 CarbonylContact C-O 3.59Å; A241-T395 VanDerWaalsContact CA-O 3.31Å; A241-T395 WeakPolarHBondContact CA-O 3.25Å; A241-V397 HydrophobicContact CB-CG2 3.98Å
242	V	98.6	Very high	96.2	Very high	2 Å²	2	37 Å²	37	1%	0.012	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	125.1	-179.8	-172.6	0	0	0	0	109.8	V240 V246 L247 V278 V394 T395 V397	V240-V242 HydrophobicContact CG1-CG2 3.89Å; V242-V246 HydrophobicContact CG1-CB 4.08Å; V242-V246 HydrophobicContact CG1-CG1 4.21Å; V242-L247 HydrophobicContact CG1-CD2 3.85Å; V242-L247 HydrophobicContact CG1-CG 4.06Å; V242-V278 HydrophobicContact CG1-CB 4.37Å; V242-V278 HydrophobicContact CG2-CB 4.31Å; V242-V278 HydrophobicContact CG2-CG2 4.25Å; V242-V394 HydrophobicContact CG2-CB 4.27Å; V242-V394 HydrophobicContact CG2-CG1 4.42Å; V242-T395 PolarHBondContact N-O 3.32Å; V242-V397 PolarHBondContact O-N 2.81Å
243	S	98.1	Very high	96.6	Very high	9 Å²	9	35.2 Å²	35.2	6%	0.063	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	142.3	175.9	134.7	0	0	0	0	111.6	N245 V246 L247 V278 V397 D399	S243-N245 VanDerWaalsContact C-N 3.27Å; S243-N245 PolarHBondContact O-N 2.9Å; S243-N245 PolarHBondContact OG-N 3.49Å; S243-V246 VanDerWaalsContact O-CB 3.28Å; S243-V246 WeakPolarHBondContact O-CB 2.92Å; S243-V246 PolarHBondContact O-N 3.3Å; S243-L247 PolarHBondContact O-N 2.98Å; S243-V278 PolarHBondContact N-O 3.45Å; S243-V397 CarbonylContact C-O 3.6Å; S243-V397 WeakPolarHBondContact CA-O 3.37Å; S243-D399 VanDerWaalsContact CB-OD2 3.31Å; S243-D399 WeakPolarHBondContact CB-OD2 3.25Å; S243-D399 PolarHBondContact OG-OD2 2.93Å
244	S	97.3	Very high	96.9	Very high	10 Å²	10	27.7 Å²	27.7	7%	0.07	13%	0.134	C	C	.	.	H	α-helix	trans	-65.2	-31.5	179.2	66.9	0	0	0	0	112.5	V246 L247 L248 V397 D399 H447	S244-V246 PolarHBondContact O-N 3.01Å; S244-L247 PolarHBondContact O-N 2.74Å; S244-L248 WeakPolarHBondContact O-CB 3.46Å; S244-L248 PolarHBondContact O-N 2.67Å; S244-V397 PolarHBondContact N-O 3.07Å; S244-D399 PolarHBondContact N-OD2 3.09Å; S244-D399 PolarHBondContact OG-N 3.39Å; S244-D399 PolarHBondContact OG-OD2 3.47Å; S244-H447 WeakPolarHBondContact CB-O 3.33Å
245	N	97.4	Very high	97.2	Very high	6 Å²	6	21.4 Å²	21.4	3%	0.032	11%	0.11	C	C	.	.	H	α-helix	trans	-59.4	-29.9	169.6	-82.2	-42.1	0	0	0	113.2	S243 L249 D399 F401 L402 V406	S243-N245 VanDerWaalsContact C-N 3.27Å; S243-N245 PolarHBondContact O-N 2.9Å; S243-N245 PolarHBondContact OG-N 3.49Å; N245-L249 PolarHBondContact O-N 3.28Å; N245-D399 WeakPolarHBondContact CB-OD2 3.47Å; N245-D399 PolarHBondContact N-OD2 2.84Å; N245-D399 WeakPolarHBondContact ND2-CB 3.28Å; N245-D399 PolarHBondContact ND2-OD1 3.12Å; N245-D399 VanDerWaalsContact ND2-OD1 3.13Å; N245-D399 PolarHBondContact ND2-OD2 2.9Å; N245-F401 PolarHBondContact ND2-O 3.29Å; N245-L402 WeakPolarHBondContact OD1-CD1 3.43Å; N245-V406 HydrophobicContact CB-CG2 4.28Å
246	V	98.4	Very high	97.5	Very high	2 Å²	2	12.3 Å²	12.3	1%	0.012	7%	0.07	C	C	.	.	H	α-helix	trans	-69.9	-48.7	174	-177.4	0	0	0	0	110.4	V242 S243 S244 L248 L249 M250 L265 V278 L279 A281	V242-V246 HydrophobicContact CG1-CB 4.08Å; V242-V246 HydrophobicContact CG1-CG1 4.21Å; S243-V246 VanDerWaalsContact O-CB 3.28Å; S243-V246 WeakPolarHBondContact O-CB 2.92Å; S243-V246 PolarHBondContact O-N 3.3Å; S244-V246 PolarHBondContact O-N 3.01Å; V246-L248 PolarHBondContact O-N 3.08Å; V246-L249 PolarHBondContact O-N 3.34Å; V246-M250 WeakPolarHBondContact O-CB 3.43Å; V246-M250 PolarHBondContact O-N 3.04Å; V246-L265 HydrophobicContact CG1-CD2 4.11Å; V246-V278 HydrophobicContact CG1-CG1 3.94Å; V246-V278 HydrophobicContact CG2-CG1 4.34Å; V246-L279 VanDerWaalsContact CG2-C 3.41Å; V246-A281 HydrophobicContact CG1-CB 4Å
247	L	98.2	Very high	97.5	Very high	8 Å²	8	10.2 Å²	10.2	4%	0.042	6%	0.061	C	C	.	.	H	α-helix	trans	-61.8	-43.8	179.7	-60.1	176.9	0	0	0	111.5	V242 S243 S244 M250 D251 I370 Y396 H447	V242-L247 HydrophobicContact CG1-CD2 3.85Å; V242-L247 HydrophobicContact CG1-CG 4.06Å; S243-L247 PolarHBondContact O-N 2.98Å; S244-L247 PolarHBondContact O-N 2.74Å; L247-M250 HydrophobicContact CD2-CE 3.89Å; L247-M250 PolarHBondContact O-N 3.45Å; L247-D251 VanDerWaalsContact O-CB 3.24Å; L247-D251 WeakPolarHBondContact O-CB 3.49Å; L247-D251 PolarHBondContact O-N 3.09Å; L247-I370 HydrophobicContact CD2-CD1 4.39Å; L247-I370 HydrophobicContact CD2-CG2 4.43Å; L247-Y396 HydrophobicContact CD1-CD1 3.62Å; L247-Y396 HydrophobicContact CD1-CE1 3.76Å; L247-Y396 HydrophobicContact CD1-CG 4.49Å; L247-Y396 HydrophobicContact CD2-CE1 4.37Å; L247-H447 HydrophobicContact CB-CB 4.12Å
248	L	98.1	Very high	97.7	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-59.3	-48.5	179.1	-173	156.5	0	0	0	111.7	S244 V246 F252 L402 V406 M410 L444 H447 L458	S244-L248 WeakPolarHBondContact O-CB 3.46Å; S244-L248 PolarHBondContact O-N 2.67Å; V246-L248 PolarHBondContact O-N 3.08Å; L248-F252 WeakPolarHBondContact O-CB 3.5Å; L248-F252 PolarHBondContact O-N 3.36Å; L248-L402 HydrophobicContact CD1-CD1 4.21Å; L248-L402 HydrophobicContact CD2-CD1 4.13Å; L248-V406 HydrophobicContact CD2-CG1 4.21Å; L248-M410 HydrophobicContact CD2-CE 4.04Å; L248-M410 HydrophobicContact CD2-SD 3.65Å; L248-L444 HydrophobicContact CG-CD2 4.39Å; L248-L444 WeakPolarHBondContact O-CD2 3.48Å; L248-H447 HydrophobicContact CB-CB 3.88Å; L248-L458 HydrophobicContact CD1-CD1 4.42Å; L248-L458 HydrophobicContact CD2-CD2 4.35Å
249	L	98.6	Very high	97.7	Very high	3 Å²	3	12.2 Å²	12.2	2%	0.016	7%	0.074	C	C	.	.	H	α-helix	trans	-68.9	-38.7	178.9	-177.7	57.7	0	0	0	112.4	N245 V246 H253 A281 P283 V406 E409 M410 L413	N245-L249 PolarHBondContact O-N 3.28Å; V246-L249 PolarHBondContact O-N 3.34Å; L249-H253 WeakPolarHBondContact O-CB 3.47Å; L249-H253 PolarHBondContact O-N 3.11Å; L249-A281 HydrophobicContact CB-CB 4.5Å; L249-A281 HydrophobicContact CD2-CB 4.27Å; L249-A281 HydrophobicContact CG-CB 4.44Å; L249-P283 HydrophobicContact CD1-CG 4.19Å; L249-P283 HydrophobicContact CD2-CG 4.17Å; L249-P283 HydrophobicContact CG-CG 4.02Å; L249-V406 HydrophobicContact CB-CG1 4.12Å; L249-V406 HydrophobicContact CD2-CG2 4.49Å; L249-E409 HydrophobicContact CD1-CB 3.85Å; L249-E409 HydrophobicContact CD2-CB 3.75Å; L249-E409 HydrophobicContact CD2-CG 4.15Å; L249-E409 HydrophobicContact CG-CB 4.48Å; L249-M410 HydrophobicContact CD1-CG 3.74Å; L249-L413 HydrophobicContact CD1-CD1 4.14Å
250	M	98.4	Very high	97.6	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-65.5	-50.4	178.6	-178.7	-178.1	74.2	0	0	111.4	V246 L247 H253 C254 Y316 I354 I370	V246-M250 WeakPolarHBondContact O-CB 3.43Å; V246-M250 PolarHBondContact O-N 3.04Å; L247-M250 HydrophobicContact CD2-CE 3.89Å; L247-M250 PolarHBondContact O-N 3.45Å; M250-H253 PolarHBondContact O-N 2.59Å; M250-C254 PolarHBondContact O-N 2.92Å; M250-C254 VanDerWaalsContact O-N 3.08Å; M250-C254 PolarHBondContact O-SG 2.96Å; M250-Y316 HydrophobicContact CB-CE2 4.45Å; M250-Y316 HydrophobicContact CG-CD1 4.07Å; M250-Y316 HydrophobicContact CG-CD2 3.54Å; M250-Y316 HydrophobicContact CG-CE1 4.15Å; M250-Y316 HydrophobicContact CG-CE2 3.64Å; M250-Y316 HydrophobicContact CG-CG 3.75Å; M250-Y316 HydrophobicContact SD-CD1 4.27Å; M250-Y316 HydrophobicContact SD-CD2 4.19Å; M250-Y316 HydrophobicContact SD-CG 3.88Å; M250-I354 HydrophobicContact CE-CG2 3.86Å; M250-I354 HydrophobicContact SD-CB 4.27Å; M250-I354 HydrophobicContact SD-CD1 4.21Å; M250-I354 HydrophobicContact SD-CG2 3.87Å; M250-I370 HydrophobicContact CE-CB 4.48Å; M250-I370 HydrophobicContact CE-CD1 3.81Å; M250-I370 HydrophobicContact CE-CG1 4.14Å; M250-I370 HydrophobicContact CE-CG2 3.52Å
251	D	98.4	Very high	97.5	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-67.2	-36.8	179.3	-172.8	40.1	0	0	0	111.6	L247 C254 H255 S368 I370 S443 L444	L247-D251 VanDerWaalsContact O-CB 3.24Å; L247-D251 WeakPolarHBondContact O-CB 3.49Å; L247-D251 PolarHBondContact O-N 3.09Å; D251-C254 PolarHBondContact O-N 3.21Å; D251-H255 PolarHBondContact O-N 3.19Å; D251-H255 VanDerWaalsContact O-N 3.13Å; D251-H255 PolarHBondContact O-ND1 3.42Å; D251-H255 IonicContact OD1-CE1 3.74Å; D251-H255 PolarHBondContact OD1-CE1 3.41Å; D251-H255 IonicContact OD1-ND1 3.08Å; D251-H255 PolarHBondContact OD1-ND1 3.4Å; D251-H255 IonicContact OD2-CE1 3.14Å; D251-H255 PolarHBondContact OD2-CE1 3.13Å; D251-H255 IonicContact OD2-ND1 2.7Å; D251-S368 WeakPolarHBondContact OD1-CB 3.47Å; D251-S368 PolarHBondContact OD1-OG 3.02Å; D251-I370 HydrophobicContact CB-CD1 4.35Å; D251-S443 WeakPolarHBondContact OD2-CB 3.15Å; D251-S443 PolarHBondContact OD2-OG 2.96Å; D251-L444 HydrophobicContact CB-CD2 3.81Å
252	F	98.6	Very high	97.4	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-58.6	-51.4	172.8	176	-100.8	0	0	0	110.7	L248 C254 H255 L256 M410 L413 V414 I440 L444 V461 L465	L248-F252 WeakPolarHBondContact O-CB 3.5Å; L248-F252 PolarHBondContact O-N 3.36Å; F252-C254 VanDerWaalsContact C-N 3.3Å; F252-C254 PolarHBondContact O-N 3.33Å; F252-H255 PolarHBondContact O-N 3.31Å; F252-H255 VanDerWaalsContact O-N 3.11Å; F252-L256 HydrophobicContact CD1-CD1 4.32Å; F252-L256 HydrophobicContact CE1-CD1 3.83Å; F252-L256 HydrophobicContact CE1-CD2 4.17Å; F252-L256 HydrophobicContact CE1-CG 4.36Å; F252-L256 HydrophobicContact CE2-CD2 4.1Å; F252-L256 HydrophobicContact CZ-CD1 4.29Å; F252-L256 HydrophobicContact CZ-CD2 3.9Å; F252-L256 WeakPolarHBondContact O-CG 3.36Å; F252-M410 HydrophobicContact CB-CE 4.12Å; F252-M410 HydrophobicContact CD1-CB 4.12Å; F252-M410 HydrophobicContact CD1-CE 3.96Å; F252-M410 HydrophobicContact CD1-CG 3.8Å; F252-M410 HydrophobicContact CD2-CE 3.36Å; F252-M410 HydrophobicContact CE1-CB 3.75Å; F252-M410 HydrophobicContact CE1-CE 4.18Å; F252-M410 HydrophobicContact CE1-CG 3.97Å; F252-M410 HydrophobicContact CE2-CE 3.62Å; F252-M410 HydrophobicContact CG-CE 3.54Å; F252-M410 HydrophobicContact CG-CG 4.27Å; F252-M410 HydrophobicContact CZ-CB 4.2Å; F252-M410 HydrophobicContact CZ-CE 4.03Å; F252-L413 HydrophobicContact CD1-CD1 4.05Å; F252-L413 HydrophobicContact CE1-CB 4.1Å; F252-L413 HydrophobicContact CE1-CD1 4.26Å; F252-V414 HydrophobicContact CZ-CG2 3.9Å; F252-I440 HydrophobicContact CD2-CD1 3.77Å; F252-I440 HydrophobicContact CE2-CD1 4.15Å; F252-L444 HydrophobicContact CB-CD1 4Å; F252-L444 HydrophobicContact CB-CD2 4.14Å; F252-L444 HydrophobicContact CD2-CD1 3.82Å; F252-L444 HydrophobicContact CG-CD1 4.41Å; F252-V461 HydrophobicContact CE2-CG1 3.61Å; F252-V461 HydrophobicContact CZ-CG1 3.52Å; F252-L465 HydrophobicContact CE2-CD1 3.78Å; F252-L465 HydrophobicContact CZ-CD1 4.18Å
253	H	98.4	Very high	97.4	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-56	-44	177.6	-174.9	-153.8	0	0	0	112.2	L249 M250 H255 L256 V262 Y316 L413 Y417	L249-H253 WeakPolarHBondContact O-CB 3.47Å; L249-H253 PolarHBondContact O-N 3.11Å; M250-H253 PolarHBondContact O-N 2.59Å; H253-H255 VanDerWaalsContact C-N 3.28Å; H253-H255 PolarHBondContact O-N 2.82Å; H253-L256 PolarHBondContact O-N 3.09Å; H253-V262 PolarHBondContact CE1-O 3.34Å; H253-Y316 AromaticContact ND1-CE2 3.83Å; H253-Y316 AromaticContact ND1-CZ 3.74Å; H253-Y316 PolarHBondContact ND1-OH 3.26Å; H253-L413 HydrophobicContact CB-CD1 3.78Å; H253-L413 VanDerWaalsContact CD2-CD2 3.5Å; H253-L413 WeakPolarHBondContact CD2-CD2 3.49Å; H253-Y417 AromaticContact CD2-CE2 3.78Å; H253-Y417 AromaticContact NE2-CE2 3.73Å; H253-Y417 PolarHBondContact NE2-OH 3.1Å
254	C	98.2	Very high	97.4	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-65.3	-26.6	180	-62	0	0	0	0	113.8	M250 D251 F252 C356 P358	M250-C254 PolarHBondContact O-N 2.92Å; M250-C254 VanDerWaalsContact O-N 3.08Å; M250-C254 PolarHBondContact O-SG 2.96Å; D251-C254 PolarHBondContact O-N 3.21Å; F252-C254 VanDerWaalsContact C-N 3.3Å; F252-C254 PolarHBondContact O-N 3.33Å; C254-C356 HydrophobicContact CB-CB 4.09Å; C254-C356 VanDerWaalsContact SG-CB 3.53Å; C254-P358 HydrophobicContact CB-CG 4.19Å
255	H	98.1	Very high	97.5	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-82.2	-9.7	176.4	-77.4	90.3	0	0	0	114.1	D251 F252 H253 Y359 S368 V424 K439 I440	D251-H255 PolarHBondContact O-N 3.19Å; D251-H255 VanDerWaalsContact O-N 3.13Å; D251-H255 PolarHBondContact O-ND1 3.42Å; D251-H255 IonicContact OD1-CE1 3.74Å; D251-H255 PolarHBondContact OD1-CE1 3.41Å; D251-H255 IonicContact OD1-ND1 3.08Å; D251-H255 PolarHBondContact OD1-ND1 3.4Å; D251-H255 IonicContact OD2-CE1 3.14Å; D251-H255 PolarHBondContact OD2-CE1 3.13Å; D251-H255 IonicContact OD2-ND1 2.7Å; F252-H255 PolarHBondContact O-N 3.31Å; F252-H255 VanDerWaalsContact O-N 3.11Å; H253-H255 VanDerWaalsContact C-N 3.28Å; H253-H255 PolarHBondContact O-N 2.82Å; H255-Y359 HydrophobicContact CB-CE2 4.5Å; H255-Y359 AromaticContact CD2-CE1 3.73Å; H255-Y359 AromaticContact CD2-CZ 3.47Å; H255-Y359 VanDerWaalsContact CD2-CZ 3.47Å; H255-Y359 PolarHBondContact CD2-OH 2.66Å; H255-Y359 PolarHBondContact O-OH 3.33Å; H255-S368 PolarHBondContact CE1-OG 2.94Å; H255-V424 VanDerWaalsContact O-CG2 3.3Å; H255-V424 WeakPolarHBondContact O-CG2 3.33Å; H255-K439 PolarHBondContact NE2-NZ 3.15Å; H255-I440 HydrophobicContact CB-CB 4.12Å; H255-I440 HydrophobicContact CB-CD1 3.54Å; H255-I440 HydrophobicContact CB-CG1 3.74Å
256	L	97.4	Very high	97.5	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	7%	0.067	C	C	.	.	S	Bend	trans	-78.2	-27.6	-172.3	-61.3	-171.1	0	0	0	114.6	F252 H253 L413 Y417 L423 V424 F426 L465	F252-L256 HydrophobicContact CD1-CD1 4.32Å; F252-L256 HydrophobicContact CE1-CD1 3.83Å; F252-L256 HydrophobicContact CE1-CD2 4.17Å; F252-L256 HydrophobicContact CE1-CG 4.36Å; F252-L256 HydrophobicContact CE2-CD2 4.1Å; F252-L256 HydrophobicContact CZ-CD1 4.29Å; F252-L256 HydrophobicContact CZ-CD2 3.9Å; F252-L256 WeakPolarHBondContact O-CG 3.36Å; H253-L256 PolarHBondContact O-N 3.09Å; L256-L413 HydrophobicContact CD1-CB 3.67Å; L256-L413 HydrophobicContact CD1-CD1 4.45Å; L256-Y417 HydrophobicContact CB-CD2 3.86Å; L256-Y417 HydrophobicContact CB-CE2 4.29Å; L256-Y417 HydrophobicContact CB-CG 4.09Å; L256-Y417 HydrophobicContact CD1-CD2 3.61Å; L256-Y417 HydrophobicContact CD1-CE2 4.24Å; L256-Y417 HydrophobicContact CD1-CG 4.38Å; L256-Y417 HydrophobicContact CG-CD2 4.4Å; L256-L423 WeakPolarHBondContact O-CD1 3.29Å; L256-V424 PolarHBondContact O-N 2.76Å; L256-F426 HydrophobicContact CD2-CZ 4.08Å; L256-L465 HydrophobicContact CD2-CD1 3.99Å; L256-L465 HydrophobicContact CD2-CD2 3.84Å
257	T	95.8	Very high	97.5	Very high	1 Å²	1	11.7 Å²	11.7	1%	0.006	7%	0.066	C	C	.	.	B	Isolated β-bridge	trans	-133.7	153.7	-176	174.9	0	0	0	0	112.2	S259 V261 Y417 D422	T257-S259 WeakPolarHBondContact OG1-CB 3.29Å; T257-S259 PolarHBondContact OG1-N 3.33Å; T257-V261 HydrophobicContact CG2-CG1 3.21Å; T257-Y417 HydrophobicContact CG2-CD1 4.34Å; T257-Y417 HydrophobicContact CG2-CE1 3.55Å; T257-D422 WeakPolarHBondContact CA-O 3.38Å; T257-D422 PolarHBondContact OG1-O 3.32Å; T257-D422 VanDerWaalsContact OG1-O 3.05Å; T257-D422 PolarHBondContact OG1-OD2 2.9Å
258	T	94.9	Very high	97.4	Very high	55 Å²	55	17.5 Å²	17.5	34%	0.337	9%	0.088	S	C	.	.	S	Bend	trans	-78.8	-8.6	171.3	56.9	0	0	0	0	113.1	D422 V424	T258-D422 PolarHBondContact N-O 3.4Å; T258-D422 PolarHBondContact OG1-O 3.02Å; T258-V424 HydrophobicContact CG2-CG2 3.98Å
259	S	94.7	Very high	97.2	Very high	48 Å²	48	19.4 Å²	19.4	34%	0.336	10%	0.095	S	C	.	.	S	Bend	trans	-86.7	158.7	171.5	-59.4	0	0	0	0	112.1	T257 P320 D422	T257-S259 WeakPolarHBondContact OG1-CB 3.29Å; T257-S259 PolarHBondContact OG1-N 3.33Å; S259-P320 WeakPolarHBondContact O-CG 3.3Å; S259-D422 WeakPolarHBondContact CB-OD2 3.41Å; S259-D422 PolarHBondContact OG-OD2 2.97Å
260	E	95.3	Very high	97	Very high	80 Å²	80	22 Å²	22	37%	0.374	11%	0.109	S	C	.	.			trans	-68.3	134.7	170.4	-59.1	-178.2	167.4	0	0	110.2	L288 S318 H319	E260-L288 HydrophobicContact CB-CD1 4.37Å; E260-S318 WeakPolarHBondContact CA-OG 3.05Å; E260-S318 WeakPolarHBondContact CB-O 3.47Å; E260-S318 WeakPolarHBondContact CG-O 3.19Å; E260-H319 IonicContact OE1-CD2 3.69Å
261	V	96.4	Very high	96.6	Very high	5 Å²	5	25.8 Å²	25.8	3%	0.03	13%	0.132	C	C	.	.			trans	-115.5	158.9	176.4	-52.4	0	0	0	0	110.6	T257 H317 S318 Y417	T257-V261 HydrophobicContact CG2-CG1 3.21Å; V261-H317 CarbonylContact O-C 3.59Å; V261-H317 WeakPolarHBondContact O-CA 3.36Å; V261-H317 VanDerWaalsContact O-CB 3.24Å; V261-H317 WeakPolarHBondContact O-CB 2.91Å; V261-S318 PolarHBondContact N-OG 2.85Å; V261-S318 PolarHBondContact O-N 3.24Å; V261-Y417 VanDerWaalsContact CG1-OH 3.31Å; V261-Y417 WeakPolarHBondContact CG1-OH 3.15Å
262	V	96.9	Very high	96.3	Very high	31 Å²	31	32.6 Å²	32.6	19%	0.188	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	161.5	175.4	-54.7	0	0	0	0	112.1	M4 H253 C284 L288 Y316 H317	M4-V262 HydrophobicContact CE-CG2 3.58Å; H253-V262 PolarHBondContact CE1-O 3.34Å; V262-C284 HydrophobicContact CG2-CB 3.85Å; V262-C284 WeakPolarHBondContact O-CB 3.42Å; V262-C284 PolarHBondContact O-N 2.92Å; V262-L288 HydrophobicContact CG1-CD2 4.19Å; V262-Y316 CarbonylContact C-O 3.54Å; V262-Y316 VanDerWaalsContact CA-O 3.32Å; V262-Y316 WeakPolarHBondContact CA-O 3.39Å; V262-H317 HydrophobicContact CG1-CB 3.92Å
263	G	97.7	Very high	96.1	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.8	169.9	170.4	0	0	0	0	0	113	F282 W315 Y316	G263-F282 CarbonylContact C-O 3.59Å; G263-F282 VanDerWaalsContact CA-O 3.22Å; G263-F282 WeakPolarHBondContact CA-O 3.5Å; G263-W315 CarbonylContact O-C 3.59Å; G263-W315 WeakPolarHBondContact O-CA 3.41Å; G263-Y316 VanDerWaalsContact CA-CE1 3.49Å; G263-Y316 PolarHBondContact N-O 2.96Å; G263-Y316 PolarHBondContact O-N 3.04Å
264	Y	98.3	Very high	95.8	Very high	14 Å²	14	39.6 Å²	39.6	6%	0.055	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	153.3	179.6	-61.3	-55.1	0	0	0	112.4	M1 F2 A281 F282 E298 I301 L312 W315	M1-Y264 HydrophobicContact CG-CE2 4.28Å; M1-Y264 HydrophobicContact SD-CD2 3.42Å; M1-Y264 WeakPolarHBondContact SD-CD2 3Å; M1-Y264 HydrophobicContact SD-CE2 3.6Å; M1-Y264 HydrophobicContact SD-CG 3.93Å; F2-Y264 HydrophobicContact CB-CE1 4.11Å; F2-Y264 AromaticContact CD2-CD1 3.98Å; F2-Y264 HydrophobicContact CD2-CD1 3.98Å; F2-Y264 AromaticContact CD2-CE1 3.71Å; F2-Y264 HydrophobicContact CD2-CE1 3.71Å; F2-Y264 HydrophobicContact CG-CE1 4.41Å; F2-Y264 PolarHBondContact O-OH 3.03Å; Y264-A281 CarbonylContact O-C 3.56Å; Y264-F282 PolarHBondContact N-O 3.2Å; Y264-F282 PolarHBondContact O-N 3.49Å; Y264-E298 HydrophobicContact CE2-CG 4.2Å; Y264-I301 HydrophobicContact CD2-CB 4.48Å; Y264-I301 HydrophobicContact CD2-CD1 3.84Å; Y264-I301 HydrophobicContact CD2-CG2 4.05Å; Y264-I301 HydrophobicContact CE2-CD1 4.36Å; Y264-L312 HydrophobicContact CD1-CD1 4.31Å; Y264-L312 HydrophobicContact CG-CD1 4.2Å; Y264-W315 HydrophobicContact CD1-CB 4.11Å
265	L	98.6	Very high	95.8	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	123.1	179.2	-58.9	176.8	0	0	0	109.5	V246 V278 A281 V313 G314 Y316 I354	V246-L265 HydrophobicContact CG1-CD2 4.11Å; L265-V278 HydrophobicContact CB-CG1 3.95Å; L265-V278 HydrophobicContact CD1-CG1 4.48Å; L265-V278 HydrophobicContact CD2-CG1 4.24Å; L265-V278 HydrophobicContact CG-CG1 4.45Å; L265-A281 HydrophobicContact CD2-CB 4.4Å; L265-V313 HydrophobicContact CB-CG2 4.13Å; L265-V313 VanDerWaalsContact O-CG2 3.25Å; L265-V313 WeakPolarHBondContact O-CG2 3.32Å; L265-V313 PolarHBondContact O-N 3.02Å; L265-G314 PolarHBondContact N-O 2.96Å; L265-G314 PolarHBondContact O-N 2.86Å; L265-Y316 HydrophobicContact CD2-CD1 3.85Å; L265-Y316 HydrophobicContact CD2-CE1 4.5Å; L265-Y316 HydrophobicContact CG-CD1 4.42Å; L265-I354 HydrophobicContact CD1-CD1 3.62Å; L265-I354 HydrophobicContact CD1-CG1 3.92Å
266	G	98.2	Very high	95.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	140.6	177.3	0	0	0	0	0	112.1	L279 R280 S311	G266-L279 PolarHBondContact O-N 3.32Å; G266-R280 PolarHBondContact N-O 3.07Å; G266-R280 PolarHBondContact O-N 3.01Å; G266-S311 WeakPolarHBondContact CA-O 3.23Å
267	G	97.6	Very high	95.8	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.4	-158	-170.9	0	0	0	0	0	114.6	T277 S311	G267-T277 CarbonylContact C-O 3.49Å; G267-T277 WeakPolarHBondContact CA-O 3.22Å; G267-S311 PolarHBondContact N-O 2.9Å; G267-S311 PolarHBondContact O-N 2.9Å
268	R	96.2	Very high	95.9	Very high	129 Å²	129	44 Å²	44	49%	0.487	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	146.7	175	-61.2	-171.5	-176.6	-63.4	-13.8	109.9	T277 L279 G309	R268-T277 PolarHBondContact N-O 3.33Å; R268-T277 PolarHBondContact O-N 3.38Å; R268-L279 HydrophobicContact CG-CD1 4Å; R268-G309 VanDerWaalsContact CZ-O 3.27Å; R268-G309 PolarHBondContact NH1-O 2.97Å; R268-G309 PolarHBondContact NH2-O 3.01Å
269	W	94.8	Very high	96.1	Very high	41 Å²	41	44.2 Å²	44.2	16%	0.155	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	124.6	171	170.8	-124.4	0	0	0	108.2	F238 Q274 L275 L276 F348 Q349 P350	F238-W269 HydrophobicContact CB-CH2 3.73Å; F238-W269 HydrophobicContact CB-CZ3 3.79Å; W269-Q274 VanDerWaalsContact CH2-C 3.49Å; W269-Q274 VanDerWaalsContact CH2-CA 3.48Å; W269-Q274 HydrophobicContact CH2-CB 3.96Å; W269-Q274 VanDerWaalsContact CH2-OE1 3.3Å; W269-Q274 WeakPolarHBondContact CZ3-O 3.31Å; W269-L275 VanDerWaalsContact CE3-C 3.43Å; W269-L275 VanDerWaalsContact CE3-O 3.32Å; W269-L276 HydrophobicContact CB-CD1 4.11Å; W269-L276 HydrophobicContact CE3-CB 4Å; W269-L276 HydrophobicContact CE3-CD1 4.1Å; W269-L276 HydrophobicContact CZ3-CB 4.27Å; W269-F348 HydrophobicContact CH2-CD1 4.17Å; W269-F348 HydrophobicContact CH2-CE1 4.22Å; W269-F348 AromaticContact CZ2-CD1 3.74Å; W269-F348 HydrophobicContact CZ2-CD1 3.74Å; W269-F348 HydrophobicContact CZ2-CE1 4.22Å; W269-F348 PolarHBondContact NE1-O 2.99Å; W269-Q349 HydrophobicContact CB-CG 4.43Å; W269-Q349 HydrophobicContact CG-CG 4.26Å; W269-P350 VanDerWaalsContact CD2-CD 3.43Å; W269-P350 HydrophobicContact CD2-CG 4.02Å; W269-P350 HydrophobicContact CE3-CG 3.6Å; W269-P350 HydrophobicContact CH2-CG 4.08Å; W269-P350 HydrophobicContact CZ2-CG 4.47Å; W269-P350 HydrophobicContact CZ3-CG 3.63Å
270	D	93.3	Very high	96.2	Very high	57 Å²	57	44.5 Å²	44.5	31%	0.305	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	111.2	173.5	177.5	10	0	0	0	109.9	N272 T273 Q274 L275	D270-N272 PolarHBondContact O-N 2.87Å; D270-N272 WeakPolarHBondContact OD1-CB 3.11Å; D270-N272 PolarHBondContact OD1-N 3.16Å; D270-N272 PolarHBondContact OD1-ND2 3.04Å; D270-T273 WeakPolarHBondContact CB-OG1 3.36Å; D270-T273 WeakPolarHBondContact OD2-CB 3.41Å; D270-T273 VanDerWaalsContact OD2-CG2 3.31Å; D270-T273 WeakPolarHBondContact OD2-CG2 3.44Å; D270-T273 PolarHBondContact OD2-OG1 2.81Å; D270-Q274 VanDerWaalsContact O-CA 3.24Å; D270-Q274 WeakPolarHBondContact O-CA 3.5Å; D270-Q274 PolarHBondContact O-N 3.42Å; D270-L275 PolarHBondContact N-O 2.67Å; D270-L275 PolarHBondContact O-N 3.47Å
271	T	90.9	Very high	96.3	Very high	79 Å²	79	40.9 Å²	40.9	49%	0.485	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-19.6	178.9	49	0	0	0	0	113.7	Q274	T271-Q274 PolarHBondContact O-NE2 3.3Å
272	N	91.4	Very high	96.4	Very high	144 Å²	144	41.2 Å²	41.2	77%	0.77	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-40.5	-177.3	-49.5	-72.7	0	0	0	111.3	D270	D270-N272 PolarHBondContact O-N 2.87Å; D270-N272 WeakPolarHBondContact OD1-CB 3.11Å; D270-N272 PolarHBondContact OD1-N 3.16Å; D270-N272 PolarHBondContact OD1-ND2 3.04Å
273	T	94.1	Very high	96.4	Very high	75 Å²	75	39.9 Å²	39.9	46%	0.46	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-4.3	177.2	58.6	0	0	0	0	113.5	D270 L275	D270-T273 WeakPolarHBondContact CB-OG1 3.36Å; D270-T273 WeakPolarHBondContact OD2-CB 3.41Å; D270-T273 VanDerWaalsContact OD2-CG2 3.31Å; D270-T273 WeakPolarHBondContact OD2-CG2 3.44Å; D270-T273 PolarHBondContact OD2-OG1 2.81Å; T273-L275 PolarHBondContact O-N 3.24Å; T273-L275 WeakPolarHBondContact OG1-CB 3.32Å
274	Q	93.8	Very high	96.3	Very high	71 Å²	71	40 Å²	40	33%	0.332	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.6	41.3	-171.8	-63.5	-70.3	-52	0	0	111.9	F238 N239 W269 D270 T271	F238-Q274 CarbonylContact C-O 3.56Å; F238-Q274 WeakPolarHBondContact CA-O 3.33Å; N239-Q274 PolarHBondContact N-O 3.18Å; W269-Q274 VanDerWaalsContact CH2-C 3.49Å; W269-Q274 VanDerWaalsContact CH2-CA 3.48Å; W269-Q274 HydrophobicContact CH2-CB 3.96Å; W269-Q274 VanDerWaalsContact CH2-OE1 3.3Å; W269-Q274 WeakPolarHBondContact CZ3-O 3.31Å; D270-Q274 VanDerWaalsContact O-CA 3.24Å; D270-Q274 WeakPolarHBondContact O-CA 3.5Å; D270-Q274 PolarHBondContact O-N 3.42Å; T271-Q274 PolarHBondContact O-NE2 3.3Å
275	L	96.4	Very high	96.1	Very high	54 Å²	54	41.4 Å²	41.4	28%	0.283	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	121.4	-175.2	179.9	61.6	0	0	0	112	N239 A241 W269 D270 T273	N239-L275 HydrophobicContact CB-CD1 3.69Å; A241-L275 HydrophobicContact CB-CD1 4.08Å; W269-L275 VanDerWaalsContact CE3-C 3.43Å; W269-L275 VanDerWaalsContact CE3-O 3.32Å; D270-L275 PolarHBondContact N-O 2.67Å; D270-L275 PolarHBondContact O-N 3.47Å; T273-L275 PolarHBondContact O-N 3.24Å; T273-L275 WeakPolarHBondContact OG1-CB 3.32Å
276	L	97.9	Very high	95.6	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	108.9	168.6	-168.3	66.5	0	0	0	109.5	F238 N239 V240 A241 W269 V313 P350 L352	F238-L276 HydrophobicContact CD2-CB 4.5Å; N239-L276 PolarHBondContact O-N 2.87Å; V240-L276 CarbonylContact C-O 3.48Å; V240-L276 WeakPolarHBondContact CA-O 3.19Å; V240-L276 HydrophobicContact CG2-CB 4.37Å; A241-L276 PolarHBondContact N-O 3.4Å; W269-L276 HydrophobicContact CB-CD1 4.11Å; W269-L276 HydrophobicContact CE3-CB 4Å; W269-L276 HydrophobicContact CE3-CD1 4.1Å; W269-L276 HydrophobicContact CZ3-CB 4.27Å; L276-V313 HydrophobicContact CD1-CB 3.72Å; L276-V313 HydrophobicContact CD1-CG1 3.59Å; L276-V313 HydrophobicContact CD2-CB 4.45Å; L276-V313 HydrophobicContact CG-CB 4.3Å; L276-P350 HydrophobicContact CB-CG 4.08Å; L276-P350 HydrophobicContact CD1-CG 3.84Å; L276-P350 HydrophobicContact CD2-CB 4.3Å; L276-P350 HydrophobicContact CD2-CG 3.94Å; L276-P350 HydrophobicContact CG-CG 4.16Å; L276-L352 HydrophobicContact CD2-CB 4.12Å
277	T	98.4	Very high	94.9	Very high	39 Å²	39	46.8 Å²	46.8	24%	0.239	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	110.1	176.8	-49.6	0	0	0	0	109.8	A241 G267 R268 L279	A241-T277 HydrophobicContact CB-CG2 4.34Å; A241-T277 CarbonylContact O-C 3.53Å; A241-T277 WeakPolarHBondContact O-CA 3.37Å; G267-T277 CarbonylContact C-O 3.49Å; G267-T277 WeakPolarHBondContact CA-O 3.22Å; R268-T277 PolarHBondContact N-O 3.33Å; R268-T277 PolarHBondContact O-N 3.38Å; T277-L279 HydrophobicContact CG2-CD2 3.63Å; T277-L279 HydrophobicContact CG2-CG 3.97Å
278	V	98.6	Very high	93.6	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	119.5	174.7	-169.5	0	0	0	0	108.9	A241 V242 S243 V246 L265 V313 L352	A241-V278 PolarHBondContact O-N 3.23Å; V242-V278 HydrophobicContact CG1-CB 4.37Å; V242-V278 HydrophobicContact CG2-CB 4.31Å; V242-V278 HydrophobicContact CG2-CG2 4.25Å; S243-V278 PolarHBondContact N-O 3.45Å; V246-V278 HydrophobicContact CG1-CG1 3.94Å; V246-V278 HydrophobicContact CG2-CG1 4.34Å; L265-V278 HydrophobicContact CB-CG1 3.95Å; L265-V278 HydrophobicContact CD1-CG1 4.48Å; L265-V278 HydrophobicContact CD2-CG1 4.24Å; L265-V278 HydrophobicContact CG-CG1 4.45Å; V278-V313 HydrophobicContact CG1-CG2 4.4Å; V278-V313 HydrophobicContact CG2-CG2 4.19Å; V278-L352 HydrophobicContact CG2-CD2 4.1Å
279	L	97.8	Very high	92.4	Very high	61 Å²	61	49.8 Å²	49.8	32%	0.319	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	-21.4	-167.7	-67	172.6	0	0	0	113.9	V246 G266 R268 T277 L310	V246-L279 VanDerWaalsContact CG2-C 3.41Å; G266-L279 PolarHBondContact O-N 3.32Å; R268-L279 HydrophobicContact CG-CD1 4Å; T277-L279 HydrophobicContact CG2-CD2 3.63Å; T277-L279 HydrophobicContact CG2-CG 3.97Å; L279-L310 HydrophobicContact CB-CD2 4.38Å; L279-L310 HydrophobicContact CD1-CD2 3.87Å
280	R	97.6	Very high	91.5	Very high	53 Å²	53	51.1 Å²	51.1	20%	0.2	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	142.2	178.4	-65.5	-63.1	-176	165.8	9.7	110.9	G266 F282 L310 T403 D405	G266-R280 PolarHBondContact N-O 3.07Å; G266-R280 PolarHBondContact O-N 3.01Å; R280-F282 HydrophobicContact CB-CD2 4.27Å; R280-F282 HydrophobicContact CB-CE2 3.55Å; R280-F282 HydrophobicContact CB-CZ 3.88Å; R280-F282 HydrophobicContact CG-CE2 4.42Å; R280-F282 HydrophobicContact CG-CZ 4.32Å; R280-L310 HydrophobicContact CB-CD1 4.19Å; R280-L310 HydrophobicContact CG-CD1 3.68Å; R280-T403 PolarHBondContact NH1-OG1 2.96Å; R280-D405 IonicContact CZ-OD2 3.51Å; R280-D405 IonicContact NH1-OD2 3.65Å; R280-D405 IonicContact NH2-OD2 2.72Å; R280-D405 PolarHBondContact NH2-OD2 3.02Å
281	A	98.2	Very high	90.4	Very high	5 Å²	5	54.6 Å²	54.6	4%	0.041	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	147.4	157.9	0	0	0	0	0	109.1	V246 L249 Y264 L265 Y316	V246-A281 HydrophobicContact CG1-CB 4Å; L249-A281 HydrophobicContact CB-CB 4.5Å; L249-A281 HydrophobicContact CD2-CB 4.27Å; L249-A281 HydrophobicContact CG-CB 4.44Å; Y264-A281 CarbonylContact O-C 3.56Å; L265-A281 HydrophobicContact CD2-CB 4.4Å; A281-Y316 HydrophobicContact CB-CE1 4.14Å
282	F	97.9	Very high	89.7	Confident	12 Å²	12	58 Å²	58	5%	0.053	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	92.8	173.8	-67.8	-83.1	0	0	0	108.5	G263 Y264 R280 C284 I301 N304 L305 L310	G263-F282 CarbonylContact C-O 3.59Å; G263-F282 VanDerWaalsContact CA-O 3.22Å; G263-F282 WeakPolarHBondContact CA-O 3.5Å; Y264-F282 PolarHBondContact N-O 3.2Å; Y264-F282 PolarHBondContact O-N 3.49Å; R280-F282 HydrophobicContact CB-CD2 4.27Å; R280-F282 HydrophobicContact CB-CE2 3.55Å; R280-F282 HydrophobicContact CB-CZ 3.88Å; R280-F282 HydrophobicContact CG-CE2 4.42Å; R280-F282 HydrophobicContact CG-CZ 4.32Å; F282-C284 PolarHBondContact O-N 3.28Å; F282-I301 HydrophobicContact CB-CD1 4.05Å; F282-I301 HydrophobicContact CB-CG1 4.1Å; F282-I301 HydrophobicContact CB-CG2 3.6Å; F282-I301 HydrophobicContact CD1-CG2 4.11Å; F282-I301 HydrophobicContact CD2-CG2 4.24Å; F282-I301 HydrophobicContact CG-CG2 3.72Å; F282-N304 HydrophobicContact CE1-CB 3.91Å; F282-L305 HydrophobicContact CD2-CD2 4.12Å; F282-L305 HydrophobicContact CE2-CD2 3.42Å; F282-L305 VanDerWaalsContact CE2-CD2 3.42Å; F282-L305 HydrophobicContact CE2-CG 4.12Å; F282-L305 HydrophobicContact CZ-CD2 3.98Å; F282-L305 HydrophobicContact CZ-CG 4.44Å; F282-L310 HydrophobicContact CZ-CD1 4.48Å
283	P	97.6	Very high	89.2	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.013	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	128.9	176.1	-24.1	35.3	0	0	0	112.1	L249 R285 L413	L249-P283 HydrophobicContact CD1-CG 4.19Å; L249-P283 HydrophobicContact CD2-CG 4.17Å; L249-P283 HydrophobicContact CG-CG 4.02Å; P283-R285 PolarHBondContact O-N 2.85Å; P283-L413 HydrophobicContact CB-CD1 3.93Å; P283-L413 HydrophobicContact CB-CD2 3.83Å; P283-L413 HydrophobicContact CB-CG 4.18Å; P283-L413 HydrophobicContact CG-CD1 3.79Å; P283-L413 HydrophobicContact CG-CG 4.39Å
284	C	95.6	Very high	88.7	Confident	4 Å²	4	49.5 Å²	49.5	3%	0.027	26%	0.256	C	S	.	.			trans	-80.8	102.6	174.9	-68.8	0	0	0	0	110.2	V262 F282 T286 V297	V262-C284 HydrophobicContact CG2-CB 3.85Å; V262-C284 WeakPolarHBondContact O-CB 3.42Å; V262-C284 PolarHBondContact O-N 2.92Å; F282-C284 PolarHBondContact O-N 3.28Å; C284-T286 HydrophobicContact CB-CG2 4.12Å; C284-T286 PolarHBondContact O-N 2.74Å; C284-V297 HydrophobicContact CB-CG1 4.17Å
285	R	92.6	Very high	88.4	Confident	43 Å²	43	50 Å²	50	16%	0.162	27%	0.268	C	S	.	.			trans	-71.3	59	173.8	-70.8	179.3	-81	-89	1.9	112.5	P283 E300 E409 L413 F416	P283-R285 PolarHBondContact O-N 2.85Å; R285-E300 IonicContact CZ-OE1 3.64Å; R285-E300 IonicContact NH2-OE1 2.66Å; R285-E300 PolarHBondContact NH2-OE1 3.15Å; R285-E409 IonicContact CZ-OE2 2.69Å; R285-E409 IonicContact NH1-OE2 2.63Å; R285-E409 PolarHBondContact NH1-OE2 2.79Å; R285-E409 IonicContact NH2-OE2 3.5Å; R285-L413 HydrophobicContact CG-CD2 4.33Å; R285-F416 VanDerWaalsContact C-CE2 3.49Å; R285-F416 HydrophobicContact CB-CD2 4Å; R285-F416 HydrophobicContact CB-CE2 4.1Å; R285-F416 HydrophobicContact CB-CG 4.25Å; R285-F416 HydrophobicContact CB-CZ 4.43Å; R285-F416 HydrophobicContact CG-CB 4.49Å; R285-F416 HydrophobicContact CG-CD2 4.46Å; R285-F416 HydrophobicContact CG-CG 4.28Å; R285-F416 VanDerWaalsContact O-CE2 3.28Å; R285-F416 WeakPolarHBondContact O-CE2 3.32Å
286	T	88.9	Confident	88	Confident	14 Å²	14	50.3 Å²	50.3	9%	0.086	28%	0.278	C	S	.	.	S	Bend	trans	-151.2	159.1	177.6	176	0	0	0	0	110.5	M4 C284 D290 S293 A294 V297	M4-T286 HydrophobicContact CE-CG2 3.67Å; C284-T286 HydrophobicContact CB-CG2 4.12Å; C284-T286 PolarHBondContact O-N 2.74Å; T286-D290 PolarHBondContact OG1-O 3.39Å; T286-S293 WeakPolarHBondContact CB-OG 3.45Å; T286-S293 PolarHBondContact OG1-OG 2.87Å; T286-A294 HydrophobicContact CG2-CB 4.45Å; T286-V297 HydrophobicContact CG2-CB 4.4Å; T286-V297 HydrophobicContact CG2-CG1 4.43Å; T286-V297 HydrophobicContact CG2-CG2 4.29Å
287	R	82.1	Confident	87.7	Confident	99 Å²	99	51 Å²	51	37%	0.374	28%	0.283	S	S	.	.			trans	-96.8	143.1	177.8	-67.7	177.6	172.2	-83.7	-5.9	109.2	A289 D290 D422	R287-A289 PolarHBondContact O-N 2.79Å; R287-D290 PolarHBondContact O-N 2.91Å; R287-D422 IonicContact CZ-OD1 2.99Å; R287-D422 VanDerWaalsContact CZ-OD1 3.26Å; R287-D422 VanDerWaalsContact NH1-CG 3.28Å; R287-D422 IonicContact NH1-OD1 2.69Å; R287-D422 PolarHBondContact NH1-OD1 2.92Å; R287-D422 IonicContact NH1-OD2 3.89Å; R287-D422 PolarHBondContact NH1-OD2 2.9Å; R287-D422 VanDerWaalsContact NH1-OD2 3.08Å; R287-D422 IonicContact NH2-OD1 3.28Å; R287-D422 PolarHBondContact NH2-OD1 2.84Å
288	L	72.3	Confident	87.4	Confident	96 Å²	96	50.3 Å²	50.3	50%	0.503	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-18.3	-177.9	-64.3	172	0	0	0	115.4	M4 E260 V262	M4-L288 HydrophobicContact CE-CD2 4.08Å; E260-L288 HydrophobicContact CB-CD1 4.37Å; V262-L288 HydrophobicContact CG1-CD2 4.19Å
289	A	70.5	Confident	87	Confident	96 Å²	96	57.2 Å²	57.2	79%	0.793	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-16.6	175.4	0	0	0	0	0	114.4	R287 R291	R287-A289 PolarHBondContact O-N 2.79Å; A289-R291 PolarHBondContact O-N 3.44Å
290	D	76.2	Confident	86.8	Confident	69 Å²	69	58.2 Å²	58.2	37%	0.369	31%	0.312	S	S	.	.			trans	-94.3	86.8	-175.4	-179.7	2	0	0	0	110.6	T286 R287 D292 S293 A294	T286-D290 PolarHBondContact OG1-O 3.39Å; R287-D290 PolarHBondContact O-N 2.91Å; D290-D292 VanDerWaalsContact C-N 3.31Å; D290-D292 PolarHBondContact O-N 3.22Å; D290-D292 PolarHBondContact OD1-N 3.11Å; D290-S293 PolarHBondContact OD1-N 3.43Å; D290-S293 VanDerWaalsContact OD1-N 3.07Å; D290-S293 PolarHBondContact OD1-OG 3.4Å; D290-S293 VanDerWaalsContact OD2-CB 3.23Å; D290-S293 WeakPolarHBondContact OD2-CB 3.46Å; D290-S293 PolarHBondContact OD2-OG 3.48Å; D290-A294 WeakPolarHBondContact O-CB 3.45Å; D290-A294 PolarHBondContact O-N 3.11Å
291	R	70.3	Confident	86.7	Confident	131 Å²	131	55.9 Å²	55.9	49%	0.494	30%	0.303	S	S	.	.	H	α-helix	trans	-75.3	-20.7	-175.4	-57.7	-168.9	65.9	174.1	1.1	113.5	M6 A289	M6-R291 PolarHBondContact SD-NH1 2.99Å; M6-R291 VanDerWaalsContact SD-NH1 3.42Å; M6-R291 PolarHBondContact SD-NH2 2.78Å; A289-R291 PolarHBondContact O-N 3.44Å
292	D	74.9	Confident	86.6	Confident	150 Å²	150	58.9 Å²	58.9	80%	0.802	32%	0.323	S	S	*	.	H	α-helix	trans	-83.4	-41.1	-175.9	-63.4	-35.7	0	0	0	110.3	D290	D290-D292 VanDerWaalsContact C-N 3.31Å; D290-D292 PolarHBondContact O-N 3.22Å; D290-D292 PolarHBondContact OD1-N 3.11Å
293	S	81.1	Confident	86.4	Confident	34 Å²	34	63.2 Å²	63.2	24%	0.238	34%	0.344	C	S	.	.	H	α-helix	trans	-71	-31	171.7	72.4	0	0	0	0	113.2	T286 D290 S295 A296 V297	T286-S293 WeakPolarHBondContact CB-OG 3.45Å; T286-S293 PolarHBondContact OG1-OG 2.87Å; D290-S293 PolarHBondContact OD1-N 3.43Å; D290-S293 VanDerWaalsContact OD1-N 3.07Å; D290-S293 PolarHBondContact OD1-OG 3.4Å; D290-S293 VanDerWaalsContact OD2-CB 3.23Å; D290-S293 WeakPolarHBondContact OD2-CB 3.46Å; D290-S293 PolarHBondContact OD2-OG 3.48Å; S293-S295 VanDerWaalsContact C-N 3.29Å; S293-S295 PolarHBondContact O-N 2.96Å; S293-A296 WeakPolarHBondContact O-CB 3.23Å; S293-A296 PolarHBondContact O-N 2.91Å; S293-V297 PolarHBondContact O-N 3.47Å
294	A	84.1	Confident	86.2	Confident	7 Å²	7	65 Å²	65	6%	0.058	35%	0.353	C	S	.	.	H	α-helix	trans	-54.5	-41.5	-179.4	0	0	0	0	0	113.2	M4 T286 D290 A296 V297 E298	M4-A294 HydrophobicContact SD-CB 3.73Å; T286-A294 HydrophobicContact CG2-CB 4.45Å; D290-A294 WeakPolarHBondContact O-CB 3.45Å; D290-A294 PolarHBondContact O-N 3.11Å; A294-A296 VanDerWaalsContact C-N 3.33Å; A294-A296 PolarHBondContact O-N 2.89Å; A294-V297 PolarHBondContact O-N 2.85Å; A294-E298 WeakPolarHBondContact O-CB 3.3Å; A294-E298 WeakPolarHBondContact O-CG 3.49Å; A294-E298 PolarHBondContact O-N 3.23Å
295	S	86.5	Confident	86.1	Confident	81 Å²	81	65.2 Å²	65.2	57%	0.566	35%	0.354	S	S	*	.	H	α-helix	trans	-66.8	-32.7	178	-170.5	0	0	0	0	113.1	S293 E299	S293-S295 VanDerWaalsContact C-N 3.29Å; S293-S295 PolarHBondContact O-N 2.96Å; S295-E299 PolarHBondContact O-N 3.05Å
296	A	89.6	Confident	86.2	Confident	61 Å²	61	68.6 Å²	68.6	50%	0.504	37%	0.37	S	S	.	.	H	α-helix	trans	-73.3	-40.9	177.1	0	0	0	0	0	111.3	S293 A294 E299 E300	S293-A296 WeakPolarHBondContact O-CB 3.23Å; S293-A296 PolarHBondContact O-N 2.91Å; A294-A296 VanDerWaalsContact C-N 3.33Å; A294-A296 PolarHBondContact O-N 2.89Å; A296-E299 PolarHBondContact O-N 3.38Å; A296-E300 PolarHBondContact O-N 3.39Å
297	V	91.4	Very high	86.4	Confident	15 Å²	15	74.3 Å²	74.3	9%	0.091	40%	0.397	C	S	.	.	H	α-helix	trans	-63.7	-40.4	173.8	175.5	0	0	0	0	111.2	C284 T286 S293 A294 E299 E300 I301	C284-V297 HydrophobicContact CB-CG1 4.17Å; T286-V297 HydrophobicContact CG2-CB 4.4Å; T286-V297 HydrophobicContact CG2-CG1 4.43Å; T286-V297 HydrophobicContact CG2-CG2 4.29Å; S293-V297 PolarHBondContact O-N 3.47Å; A294-V297 PolarHBondContact O-N 2.85Å; V297-E299 VanDerWaalsContact C-N 3.3Å; V297-E299 PolarHBondContact O-N 2.93Å; V297-E300 PolarHBondContact O-N 2.82Å; V297-I301 HydrophobicContact CG1-CD1 3.8Å; V297-I301 HydrophobicContact CG1-CG1 4.47Å; V297-I301 VanDerWaalsContact O-CG1 3.3Å; V297-I301 WeakPolarHBondContact O-CG1 3.4Å; V297-I301 PolarHBondContact O-N 2.84Å
298	E	91.2	Very high	86.8	Confident	24 Å²	24	73.8 Å²	73.8	11%	0.112	40%	0.395	C	S	.	.	H	α-helix	trans	-60.9	-35.4	172.5	-80.6	-170.6	-125.4	0	0	113	M1 F2 Y264 A294 C302	M1-E298 WeakPolarHBondContact CA-OE2 3.17Å; M1-E298 HydrophobicContact CB-CB 3.82Å; M1-E298 HydrophobicContact CB-CG 3.89Å; M1-E298 WeakPolarHBondContact CB-OE2 3.19Å; M1-E298 PolarHBondContact N-OE2 2.84Å; F2-E298 PolarHBondContact N-OE2 2.87Å; F2-E298 VanDerWaalsContact O-CD 3.28Å; Y264-E298 HydrophobicContact CE2-CG 4.2Å; A294-E298 WeakPolarHBondContact O-CB 3.3Å; A294-E298 WeakPolarHBondContact O-CG 3.49Å; A294-E298 PolarHBondContact O-N 3.23Å; E298-C302 VanDerWaalsContact O-CB 3.29Å; E298-C302 WeakPolarHBondContact O-CB 3.2Å; E298-C302 PolarHBondContact O-N 3.06Å; E298-C302 VanDerWaalsContact O-N 3.11Å
299	E	91.1	Very high	87.9	Confident	145 Å²	145	71.2 Å²	71.2	68%	0.678	39%	0.392	S	S	*	.	H	α-helix	trans	-76.1	-41.8	177.1	-172.7	161.1	-151.5	0	0	112.1	S295 A296 V297 I301 C302 Q303	S295-E299 PolarHBondContact O-N 3.05Å; A296-E299 PolarHBondContact O-N 3.38Å; V297-E299 VanDerWaalsContact C-N 3.3Å; V297-E299 PolarHBondContact O-N 2.93Å; E299-I301 PolarHBondContact O-N 3.08Å; E299-C302 WeakPolarHBondContact O-CB 3.13Å; E299-C302 PolarHBondContact O-N 3.41Å; E299-Q303 PolarHBondContact O-N 2.93Å
300	E	94.1	Very high	89.1	Confident	81 Å²	81	67.8 Å²	67.8	38%	0.379	36%	0.36	S	S	.	.	H	α-helix	trans	-55.8	-47.8	172.5	-175.1	-167.6	146.9	0	0	111.3	R285 A296 V297 Q303 N304	R285-E300 IonicContact CZ-OE1 3.64Å; R285-E300 IonicContact NH2-OE1 2.66Å; R285-E300 PolarHBondContact NH2-OE1 3.15Å; A296-E300 PolarHBondContact O-N 3.39Å; V297-E300 PolarHBondContact O-N 2.82Å; E300-Q303 PolarHBondContact O-N 3.06Å; E300-N304 WeakPolarHBondContact O-CB 3.42Å; E300-N304 PolarHBondContact O-N 2.84Å; E300-N304 PolarHBondContact O-ND2 3.21Å
301	I	95.2	Very high	90	Very high	5 Å²	5	67.1 Å²	67.1	3%	0.026	36%	0.361	C	S	.	.	H	α-helix	trans	-69.5	-36.1	179.8	-63.2	169.2	0	0	0	110.8	M1 Y264 F282 V297 E299 N304 L305	M1-I301 HydrophobicContact CE-CB 4.48Å; M1-I301 HydrophobicContact CE-CG2 4.11Å; M1-I301 HydrophobicContact SD-CB 4.37Å; M1-I301 HydrophobicContact SD-CG2 4.05Å; Y264-I301 HydrophobicContact CD2-CB 4.48Å; Y264-I301 HydrophobicContact CD2-CD1 3.84Å; Y264-I301 HydrophobicContact CD2-CG2 4.05Å; Y264-I301 HydrophobicContact CE2-CD1 4.36Å; F282-I301 HydrophobicContact CB-CD1 4.05Å; F282-I301 HydrophobicContact CB-CG1 4.1Å; F282-I301 HydrophobicContact CB-CG2 3.6Å; F282-I301 HydrophobicContact CD1-CG2 4.11Å; F282-I301 HydrophobicContact CD2-CG2 4.24Å; F282-I301 HydrophobicContact CG-CG2 3.72Å; V297-I301 HydrophobicContact CG1-CD1 3.8Å; V297-I301 HydrophobicContact CG1-CG1 4.47Å; V297-I301 VanDerWaalsContact O-CG1 3.3Å; V297-I301 WeakPolarHBondContact O-CG1 3.4Å; V297-I301 PolarHBondContact O-N 2.84Å; E299-I301 PolarHBondContact O-N 3.08Å; I301-N304 PolarHBondContact O-N 2.94Å; I301-L305 HydrophobicContact CG2-CD1 4.5Å; I301-L305 WeakPolarHBondContact O-CG 3.16Å; I301-L305 PolarHBondContact O-N 3.02Å
302	C	94.4	Very high	91.2	Very high	68 Å²	68	62.1 Å²	62.1	46%	0.459	34%	0.344	S	S	.	.	H	α-helix	trans	-59.7	-47.2	173.7	-164.7	0	0	0	0	111.8	M1 E298 E299 L305 F306	M1-C302 VanDerWaalsContact CE-CA 3.4Å; M1-C302 HydrophobicContact CE-CB 3.71Å; E298-C302 VanDerWaalsContact O-CB 3.29Å; E298-C302 WeakPolarHBondContact O-CB 3.2Å; E298-C302 PolarHBondContact O-N 3.06Å; E298-C302 VanDerWaalsContact O-N 3.11Å; E299-C302 WeakPolarHBondContact O-CB 3.13Å; E299-C302 PolarHBondContact O-N 3.41Å; C302-L305 PolarHBondContact O-N 2.94Å; C302-F306 PolarHBondContact O-N 2.94Å; C302-F306 VanDerWaalsContact O-N 3.09Å
303	Q	93.9	Very high	92.3	Very high	103 Å²	103	55 Å²	55	48%	0.481	31%	0.306	S	S	.	.	H	α-helix	trans	-65.8	-40	177	-173.4	60.6	24.2	0	0	111.5	E299 E300 L305 F306 M307	E299-Q303 PolarHBondContact O-N 2.93Å; E300-Q303 PolarHBondContact O-N 3.06Å; Q303-L305 PolarHBondContact O-N 2.98Å; Q303-F306 PolarHBondContact O-N 3Å; Q303-M307 HydrophobicContact CG-CG 4.25Å; Q303-M307 WeakPolarHBondContact O-CB 3.37Å; Q303-M307 VanDerWaalsContact O-CG 3.22Å; Q303-M307 WeakPolarHBondContact O-CG 3.3Å; Q303-M307 PolarHBondContact O-N 3.06Å
304	N	93.9	Very high	93.1	Very high	40 Å²	40	53.4 Å²	53.4	21%	0.214	30%	0.295	C	S	.	.	H	α-helix	trans	-65.7	-36.1	178	-87.7	-75.7	0	0	0	113.5	F282 E300 I301 R308	F282-N304 HydrophobicContact CE1-CB 3.91Å; E300-N304 WeakPolarHBondContact O-CB 3.42Å; E300-N304 PolarHBondContact O-N 2.84Å; E300-N304 PolarHBondContact O-ND2 3.21Å; I301-N304 PolarHBondContact O-N 2.94Å; N304-R308 WeakPolarHBondContact O-CG 3.12Å; N304-R308 PolarHBondContact O-N 3.19Å; N304-R308 PolarHBondContact OD1-NH1 3.27Å
305	L	94.9	Very high	93.8	Very high	8 Å²	8	54 Å²	54	4%	0.042	30%	0.295	C	S	.	.	H	α-helix	trans	-63.7	-49.6	170.6	-75.5	172.8	0	0	0	111.2	M1 F282 I301 C302 Q303 R308 G309 L310 L312	M1-L305 HydrophobicContact CE-CD1 3.63Å; F282-L305 HydrophobicContact CD2-CD2 4.12Å; F282-L305 HydrophobicContact CE2-CD2 3.42Å; F282-L305 VanDerWaalsContact CE2-CD2 3.42Å; F282-L305 HydrophobicContact CE2-CG 4.12Å; F282-L305 HydrophobicContact CZ-CD2 3.98Å; F282-L305 HydrophobicContact CZ-CG 4.44Å; I301-L305 HydrophobicContact CG2-CD1 4.5Å; I301-L305 WeakPolarHBondContact O-CG 3.16Å; I301-L305 PolarHBondContact O-N 3.02Å; C302-L305 PolarHBondContact O-N 2.94Å; Q303-L305 PolarHBondContact O-N 2.98Å; L305-R308 CarbonylContact O-C 3.57Å; L305-R308 PolarHBondContact O-N 3.23Å; L305-G309 PolarHBondContact O-N 2.99Å; L305-G309 VanDerWaalsContact O-N 3.08Å; L305-L310 HydrophobicContact CD2-CB 3.74Å; L305-L310 HydrophobicContact CD2-CD1 4.45Å; L305-L310 PolarHBondContact O-N 2.72Å; L305-L312 HydrophobicContact CD1-CB 3.95Å; L305-L312 HydrophobicContact CD1-CD1 4.27Å
306	F	92.9	Very high	94.3	Very high	114 Å²	114	50.1 Å²	50.1	50%	0.5	27%	0.268	S	S	.	.	H	α-helix	trans	-59	-49.6	179.8	177	-98.3	0	0	0	112	C302 Q303 R308 G309	C302-F306 PolarHBondContact O-N 2.94Å; C302-F306 VanDerWaalsContact O-N 3.09Å; Q303-F306 PolarHBondContact O-N 3Å; F306-R308 PolarHBondContact O-N 3.37Å; F306-G309 PolarHBondContact O-N 3.43Å
307	M	93	Very high	94.7	Very high	134 Å²	134	47.6 Å²	47.6	66%	0.66	25%	0.246	S	C	*	.	H	α-helix	trans	-62.1	-26.5	179.7	-70	-65.6	-67.9	0	0	113.5	Q303	Q303-M307 HydrophobicContact CG-CG 4.25Å; Q303-M307 WeakPolarHBondContact O-CB 3.37Å; Q303-M307 VanDerWaalsContact O-CG 3.22Å; Q303-M307 WeakPolarHBondContact O-CG 3.3Å; Q303-M307 PolarHBondContact O-N 3.06Å
308	R	92.2	Very high	95.1	Very high	87 Å²	87	46.9 Å²	46.9	33%	0.328	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	3.2	175.8	-67.8	-179.7	175.8	78.5	-8.3	113.3	N304 L305 F306 L310 D405	N304-R308 WeakPolarHBondContact O-CG 3.12Å; N304-R308 PolarHBondContact O-N 3.19Å; N304-R308 PolarHBondContact OD1-NH1 3.27Å; L305-R308 CarbonylContact O-C 3.57Å; L305-R308 PolarHBondContact O-N 3.23Å; F306-R308 PolarHBondContact O-N 3.37Å; R308-L310 HydrophobicContact CB-CD1 4.09Å; R308-L310 HydrophobicContact CB-CG 4.1Å; R308-L310 PolarHBondContact O-N 2.8Å; R308-D405 IonicContact CZ-OD1 2.7Å; R308-D405 IonicContact NE-OD1 2.71Å; R308-D405 PolarHBondContact NE-OD1 3.41Å; R308-D405 IonicContact NH2-OD1 3.4Å; R308-D405 PolarHBondContact NH2-OD1 3.03Å
309	G	94.6	Very high	95.3	Very high	43 Å²	43	46.1 Å²	46.1	44%	0.443	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	36.5	-177.9	0	0	0	0	0	112.9	R268 L305 F306	R268-G309 VanDerWaalsContact CZ-O 3.27Å; R268-G309 PolarHBondContact NH1-O 2.97Å; R268-G309 PolarHBondContact NH2-O 3.01Å; L305-G309 PolarHBondContact O-N 2.99Å; L305-G309 VanDerWaalsContact O-N 3.08Å; F306-G309 PolarHBondContact O-N 3.43Å
310	L	95.8	Very high	95.5	Very high	23 Å²	23	39.6 Å²	39.6	12%	0.12	21%	0.208	C	C	.	.			trans	-104.5	150.9	178.8	-66.3	176.2	0	0	0	110.8	L279 R280 F282 L305 R308	L279-L310 HydrophobicContact CB-CD2 4.38Å; L279-L310 HydrophobicContact CD1-CD2 3.87Å; R280-L310 HydrophobicContact CB-CD1 4.19Å; R280-L310 HydrophobicContact CG-CD1 3.68Å; F282-L310 HydrophobicContact CZ-CD1 4.48Å; L305-L310 HydrophobicContact CD2-CB 3.74Å; L305-L310 HydrophobicContact CD2-CD1 4.45Å; L305-L310 PolarHBondContact O-N 2.72Å; R308-L310 HydrophobicContact CB-CD1 4.09Å; R308-L310 HydrophobicContact CB-CG 4.1Å; R308-L310 PolarHBondContact O-N 2.8Å
311	S	94.7	Very high	95.5	Very high	55 Å²	55	42.2 Å²	42.2	39%	0.385	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	150.9	168.8	-61.5	0	0	0	0	110.5	G266 G267 V313	G266-S311 WeakPolarHBondContact CA-O 3.23Å; G267-S311 PolarHBondContact N-O 2.9Å; G267-S311 PolarHBondContact O-N 2.9Å; S311-V313 PolarHBondContact O-N 3.16Å
312	L	96.4	Very high	95.4	Very high	27 Å²	27	43 Å²	43	14%	0.141	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	119.8	163.2	-176.9	60.8	0	0	0	108.2	M1 F2 Y264 L305 L341 Q349	M1-L312 HydrophobicContact CE-CD2 4.36Å; M1-L312 HydrophobicContact CG-CD2 3.71Å; M1-L312 HydrophobicContact SD-CD1 4.36Å; M1-L312 HydrophobicContact SD-CD2 4.18Å; F2-L312 HydrophobicContact CD2-CD2 3.81Å; F2-L312 HydrophobicContact CE1-CD2 4.33Å; F2-L312 HydrophobicContact CE2-CD1 4.19Å; F2-L312 HydrophobicContact CE2-CD2 3.51Å; F2-L312 HydrophobicContact CE2-CG 3.86Å; F2-L312 HydrophobicContact CG-CD2 4.37Å; F2-L312 HydrophobicContact CZ-CD2 3.82Å; F2-L312 HydrophobicContact CZ-CG 4.25Å; Y264-L312 HydrophobicContact CD1-CD1 4.31Å; Y264-L312 HydrophobicContact CG-CD1 4.2Å; L305-L312 HydrophobicContact CD1-CB 3.95Å; L305-L312 HydrophobicContact CD1-CD1 4.27Å; L312-L341 HydrophobicContact CB-CD2 4.42Å; L312-L341 HydrophobicContact CG-CD2 4.49Å; L312-Q349 PolarHBondContact O-NE2 2.79Å; L312-Q349 VanDerWaalsContact O-NE2 3.11Å
313	V	97.2	Very high	95.5	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	-6.6	-174.1	-67.3	0	0	0	0	113.5	L265 L276 V278 S311 C351 L352	L265-V313 HydrophobicContact CB-CG2 4.13Å; L265-V313 VanDerWaalsContact O-CG2 3.25Å; L265-V313 WeakPolarHBondContact O-CG2 3.32Å; L265-V313 PolarHBondContact O-N 3.02Å; L276-V313 HydrophobicContact CD1-CB 3.72Å; L276-V313 HydrophobicContact CD1-CG1 3.59Å; L276-V313 HydrophobicContact CD2-CB 4.45Å; L276-V313 HydrophobicContact CG-CB 4.3Å; V278-V313 HydrophobicContact CG1-CG2 4.4Å; V278-V313 HydrophobicContact CG2-CG2 4.19Å; S311-V313 PolarHBondContact O-N 3.16Å; V313-C351 WeakPolarHBondContact O-CA 3.26Å; V313-L352 PolarHBondContact O-N 3.31Å
314	G	97.8	Very high	95.6	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.1	-169	-177.4	0	0	0	0	0	113.6	L265 L352	L265-G314 PolarHBondContact N-O 2.96Å; L265-G314 PolarHBondContact O-N 2.86Å; G314-L352 CarbonylContact C-O 3.54Å; G314-L352 WeakPolarHBondContact CA-O 3.37Å
315	W	98.4	Very high	95.8	Very high	19 Å²	19	35.6 Å²	35.6	7%	0.072	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	165.5	178.8	65.8	-70.9	0	0	0	109.9	G263 Y264 H317 D330 Q334 H337 L352 I354 F373	G263-W315 CarbonylContact O-C 3.59Å; G263-W315 WeakPolarHBondContact O-CA 3.41Å; Y264-W315 HydrophobicContact CD1-CB 4.11Å; W315-H317 AromaticContact CH2-ND1 3.71Å; W315-H317 HydrophobicContact CZ3-CB 4.15Å; W315-H317 AromaticContact CZ3-ND1 3.36Å; W315-H317 WeakPolarHBondContact CZ3-ND1 3.45Å; W315-D330 HydrophobicContact CH2-CB 4.4Å; W315-Q334 HydrophobicContact CZ2-CB 4.3Å; W315-H337 AromaticContact CD1-CD2 3.74Å; W315-H337 AromaticContact CD1-CG 3.98Å; W315-H337 AromaticContact CE2-CD2 3.69Å; W315-H337 AromaticContact CE2-NE2 3.91Å; W315-H337 AromaticContact NE1-CD2 3.39Å; W315-H337 PolarHBondContact NE1-CD2 3.43Å; W315-H337 AromaticContact NE1-CG 3.97Å; W315-H337 AromaticContact NE1-NE2 3.97Å; W315-L352 PolarHBondContact N-O 3.48Å; W315-I354 PolarHBondContact O-N 2.85Å; W315-I354 VanDerWaalsContact O-N 3.08Å; W315-F373 HydrophobicContact CZ2-CZ 4.03Å
316	Y	98.7	Very high	95.9	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	158.3	171	74.5	-90.3	0	0	0	112	M250 H253 V262 G263 L265 A281 I354	M250-Y316 HydrophobicContact CB-CE2 4.45Å; M250-Y316 HydrophobicContact CG-CD1 4.07Å; M250-Y316 HydrophobicContact CG-CD2 3.54Å; M250-Y316 HydrophobicContact CG-CE1 4.15Å; M250-Y316 HydrophobicContact CG-CE2 3.64Å; M250-Y316 HydrophobicContact CG-CG 3.75Å; M250-Y316 HydrophobicContact SD-CD1 4.27Å; M250-Y316 HydrophobicContact SD-CD2 4.19Å; M250-Y316 HydrophobicContact SD-CG 3.88Å; H253-Y316 AromaticContact ND1-CE2 3.83Å; H253-Y316 AromaticContact ND1-CZ 3.74Å; H253-Y316 PolarHBondContact ND1-OH 3.26Å; V262-Y316 CarbonylContact C-O 3.54Å; V262-Y316 VanDerWaalsContact CA-O 3.32Å; V262-Y316 WeakPolarHBondContact CA-O 3.39Å; G263-Y316 VanDerWaalsContact CA-CE1 3.49Å; G263-Y316 PolarHBondContact N-O 2.96Å; G263-Y316 PolarHBondContact O-N 3.04Å; L265-Y316 HydrophobicContact CD2-CD1 3.85Å; L265-Y316 HydrophobicContact CD2-CE1 4.5Å; L265-Y316 HydrophobicContact CG-CD1 4.42Å; A281-Y316 HydrophobicContact CB-CE1 4.14Å; Y316-I354 CarbonylContact C-O 3.55Å; Y316-I354 WeakPolarHBondContact CA-O 3.47Å; Y316-I354 WeakPolarHBondContact CB-O 3.34Å
317	H	98.1	Very high	96.1	Very high	8 Å²	8	30 Å²	30	4%	0.037	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	172.6	164.6	77.4	-73.6	0	0	0	112.6	V261 V262 W315 H319 D330 I354 I355 C356	V261-H317 CarbonylContact O-C 3.59Å; V261-H317 WeakPolarHBondContact O-CA 3.36Å; V261-H317 VanDerWaalsContact O-CB 3.24Å; V261-H317 WeakPolarHBondContact O-CB 2.91Å; V262-H317 HydrophobicContact CG1-CB 3.92Å; W315-H317 AromaticContact CH2-ND1 3.71Å; W315-H317 HydrophobicContact CZ3-CB 4.15Å; W315-H317 AromaticContact CZ3-ND1 3.36Å; W315-H317 WeakPolarHBondContact CZ3-ND1 3.45Å; H317-H319 AromaticContact CD2-CD2 3.77Å; H317-H319 AromaticContact CD2-NE2 3.8Å; H317-H319 AromaticContact NE2-CD2 3.46Å; H317-H319 PolarHBondContact NE2-CD2 3.15Å; H317-H319 AromaticContact NE2-CE1 3.82Å; H317-H319 AromaticContact NE2-NE2 3.03Å; H317-H319 PolarHBondContact NE2-NE2 2.97Å; H317-D330 VanDerWaalsContact CE1-CG 3.45Å; H317-D330 IonicContact CE1-OD1 3.6Å; H317-D330 PolarHBondContact CE1-OD1 3.37Å; H317-D330 IonicContact CE1-OD2 3.75Å; H317-D330 IonicContact NE2-OD1 3.12Å; H317-D330 PolarHBondContact NE2-OD1 2.87Å; H317-D330 IonicContact NE2-OD2 2.68Å; H317-I354 PolarHBondContact N-O 2.94Å; H317-I355 WeakPolarHBondContact O-CA 3.49Å; H317-C356 PolarHBondContact O-N 3.03Å
318	S	97.9	Very high	96.3	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	147.7	173.8	68.9	0	0	0	0	113	E260 V261 C356	E260-S318 WeakPolarHBondContact CA-OG 3.05Å; E260-S318 WeakPolarHBondContact CB-O 3.47Å; E260-S318 WeakPolarHBondContact CG-O 3.19Å; V261-S318 PolarHBondContact N-OG 2.85Å; V261-S318 PolarHBondContact O-N 3.24Å; S318-C356 CarbonylContact C-O 3.52Å; S318-C356 VanDerWaalsContact CA-O 3.23Å; S318-C356 WeakPolarHBondContact CA-O 3.22Å
319	H	96.8	Very high	96.4	Very high	8 Å²	8	23.1 Å²	23.1	4%	0.037	13%	0.13	C	C	.	.			trans	-113.6	83	158.1	-72.6	168.5	0	0	0	107.6	E260 H317 R321 G322 P323 L325 D330 I355 C356	E260-H319 IonicContact OE1-CD2 3.69Å; H317-H319 AromaticContact CD2-CD2 3.77Å; H317-H319 AromaticContact CD2-NE2 3.8Å; H317-H319 AromaticContact NE2-CD2 3.46Å; H317-H319 PolarHBondContact NE2-CD2 3.15Å; H317-H319 AromaticContact NE2-CE1 3.82Å; H317-H319 AromaticContact NE2-NE2 3.03Å; H317-H319 PolarHBondContact NE2-NE2 2.97Å; H319-R321 VanDerWaalsContact C-N 3.29Å; H319-R321 PolarHBondContact O-N 3.32Å; H319-G322 PolarHBondContact O-N 3.06Å; H319-P323 PolarHBondContact ND1-O 3.3Å; H319-P323 VanDerWaalsContact ND1-O 3.09Å; H319-L325 PolarHBondContact CE1-O 2.89Å; H319-L325 PolarHBondContact ND1-O 3.32Å; H319-D330 IonicContact NE2-OD2 3.59Å; H319-I355 HydrophobicContact CB-CG2 4.46Å; H319-C356 PolarHBondContact N-O 3.41Å
320	P	95.1	Very high	96.6	Very high	8 Å²	8	21.8 Å²	21.8	5%	0.052	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-41.7	-163.4	-31.3	34.5	0	0	0	115.6	S259 Y359	S259-P320 WeakPolarHBondContact O-CG 3.3Å; P320-Y359 WeakPolarHBondContact O-CA 3.48Å; P320-Y359 VanDerWaalsContact O-CB 3.26Å; P320-Y359 WeakPolarHBondContact O-CB 3.49Å; P320-Y359 PolarHBondContact O-N 3.46Å
321	R	93.8	Very high	96.7	Very high	136 Å²	136	20.7 Å²	20.7	51%	0.513	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.9	3.2	176.3	-59.7	-171.9	-177	102.2	4.7	114	H319 Y360	H319-R321 VanDerWaalsContact C-N 3.29Å; H319-R321 PolarHBondContact O-N 3.32Å; R321-Y360 WeakPolarHBondContact O-CD2 3.5Å
322	G	93.6	Very high	96.7	Very high	21 Å²	21	20.5 Å²	20.5	22%	0.216	10%	0.102	C	C	.	.	S	Bend	trans	-102.2	161.2	-176.8	0	0	0	0	0	112.3	H319 Y360	H319-G322 PolarHBondContact O-N 3.06Å; G322-Y360 WeakPolarHBondContact O-CB 3.47Å
323	P	95.4	Very high	96.7	Very high	15 Å²	15	20.9 Å²	20.9	10%	0.097	11%	0.107	C	C	.	.			trans	-61.9	142	172.3	26.6	-32.2	0	0	0	110.3	P205 L223 H319 L325 Y360	P205-P323 HydrophobicContact CG-CG 4.34Å; L223-P323 HydrophobicContact CD1-CG 3.69Å; H319-P323 PolarHBondContact ND1-O 3.3Å; H319-P323 VanDerWaalsContact ND1-O 3.09Å; P323-L325 HydrophobicContact CB-CD1 4.33Å; P323-L325 HydrophobicContact CB-CG 4.48Å; P323-L325 PolarHBondContact O-N 3.11Å; P323-Y360 HydrophobicContact CB-CD1 4.21Å; P323-Y360 HydrophobicContact CB-CE1 3.83Å; P323-Y360 HydrophobicContact CB-CE2 4.35Å; P323-Y360 HydrophobicContact CG-CE2 4.5Å
324	A	96.9	Very high	96.7	Very high	4 Å²	4	20.9 Å²	20.9	3%	0.033	11%	0.107	C	C	.	.	S	Bend	trans	-76	70.2	177.4	0	0	0	0	0	110.8	I355 T369 T371	A324-I355 HydrophobicContact CB-CB 4.36Å; A324-I355 HydrophobicContact CB-CG2 4.2Å; A324-T369 HydrophobicContact CB-CG2 3.9Å; A324-T369 WeakPolarHBondContact CB-O 3.46Å; A324-T371 VanDerWaalsContact CB-OG1 3.3Å; A324-T371 WeakPolarHBondContact CB-OG1 3.4Å; A324-T371 WeakPolarHBondContact O-CB 3.35Å; A324-T371 WeakPolarHBondContact O-CG2 3.07Å; A324-T371 PolarHBondContact O-OG1 3.04Å
325	L	97.8	Very high	96.5	Very high	37 Å²	37	22.7 Å²	22.7	19%	0.194	12%	0.116	C	C	.	.			trans	-135.4	143	179.4	-69.3	174.1	0	0	0	108.7	P205 L226 H319 P323	P205-L325 HydrophobicContact CB-CD1 3.81Å; P205-L325 HydrophobicContact CG-CD1 3.57Å; L226-L325 HydrophobicContact CD1-CD2 4.47Å; L226-L325 HydrophobicContact CG-CD2 3.97Å; H319-L325 PolarHBondContact CE1-O 2.89Å; H319-L325 PolarHBondContact ND1-O 3.32Å; P323-L325 HydrophobicContact CB-CD1 4.33Å; P323-L325 HydrophobicContact CB-CG 4.48Å; P323-L325 PolarHBondContact O-N 3.11Å
326	P	97.8	Very high	96.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.134	C	C	.	.			trans	-70.7	142.2	-175.3	29.4	-35.6	0	0	0	112	V224 L226 D330 I331 I355 F373 P389	V224-P326 PolarHBondContact N-O 2.85Å; L226-P326 HydrophobicContact CD2-CG 3.58Å; P326-D330 HydrophobicContact CB-CB 3.83Å; P326-I331 HydrophobicContact CB-CG1 4.16Å; P326-I331 HydrophobicContact CG-CG1 4.36Å; P326-I355 VanDerWaalsContact CA-CD1 3.42Å; P326-I355 HydrophobicContact CB-CD1 3.87Å; P326-F373 HydrophobicContact CB-CD2 4.3Å; P326-F373 HydrophobicContact CB-CE2 3.93Å; P326-F373 HydrophobicContact CB-CZ 4.14Å; P326-F373 HydrophobicContact CG-CD2 4.26Å; P326-F373 HydrophobicContact CG-CE2 4.37Å; P326-P389 HydrophobicContact CG-CB 3.92Å
327	S	97.1	Very high	96	Very high	5 Å²	5	26.5 Å²	26.5	4%	0.035	14%	0.137	C	C	.	.	B	Isolated β-bridge	trans	-77.6	168.4	162.4	70.1	0	0	0	0	111.7	P220 T222 Q329 D330 I331	P220-S327 WeakPolarHBondContact O-CB 3.38Å; T222-S327 CarbonylContact O-C 3.58Å; T222-S327 VanDerWaalsContact O-CA 3.25Å; T222-S327 WeakPolarHBondContact O-CA 3.44Å; S327-Q329 PolarHBondContact O-N 3.1Å; S327-Q329 PolarHBondContact OG-N 3.24Å; S327-D330 VanDerWaalsContact CB-OD2 3.3Å; S327-D330 WeakPolarHBondContact CB-OD2 3.42Å; S327-D330 PolarHBondContact N-OD2 2.91Å; S327-D330 PolarHBondContact O-N 3.02Å; S327-D330 PolarHBondContact OG-N 3.36Å; S327-D330 PolarHBondContact OG-OD2 2.96Å; S327-I331 WeakPolarHBondContact O-CG1 3.43Å; S327-I331 PolarHBondContact O-N 3.18Å
328	L	95.9	Very high	95.8	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.01	14%	0.137	C	C	.	.	H	α-helix	trans	-58.4	-35.8	171.4	-61.2	172.7	0	0	0	111.7	L211 R218 P220 T222 V224 D330 I331 D332 Y386	L211-L328 HydrophobicContact CD1-CD2 3.82Å; L211-L328 HydrophobicContact CD2-CD2 4Å; R218-L328 VanDerWaalsContact CD-CD1 3.47Å; R218-L328 HydrophobicContact CG-CD1 3.77Å; P220-L328 PolarHBondContact O-N 3.2Å; P220-L328 VanDerWaalsContact O-N 3.15Å; T222-L328 PolarHBondContact O-N 3.19Å; T222-L328 VanDerWaalsContact O-N 3.09Å; V224-L328 HydrophobicContact CG2-CD2 3.75Å; V224-L328 HydrophobicContact CG2-CG 4.35Å; L328-D330 VanDerWaalsContact C-N 3.35Å; L328-I331 HydrophobicContact CD2-CD1 4.35Å; L328-I331 PolarHBondContact O-N 3.46Å; L328-D332 PolarHBondContact O-N 3Å; L328-Y386 HydrophobicContact CB-CE1 4.09Å; L328-Y386 HydrophobicContact CD1-CE1 4.28Å; L328-Y386 HydrophobicContact CD2-CD1 3.9Å; L328-Y386 HydrophobicContact CD2-CD2 4.29Å; L328-Y386 HydrophobicContact CD2-CE1 3.93Å; L328-Y386 HydrophobicContact CD2-CE2 4.3Å; L328-Y386 HydrophobicContact CD2-CG 4.1Å; L328-Y386 HydrophobicContact CG-CE1 4.32Å
329	Q	95.6	Very high	95.5	Very high	74 Å²	74	31.6 Å²	31.6	35%	0.346	16%	0.164	S	C	.	.	H	α-helix	trans	-63	-38	173.3	-177.9	176	-11	0	0	112.5	P220 H221 S327 S333	P220-Q329 HydrophobicContact CB-CB 4.11Å; P220-Q329 PolarHBondContact O-N 3.41Å; H221-Q329 PolarHBondContact CE1-OE1 3.36Å; H221-Q329 VanDerWaalsContact CE1-OE1 3.22Å; S327-Q329 PolarHBondContact O-N 3.1Å; S327-Q329 PolarHBondContact OG-N 3.24Å; Q329-S333 VanDerWaalsContact O-CB 3.3Å; Q329-S333 WeakPolarHBondContact O-CB 3.29Å; Q329-S333 PolarHBondContact O-N 3.31Å; Q329-S333 PolarHBondContact O-OG 3.17Å
330	D	97.7	Very high	95.1	Very high	15 Å²	15	35.4 Å²	35.4	8%	0.08	18%	0.178	C	C	.	.	H	α-helix	trans	-71.8	-36.4	177.3	-57.9	-49.4	0	0	0	112	W315 H317 H319 P326 S327 L328 S333 Q334 F373	W315-D330 HydrophobicContact CH2-CB 4.4Å; H317-D330 VanDerWaalsContact CE1-CG 3.45Å; H317-D330 IonicContact CE1-OD1 3.6Å; H317-D330 PolarHBondContact CE1-OD1 3.37Å; H317-D330 IonicContact CE1-OD2 3.75Å; H317-D330 IonicContact NE2-OD1 3.12Å; H317-D330 PolarHBondContact NE2-OD1 2.87Å; H317-D330 IonicContact NE2-OD2 2.68Å; H319-D330 IonicContact NE2-OD2 3.59Å; P326-D330 HydrophobicContact CB-CB 3.83Å; S327-D330 VanDerWaalsContact CB-OD2 3.3Å; S327-D330 WeakPolarHBondContact CB-OD2 3.42Å; S327-D330 PolarHBondContact N-OD2 2.91Å; S327-D330 PolarHBondContact O-N 3.02Å; S327-D330 PolarHBondContact OG-N 3.36Å; S327-D330 PolarHBondContact OG-OD2 2.96Å; L328-D330 VanDerWaalsContact C-N 3.35Å; D330-S333 PolarHBondContact O-N 2.62Å; D330-Q334 WeakPolarHBondContact O-CB 3.13Å; D330-Q334 PolarHBondContact O-N 3.18Å; D330-F373 HydrophobicContact CB-CZ 4.34Å
331	I	97.2	Very high	94.6	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.2	-50.1	174.9	-67.7	170.9	0	0	0	110.3	V224 P326 S327 L328 Q334 M335 V375 G387 P389	V224-I331 HydrophobicContact CB-CD1 4.01Å; V224-I331 HydrophobicContact CG1-CD1 4.35Å; V224-I331 HydrophobicContact CG2-CD1 3.77Å; P326-I331 HydrophobicContact CB-CG1 4.16Å; P326-I331 HydrophobicContact CG-CG1 4.36Å; S327-I331 WeakPolarHBondContact O-CG1 3.43Å; S327-I331 PolarHBondContact O-N 3.18Å; L328-I331 HydrophobicContact CD2-CD1 4.35Å; L328-I331 PolarHBondContact O-N 3.46Å; I331-Q334 PolarHBondContact O-N 2.92Å; I331-M335 WeakPolarHBondContact O-CG 3.26Å; I331-M335 PolarHBondContact O-N 3.43Å; I331-V375 HydrophobicContact CB-CG2 4.44Å; I331-V375 HydrophobicContact CG2-CG1 3.96Å; I331-V375 HydrophobicContact CG2-CG2 4.09Å; I331-G387 WeakPolarHBondContact CG2-O 3.48Å; I331-P389 HydrophobicContact CD1-CB 4.05Å; I331-P389 HydrophobicContact CD1-CG 3.73Å; I331-P389 HydrophobicContact CG1-CB 4.04Å; I331-P389 HydrophobicContact CG1-CG 4.29Å
332	D	95.3	Very high	93.9	Very high	51 Å²	51	33.2 Å²	33.2	27%	0.273	17%	0.173	S	C	.	.	H	α-helix	trans	-62.3	-47.7	177.7	-73.3	-22.1	0	0	0	111.2	R214 L328 Q334 M335 D336	R214-D332 IonicContact CZ-OD1 3.75Å; R214-D332 VanDerWaalsContact CZ-OD1 3.28Å; R214-D332 IonicContact CZ-OD2 2.78Å; R214-D332 IonicContact NH1-OD1 2.68Å; R214-D332 PolarHBondContact NH1-OD1 3.14Å; R214-D332 IonicContact NH1-OD2 3.26Å; R214-D332 IonicContact NH2-OD1 2.58Å; R214-D332 PolarHBondContact NH2-OD1 3.01Å; R214-D332 IonicContact NH2-OD2 2.79Å; R214-D332 PolarHBondContact NH2-OD2 3.43Å; L328-D332 PolarHBondContact O-N 3Å; D332-Q334 VanDerWaalsContact C-N 3.33Å; D332-Q334 PolarHBondContact O-N 3.4Å; D332-M335 PolarHBondContact O-N 3.01Å; D332-D336 WeakPolarHBondContact O-CB 3.09Å; D332-D336 PolarHBondContact O-N 3.09Å
333	S	95.9	Very high	92.5	Very high	35 Å²	35	33.9 Å²	33.9	25%	0.245	18%	0.181	C	C	.	.	H	α-helix	trans	-57.5	-46.2	177	-58.6	0	0	0	0	111.3	Q329 D330 D336 H337	Q329-S333 VanDerWaalsContact O-CB 3.3Å; Q329-S333 WeakPolarHBondContact O-CB 3.29Å; Q329-S333 PolarHBondContact O-N 3.31Å; Q329-S333 PolarHBondContact O-OG 3.17Å; D330-S333 PolarHBondContact O-N 2.62Å; S333-D336 CarbonylContact O-C 3.37Å; S333-D336 WeakPolarHBondContact O-CA 3.46Å; S333-D336 VanDerWaalsContact O-CB 3.28Å; S333-D336 WeakPolarHBondContact O-CB 3.47Å; S333-D336 PolarHBondContact O-N 3.48Å; S333-D336 VanDerWaalsContact O-N 3.12Å; S333-H337 VanDerWaalsContact C-CD2 3.4Å; S333-H337 PolarHBondContact O-CD2 3.09Å; S333-H337 PolarHBondContact O-N 3.25Å
334	Q	97.4	Very high	90.5	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.6	-39.4	179.5	173.4	58.6	13.6	0	0	112.9	W315 D330 I331 D332 D336 H337 Q338 C351 F373 V375	W315-Q334 HydrophobicContact CZ2-CB 4.3Å; D330-Q334 WeakPolarHBondContact O-CB 3.13Å; D330-Q334 PolarHBondContact O-N 3.18Å; I331-Q334 PolarHBondContact O-N 2.92Å; D332-Q334 VanDerWaalsContact C-N 3.33Å; D332-Q334 PolarHBondContact O-N 3.4Å; Q334-D336 VanDerWaalsContact C-N 3.28Å; Q334-D336 PolarHBondContact O-N 3.01Å; Q334-H337 PolarHBondContact O-N 3.09Å; Q334-Q338 WeakPolarHBondContact O-CB 3.45Å; Q334-Q338 VanDerWaalsContact O-CG 3.25Å; Q334-Q338 WeakPolarHBondContact O-CG 3.25Å; Q334-Q338 PolarHBondContact O-N 3.42Å; Q334-C351 PolarHBondContact NE2-O 2.88Å; Q334-F373 HydrophobicContact CB-CE2 3.77Å; Q334-F373 HydrophobicContact CB-CZ 4.07Å; Q334-F373 HydrophobicContact CG-CD2 4.31Å; Q334-F373 HydrophobicContact CG-CE2 3.74Å; Q334-F373 HydrophobicContact CG-CZ 4.27Å; Q334-V375 HydrophobicContact CB-CG2 3.94Å; Q334-V375 HydrophobicContact CG-CB 4.14Å; Q334-V375 HydrophobicContact CG-CG2 3.62Å
335	M	94.1	Very high	88.4	Confident	39 Å²	39	41.1 Å²	41.1	19%	0.192	23%	0.231	C	C	.	.	H	α-helix	trans	-58.4	-44.7	170	-73.8	-176.7	61.4	0	0	111.1	I331 D332 Q338 L339 V375	I331-M335 WeakPolarHBondContact O-CG 3.26Å; I331-M335 PolarHBondContact O-N 3.43Å; D332-M335 PolarHBondContact O-N 3.01Å; M335-Q338 WeakPolarHBondContact O-CB 3.28Å; M335-Q338 PolarHBondContact O-N 2.83Å; M335-L339 WeakPolarHBondContact O-CG 3.48Å; M335-L339 PolarHBondContact O-N 3.22Å; M335-V375 HydrophobicContact CG-CB 3.95Å; M335-V375 HydrophobicContact CG-CG1 3.42Å; M335-V375 VanDerWaalsContact CG-CG1 3.42Å; M335-V375 HydrophobicContact SD-CG1 3.91Å
336	D	93.8	Very high	86.4	Confident	84 Å²	84	48.1 Å²	48.1	45%	0.449	27%	0.269	S	S	.	.	H	α-helix	trans	-65	-39.1	-179.8	-137.4	34.4	0	0	0	111.5	D332 S333 Q334 R340	D332-D336 WeakPolarHBondContact O-CB 3.09Å; D332-D336 PolarHBondContact O-N 3.09Å; S333-D336 CarbonylContact O-C 3.37Å; S333-D336 WeakPolarHBondContact O-CA 3.46Å; S333-D336 VanDerWaalsContact O-CB 3.28Å; S333-D336 WeakPolarHBondContact O-CB 3.47Å; S333-D336 PolarHBondContact O-N 3.48Å; S333-D336 VanDerWaalsContact O-N 3.12Å; Q334-D336 VanDerWaalsContact C-N 3.28Å; Q334-D336 PolarHBondContact O-N 3.01Å; D336-R340 VanDerWaalsContact CG-NH1 3.28Å; D336-R340 WeakPolarHBondContact O-CB 3.47Å; D336-R340 WeakPolarHBondContact O-CG 3.14Å; D336-R340 PolarHBondContact O-N 2.98Å; D336-R340 VanDerWaalsContact O-N 3.09Å; D336-R340 PolarHBondContact O-NE 2.87Å; D336-R340 VanDerWaalsContact O-NE 3.16Å; D336-R340 IonicContact OD2-CZ 2.67Å; D336-R340 IonicContact OD2-NH1 3.1Å; D336-R340 PolarHBondContact OD2-NH1 3.39Å; D336-R340 IonicContact OD2-NH2 3.19Å
337	H	93.6	Very high	85	Confident	14 Å²	14	50.2 Å²	50.2	7%	0.065	29%	0.29	C	S	.	.	H	α-helix	trans	-65.6	-42.7	172.5	-67.7	-73.5	0	0	0	112.7	F2 W315 S333 Q334 R340 L341 C351	F2-H337 VanDerWaalsContact CB-CE1 3.47Å; F2-H337 WeakPolarHBondContact CB-CE1 3.33Å; F2-H337 AromaticContact CD1-ND1 3.26Å; F2-H337 VanDerWaalsContact CD1-ND1 3.26Å; F2-H337 WeakPolarHBondContact CD1-ND1 3.39Å; F2-H337 AromaticContact CD2-CE1 3.51Å; F2-H337 AromaticContact CD2-ND1 3.13Å; F2-H337 WeakPolarHBondContact CD2-ND1 3.33Å; F2-H337 HydrophobicContact CE1-CB 4.13Å; F2-H337 AromaticContact CE1-ND1 3.43Å; F2-H337 WeakPolarHBondContact CE1-ND1 3.38Å; F2-H337 HydrophobicContact CE2-CB 4.43Å; F2-H337 AromaticContact CE2-ND1 3.29Å; F2-H337 VanDerWaalsContact CE2-ND1 3.29Å; F2-H337 WeakPolarHBondContact CE2-ND1 3.46Å; F2-H337 AromaticContact CG-CE1 3.46Å; F2-H337 VanDerWaalsContact CG-CE1 3.46Å; F2-H337 WeakPolarHBondContact CG-CE1 3.4Å; F2-H337 AromaticContact CG-ND1 3.09Å; F2-H337 WeakPolarHBondContact CG-ND1 3.21Å; F2-H337 HydrophobicContact CZ-CB 3.94Å; F2-H337 AromaticContact CZ-ND1 3.42Å; F2-H337 WeakPolarHBondContact CZ-ND1 3.31Å; W315-H337 AromaticContact CD1-CD2 3.74Å; W315-H337 AromaticContact CD1-CG 3.98Å; W315-H337 AromaticContact CE2-CD2 3.69Å; W315-H337 AromaticContact CE2-NE2 3.91Å; W315-H337 AromaticContact NE1-CD2 3.39Å; W315-H337 PolarHBondContact NE1-CD2 3.43Å; W315-H337 AromaticContact NE1-CG 3.97Å; W315-H337 AromaticContact NE1-NE2 3.97Å; S333-H337 VanDerWaalsContact C-CD2 3.4Å; S333-H337 PolarHBondContact O-CD2 3.09Å; S333-H337 PolarHBondContact O-N 3.25Å; Q334-H337 PolarHBondContact O-N 3.09Å; H337-R340 PolarHBondContact ND1-NH2 3.39Å; H337-R340 PolarHBondContact O-N 3.28Å; H337-L341 PolarHBondContact O-N 3.36Å; H337-L341 VanDerWaalsContact O-N 3.09Å; H337-C351 VanDerWaalsContact CB-SG 3.56Å
338	Q	93.8	Very high	84.2	Confident	8 Å²	8	53 Å²	53	4%	0.037	30%	0.302	C	S	.	.	H	α-helix	trans	-60	-49.7	176	-74.5	167.6	-159.4	0	0	111.8	Q334 M335 R340 L341 Q342 C351 W374 V375	Q334-Q338 WeakPolarHBondContact O-CB 3.45Å; Q334-Q338 VanDerWaalsContact O-CG 3.25Å; Q334-Q338 WeakPolarHBondContact O-CG 3.25Å; Q334-Q338 PolarHBondContact O-N 3.42Å; M335-Q338 WeakPolarHBondContact O-CB 3.28Å; M335-Q338 PolarHBondContact O-N 2.83Å; Q338-R340 VanDerWaalsContact C-N 3.32Å; Q338-R340 PolarHBondContact O-N 2.94Å; Q338-L341 PolarHBondContact O-N 2.82Å; Q338-Q342 WeakPolarHBondContact O-CG 3.36Å; Q338-Q342 PolarHBondContact O-N 3.3Å; Q338-Q342 VanDerWaalsContact O-N 3.09Å; Q338-C351 HydrophobicContact CB-CB 4.45Å; Q338-C351 HydrophobicContact CG-CB 3.85Å; Q338-W374 VanDerWaalsContact CD-NE1 3.3Å; Q338-V375 PolarHBondContact NE2-O 2.86Å; Q338-V375 PolarHBondContact OE1-O 2.83Å
339	L	90.7	Very high	83.9	Confident	107 Å²	107	55.1 Å²	55.1	56%	0.56	31%	0.312	S	S	*	.	H	α-helix	trans	-61.7	-40.1	178.7	-70	169.6	0	0	0	111.8	M335 L341 G343	M335-L339 WeakPolarHBondContact O-CG 3.48Å; M335-L339 PolarHBondContact O-N 3.22Å; L339-L341 PolarHBondContact O-N 3.45Å; L339-G343 PolarHBondContact O-N 2.84Å
340	R	88.1	Confident	83.7	Confident	88 Å²	88	51.6 Å²	51.6	33%	0.332	30%	0.296	S	S	.	.	H	α-helix	trans	-63.6	-36.3	176.4	-77.5	-177.8	-69.2	-114	5.5	113.4	F2 D336 H337 Q338	F2-R340 HydrophobicContact CD1-CB 4.43Å; F2-R340 HydrophobicContact CE1-CB 3.94Å; D336-R340 VanDerWaalsContact CG-NH1 3.28Å; D336-R340 WeakPolarHBondContact O-CB 3.47Å; D336-R340 WeakPolarHBondContact O-CG 3.14Å; D336-R340 PolarHBondContact O-N 2.98Å; D336-R340 VanDerWaalsContact O-N 3.09Å; D336-R340 PolarHBondContact O-NE 2.87Å; D336-R340 VanDerWaalsContact O-NE 3.16Å; D336-R340 IonicContact OD2-CZ 2.67Å; D336-R340 IonicContact OD2-NH1 3.1Å; D336-R340 PolarHBondContact OD2-NH1 3.39Å; D336-R340 IonicContact OD2-NH2 3.19Å; H337-R340 PolarHBondContact ND1-NH2 3.39Å; H337-R340 PolarHBondContact O-N 3.28Å; Q338-R340 VanDerWaalsContact C-N 3.32Å; Q338-R340 PolarHBondContact O-N 2.94Å
341	L	86	Confident	83.6	Confident	29 Å²	29	50.9 Å²	50.9	15%	0.152	29%	0.292	C	S	.	.	H	α-helix	trans	-83.2	-28.5	-179.3	-78.4	179	0	0	0	114.5	F2 L312 H337 Q338 L339 C351	F2-L341 HydrophobicContact CE1-CG 4.22Å; F2-L341 HydrophobicContact CZ-CD1 3.8Å; F2-L341 HydrophobicContact CZ-CD2 4.36Å; F2-L341 HydrophobicContact CZ-CG 3.81Å; L312-L341 HydrophobicContact CB-CD2 4.42Å; L312-L341 HydrophobicContact CG-CD2 4.49Å; H337-L341 PolarHBondContact O-N 3.36Å; H337-L341 VanDerWaalsContact O-N 3.09Å; Q338-L341 PolarHBondContact O-N 2.82Å; L339-L341 PolarHBondContact O-N 3.45Å; L341-C351 HydrophobicContact CD1-CB 3.78Å
342	Q	78.6	Confident	83.6	Confident	69 Å²	69	50.9 Å²	50.9	32%	0.322	29%	0.292	S	S	.	.	H	α-helix	trans	-62.9	-47.2	169.4	-70.2	171.7	-9.4	0	0	111.2	Q338	Q338-Q342 WeakPolarHBondContact O-CG 3.36Å; Q338-Q342 PolarHBondContact O-N 3.3Å; Q338-Q342 VanDerWaalsContact O-N 3.09Å
343	G	63.8	Low	83.8	Confident	36 Å²	36	48.5 Å²	48.5	37%	0.371	28%	0.279	S	S	.	.			trans	64.5	-168.7	175.3	0	0	0	0	0	114.8	L339 S345	L339-G343 PolarHBondContact O-N 2.84Å; G343-S345 PolarHBondContact O-N 2.79Å
344	S	54.2	Low	83.9	Confident	110 Å²	110	46.9 Å²	46.9	77%	0.769	27%	0.267	S	S	*	.	S	Bend	trans	-85.5	48	-172.1	-31.5	0	0	0	0	113.5	R54	R54-S344 PolarHBondContact NH2-O 3.39Å
345	S	52.2	Low	84	Confident	61 Å²	61	46.9 Å²	46.9	43%	0.427	27%	0.267	S	S	.	.	S	Bend	trans	-155.1	133.4	-176.4	30.4	0	0	0	0	108.1	R54 G343 G347	R54-S345 PolarHBondContact NH2-OG 3.03Å; R54-S345 VanDerWaalsContact NH2-OG 3.14Å; G343-S345 PolarHBondContact O-N 2.79Å; S345-G347 PolarHBondContact O-N 3.02Å
346	N	56.3	Low	84.2	Confident	183 Å²	183	45 Å²	45	98%	0.979	26%	0.258	S	S	*	.	S	Bend	trans	-70.8	20.4	-171.3	-58.3	17.2	0	0	0	114.5
347	G	68.4	Low	84.4	Confident	44 Å²	44	41 Å²	41	45%	0.454	24%	0.237	S	C	.	.			trans	-88.4	126.1	172.4	0	0	0	0	0	110.2	S345 Q349	S345-G347 PolarHBondContact O-N 3.02Å; G347-Q349 PolarHBondContact O-N 2.79Å
348	F	80.6	Confident	84.5	Confident	64 Å²	64	40.3 Å²	40.3	28%	0.281	23%	0.234	S	C	.	.			trans	-67.5	130.1	168.3	-179.6	-103.8	0	0	0	109.8	F238 W269 P350 W374	F238-F348 HydrophobicContact CB-CE1 4.36Å; F238-F348 AromaticContact CD1-CE1 3.64Å; F238-F348 HydrophobicContact CD1-CE1 3.64Å; F238-F348 AromaticContact CD1-CZ 3.63Å; F238-F348 HydrophobicContact CD1-CZ 3.63Å; F238-F348 HydrophobicContact CE1-CE1 4.35Å; F238-F348 AromaticContact CE1-CZ 3.92Å; F238-F348 HydrophobicContact CE1-CZ 3.92Å; F238-F348 HydrophobicContact CG-CE1 4.28Å; W269-F348 HydrophobicContact CH2-CD1 4.17Å; W269-F348 HydrophobicContact CH2-CE1 4.22Å; W269-F348 AromaticContact CZ2-CD1 3.74Å; W269-F348 HydrophobicContact CZ2-CD1 3.74Å; W269-F348 HydrophobicContact CZ2-CE1 4.22Å; W269-F348 PolarHBondContact NE1-O 2.99Å; F348-P350 HydrophobicContact CE1-CB 3.85Å; F348-P350 HydrophobicContact CE1-CG 4.08Å; F348-P350 HydrophobicContact CZ-CB 3.93Å; F348-W374 AromaticContact CE2-CZ2 3.99Å; F348-W374 HydrophobicContact CE2-CZ2 3.99Å; F348-W374 HydrophobicContact CZ-CZ2 4.02Å
349	Q	88	Confident	84.6	Confident	46 Å²	46	40.4 Å²	40.4	22%	0.215	23%	0.234	C	C	.	.			trans	-130.2	122.8	162.2	178.2	175.3	-32.3	0	0	107.5	W269 L312 G347	W269-Q349 HydrophobicContact CB-CG 4.43Å; W269-Q349 HydrophobicContact CG-CG 4.26Å; L312-Q349 PolarHBondContact O-NE2 2.79Å; L312-Q349 VanDerWaalsContact O-NE2 3.11Å; G347-Q349 PolarHBondContact O-N 2.79Å
350	P	91.6	Very high	84.8	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.006	22%	0.218	C	C	.	.			trans	-73.9	156.4	177.5	29.9	-33.6	0	0	0	111.8	F238 W269 L276 F348	F238-P350 HydrophobicContact CB-CG 4.47Å; F238-P350 HydrophobicContact CD1-CB 3.72Å; F238-P350 HydrophobicContact CD1-CG 4.32Å; F238-P350 HydrophobicContact CD2-CB 3.84Å; F238-P350 HydrophobicContact CD2-CG 4.01Å; F238-P350 HydrophobicContact CE1-CB 3.64Å; F238-P350 HydrophobicContact CE2-CB 3.74Å; F238-P350 HydrophobicContact CE2-CG 4.34Å; F238-P350 HydrophobicContact CG-CB 3.83Å; F238-P350 HydrophobicContact CG-CG 4.01Å; F238-P350 HydrophobicContact CZ-CB 3.65Å; W269-P350 VanDerWaalsContact CD2-CD 3.43Å; W269-P350 HydrophobicContact CD2-CG 4.02Å; W269-P350 HydrophobicContact CE3-CG 3.6Å; W269-P350 HydrophobicContact CH2-CG 4.08Å; W269-P350 HydrophobicContact CZ2-CG 4.47Å; W269-P350 HydrophobicContact CZ3-CG 3.63Å; L276-P350 HydrophobicContact CB-CG 4.08Å; L276-P350 HydrophobicContact CD1-CG 3.84Å; L276-P350 HydrophobicContact CD2-CB 4.3Å; L276-P350 HydrophobicContact CD2-CG 3.94Å; L276-P350 HydrophobicContact CG-CG 4.16Å; F348-P350 HydrophobicContact CE1-CB 3.85Å; F348-P350 HydrophobicContact CE1-CG 4.08Å; F348-P350 HydrophobicContact CZ-CB 3.93Å
351	C	96.1	Very high	84.8	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.233	C	C	.	.			trans	-123.6	121	170.3	-178.8	0	0	0	0	107.8	V313 Q334 H337 Q338 L341	V313-C351 WeakPolarHBondContact O-CA 3.26Å; Q334-C351 PolarHBondContact NE2-O 2.88Å; H337-C351 VanDerWaalsContact CB-SG 3.56Å; Q338-C351 HydrophobicContact CB-CB 4.45Å; Q338-C351 HydrophobicContact CG-CB 3.85Å; L341-C351 HydrophobicContact CD1-CB 3.78Å
352	L	98.1	Very high	85	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	127	176.3	-168.6	65.2	0	0	0	110.5	V240 L276 V278 V313 G314 W315 I354 P372 V392	V240-L352 HydrophobicContact CG1-CD2 3.91Å; L276-L352 HydrophobicContact CD2-CB 4.12Å; V278-L352 HydrophobicContact CG2-CD2 4.1Å; V313-L352 PolarHBondContact O-N 3.31Å; G314-L352 CarbonylContact C-O 3.54Å; G314-L352 WeakPolarHBondContact CA-O 3.37Å; W315-L352 PolarHBondContact N-O 3.48Å; L352-I354 HydrophobicContact CD2-CD1 3.86Å; L352-I354 HydrophobicContact CD2-CG1 3.99Å; L352-I354 HydrophobicContact CG-CD1 4.41Å; L352-I354 HydrophobicContact CG-CG1 3.99Å; L352-P372 HydrophobicContact CD1-CB 4.09Å; L352-V392 HydrophobicContact CD1-CB 4.13Å; L352-V392 HydrophobicContact CD1-CG1 3.88Å; L352-V392 HydrophobicContact CD1-CG2 4.21Å
353	G	98.4	Very high	85.5	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	142.2	161.8	0	0	0	0	0	109.4	P372 F373	G353-P372 WeakPolarHBondContact O-CA 3.24Å; G353-F373 PolarHBondContact N-O 3.01Å; G353-F373 VanDerWaalsContact N-O 3.15Å; G353-F373 WeakPolarHBondContact O-CD1 3.08Å; G353-F373 PolarHBondContact O-N 3.47Å
354	I	98.8	Very high	86.6	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.005	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	132.8	172.4	-53.1	-177.6	0	0	0	109.6	M250 L265 W315 Y316 H317 L352 I370 T371 P372	M250-I354 HydrophobicContact CE-CG2 3.86Å; M250-I354 HydrophobicContact SD-CB 4.27Å; M250-I354 HydrophobicContact SD-CD1 4.21Å; M250-I354 HydrophobicContact SD-CG2 3.87Å; L265-I354 HydrophobicContact CD1-CD1 3.62Å; L265-I354 HydrophobicContact CD1-CG1 3.92Å; W315-I354 PolarHBondContact O-N 2.85Å; W315-I354 VanDerWaalsContact O-N 3.08Å; Y316-I354 CarbonylContact C-O 3.55Å; Y316-I354 WeakPolarHBondContact CA-O 3.47Å; Y316-I354 WeakPolarHBondContact CB-O 3.34Å; H317-I354 PolarHBondContact N-O 2.94Å; L352-I354 HydrophobicContact CD2-CD1 3.86Å; L352-I354 HydrophobicContact CD2-CG1 3.99Å; L352-I354 HydrophobicContact CG-CD1 4.41Å; L352-I354 HydrophobicContact CG-CG1 3.99Å; I354-I370 HydrophobicContact CG2-CG2 3.6Å; I354-T371 WeakPolarHBondContact CA-O 3.32Å; I354-P372 HydrophobicContact CG1-CB 4.37Å
355	I	98.8	Very high	88.3	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	132.4	173.7	-48.7	-176.4	0	0	0	108.7	H317 H319 A324 P326 T371 F373	H317-I355 WeakPolarHBondContact O-CA 3.49Å; H319-I355 HydrophobicContact CB-CG2 4.46Å; A324-I355 HydrophobicContact CB-CB 4.36Å; A324-I355 HydrophobicContact CB-CG2 4.2Å; P326-I355 VanDerWaalsContact CA-CD1 3.42Å; P326-I355 HydrophobicContact CB-CD1 3.87Å; I355-T371 PolarHBondContact N-O 3.09Å; I355-T371 PolarHBondContact O-N 3.21Å; I355-F373 HydrophobicContact CD1-CD1 4.3Å; I355-F373 HydrophobicContact CD1-CE1 3.86Å; I355-F373 HydrophobicContact CD1-CZ 4.38Å; I355-F373 HydrophobicContact CG1-CD1 4.06Å; I355-F373 HydrophobicContact CG1-CE1 3.66Å
356	C	98.4	Very high	90.3	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	124.3	174	-174.1	0	0	0	0	111.3	C254 H317 S318 H319 P358 I370	C254-C356 HydrophobicContact CB-CB 4.09Å; C254-C356 VanDerWaalsContact SG-CB 3.53Å; H317-C356 PolarHBondContact O-N 3.03Å; S318-C356 CarbonylContact C-O 3.52Å; S318-C356 VanDerWaalsContact CA-O 3.23Å; S318-C356 WeakPolarHBondContact CA-O 3.22Å; H319-C356 PolarHBondContact N-O 3.41Å; C356-P358 VanDerWaalsContact O-CD 3.23Å; C356-P358 WeakPolarHBondContact O-CD 3.42Å; C356-I370 HydrophobicContact CB-CG1 4.47Å
357	G	97.4	Very high	92.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	87.4	172.6	0	0	0	0	0	110.2	N363 T369	G357-N363 PolarHBondContact O-ND2 2.87Å; G357-T369 PolarHBondContact N-O 3.13Å; G357-T369 PolarHBondContact O-N 3.48Å
358	P	96.9	Very high	93.6	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.201	C	C	.	.	S	Bend	trans	-73.2	-46	-171.9	25.8	-34.2	0	0	0	113.9	C254 C356 N363 S368 K439	C254-P358 HydrophobicContact CB-CG 4.19Å; C356-P358 VanDerWaalsContact O-CD 3.23Å; C356-P358 WeakPolarHBondContact O-CD 3.42Å; P358-N363 PolarHBondContact O-ND2 3.05Å; P358-N363 VanDerWaalsContact O-ND2 3.16Å; P358-S368 WeakPolarHBondContact CA-OG 3.15Å; P358-K439 WeakPolarHBondContact O-CE 3.49Å; P358-K439 PolarHBondContact O-NZ 2.84Å
359	Y	95.9	Very high	94.4	Very high	9 Å²	9	34.9 Å²	34.9	4%	0.035	20%	0.204	C	C	.	.	S	Bend	trans	-108.3	10.5	-173.2	-56.3	-74.3	0	0	0	114.4	H255 P320 H361 V424 W430 M436 K439	H255-Y359 HydrophobicContact CB-CE2 4.5Å; H255-Y359 AromaticContact CD2-CE1 3.73Å; H255-Y359 AromaticContact CD2-CZ 3.47Å; H255-Y359 VanDerWaalsContact CD2-CZ 3.47Å; H255-Y359 PolarHBondContact CD2-OH 2.66Å; H255-Y359 PolarHBondContact O-OH 3.33Å; P320-Y359 WeakPolarHBondContact O-CA 3.48Å; P320-Y359 VanDerWaalsContact O-CB 3.26Å; P320-Y359 WeakPolarHBondContact O-CB 3.49Å; P320-Y359 PolarHBondContact O-N 3.46Å; Y359-H361 PolarHBondContact O-N 3.43Å; Y359-V424 HydrophobicContact CE2-CG2 3.99Å; Y359-W430 AromaticContact CD1-CD1 3.75Å; Y359-W430 HydrophobicContact CD1-CG 4.21Å; Y359-W430 PolarHBondContact O-NE1 2.96Å; Y359-M436 HydrophobicContact CD1-SD 3.53Å; Y359-M436 VanDerWaalsContact CD1-SD 3.53Å; Y359-M436 HydrophobicContact CE1-SD 3.31Å; Y359-M436 WeakPolarHBondContact CE1-SD 3.35Å; Y359-M436 HydrophobicContact CG-SD 4.29Å; Y359-K439 HydrophobicContact CD1-CG 3.85Å; Y359-K439 HydrophobicContact CE1-CB 4.28Å; Y359-K439 HydrophobicContact CE1-CG 3.71Å
360	Y	93.7	Very high	94.8	Very high	59 Å²	59	33.9 Å²	33.9	23%	0.231	20%	0.199	C	C	.	.			trans	-59.4	125.9	176.7	177.3	-125.5	0	0	0	111.3	R321 G322 P323 G362 N363	R321-Y360 WeakPolarHBondContact O-CD2 3.5Å; G322-Y360 WeakPolarHBondContact O-CB 3.47Å; P323-Y360 HydrophobicContact CB-CD1 4.21Å; P323-Y360 HydrophobicContact CB-CE1 3.83Å; P323-Y360 HydrophobicContact CB-CE2 4.35Å; P323-Y360 HydrophobicContact CG-CE2 4.5Å; Y360-G362 VanDerWaalsContact CE1-CA 3.49Å; Y360-G362 PolarHBondContact O-N 3.04Å; Y360-G362 VanDerWaalsContact O-N 3.16Å; Y360-N363 VanDerWaalsContact O-CB 3.25Å; Y360-N363 WeakPolarHBondContact O-CB 3.18Å; Y360-N363 PolarHBondContact O-N 2.86Å; Y360-N363 PolarHBondContact O-ND2 3.33Å
361	H	89.3	Confident	95.2	Very high	140 Å²	140	34.8 Å²	34.8	65%	0.648	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-10.8	-175.4	-65.8	-66	0	0	0	114.3	Y359 N363 W430	Y359-H361 PolarHBondContact O-N 3.43Å; H361-N363 VanDerWaalsContact C-N 3.32Å; H361-W430 AromaticContact CE1-NE1 3.86Å; H361-W430 PolarHBondContact CE1-O 3.26Å; H361-W430 AromaticContact ND1-NE1 3.87Å
362	G	88.9	Confident	95.3	Very high	49 Å²	49	35.4 Å²	35.4	51%	0.505	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-0.1	169.2	0	0	0	0	0	114.8	Y360	Y360-G362 VanDerWaalsContact CE1-CA 3.49Å; Y360-G362 PolarHBondContact O-N 3.04Å; Y360-G362 VanDerWaalsContact O-N 3.16Å
363	N	90.7	Very high	95.3	Very high	13 Å²	13	35.4 Å²	35.4	7%	0.07	21%	0.209	C	C	.	.	S	Bend	trans	-65.9	145.2	175.3	-71.9	-7.1	0	0	0	111.7	G357 P358 Y360 H361 G365 A367 T369	G357-N363 PolarHBondContact O-ND2 2.87Å; P358-N363 PolarHBondContact O-ND2 3.05Å; P358-N363 VanDerWaalsContact O-ND2 3.16Å; Y360-N363 VanDerWaalsContact O-CB 3.25Å; Y360-N363 WeakPolarHBondContact O-CB 3.18Å; Y360-N363 PolarHBondContact O-N 2.86Å; Y360-N363 PolarHBondContact O-ND2 3.33Å; H361-N363 VanDerWaalsContact C-N 3.32Å; N363-G365 PolarHBondContact O-N 3.13Å; N363-A367 PolarHBondContact ND2-O 3.14Å; N363-T369 WeakPolarHBondContact OD1-CB 3.46Å; N363-T369 PolarHBondContact OD1-OG1 3.47Å
364	Q	86.1	Confident	95.3	Very high	194 Å²	194	36.5 Å²	36.5	91%	0.907	21%	0.213	S	C	*	.	S	Bend	trans	-80.9	82.7	176.8	-64.5	-171.2	12.1	0	0	110.9
365	G	90.5	Very high	95.2	Very high	44 Å²	44	36.5 Å²	36.5	45%	0.454	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.9	-148.6	-179	0	0	0	0	0	112.8	N363 A367 W430	N363-G365 PolarHBondContact O-N 3.13Å; G365-A367 VanDerWaalsContact C-N 3.27Å; G365-A367 PolarHBondContact O-N 2.97Å; G365-W430 WeakPolarHBondContact O-CH2 3.37Å
366	V	93.8	Very high	94.9	Very high	56 Å²	56	36.5 Å²	36.5	34%	0.339	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-6.1	-171.1	-63	0	0	0	0	115.2	T434 K439 S443	V366-T434 HydrophobicContact CG1-CG2 4.12Å; V366-K439 HydrophobicContact CB-CD 4.15Å; V366-K439 VanDerWaalsContact O-CD 3.25Å; V366-K439 WeakPolarHBondContact O-CD 3.48Å; V366-K439 WeakPolarHBondContact O-CE 3.43Å; V366-K439 PolarHBondContact O-NZ 2.7Å; V366-S443 WeakPolarHBondContact O-CA 3.42Å; V366-S443 VanDerWaalsContact O-CB 3.28Å; V366-S443 WeakPolarHBondContact O-CB 3.31Å; V366-S443 PolarHBondContact O-N 3.12Å
367	A	96.1	Very high	94.6	Very high	53 Å²	53	39.8 Å²	39.8	44%	0.438	24%	0.235	S	C	.	.	S	Bend	trans	-73	137.7	174.8	0	0	0	0	0	111.3	N363 G365	N363-A367 PolarHBondContact ND2-O 3.14Å; G365-A367 VanDerWaalsContact C-N 3.27Å; G365-A367 PolarHBondContact O-N 2.97Å
368	S	97.3	Very high	94.1	Very high	13 Å²	13	41 Å²	41	9%	0.091	24%	0.243	C	C	.	.			trans	-68.2	141.7	163.6	-63.5	0	0	0	0	110.9	D251 H255 P358 I370 K439 S443	D251-S368 WeakPolarHBondContact OD1-CB 3.47Å; D251-S368 PolarHBondContact OD1-OG 3.02Å; H255-S368 PolarHBondContact CE1-OG 2.94Å; P358-S368 WeakPolarHBondContact CA-OG 3.15Å; S368-I370 PolarHBondContact O-N 2.85Å; S368-K439 PolarHBondContact OG-NZ 3.22Å; S368-S443 PolarHBondContact N-OG 2.77Å; S368-S443 PolarHBondContact OG-OG 3.28Å; S368-S443 VanDerWaalsContact OG-OG 3.06Å
369	T	97.2	Very high	93.4	Very high	54 Å²	54	42.8 Å²	42.8	33%	0.331	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	113.4	166.4	-59.7	0	0	0	0	108.5	A324 G357 N363	A324-T369 HydrophobicContact CB-CG2 3.9Å; A324-T369 WeakPolarHBondContact CB-O 3.46Å; G357-T369 PolarHBondContact N-O 3.13Å; G357-T369 PolarHBondContact O-N 3.48Å; N363-T369 WeakPolarHBondContact OD1-CB 3.46Å; N363-T369 PolarHBondContact OD1-OG1 3.47Å
370	I	97.6	Very high	92.8	Very high	25 Å²	25	51 Å²	51	13%	0.128	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	120.7	175	-65.6	172.5	0	0	0	107.8	L247 M250 D251 I354 C356 S368 P372 H447	L247-I370 HydrophobicContact CD2-CD1 4.39Å; L247-I370 HydrophobicContact CD2-CG2 4.43Å; M250-I370 HydrophobicContact CE-CB 4.48Å; M250-I370 HydrophobicContact CE-CD1 3.81Å; M250-I370 HydrophobicContact CE-CG1 4.14Å; M250-I370 HydrophobicContact CE-CG2 3.52Å; D251-I370 HydrophobicContact CB-CD1 4.35Å; I354-I370 HydrophobicContact CG2-CG2 3.6Å; C356-I370 HydrophobicContact CB-CG1 4.47Å; S368-I370 PolarHBondContact O-N 2.85Å; I370-P372 WeakPolarHBondContact O-CD 3.4Å; I370-H447 VanDerWaalsContact CD1-NE2 3.26Å; I370-H447 WeakPolarHBondContact CD1-NE2 3.23Å
371	T	98.3	Very high	92.4	Very high	20 Å²	20	55.5 Å²	55.5	12%	0.123	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	100.2	-172.2	-55.1	0	0	0	0	111.1	L226 A324 I354 I355	L226-T371 HydrophobicContact CD1-CG2 3.28Å; A324-T371 VanDerWaalsContact CB-OG1 3.3Å; A324-T371 WeakPolarHBondContact CB-OG1 3.4Å; A324-T371 WeakPolarHBondContact O-CB 3.35Å; A324-T371 WeakPolarHBondContact O-CG2 3.07Å; A324-T371 PolarHBondContact O-OG1 3.04Å; I354-T371 WeakPolarHBondContact CA-O 3.32Å; I355-T371 PolarHBondContact N-O 3.09Å; I355-T371 PolarHBondContact O-N 3.21Å
372	P	98.5	Very high	92.1	Very high	14 Å²	14	55 Å²	55	9%	0.091	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	132.6	168.6	-14.5	30.9	0	0	0	111	L352 G353 I354 I370 V392 V394	L352-P372 HydrophobicContact CD1-CB 4.09Å; G353-P372 WeakPolarHBondContact O-CA 3.24Å; I354-P372 HydrophobicContact CG1-CB 4.37Å; I370-P372 WeakPolarHBondContact O-CD 3.4Å; P372-V392 HydrophobicContact CB-CB 4.19Å; P372-V392 PolarHBondContact O-N 3.45Å; P372-V394 HydrophobicContact CB-CG1 3.76Å; P372-V394 HydrophobicContact CG-CG1 3.73Å; P372-V394 HydrophobicContact CG-CG2 4.05Å
373	F	98.6	Very high	91.9	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	160.3	-179.9	79.4	-75.8	0	0	0	113.2	L226 W315 P326 D330 Q334 G353 I355 V375 V390	L226-F373 HydrophobicContact CD1-CB 4.05Å; L226-F373 HydrophobicContact CD2-CB 4.04Å; W315-F373 HydrophobicContact CZ2-CZ 4.03Å; P326-F373 HydrophobicContact CB-CD2 4.3Å; P326-F373 HydrophobicContact CB-CE2 3.93Å; P326-F373 HydrophobicContact CB-CZ 4.14Å; P326-F373 HydrophobicContact CG-CD2 4.26Å; P326-F373 HydrophobicContact CG-CE2 4.37Å; D330-F373 HydrophobicContact CB-CZ 4.34Å; Q334-F373 HydrophobicContact CB-CE2 3.77Å; Q334-F373 HydrophobicContact CB-CZ 4.07Å; Q334-F373 HydrophobicContact CG-CD2 4.31Å; Q334-F373 HydrophobicContact CG-CE2 3.74Å; Q334-F373 HydrophobicContact CG-CZ 4.27Å; G353-F373 PolarHBondContact N-O 3.01Å; G353-F373 VanDerWaalsContact N-O 3.15Å; G353-F373 WeakPolarHBondContact O-CD1 3.08Å; G353-F373 PolarHBondContact O-N 3.47Å; I355-F373 HydrophobicContact CD1-CD1 4.3Å; I355-F373 HydrophobicContact CD1-CE1 3.86Å; I355-F373 HydrophobicContact CD1-CZ 4.38Å; I355-F373 HydrophobicContact CG1-CD1 4.06Å; I355-F373 HydrophobicContact CG1-CE1 3.66Å; F373-V375 HydrophobicContact CD2-CG2 4.3Å; F373-V375 HydrophobicContact CE2-CG2 4.19Å; F373-V390 VanDerWaalsContact CA-O 3.32Å; F373-V390 WeakPolarHBondContact CA-O 3.36Å; F373-V390 WeakPolarHBondContact CB-O 3.3Å
374	W	97.8	Very high	91.7	Very high	23 Å²	23	61.7 Å²	61.7	9%	0.087	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	162.4	172.6	-165.1	63.3	0	0	0	108.2	F229 P237 F238 Q338 F348 V376 V390 V392	F229-W374 AromaticContact CE1-CE3 3.93Å; F229-W374 HydrophobicContact CE1-CE3 3.93Å; F229-W374 HydrophobicContact CE1-CZ3 4.16Å; F229-W374 AromaticContact CZ-CE3 3.86Å; F229-W374 HydrophobicContact CZ-CE3 3.86Å; F229-W374 HydrophobicContact CZ-CZ3 4.49Å; P237-W374 HydrophobicContact CG-CE3 4.37Å; P237-W374 HydrophobicContact CG-CH2 3.76Å; P237-W374 HydrophobicContact CG-CZ2 4.49Å; P237-W374 HydrophobicContact CG-CZ3 3.68Å; F238-W374 HydrophobicContact CE1-CD2 4.01Å; F238-W374 AromaticContact CE1-CE2 3.8Å; F238-W374 HydrophobicContact CE1-CG 4.28Å; F238-W374 HydrophobicContact CE1-CZ2 4.18Å; F238-W374 AromaticContact CE1-NE1 3.92Å; F238-W374 AromaticContact CZ-CD1 3.87Å; F238-W374 HydrophobicContact CZ-CD2 4.25Å; F238-W374 HydrophobicContact CZ-CG 4.03Å; Q338-W374 VanDerWaalsContact CD-NE1 3.3Å; F348-W374 AromaticContact CE2-CZ2 3.99Å; F348-W374 HydrophobicContact CE2-CZ2 3.99Å; F348-W374 HydrophobicContact CZ-CZ2 4.02Å; W374-V376 HydrophobicContact CE3-CG2 4.06Å; W374-V376 HydrophobicContact CZ3-CG2 4.01Å; W374-V390 HydrophobicContact CB-CG2 4.03Å; W374-V390 HydrophobicContact CE3-CG2 4.23Å; W374-V390 PolarHBondContact N-O 3.35Å; W374-V390 WeakPolarHBondContact O-CG2 3.42Å; W374-V390 PolarHBondContact O-N 2.63Å; W374-V392 HydrophobicContact CB-CG2 3.57Å
375	V	96.8	Very high	91.9	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	117.6	175.8	178.2	0	0	0	0	109.8	I331 Q334 M335 Q338 F373 I388	I331-V375 HydrophobicContact CB-CG2 4.44Å; I331-V375 HydrophobicContact CG2-CG1 3.96Å; I331-V375 HydrophobicContact CG2-CG2 4.09Å; Q334-V375 HydrophobicContact CB-CG2 3.94Å; Q334-V375 HydrophobicContact CG-CB 4.14Å; Q334-V375 HydrophobicContact CG-CG2 3.62Å; M335-V375 HydrophobicContact CG-CB 3.95Å; M335-V375 HydrophobicContact CG-CG1 3.42Å; M335-V375 VanDerWaalsContact CG-CG1 3.42Å; M335-V375 HydrophobicContact SD-CG1 3.91Å; Q338-V375 PolarHBondContact NE2-O 2.86Å; Q338-V375 PolarHBondContact OE1-O 2.83Å; F373-V375 HydrophobicContact CD2-CG2 4.3Å; F373-V375 HydrophobicContact CE2-CG2 4.19Å; V375-I388 WeakPolarHBondContact CA-O 3.42Å
376	V	94.3	Very high	91.9	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.006	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	126.4	170.2	-176.7	0	0	0	0	107.8	F229 I232 R234 W374 G387 I388 V390	F229-V376 HydrophobicContact CE1-CG2 4.4Å; I232-V376 HydrophobicContact CD1-CB 4.45Å; I232-V376 HydrophobicContact CD1-CG2 3.85Å; R234-V376 VanDerWaalsContact NH1-CG1 3.33Å; W374-V376 HydrophobicContact CE3-CG2 4.06Å; W374-V376 HydrophobicContact CZ3-CG2 4.01Å; V376-G387 CarbonylContact O-C 3.49Å; V376-G387 WeakPolarHBondContact O-CA 3.25Å; V376-I388 HydrophobicContact CB-CB 4.28Å; V376-I388 PolarHBondContact N-O 3.42Å; V376-I388 PolarHBondContact O-N 3.22Å; V376-V390 HydrophobicContact CG2-CG1 3.97Å; V376-V390 HydrophobicContact CG2-CG2 3.89Å
377	P	91.5	Very high	91.9	Very high	69 Å²	69	48.4 Å²	48.4	45%	0.448	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-54.4	148.7	175.8	-26.6	35.3	0	0	0	112.1
378	P	87.4	Confident	91.9	Very high	25 Å²	25	46.9 Å²	46.9	16%	0.162	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-59.3	150.6	177	26.4	-34.4	0	0	0	110.9	D385	P378-D385 HydrophobicContact CB-CB 4.29Å
379	P	81.4	Confident	91.9	Very high	37 Å²	37	46.2 Å²	46.2	24%	0.24	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-59.2	147.6	177.9	-21.8	33.2	0	0	0	112.1	Q381 R382	P379-Q381 PolarHBondContact O-N 2.69Å; P379-Q381 VanDerWaalsContact O-N 3.11Å; P379-R382 CarbonylContact O-C 3.6Å; P379-R382 WeakPolarHBondContact O-CA 3.46Å; P379-R382 PolarHBondContact O-N 2.81Å
380	E	82.7	Confident	91.9	Very high	181 Å²	181	43.7 Å²	43.7	85%	0.846	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-25.8	-179.5	-64.5	176.4	165.9	0	0	113	R382 P383	E380-R382 VanDerWaalsContact C-N 3.29Å; E380-R382 PolarHBondContact O-N 2.7Å; E380-P383 WeakPolarHBondContact O-CD 3.45Å
381	Q	85.4	Confident	91.9	Very high	155 Å²	155	44.4 Å²	44.4	72%	0.724	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-14.3	174.8	-53.8	77.9	15.8	0	0	113.3	P379	P379-Q381 PolarHBondContact O-N 2.69Å; P379-Q381 VanDerWaalsContact O-N 3.11Å
382	R	84.3	Confident	91.9	Very high	130 Å²	130	43.9 Å²	43.9	49%	0.491	23%	0.23	S	C	.	.			trans	-140.5	61.7	180	-71.4	-171.1	-75	148	-11.5	111.2	P379 E380 N384 D385	P379-R382 CarbonylContact O-C 3.6Å; P379-R382 WeakPolarHBondContact O-CA 3.46Å; P379-R382 PolarHBondContact O-N 2.81Å; E380-R382 VanDerWaalsContact C-N 3.29Å; E380-R382 PolarHBondContact O-N 2.7Å; R382-N384 PolarHBondContact O-N 2.92Å; R382-N384 VanDerWaalsContact O-N 3.12Å; R382-D385 HydrophobicContact CB-CB 4.4Å; R382-D385 WeakPolarHBondContact CD-OD2 3.22Å; R382-D385 IonicContact CZ-OD2 3.64Å; R382-D385 IonicContact NE-OD2 3.9Å; R382-D385 IonicContact NH1-OD2 3.21Å; R382-D385 PolarHBondContact NH1-OD2 2.8Å; R382-D385 PolarHBondContact O-N 2.95Å; R382-D385 VanDerWaalsContact O-N 3.15Å
383	P	84.3	Confident	91.8	Very high	87 Å²	87	51 Å²	51	57%	0.565	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-14	-175.5	30.9	-36.8	0	0	0	113.4	E380	E380-P383 WeakPolarHBondContact O-CD 3.45Å
384	N	86.3	Confident	91.8	Very high	115 Å²	115	52.2 Å²	52.2	62%	0.615	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	4.6	178.1	-64.3	-27.3	0	0	0	113.5	T213 R214 R382	T213-N384 HydrophobicContact CG2-CB 3.74Å; T213-N384 WeakPolarHBondContact CG2-O 3.48Å; R214-N384 VanDerWaalsContact CB-O 3.25Å; R214-N384 WeakPolarHBondContact CB-O 3.49Å; R214-N384 VanDerWaalsContact CD-O 3.23Å; R214-N384 WeakPolarHBondContact CD-O 3.34Å; R214-N384 WeakPolarHBondContact CG-O 3.23Å; R214-N384 PolarHBondContact N-O 2.93Å; R382-N384 PolarHBondContact O-N 2.92Å; R382-N384 VanDerWaalsContact O-N 3.12Å
385	D	89.9	Confident	91.8	Very high	3 Å²	3	55.7 Å²	55.7	2%	0.016	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-86.1	165.3	174.5	-72.5	14.7	0	0	0	111.2	T213 R214 P378 R382	T213-D385 WeakPolarHBondContact CA-OD1 3.44Å; T213-D385 WeakPolarHBondContact CB-OD1 3.46Å; T213-D385 PolarHBondContact OG1-OD1 3.4Å; R214-D385 WeakPolarHBondContact CD-O 3.28Å; P378-D385 HydrophobicContact CB-CB 4.29Å; R382-D385 HydrophobicContact CB-CB 4.4Å; R382-D385 WeakPolarHBondContact CD-OD2 3.22Å; R382-D385 IonicContact CZ-OD2 3.64Å; R382-D385 IonicContact NE-OD2 3.9Å; R382-D385 IonicContact NH1-OD2 3.21Å; R382-D385 PolarHBondContact NH1-OD2 2.8Å; R382-D385 PolarHBondContact O-N 2.95Å; R382-D385 VanDerWaalsContact O-N 3.15Å
386	Y	90.5	Very high	91.8	Very high	12 Å²	12	62.2 Å²	62.2	5%	0.047	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-68.3	154.6	170.4	-67.7	-85.5	0	0	0	110.5	Y208 L211 R214 L328	Y208-Y386 WeakPolarHBondContact CE2-O 3.49Å; Y208-Y386 PolarHBondContact OH-O 2.87Å; L211-Y386 HydrophobicContact CB-CD2 4.37Å; L211-Y386 HydrophobicContact CD1-CD2 4.37Å; R214-Y386 HydrophobicContact CB-CE2 4.08Å; R214-Y386 HydrophobicContact CG-CD1 4.03Å; R214-Y386 HydrophobicContact CG-CD2 3.73Å; R214-Y386 HydrophobicContact CG-CE1 4Å; R214-Y386 HydrophobicContact CG-CE2 3.7Å; R214-Y386 HydrophobicContact CG-CG 3.9Å; L328-Y386 HydrophobicContact CB-CE1 4.09Å; L328-Y386 HydrophobicContact CD1-CE1 4.28Å; L328-Y386 HydrophobicContact CD2-CD1 3.9Å; L328-Y386 HydrophobicContact CD2-CD2 4.29Å; L328-Y386 HydrophobicContact CD2-CE1 3.93Å; L328-Y386 HydrophobicContact CD2-CE2 4.3Å; L328-Y386 HydrophobicContact CD2-CG 4.1Å; L328-Y386 HydrophobicContact CG-CE1 4.32Å
387	G	93.8	Very high	91.9	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-64.9	149.6	167.1	0	0	0	0	0	111.1	Y208 I331 V376 P389	Y208-G387 WeakPolarHBondContact CE2-O 3.3Å; I331-G387 WeakPolarHBondContact CG2-O 3.48Å; V376-G387 CarbonylContact O-C 3.49Å; V376-G387 WeakPolarHBondContact O-CA 3.25Å; G387-P389 VanDerWaalsContact O-CD 3.3Å; G387-P389 WeakPolarHBondContact O-CD 3.39Å
388	I	95.4	Very high	92.2	Very high	20 Å²	20	66.6 Å²	66.6	10%	0.103	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	114.4	-179.9	-45.4	172.6	0	0	0	108.7	Y208 I232 V375 V376 V390	Y208-I388 HydrophobicContact CD1-CG1 4.35Å; Y208-I388 HydrophobicContact CD1-CG2 4.17Å; Y208-I388 HydrophobicContact CD2-CB 4.46Å; Y208-I388 HydrophobicContact CD2-CG2 4.3Å; Y208-I388 HydrophobicContact CE1-CD1 4.43Å; Y208-I388 HydrophobicContact CE1-CG1 3.82Å; Y208-I388 HydrophobicContact CE1-CG2 4.49Å; Y208-I388 HydrophobicContact CE2-CB 4.31Å; Y208-I388 HydrophobicContact CE2-CG1 4.01Å; Y208-I388 HydrophobicContact CG-CG2 4.1Å; I232-I388 HydrophobicContact CD1-CD1 4.48Å; I232-I388 HydrophobicContact CG2-CD1 4.48Å; I232-I388 HydrophobicContact CG2-CG2 4.32Å; V375-I388 WeakPolarHBondContact CA-O 3.42Å; V376-I388 HydrophobicContact CB-CB 4.28Å; V376-I388 PolarHBondContact N-O 3.42Å; V376-I388 PolarHBondContact O-N 3.22Å; I388-V390 HydrophobicContact CG2-CG1 4.38Å; I388-V390 PolarHBondContact O-N 3.16Å
389	P	97.3	Very high	92.7	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	127.3	175.4	34.7	-35.6	0	0	0	109.6	V224 L226 S227 P326 I331 G387	V224-P389 HydrophobicContact CB-CG 4.3Å; V224-P389 HydrophobicContact CG1-CG 3.8Å; L226-P389 HydrophobicContact CD2-CB 3.67Å; L226-P389 HydrophobicContact CD2-CG 4.34Å; S227-P389 PolarHBondContact N-O 3.24Å; P326-P389 HydrophobicContact CG-CB 3.92Å; I331-P389 HydrophobicContact CD1-CB 4.05Å; I331-P389 HydrophobicContact CD1-CG 3.73Å; I331-P389 HydrophobicContact CG1-CB 4.04Å; I331-P389 HydrophobicContact CG1-CG 4.29Å; G387-P389 VanDerWaalsContact O-CD 3.3Å; G387-P389 WeakPolarHBondContact O-CD 3.39Å
390	V	97.7	Very high	93.4	Very high	0 Å²	0	70.3 Å²	70.3	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	140.1	-179	-68.1	0	0	0	0	111.3	S227 F229 I232 F373 W374 V376 I388	S227-V390 CarbonylContact O-C 3.6Å; S227-V390 WeakPolarHBondContact O-CA 3.3Å; S227-V390 WeakPolarHBondContact O-CB 3.46Å; F229-V390 HydrophobicContact CD1-CG2 4.4Å; F229-V390 HydrophobicContact CD2-CB 4.37Å; F229-V390 HydrophobicContact CD2-CG2 4.4Å; F229-V390 HydrophobicContact CE1-CG2 3.78Å; F229-V390 HydrophobicContact CE2-CB 4.17Å; F229-V390 HydrophobicContact CE2-CG2 3.78Å; F229-V390 HydrophobicContact CZ-CB 4.25Å; F229-V390 HydrophobicContact CZ-CG2 3.43Å; F229-V390 VanDerWaalsContact CZ-CG2 3.43Å; I232-V390 HydrophobicContact CD1-CG1 3.76Å; F373-V390 VanDerWaalsContact CA-O 3.32Å; F373-V390 WeakPolarHBondContact CA-O 3.36Å; F373-V390 WeakPolarHBondContact CB-O 3.3Å; W374-V390 HydrophobicContact CB-CG2 4.03Å; W374-V390 HydrophobicContact CE3-CG2 4.23Å; W374-V390 PolarHBondContact N-O 3.35Å; W374-V390 WeakPolarHBondContact O-CG2 3.42Å; W374-V390 PolarHBondContact O-N 2.63Å; V376-V390 HydrophobicContact CG2-CG1 3.97Å; V376-V390 HydrophobicContact CG2-CG2 3.89Å; I388-V390 HydrophobicContact CG2-CG1 4.38Å; I388-V390 PolarHBondContact O-N 3.16Å
391	A	98.1	Very high	94	Very high	40 Å²	40	67.2 Å²	67.2	33%	0.331	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	137.5	172.4	0	0	0	0	0	110.1	L226 S227 F229	L226-A391 HydrophobicContact CB-CB 4.16Å; L226-A391 HydrophobicContact CD1-CB 3.97Å; S227-A391 PolarHBondContact O-N 3.49Å; F229-A391 WeakPolarHBondContact CD2-O 3.15Å; F229-A391 VanDerWaalsContact CE2-O 3.29Å; F229-A391 WeakPolarHBondContact CE2-O 3.32Å
392	V	98.1	Very high	94.4	Very high	9 Å²	9	60.6 Å²	60.6	6%	0.055	31%	0.308	C	S	.	.			trans	-105.5	121	177.9	175.2	0	0	0	0	109.3	F229 V240 L352 P372 W374 V394	F229-V392 HydrophobicContact CE2-CG2 4.46Å; V240-V392 HydrophobicContact CB-CG1 4.41Å; V240-V392 HydrophobicContact CG2-CG1 3.72Å; L352-V392 HydrophobicContact CD1-CB 4.13Å; L352-V392 HydrophobicContact CD1-CG1 3.88Å; L352-V392 HydrophobicContact CD1-CG2 4.21Å; P372-V392 HydrophobicContact CB-CB 4.19Å; P372-V392 PolarHBondContact O-N 3.45Å; W374-V392 HydrophobicContact CB-CG2 3.57Å; V392-V394 HydrophobicContact CG1-CG1 4.05Å
393	E	97.1	Very high	94.7	Very high	165 Å²	165	55.5 Å²	55.5	77%	0.771	29%	0.291	S	S	*	.			trans	-72.6	126.8	170.6	-66.6	-179.4	-171.2	0	0	109.3	Q236	Q236-E393 PolarHBondContact NE2-O 2.61Å
394	V	97.5	Very high	95.1	Very high	25 Å²	25	55.6 Å²	55.6	15%	0.152	29%	0.294	C	S	.	.			trans	-124.3	140.7	-176	-57.1	0	0	0	0	111	V240 V242 P372 V392 Y396	V240-V394 HydrophobicContact CB-CB 4.35Å; V240-V394 HydrophobicContact CB-CG1 3.91Å; V240-V394 HydrophobicContact CG1-CB 4.21Å; V240-V394 HydrophobicContact CG1-CG1 3.69Å; V242-V394 HydrophobicContact CG2-CB 4.27Å; V242-V394 HydrophobicContact CG2-CG1 4.42Å; P372-V394 HydrophobicContact CB-CG1 3.76Å; P372-V394 HydrophobicContact CG-CG1 3.73Å; P372-V394 HydrophobicContact CG-CG2 4.05Å; V392-V394 HydrophobicContact CG1-CG1 4.05Å; V394-Y396 HydrophobicContact CG2-CD1 4.09Å; V394-Y396 HydrophobicContact CG2-CE1 3.4Å; V394-Y396 VanDerWaalsContact CG2-CE1 3.4Å; V394-Y396 HydrophobicContact CG2-CE2 4.19Å; V394-Y396 VanDerWaalsContact CG2-CZ 3.45Å
395	T	98.1	Very high	95.3	Very high	95 Å²	95	52.8 Å²	52.8	58%	0.583	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91	119.6	170.5	-60.6	0	0	0	0	109.5	V240 A241 V242	V240-T395 PolarHBondContact O-N 3.01Å; A241-T395 CarbonylContact C-O 3.59Å; A241-T395 VanDerWaalsContact CA-O 3.31Å; A241-T395 WeakPolarHBondContact CA-O 3.25Å; V242-T395 PolarHBondContact N-O 3.32Å
396	Y	96.3	Very high	95.6	Very high	137 Å²	137	52.9 Å²	52.9	54%	0.537	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	121.1	176.4	-60.9	-56.5	0	0	0	111.1	L247 V394	L247-Y396 HydrophobicContact CD1-CD1 3.62Å; L247-Y396 HydrophobicContact CD1-CE1 3.76Å; L247-Y396 HydrophobicContact CD1-CG 4.49Å; L247-Y396 HydrophobicContact CD2-CE1 4.37Å; V394-Y396 HydrophobicContact CG2-CD1 4.09Å; V394-Y396 HydrophobicContact CG2-CE1 3.4Å; V394-Y396 VanDerWaalsContact CG2-CE1 3.4Å; V394-Y396 HydrophobicContact CG2-CE2 4.19Å; V394-Y396 VanDerWaalsContact CG2-CZ 3.45Å
397	V	97.8	Very high	95.8	Very high	70 Å²	70	54.6 Å²	54.6	42%	0.424	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	101.8	-179.5	-179	0	0	0	0	108.6	A241 V242 S243 S244 D399	A241-V397 HydrophobicContact CB-CG2 3.98Å; V242-V397 PolarHBondContact O-N 2.81Å; S243-V397 CarbonylContact C-O 3.6Å; S243-V397 WeakPolarHBondContact CA-O 3.37Å; S244-V397 PolarHBondContact N-O 3.07Å; V397-D399 PolarHBondContact O-N 3.04Å
398	Q	97.2	Very high	95.9	Very high	93 Å²	93	59.2 Å²	59.2	44%	0.435	31%	0.314	S	S	.	.			trans	-69.8	117.7	178.5	-165.2	-171.9	27.3	0	0	110.8	A448 K450	Q398-A448 WeakPolarHBondContact CG-O 3.25Å; Q398-A448 PolarHBondContact NE2-O 2.98Å; Q398-K450 HydrophobicContact CG-CG 4.09Å; Q398-K450 WeakPolarHBondContact O-CE 3.34Å; Q398-K450 PolarHBondContact O-NZ 3.48Å; Q398-K450 VanDerWaalsContact OE1-CG 3.26Å
399	D	97	Very high	96	Very high	40 Å²	40	59.6 Å²	59.6	21%	0.214	32%	0.315	C	S	.	.			trans	-63.8	154.7	175.2	-75.7	-89.1	0	0	0	112.1	S243 S244 N245 V397 P449 K450	S243-D399 VanDerWaalsContact CB-OD2 3.31Å; S243-D399 WeakPolarHBondContact CB-OD2 3.25Å; S243-D399 PolarHBondContact OG-OD2 2.93Å; S244-D399 PolarHBondContact N-OD2 3.09Å; S244-D399 PolarHBondContact OG-N 3.39Å; S244-D399 PolarHBondContact OG-OD2 3.47Å; N245-D399 WeakPolarHBondContact CB-OD2 3.47Å; N245-D399 PolarHBondContact N-OD2 2.84Å; N245-D399 WeakPolarHBondContact ND2-CB 3.28Å; N245-D399 PolarHBondContact ND2-OD1 3.12Å; N245-D399 VanDerWaalsContact ND2-OD1 3.13Å; N245-D399 PolarHBondContact ND2-OD2 2.9Å; V397-D399 PolarHBondContact O-N 3.04Å; D399-P449 HydrophobicContact CB-CB 4.15Å; D399-P449 WeakPolarHBondContact O-CA 3.47Å; D399-P449 WeakPolarHBondContact O-CB 3.36Å; D399-K450 PolarHBondContact O-N 3.33Å
400	N	95.9	Very high	96	Very high	100 Å²	100	59.6 Å²	59.6	54%	0.535	32%	0.315	S	S	.	.	S	Bend	trans	-75.4	-34.1	177.2	-67.4	-15.2	0	0	0	112.1	K450 D451	N400-K450 PolarHBondContact OD1-NZ 3.48Å; N400-D451 WeakPolarHBondContact O-CB 3.21Å; N400-D451 PolarHBondContact O-N 2.9Å
401	F	95.4	Very high	96	Very high	115 Å²	115	61.6 Å²	61.6	50%	0.504	33%	0.325	S	S	.	.	S	Bend	trans	-151	162	-177.3	55.1	-93.3	0	0	0	111.6	N245 T403 D451	N245-F401 PolarHBondContact ND2-O 3.29Å; F401-T403 HydrophobicContact CD2-CG2 4.4Å; F401-T403 HydrophobicContact CE2-CG2 4.03Å; F401-T403 PolarHBondContact O-N 3Å; F401-D451 HydrophobicContact CB-CB 4.2Å
402	L	93.7	Very high	95.9	Very high	16 Å²	16	63.5 Å²	63.5	8%	0.084	33%	0.329	C	S	.	.			trans	-77.3	117	172.7	-176.5	61.2	0	0	0	109.1	N245 L248 V406 P449 I457 L458	N245-L402 WeakPolarHBondContact OD1-CD1 3.43Å; L248-L402 HydrophobicContact CD1-CD1 4.21Å; L248-L402 HydrophobicContact CD2-CD1 4.13Å; L402-V406 HydrophobicContact CD1-CB 4.12Å; L402-V406 HydrophobicContact CD1-CG1 3.64Å; L402-P449 HydrophobicContact CB-CG 4.15Å; L402-I457 HydrophobicContact CD2-CB 4.18Å; L402-I457 HydrophobicContact CD2-CD1 4.49Å; L402-I457 HydrophobicContact CD2-CG2 3.69Å; L402-L458 HydrophobicContact CD2-CD2 4.26Å
403	T	92	Very high	95.9	Very high	23 Å²	23	63 Å²	63	14%	0.141	33%	0.327	C	S	.	.			trans	-73.3	145.7	-177.1	70.2	0	0	0	0	112.1	R280 F401 D405 V406 L407	R280-T403 PolarHBondContact NH1-OG1 2.96Å; F401-T403 HydrophobicContact CD2-CG2 4.4Å; F401-T403 HydrophobicContact CE2-CG2 4.03Å; F401-T403 PolarHBondContact O-N 3Å; T403-D405 VanDerWaalsContact C-N 3.25Å; T403-D405 PolarHBondContact O-N 2.96Å; T403-V406 PolarHBondContact O-N 3.08Å; T403-V406 WeakPolarHBondContact OG1-CG2 3.24Å; T403-V406 PolarHBondContact OG1-N 2.86Å; T403-L407 PolarHBondContact O-N 3.39Å
404	S	91.8	Very high	95.9	Very high	90 Å²	90	55.2 Å²	55.2	63%	0.629	29%	0.29	S	S	*	.	H	α-helix	trans	-59.3	-33	176.3	-47	0	0	0	0	113.3	V406 L407 N408	S404-V406 VanDerWaalsContact C-N 3.31Å; S404-V406 PolarHBondContact O-N 3.39Å; S404-L407 PolarHBondContact O-N 2.83Å; S404-N408 WeakPolarHBondContact O-CB 3.26Å; S404-N408 PolarHBondContact O-N 3.49Å; S404-N408 PolarHBondContact O-ND2 3.09Å; S404-N408 PolarHBondContact O-OD1 3.32Å
405	D	92	Very high	95.8	Very high	55 Å²	55	57.7 Å²	57.7	29%	0.294	30%	0.303	S	S	.	.	H	α-helix	trans	-55.3	-46.6	170.4	-63.4	-90.5	0	0	0	111.2	R280 R308 T403 N408 E409	R280-D405 IonicContact CZ-OD2 3.51Å; R280-D405 IonicContact NH1-OD2 3.65Å; R280-D405 IonicContact NH2-OD2 2.72Å; R280-D405 PolarHBondContact NH2-OD2 3.02Å; R308-D405 IonicContact CZ-OD1 2.7Å; R308-D405 IonicContact NE-OD1 2.71Å; R308-D405 PolarHBondContact NE-OD1 3.41Å; R308-D405 IonicContact NH2-OD1 3.4Å; R308-D405 PolarHBondContact NH2-OD1 3.03Å; T403-D405 VanDerWaalsContact C-N 3.25Å; T403-D405 PolarHBondContact O-N 2.96Å; D405-N408 WeakPolarHBondContact O-CB 3.31Å; D405-N408 PolarHBondContact O-N 3.07Å; D405-E409 WeakPolarHBondContact O-CG 3.43Å; D405-E409 PolarHBondContact O-N 2.71Å
406	V	95.3	Very high	95.6	Very high	5 Å²	5	56.5 Å²	56.5	3%	0.03	29%	0.289	C	S	.	.	H	α-helix	trans	-67.2	-41.6	-177.4	169.1	0	0	0	0	110.8	N245 L248 L249 L402 T403 S404 N408 E409 M410	N245-V406 HydrophobicContact CB-CG2 4.28Å; L248-V406 HydrophobicContact CD2-CG1 4.21Å; L249-V406 HydrophobicContact CB-CG1 4.12Å; L249-V406 HydrophobicContact CD2-CG2 4.49Å; L402-V406 HydrophobicContact CD1-CB 4.12Å; L402-V406 HydrophobicContact CD1-CG1 3.64Å; T403-V406 PolarHBondContact O-N 3.08Å; T403-V406 WeakPolarHBondContact OG1-CG2 3.24Å; T403-V406 PolarHBondContact OG1-N 2.86Å; S404-V406 VanDerWaalsContact C-N 3.31Å; S404-V406 PolarHBondContact O-N 3.39Å; V406-N408 VanDerWaalsContact C-N 3.3Å; V406-N408 PolarHBondContact O-N 2.96Å; V406-E409 PolarHBondContact O-N 3.06Å; V406-M410 HydrophobicContact CG1-CG 4.37Å; V406-M410 HydrophobicContact CG1-SD 4.18Å; V406-M410 VanDerWaalsContact O-CG 3.27Å; V406-M410 WeakPolarHBondContact O-CG 3.3Å; V406-M410 PolarHBondContact O-N 3.17Å
407	L	95.4	Very high	95.5	Very high	48 Å²	48	50.5 Å²	50.5	25%	0.251	27%	0.266	S	S	.	.	H	α-helix	trans	-59	-42.8	173.2	177.3	57.7	0	0	0	111.6	T403 S404 M410 M411 I457 V461	T403-L407 PolarHBondContact O-N 3.39Å; S404-L407 PolarHBondContact O-N 2.83Å; L407-M410 PolarHBondContact O-N 3.44Å; L407-M411 HydrophobicContact CD1-CG 4.27Å; L407-M411 WeakPolarHBondContact O-CG 3.3Å; L407-M411 PolarHBondContact O-N 3.22Å; L407-I457 HydrophobicContact CD1-CG2 3.54Å; L407-I457 HydrophobicContact CD2-CG2 3.71Å; L407-I457 HydrophobicContact CG-CG2 4.12Å; L407-V461 HydrophobicContact CD1-CG2 3.69Å
408	N	95.9	Very high	95.3	Very high	98 Å²	98	52 Å²	52	52%	0.524	26%	0.264	S	S	.	.	H	α-helix	trans	-63.8	-44.4	177.2	-66.8	-13.1	0	0	0	111.5	S404 D405 V406 M410 M411 L412	S404-N408 WeakPolarHBondContact O-CB 3.26Å; S404-N408 PolarHBondContact O-N 3.49Å; S404-N408 PolarHBondContact O-ND2 3.09Å; S404-N408 PolarHBondContact O-OD1 3.32Å; D405-N408 WeakPolarHBondContact O-CB 3.31Å; D405-N408 PolarHBondContact O-N 3.07Å; V406-N408 VanDerWaalsContact C-N 3.3Å; V406-N408 PolarHBondContact O-N 2.96Å; N408-M410 VanDerWaalsContact C-N 3.35Å; N408-M410 PolarHBondContact O-N 3Å; N408-M411 PolarHBondContact O-N 3.39Å; N408-L412 WeakPolarHBondContact O-CB 3.4Å; N408-L412 VanDerWaalsContact O-CG 3.3Å; N408-L412 WeakPolarHBondContact O-CG 3.5Å; N408-L412 PolarHBondContact O-N 3.15Å
409	E	96.8	Very high	94.8	Very high	27 Å²	27	52.2 Å²	52.2	13%	0.126	28%	0.282	C	S	.	.	H	α-helix	trans	-62.5	-39.4	175.3	-66.7	-64.3	162.2	0	0	112.1	L249 R285 D405 V406 L412 L413	L249-E409 HydrophobicContact CD1-CB 3.85Å; L249-E409 HydrophobicContact CD2-CB 3.75Å; L249-E409 HydrophobicContact CD2-CG 4.15Å; L249-E409 HydrophobicContact CG-CB 4.48Å; R285-E409 IonicContact CZ-OE2 2.69Å; R285-E409 IonicContact NH1-OE2 2.63Å; R285-E409 PolarHBondContact NH1-OE2 2.79Å; R285-E409 IonicContact NH2-OE2 3.5Å; D405-E409 WeakPolarHBondContact O-CG 3.43Å; D405-E409 PolarHBondContact O-N 2.71Å; V406-E409 PolarHBondContact O-N 3.06Å; E409-L412 PolarHBondContact O-N 2.63Å; E409-L413 WeakPolarHBondContact O-CB 3.32Å; E409-L413 WeakPolarHBondContact O-CG 3.47Å; E409-L413 PolarHBondContact O-N 3.02Å
410	M	97.6	Very high	94.5	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-61.9	-44.9	173.6	-69.2	177.1	81.4	0	0	111.6	L248 L249 F252 V406 L407 N408 L413 V414 L458 V461	L248-M410 HydrophobicContact CD2-CE 4.04Å; L248-M410 HydrophobicContact CD2-SD 3.65Å; L249-M410 HydrophobicContact CD1-CG 3.74Å; F252-M410 HydrophobicContact CB-CE 4.12Å; F252-M410 HydrophobicContact CD1-CB 4.12Å; F252-M410 HydrophobicContact CD1-CE 3.96Å; F252-M410 HydrophobicContact CD1-CG 3.8Å; F252-M410 HydrophobicContact CD2-CE 3.36Å; F252-M410 HydrophobicContact CE1-CB 3.75Å; F252-M410 HydrophobicContact CE1-CE 4.18Å; F252-M410 HydrophobicContact CE1-CG 3.97Å; F252-M410 HydrophobicContact CE2-CE 3.62Å; F252-M410 HydrophobicContact CG-CE 3.54Å; F252-M410 HydrophobicContact CG-CG 4.27Å; F252-M410 HydrophobicContact CZ-CB 4.2Å; F252-M410 HydrophobicContact CZ-CE 4.03Å; V406-M410 HydrophobicContact CG1-CG 4.37Å; V406-M410 HydrophobicContact CG1-SD 4.18Å; V406-M410 VanDerWaalsContact O-CG 3.27Å; V406-M410 WeakPolarHBondContact O-CG 3.3Å; V406-M410 PolarHBondContact O-N 3.17Å; L407-M410 PolarHBondContact O-N 3.44Å; N408-M410 VanDerWaalsContact C-N 3.35Å; N408-M410 PolarHBondContact O-N 3Å; M410-L413 WeakPolarHBondContact O-CB 3.4Å; M410-L413 PolarHBondContact O-N 3.11Å; M410-V414 WeakPolarHBondContact O-CG2 3.39Å; M410-V414 PolarHBondContact O-N 2.84Å; M410-L458 HydrophobicContact CE-CD2 3.59Å; M410-L458 HydrophobicContact SD-CD2 4.06Å; M410-V461 HydrophobicContact CB-CG1 4.49Å; M410-V461 HydrophobicContact CE-CG1 4.09Å; M410-V461 HydrophobicContact CE-CG2 4.49Å
411	M	97.3	Very high	94.3	Very high	43 Å²	43	52.2 Å²	52.2	21%	0.212	29%	0.29	C	S	.	.	H	α-helix	trans	-65.3	-43.3	177.8	-71.3	-61.5	-58.3	0	0	112.3	L407 N408 L413 V414 D415 V461 Q464	L407-M411 HydrophobicContact CD1-CG 4.27Å; L407-M411 WeakPolarHBondContact O-CG 3.3Å; L407-M411 PolarHBondContact O-N 3.22Å; N408-M411 PolarHBondContact O-N 3.39Å; M411-L413 PolarHBondContact O-N 2.68Å; M411-V414 WeakPolarHBondContact O-CB 3.2Å; M411-V414 PolarHBondContact O-N 2.88Å; M411-V414 VanDerWaalsContact O-N 3.09Å; M411-D415 PolarHBondContact O-N 2.93Å; M411-V461 HydrophobicContact SD-CG2 4.25Å; M411-Q464 HydrophobicContact CE-CG 4.09Å; M411-Q464 HydrophobicContact SD-CG 4.35Å
412	L	96.5	Very high	94.2	Very high	79 Å²	79	47.7 Å²	47.7	41%	0.414	27%	0.271	S	S	.	.	H	α-helix	trans	-60.4	-32.6	174.1	-72	170.5	0	0	0	112.3	N408 E409 F416	N408-L412 WeakPolarHBondContact O-CB 3.4Å; N408-L412 VanDerWaalsContact O-CG 3.3Å; N408-L412 WeakPolarHBondContact O-CG 3.5Å; N408-L412 PolarHBondContact O-N 3.15Å; E409-L412 PolarHBondContact O-N 2.63Å; L412-F416 VanDerWaalsContact O-CB 3.25Å; L412-F416 WeakPolarHBondContact O-CB 3.26Å; L412-F416 PolarHBondContact O-N 3.12Å
413	L	97.4	Very high	94.3	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-71.5	-40.7	172.2	-78.1	176.9	0	0	0	112.9	L249 F252 H253 L256 P283 R285 E409 M410 M411 D415 F416 Y417	L249-L413 HydrophobicContact CD1-CD1 4.14Å; F252-L413 HydrophobicContact CD1-CD1 4.05Å; F252-L413 HydrophobicContact CE1-CB 4.1Å; F252-L413 HydrophobicContact CE1-CD1 4.26Å; H253-L413 HydrophobicContact CB-CD1 3.78Å; H253-L413 VanDerWaalsContact CD2-CD2 3.5Å; H253-L413 WeakPolarHBondContact CD2-CD2 3.49Å; L256-L413 HydrophobicContact CD1-CB 3.67Å; L256-L413 HydrophobicContact CD1-CD1 4.45Å; P283-L413 HydrophobicContact CB-CD1 3.93Å; P283-L413 HydrophobicContact CB-CD2 3.83Å; P283-L413 HydrophobicContact CB-CG 4.18Å; P283-L413 HydrophobicContact CG-CD1 3.79Å; P283-L413 HydrophobicContact CG-CG 4.39Å; R285-L413 HydrophobicContact CG-CD2 4.33Å; E409-L413 WeakPolarHBondContact O-CB 3.32Å; E409-L413 WeakPolarHBondContact O-CG 3.47Å; E409-L413 PolarHBondContact O-N 3.02Å; M410-L413 WeakPolarHBondContact O-CB 3.4Å; M410-L413 PolarHBondContact O-N 3.11Å; M411-L413 PolarHBondContact O-N 2.68Å; L413-D415 VanDerWaalsContact C-N 3.34Å; L413-F416 PolarHBondContact O-N 2.9Å; L413-Y417 HydrophobicContact CD2-CD2 4.36Å; L413-Y417 HydrophobicContact CD2-CE2 4.01Å; L413-Y417 WeakPolarHBondContact O-CD2 3.16Å; L413-Y417 PolarHBondContact O-N 2.86Å
414	V	96.7	Very high	94.5	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.006	27%	0.265	C	S	.	.	H	α-helix	trans	-58.7	-47.3	172.5	176.4	0	0	0	0	110.5	F252 M410 M411 Y417 R418 V461 Q464 L465 T468	F252-V414 HydrophobicContact CZ-CG2 3.9Å; M410-V414 WeakPolarHBondContact O-CG2 3.39Å; M410-V414 PolarHBondContact O-N 2.84Å; M411-V414 WeakPolarHBondContact O-CB 3.2Å; M411-V414 PolarHBondContact O-N 2.88Å; M411-V414 VanDerWaalsContact O-N 3.09Å; V414-Y417 PolarHBondContact O-N 3.02Å; V414-R418 WeakPolarHBondContact O-CB 3.47Å; V414-R418 PolarHBondContact O-N 2.92Å; V414-V461 HydrophobicContact CG2-CG1 4.02Å; V414-Q464 HydrophobicContact CG1-CB 4.02Å; V414-L465 HydrophobicContact CB-CD2 4.46Å; V414-L465 HydrophobicContact CG1-CD2 4.2Å; V414-L465 HydrophobicContact CG2-CD2 3.82Å; V414-L465 HydrophobicContact CG2-CG 4.1Å; V414-T468 HydrophobicContact CG1-CG2 4.29Å
415	D	95.4	Very high	94.6	Very high	77 Å²	77	47.5 Å²	47.5	41%	0.412	26%	0.259	S	S	.	.	H	α-helix	trans	-64.5	-40.6	179.4	-71.5	-36.7	0	0	0	112.2	M411 L413 R418	M411-D415 PolarHBondContact O-N 2.93Å; L413-D415 VanDerWaalsContact C-N 3.34Å; D415-R418 IonicContact OD1-CZ 3.51Å; D415-R418 IonicContact OD1-NH1 3.34Å; D415-R418 PolarHBondContact OD1-NH1 2.85Å; D415-R418 IonicContact OD1-NH2 2.77Å; D415-R418 PolarHBondContact OD1-NH2 2.92Å
416	F	94.5	Very high	94.7	Very high	69 Å²	69	45 Å²	45	30%	0.303	25%	0.245	S	C	.	.	H	α-helix	trans	-65.5	-41.3	176.9	177.3	-101.5	0	0	0	113	R285 L412 L413	R285-F416 VanDerWaalsContact C-CE2 3.49Å; R285-F416 HydrophobicContact CB-CD2 4Å; R285-F416 HydrophobicContact CB-CE2 4.1Å; R285-F416 HydrophobicContact CB-CG 4.25Å; R285-F416 HydrophobicContact CB-CZ 4.43Å; R285-F416 HydrophobicContact CG-CB 4.49Å; R285-F416 HydrophobicContact CG-CD2 4.46Å; R285-F416 HydrophobicContact CG-CG 4.28Å; R285-F416 VanDerWaalsContact O-CE2 3.28Å; R285-F416 WeakPolarHBondContact O-CE2 3.32Å; L412-F416 VanDerWaalsContact O-CB 3.25Å; L412-F416 WeakPolarHBondContact O-CB 3.26Å; L412-F416 PolarHBondContact O-N 3.12Å; L413-F416 PolarHBondContact O-N 2.9Å
417	Y	94.7	Very high	94.6	Very high	12 Å²	12	50.2 Å²	50.2	5%	0.047	27%	0.269	C	S	.	.	H	α-helix	trans	-87.5	-11.3	-179.5	-76.7	-73.6	0	0	0	114.5	H253 L256 T257 V261 L413 V414 A419 A420	H253-Y417 AromaticContact CD2-CE2 3.78Å; H253-Y417 AromaticContact NE2-CE2 3.73Å; H253-Y417 PolarHBondContact NE2-OH 3.1Å; L256-Y417 HydrophobicContact CB-CD2 3.86Å; L256-Y417 HydrophobicContact CB-CE2 4.29Å; L256-Y417 HydrophobicContact CB-CG 4.09Å; L256-Y417 HydrophobicContact CD1-CD2 3.61Å; L256-Y417 HydrophobicContact CD1-CE2 4.24Å; L256-Y417 HydrophobicContact CD1-CG 4.38Å; L256-Y417 HydrophobicContact CG-CD2 4.4Å; T257-Y417 HydrophobicContact CG2-CD1 4.34Å; T257-Y417 HydrophobicContact CG2-CE1 3.55Å; V261-Y417 VanDerWaalsContact CG1-OH 3.31Å; V261-Y417 WeakPolarHBondContact CG1-OH 3.15Å; L413-Y417 HydrophobicContact CD2-CD2 4.36Å; L413-Y417 HydrophobicContact CD2-CE2 4.01Å; L413-Y417 WeakPolarHBondContact O-CD2 3.16Å; L413-Y417 PolarHBondContact O-N 2.86Å; V414-Y417 PolarHBondContact O-N 3.02Å; Y417-A419 PolarHBondContact O-N 2.95Å; Y417-A420 HydrophobicContact CD1-CB 3.87Å; Y417-A420 WeakPolarHBondContact O-CB 3.33Å; Y417-A420 PolarHBondContact O-N 2.95Å
418	R	92.3	Very high	94.6	Very high	102 Å²	102	52.5 Å²	52.5	39%	0.385	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.4	-39.7	-178.5	175.4	175.3	-62.7	117.9	8.7	114.4	V414 D415 T468	V414-R418 WeakPolarHBondContact O-CB 3.47Å; V414-R418 PolarHBondContact O-N 2.92Å; D415-R418 IonicContact OD1-CZ 3.51Å; D415-R418 IonicContact OD1-NH1 3.34Å; D415-R418 PolarHBondContact OD1-NH1 2.85Å; D415-R418 IonicContact OD1-NH2 2.77Å; D415-R418 PolarHBondContact OD1-NH2 2.92Å; R418-T468 HydrophobicContact CB-CG2 3.88Å; R418-T468 HydrophobicContact CG-CG2 3.67Å
419	A	87.9	Confident	94.5	Very high	97 Å²	97	54.3 Å²	54.3	80%	0.802	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	14.5	-178.3	0	0	0	0	0	113.6	Y417	Y417-A419 PolarHBondContact O-N 2.95Å
420	A	91.1	Very high	94.3	Very high	10 Å²	10	54.3 Å²	54.3	8%	0.083	28%	0.281	C	S	.	.			trans	-76.6	125.4	-178	0	0	0	0	0	111.3	Y417 D422 L423	Y417-A420 HydrophobicContact CD1-CB 3.87Å; Y417-A420 WeakPolarHBondContact O-CB 3.33Å; Y417-A420 PolarHBondContact O-N 2.95Å; A420-D422 WeakPolarHBondContact CB-OD1 3.46Å; A420-D422 PolarHBondContact O-N 2.94Å; A420-D422 VanDerWaalsContact O-N 3.14Å; A420-L423 HydrophobicContact CB-CB 4.18Å; A420-L423 WeakPolarHBondContact O-CB 3.35Å; A420-L423 PolarHBondContact O-N 2.66Å; A420-L423 VanDerWaalsContact O-N 3.13Å
421	P	91.5	Very high	93.9	Very high	129 Å²	129	56.4 Å²	56.4	84%	0.838	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-14.1	176.3	29.8	-36.7	0	0	0	113
422	D	93.5	Very high	93.5	Very high	20 Å²	20	59.6 Å²	59.6	11%	0.107	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	3.4	178.8	54.1	-40.7	0	0	0	113.9	T257 T258 S259 R287 A420	T257-D422 WeakPolarHBondContact CA-O 3.38Å; T257-D422 PolarHBondContact OG1-O 3.32Å; T257-D422 VanDerWaalsContact OG1-O 3.05Å; T257-D422 PolarHBondContact OG1-OD2 2.9Å; T258-D422 PolarHBondContact N-O 3.4Å; T258-D422 PolarHBondContact OG1-O 3.02Å; S259-D422 WeakPolarHBondContact CB-OD2 3.41Å; S259-D422 PolarHBondContact OG-OD2 2.97Å; R287-D422 IonicContact CZ-OD1 2.99Å; R287-D422 VanDerWaalsContact CZ-OD1 3.26Å; R287-D422 VanDerWaalsContact NH1-CG 3.28Å; R287-D422 IonicContact NH1-OD1 2.69Å; R287-D422 PolarHBondContact NH1-OD1 2.92Å; R287-D422 IonicContact NH1-OD2 3.89Å; R287-D422 PolarHBondContact NH1-OD2 2.9Å; R287-D422 VanDerWaalsContact NH1-OD2 3.08Å; R287-D422 IonicContact NH2-OD1 3.28Å; R287-D422 PolarHBondContact NH2-OD1 2.84Å; A420-D422 WeakPolarHBondContact CB-OD1 3.46Å; A420-D422 PolarHBondContact O-N 2.94Å; A420-D422 VanDerWaalsContact O-N 3.14Å
423	L	95.3	Very high	93.2	Very high	14 Å²	14	63 Å²	63	7%	0.073	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-49.7	137.3	170.1	178.5	69.4	0	0	0	110.8	L256 A420 Q425 F426	L256-L423 WeakPolarHBondContact O-CD1 3.29Å; A420-L423 HydrophobicContact CB-CB 4.18Å; A420-L423 WeakPolarHBondContact O-CB 3.35Å; A420-L423 PolarHBondContact O-N 2.66Å; A420-L423 VanDerWaalsContact O-N 3.13Å; L423-Q425 PolarHBondContact O-N 2.83Å; L423-F426 HydrophobicContact CD1-CE2 4.14Å
424	V	95.6	Very high	93.1	Very high	4 Å²	4	64.2 Å²	64.2	2%	0.024	35%	0.345	C	S	.	.			trans	-67.2	124.9	173.8	172.4	0	0	0	0	109.8	H255 L256 T258 Y359 F426 M436	H255-V424 VanDerWaalsContact O-CG2 3.3Å; H255-V424 WeakPolarHBondContact O-CG2 3.33Å; L256-V424 PolarHBondContact O-N 2.76Å; T258-V424 HydrophobicContact CG2-CG2 3.98Å; Y359-V424 HydrophobicContact CE2-CG2 3.99Å; V424-F426 HydrophobicContact CB-CE1 4.18Å; V424-F426 HydrophobicContact CB-CZ 4.14Å; V424-F426 HydrophobicContact CG1-CD1 4.18Å; V424-F426 HydrophobicContact CG1-CE1 4.12Å; V424-F426 WeakPolarHBondContact O-CD2 3.22Å; V424-F426 VanDerWaalsContact O-CE2 3.26Å; V424-F426 WeakPolarHBondContact O-CE2 3.34Å; V424-F426 PolarHBondContact O-N 2.96Å; V424-M436 HydrophobicContact CG1-CB 3.76Å; V424-M436 HydrophobicContact CG1-CG 3.89Å; V424-M436 HydrophobicContact CG1-SD 4.13Å
425	Q	94.1	Very high	93	Very high	108 Å²	108	65.4 Å²	65.4	51%	0.505	35%	0.352	S	S	.	.			trans	-75.8	90.5	173.9	-65.5	-175.5	17.4	0	0	109.2	L423 H427 Q428	L423-Q425 PolarHBondContact O-N 2.83Å; Q425-H427 PolarHBondContact O-N 3.44Å; Q425-Q428 HydrophobicContact CB-CG 3.82Å; Q425-Q428 WeakPolarHBondContact O-CB 3.4Å; Q425-Q428 PolarHBondContact O-N 2.67Å
426	F	95.1	Very high	93	Very high	1 Å²	1	62.7 Å²	62.7	0%	0.004	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-23.8	-171.1	-68.2	-71.3	0	0	0	115.2	L256 L423 V424 Q428 M437 I440 L465	L256-F426 HydrophobicContact CD2-CZ 4.08Å; L423-F426 HydrophobicContact CD1-CE2 4.14Å; V424-F426 HydrophobicContact CB-CE1 4.18Å; V424-F426 HydrophobicContact CB-CZ 4.14Å; V424-F426 HydrophobicContact CG1-CD1 4.18Å; V424-F426 HydrophobicContact CG1-CE1 4.12Å; V424-F426 WeakPolarHBondContact O-CD2 3.22Å; V424-F426 VanDerWaalsContact O-CE2 3.26Å; V424-F426 WeakPolarHBondContact O-CE2 3.34Å; V424-F426 PolarHBondContact O-N 2.96Å; F426-Q428 VanDerWaalsContact C-N 3.35Å; F426-M437 HydrophobicContact CB-CB 4.21Å; F426-M437 HydrophobicContact CB-CE 3.73Å; F426-M437 HydrophobicContact CD1-CE 3.98Å; F426-M437 HydrophobicContact CG-CE 3.81Å; F426-M437 PolarHBondContact O-N 3.11Å; F426-I440 HydrophobicContact CD1-CG2 4.34Å; F426-I440 HydrophobicContact CE1-CD1 4.43Å; F426-I440 HydrophobicContact CE1-CG2 4.31Å; F426-L465 HydrophobicContact CD2-CB 4.07Å; F426-L465 HydrophobicContact CE1-CD1 4.36Å; F426-L465 HydrophobicContact CE2-CB 3.99Å; F426-L465 HydrophobicContact CE2-CD1 4.21Å; F426-L465 HydrophobicContact CE2-CD2 3.79Å; F426-L465 HydrophobicContact CE2-CG 4.22Å; F426-L465 HydrophobicContact CZ-CD1 3.96Å; F426-L465 HydrophobicContact CZ-CD2 4.09Å; F426-L465 HydrophobicContact CZ-CG 4.45Å
427	H	93.3	Very high	93.1	Very high	115 Å²	115	60.1 Å²	60.1	53%	0.532	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-11.7	175.5	-58.2	107.1	0	0	0	114.7	Q425	Q425-H427 PolarHBondContact O-N 3.44Å
428	Q	94.1	Very high	93.2	Very high	97 Å²	97	63.2 Å²	63.2	45%	0.453	34%	0.344	S	S	.	.	S	Bend	trans	-76.4	155.2	176.7	-67.7	-170.3	4.6	0	0	111.8	Q425 F426 T435 M436	Q425-Q428 HydrophobicContact CB-CG 3.82Å; Q425-Q428 WeakPolarHBondContact O-CB 3.4Å; Q425-Q428 PolarHBondContact O-N 2.67Å; F426-Q428 VanDerWaalsContact C-N 3.35Å; Q428-T435 CarbonylContact O-C 3.38Å; Q428-T435 VanDerWaalsContact O-CA 3.28Å; Q428-T435 WeakPolarHBondContact O-CA 3.22Å; Q428-T435 WeakPolarHBondContact O-CB 3.05Å; Q428-M436 HydrophobicContact CB-CG 4.33Å; Q428-M436 WeakPolarHBondContact O-CG 3.43Å; Q428-M436 PolarHBondContact O-N 3.18Å
429	F	94.2	Very high	93.4	Very high	136 Å²	136	58.3 Å²	58.3	60%	0.596	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	133.5	171.7	-72.3	-87.7	0	0	0	111.4	C431 P432 T435	F429-C431 WeakPolarHBondContact CD1-O 3.42Å; F429-P432 WeakPolarHBondContact CD1-O 3.47Å; F429-T435 HydrophobicContact CD1-CG2 4.37Å; F429-T435 HydrophobicContact CE1-CG2 4.2Å; F429-T435 HydrophobicContact CZ-CG2 4.47Å
430	W	92.6	Very high	93.8	Very high	27 Å²	27	53.7 Å²	53.7	10%	0.102	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	-40.2	168.7	170.5	60.4	0	0	0	111	Y359 H361 G365 T434 M436 K439	Y359-W430 AromaticContact CD1-CD1 3.75Å; Y359-W430 HydrophobicContact CD1-CG 4.21Å; Y359-W430 PolarHBondContact O-NE1 2.96Å; H361-W430 AromaticContact CE1-NE1 3.86Å; H361-W430 PolarHBondContact CE1-O 3.26Å; H361-W430 AromaticContact ND1-NE1 3.87Å; G365-W430 WeakPolarHBondContact O-CH2 3.37Å; W430-T434 HydrophobicContact CE3-CG2 4.1Å; W430-T434 PolarHBondContact N-O 3.28Å; W430-M436 HydrophobicContact CB-CE 4.02Å; W430-M436 HydrophobicContact CB-SD 3.85Å; W430-M436 HydrophobicContact CG-SD 4.43Å; W430-K439 HydrophobicContact CD2-CB 4.45Å; W430-K439 HydrophobicContact CD2-CD 4.19Å; W430-K439 HydrophobicContact CD2-CG 4.18Å; W430-K439 HydrophobicContact CE3-CB 4.24Å; W430-K439 HydrophobicContact CE3-CD 3.91Å; W430-K439 HydrophobicContact CE3-CG 4.2Å; W430-K439 HydrophobicContact CH2-CD 4.14Å; W430-K439 HydrophobicContact CZ2-CD 4.41Å; W430-K439 HydrophobicContact CZ3-CD 3.89Å
431	C	89.1	Confident	94.1	Very high	43 Å²	43	55.9 Å²	55.9	29%	0.291	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	172.2	166	79.3	0	0	0	0	108.8	F429 D433 T434	F429-C431 WeakPolarHBondContact CD1-O 3.42Å; C431-D433 PolarHBondContact O-N 3.18Å; C431-T434 PolarHBondContact N-O 2.97Å; C431-T434 PolarHBondContact O-N 3.23Å; C431-T434 VanDerWaalsContact O-N 3.15Å; C431-T434 VanDerWaalsContact O-O 3.13Å; C431-T434 VanDerWaalsContact SG-CB 3.58Å
432	P	88.7	Confident	94.3	Very high	111 Å²	111	50.6 Å²	50.6	72%	0.721	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-35.2	-168.7	-30.6	37	0	0	0	115.9	F429	F429-P432 WeakPolarHBondContact CD1-O 3.47Å
433	D	90.4	Very high	94.4	Very high	149 Å²	149	49.9 Å²	49.9	80%	0.797	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.3	18.3	-174.5	-52.1	-71.6	0	0	0	113	C431	C431-D433 PolarHBondContact O-N 3.18Å
434	T	94.2	Very high	94.5	Very high	26 Å²	26	49.2 Å²	49.2	16%	0.16	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	120.5	-175.1	-56.5	0	0	0	0	111.5	V366 W430 C431 D438 K439	V366-T434 HydrophobicContact CG1-CG2 4.12Å; W430-T434 HydrophobicContact CE3-CG2 4.1Å; W430-T434 PolarHBondContact N-O 3.28Å; C431-T434 PolarHBondContact N-O 2.97Å; C431-T434 PolarHBondContact O-N 3.23Å; C431-T434 VanDerWaalsContact O-N 3.15Å; C431-T434 VanDerWaalsContact O-O 3.13Å; C431-T434 VanDerWaalsContact SG-CB 3.58Å; T434-D438 HydrophobicContact CG2-CB 3.67Å; T434-K439 HydrophobicContact CG2-CB 4.42Å
435	T	96	Very high	94.5	Very high	27 Å²	27	52.1 Å²	52.1	17%	0.166	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	165.5	174.5	68.6	0	0	0	0	112.4	Q428 F429 M437 D438 K439	Q428-T435 CarbonylContact O-C 3.38Å; Q428-T435 VanDerWaalsContact O-CA 3.28Å; Q428-T435 WeakPolarHBondContact O-CA 3.22Å; Q428-T435 WeakPolarHBondContact O-CB 3.05Å; F429-T435 HydrophobicContact CD1-CG2 4.37Å; F429-T435 HydrophobicContact CE1-CG2 4.2Å; F429-T435 HydrophobicContact CZ-CG2 4.47Å; T435-M437 PolarHBondContact O-N 3.26Å; T435-M437 PolarHBondContact OG1-N 3.34Å; T435-D438 VanDerWaalsContact CB-OD2 3.31Å; T435-D438 WeakPolarHBondContact CB-OD2 3.21Å; T435-D438 WeakPolarHBondContact CG2-OD2 3.35Å; T435-D438 PolarHBondContact N-OD2 2.7Å; T435-D438 PolarHBondContact O-N 2.99Å; T435-D438 PolarHBondContact OG1-N 2.69Å; T435-D438 PolarHBondContact OG1-OD2 3.11Å; T435-K439 WeakPolarHBondContact O-CB 3.38Å; T435-K439 PolarHBondContact O-N 3.12Å
436	M	95.9	Very high	94.4	Very high	20 Å²	20	50 Å²	50	10%	0.099	28%	0.284	C	S	.	.	H	α-helix	trans	-59.2	-31.3	170.4	-66.6	-70.6	177.3	0	0	111.7	Y359 V424 Q428 W430 I440	Y359-M436 HydrophobicContact CD1-SD 3.53Å; Y359-M436 VanDerWaalsContact CD1-SD 3.53Å; Y359-M436 HydrophobicContact CE1-SD 3.31Å; Y359-M436 WeakPolarHBondContact CE1-SD 3.35Å; Y359-M436 HydrophobicContact CG-SD 4.29Å; V424-M436 HydrophobicContact CG1-CB 3.76Å; V424-M436 HydrophobicContact CG1-CG 3.89Å; V424-M436 HydrophobicContact CG1-SD 4.13Å; Q428-M436 HydrophobicContact CB-CG 4.33Å; Q428-M436 WeakPolarHBondContact O-CG 3.43Å; Q428-M436 PolarHBondContact O-N 3.18Å; W430-M436 HydrophobicContact CB-CE 4.02Å; W430-M436 HydrophobicContact CB-SD 3.85Å; W430-M436 HydrophobicContact CG-SD 4.43Å; M436-I440 PolarHBondContact O-N 3.03Å
437	M	96.5	Very high	94.4	Very high	15 Å²	15	51.3 Å²	51.3	7%	0.074	29%	0.29	C	S	.	.	H	α-helix	trans	-67.6	-47.9	170.6	-178.7	53	58.4	0	0	112.1	F426 T435 K439 I440 K441 Y462 L465 I466	F426-M437 HydrophobicContact CB-CB 4.21Å; F426-M437 HydrophobicContact CB-CE 3.73Å; F426-M437 HydrophobicContact CD1-CE 3.98Å; F426-M437 HydrophobicContact CG-CE 3.81Å; F426-M437 PolarHBondContact O-N 3.11Å; T435-M437 PolarHBondContact O-N 3.26Å; T435-M437 PolarHBondContact OG1-N 3.34Å; M437-K439 PolarHBondContact O-N 3.49Å; M437-I440 WeakPolarHBondContact O-CG2 3.38Å; M437-I440 PolarHBondContact O-N 3.43Å; M437-I440 HydrophobicContact SD-CG2 4.09Å; M437-K441 HydrophobicContact CG-CD 4.26Å; M437-K441 HydrophobicContact CG-CG 4.47Å; M437-K441 WeakPolarHBondContact O-CB 3.22Å; M437-K441 VanDerWaalsContact O-CG 3.32Å; M437-K441 WeakPolarHBondContact O-CG 3.43Å; M437-K441 PolarHBondContact O-N 3.43Å; M437-K441 HydrophobicContact SD-CD 4.15Å; M437-K441 VanDerWaalsContact SD-CE 3.52Å; M437-K441 HydrophobicContact SD-CG 3.97Å; M437-Y462 HydrophobicContact SD-CD1 4.15Å; M437-Y462 HydrophobicContact SD-CG 4.17Å; M437-L465 HydrophobicContact CE-CB 4.21Å; M437-I466 HydrophobicContact CE-CD1 4.28Å; M437-I466 HydrophobicContact CE-CG1 3.85Å
438	D	95.8	Very high	94.3	Very high	76 Å²	76	46.4 Å²	46.4	41%	0.406	27%	0.27	S	S	.	.	H	α-helix	trans	-61.9	-36	177.6	-57.7	-50.8	0	0	0	111.4	T434 T435 G442	T434-D438 HydrophobicContact CG2-CB 3.67Å; T435-D438 VanDerWaalsContact CB-OD2 3.31Å; T435-D438 WeakPolarHBondContact CB-OD2 3.21Å; T435-D438 WeakPolarHBondContact CG2-OD2 3.35Å; T435-D438 PolarHBondContact N-OD2 2.7Å; T435-D438 PolarHBondContact O-N 2.99Å; T435-D438 PolarHBondContact OG1-N 2.69Å; T435-D438 PolarHBondContact OG1-OD2 3.11Å; D438-G442 PolarHBondContact O-N 2.66Å
439	K	96.3	Very high	94.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.7	-48.4	175.9	175.1	57.7	-175.1	73.5	0	112.6	H255 P358 Y359 V366 S368 W430 T434 T435 M437 G442 S443	H255-K439 PolarHBondContact NE2-NZ 3.15Å; P358-K439 WeakPolarHBondContact O-CE 3.49Å; P358-K439 PolarHBondContact O-NZ 2.84Å; Y359-K439 HydrophobicContact CD1-CG 3.85Å; Y359-K439 HydrophobicContact CE1-CB 4.28Å; Y359-K439 HydrophobicContact CE1-CG 3.71Å; V366-K439 HydrophobicContact CB-CD 4.15Å; V366-K439 VanDerWaalsContact O-CD 3.25Å; V366-K439 WeakPolarHBondContact O-CD 3.48Å; V366-K439 WeakPolarHBondContact O-CE 3.43Å; V366-K439 PolarHBondContact O-NZ 2.7Å; S368-K439 PolarHBondContact OG-NZ 3.22Å; W430-K439 HydrophobicContact CD2-CB 4.45Å; W430-K439 HydrophobicContact CD2-CD 4.19Å; W430-K439 HydrophobicContact CD2-CG 4.18Å; W430-K439 HydrophobicContact CE3-CB 4.24Å; W430-K439 HydrophobicContact CE3-CD 3.91Å; W430-K439 HydrophobicContact CE3-CG 4.2Å; W430-K439 HydrophobicContact CH2-CD 4.14Å; W430-K439 HydrophobicContact CZ2-CD 4.41Å; W430-K439 HydrophobicContact CZ3-CD 3.89Å; T434-K439 HydrophobicContact CG2-CB 4.42Å; T435-K439 WeakPolarHBondContact O-CB 3.38Å; T435-K439 PolarHBondContact O-N 3.12Å; M437-K439 PolarHBondContact O-N 3.49Å; K439-G442 PolarHBondContact O-N 2.69Å; K439-S443 WeakPolarHBondContact O-CB 3.24Å; K439-S443 PolarHBondContact O-N 2.89Å
440	I	96.9	Very high	94.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-67	-42.5	177.2	-171.2	178.6	0	0	0	111.3	F252 H255 F426 M436 M437 G442 S443 L444 L465	F252-I440 HydrophobicContact CD2-CD1 3.77Å; F252-I440 HydrophobicContact CE2-CD1 4.15Å; H255-I440 HydrophobicContact CB-CB 4.12Å; H255-I440 HydrophobicContact CB-CD1 3.54Å; H255-I440 HydrophobicContact CB-CG1 3.74Å; F426-I440 HydrophobicContact CD1-CG2 4.34Å; F426-I440 HydrophobicContact CE1-CD1 4.43Å; F426-I440 HydrophobicContact CE1-CG2 4.31Å; M436-I440 PolarHBondContact O-N 3.03Å; M437-I440 WeakPolarHBondContact O-CG2 3.38Å; M437-I440 PolarHBondContact O-N 3.43Å; M437-I440 HydrophobicContact SD-CG2 4.09Å; I440-G442 PolarHBondContact O-N 3.02Å; I440-S443 PolarHBondContact O-N 3.27Å; I440-L444 HydrophobicContact CD1-CD1 4.15Å; I440-L444 HydrophobicContact CG1-CD1 3.66Å; I440-L444 HydrophobicContact CG1-CG 4.14Å; I440-L444 WeakPolarHBondContact O-CB 3.29Å; I440-L444 WeakPolarHBondContact O-CG 3.37Å; I440-L444 PolarHBondContact O-N 2.99Å; I440-L465 HydrophobicContact CD1-CD1 4.36Å
441	K	96.6	Very high	94	Very high	55 Å²	55	43.2 Å²	43.2	24%	0.239	26%	0.259	C	S	.	.	H	α-helix	trans	-58.1	-47	175.2	-72.6	-169.9	175	-148.3	0	112	M437 S445 E459 Y462	M437-K441 HydrophobicContact CG-CD 4.26Å; M437-K441 HydrophobicContact CG-CG 4.47Å; M437-K441 WeakPolarHBondContact O-CB 3.22Å; M437-K441 VanDerWaalsContact O-CG 3.32Å; M437-K441 WeakPolarHBondContact O-CG 3.43Å; M437-K441 PolarHBondContact O-N 3.43Å; M437-K441 HydrophobicContact SD-CD 4.15Å; M437-K441 VanDerWaalsContact SD-CE 3.52Å; M437-K441 HydrophobicContact SD-CG 3.97Å; K441-S445 PolarHBondContact O-N 2.82Å; K441-E459 IonicContact NZ-OE1 3.42Å; K441-E459 PolarHBondContact NZ-OE1 2.77Å; K441-E459 IonicContact NZ-OE2 2.83Å; K441-E459 PolarHBondContact NZ-OE2 3.3Å; K441-Y462 HydrophobicContact CB-CE2 4.48Å; K441-Y462 HydrophobicContact CD-CD2 4.07Å; K441-Y462 HydrophobicContact CD-CE2 4.26Å; K441-Y462 VanDerWaalsContact CE-CD2 3.42Å; K441-Y462 HydrophobicContact CG-CD1 4.29Å; K441-Y462 HydrophobicContact CG-CD2 3.81Å; K441-Y462 HydrophobicContact CG-CE1 4.15Å; K441-Y462 HydrophobicContact CG-CE2 3.65Å; K441-Y462 HydrophobicContact CG-CG 4.16Å
442	G	96	Very high	94	Very high	19 Å²	19	48.7 Å²	48.7	20%	0.196	28%	0.28	C	S	.	.	H	α-helix	trans	-62.8	-47.8	178.3	0	0	0	0	0	112.5	D438 K439 I440 S445	D438-G442 PolarHBondContact O-N 2.66Å; K439-G442 PolarHBondContact O-N 2.69Å; I440-G442 PolarHBondContact O-N 3.02Å; G442-S445 PolarHBondContact O-N 2.95Å; G442-S445 PolarHBondContact O-OG 2.82Å
443	S	96.8	Very high	93.9	Very high	4 Å²	4	45.3 Å²	45.3	3%	0.028	26%	0.262	C	S	.	.	H	α-helix	trans	-61.4	-51.5	-179.9	-159.5	0	0	0	0	112.5	D251 V366 S368 K439 I440 S445 G446	D251-S443 WeakPolarHBondContact OD2-CB 3.15Å; D251-S443 PolarHBondContact OD2-OG 2.96Å; V366-S443 WeakPolarHBondContact O-CA 3.42Å; V366-S443 VanDerWaalsContact O-CB 3.28Å; V366-S443 WeakPolarHBondContact O-CB 3.31Å; V366-S443 PolarHBondContact O-N 3.12Å; S368-S443 PolarHBondContact N-OG 2.77Å; S368-S443 PolarHBondContact OG-OG 3.28Å; S368-S443 VanDerWaalsContact OG-OG 3.06Å; K439-S443 WeakPolarHBondContact O-CB 3.24Å; K439-S443 PolarHBondContact O-N 2.89Å; I440-S443 PolarHBondContact O-N 3.27Å; S443-S445 PolarHBondContact O-N 2.85Å; S443-G446 PolarHBondContact O-N 2.95Å
444	L	96.7	Very high	93.9	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-67.3	-23.1	-176.9	-63.2	179.1	0	0	0	113.4	L248 D251 F252 I440 G446 H447 A448 Y462	L248-L444 HydrophobicContact CG-CD2 4.39Å; L248-L444 WeakPolarHBondContact O-CD2 3.48Å; D251-L444 HydrophobicContact CB-CD2 3.81Å; F252-L444 HydrophobicContact CB-CD1 4Å; F252-L444 HydrophobicContact CB-CD2 4.14Å; F252-L444 HydrophobicContact CD2-CD1 3.82Å; F252-L444 HydrophobicContact CG-CD1 4.41Å; I440-L444 HydrophobicContact CD1-CD1 4.15Å; I440-L444 HydrophobicContact CG1-CD1 3.66Å; I440-L444 HydrophobicContact CG1-CG 4.14Å; I440-L444 WeakPolarHBondContact O-CB 3.29Å; I440-L444 WeakPolarHBondContact O-CG 3.37Å; I440-L444 PolarHBondContact O-N 2.99Å; L444-G446 PolarHBondContact O-N 3.32Å; L444-H447 PolarHBondContact O-N 2.9Å; L444-A448 PolarHBondContact O-N 3.49Å; L444-Y462 HydrophobicContact CD1-CE1 4.16Å
445	S	94.6	Very high	93.6	Very high	66 Å²	66	42.1 Å²	42.1	46%	0.462	24%	0.244	S	C	.	.	H	α-helix	trans	-60.7	-30.2	170.5	81.1	0	0	0	0	112.6	K441 G442 S443 H447 A448	K441-S445 PolarHBondContact O-N 2.82Å; G442-S445 PolarHBondContact O-N 2.95Å; G442-S445 PolarHBondContact O-OG 2.82Å; S443-S445 PolarHBondContact O-N 2.85Å; S445-H447 PolarHBondContact O-N 2.85Å; S445-A448 VanDerWaalsContact O-CB 3.31Å; S445-A448 WeakPolarHBondContact O-CB 3.04Å; S445-A448 PolarHBondContact O-N 2.77Å
446	G	92.8	Very high	93.4	Very high	62 Å²	62	48.4 Å²	48.4	64%	0.639	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-5.3	173.3	0	0	0	0	0	114.6	S443 L444	S443-G446 PolarHBondContact O-N 2.95Å; L444-G446 PolarHBondContact O-N 3.32Å
447	H	94.8	Very high	93.1	Very high	29 Å²	29	50 Å²	50	13%	0.134	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	12.3	177.8	-57.4	-24.6	0	0	0	112.5	S244 L247 L248 I370 L444 S445	S244-H447 WeakPolarHBondContact CB-O 3.33Å; L247-H447 HydrophobicContact CB-CB 4.12Å; L248-H447 HydrophobicContact CB-CB 3.88Å; I370-H447 VanDerWaalsContact CD1-NE2 3.26Å; I370-H447 WeakPolarHBondContact CD1-NE2 3.23Å; L444-H447 PolarHBondContact O-N 2.9Å; S445-H447 PolarHBondContact O-N 2.85Å
448	A	90.6	Very high	93	Very high	12 Å²	12	49.5 Å²	49.5	10%	0.099	28%	0.278	C	S	.	.			trans	-58.8	134.5	-178.3	0	0	0	0	0	113.6	Q398 L444 S445 Y454	Q398-A448 WeakPolarHBondContact CG-O 3.25Å; Q398-A448 PolarHBondContact NE2-O 2.98Å; L444-A448 PolarHBondContact O-N 3.49Å; S445-A448 VanDerWaalsContact O-CB 3.31Å; S445-A448 WeakPolarHBondContact O-CB 3.04Å; S445-A448 PolarHBondContact O-N 2.77Å; A448-Y454 HydrophobicContact CB-CD1 4.15Å; A448-Y454 HydrophobicContact CB-CD2 4.43Å; A448-Y454 HydrophobicContact CB-CE1 3.56Å; A448-Y454 HydrophobicContact CB-CE2 3.86Å; A448-Y454 VanDerWaalsContact CB-CZ 3.4Å
449	P	92.4	Very high	92.9	Very high	3 Å²	3	49.6 Å²	49.6	2%	0.019	28%	0.276	C	S	.	.			trans	-70.9	169.6	164.9	33.6	-35.8	0	0	0	111.2	D399 L402 Y454	D399-P449 HydrophobicContact CB-CB 4.15Å; D399-P449 WeakPolarHBondContact O-CA 3.47Å; D399-P449 WeakPolarHBondContact O-CB 3.36Å; L402-P449 HydrophobicContact CB-CG 4.15Å; P449-Y454 HydrophobicContact CG-CD1 4Å; P449-Y454 HydrophobicContact CG-CG 4.08Å
450	K	92.6	Very high	92.8	Very high	109 Å²	109	54.3 Å²	54.3	47%	0.474	30%	0.297	S	S	.	.	S	Bend	trans	-67.1	-37.4	-174.6	-63.7	165.7	-158.9	148.3	0	113.9	Q398 D399 N400 Q452	Q398-K450 HydrophobicContact CG-CG 4.09Å; Q398-K450 WeakPolarHBondContact O-CE 3.34Å; Q398-K450 PolarHBondContact O-NZ 3.48Å; Q398-K450 VanDerWaalsContact OE1-CG 3.26Å; D399-K450 PolarHBondContact O-N 3.33Å; N400-K450 PolarHBondContact OD1-NZ 3.48Å; K450-Q452 PolarHBondContact O-N 3.35Å
451	D	90.6	Very high	92.7	Very high	82 Å²	82	54.3 Å²	54.3	44%	0.439	30%	0.297	S	S	.	.	S	Bend	trans	-74.3	108.4	178.7	175.8	13.7	0	0	0	111.4	N400 F401 A453 Y454	N400-D451 WeakPolarHBondContact O-CB 3.21Å; N400-D451 PolarHBondContact O-N 2.9Å; F401-D451 HydrophobicContact CB-CB 4.2Å; D451-A453 PolarHBondContact O-N 2.95Å; D451-A453 WeakPolarHBondContact OD1-CB 3.46Å; D451-A453 PolarHBondContact OD1-N 3.34Å; D451-Y454 WeakPolarHBondContact O-CD1 3.43Å; D451-Y454 PolarHBondContact O-N 3.15Å; D451-Y454 VanDerWaalsContact O-N 3.11Å
452	Q	88.2	Confident	92.6	Very high	157 Å²	157	52 Å²	52	73%	0.734	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-12.6	-179	-65.1	-176.8	-9.2	0	0	114.6	K450 Y454 S455	K450-Q452 PolarHBondContact O-N 3.35Å; Q452-Y454 PolarHBondContact O-N 3.13Å; Q452-Y454 VanDerWaalsContact O-N 3.1Å; Q452-S455 WeakPolarHBondContact O-CB 3.38Å; Q452-S455 PolarHBondContact O-N 3Å; Q452-S455 PolarHBondContact O-OG 3.35Å
453	A	87.6	Confident	92.5	Very high	40 Å²	40	54.8 Å²	54.8	33%	0.331	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-23	169.6	0	0	0	0	0	113.3	D451 S455 Q456 I457	D451-A453 PolarHBondContact O-N 2.95Å; D451-A453 WeakPolarHBondContact OD1-CB 3.46Å; D451-A453 PolarHBondContact OD1-N 3.34Å; A453-S455 PolarHBondContact O-N 2.73Å; A453-S455 VanDerWaalsContact O-N 3.13Å; A453-Q456 PolarHBondContact O-N 3.29Å; A453-I457 PolarHBondContact O-N 3.01Å
454	Y	89.3	Confident	92.4	Very high	54 Å²	54	57.2 Å²	57.2	21%	0.212	31%	0.309	C	S	.	.	H	α-helix	trans	-52.7	-33.4	172.1	82.7	-101.6	0	0	0	112.4	A448 P449 D451 Q452 Q456 I457 L458	A448-Y454 HydrophobicContact CB-CD1 4.15Å; A448-Y454 HydrophobicContact CB-CD2 4.43Å; A448-Y454 HydrophobicContact CB-CE1 3.56Å; A448-Y454 HydrophobicContact CB-CE2 3.86Å; A448-Y454 VanDerWaalsContact CB-CZ 3.4Å; P449-Y454 HydrophobicContact CG-CD1 4Å; P449-Y454 HydrophobicContact CG-CG 4.08Å; D451-Y454 WeakPolarHBondContact O-CD1 3.43Å; D451-Y454 PolarHBondContact O-N 3.15Å; D451-Y454 VanDerWaalsContact O-N 3.11Å; Q452-Y454 PolarHBondContact O-N 3.13Å; Q452-Y454 VanDerWaalsContact O-N 3.1Å; Y454-Q456 PolarHBondContact O-N 3.4Å; Y454-I457 PolarHBondContact O-N 2.87Å; Y454-L458 HydrophobicContact CD2-CD1 3.7Å; Y454-L458 HydrophobicContact CD2-CG 4.24Å; Y454-L458 HydrophobicContact CE2-CD1 4.18Å; Y454-L458 WeakPolarHBondContact O-CG 3.4Å; Y454-L458 PolarHBondContact O-N 3.42Å
455	S	89.4	Confident	92.1	Very high	54 Å²	54	57.3 Å²	57.3	38%	0.378	31%	0.309	S	S	.	.	H	α-helix	trans	-62.3	-46.8	-174.5	58.9	0	0	0	0	112.4	Q452 A453 I457 L458 E459	Q452-S455 WeakPolarHBondContact O-CB 3.38Å; Q452-S455 PolarHBondContact O-N 3Å; Q452-S455 PolarHBondContact O-OG 3.35Å; A453-S455 PolarHBondContact O-N 2.73Å; A453-S455 VanDerWaalsContact O-N 3.13Å; S455-I457 VanDerWaalsContact C-N 3.31Å; S455-I457 PolarHBondContact O-N 2.8Å; S455-L458 PolarHBondContact O-N 2.84Å; S455-E459 WeakPolarHBondContact O-CG 3.49Å; S455-E459 PolarHBondContact O-N 2.96Å
456	Q	90.4	Very high	91.7	Very high	159 Å²	159	56.8 Å²	56.8	74%	0.743	30%	0.301	S	S	*	.	H	α-helix	trans	-66.4	-35.5	178.1	-60.6	179.8	7.1	0	0	111.6	A453 Y454 H460	A453-Q456 PolarHBondContact O-N 3.29Å; Y454-Q456 PolarHBondContact O-N 3.4Å; Q456-H460 PolarHBondContact O-N 3.27Å
457	I	90.8	Very high	91.2	Very high	54 Å²	54	59.2 Å²	59.2	28%	0.277	30%	0.299	S	S	.	.	H	α-helix	trans	-67.9	-47	177.1	-62.6	169.1	0	0	0	110.6	L402 L407 A453 Y454 S455 H460 V461	L402-I457 HydrophobicContact CD2-CB 4.18Å; L402-I457 HydrophobicContact CD2-CD1 4.49Å; L402-I457 HydrophobicContact CD2-CG2 3.69Å; L407-I457 HydrophobicContact CD1-CG2 3.54Å; L407-I457 HydrophobicContact CD2-CG2 3.71Å; L407-I457 HydrophobicContact CG-CG2 4.12Å; A453-I457 PolarHBondContact O-N 3.01Å; Y454-I457 PolarHBondContact O-N 2.87Å; S455-I457 VanDerWaalsContact C-N 3.31Å; S455-I457 PolarHBondContact O-N 2.8Å; I457-H460 WeakPolarHBondContact O-CB 3.47Å; I457-H460 PolarHBondContact O-N 2.83Å; I457-V461 PolarHBondContact O-N 3.17Å
458	L	93.8	Very high	89.9	Confident	4 Å²	4	58.6 Å²	58.6	2%	0.021	30%	0.297	C	S	.	.	H	α-helix	trans	-65.5	-39.1	177.7	-68	-174.2	0	0	0	111.8	L248 L402 M410 Y454 S455 H460 V461 Y462	L248-L458 HydrophobicContact CD1-CD1 4.42Å; L248-L458 HydrophobicContact CD2-CD2 4.35Å; L402-L458 HydrophobicContact CD2-CD2 4.26Å; M410-L458 HydrophobicContact CE-CD2 3.59Å; M410-L458 HydrophobicContact SD-CD2 4.06Å; Y454-L458 HydrophobicContact CD2-CD1 3.7Å; Y454-L458 HydrophobicContact CD2-CG 4.24Å; Y454-L458 HydrophobicContact CE2-CD1 4.18Å; Y454-L458 WeakPolarHBondContact O-CG 3.4Å; Y454-L458 PolarHBondContact O-N 3.42Å; S455-L458 PolarHBondContact O-N 2.84Å; L458-H460 VanDerWaalsContact C-N 3.26Å; L458-H460 PolarHBondContact O-N 2.86Å; L458-V461 PolarHBondContact O-N 3.38Å; L458-Y462 VanDerWaalsContact C-CD2 3.49Å; L458-Y462 HydrophobicContact CB-CD2 4.31Å; L458-Y462 HydrophobicContact CB-CE2 3.62Å; L458-Y462 WeakPolarHBondContact O-CD2 3.48Å; L458-Y462 PolarHBondContact O-N 3.14Å
459	E	94.1	Very high	88.2	Confident	78 Å²	78	66.1 Å²	66.1	36%	0.364	33%	0.33	S	S	.	.	H	α-helix	trans	-60	-34.3	172.4	-74.1	-58.8	150.7	0	0	112.6	K441 S455 Y462 N463	K441-E459 IonicContact NZ-OE1 3.42Å; K441-E459 PolarHBondContact NZ-OE1 2.77Å; K441-E459 IonicContact NZ-OE2 2.83Å; K441-E459 PolarHBondContact NZ-OE2 3.3Å; S455-E459 WeakPolarHBondContact O-CG 3.49Å; S455-E459 PolarHBondContact O-N 2.96Å; E459-Y462 PolarHBondContact O-N 3.04Å; E459-N463 PolarHBondContact O-N 3.04Å; E459-N463 PolarHBondContact O-ND2 3.34Å
460	H	93.3	Very high	88	Confident	99 Å²	99	69.3 Å²	69.3	46%	0.458	35%	0.345	S	S	.	.	H	α-helix	trans	-60.5	-48.1	170.1	-172.7	82.4	0	0	0	111.5	Q456 I457 L458 Y462 N463 Q464	Q456-H460 PolarHBondContact O-N 3.27Å; I457-H460 WeakPolarHBondContact O-CB 3.47Å; I457-H460 PolarHBondContact O-N 2.83Å; L458-H460 VanDerWaalsContact C-N 3.26Å; L458-H460 PolarHBondContact O-N 2.86Å; H460-Y462 PolarHBondContact O-N 3.49Å; H460-N463 PolarHBondContact O-N 3.21Å; H460-Q464 PolarHBondContact CE1-NE2 3.13Å; H460-Q464 PolarHBondContact NE2-NE2 3.09Å; H460-Q464 WeakPolarHBondContact O-CG 3.4Å; H460-Q464 PolarHBondContact O-N 3.43Å; H460-Q464 VanDerWaalsContact O-N 3.14Å
461	V	95.2	Very high	87.8	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-62.2	-41.8	178.9	-177.3	0	0	0	0	111.8	F252 L407 M410 M411 V414 I457 L458 N463 Q464 L465	F252-V461 HydrophobicContact CE2-CG1 3.61Å; F252-V461 HydrophobicContact CZ-CG1 3.52Å; L407-V461 HydrophobicContact CD1-CG2 3.69Å; M410-V461 HydrophobicContact CB-CG1 4.49Å; M410-V461 HydrophobicContact CE-CG1 4.09Å; M410-V461 HydrophobicContact CE-CG2 4.49Å; M411-V461 HydrophobicContact SD-CG2 4.25Å; V414-V461 HydrophobicContact CG2-CG1 4.02Å; I457-V461 PolarHBondContact O-N 3.17Å; L458-V461 PolarHBondContact O-N 3.38Å; V461-N463 PolarHBondContact O-N 3.22Å; V461-Q464 WeakPolarHBondContact O-CB 3.47Å; V461-Q464 PolarHBondContact O-N 3.14Å; V461-Q464 VanDerWaalsContact O-N 3.16Å; V461-L465 PolarHBondContact O-N 3.24Å; V461-L465 VanDerWaalsContact O-N 3.1Å
462	Y	95.2	Very high	87.6	Confident	8 Å²	8	66.3 Å²	66.3	3%	0.031	33%	0.333	C	S	.	.	H	α-helix	trans	-64.3	-38.8	177.3	-58.5	-42.1	0	0	0	112.5	M437 K441 L444 L458 E459 H460 Q464 L465 I466	M437-Y462 HydrophobicContact SD-CD1 4.15Å; M437-Y462 HydrophobicContact SD-CG 4.17Å; K441-Y462 HydrophobicContact CB-CE2 4.48Å; K441-Y462 HydrophobicContact CD-CD2 4.07Å; K441-Y462 HydrophobicContact CD-CE2 4.26Å; K441-Y462 VanDerWaalsContact CE-CD2 3.42Å; K441-Y462 HydrophobicContact CG-CD1 4.29Å; K441-Y462 HydrophobicContact CG-CD2 3.81Å; K441-Y462 HydrophobicContact CG-CE1 4.15Å; K441-Y462 HydrophobicContact CG-CE2 3.65Å; K441-Y462 HydrophobicContact CG-CG 4.16Å; L444-Y462 HydrophobicContact CD1-CE1 4.16Å; L458-Y462 VanDerWaalsContact C-CD2 3.49Å; L458-Y462 HydrophobicContact CB-CD2 4.31Å; L458-Y462 HydrophobicContact CB-CE2 3.62Å; L458-Y462 WeakPolarHBondContact O-CD2 3.48Å; L458-Y462 PolarHBondContact O-N 3.14Å; E459-Y462 PolarHBondContact O-N 3.04Å; H460-Y462 PolarHBondContact O-N 3.49Å; Y462-Q464 VanDerWaalsContact C-N 3.3Å; Y462-Q464 PolarHBondContact O-N 3.27Å; Y462-L465 PolarHBondContact O-N 3.06Å; Y462-I466 WeakPolarHBondContact O-CG1 3.43Å; Y462-I466 PolarHBondContact O-N 3.31Å
463	N	93.9	Very high	87.6	Confident	77 Å²	77	61 Å²	61	41%	0.412	31%	0.31	S	S	.	.	H	α-helix	trans	-63.5	-35.9	173.5	-79.2	-70.1	0	0	0	111.9	E459 H460 V461 I466 N467	E459-N463 PolarHBondContact O-N 3.04Å; E459-N463 PolarHBondContact O-ND2 3.34Å; H460-N463 PolarHBondContact O-N 3.21Å; V461-N463 PolarHBondContact O-N 3.22Å; N463-I466 PolarHBondContact O-N 2.89Å; N463-N467 WeakPolarHBondContact O-CB 3.42Å; N463-N467 PolarHBondContact O-N 3.25Å; N463-N467 VanDerWaalsContact O-N 3.08Å; N463-N467 PolarHBondContact O-ND2 3.3Å; N463-N467 VanDerWaalsContact O-ND2 3.11Å
464	Q	93.5	Very high	87.6	Confident	54 Å²	54	62.3 Å²	62.3	25%	0.252	31%	0.308	S	S	.	.	H	α-helix	trans	-64.7	-41.1	173.9	-59.6	-69.3	-2.1	0	0	111.8	M411 V414 H460 V461 Y462 I466 N467 T468	M411-Q464 HydrophobicContact CE-CG 4.09Å; M411-Q464 HydrophobicContact SD-CG 4.35Å; V414-Q464 HydrophobicContact CG1-CB 4.02Å; H460-Q464 PolarHBondContact CE1-NE2 3.13Å; H460-Q464 PolarHBondContact NE2-NE2 3.09Å; H460-Q464 WeakPolarHBondContact O-CG 3.4Å; H460-Q464 PolarHBondContact O-N 3.43Å; H460-Q464 VanDerWaalsContact O-N 3.14Å; V461-Q464 WeakPolarHBondContact O-CB 3.47Å; V461-Q464 PolarHBondContact O-N 3.14Å; V461-Q464 VanDerWaalsContact O-N 3.16Å; Y462-Q464 VanDerWaalsContact C-N 3.3Å; Y462-Q464 PolarHBondContact O-N 3.27Å; Q464-I466 VanDerWaalsContact C-N 3.29Å; Q464-I466 PolarHBondContact O-N 2.89Å; Q464-N467 PolarHBondContact O-N 3.07Å; Q464-T468 WeakPolarHBondContact O-CG2 3.47Å; Q464-T468 PolarHBondContact O-N 3.43Å
465	L	91.3	Very high	87.5	Confident	2 Å²	2	62.9 Å²	62.9	1%	0.01	32%	0.315	C	S	.	.	H	α-helix	trans	-67.1	-23.7	175.3	-71.7	176.8	0	0	0	114.4	F252 L256 V414 F426 M437 I440 V461 Y462 T468	F252-L465 HydrophobicContact CE2-CD1 3.78Å; F252-L465 HydrophobicContact CZ-CD1 4.18Å; L256-L465 HydrophobicContact CD2-CD1 3.99Å; L256-L465 HydrophobicContact CD2-CD2 3.84Å; V414-L465 HydrophobicContact CB-CD2 4.46Å; V414-L465 HydrophobicContact CG1-CD2 4.2Å; V414-L465 HydrophobicContact CG2-CD2 3.82Å; V414-L465 HydrophobicContact CG2-CG 4.1Å; F426-L465 HydrophobicContact CD2-CB 4.07Å; F426-L465 HydrophobicContact CE1-CD1 4.36Å; F426-L465 HydrophobicContact CE2-CB 3.99Å; F426-L465 HydrophobicContact CE2-CD1 4.21Å; F426-L465 HydrophobicContact CE2-CD2 3.79Å; F426-L465 HydrophobicContact CE2-CG 4.22Å; F426-L465 HydrophobicContact CZ-CD1 3.96Å; F426-L465 HydrophobicContact CZ-CD2 4.09Å; F426-L465 HydrophobicContact CZ-CG 4.45Å; M437-L465 HydrophobicContact CE-CB 4.21Å; I440-L465 HydrophobicContact CD1-CD1 4.36Å; V461-L465 PolarHBondContact O-N 3.24Å; V461-L465 VanDerWaalsContact O-N 3.1Å; Y462-L465 PolarHBondContact O-N 3.06Å; L465-T468 PolarHBondContact O-OG1 2.68Å; L465-T468 VanDerWaalsContact O-OG1 3.09Å
466	I	86.9	Confident	87.3	Confident	56 Å²	56	63.5 Å²	63.5	29%	0.287	31%	0.31	S	S	.	.	H	α-helix	trans	-76.8	-39.1	172	-71.1	166.9	0	0	0	110.1	M437 Y462 N463 Q464 T468	M437-I466 HydrophobicContact CE-CD1 4.28Å; M437-I466 HydrophobicContact CE-CG1 3.85Å; Y462-I466 WeakPolarHBondContact O-CG1 3.43Å; Y462-I466 PolarHBondContact O-N 3.31Å; N463-I466 PolarHBondContact O-N 2.89Å; Q464-I466 VanDerWaalsContact C-N 3.29Å; Q464-I466 PolarHBondContact O-N 2.89Å; I466-T468 VanDerWaalsContact C-N 3.29Å; I466-T468 PolarHBondContact O-N 2.58Å
467	N	81.1	Confident	87.1	Confident	113 Å²	113	56.2 Å²	56.2	60%	0.604	28%	0.277	S	S	*	.	S	Bend	trans	-82.2	10.3	-176.3	-64.5	-25.1	0	0	0	114.7	N463 Q464 H469	N463-N467 WeakPolarHBondContact O-CB 3.42Å; N463-N467 PolarHBondContact O-N 3.25Å; N463-N467 VanDerWaalsContact O-N 3.08Å; N463-N467 PolarHBondContact O-ND2 3.3Å; N463-N467 VanDerWaalsContact O-ND2 3.11Å; Q464-N467 PolarHBondContact O-N 3.07Å; N467-H469 VanDerWaalsContact C-N 3.26Å; N467-H469 PolarHBondContact O-N 3.27Å
468	T	67.8	Low	86.8	Confident	16 Å²	16	56.3 Å²	56.3	10%	0.098	28%	0.277	C	S	.	.			trans	-86	19.4	175	48.5	0	0	0	0	114.4	V414 R418 Q464 L465 I466	V414-T468 HydrophobicContact CG1-CG2 4.29Å; R418-T468 HydrophobicContact CB-CG2 3.88Å; R418-T468 HydrophobicContact CG-CG2 3.67Å; Q464-T468 WeakPolarHBondContact O-CG2 3.47Å; Q464-T468 PolarHBondContact O-N 3.43Å; L465-T468 PolarHBondContact O-OG1 2.68Å; L465-T468 VanDerWaalsContact O-OG1 3.09Å; I466-T468 VanDerWaalsContact C-N 3.29Å; I466-T468 PolarHBondContact O-N 2.58Å
469	H	55.3	Low	86.1	Confident	169 Å²	169	61.1 Å²	61.1	78%	0.782	30%	0.3	S	S	*	.			trans	-136.3	0	-179.9	-72.1	-34.5	0	0	0	112.1	N467	N467-H469 VanDerWaalsContact C-N 3.26Å; N467-H469 PolarHBondContact O-N 3.27Å

Retrieved 469 of 469 residues in 1118.5 ms (Link to these results)

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