A0A096NMU9_PAPAN Loading...

Leucine rich repeat and Ig domain containing 1

AlphaFold DB (A0A2K5MAW6), UniProt , Accession A0A096NMU9, Species PAPAN (Papio anubis, Olive baboon), Gene LINGO1, Length 620 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.9	Very low	30.9	Very low	239 Å²	239	140.6 Å²	140.6	100%	1.177	80%	0.804	S	S	*	*				0	120.9	0	-96	168.2	162	0	0	108.2
2	Q	31.3	Very low	30.9	Very low	176 Å²	176	141 Å²	141	82%	0.822	81%	0.81	S	S	*	*			trans	52.1	106.2	161.9	-76	167.3	-33.9	0	0	118.9
3	V	27.9	Very low	30.7	Very low	132 Å²	132	148.4 Å²	148.4	80%	0.8	82%	0.816	S	S	*	*				70.8	98.1	79.8	175.2	0	0	0	0	109.3
4	S	30.6	Very low	30.7	Very low	104 Å²	104	146.6 Å²	146.6	73%	0.727	82%	0.819	S	S	*	*				81.9	129.8	84.1	-162.1	0	0	0	0	112.5
5	E	33.5	Very low	31	Very low	146 Å²	146	148.7 Å²	148.7	68%	0.682	82%	0.823	S	S	*	*			trans	170	142.1	131.1	-89.5	-166.3	158.5	0	0	106.6
6	R	31.5	Very low	31.7	Very low	192 Å²	192	145.6 Å²	145.6	73%	0.725	81%	0.812	S	S	*	*			cis	-169.3	132.5	-6	-109.5	165.2	175.9	172.4	-3.9	103
7	M	30.1	Very low	32.1	Very low	162 Å²	162	143.5 Å²	143.5	80%	0.798	81%	0.809	S	S	*	*				55.8	120.6	91.2	-97	-166.2	-164.3	0	0	112
8	L	32.6	Very low	32.8	Very low	156 Å²	156	141.7 Å²	141.7	82%	0.817	81%	0.805	S	S	*	*				171.4	168.2	56.9	-88.6	145	0	0	0	104.7
9	A	30.1	Very low	33	Very low	90 Å²	90	143.1 Å²	143.1	74%	0.744	81%	0.809	S	S	*	*			cis	177.7	166.6	-7.9	0	0	0	0	0	106.9
10	G	28.6	Very low	33.5	Very low	76 Å²	76	144.3 Å²	144.3	78%	0.784	81%	0.812	S	S	*	*			trans	115.2	100.3	162.8	0	0	0	0	0	111.7
11	G	28.3	Very low	34.2	Very low	74 Å²	74	142.3 Å²	142.3	76%	0.763	81%	0.814	S	S	*	*				78.7	120.5	66.7	0	0	0	0	0	107.5
12	V	30.2	Very low	34.9	Very low	145 Å²	145	135.3 Å²	135.3	88%	0.879	79%	0.787	S	S	*	*			cis	-164.7	156.7	42	163.5	0	0	0	0	109.1
13	R	29.1	Very low	35.7	Very low	237 Å²	237	136 Å²	136	89%	0.894	78%	0.783	S	S	*	*			trans	-40.7	143.8	175.2	-63.7	165.3	170.7	170.1	-4.5	118
14	S	30.3	Very low	36.7	Very low	123 Å²	123	137.8 Å²	137.8	86%	0.86	78%	0.782	S	S	*	*				-159.5	129.9	121.5	55.2	0	0	0	0	112.6
15	M	34.7	Very low	37.8	Very low	178 Å²	178	136.7 Å²	136.7	88%	0.877	77%	0.772	S	S	*	*			trans	-74.6	-177.1	172.2	-75.5	172.9	109.5	0	0	111.6
16	P	42.5	Very low	38.8	Very low	99 Å²	99	134 Å²	134	64%	0.643	76%	0.762	S	S	*	*				-136.4	150.9	-50.8	36.9	-20.6	0	0	0	113.7
17	S	38.7	Very low	39.8	Very low	110 Å²	110	130.5 Å²	130.5	77%	0.769	76%	0.757	S	S	*	*			trans	59.2	165	144.4	66.6	0	0	0	0	121
18	P	43.9	Very low	40.9	Very low	112 Å²	112	129.1 Å²	129.1	73%	0.727	75%	0.752	S	S	*	*			cis	-135.9	97.4	-19	30.5	-7.5	0	0	0	111.5
19	L	37.7	Very low	41.9	Very low	167 Å²	167	127.8 Å²	127.8	87%	0.874	75%	0.745	S	S	*	*			trans	-150.8	79.9	172.8	-75	177.1	0	0	0	109.9
20	L	43	Very low	43	Very low	168 Å²	168	127.1 Å²	127.1	88%	0.88	73%	0.732	S	S	*	*			trans	-171.1	45.1	165.3	-102.6	149.6	0	0	0	112.2
21	A	48	Very low	43.9	Very low	102 Å²	102	128.6 Å²	128.6	84%	0.843	72%	0.721	S	S	*	*			trans	-120.2	39.5	174.9	0	0	0	0	0	112.5
22	C	49.7	Very low	44.8	Very low	92 Å²	92	127 Å²	127	62%	0.622	70%	0.704	S	S	*	*	S	Bend	trans	-132.7	6	178.2	-101.4	0	0	0	0	115.7
23	W	49	Very low	45.6	Very low	192 Å²	192	123.1 Å²	123.1	73%	0.727	68%	0.684	S	S	*	*	S	Bend	trans	-116.6	2.7	-173.5	-75.6	74.7	0	0	0	115.3
24	Q	48.9	Very low	46.3	Very low	168 Å²	168	117.2 Å²	117.2	79%	0.785	67%	0.674	S	S	*	*	H	α-helix	trans	-86.5	-26.7	171.9	-84.9	176.9	-33.4	0	0	116
25	P	53	Low	46.9	Very low	81 Å²	81	119 Å²	119	53%	0.526	67%	0.672	S	S	.	*	H	α-helix	trans	-80.9	-21.7	176.1	27.5	-24	0	0	0	112.3	L29	P25-L29 WeakPolarHBondContact O-CB 3.49Å; P25-L29 PolarHBondContact O-N 2.89Å; P25-L29 VanDerWaalsContact O-N 3.14Å
26	I	55.7	Low	47.4	Very low	89 Å²	89	114.1 Å²	114.1	46%	0.456	66%	0.656	S	S	.	*	H	α-helix	trans	-78.1	-37.7	-179.3	-57.8	173.2	0	0	0	110.8	L28 L29 V30	I26-L28 PolarHBondContact O-N 2.85Å; I26-L29 PolarHBondContact O-N 3.41Å; I26-V30 HydrophobicContact CG2-CG2 4.45Å; I26-V30 WeakPolarHBondContact O-CB 3.45Å; I26-V30 VanDerWaalsContact O-CG2 3.25Å; I26-V30 WeakPolarHBondContact O-CG2 3.25Å; I26-V30 PolarHBondContact O-N 3.14Å
27	L	51.3	Low	47.2	Very low	119 Å²	119	112.5 Å²	112.5	62%	0.623	66%	0.657	S	S	*	*	H	α-helix	trans	-70.1	-32.1	178.1	-155.2	83	0	0	0	112.5	V30 L31	L27-V30 PolarHBondContact O-N 3.33Å; L27-L31 HydrophobicContact CG-CD1 4.32Å; L27-L31 WeakPolarHBondContact O-CD1 3.33Å; L27-L31 PolarHBondContact O-N 2.72Å
28	L	54.1	Low	47.3	Very low	133 Å²	133	112.1 Å²	112.1	70%	0.696	66%	0.655	S	S	*	*	H	α-helix	trans	-75	-32.2	172.7	-89.6	158.9	0	0	0	112.8	I26 G32	I26-L28 PolarHBondContact O-N 2.85Å; L28-G32 PolarHBondContact O-N 3.5Å
29	L	53.8	Low	47.5	Very low	129 Å²	129	110.8 Å²	110.8	68%	0.675	65%	0.653	S	S	*	*	H	α-helix	trans	-69.5	-34.3	169.9	-108.5	140.3	0	0	0	111.8	P25 I26 S33	P25-L29 WeakPolarHBondContact O-CB 3.49Å; P25-L29 PolarHBondContact O-N 2.89Å; P25-L29 VanDerWaalsContact O-N 3.14Å; I26-L29 PolarHBondContact O-N 3.41Å; L29-S33 VanDerWaalsContact O-CB 3.25Å; L29-S33 WeakPolarHBondContact O-CB 3.45Å; L29-S33 PolarHBondContact O-N 3.29Å; L29-S33 PolarHBondContact O-OG 3.47Å
30	V	53	Low	48.5	Very low	76 Å²	76	109 Å²	109	46%	0.461	65%	0.65	S	S	.	*	H	α-helix	trans	-74.4	-41.6	175.6	175.4	0	0	0	0	111.3	I26 L27 S33 V34	I26-V30 HydrophobicContact CG2-CG2 4.45Å; I26-V30 WeakPolarHBondContact O-CB 3.45Å; I26-V30 VanDerWaalsContact O-CG2 3.25Å; I26-V30 WeakPolarHBondContact O-CG2 3.25Å; I26-V30 PolarHBondContact O-N 3.14Å; L27-V30 PolarHBondContact O-N 3.33Å; V30-S33 VanDerWaalsContact CA-OG 3.32Å; V30-S33 WeakPolarHBondContact CA-OG 3.26Å; V30-S33 PolarHBondContact O-N 2.91Å; V30-S33 PolarHBondContact O-OG 3.03Å; V30-V34 VanDerWaalsContact O-CG2 3.26Å; V30-V34 WeakPolarHBondContact O-CG2 3.32Å; V30-V34 PolarHBondContact O-N 3.22Å
31	L	47.7	Very low	49.7	Very low	107 Å²	107	102.3 Å²	102.3	56%	0.56	62%	0.62	S	S	*	*	H	α-helix	trans	-69.1	-31.4	171.8	-97.8	103.8	0	0	0	113.5	L27 S33 V34 L35	L27-L31 HydrophobicContact CG-CD1 4.32Å; L27-L31 WeakPolarHBondContact O-CD1 3.33Å; L27-L31 PolarHBondContact O-N 2.72Å; L31-S33 VanDerWaalsContact C-N 3.34Å; L31-V34 PolarHBondContact O-N 3.5Å; L31-L35 PolarHBondContact O-N 2.89Å
32	G	46.9	Very low	51.5	Low	40 Å²	40	99.6 Å²	99.6	41%	0.412	60%	0.595	S	S	.	*	H	α-helix	trans	-65.4	-37.8	169	0	0	0	0	0	112.2	L28 L35 S36	L28-G32 PolarHBondContact O-N 3.5Å; G32-L35 PolarHBondContact O-N 3.18Å; G32-S36 PolarHBondContact O-N 3.45Å; G32-S36 PolarHBondContact O-OG 3.16Å
33	S	47.3	Very low	53.4	Low	64 Å²	64	95.3 Å²	95.3	45%	0.448	57%	0.566	S	S	.	*	H	α-helix	trans	-73.3	-22.6	177.3	72.9	0	0	0	0	114.3	L29 V30 L31 S36	L29-S33 VanDerWaalsContact O-CB 3.25Å; L29-S33 WeakPolarHBondContact O-CB 3.45Å; L29-S33 PolarHBondContact O-N 3.29Å; L29-S33 PolarHBondContact O-OG 3.47Å; V30-S33 VanDerWaalsContact CA-OG 3.32Å; V30-S33 WeakPolarHBondContact CA-OG 3.26Å; V30-S33 PolarHBondContact O-N 2.91Å; V30-S33 PolarHBondContact O-OG 3.03Å; L31-S33 VanDerWaalsContact C-N 3.34Å; S33-S36 WeakPolarHBondContact CA-OG 3.25Å; S33-S36 PolarHBondContact O-OG 3.29Å
34	V	43.8	Very low	55.1	Low	113 Å²	113	92.6 Å²	92.6	69%	0.685	57%	0.573	S	S	*	*	H	α-helix	trans	-83.6	-19.7	176.9	173.6	0	0	0	0	112.1	V30 L31	V30-V34 VanDerWaalsContact O-CG2 3.26Å; V30-V34 WeakPolarHBondContact O-CG2 3.32Å; V30-V34 PolarHBondContact O-N 3.22Å; L31-V34 PolarHBondContact O-N 3.5Å
35	L	42.2	Very low	57.1	Low	159 Å²	159	92.5 Å²	92.5	83%	0.832	57%	0.566	S	S	*	*	H	α-helix	trans	-92.6	-17.8	171.1	-80.2	159.4	0	0	0	113.4	L31 G32 G37	L31-L35 PolarHBondContact O-N 2.89Å; G32-L35 PolarHBondContact O-N 3.18Å; L35-G37 VanDerWaalsContact C-N 3.29Å; L35-G37 PolarHBondContact O-N 3.27Å
36	S	44.3	Very low	59	Low	77 Å²	77	89.5 Å²	89.5	54%	0.538	55%	0.546	S	S	.	.	S	Bend	trans	-89.8	70.3	163.5	57.3	0	0	0	0	109.4	G32 S33 S38	G32-S36 PolarHBondContact O-N 3.45Å; G32-S36 PolarHBondContact O-OG 3.16Å; S33-S36 WeakPolarHBondContact CA-OG 3.25Å; S33-S36 PolarHBondContact O-OG 3.29Å; S36-S38 PolarHBondContact O-N 2.77Å
37	G	38.3	Very low	60.8	Low	64 Å²	64	92.2 Å²	92.2	66%	0.66	56%	0.557	S	S	*	*			trans	-49	118.9	159.6	0	0	0	0	0	107.6	L35 A39	L35-G37 VanDerWaalsContact C-N 3.29Å; L35-G37 PolarHBondContact O-N 3.27Å; G37-A39 VanDerWaalsContact C-N 3.33Å; G37-A39 PolarHBondContact O-N 3.05Å
38	S	42	Very low	62.8	Low	102 Å²	102	88.7 Å²	88.7	71%	0.713	54%	0.542	S	S	*	.			trans	-57.3	90.3	-175.3	47.1	0	0	0	0	111.1	S36 T40	S36-S38 PolarHBondContact O-N 2.77Å; S38-T40 PolarHBondContact O-N 3.11Å; S38-T40 VanDerWaalsContact O-N 3.08Å
39	A	46.8	Very low	64.7	Low	84 Å²	84	84.2 Å²	84.2	69%	0.694	52%	0.522	S	S	*	.			trans	-78.8	59.5	161.3	0	0	0	0	0	108.8	G37 G41	G37-A39 VanDerWaalsContact C-N 3.33Å; G37-A39 PolarHBondContact O-N 3.05Å; A39-G41 VanDerWaalsContact C-N 3.28Å; A39-G41 PolarHBondContact O-N 3.08Å; A39-G41 VanDerWaalsContact O-N 3.11Å
40	T	59.4	Low	66.4	Low	131 Å²	131	82.5 Å²	82.5	80%	0.804	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	75.4	174.5	50.7	0	0	0	0	108.8	S38	S38-T40 PolarHBondContact O-N 3.11Å; S38-T40 VanDerWaalsContact O-N 3.08Å
41	G	67.6	Low	68.1	Low	26 Å²	26	87.5 Å²	87.5	27%	0.268	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	146.5	37.8	175.3	0	0	0	0	0	114.6	A39 G68 P70	A39-G41 VanDerWaalsContact C-N 3.28Å; A39-G41 PolarHBondContact O-N 3.08Å; A39-G41 VanDerWaalsContact O-N 3.11Å; G41-G68 CarbonylContact C-O 3.56Å; G41-P70 WeakPolarHBondContact O-CD 3.46Å; G41-P70 WeakPolarHBondContact O-CG 3.47Å
42	C	85.8	Confident	70.2	Confident	46 Å²	46	87.6 Å²	87.6	31%	0.311	55%	0.545	S	S	.	.			trans	-100.8	131.8	164.5	-176.4	0	0	0	0	108.6	C48 G68	C42-C48 VanDerWaalsContact CA-SG 3.54Å; C42-C48 HydrophobicContact CB-CB 3.74Å; C42-C48 WeakPolarHBondContact CB-SG 3.02Å; C42-C48 WeakPolarHBondContact SG-CB 3.03Å; C42-C48 CovalentContact SG-SG 2.03Å; C42-C48 PolarHBondContact SG-SG 2.03Å; C42-G68 CarbonylContact C-O 3.55Å
43	P	90.3	Very high	72.4	Confident	2 Å²	2	91 Å²	91	1%	0.013	55%	0.546	C	S	.	.			trans	-60	136.3	176.6	-18.9	29.5	0	0	0	109.7	R45 C46 V55 P66 G68 I69	P43-R45 PolarHBondContact O-N 2.77Å; P43-C46 HydrophobicContact CB-CB 4.06Å; P43-C46 HydrophobicContact CG-CB 4.21Å; P43-C46 PolarHBondContact O-N 2.88Å; P43-V55 HydrophobicContact CG-CG1 4.47Å; P43-P66 HydrophobicContact CB-CB 4.34Å; P43-P66 HydrophobicContact CG-CG 4.42Å; P43-G68 WeakPolarHBondContact CD-O 3.08Å; P43-I69 HydrophobicContact CG-CG1 3.76Å
44	P	85	Confident	74.8	Confident	135 Å²	135	88.5 Å²	88.5	88%	0.877	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-15.2	-165.3	21	-32.5	0	0	0	114.9
45	R	90.2	Very high	77.3	Confident	166 Å²	166	83.2 Å²	83.2	63%	0.626	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	-6.7	177.5	-65.1	-174.7	178	172.7	2.7	113.5	P43 K60 F62	P43-R45 PolarHBondContact O-N 2.77Å; R45-K60 HydrophobicContact CB-CD 4.23Å; R45-K60 HydrophobicContact CB-CG 4.36Å; R45-K60 WeakPolarHBondContact O-CD 3.08Å; R45-K60 WeakPolarHBondContact O-CE 3.26Å; R45-K60 PolarHBondContact O-NZ 3.46Å; R45-F62 HydrophobicContact CB-CZ 4.13Å
46	C	94.1	Very high	79.9	Confident	18 Å²	18	78.6 Å²	78.6	12%	0.122	47%	0.473	C	S	.	.	S	Bend	trans	-98.1	162.9	-177.1	-59.7	0	0	0	0	111.2	P43 V55 L56 C57	P43-C46 HydrophobicContact CB-CB 4.06Å; P43-C46 HydrophobicContact CG-CB 4.21Å; P43-C46 PolarHBondContact O-N 2.88Å; C46-V55 HydrophobicContact CB-CG1 4.28Å; C46-L56 WeakPolarHBondContact CA-O 2.9Å; C46-L56 WeakPolarHBondContact CB-O 3.01Å; C46-C57 HydrophobicContact CB-CB 4.15Å; C46-C57 WeakPolarHBondContact CB-SG 3.31Å; C46-C57 WeakPolarHBondContact SG-CB 3.2Å; C46-C57 CovalentContact SG-SG 2.03Å; C46-C57 PolarHBondContact SG-SG 2.86Å
47	E	93.6	Very high	82.3	Confident	145 Å²	145	75 Å²	75	68%	0.678	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106	122.7	173.4	-176.3	171	-170.3	0	0	107.8	L56	E47-L56 HydrophobicContact CB-CB 4.49Å; E47-L56 PolarHBondContact N-O 2.9Å; E47-L56 PolarHBondContact O-N 3.44Å
48	C	93.4	Very high	85	Confident	45 Å²	45	75.3 Å²	75.3	30%	0.304	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	130	-176.6	-52.6	0	0	0	0	110.5	C42 A54 V55	C42-C48 VanDerWaalsContact CA-SG 3.54Å; C42-C48 HydrophobicContact CB-CB 3.74Å; C42-C48 WeakPolarHBondContact CB-SG 3.02Å; C42-C48 WeakPolarHBondContact SG-CB 3.03Å; C42-C48 CovalentContact SG-SG 2.03Å; C42-C48 PolarHBondContact SG-SG 2.03Å; C48-A54 CarbonylContact C-O 3.47Å; C48-A54 VanDerWaalsContact CA-O 3.32Å; C48-A54 WeakPolarHBondContact CA-O 3.47Å; C48-V55 HydrophobicContact CB-CG2 4.41Å
49	S	93.6	Very high	87.4	Confident	39 Å²	39	79.4 Å²	79.4	27%	0.273	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	110.1	169.2	177.7	0	0	0	0	108.9	Q51 D52 R53 A54	S49-Q51 VanDerWaalsContact C-N 3.31Å; S49-D52 PolarHBondContact OG-N 2.8Å; S49-D52 PolarHBondContact OG-OD2 2.84Å; S49-R53 WeakPolarHBondContact O-CA 3.2Å; S49-R53 PolarHBondContact O-N 2.03Å; S49-A54 PolarHBondContact N-O 2.79Å; S49-A54 PolarHBondContact O-N 2.89Å
50	A	88.7	Confident	89.7	Confident	93 Å²	93	79.2 Å²	79.2	77%	0.769	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-29.3	177.3	0	0	0	0	0	112.6
51	Q	89.3	Confident	91.4	Very high	181 Å²	181	81.8 Å²	81.8	85%	0.846	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-44.4	178.5	-66.5	-174.5	-7.5	0	0	111.1	S49	S49-Q51 VanDerWaalsContact C-N 3.31Å
52	D	90.9	Very high	92.7	Very high	109 Å²	109	82.3 Å²	82.3	58%	0.583	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-5.9	-178.2	-51	-51.5	0	0	0	112.7	S49 A54	S49-D52 PolarHBondContact OG-N 2.8Å; S49-D52 PolarHBondContact OG-OD2 2.84Å; D52-A54 HydrophobicContact CB-CB 4.03Å; D52-A54 PolarHBondContact O-N 3.06Å
53	R	94.7	Very high	93.2	Very high	111 Å²	111	84.7 Å²	84.7	42%	0.419	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	44	-171.5	-59.6	168.4	178.7	-98.4	-5.6	110.6	S49 E72 T73 R74 L75	S49-R53 WeakPolarHBondContact O-CA 3.2Å; S49-R53 PolarHBondContact O-N 2.03Å; R53-E72 WeakPolarHBondContact CD-O 3.39Å; R53-E72 PolarHBondContact NH1-O 3.35Å; R53-T73 WeakPolarHBondContact O-CG2 3.46Å; R53-R74 HydrophobicContact CB-CB 4.19Å; R53-R74 HydrophobicContact CB-CG 4.07Å; R53-R74 PolarHBondContact O-N 3.19Å; R53-L75 PolarHBondContact O-N 3.08Å
54	A	96.3	Very high	93.3	Very high	12 Å²	12	87.1 Å²	87.1	10%	0.099	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	138.7	-174.6	0	0	0	0	0	110.8	C48 S49 D52 L75	C48-A54 CarbonylContact C-O 3.47Å; C48-A54 VanDerWaalsContact CA-O 3.32Å; C48-A54 WeakPolarHBondContact CA-O 3.47Å; S49-A54 PolarHBondContact N-O 2.79Å; S49-A54 PolarHBondContact O-N 2.89Å; D52-A54 HydrophobicContact CB-CB 4.03Å; D52-A54 PolarHBondContact O-N 3.06Å; A54-L75 CarbonylContact C-O 3.1Å; A54-L75 WeakPolarHBondContact CA-O 3.32Å; A54-L75 HydrophobicContact CB-CB 4.05Å; A54-L75 HydrophobicContact CB-CD2 4.24Å
55	V	96.4	Very high	93.8	Very high	2 Å²	2	81.6 Å²	81.6	1%	0.012	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	117.3	177.3	178.8	0	0	0	0	109	P43 C46 C48 I69 T73 L75 L76 D77	P43-V55 HydrophobicContact CG-CG1 4.47Å; C46-V55 HydrophobicContact CB-CG1 4.28Å; C48-V55 HydrophobicContact CB-CG2 4.41Å; V55-I69 HydrophobicContact CG2-CG2 4.33Å; V55-T73 HydrophobicContact CB-CG2 4.35Å; V55-T73 HydrophobicContact CG2-CG2 3.89Å; V55-L75 PolarHBondContact N-O 2.9Å; V55-L76 HydrophobicContact CB-CD1 3.89Å; V55-L76 HydrophobicContact CG1-CD1 3.91Å; V55-D77 PolarHBondContact O-N 2.86Å
56	L	96.8	Very high	93.9	Very high	63 Å²	63	74.5 Å²	74.5	33%	0.33	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	116.6	-176.7	-58.5	178.4	0	0	0	110.7	C46 E47 L75 D77	C46-L56 WeakPolarHBondContact CA-O 2.9Å; C46-L56 WeakPolarHBondContact CB-O 3.01Å; E47-L56 HydrophobicContact CB-CB 4.49Å; E47-L56 PolarHBondContact N-O 2.9Å; E47-L56 PolarHBondContact O-N 3.44Å; L56-L75 HydrophobicContact CD2-CD2 3.81Å; L56-D77 HydrophobicContact CD2-CB 3.55Å
57	C	95.6	Very high	93.7	Very high	0 Å²	0	81.9 Å²	81.9	0%	0	41%	0.41	C	S	.	.			trans	-123.4	41.6	-172.1	-67.9	0	0	0	0	112.6	C46 K60 F62 D77 L78 N81	C46-C57 HydrophobicContact CB-CB 4.15Å; C46-C57 WeakPolarHBondContact CB-SG 3.31Å; C46-C57 WeakPolarHBondContact SG-CB 3.2Å; C46-C57 CovalentContact SG-SG 2.03Å; C46-C57 PolarHBondContact SG-SG 2.86Å; C57-K60 WeakPolarHBondContact O-CG 3.45Å; C57-F62 HydrophobicContact CB-CD2 4.28Å; C57-F62 HydrophobicContact CB-CE2 3.94Å; C57-D77 WeakPolarHBondContact CA-O 3.38Å; C57-D77 WeakPolarHBondContact CB-O 3.15Å; C57-D77 PolarHBondContact N-O 2.79Å; C57-L78 HydrophobicContact CB-CD2 3.7Å; C57-N81 PolarHBondContact O-ND2 3.2Å
58	H	94.1	Very high	93.5	Very high	72 Å²	72	76.8 Å²	76.8	33%	0.333	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	135	-176.3	-73.5	90.5	0	0	0	114.5	K60 D77 G79	H58-K60 VanDerWaalsContact O-CD 3.31Å; H58-K60 WeakPolarHBondContact O-CD 3.49Å; H58-K60 WeakPolarHBondContact O-CE 3.5Å; H58-K60 WeakPolarHBondContact O-CG 3.03Å; H58-K60 PolarHBondContact O-N 2.81Å; H58-D77 IonicContact CE1-OD1 3.54Å; H58-D77 IonicContact CE1-OD2 2.88Å; H58-D77 PolarHBondContact CE1-OD2 3.18Å; H58-D77 IonicContact ND1-OD2 3.98Å; H58-D77 IonicContact NE2-OD1 3.6Å; H58-D77 IonicContact NE2-OD2 3.2Å; H58-D77 PolarHBondContact NE2-OD2 3.42Å; H58-G79 WeakPolarHBondContact CA-O 3.45Å
59	R	93.8	Very high	93.5	Very high	188 Å²	188	75.3 Å²	75.3	71%	0.709	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	28.2	170.6	-59.6	178.8	175.5	171.5	-0.5	114.5	K80	R59-K80 VanDerWaalsContact CA-O 3.26Å; R59-K80 WeakPolarHBondContact CA-O 3.49Å; R59-K80 HydrophobicContact CG-CB 3.79Å; R59-K80 HydrophobicContact CG-CD 4.13Å; R59-K80 PolarHBondContact N-O 3.38Å
60	K	94.5	Very high	93.5	Very high	80 Å²	80	74.9 Å²	74.9	35%	0.348	38%	0.382	S	S	.	.	S	Bend	trans	-90.8	-1.1	-177.8	-53.5	-53.9	173.9	153.6	0	113.7	R45 C57 H58 F62 N81	R45-K60 HydrophobicContact CB-CD 4.23Å; R45-K60 HydrophobicContact CB-CG 4.36Å; R45-K60 WeakPolarHBondContact O-CD 3.08Å; R45-K60 WeakPolarHBondContact O-CE 3.26Å; R45-K60 PolarHBondContact O-NZ 3.46Å; C57-K60 WeakPolarHBondContact O-CG 3.45Å; H58-K60 VanDerWaalsContact O-CD 3.31Å; H58-K60 WeakPolarHBondContact O-CD 3.49Å; H58-K60 WeakPolarHBondContact O-CE 3.5Å; H58-K60 WeakPolarHBondContact O-CG 3.03Å; H58-K60 PolarHBondContact O-N 2.81Å; K60-F62 VanDerWaalsContact C-N 3.27Å; K60-F62 HydrophobicContact CB-CD2 3.6Å; K60-F62 HydrophobicContact CB-CE2 3.32Å; K60-F62 HydrophobicContact CB-CG 4.34Å; K60-F62 HydrophobicContact CB-CZ 3.87Å; K60-F62 HydrophobicContact CG-CD2 4.43Å; K60-F62 HydrophobicContact CG-CE2 3.86Å; K60-F62 HydrophobicContact CG-CZ 4.49Å; K60-F62 PolarHBondContact O-N 3.28Å; K60-N81 PolarHBondContact N-OD1 3.25Å; K60-N81 VanDerWaalsContact N-OD1 3.08Å
61	R	94.8	Very high	93.6	Very high	185 Å²	185	74.6 Å²	74.6	70%	0.698	37%	0.371	S	S	*	.			trans	61.1	32.5	178.8	-53.3	178.8	178.7	179.7	-0.3	112.8	N81	R61-N81 PolarHBondContact N-OD1 2.63Å
62	F	95.5	Very high	93.9	Very high	36 Å²	36	70.2 Å²	70.2	16%	0.158	35%	0.351	C	S	.	.			trans	-65.1	141.7	175.6	-68.6	-56.1	0	0	0	111.5	R45 C57 K60 P66 N81 R82 I83	R45-F62 HydrophobicContact CB-CZ 4.13Å; C57-F62 HydrophobicContact CB-CD2 4.28Å; C57-F62 HydrophobicContact CB-CE2 3.94Å; K60-F62 VanDerWaalsContact C-N 3.27Å; K60-F62 HydrophobicContact CB-CD2 3.6Å; K60-F62 HydrophobicContact CB-CE2 3.32Å; K60-F62 HydrophobicContact CB-CG 4.34Å; K60-F62 HydrophobicContact CB-CZ 3.87Å; K60-F62 HydrophobicContact CG-CD2 4.43Å; K60-F62 HydrophobicContact CG-CE2 3.86Å; K60-F62 HydrophobicContact CG-CZ 4.49Å; K60-F62 PolarHBondContact O-N 3.28Å; F62-P66 HydrophobicContact CD1-CB 4.13Å; F62-P66 HydrophobicContact CD2-CG 4.23Å; F62-P66 HydrophobicContact CE1-CB 3.81Å; F62-P66 HydrophobicContact CE1-CG 4.48Å; F62-P66 HydrophobicContact CE2-CB 4.21Å; F62-P66 HydrophobicContact CE2-CG 4.02Å; F62-P66 HydrophobicContact CG-CB 4.49Å; F62-P66 HydrophobicContact CZ-CB 3.84Å; F62-P66 HydrophobicContact CZ-CG 4.16Å; F62-N81 HydrophobicContact CB-CB 4.24Å; F62-N81 PolarHBondContact N-OD1 3.34Å; F62-R82 CarbonylContact O-C 3.44Å; F62-R82 VanDerWaalsContact O-CA 3.26Å; F62-R82 WeakPolarHBondContact O-CA 3.36Å; F62-R82 PolarHBondContact O-N 2.85Å; F62-I83 PolarHBondContact O-N 2.84Å
63	V	94.9	Very high	94.1	Very high	96 Å²	96	65.1 Å²	65.1	58%	0.582	32%	0.323	S	S	*	.	S	Bend	trans	-103.4	-21.6	178.7	-177.5	0	0	0	0	111.6	I83	V63-I83 WeakPolarHBondContact O-CA 2.93Å
64	A	93.9	Very high	94.2	Very high	53 Å²	53	65.6 Å²	65.6	44%	0.438	33%	0.325	S	S	.	.	S	Bend	trans	-139.3	175.5	175.4	0	0	0	0	0	108.7
65	V	93.9	Very high	94.3	Very high	20 Å²	20	67.1 Å²	67.1	12%	0.121	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-62.8	128.1	172.9	-179.1	0	0	0	0	109	I69 L78 E90 F91	V65-I69 HydrophobicContact CG1-CD1 3.75Å; V65-L78 HydrophobicContact CG1-CD1 4.23Å; V65-L78 HydrophobicContact CG2-CD1 4.19Å; V65-E90 HydrophobicContact CB-CG 4.46Å; V65-E90 HydrophobicContact CG2-CG 3.65Å; V65-F91 HydrophobicContact CG1-CE1 4.3Å; V65-F91 HydrophobicContact CG2-CD1 4.45Å; V65-F91 HydrophobicContact CG2-CE1 3.59Å; V65-F91 HydrophobicContact CG2-CZ 3.71Å
66	P	92.8	Very high	94.3	Very high	16 Å²	16	67 Å²	67	10%	0.104	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-74	144.4	-176.7	29.1	-33.7	0	0	0	111.9	P43 F62 I69 L78	P43-P66 HydrophobicContact CB-CB 4.34Å; P43-P66 HydrophobicContact CG-CG 4.42Å; F62-P66 HydrophobicContact CD1-CB 4.13Å; F62-P66 HydrophobicContact CD2-CG 4.23Å; F62-P66 HydrophobicContact CE1-CB 3.81Å; F62-P66 HydrophobicContact CE1-CG 4.48Å; F62-P66 HydrophobicContact CE2-CB 4.21Å; F62-P66 HydrophobicContact CE2-CG 4.02Å; F62-P66 HydrophobicContact CG-CB 4.49Å; F62-P66 HydrophobicContact CZ-CB 3.84Å; F62-P66 HydrophobicContact CZ-CG 4.16Å; P66-I69 HydrophobicContact CG-CD1 4.12Å; P66-I69 HydrophobicContact CG-CG1 4.46Å; P66-I69 WeakPolarHBondContact O-CD1 3.09Å; P66-I69 WeakPolarHBondContact O-CG1 3.38Å; P66-L78 VanDerWaalsContact CD-CD2 3.49Å; P66-L78 HydrophobicContact CG-CD2 3.89Å
67	E	89.9	Confident	94.3	Very high	173 Å²	173	65.1 Å²	65.1	81%	0.808	32%	0.321	S	S	*	.	S	Bend	trans	-67.9	154.4	172.8	-66.9	-62.4	159	0	0	112.3
68	G	89.4	Confident	94.4	Very high	39 Å²	39	65.1 Å²	65.1	40%	0.402	32%	0.321	S	S	.	.			trans	78.3	34.4	175.1	0	0	0	0	0	113.9	G41 C42 P43	G41-G68 CarbonylContact C-O 3.56Å; C42-G68 CarbonylContact C-O 3.55Å; P43-G68 WeakPolarHBondContact CD-O 3.08Å
69	I	93.3	Very high	94.5	Very high	13 Å²	13	61.8 Å²	61.8	7%	0.067	31%	0.306	C	S	.	.			trans	-83.8	138.4	165	-62.6	167.7	0	0	0	108.3	P43 V55 V65 P66 T73 L76 F94	P43-I69 HydrophobicContact CG-CG1 3.76Å; V55-I69 HydrophobicContact CG2-CG2 4.33Å; V65-I69 HydrophobicContact CG1-CD1 3.75Å; P66-I69 HydrophobicContact CG-CD1 4.12Å; P66-I69 HydrophobicContact CG-CG1 4.46Å; P66-I69 WeakPolarHBondContact O-CD1 3.09Å; P66-I69 WeakPolarHBondContact O-CG1 3.38Å; I69-T73 HydrophobicContact CG2-CG2 4.49Å; I69-L76 HydrophobicContact CD1-CD1 3.93Å; I69-L76 HydrophobicContact CD1-CD2 4.09Å; I69-L76 HydrophobicContact CG2-CD1 4.47Å; I69-F94 HydrophobicContact CB-CE1 3.59Å; I69-F94 HydrophobicContact CB-CZ 3.71Å; I69-F94 HydrophobicContact CD1-CE2 4.43Å; I69-F94 HydrophobicContact CD1-CZ 4.08Å; I69-F94 HydrophobicContact CG1-CZ 4.46Å; I69-F94 HydrophobicContact CG2-CD1 3.93Å; I69-F94 HydrophobicContact CG2-CE1 3.49Å; I69-F94 VanDerWaalsContact CG2-CE1 3.49Å; I69-F94 HydrophobicContact CG2-CZ 3.9Å
70	P	93.4	Very high	94.6	Very high	31 Å²	31	56.2 Å²	56.2	20%	0.201	29%	0.287	C	S	.	.			trans	-64.3	140	176.4	-15.5	28.7	0	0	0	111.8	G41 E72 T73 F94	G41-P70 WeakPolarHBondContact O-CD 3.46Å; G41-P70 WeakPolarHBondContact O-CG 3.47Å; P70-E72 HydrophobicContact CB-CG 4.4Å; P70-E72 WeakPolarHBondContact CB-OE2 3.22Å; P70-E72 PolarHBondContact O-N 3.48Å; P70-T73 WeakPolarHBondContact CD-OG1 3.25Å; P70-T73 VanDerWaalsContact O-CB 3.32Å; P70-T73 WeakPolarHBondContact O-CB 3.45Å; P70-T73 PolarHBondContact O-N 2.96Å; P70-T73 PolarHBondContact O-OG1 2.71Å; P70-F94 WeakPolarHBondContact O-CD1 3.26Å
71	T	92.6	Very high	94.8	Very high	86 Å²	86	52.9 Å²	52.9	53%	0.528	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-18.1	-179.1	57.3	0	0	0	0	112.9	H96	T71-H96 PolarHBondContact O-ND1 3.37Å
72	E	93.8	Very high	94.9	Very high	90 Å²	90	50.9 Å²	50.9	42%	0.421	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	12.1	178.8	74.4	-90.1	-152.5	0	0	114.2	R53 P70	R53-E72 WeakPolarHBondContact CD-O 3.39Å; R53-E72 PolarHBondContact NH1-O 3.35Å; P70-E72 HydrophobicContact CB-CG 4.4Å; P70-E72 WeakPolarHBondContact CB-OE2 3.22Å; P70-E72 PolarHBondContact O-N 3.48Å
73	T	95.6	Very high	94.9	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.012	26%	0.258	C	S	.	.			trans	-61.9	136.9	176	-60	0	0	0	0	111.1	R53 V55 I69 P70 L75 L76 H96 L97	R53-T73 WeakPolarHBondContact O-CG2 3.46Å; V55-T73 HydrophobicContact CB-CG2 4.35Å; V55-T73 HydrophobicContact CG2-CG2 3.89Å; I69-T73 HydrophobicContact CG2-CG2 4.49Å; P70-T73 WeakPolarHBondContact CD-OG1 3.25Å; P70-T73 VanDerWaalsContact O-CB 3.32Å; P70-T73 WeakPolarHBondContact O-CB 3.45Å; P70-T73 PolarHBondContact O-N 2.96Å; P70-T73 PolarHBondContact O-OG1 2.71Å; T73-L75 VanDerWaalsContact CG2-O 3.24Å; T73-L75 WeakPolarHBondContact CG2-O 3.42Å; T73-L76 HydrophobicContact CG2-CB 4.31Å; T73-H96 CarbonylContact O-C 3.01Å; T73-L97 HydrophobicContact CG2-CD2 3.88Å; T73-L97 PolarHBondContact O-N 3.37Å
74	R	96.9	Very high	95	Very high	121 Å²	121	50.3 Å²	50.3	46%	0.457	26%	0.255	S	S	.	.	S	Bend	trans	-107.5	-35.9	175.8	-69.4	-173.7	179.4	-177.4	-0.7	113.1	R53 E98 E99	R53-R74 HydrophobicContact CB-CB 4.19Å; R53-R74 HydrophobicContact CB-CG 4.07Å; R53-R74 PolarHBondContact O-N 3.19Å; R74-E98 IonicContact CZ-OE1 3.98Å; R74-E98 IonicContact NE-OE1 3.77Å; R74-E98 IonicContact NH1-OE1 3.95Å; R74-E98 PolarHBondContact O-N 2.99Å; R74-E99 PolarHBondContact O-N 3.49Å
75	L	97.8	Very high	95.1	Very high	44 Å²	44	50.8 Å²	50.8	23%	0.23	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	122.1	177.2	-175	159.1	0	0	0	109	R53 A54 V55 L56 T73 D77 E99	R53-L75 PolarHBondContact O-N 3.08Å; A54-L75 CarbonylContact C-O 3.1Å; A54-L75 WeakPolarHBondContact CA-O 3.32Å; A54-L75 HydrophobicContact CB-CB 4.05Å; A54-L75 HydrophobicContact CB-CD2 4.24Å; V55-L75 PolarHBondContact N-O 2.9Å; L56-L75 HydrophobicContact CD2-CD2 3.81Å; T73-L75 VanDerWaalsContact CG2-O 3.24Å; T73-L75 WeakPolarHBondContact CG2-O 3.42Å; L75-D77 HydrophobicContact CD2-CB 4.22Å; L75-E99 WeakPolarHBondContact CA-O 3.33Å; L75-E99 HydrophobicContact CB-CB 4.48Å; L75-E99 HydrophobicContact CD1-CG 4.39Å; L75-E99 HydrophobicContact CG-CB 4.17Å; L75-E99 HydrophobicContact CG-CG 4.22Å
76	L	97.3	Very high	95.2	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	112.2	175.2	178.3	60.5	0	0	0	110	V55 I69 T73 L78 F91 L97 E99 L100 E101	V55-L76 HydrophobicContact CB-CD1 3.89Å; V55-L76 HydrophobicContact CG1-CD1 3.91Å; I69-L76 HydrophobicContact CD1-CD1 3.93Å; I69-L76 HydrophobicContact CD1-CD2 4.09Å; I69-L76 HydrophobicContact CG2-CD1 4.47Å; T73-L76 HydrophobicContact CG2-CB 4.31Å; L76-L78 HydrophobicContact CD1-CD1 4.29Å; L76-L78 HydrophobicContact CD1-CD2 4.46Å; L76-L78 HydrophobicContact CD1-CG 4.02Å; L76-L78 HydrophobicContact CD2-CD1 3.89Å; L76-L78 HydrophobicContact CD2-CG 4.47Å; L76-L78 HydrophobicContact CG-CD1 4.01Å; L76-L78 HydrophobicContact CG-CG 4.05Å; L76-F91 HydrophobicContact CD2-CD1 4.19Å; L76-F91 HydrophobicContact CD2-CE1 4.08Å; L76-L97 HydrophobicContact CB-CD2 3.72Å; L76-L97 HydrophobicContact CD2-CD1 4.44Å; L76-E99 PolarHBondContact N-O 3.46Å; L76-L100 HydrophobicContact CB-CD1 4.1Å; L76-L100 HydrophobicContact CD2-CD1 3.95Å; L76-L100 HydrophobicContact CG-CD1 4.07Å; L76-E101 PolarHBondContact O-N 3.36Å
77	D	97.4	Very high	95.4	Very high	23 Å²	23	52.2 Å²	52.2	12%	0.123	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	107.4	175.4	-167.9	-30.4	0	0	0	110.2	V55 L56 C57 H58 L75 G79 E101	V55-D77 PolarHBondContact O-N 2.86Å; L56-D77 HydrophobicContact CD2-CB 3.55Å; C57-D77 WeakPolarHBondContact CA-O 3.38Å; C57-D77 WeakPolarHBondContact CB-O 3.15Å; C57-D77 PolarHBondContact N-O 2.79Å; H58-D77 IonicContact CE1-OD1 3.54Å; H58-D77 IonicContact CE1-OD2 2.88Å; H58-D77 PolarHBondContact CE1-OD2 3.18Å; H58-D77 IonicContact ND1-OD2 3.98Å; H58-D77 IonicContact NE2-OD1 3.6Å; H58-D77 IonicContact NE2-OD2 3.2Å; H58-D77 PolarHBondContact NE2-OD2 3.42Å; L75-D77 HydrophobicContact CD2-CB 4.22Å; D77-G79 WeakPolarHBondContact OD1-CA 3.35Å; D77-G79 PolarHBondContact OD1-N 3.26Å; D77-E101 HydrophobicContact CB-CB 4.25Å
78	L	96.8	Very high	95.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.246	C	C	.	.			trans	-107.9	23.7	174.9	-71.4	167	0	0	0	111.1	C57 V65 P66 L76 N81 I83 F91 E101 L102 N105	C57-L78 HydrophobicContact CB-CD2 3.7Å; V65-L78 HydrophobicContact CG1-CD1 4.23Å; V65-L78 HydrophobicContact CG2-CD1 4.19Å; P66-L78 VanDerWaalsContact CD-CD2 3.49Å; P66-L78 HydrophobicContact CG-CD2 3.89Å; L76-L78 HydrophobicContact CD1-CD1 4.29Å; L76-L78 HydrophobicContact CD1-CD2 4.46Å; L76-L78 HydrophobicContact CD1-CG 4.02Å; L76-L78 HydrophobicContact CD2-CD1 3.89Å; L76-L78 HydrophobicContact CD2-CG 4.47Å; L76-L78 HydrophobicContact CG-CD1 4.01Å; L76-L78 HydrophobicContact CG-CG 4.05Å; L78-N81 PolarHBondContact O-ND2 2.88Å; L78-I83 HydrophobicContact CB-CD1 4.1Å; L78-I83 HydrophobicContact CD1-CD1 4.35Å; L78-F91 HydrophobicContact CD1-CE1 4.17Å; L78-E101 PolarHBondContact N-O 3.14Å; L78-L102 HydrophobicContact CB-CD2 3.82Å; L78-L102 HydrophobicContact CD1-CD2 4.07Å; L78-N105 PolarHBondContact O-ND2 3.33Å
79	G	96.3	Very high	96	Very high	2 Å²	2	51 Å²	51	2%	0.021	25%	0.245	C	C	.	.			trans	-65.3	156.8	-177.7	0	0	0	0	0	114	H58 D77 N81 N103	H58-G79 WeakPolarHBondContact CA-O 3.45Å; D77-G79 WeakPolarHBondContact OD1-CA 3.35Å; D77-G79 PolarHBondContact OD1-N 3.26Å; G79-N81 VanDerWaalsContact C-N 3.3Å; G79-N81 PolarHBondContact O-N 2.81Å; G79-N81 PolarHBondContact O-ND2 2.87Å; G79-N103 CarbonylContact C-O 3.55Å; G79-N103 WeakPolarHBondContact CA-O 3.34Å
80	K	96.8	Very high	96.1	Very high	71 Å²	71	52.6 Å²	52.6	31%	0.309	25%	0.252	S	S	.	.	S	Bend	trans	59.2	37.5	178	-57.4	-179.7	176.3	154.7	0	113.1	R59 N103 E104	R59-K80 VanDerWaalsContact CA-O 3.26Å; R59-K80 WeakPolarHBondContact CA-O 3.49Å; R59-K80 HydrophobicContact CG-CB 3.79Å; R59-K80 HydrophobicContact CG-CD 4.13Å; R59-K80 PolarHBondContact N-O 3.38Å; K80-N103 PolarHBondContact N-O 2.94Å; K80-E104 VanDerWaalsContact CA-O 3.28Å; K80-E104 WeakPolarHBondContact CA-O 3.43Å; K80-E104 WeakPolarHBondContact CE-OE1 3.24Å; K80-E104 WeakPolarHBondContact CE-OE2 3.32Å; K80-E104 HydrophobicContact CG-CB 3.88Å; K80-E104 HydrophobicContact CG-CG 4.41Å; K80-E104 WeakPolarHBondContact CG-OE2 3.5Å; K80-E104 PolarHBondContact N-O 3.16Å; K80-E104 IonicContact NZ-OE1 3.68Å
81	N	97	Very high	96.2	Very high	9 Å²	9	51.1 Å²	51.1	5%	0.048	24%	0.242	C	C	.	.	S	Bend	trans	-111	-160.2	176.3	-76.9	-63.3	0	0	0	111.2	C57 K60 R61 F62 L78 G79 I83 N105	C57-N81 PolarHBondContact O-ND2 3.2Å; K60-N81 PolarHBondContact N-OD1 3.25Å; K60-N81 VanDerWaalsContact N-OD1 3.08Å; R61-N81 PolarHBondContact N-OD1 2.63Å; F62-N81 HydrophobicContact CB-CB 4.24Å; F62-N81 PolarHBondContact N-OD1 3.34Å; L78-N81 PolarHBondContact O-ND2 2.88Å; G79-N81 VanDerWaalsContact C-N 3.3Å; G79-N81 PolarHBondContact O-N 2.81Å; G79-N81 PolarHBondContact O-ND2 2.87Å; N81-I83 HydrophobicContact CB-CG1 4.39Å; N81-N105 WeakPolarHBondContact CA-OD1 3.47Å; N81-N105 WeakPolarHBondContact CB-OD1 3.33Å; N81-N105 PolarHBondContact N-OD1 3.22Å; N81-N105 PolarHBondContact O-OD1 3.27Å
82	R	97.1	Very high	96.4	Very high	143 Å²	143	48.3 Å²	48.3	54%	0.54	23%	0.228	S	C	.	.			trans	-128	32.2	-177.8	-63	-174.4	176.6	-169.7	-2.4	111.2	F62 K84 N105 I106	F62-R82 CarbonylContact O-C 3.44Å; F62-R82 VanDerWaalsContact O-CA 3.26Å; F62-R82 WeakPolarHBondContact O-CA 3.36Å; F62-R82 PolarHBondContact O-N 2.85Å; R82-K84 PolarHBondContact O-N 2.91Å; R82-N105 PolarHBondContact N-OD1 2.77Å; R82-I106 HydrophobicContact CB-CD1 4.03Å; R82-I106 HydrophobicContact CB-CG1 4.43Å; R82-I106 WeakPolarHBondContact O-CD1 3.46Å; R82-I106 WeakPolarHBondContact O-CG1 3.34Å
83	I	96.9	Very high	96.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.233	C	C	.	.			trans	-66.8	129.7	177.7	-57.4	172.4	0	0	0	108.5	F62 V63 L78 N81 L86 L102 N105 I106 V107	F62-I83 PolarHBondContact O-N 2.84Å; V63-I83 WeakPolarHBondContact O-CA 2.93Å; L78-I83 HydrophobicContact CB-CD1 4.1Å; L78-I83 HydrophobicContact CD1-CD1 4.35Å; N81-I83 HydrophobicContact CB-CG1 4.39Å; I83-L86 HydrophobicContact CG2-CD2 4.02Å; I83-L102 HydrophobicContact CD1-CD2 4.06Å; I83-N105 HydrophobicContact CB-CB 4.44Å; I83-N105 PolarHBondContact N-OD1 2.94Å; I83-N105 VanDerWaalsContact N-OD1 3.09Å; I83-I106 CarbonylContact O-C 3.57Å; I83-I106 WeakPolarHBondContact O-CA 3.47Å; I83-I106 VanDerWaalsContact O-CG1 3.25Å; I83-I106 WeakPolarHBondContact O-CG1 3.38Å; I83-I106 PolarHBondContact O-N 3Å; I83-I106 VanDerWaalsContact O-N 3.09Å; I83-V107 HydrophobicContact CB-CG2 4.35Å; I83-V107 HydrophobicContact CG2-CG2 4.18Å; I83-V107 WeakPolarHBondContact O-CG2 3.19Å; I83-V107 PolarHBondContact O-N 3.11Å
84	K	95.9	Very high	96.4	Very high	120 Å²	120	48.4 Å²	48.4	52%	0.522	24%	0.236	S	C	.	.			trans	-105.2	-37.4	-173.6	-76.4	-177.4	178.5	179.6	0	114.2	R82 I106 V107 S108	R82-K84 PolarHBondContact O-N 2.91Å; K84-I106 HydrophobicContact CD-CD1 4.36Å; K84-I106 HydrophobicContact CG-CD1 3.58Å; K84-I106 HydrophobicContact CG-CG1 3.74Å; K84-V107 CarbonylContact O-C 3.13Å; K84-V107 WeakPolarHBondContact O-CA 3.42Å; K84-S108 PolarHBondContact O-N 3.46Å; K84-S108 PolarHBondContact O-OG 2.56Å
85	T	95.8	Very high	96.3	Very high	64 Å²	64	44.4 Å²	44.4	39%	0.393	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	147.4	-176.5	53.9	0	0	0	0	109	A109	T85-A109 WeakPolarHBondContact CA-O 3.3Å; T85-A109 HydrophobicContact CG2-CB 4.34Å
86	L	96.8	Very high	96.3	Very high	1 Å²	1	47 Å²	47	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	112.5	169.8	-58.7	175.9	0	0	0	106.6	I83 F91 L102 V107 A109 V110 E111 A114 F115 L126	I83-L86 HydrophobicContact CG2-CD2 4.02Å; L86-F91 HydrophobicContact CD2-CE2 4.05Å; L86-F91 HydrophobicContact CD2-CZ 4.18Å; L86-L102 HydrophobicContact CD1-CD1 3.84Å; L86-L102 HydrophobicContact CD2-CD1 4.24Å; L86-V107 HydrophobicContact CD1-CG1 4.26Å; L86-V107 HydrophobicContact CG-CG1 4.07Å; L86-A109 PolarHBondContact N-O 2.98Å; L86-V110 HydrophobicContact CB-CB 4.46Å; L86-V110 HydrophobicContact CB-CG2 4.19Å; L86-V110 HydrophobicContact CD1-CG2 4.35Å; L86-E111 PolarHBondContact O-N 3.31Å; L86-A114 HydrophobicContact CB-CB 4.09Å; L86-F115 HydrophobicContact CD1-CE1 4.13Å; L86-F115 HydrophobicContact CD1-CZ 3.77Å; L86-L126 HydrophobicContact CD1-CD2 4.28Å
87	N	95.9	Very high	96.3	Very high	65 Å²	65	47 Å²	47	35%	0.348	24%	0.237	S	C	.	.			trans	-86	168.4	-175.2	-44.6	-51.4	0	0	0	110.2	D89 E90 E111 A114	N87-D89 PolarHBondContact O-N 2.92Å; N87-E90 WeakPolarHBondContact CB-OE2 3.33Å; N87-E90 PolarHBondContact N-OE2 2.92Å; N87-E90 PolarHBondContact ND2-OE2 3.42Å; N87-E90 WeakPolarHBondContact O-CB 3.28Å; N87-E90 PolarHBondContact O-N 3.49Å; N87-E111 VanDerWaalsContact CA-OE2 3.32Å; N87-E111 WeakPolarHBondContact CA-OE2 2.99Å; N87-A114 WeakPolarHBondContact O-CA 3.34Å; N87-A114 VanDerWaalsContact O-CB 3.25Å; N87-A114 WeakPolarHBondContact O-CB 3.38Å
88	Q	96.6	Very high	96.3	Very high	116 Å²	116	48.8 Å²	48.8	54%	0.542	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	136.7	173.2	-170.6	-175.7	-19.4	0	0	111.7	E90 E111	Q88-E90 PolarHBondContact O-N 3.49Å; Q88-E90 VanDerWaalsContact O-N 3.11Å; Q88-E111 PolarHBondContact N-OE2 3.04Å
89	D	95.8	Very high	96.4	Very high	71 Å²	71	52.1 Å²	52.1	38%	0.38	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	16.4	176.8	-55.3	-44.3	0	0	0	115.7	N87 F91 A92 G113 N116	N87-D89 PolarHBondContact O-N 2.92Å; D89-F91 PolarHBondContact O-N 3.09Å; D89-A92 HydrophobicContact CB-CB 3.94Å; D89-A92 WeakPolarHBondContact O-CB 3.1Å; D89-A92 PolarHBondContact O-N 3Å; D89-G113 PolarHBondContact N-O 3.25Å; D89-N116 WeakPolarHBondContact OD1-CB 3.44Å; D89-N116 PolarHBondContact OD1-ND2 3.5Å
90	E	95.6	Very high	96.4	Very high	46 Å²	46	52 Å²	52	22%	0.215	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-33.8	-176.9	-169.2	83.1	-163.1	0	0	113.4	V65 N87 Q88	V65-E90 HydrophobicContact CB-CG 4.46Å; V65-E90 HydrophobicContact CG2-CG 3.65Å; N87-E90 WeakPolarHBondContact CB-OE2 3.33Å; N87-E90 PolarHBondContact N-OE2 2.92Å; N87-E90 PolarHBondContact ND2-OE2 3.42Å; N87-E90 WeakPolarHBondContact O-CB 3.28Å; N87-E90 PolarHBondContact O-N 3.49Å; Q88-E90 PolarHBondContact O-N 3.49Å; Q88-E90 VanDerWaalsContact O-N 3.11Å
91	F	96.3	Very high	96.5	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	8.6	-179.4	-59	-78.4	0	0	0	113.9	V65 L76 L78 L86 D89 S93 F94 L100 L102 F115 L118	V65-F91 HydrophobicContact CG1-CE1 4.3Å; V65-F91 HydrophobicContact CG2-CD1 4.45Å; V65-F91 HydrophobicContact CG2-CE1 3.59Å; V65-F91 HydrophobicContact CG2-CZ 3.71Å; L76-F91 HydrophobicContact CD2-CD1 4.19Å; L76-F91 HydrophobicContact CD2-CE1 4.08Å; L78-F91 HydrophobicContact CD1-CE1 4.17Å; L86-F91 HydrophobicContact CD2-CE2 4.05Å; L86-F91 HydrophobicContact CD2-CZ 4.18Å; D89-F91 PolarHBondContact O-N 3.09Å; F91-S93 PolarHBondContact O-N 3.07Å; F91-F94 HydrophobicContact CB-CD2 4.34Å; F91-F94 HydrophobicContact CD1-CD2 4.31Å; F91-F94 PolarHBondContact O-N 3.11Å; F91-L100 HydrophobicContact CD1-CD1 4.35Å; F91-L100 HydrophobicContact CD1-CD2 4.29Å; F91-L100 HydrophobicContact CD2-CD2 4.05Å; F91-L100 HydrophobicContact CE1-CD1 3.93Å; F91-L100 HydrophobicContact CE1-CD2 4.23Å; F91-L100 HydrophobicContact CE2-CD2 3.99Å; F91-L100 HydrophobicContact CG-CD2 4.21Å; F91-L100 HydrophobicContact CZ-CD1 4.27Å; F91-L100 HydrophobicContact CZ-CD2 4.09Å; F91-L102 HydrophobicContact CE2-CD1 4.18Å; F91-L102 HydrophobicContact CZ-CD1 3.94Å; F91-L102 HydrophobicContact CZ-CD2 4.18Å; F91-F115 HydrophobicContact CD2-CD1 4.09Å; F91-F115 HydrophobicContact CD2-CE1 4.26Å; F91-F115 HydrophobicContact CE2-CD1 4.39Å; F91-F115 HydrophobicContact CE2-CE1 4.1Å; F91-L118 HydrophobicContact CB-CD1 3.83Å; F91-L118 HydrophobicContact CB-CD2 4.03Å; F91-L118 HydrophobicContact CB-CG 4.25Å; F91-L118 HydrophobicContact CG-CD1 4.45Å; F91-L118 WeakPolarHBondContact O-CD2 3.1Å
92	A	95.1	Very high	96.5	Very high	26 Å²	26	49.3 Å²	49.3	22%	0.215	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-23	-173.1	0	0	0	0	0	113.5	D89 F94 N117	D89-A92 HydrophobicContact CB-CB 3.94Å; D89-A92 WeakPolarHBondContact O-CB 3.1Å; D89-A92 PolarHBondContact O-N 3Å; A92-F94 PolarHBondContact O-N 3.39Å; A92-N117 HydrophobicContact CB-CB 4.2Å; A92-N117 PolarHBondContact O-ND2 3.01Å
93	S	94.4	Very high	96.5	Very high	76 Å²	76	44 Å²	44	53%	0.531	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-11.1	175.5	-57.4	0	0	0	0	114.5	F91 P95	F91-S93 PolarHBondContact O-N 3.07Å; S93-P95 VanDerWaalsContact C-CD 3.4Å; S93-P95 WeakPolarHBondContact O-CD 3.13Å
94	F	95.3	Very high	96.5	Very high	18 Å²	18	48.1 Å²	48.1	8%	0.079	25%	0.249	C	C	.	.			trans	-122.3	61.4	-173.9	-42.2	-68.2	0	0	0	112.6	I69 P70 F91 A92 H96 L97 L118	I69-F94 HydrophobicContact CB-CE1 3.59Å; I69-F94 HydrophobicContact CB-CZ 3.71Å; I69-F94 HydrophobicContact CD1-CE2 4.43Å; I69-F94 HydrophobicContact CD1-CZ 4.08Å; I69-F94 HydrophobicContact CG1-CZ 4.46Å; I69-F94 HydrophobicContact CG2-CD1 3.93Å; I69-F94 HydrophobicContact CG2-CE1 3.49Å; I69-F94 VanDerWaalsContact CG2-CE1 3.49Å; I69-F94 HydrophobicContact CG2-CZ 3.9Å; P70-F94 WeakPolarHBondContact O-CD1 3.26Å; F91-F94 HydrophobicContact CB-CD2 4.34Å; F91-F94 HydrophobicContact CD1-CD2 4.31Å; F91-F94 PolarHBondContact O-N 3.11Å; A92-F94 PolarHBondContact O-N 3.39Å; F94-H96 PolarHBondContact O-N 3.42Å; F94-H96 VanDerWaalsContact O-N 3.07Å; F94-L97 HydrophobicContact CB-CD1 3.62Å; F94-L97 HydrophobicContact CB-CG 3.71Å; F94-L97 HydrophobicContact CD2-CD1 4.42Å; F94-L97 HydrophobicContact CG-CD1 4.38Å; F94-L97 WeakPolarHBondContact O-CG 3.34Å; F94-L97 PolarHBondContact O-N 3.03Å; F94-L97 VanDerWaalsContact O-N 3.16Å; F94-L118 WeakPolarHBondContact O-CD2 3.4Å
95	P	95.8	Very high	96.6	Very high	37 Å²	37	42.8 Å²	42.8	24%	0.24	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-13	-173.4	28.3	-36.1	0	0	0	114.6	S93 L97 N117 N120	S93-P95 VanDerWaalsContact C-CD 3.4Å; S93-P95 WeakPolarHBondContact O-CD 3.13Å; P95-L97 VanDerWaalsContact C-N 3.34Å; P95-N117 WeakPolarHBondContact CA-O 3.32Å; P95-N120 PolarHBondContact O-ND2 2.8Å
96	H	96.6	Very high	96.6	Very high	99 Å²	99	41.6 Å²	41.6	46%	0.458	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	0.7	178.9	-59.1	96.4	0	0	0	113.5	T71 T73 F94 E98	T71-H96 PolarHBondContact O-ND1 3.37Å; T73-H96 CarbonylContact O-C 3.01Å; F94-H96 PolarHBondContact O-N 3.42Å; F94-H96 VanDerWaalsContact O-N 3.07Å; H96-E98 PolarHBondContact O-N 2.92Å
97	L	97.6	Very high	96.7	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.216	C	C	.	.			trans	-61.4	128.3	179.4	-77	176.3	0	0	0	111.3	T73 L76 F94 P95 L118 N120 L121	T73-L97 HydrophobicContact CG2-CD2 3.88Å; T73-L97 PolarHBondContact O-N 3.37Å; L76-L97 HydrophobicContact CB-CD2 3.72Å; L76-L97 HydrophobicContact CD2-CD1 4.44Å; F94-L97 HydrophobicContact CB-CD1 3.62Å; F94-L97 HydrophobicContact CB-CG 3.71Å; F94-L97 HydrophobicContact CD2-CD1 4.42Å; F94-L97 HydrophobicContact CG-CD1 4.38Å; F94-L97 WeakPolarHBondContact O-CG 3.34Å; F94-L97 PolarHBondContact O-N 3.03Å; F94-L97 VanDerWaalsContact O-N 3.16Å; P95-L97 VanDerWaalsContact C-N 3.34Å; L97-L118 HydrophobicContact CB-CD2 4.3Å; L97-L118 HydrophobicContact CD1-CD2 4.07Å; L97-N120 CarbonylContact O-C 3.55Å; L97-L121 HydrophobicContact CB-CD1 3.95Å; L97-L121 WeakPolarHBondContact O-CA 3.36Å; L97-L121 PolarHBondContact O-N 3.09Å; L97-L121 VanDerWaalsContact O-N 3.13Å
98	E	97.9	Very high	96.6	Very high	61 Å²	61	41.4 Å²	41.4	29%	0.285	22%	0.22	S	C	.	.	S	Bend	trans	-106.5	-31.7	172.7	-62.5	-174.7	-150	0	0	110.7	R74 H96 R122 T123	R74-E98 IonicContact CZ-OE1 3.98Å; R74-E98 IonicContact NE-OE1 3.77Å; R74-E98 IonicContact NH1-OE1 3.95Å; R74-E98 PolarHBondContact O-N 2.99Å; H96-E98 PolarHBondContact O-N 2.92Å; E98-R122 WeakPolarHBondContact O-CA 3.32Å; E98-R122 WeakPolarHBondContact O-CB 3.5Å; E98-R122 PolarHBondContact O-N 2.97Å; E98-R122 IonicContact OE2-NH1 2.7Å; E98-T123 PolarHBondContact O-N 3.2Å; E98-T123 VanDerWaalsContact O-N 3.1Å
99	E	98.3	Very high	96.6	Very high	70 Å²	70	38.1 Å²	38.1	33%	0.327	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	123.3	-178.1	-178	163.6	155.6	0	0	111	R74 L75 L76 E101 T123	R74-E99 PolarHBondContact O-N 3.49Å; L75-E99 WeakPolarHBondContact CA-O 3.33Å; L75-E99 HydrophobicContact CB-CB 4.48Å; L75-E99 HydrophobicContact CD1-CG 4.39Å; L75-E99 HydrophobicContact CG-CB 4.17Å; L75-E99 HydrophobicContact CG-CG 4.22Å; L76-E99 PolarHBondContact N-O 3.46Å; E99-E101 HydrophobicContact CG-CG 4.1Å; E99-T123 HydrophobicContact CG-CG2 4.21Å
100	L	97.9	Very high	96.6	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	113	177.9	177.7	59.8	0	0	0	109.6	L76 F91 L102 F115 L118 L121 T123 L124 G125	L76-L100 HydrophobicContact CB-CD1 4.1Å; L76-L100 HydrophobicContact CD2-CD1 3.95Å; L76-L100 HydrophobicContact CG-CD1 4.07Å; F91-L100 HydrophobicContact CD1-CD1 4.35Å; F91-L100 HydrophobicContact CD1-CD2 4.29Å; F91-L100 HydrophobicContact CD2-CD2 4.05Å; F91-L100 HydrophobicContact CE1-CD1 3.93Å; F91-L100 HydrophobicContact CE1-CD2 4.23Å; F91-L100 HydrophobicContact CE2-CD2 3.99Å; F91-L100 HydrophobicContact CG-CD2 4.21Å; F91-L100 HydrophobicContact CZ-CD1 4.27Å; F91-L100 HydrophobicContact CZ-CD2 4.09Å; L100-L102 HydrophobicContact CD1-CD1 4.36Å; L100-L102 HydrophobicContact CD1-CG 4.21Å; L100-L102 HydrophobicContact CD2-CD1 4.02Å; L100-L102 HydrophobicContact CG-CD1 4.04Å; L100-L102 HydrophobicContact CG-CG 4.2Å; L100-F115 HydrophobicContact CD2-CD1 4.1Å; L100-F115 HydrophobicContact CD2-CE1 3.92Å; L100-L118 HydrophobicContact CD2-CD1 4.28Å; L100-L121 HydrophobicContact CB-CD1 3.79Å; L100-L121 HydrophobicContact CB-CD2 4.46Å; L100-T123 PolarHBondContact N-O 3.05Å; L100-L124 HydrophobicContact CB-CD1 4.18Å; L100-L124 HydrophobicContact CD2-CD1 3.96Å; L100-L124 HydrophobicContact CG-CD1 4.08Å; L100-L124 WeakPolarHBondContact O-CA 3.46Å; L100-G125 PolarHBondContact O-N 2.96Å
101	E	98	Very high	96.6	Very high	23 Å²	23	37.3 Å²	37.3	11%	0.107	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	111.3	-178.2	-64.9	-66	169.7	0	0	110	L76 D77 L78 E99 N103 T123 G125	L76-E101 PolarHBondContact O-N 3.36Å; D77-E101 HydrophobicContact CB-CB 4.25Å; L78-E101 PolarHBondContact N-O 3.14Å; E99-E101 HydrophobicContact CG-CG 4.1Å; E101-N103 PolarHBondContact OE2-ND2 2.81Å; E101-N103 PolarHBondContact OE2-OD1 2.85Å; E101-T123 WeakPolarHBondContact OE1-CG2 3.32Å; E101-G125 WeakPolarHBondContact OE2-CA 3.21Å
102	L	97.3	Very high	96.6	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.229	C	C	.	.			trans	-115.9	23.1	179.1	-69.5	163.1	0	0	0	111.5	L78 I83 L86 F91 L100 N105 F115 G125 L126 N129	L78-L102 HydrophobicContact CB-CD2 3.82Å; L78-L102 HydrophobicContact CD1-CD2 4.07Å; I83-L102 HydrophobicContact CD1-CD2 4.06Å; L86-L102 HydrophobicContact CD1-CD1 3.84Å; L86-L102 HydrophobicContact CD2-CD1 4.24Å; F91-L102 HydrophobicContact CE2-CD1 4.18Å; F91-L102 HydrophobicContact CZ-CD1 3.94Å; F91-L102 HydrophobicContact CZ-CD2 4.18Å; L100-L102 HydrophobicContact CD1-CD1 4.36Å; L100-L102 HydrophobicContact CD1-CG 4.21Å; L100-L102 HydrophobicContact CD2-CD1 4.02Å; L100-L102 HydrophobicContact CG-CD1 4.04Å; L100-L102 HydrophobicContact CG-CG 4.2Å; L102-N105 PolarHBondContact O-ND2 2.92Å; L102-F115 HydrophobicContact CD1-CE1 4.37Å; L102-G125 WeakPolarHBondContact CA-O 3.37Å; L102-G125 WeakPolarHBondContact CB-O 3.05Å; L102-G125 PolarHBondContact N-O 3.01Å; L102-L126 HydrophobicContact CB-CD2 3.98Å; L102-L126 HydrophobicContact CD1-CD2 4.09Å; L102-N129 PolarHBondContact O-ND2 3.49Å
103	N	97.3	Very high	96.6	Very high	30 Å²	30	39.7 Å²	39.7	16%	0.16	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	151.1	-175	-58.2	-26.5	0	0	0	113.1	G79 K80 E101 N105 G125 L126 R127	G79-N103 CarbonylContact C-O 3.55Å; G79-N103 WeakPolarHBondContact CA-O 3.34Å; K80-N103 PolarHBondContact N-O 2.94Å; E101-N103 PolarHBondContact OE2-ND2 2.81Å; E101-N103 PolarHBondContact OE2-OD1 2.85Å; N103-N105 PolarHBondContact O-N 3.07Å; N103-N105 PolarHBondContact O-ND2 3.33Å; N103-G125 VanDerWaalsContact OD1-CA 3.23Å; N103-G125 WeakPolarHBondContact OD1-CA 3.25Å; N103-G125 PolarHBondContact OD1-O 2.86Å; N103-L126 PolarHBondContact OD1-N 3.04Å; N103-R127 CarbonylContact C-O 3.54Å; N103-R127 VanDerWaalsContact CA-O 3.3Å; N103-R127 WeakPolarHBondContact CA-O 3.3Å; N103-R127 HydrophobicContact CB-CG 3.65Å; N103-R127 WeakPolarHBondContact OD1-CG 3.4Å; N103-R127 PolarHBondContact OD1-N 3.42Å
104	E	96.7	Very high	96.7	Very high	88 Å²	88	36 Å²	36	41%	0.411	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	40	175.7	-60.3	178.7	-128.4	0	0	112.9	K80 R127 S128	K80-E104 VanDerWaalsContact CA-O 3.28Å; K80-E104 WeakPolarHBondContact CA-O 3.43Å; K80-E104 WeakPolarHBondContact CE-OE1 3.24Å; K80-E104 WeakPolarHBondContact CE-OE2 3.32Å; K80-E104 HydrophobicContact CG-CB 3.88Å; K80-E104 HydrophobicContact CG-CG 4.41Å; K80-E104 WeakPolarHBondContact CG-OE2 3.5Å; K80-E104 PolarHBondContact N-O 3.16Å; K80-E104 IonicContact NZ-OE1 3.68Å; E104-R127 PolarHBondContact N-O 3.38Å; E104-S128 WeakPolarHBondContact CA-O 3.45Å
105	N	97.3	Very high	96.8	Very high	8 Å²	8	35.3 Å²	35.3	4%	0.043	19%	0.193	C	C	.	.	S	Bend	trans	-101.5	-163.3	170.4	-87	-76.4	0	0	0	110.2	L78 N81 R82 I83 L102 N103 V107 S128 N129	L78-N105 PolarHBondContact O-ND2 3.33Å; N81-N105 WeakPolarHBondContact CA-OD1 3.47Å; N81-N105 WeakPolarHBondContact CB-OD1 3.33Å; N81-N105 PolarHBondContact N-OD1 3.22Å; N81-N105 PolarHBondContact O-OD1 3.27Å; R82-N105 PolarHBondContact N-OD1 2.77Å; I83-N105 HydrophobicContact CB-CB 4.44Å; I83-N105 PolarHBondContact N-OD1 2.94Å; I83-N105 VanDerWaalsContact N-OD1 3.09Å; L102-N105 PolarHBondContact O-ND2 2.92Å; N103-N105 PolarHBondContact O-N 3.07Å; N103-N105 PolarHBondContact O-ND2 3.33Å; N105-V107 HydrophobicContact CB-CG2 4Å; N105-S128 PolarHBondContact N-O 2.92Å; N105-N129 VanDerWaalsContact CA-OD1 3.32Å; N105-N129 WeakPolarHBondContact CA-OD1 3.28Å; N105-N129 WeakPolarHBondContact CB-OD1 3.4Å; N105-N129 PolarHBondContact N-OD1 2.65Å; N105-N129 PolarHBondContact O-OD1 3.47Å
106	I	97.2	Very high	96.8	Very high	39 Å²	39	36.1 Å²	36.1	20%	0.2	20%	0.195	C	C	.	.			trans	-123.5	32.7	174.8	58	176.9	0	0	0	110.8	R82 I83 K84 S108 N129	R82-I106 HydrophobicContact CB-CD1 4.03Å; R82-I106 HydrophobicContact CB-CG1 4.43Å; R82-I106 WeakPolarHBondContact O-CD1 3.46Å; R82-I106 WeakPolarHBondContact O-CG1 3.34Å; I83-I106 CarbonylContact O-C 3.57Å; I83-I106 WeakPolarHBondContact O-CA 3.47Å; I83-I106 VanDerWaalsContact O-CG1 3.25Å; I83-I106 WeakPolarHBondContact O-CG1 3.38Å; I83-I106 PolarHBondContact O-N 3Å; I83-I106 VanDerWaalsContact O-N 3.09Å; K84-I106 HydrophobicContact CD-CD1 4.36Å; K84-I106 HydrophobicContact CG-CD1 3.58Å; K84-I106 HydrophobicContact CG-CG1 3.74Å; I106-S108 PolarHBondContact O-N 3.25Å; I106-S108 VanDerWaalsContact O-N 3.14Å; I106-N129 PolarHBondContact N-OD1 3.35Å
107	V	97.3	Very high	96.7	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.19	C	C	.	.			trans	-64.5	114.9	-176.1	-176.8	0	0	0	0	108.8	I83 K84 L86 N105 N129 R130 L131	I83-V107 HydrophobicContact CB-CG2 4.35Å; I83-V107 HydrophobicContact CG2-CG2 4.18Å; I83-V107 WeakPolarHBondContact O-CG2 3.19Å; I83-V107 PolarHBondContact O-N 3.11Å; K84-V107 CarbonylContact O-C 3.13Å; K84-V107 WeakPolarHBondContact O-CA 3.42Å; L86-V107 HydrophobicContact CD1-CG1 4.26Å; L86-V107 HydrophobicContact CG-CG1 4.07Å; N105-V107 HydrophobicContact CB-CG2 4Å; V107-N129 HydrophobicContact CB-CB 4.29Å; V107-N129 WeakPolarHBondContact CB-OD1 3.43Å; V107-N129 WeakPolarHBondContact CG2-OD1 3.13Å; V107-N129 PolarHBondContact N-OD1 2.75Å; V107-R130 CarbonylContact O-C 3.6Å; V107-R130 VanDerWaalsContact O-CA 3.28Å; V107-R130 WeakPolarHBondContact O-CA 3.4Å; V107-R130 PolarHBondContact O-N 3.1Å; V107-L131 HydrophobicContact CG1-CD2 3.88Å; V107-L131 PolarHBondContact O-N 3.18Å
108	S	95.5	Very high	96.6	Very high	61 Å²	61	34.6 Å²	34.6	43%	0.427	19%	0.191	S	C	.	.			trans	-105.8	-20.9	-179.2	53	0	0	0	0	113.7	K84 I106	K84-S108 PolarHBondContact O-N 3.46Å; K84-S108 PolarHBondContact O-OG 2.56Å; I106-S108 PolarHBondContact O-N 3.25Å; I106-S108 VanDerWaalsContact O-N 3.14Å
109	A	95.3	Very high	96.5	Very high	47 Å²	47	36.8 Å²	36.8	39%	0.388	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	143.4	179.1	0	0	0	0	0	110.4	T85 L86	T85-A109 WeakPolarHBondContact CA-O 3.3Å; T85-A109 HydrophobicContact CG2-CB 4.34Å; L86-A109 PolarHBondContact N-O 2.98Å
110	V	96.6	Very high	96.4	Very high	9 Å²	9	37.1 Å²	37.1	6%	0.055	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	123.6	173.9	51.7	0	0	0	0	107.5	L86 A114 F115 L131 P135 V138	L86-V110 HydrophobicContact CB-CB 4.46Å; L86-V110 HydrophobicContact CB-CG2 4.19Å; L86-V110 HydrophobicContact CD1-CG2 4.35Å; V110-A114 HydrophobicContact CG2-CB 3.82Å; V110-F115 HydrophobicContact CG2-CE2 3.96Å; V110-F115 HydrophobicContact CG2-CZ 4.38Å; V110-L131 HydrophobicContact CG1-CD2 4.16Å; V110-P135 WeakPolarHBondContact O-CG 3.43Å; V110-V138 HydrophobicContact CB-CG1 4.45Å; V110-V138 HydrophobicContact CG1-CG1 4.04Å; V110-V138 HydrophobicContact CG1-CG2 3.98Å; V110-V138 HydrophobicContact CG2-CB 4.47Å; V110-V138 HydrophobicContact CG2-CG1 3.54Å; V110-V138 HydrophobicContact CG2-CG2 4.07Å
111	E	95.8	Very high	96.4	Very high	92 Å²	92	37.1 Å²	37.1	43%	0.43	20%	0.203	S	C	.	.			trans	-78.9	148.5	179.6	-66.1	-172.6	154.4	0	0	111.1	L86 N87 Q88 G113 A114	L86-E111 PolarHBondContact O-N 3.31Å; N87-E111 VanDerWaalsContact CA-OE2 3.32Å; N87-E111 WeakPolarHBondContact CA-OE2 2.99Å; Q88-E111 PolarHBondContact N-OE2 3.04Å; E111-G113 PolarHBondContact O-N 2.9Å; E111-A114 VanDerWaalsContact O-CB 3.3Å; E111-A114 WeakPolarHBondContact O-CB 3.42Å; E111-A114 PolarHBondContact O-N 3.46Å; E111-A114 VanDerWaalsContact O-N 3.11Å
112	P	96.3	Very high	96.4	Very high	68 Å²	68	42.6 Å²	42.6	44%	0.442	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	133.5	169.7	-24.4	34.9	0	0	0	111	A114	P112-A114 VanDerWaalsContact C-N 3.35Å
113	G	95.3	Very high	96.4	Very high	7 Å²	7	43.7 Å²	43.7	7%	0.072	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.1	9.3	-176.7	0	0	0	0	0	115.8	D89 E111 F115 N116 G137	D89-G113 PolarHBondContact N-O 3.25Å; E111-G113 PolarHBondContact O-N 2.9Å; G113-F115 PolarHBondContact O-N 2.89Å; G113-N116 VanDerWaalsContact CA-CG 3.5Å; G113-N116 WeakPolarHBondContact CA-OD1 3.43Å; G113-N116 VanDerWaalsContact O-CB 3.31Å; G113-N116 WeakPolarHBondContact O-CB 3.23Å; G113-N116 PolarHBondContact O-N 3.23Å; G113-N116 VanDerWaalsContact O-N 3.12Å; G113-N116 PolarHBondContact O-ND2 3.3Å; G113-G137 PolarHBondContact N-O 3.24Å
114	A	96.7	Very high	96.5	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-28.1	173.6	0	0	0	0	0	113.8	L86 N87 V110 E111 P112	L86-A114 HydrophobicContact CB-CB 4.09Å; N87-A114 WeakPolarHBondContact O-CA 3.34Å; N87-A114 VanDerWaalsContact O-CB 3.25Å; N87-A114 WeakPolarHBondContact O-CB 3.38Å; V110-A114 HydrophobicContact CG2-CB 3.82Å; E111-A114 VanDerWaalsContact O-CB 3.3Å; E111-A114 WeakPolarHBondContact O-CB 3.42Å; E111-A114 PolarHBondContact O-N 3.46Å; E111-A114 VanDerWaalsContact O-N 3.11Å; P112-A114 VanDerWaalsContact C-N 3.35Å
115	F	96.9	Very high	96.5	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.009	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106	22.8	179	-53.6	-64.8	0	0	0	113.2	L86 F91 L100 L102 V110 G113 L118 L124 L126 V138 L142	L86-F115 HydrophobicContact CD1-CE1 4.13Å; L86-F115 HydrophobicContact CD1-CZ 3.77Å; F91-F115 HydrophobicContact CD2-CD1 4.09Å; F91-F115 HydrophobicContact CD2-CE1 4.26Å; F91-F115 HydrophobicContact CE2-CD1 4.39Å; F91-F115 HydrophobicContact CE2-CE1 4.1Å; L100-F115 HydrophobicContact CD2-CD1 4.1Å; L100-F115 HydrophobicContact CD2-CE1 3.92Å; L102-F115 HydrophobicContact CD1-CE1 4.37Å; V110-F115 HydrophobicContact CG2-CE2 3.96Å; V110-F115 HydrophobicContact CG2-CZ 4.38Å; G113-F115 PolarHBondContact O-N 2.89Å; F115-L118 HydrophobicContact CB-CD1 4.08Å; F115-L118 HydrophobicContact CD1-CD1 4.11Å; F115-L118 WeakPolarHBondContact O-CB 3.31Å; F115-L118 PolarHBondContact O-N 3Å; F115-L124 HydrophobicContact CD2-CD2 4.36Å; F115-L124 HydrophobicContact CE1-CD1 3.96Å; F115-L124 HydrophobicContact CE1-CD2 4.33Å; F115-L124 HydrophobicContact CE2-CD2 3.98Å; F115-L124 HydrophobicContact CZ-CD1 4.15Å; F115-L124 HydrophobicContact CZ-CD2 3.97Å; F115-L126 HydrophobicContact CZ-CD1 4.39Å; F115-V138 HydrophobicContact CD2-CG1 3.9Å; F115-V138 HydrophobicContact CE2-CG1 3.7Å; F115-L142 HydrophobicContact CB-CD1 3.87Å; F115-L142 HydrophobicContact CB-CD2 4.02Å; F115-L142 HydrophobicContact CB-CG 4.2Å; F115-L142 HydrophobicContact CD2-CD1 4.16Å; F115-L142 HydrophobicContact CG-CD1 4.19Å
116	N	95.1	Very high	96.5	Very high	54 Å²	54	37.9 Å²	37.9	29%	0.289	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	151.9	175.6	-81.1	-14.3	0	0	0	111.8	D89 G113 L118	D89-N116 WeakPolarHBondContact OD1-CB 3.44Å; D89-N116 PolarHBondContact OD1-ND2 3.5Å; G113-N116 VanDerWaalsContact CA-CG 3.5Å; G113-N116 WeakPolarHBondContact CA-OD1 3.43Å; G113-N116 VanDerWaalsContact O-CB 3.31Å; G113-N116 WeakPolarHBondContact O-CB 3.23Å; G113-N116 PolarHBondContact O-N 3.23Å; G113-N116 VanDerWaalsContact O-N 3.12Å; G113-N116 PolarHBondContact O-ND2 3.3Å; N116-L118 PolarHBondContact O-N 3.12Å; N116-L118 VanDerWaalsContact O-N 3.11Å
117	N	94.8	Very high	96.4	Very high	66 Å²	66	40.2 Å²	40.2	35%	0.353	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.4	5.7	179.9	-154.1	36	0	0	0	115.2	A92 P95 F119	A92-N117 HydrophobicContact CB-CB 4.2Å; A92-N117 PolarHBondContact O-ND2 3.01Å; P95-N117 WeakPolarHBondContact CA-O 3.32Å; N117-F119 VanDerWaalsContact C-N 3.31Å; N117-F119 PolarHBondContact O-N 3.34Å; N117-F119 WeakPolarHBondContact OD1-CE2 3.2Å
118	L	96.4	Very high	96.4	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	22%	0.215	C	C	.	.			trans	-91.6	51.8	177	-58.1	-171.9	0	0	0	112.6	F91 F94 L97 L100 F115 N116 N120 L121 L142	F91-L118 HydrophobicContact CB-CD1 3.83Å; F91-L118 HydrophobicContact CB-CD2 4.03Å; F91-L118 HydrophobicContact CB-CG 4.25Å; F91-L118 HydrophobicContact CG-CD1 4.45Å; F91-L118 WeakPolarHBondContact O-CD2 3.1Å; F94-L118 WeakPolarHBondContact O-CD2 3.4Å; L97-L118 HydrophobicContact CB-CD2 4.3Å; L97-L118 HydrophobicContact CD1-CD2 4.07Å; L100-L118 HydrophobicContact CD2-CD1 4.28Å; F115-L118 HydrophobicContact CB-CD1 4.08Å; F115-L118 HydrophobicContact CD1-CD1 4.11Å; F115-L118 WeakPolarHBondContact O-CB 3.31Å; F115-L118 PolarHBondContact O-N 3Å; N116-L118 PolarHBondContact O-N 3.12Å; N116-L118 VanDerWaalsContact O-N 3.11Å; L118-N120 PolarHBondContact O-N 3.17Å; L118-L121 HydrophobicContact CB-CB 4.14Å; L118-L121 HydrophobicContact CB-CD2 4.47Å; L118-L121 HydrophobicContact CD1-CD2 4.1Å; L118-L121 VanDerWaalsContact O-CB 3.32Å; L118-L121 WeakPolarHBondContact O-CB 3.49Å; L118-L121 PolarHBondContact O-N 3.26Å; L118-L142 HydrophobicContact CB-CD2 3.99Å
119	F	94.9	Very high	96.4	Very high	108 Å²	108	38.7 Å²	38.7	47%	0.474	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-18.8	-173.5	-50.8	-59.9	0	0	0	114.1	N117 N144	N117-F119 VanDerWaalsContact C-N 3.31Å; N117-F119 PolarHBondContact O-N 3.34Å; N117-F119 WeakPolarHBondContact OD1-CE2 3.2Å; F119-N144 VanDerWaalsContact O-CB 3.31Å; F119-N144 WeakPolarHBondContact O-CB 3.32Å; F119-N144 PolarHBondContact O-ND2 3.46Å
120	N	96.3	Very high	96.4	Very high	76 Å²	76	43.3 Å²	43.3	41%	0.406	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-2.9	179.6	-64.8	-50.8	0	0	0	113.3	P95 L97 L118 R122	P95-N120 PolarHBondContact O-ND2 2.8Å; L97-N120 CarbonylContact O-C 3.55Å; L118-N120 PolarHBondContact O-N 3.17Å; N120-R122 PolarHBondContact O-N 3.08Å
121	L	97.9	Very high	96.3	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.202	C	C	.	.			trans	-66.6	127.3	-172.8	-159.9	72.8	0	0	0	110.6	L97 L100 L118 L124 L142 N144 L145	L97-L121 HydrophobicContact CB-CD1 3.95Å; L97-L121 WeakPolarHBondContact O-CA 3.36Å; L97-L121 PolarHBondContact O-N 3.09Å; L97-L121 VanDerWaalsContact O-N 3.13Å; L100-L121 HydrophobicContact CB-CD1 3.79Å; L100-L121 HydrophobicContact CB-CD2 4.46Å; L118-L121 HydrophobicContact CB-CB 4.14Å; L118-L121 HydrophobicContact CB-CD2 4.47Å; L118-L121 HydrophobicContact CD1-CD2 4.1Å; L118-L121 VanDerWaalsContact O-CB 3.32Å; L118-L121 WeakPolarHBondContact O-CB 3.49Å; L118-L121 PolarHBondContact O-N 3.26Å; L121-L124 HydrophobicContact CD2-CB 4.22Å; L121-L124 HydrophobicContact CD2-CD1 4.47Å; L121-L142 HydrophobicContact CB-CD2 4.28Å; L121-L142 HydrophobicContact CD2-CD2 4.09Å; L121-N144 CarbonylContact O-C 3.16Å; L121-L145 HydrophobicContact CB-CD1 4.31Å; L121-L145 HydrophobicContact CD2-CD1 3.97Å; L121-L145 HydrophobicContact CG-CD1 3.94Å; L121-L145 VanDerWaalsContact O-CA 3.26Å; L121-L145 WeakPolarHBondContact O-CA 3.4Å; L121-L145 PolarHBondContact O-N 2.86Å
122	R	97.8	Very high	96.2	Very high	138 Å²	138	45.8 Å²	45.8	52%	0.521	21%	0.213	S	C	.	.			trans	-111.9	-34.3	-178.5	-65.3	-177.9	175.5	177	1.2	112.4	E98 N120 T146 K147	E98-R122 WeakPolarHBondContact O-CA 3.32Å; E98-R122 WeakPolarHBondContact O-CB 3.5Å; E98-R122 PolarHBondContact O-N 2.97Å; E98-R122 IonicContact OE2-NH1 2.7Å; N120-R122 PolarHBondContact O-N 3.08Å; R122-T146 PolarHBondContact O-N 3.06Å; R122-T146 PolarHBondContact O-OG1 3.26Å; R122-K147 PolarHBondContact O-N 2.96Å
123	T	98.2	Very high	95.9	Very high	23 Å²	23	47.6 Å²	47.6	14%	0.141	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	126.8	-178.4	-56	0	0	0	0	109.5	E98 E99 L100 E101 K147	E98-T123 PolarHBondContact O-N 3.2Å; E98-T123 VanDerWaalsContact O-N 3.1Å; E99-T123 HydrophobicContact CG-CG2 4.21Å; L100-T123 PolarHBondContact N-O 3.05Å; E101-T123 WeakPolarHBondContact OE1-CG2 3.32Å; T123-K147 WeakPolarHBondContact CA-O 3.06Å; T123-K147 HydrophobicContact CG2-CB 4.37Å; T123-K147 HydrophobicContact CG2-CD 4.23Å
124	L	98	Very high	95.7	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	115.8	172.8	177.4	60.3	0	0	0	109.3	L100 F115 L121 L126 F139 L142 L145 K147 L148 D149	L100-L124 HydrophobicContact CB-CD1 4.18Å; L100-L124 HydrophobicContact CD2-CD1 3.96Å; L100-L124 HydrophobicContact CG-CD1 4.08Å; L100-L124 WeakPolarHBondContact O-CA 3.46Å; F115-L124 HydrophobicContact CD2-CD2 4.36Å; F115-L124 HydrophobicContact CE1-CD1 3.96Å; F115-L124 HydrophobicContact CE1-CD2 4.33Å; F115-L124 HydrophobicContact CE2-CD2 3.98Å; F115-L124 HydrophobicContact CZ-CD1 4.15Å; F115-L124 HydrophobicContact CZ-CD2 3.97Å; L121-L124 HydrophobicContact CD2-CB 4.22Å; L121-L124 HydrophobicContact CD2-CD1 4.47Å; L124-L126 HydrophobicContact CD1-CG 4.39Å; L124-L126 HydrophobicContact CD2-CD1 4.16Å; L124-L126 HydrophobicContact CG-CD1 4.28Å; L124-L126 HydrophobicContact CG-CG 4.32Å; L124-F139 HydrophobicContact CD2-CE1 4.17Å; L124-L142 HydrophobicContact CD2-CD1 4.31Å; L124-L145 HydrophobicContact CB-CD1 3.83Å; L124-L145 HydrophobicContact CB-CD2 4.16Å; L124-K147 PolarHBondContact N-O 3.02Å; L124-L148 HydrophobicContact CB-CD1 4.11Å; L124-L148 HydrophobicContact CD2-CD1 3.99Å; L124-L148 HydrophobicContact CG-CD1 4.05Å; L124-D149 PolarHBondContact O-N 3.36Å; L124-D149 VanDerWaalsContact O-N 3.15Å
125	G	97.4	Very high	95.4	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	120.8	175.4	0	0	0	0	0	111.7	L100 E101 L102 N103	L100-G125 PolarHBondContact O-N 2.96Å; E101-G125 WeakPolarHBondContact OE2-CA 3.21Å; L102-G125 WeakPolarHBondContact CA-O 3.37Å; L102-G125 WeakPolarHBondContact CB-O 3.05Å; L102-G125 PolarHBondContact N-O 3.01Å; N103-G125 VanDerWaalsContact OD1-CA 3.23Å; N103-G125 WeakPolarHBondContact OD1-CA 3.25Å; N103-G125 PolarHBondContact OD1-O 2.86Å
126	L	96.5	Very high	95.1	Very high	3 Å²	3	55.4 Å²	55.4	2%	0.016	26%	0.26	C	S	.	.			trans	-126.9	19	174.2	-72.1	167.7	0	0	0	111.5	L86 L102 N103 F115 L124 N129 L131 D149 I150 N153	L86-L126 HydrophobicContact CD1-CD2 4.28Å; L102-L126 HydrophobicContact CB-CD2 3.98Å; L102-L126 HydrophobicContact CD1-CD2 4.09Å; N103-L126 PolarHBondContact OD1-N 3.04Å; F115-L126 HydrophobicContact CZ-CD1 4.39Å; L124-L126 HydrophobicContact CD1-CG 4.39Å; L124-L126 HydrophobicContact CD2-CD1 4.16Å; L124-L126 HydrophobicContact CG-CD1 4.28Å; L124-L126 HydrophobicContact CG-CG 4.32Å; L126-N129 PolarHBondContact O-ND2 2.83Å; L126-L131 HydrophobicContact CB-CD1 4.31Å; L126-L131 HydrophobicContact CD1-CD1 4.3Å; L126-D149 CarbonylContact C-O 3.19Å; L126-D149 WeakPolarHBondContact CA-O 3.36Å; L126-D149 PolarHBondContact N-O 3.06Å; L126-I150 HydrophobicContact CB-CG2 4.35Å; L126-N153 PolarHBondContact O-ND2 3.11Å
127	R	95.9	Very high	94.8	Very high	87 Å²	87	53.9 Å²	53.9	33%	0.328	26%	0.257	S	S	.	.			trans	-65.2	154.1	-177.7	61.3	170.2	-66.8	-179.2	10.9	112.7	N103 E104 N129 D149 S151 E152	N103-R127 CarbonylContact C-O 3.54Å; N103-R127 VanDerWaalsContact CA-O 3.3Å; N103-R127 WeakPolarHBondContact CA-O 3.3Å; N103-R127 HydrophobicContact CB-CG 3.65Å; N103-R127 WeakPolarHBondContact OD1-CG 3.4Å; N103-R127 PolarHBondContact OD1-N 3.42Å; E104-R127 PolarHBondContact N-O 3.38Å; R127-N129 PolarHBondContact O-N 3.28Å; R127-N129 PolarHBondContact O-ND2 3.29Å; R127-D149 WeakPolarHBondContact CD-OD2 3.12Å; R127-D149 PolarHBondContact N-O 3.02Å; R127-S151 CarbonylContact C-O 3.59Å; R127-S151 WeakPolarHBondContact CA-O 3.27Å; R127-S151 WeakPolarHBondContact CB-OG 3.32Å; R127-E152 IonicContact CZ-OE1 3.24Å; R127-E152 IonicContact NH2-OE1 3.97Å; R127-E152 PolarHBondContact NH2-OE1 3.16Å; R127-E152 IonicContact NH2-OE2 3.91Å
128	S	96.1	Very high	94.8	Very high	21 Å²	21	50.8 Å²	50.8	15%	0.147	24%	0.241	C	C	.	.	S	Bend	trans	59.5	48.2	173.7	-41.6	0	0	0	0	111.7	E104 N105 S151 E152	E104-S128 WeakPolarHBondContact CA-O 3.45Å; N105-S128 PolarHBondContact N-O 2.92Å; S128-S151 PolarHBondContact N-O 3.17Å; S128-E152 CarbonylContact C-O 3.14Å; S128-E152 WeakPolarHBondContact CA-O 2.96Å; S128-E152 WeakPolarHBondContact CB-OE2 3.4Å; S128-E152 PolarHBondContact N-O 3.06Å; S128-E152 VanDerWaalsContact OG-CD 3.29Å; S128-E152 PolarHBondContact OG-OE2 3.31Å
129	N	96.4	Very high	94.8	Very high	8 Å²	8	51 Å²	51	4%	0.043	24%	0.242	C	C	.	.	S	Bend	trans	-119.8	-164.3	178.6	-87.3	-69	0	0	0	110.6	L102 N105 I106 V107 L126 R127 E152 N153	L102-N129 PolarHBondContact O-ND2 3.49Å; N105-N129 VanDerWaalsContact CA-OD1 3.32Å; N105-N129 WeakPolarHBondContact CA-OD1 3.28Å; N105-N129 WeakPolarHBondContact CB-OD1 3.4Å; N105-N129 PolarHBondContact N-OD1 2.65Å; N105-N129 PolarHBondContact O-OD1 3.47Å; I106-N129 PolarHBondContact N-OD1 3.35Å; V107-N129 HydrophobicContact CB-CB 4.29Å; V107-N129 WeakPolarHBondContact CB-OD1 3.43Å; V107-N129 WeakPolarHBondContact CG2-OD1 3.13Å; V107-N129 PolarHBondContact N-OD1 2.75Å; L126-N129 PolarHBondContact O-ND2 2.83Å; R127-N129 PolarHBondContact O-N 3.28Å; R127-N129 PolarHBondContact O-ND2 3.29Å; N129-E152 PolarHBondContact N-O 3.38Å; N129-E152 VanDerWaalsContact N-O 3.08Å; N129-N153 WeakPolarHBondContact CA-OD1 3.35Å; N129-N153 WeakPolarHBondContact CB-OD1 3.22Å
130	R	96	Very high	94.8	Very high	145 Å²	145	49 Å²	49	55%	0.547	24%	0.238	S	C	.	.			trans	-122.3	24.4	-176.6	-60.9	-177	-179.7	-164.9	-1.7	112.4	V107 K132 N153	V107-R130 CarbonylContact O-C 3.6Å; V107-R130 VanDerWaalsContact O-CA 3.28Å; V107-R130 WeakPolarHBondContact O-CA 3.4Å; V107-R130 PolarHBondContact O-N 3.1Å; R130-K132 PolarHBondContact O-N 3.13Å; R130-N153 PolarHBondContact N-OD1 2.93Å
131	L	94.5	Very high	94.6	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.005	24%	0.237	C	C	.	.			trans	-65.7	122.7	-177.7	-63.2	171.9	0	0	0	109.8	V107 V110 L126 N153 K154 I155	V107-L131 HydrophobicContact CG1-CD2 3.88Å; V107-L131 PolarHBondContact O-N 3.18Å; V110-L131 HydrophobicContact CG1-CD2 4.16Å; L126-L131 HydrophobicContact CB-CD1 4.31Å; L126-L131 HydrophobicContact CD1-CD1 4.3Å; L131-N153 HydrophobicContact CB-CB 4.28Å; L131-N153 VanDerWaalsContact CB-OD1 3.27Å; L131-N153 WeakPolarHBondContact CB-OD1 3.38Å; L131-N153 WeakPolarHBondContact CG-OD1 3.34Å; L131-N153 PolarHBondContact N-OD1 2.78Å; L131-K154 CarbonylContact O-C 3.49Å; L131-K154 WeakPolarHBondContact O-CA 3.37Å; L131-K154 PolarHBondContact O-N 2.93Å; L131-I155 WeakPolarHBondContact O-CG1 3.31Å; L131-I155 PolarHBondContact O-N 2.8Å
132	K	91.9	Very high	94.5	Very high	151 Å²	151	47.2 Å²	47.2	66%	0.657	24%	0.237	S	C	*	.	S	Bend	trans	-92.8	-31.3	176.3	-69	-176	178.2	-177.1	0	113.5	R130 K154 I155	R130-K132 PolarHBondContact O-N 3.13Å; K132-K154 WeakPolarHBondContact CA-O 3.49Å; K132-K154 HydrophobicContact CG-CB 4.1Å; K132-I155 WeakPolarHBondContact O-CA 3.42Å
133	L	90.9	Very high	94.2	Very high	106 Å²	106	42.1 Å²	42.1	56%	0.555	22%	0.223	S	C	*	.			trans	-152.9	150.8	179.1	67.3	97.1	0	0	0	107.7	P135	L133-P135 HydrophobicContact CD1-CB 4.17Å; L133-P135 HydrophobicContact CD1-CG 4.35Å
134	I	91.7	Very high	94.1	Very high	8 Å²	8	44.6 Å²	44.6	4%	0.041	24%	0.236	C	C	.	.			trans	-110.9	110.1	170.1	-59.1	173.6	0	0	0	106	V138 F139 I150 I155	I134-V138 HydrophobicContact CG2-CB 4.02Å; I134-V138 HydrophobicContact CG2-CG1 4.15Å; I134-V138 HydrophobicContact CG2-CG2 4.27Å; I134-F139 HydrophobicContact CD1-CE2 4.21Å; I134-F139 HydrophobicContact CD1-CZ 3.99Å; I134-F139 HydrophobicContact CG2-CD2 4.33Å; I134-F139 HydrophobicContact CG2-CE2 3.7Å; I134-F139 HydrophobicContact CG2-CZ 3.97Å; I134-I150 HydrophobicContact CD1-CD1 4.22Å; I134-I150 HydrophobicContact CD1-CG2 4.04Å; I134-I155 HydrophobicContact CD1-CD1 4.18Å; I134-I155 HydrophobicContact CG1-CD1 4.5Å
135	P	90.8	Very high	94.1	Very high	43 Å²	43	44.6 Å²	44.6	28%	0.279	24%	0.235	S	C	.	.			trans	-68.9	155.4	-179.2	25.4	-28.8	0	0	0	111.2	V110 L133 V138	V110-P135 WeakPolarHBondContact O-CG 3.43Å; L133-P135 HydrophobicContact CD1-CB 4.17Å; L133-P135 HydrophobicContact CD1-CG 4.35Å; P135-V138 HydrophobicContact CG-CG2 3.66Å; P135-V138 WeakPolarHBondContact O-CG2 3.47Å
136	L	88.7	Confident	94.2	Very high	122 Å²	122	46.8 Å²	46.8	64%	0.639	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	142	171.4	-62.7	168.2	0	0	0	109.4
137	G	89.4	Confident	94.2	Very high	22 Å²	22	51.1 Å²	51.1	23%	0.227	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	97.3	-12.6	-178.7	0	0	0	0	0	115.2	G113 T140	G113-G137 PolarHBondContact N-O 3.24Å; G137-T140 VanDerWaalsContact CA-OG1 3.31Å; G137-T140 WeakPolarHBondContact CA-OG1 3.33Å
138	V	95.6	Very high	94.3	Very high	2 Å²	2	47 Å²	47	1%	0.012	25%	0.252	C	S	.	.	S	Bend	trans	-69.5	-40.5	179.1	171.3	0	0	0	0	112	V110 F115 I134 P135	V110-V138 HydrophobicContact CB-CG1 4.45Å; V110-V138 HydrophobicContact CG1-CG1 4.04Å; V110-V138 HydrophobicContact CG1-CG2 3.98Å; V110-V138 HydrophobicContact CG2-CB 4.47Å; V110-V138 HydrophobicContact CG2-CG1 3.54Å; V110-V138 HydrophobicContact CG2-CG2 4.07Å; F115-V138 HydrophobicContact CD2-CG1 3.9Å; F115-V138 HydrophobicContact CE2-CG1 3.7Å; I134-V138 HydrophobicContact CG2-CB 4.02Å; I134-V138 HydrophobicContact CG2-CG1 4.15Å; I134-V138 HydrophobicContact CG2-CG2 4.27Å; P135-V138 HydrophobicContact CG-CG2 3.66Å; P135-V138 WeakPolarHBondContact O-CG2 3.47Å
139	F	95.8	Very high	94.3	Very high	6 Å²	6	46.9 Å²	46.9	3%	0.026	25%	0.25	C	C	.	.	S	Bend	trans	-93.9	1.9	-177.7	-62.7	-46.8	0	0	0	113.8	L124 I134 G141 L142 L148 F163 D165 L166	L124-F139 HydrophobicContact CD2-CE1 4.17Å; I134-F139 HydrophobicContact CD1-CE2 4.21Å; I134-F139 HydrophobicContact CD1-CZ 3.99Å; I134-F139 HydrophobicContact CG2-CD2 4.33Å; I134-F139 HydrophobicContact CG2-CE2 3.7Å; I134-F139 HydrophobicContact CG2-CZ 3.97Å; F139-G141 PolarHBondContact O-N 3.18Å; F139-L142 HydrophobicContact CD1-CD1 4.08Å; F139-L142 WeakPolarHBondContact O-CB 3.45Å; F139-L142 PolarHBondContact O-N 2.78Å; F139-L142 VanDerWaalsContact O-N 3.15Å; F139-L148 HydrophobicContact CE1-CD1 4.24Å; F139-L148 HydrophobicContact CE1-CD2 4.11Å; F139-L148 HydrophobicContact CE2-CD2 4.16Å; F139-L148 HydrophobicContact CZ-CD1 4.36Å; F139-L148 HydrophobicContact CZ-CD2 3.69Å; F139-F163 HydrophobicContact CD2-CD1 4.41Å; F139-F163 HydrophobicContact CE2-CD1 4.01Å; F139-F163 HydrophobicContact CE2-CE1 4.04Å; F139-D165 HydrophobicContact CB-CB 4.43Å; F139-L166 HydrophobicContact CB-CD1 4.25Å; F139-L166 HydrophobicContact CB-CD2 3.83Å; F139-L166 HydrophobicContact CB-CG 3.93Å; F139-L166 HydrophobicContact CD1-CD1 4.3Å; F139-L166 HydrophobicContact CD2-CD1 3.91Å; F139-L166 HydrophobicContact CD2-CG 4.42Å; F139-L166 HydrophobicContact CE2-CD1 4.29Å; F139-L166 HydrophobicContact CG-CD1 3.91Å; F139-L166 HydrophobicContact CG-CD2 4.23Å; F139-L166 HydrophobicContact CG-CG 4.16Å
140	T	94.1	Very high	94.3	Very high	65 Å²	65	46.5 Å²	46.5	40%	0.399	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	131.9	-179.8	-55.9	0	0	0	0	110	G137 L142 D165	G137-T140 VanDerWaalsContact CA-OG1 3.31Å; G137-T140 WeakPolarHBondContact CA-OG1 3.33Å; T140-L142 VanDerWaalsContact C-N 3.33Å; T140-D165 WeakPolarHBondContact CA-OD2 3.24Å; T140-D165 PolarHBondContact N-OD2 3.03Å; T140-D165 PolarHBondContact OG1-OD2 3.42Å
141	G	92.3	Very high	94.1	Very high	37 Å²	37	39.7 Å²	39.7	38%	0.381	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.6	-11.2	-177	0	0	0	0	0	115.2	F139 S143	F139-G141 PolarHBondContact O-N 3.18Å; G141-S143 PolarHBondContact O-N 2.6Å
142	L	95.8	Very high	94.1	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.005	24%	0.235	C	C	.	.			trans	-83.9	46.6	176.2	-62.5	-177.2	0	0	0	112.8	F115 L118 L121 L124 F139 T140 N144 L145 L166	F115-L142 HydrophobicContact CB-CD1 3.87Å; F115-L142 HydrophobicContact CB-CD2 4.02Å; F115-L142 HydrophobicContact CB-CG 4.2Å; F115-L142 HydrophobicContact CD2-CD1 4.16Å; F115-L142 HydrophobicContact CG-CD1 4.19Å; L118-L142 HydrophobicContact CB-CD2 3.99Å; L121-L142 HydrophobicContact CB-CD2 4.28Å; L121-L142 HydrophobicContact CD2-CD2 4.09Å; L124-L142 HydrophobicContact CD2-CD1 4.31Å; F139-L142 HydrophobicContact CD1-CD1 4.08Å; F139-L142 WeakPolarHBondContact O-CB 3.45Å; F139-L142 PolarHBondContact O-N 2.78Å; F139-L142 VanDerWaalsContact O-N 3.15Å; T140-L142 VanDerWaalsContact C-N 3.33Å; L142-N144 VanDerWaalsContact C-N 3.25Å; L142-N144 PolarHBondContact O-N 2.92Å; L142-L145 HydrophobicContact CB-CB 4.24Å; L142-L145 HydrophobicContact CD1-CD2 4.47Å; L142-L145 VanDerWaalsContact O-CB 3.31Å; L142-L145 WeakPolarHBondContact O-CB 3.47Å; L142-L145 PolarHBondContact O-N 3.15Å; L142-L166 HydrophobicContact CB-CD2 3.93Å
143	S	93.2	Very high	94.2	Very high	32 Å²	32	35.2 Å²	35.2	22%	0.224	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-19.5	-175.7	53.7	0	0	0	0	114.1	G141 Y167 N168	G141-S143 PolarHBondContact O-N 2.6Å; S143-Y167 WeakPolarHBondContact CB-OH 3.47Å; S143-N168 WeakPolarHBondContact O-CB 3.48Å; S143-N168 PolarHBondContact O-ND2 3.06Å
144	N	96.3	Very high	94.3	Very high	75 Å²	75	34.6 Å²	34.6	40%	0.401	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	1	176.6	-76.5	-21.5	0	0	0	113.6	F119 L121 L142 T146	F119-N144 VanDerWaalsContact O-CB 3.31Å; F119-N144 WeakPolarHBondContact O-CB 3.32Å; F119-N144 PolarHBondContact O-ND2 3.46Å; L121-N144 CarbonylContact O-C 3.16Å; L142-N144 VanDerWaalsContact C-N 3.25Å; L142-N144 PolarHBondContact O-N 2.92Å; N144-T146 WeakPolarHBondContact O-CG2 3.17Å; N144-T146 PolarHBondContact O-N 2.7Å
145	L	97.8	Very high	94.3	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.194	C	C	.	.			trans	-66.8	128.4	-179.2	-160.5	74.7	0	0	0	110	L121 L124 L142 L148 L166 N168 L169	L121-L145 HydrophobicContact CB-CD1 4.31Å; L121-L145 HydrophobicContact CD2-CD1 3.97Å; L121-L145 HydrophobicContact CG-CD1 3.94Å; L121-L145 VanDerWaalsContact O-CA 3.26Å; L121-L145 WeakPolarHBondContact O-CA 3.4Å; L121-L145 PolarHBondContact O-N 2.86Å; L124-L145 HydrophobicContact CB-CD1 3.83Å; L124-L145 HydrophobicContact CB-CD2 4.16Å; L142-L145 HydrophobicContact CB-CB 4.24Å; L142-L145 HydrophobicContact CD1-CD2 4.47Å; L142-L145 VanDerWaalsContact O-CB 3.31Å; L142-L145 WeakPolarHBondContact O-CB 3.47Å; L142-L145 PolarHBondContact O-N 3.15Å; L145-L148 HydrophobicContact CD2-CB 4.18Å; L145-L148 HydrophobicContact CD2-CD1 4.46Å; L145-L166 HydrophobicContact CB-CD2 4.16Å; L145-L166 HydrophobicContact CD2-CD1 4.39Å; L145-L166 HydrophobicContact CD2-CD2 3.86Å; L145-N168 CarbonylContact O-C 3.56Å; L145-L169 HydrophobicContact CB-CD1 4.36Å; L145-L169 HydrophobicContact CD2-CD1 4.04Å; L145-L169 HydrophobicContact CG-CD1 4.06Å; L145-L169 VanDerWaalsContact O-CA 3.3Å; L145-L169 WeakPolarHBondContact O-CA 3.23Å; L145-L169 PolarHBondContact O-N 2.7Å
146	T	97.9	Very high	94.4	Very high	48 Å²	48	35.3 Å²	35.3	29%	0.294	20%	0.2	S	C	.	.			trans	-111.8	-28.1	-177.4	63.7	0	0	0	0	112.7	R122 N144 K170 S171	R122-T146 PolarHBondContact O-N 3.06Å; R122-T146 PolarHBondContact O-OG1 3.26Å; N144-T146 WeakPolarHBondContact O-CG2 3.17Å; N144-T146 PolarHBondContact O-N 2.7Å; T146-K170 WeakPolarHBondContact O-CA 3.48Å; T146-K170 PolarHBondContact O-N 2.75Å; T146-S171 PolarHBondContact O-N 2.94Å
147	K	98.3	Very high	94.5	Very high	94 Å²	94	33 Å²	33	41%	0.409	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	127.6	-178.9	-172.8	179.8	177.4	-163.8	0	110.3	R122 T123 L124 S171	R122-K147 PolarHBondContact O-N 2.96Å; T123-K147 WeakPolarHBondContact CA-O 3.06Å; T123-K147 HydrophobicContact CG2-CB 4.37Å; T123-K147 HydrophobicContact CG2-CD 4.23Å; L124-K147 PolarHBondContact N-O 3.02Å; K147-S171 WeakPolarHBondContact CA-O 3.2Å
148	L	97.6	Very high	94.7	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	128.8	175.2	176.4	63.1	0	0	0	109.2	L124 F139 L145 I150 F163 L166 L169 S171 L172 E173	L124-L148 HydrophobicContact CB-CD1 4.11Å; L124-L148 HydrophobicContact CD2-CD1 3.99Å; L124-L148 HydrophobicContact CG-CD1 4.05Å; F139-L148 HydrophobicContact CE1-CD1 4.24Å; F139-L148 HydrophobicContact CE1-CD2 4.11Å; F139-L148 HydrophobicContact CE2-CD2 4.16Å; F139-L148 HydrophobicContact CZ-CD1 4.36Å; F139-L148 HydrophobicContact CZ-CD2 3.69Å; L145-L148 HydrophobicContact CD2-CB 4.18Å; L145-L148 HydrophobicContact CD2-CD1 4.46Å; L148-I150 HydrophobicContact CD1-CG2 3.96Å; L148-I150 HydrophobicContact CD2-CG2 4.34Å; L148-I150 HydrophobicContact CG-CG2 4.07Å; L148-F163 HydrophobicContact CD2-CD1 4.28Å; L148-F163 HydrophobicContact CD2-CE1 4.1Å; L148-L166 HydrophobicContact CD2-CD1 3.63Å; L148-L169 HydrophobicContact CB-CD1 3.84Å; L148-L169 HydrophobicContact CB-CD2 4.12Å; L148-S171 PolarHBondContact N-O 3.3Å; L148-S171 VanDerWaalsContact N-O 3.07Å; L148-L172 HydrophobicContact CB-CD1 4.09Å; L148-L172 HydrophobicContact CD2-CD1 3.93Å; L148-L172 HydrophobicContact CG-CD1 4.05Å; L148-E173 PolarHBondContact O-N 3.28Å
149	D	96.4	Very high	94.6	Very high	18 Å²	18	36.7 Å²	36.7	10%	0.096	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	114.3	173.5	-173.8	-2.9	0	0	0	110.2	L124 L126 R127 S151 E173	L124-D149 PolarHBondContact O-N 3.36Å; L124-D149 VanDerWaalsContact O-N 3.15Å; L126-D149 CarbonylContact C-O 3.19Å; L126-D149 WeakPolarHBondContact CA-O 3.36Å; L126-D149 PolarHBondContact N-O 3.06Å; R127-D149 WeakPolarHBondContact CD-OD2 3.12Å; R127-D149 PolarHBondContact N-O 3.02Å; D149-S151 VanDerWaalsContact OD1-CB 3.23Å; D149-S151 WeakPolarHBondContact OD1-CB 3.32Å; D149-S151 PolarHBondContact OD1-N 3.44Å; D149-S151 PolarHBondContact OD1-OG 3.37Å; D149-E173 HydrophobicContact CB-CB 4.41Å
150	I	94.5	Very high	94.6	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.219	C	C	.	.			trans	-121	22.9	176.1	56	168.7	0	0	0	111.2	L126 I134 L148 N153 I155 F163 E173 V174 N177	L126-I150 HydrophobicContact CB-CG2 4.35Å; I134-I150 HydrophobicContact CD1-CD1 4.22Å; I134-I150 HydrophobicContact CD1-CG2 4.04Å; L148-I150 HydrophobicContact CD1-CG2 3.96Å; L148-I150 HydrophobicContact CD2-CG2 4.34Å; L148-I150 HydrophobicContact CG-CG2 4.07Å; I150-N153 PolarHBondContact O-ND2 3.42Å; I150-I155 HydrophobicContact CD1-CD1 4.13Å; I150-F163 HydrophobicContact CD1-CE1 3.9Å; I150-F163 HydrophobicContact CD1-CZ 3.66Å; I150-E173 WeakPolarHBondContact CG1-O 3.48Å; I150-E173 PolarHBondContact N-O 3.14Å; I150-V174 HydrophobicContact CD1-CG1 4.2Å; I150-V174 HydrophobicContact CD1-CG2 3.96Å; I150-V174 HydrophobicContact CG1-CB 4.44Å; I150-V174 HydrophobicContact CG1-CG1 4.34Å; I150-V174 HydrophobicContact CG1-CG2 4.01Å; I150-N177 PolarHBondContact O-ND2 3.43Å
151	S	93.7	Very high	94.7	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.014	22%	0.215	C	C	.	.			trans	-66.5	164.8	175.3	63.9	0	0	0	0	112.6	R127 S128 D149 N153 G175	R127-S151 CarbonylContact C-O 3.59Å; R127-S151 WeakPolarHBondContact CA-O 3.27Å; R127-S151 WeakPolarHBondContact CB-OG 3.32Å; S128-S151 PolarHBondContact N-O 3.17Å; D149-S151 VanDerWaalsContact OD1-CB 3.23Å; D149-S151 WeakPolarHBondContact OD1-CB 3.32Å; D149-S151 PolarHBondContact OD1-N 3.44Å; D149-S151 PolarHBondContact OD1-OG 3.37Å; S151-N153 VanDerWaalsContact C-N 3.33Å; S151-N153 PolarHBondContact O-N 3.44Å; S151-N153 PolarHBondContact O-ND2 2.8Å; S151-G175 CarbonylContact C-O 3.41Å; S151-G175 VanDerWaalsContact C-O 3.27Å; S151-G175 WeakPolarHBondContact CA-O 3.17Å
152	E	92.8	Very high	94.7	Very high	58 Å²	58	39.7 Å²	39.7	27%	0.271	20%	0.201	S	C	.	.	S	Bend	trans	53.7	44.8	177	-61.7	179	-145.4	0	0	113.6	R127 S128 N129 G175 D176	R127-E152 IonicContact CZ-OE1 3.24Å; R127-E152 IonicContact NH2-OE1 3.97Å; R127-E152 PolarHBondContact NH2-OE1 3.16Å; R127-E152 IonicContact NH2-OE2 3.91Å; S128-E152 CarbonylContact C-O 3.14Å; S128-E152 WeakPolarHBondContact CA-O 2.96Å; S128-E152 WeakPolarHBondContact CB-OE2 3.4Å; S128-E152 PolarHBondContact N-O 3.06Å; S128-E152 VanDerWaalsContact OG-CD 3.29Å; S128-E152 PolarHBondContact OG-OE2 3.31Å; N129-E152 PolarHBondContact N-O 3.38Å; N129-E152 VanDerWaalsContact N-O 3.08Å; E152-G175 PolarHBondContact N-O 2.86Å; E152-D176 VanDerWaalsContact CA-O 3.32Å; E152-D176 WeakPolarHBondContact CA-O 3.21Å; E152-D176 HydrophobicContact CB-CB 4.2Å; E152-D176 HydrophobicContact CG-CB 3.59Å
153	N	94.1	Very high	94.7	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.201	C	C	.	.	S	Bend	trans	-114.4	-159.9	177.9	-89.3	-80.2	0	0	0	111.4	L126 N129 R130 L131 I150 S151 I155 D176 N177	L126-N153 PolarHBondContact O-ND2 3.11Å; N129-N153 WeakPolarHBondContact CA-OD1 3.35Å; N129-N153 WeakPolarHBondContact CB-OD1 3.22Å; R130-N153 PolarHBondContact N-OD1 2.93Å; L131-N153 HydrophobicContact CB-CB 4.28Å; L131-N153 VanDerWaalsContact CB-OD1 3.27Å; L131-N153 WeakPolarHBondContact CB-OD1 3.38Å; L131-N153 WeakPolarHBondContact CG-OD1 3.34Å; L131-N153 PolarHBondContact N-OD1 2.78Å; I150-N153 PolarHBondContact O-ND2 3.42Å; S151-N153 VanDerWaalsContact C-N 3.33Å; S151-N153 PolarHBondContact O-N 3.44Å; S151-N153 PolarHBondContact O-ND2 2.8Å; N153-I155 HydrophobicContact CB-CD1 4.38Å; N153-I155 HydrophobicContact CB-CG1 4.22Å; N153-D176 PolarHBondContact N-O 3.16Å; N153-N177 WeakPolarHBondContact CA-OD1 3.4Å; N153-N177 WeakPolarHBondContact CB-OD1 3.17Å; N153-N177 PolarHBondContact N-OD1 2.95Å; N153-N177 PolarHBondContact O-OD1 2.83Å
154	K	93.7	Very high	94.8	Very high	92 Å²	92	42.5 Å²	42.5	40%	0.4	21%	0.21	S	C	.	.			trans	-122	26.9	179.2	-62.2	-66.9	163.6	-154.1	0	112.5	L131 K132 V156 N177 D178	L131-K154 CarbonylContact O-C 3.49Å; L131-K154 WeakPolarHBondContact O-CA 3.37Å; L131-K154 PolarHBondContact O-N 2.93Å; K132-K154 WeakPolarHBondContact CA-O 3.49Å; K132-K154 HydrophobicContact CG-CB 4.1Å; K154-V156 PolarHBondContact O-N 3.32Å; K154-N177 PolarHBondContact N-OD1 3.34Å; K154-N177 VanDerWaalsContact N-OD1 3.14Å; K154-D178 WeakPolarHBondContact CD-OD2 3.44Å; K154-D178 IonicContact NZ-OD1 3.81Å; K154-D178 IonicContact NZ-OD2 3.85Å
155	I	92.8	Very high	94.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.204	C	C	.	.			trans	-71.8	121.9	-177.4	-57.7	171.1	0	0	0	109.2	L131 K132 I134 I150 N153 I157 L158 N177 D178 L179	L131-I155 WeakPolarHBondContact O-CG1 3.31Å; L131-I155 PolarHBondContact O-N 2.8Å; K132-I155 WeakPolarHBondContact O-CA 3.42Å; I134-I155 HydrophobicContact CD1-CD1 4.18Å; I134-I155 HydrophobicContact CG1-CD1 4.5Å; I150-I155 HydrophobicContact CD1-CD1 4.13Å; N153-I155 HydrophobicContact CB-CD1 4.38Å; N153-I155 HydrophobicContact CB-CG1 4.22Å; I155-I157 WeakPolarHBondContact CG2-O 3.26Å; I155-L158 HydrophobicContact CG2-CD2 4.07Å; I155-N177 HydrophobicContact CB-CB 4.2Å; I155-N177 WeakPolarHBondContact CB-OD1 3.45Å; I155-N177 WeakPolarHBondContact CG1-OD1 3.45Å; I155-N177 PolarHBondContact N-OD1 2.75Å; I155-N177 WeakPolarHBondContact O-CB 3.22Å; I155-D178 CarbonylContact O-C 3.07Å; I155-D178 VanDerWaalsContact O-C 3.29Å; I155-D178 PolarHBondContact O-N 2.75Å; I155-L179 HydrophobicContact CG2-CD1 4.37Å; I155-L179 WeakPolarHBondContact O-CA 3.3Å; I155-L179 PolarHBondContact O-N 3.35Å; I155-L179 VanDerWaalsContact O-N 3.16Å
156	V	91.4	Very high	94.7	Very high	66 Å²	66	41.2 Å²	41.2	40%	0.4	20%	0.204	S	C	.	.			trans	-91.4	-33.8	-178.1	-174.1	0	0	0	0	112.1	K154 D178 L179 V180	K154-V156 PolarHBondContact O-N 3.32Å; V156-D178 WeakPolarHBondContact CA-O 3.45Å; V156-D178 HydrophobicContact CG2-CB 4.34Å; V156-L179 WeakPolarHBondContact O-CA 3.14Å; V156-V180 HydrophobicContact CG1-CG2 4.49Å; V156-V180 PolarHBondContact O-N 3Å
157	I	91.3	Very high	94.6	Very high	73 Å²	73	44 Å²	44	37%	0.374	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	136.1	-173.9	-56.5	178.2	0	0	0	109.8	I155 L159 Y181	I155-I157 WeakPolarHBondContact CG2-O 3.26Å; I157-L159 HydrophobicContact CG2-CD2 3.98Å; I157-Y181 WeakPolarHBondContact CA-O 3.31Å; I157-Y181 HydrophobicContact CG2-CD1 3.94Å
158	L	93.8	Very high	94.5	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	119.7	161.8	-59.7	-178.8	0	0	0	108.8	I155 M162 F163 V174 L179 Y181 I182 S183 A186 F187	I155-L158 HydrophobicContact CG2-CD2 4.07Å; L158-M162 HydrophobicContact CD2-CE 4.36Å; L158-M162 HydrophobicContact CD2-SD 3.7Å; L158-F163 HydrophobicContact CD1-CE2 4.44Å; L158-F163 HydrophobicContact CD2-CE2 4.33Å; L158-F163 HydrophobicContact CD2-CZ 4.28Å; L158-V174 HydrophobicContact CD1-CG1 4.3Å; L158-V174 HydrophobicContact CD2-CG1 4.48Å; L158-L179 HydrophobicContact CD1-CD2 4.41Å; L158-L179 HydrophobicContact CD2-CD1 4.43Å; L158-L179 HydrophobicContact CG-CD1 3.85Å; L158-L179 HydrophobicContact CG-CD2 4.42Å; L158-Y181 PolarHBondContact N-O 3.18Å; L158-I182 HydrophobicContact CB-CG1 4.48Å; L158-I182 HydrophobicContact CB-CG2 4.32Å; L158-I182 HydrophobicContact CD1-CD1 4.28Å; L158-I182 HydrophobicContact CD1-CG1 4.05Å; L158-I182 HydrophobicContact CD1-CG2 4.29Å; L158-I182 HydrophobicContact CG-CG1 4.37Å; L158-S183 WeakPolarHBondContact O-CB 3.38Å; L158-S183 PolarHBondContact O-N 3.1Å; L158-S183 PolarHBondContact O-OG 3.04Å; L158-S183 VanDerWaalsContact O-OG 3.11Å; L158-A186 HydrophobicContact CB-CB 3.87Å; L158-F187 HydrophobicContact CD1-CE1 3.95Å; L158-F187 HydrophobicContact CD1-CZ 3.9Å
159	L	93.7	Very high	94.5	Very high	102 Å²	102	42.4 Å²	42.4	53%	0.534	21%	0.205	S	C	.	.	P	Polyproline II helix	trans	-89	160.7	-177.5	-63.1	172.8	0	0	0	111.5	I157 Y161 M162 A186	I157-L159 HydrophobicContact CG2-CD2 3.98Å; L159-Y161 PolarHBondContact O-N 3.19Å; L159-M162 HydrophobicContact CB-CE 4.25Å; L159-M162 HydrophobicContact CG-CE 4.45Å; L159-M162 WeakPolarHBondContact O-CB 2.82Å; L159-M162 PolarHBondContact O-N 3.07Å; L159-A186 WeakPolarHBondContact O-CA 3.17Å
160	D	95.5	Very high	94.6	Very high	72 Å²	72	46.3 Å²	46.3	39%	0.385	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	136.9	178.3	-74.2	-16.4	0	0	0	111	M162 S183 R185	D160-M162 PolarHBondContact O-N 3.02Å; D160-M162 VanDerWaalsContact O-N 3.13Å; D160-S183 WeakPolarHBondContact CA-OG 3.25Å; D160-S183 PolarHBondContact N-OG 3.21Å; D160-S183 WeakPolarHBondContact OD1-CB 3.39Å; D160-S183 PolarHBondContact OD1-OG 3.21Å; D160-R185 HydrophobicContact CB-CB 4.07Å; D160-R185 WeakPolarHBondContact OD1-CA 3.49Å; D160-R185 WeakPolarHBondContact OD1-CB 3.1Å; D160-R185 PolarHBondContact OD1-N 3.46Å
161	Y	95.3	Very high	94.8	Very high	82 Å²	82	47.2 Å²	47.2	32%	0.322	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	14	176.9	-46.3	-71.9	0	0	0	115.7	L159 F163 Q164 R185	L159-Y161 PolarHBondContact O-N 3.19Å; Y161-F163 PolarHBondContact O-N 3.15Å; Y161-F163 VanDerWaalsContact O-N 3.09Å; Y161-Q164 WeakPolarHBondContact O-CB 3.44Å; Y161-Q164 VanDerWaalsContact O-CG 3.32Å; Y161-Q164 WeakPolarHBondContact O-CG 3.42Å; Y161-Q164 PolarHBondContact O-N 2.98Å; Y161-Q164 VanDerWaalsContact O-N 3.08Å; Y161-R185 HydrophobicContact CE1-CB 4.27Å; Y161-R185 PolarHBondContact N-O 3.28Å; Y161-R185 WeakPolarHBondContact OH-CD 3.22Å; Y161-R185 PolarHBondContact OH-NH1 3.04Å
162	M	93.9	Very high	95	Very high	18 Å²	18	47.1 Å²	47.1	9%	0.089	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-34.3	-179.8	177.4	179.5	-76.7	0	0	113.4	L158 L159 D160	L158-M162 HydrophobicContact CD2-CE 4.36Å; L158-M162 HydrophobicContact CD2-SD 3.7Å; L159-M162 HydrophobicContact CB-CE 4.25Å; L159-M162 HydrophobicContact CG-CE 4.45Å; L159-M162 WeakPolarHBondContact O-CB 2.82Å; L159-M162 PolarHBondContact O-N 3.07Å; D160-M162 PolarHBondContact O-N 3.02Å; D160-M162 VanDerWaalsContact O-N 3.13Å
163	F	95.6	Very high	95.1	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.3	18.3	-177.9	-53.7	-72	0	0	0	113.9	F139 L148 I150 L158 Y161 D165 L166 L172 F187 L190	F139-F163 HydrophobicContact CD2-CD1 4.41Å; F139-F163 HydrophobicContact CE2-CD1 4.01Å; F139-F163 HydrophobicContact CE2-CE1 4.04Å; L148-F163 HydrophobicContact CD2-CD1 4.28Å; L148-F163 HydrophobicContact CD2-CE1 4.1Å; I150-F163 HydrophobicContact CD1-CE1 3.9Å; I150-F163 HydrophobicContact CD1-CZ 3.66Å; L158-F163 HydrophobicContact CD1-CE2 4.44Å; L158-F163 HydrophobicContact CD2-CE2 4.33Å; L158-F163 HydrophobicContact CD2-CZ 4.28Å; Y161-F163 PolarHBondContact O-N 3.15Å; Y161-F163 VanDerWaalsContact O-N 3.09Å; F163-D165 PolarHBondContact O-N 3.38Å; F163-L166 HydrophobicContact CD1-CD1 4.1Å; F163-L166 PolarHBondContact O-N 2.85Å; F163-L166 VanDerWaalsContact O-N 3.09Å; F163-L172 HydrophobicContact CD2-CD2 4.36Å; F163-L172 HydrophobicContact CE1-CD1 4.4Å; F163-L172 HydrophobicContact CE2-CD2 4.22Å; F163-L172 HydrophobicContact CZ-CD2 4.34Å; F163-F187 HydrophobicContact CD2-CD1 4.27Å; F163-F187 HydrophobicContact CE2-CD1 4.4Å; F163-F187 HydrophobicContact CE2-CE1 4.32Å; F163-L190 HydrophobicContact CB-CD1 3.86Å; F163-L190 HydrophobicContact CB-CD2 3.72Å; F163-L190 HydrophobicContact CB-CG 3.79Å; F163-L190 HydrophobicContact CD2-CD1 4.2Å; F163-L190 HydrophobicContact CG-CD1 4.22Å
164	Q	95.1	Very high	95	Very high	91 Å²	91	46.3 Å²	46.3	43%	0.425	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-31.4	-172.6	69.8	-178	-23.9	0	0	114.1	Y161 L166	Y161-Q164 WeakPolarHBondContact O-CB 3.44Å; Y161-Q164 VanDerWaalsContact O-CG 3.32Å; Y161-Q164 WeakPolarHBondContact O-CG 3.42Å; Y161-Q164 PolarHBondContact O-N 2.98Å; Y161-Q164 VanDerWaalsContact O-N 3.08Å; Q164-L166 VanDerWaalsContact C-N 3.27Å; Q164-L166 PolarHBondContact O-N 3.08Å
165	D	94.3	Very high	94.3	Very high	48 Å²	48	42 Å²	42	26%	0.257	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-18.5	-178	-65.8	-30.3	0	0	0	112.4	F139 T140 F163 Y167	F139-D165 HydrophobicContact CB-CB 4.43Å; T140-D165 WeakPolarHBondContact CA-OD2 3.24Å; T140-D165 PolarHBondContact N-OD2 3.03Å; T140-D165 PolarHBondContact OG1-OD2 3.42Å; F163-D165 PolarHBondContact O-N 3.38Å; D165-Y167 VanDerWaalsContact C-N 3.3Å; D165-Y167 VanDerWaalsContact O-CD1 3.25Å; D165-Y167 WeakPolarHBondContact O-CD1 3.25Å; D165-Y167 PolarHBondContact O-N 3.24Å
166	L	96.3	Very high	93.6	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.219	C	C	.	.			trans	-92.9	47.4	-174.6	-59.1	-179.5	0	0	0	111.8	F139 L142 L145 L148 F163 Q164 N168 L169 L190	F139-L166 HydrophobicContact CB-CD1 4.25Å; F139-L166 HydrophobicContact CB-CD2 3.83Å; F139-L166 HydrophobicContact CB-CG 3.93Å; F139-L166 HydrophobicContact CD1-CD1 4.3Å; F139-L166 HydrophobicContact CD2-CD1 3.91Å; F139-L166 HydrophobicContact CD2-CG 4.42Å; F139-L166 HydrophobicContact CE2-CD1 4.29Å; F139-L166 HydrophobicContact CG-CD1 3.91Å; F139-L166 HydrophobicContact CG-CD2 4.23Å; F139-L166 HydrophobicContact CG-CG 4.16Å; L142-L166 HydrophobicContact CB-CD2 3.93Å; L145-L166 HydrophobicContact CB-CD2 4.16Å; L145-L166 HydrophobicContact CD2-CD1 4.39Å; L145-L166 HydrophobicContact CD2-CD2 3.86Å; L148-L166 HydrophobicContact CD2-CD1 3.63Å; F163-L166 HydrophobicContact CD1-CD1 4.1Å; F163-L166 PolarHBondContact O-N 2.85Å; F163-L166 VanDerWaalsContact O-N 3.09Å; Q164-L166 VanDerWaalsContact C-N 3.27Å; Q164-L166 PolarHBondContact O-N 3.08Å; L166-N168 VanDerWaalsContact C-N 3.25Å; L166-N168 PolarHBondContact O-N 2.89Å; L166-L169 HydrophobicContact CB-CB 4.03Å; L166-L169 HydrophobicContact CB-CD2 4.37Å; L166-L169 HydrophobicContact CD1-CD2 4.2Å; L166-L169 WeakPolarHBondContact O-CB 3.34Å; L166-L169 PolarHBondContact O-N 3.03Å; L166-L190 HydrophobicContact CB-CD2 4.07Å; L166-L190 WeakPolarHBondContact O-CD2 3.41Å
167	Y	95.8	Very high	92.9	Very high	107 Å²	107	41.9 Å²	41.9	42%	0.42	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-17.3	-171.6	52.9	-97.2	0	0	0	115.1	S143 D165 G189 S192	S143-Y167 WeakPolarHBondContact CB-OH 3.47Å; D165-Y167 VanDerWaalsContact C-N 3.3Å; D165-Y167 VanDerWaalsContact O-CD1 3.25Å; D165-Y167 WeakPolarHBondContact O-CD1 3.25Å; D165-Y167 PolarHBondContact O-N 3.24Å; Y167-G189 WeakPolarHBondContact CA-O 3.42Å; Y167-G189 WeakPolarHBondContact CB-O 3.31Å; Y167-S192 VanDerWaalsContact O-CB 3.23Å; Y167-S192 WeakPolarHBondContact O-CB 3.49Å; Y167-S192 PolarHBondContact O-N 3.08Å; Y167-S192 PolarHBondContact O-OG 3.19Å
168	N	96.9	Very high	92.7	Very high	61 Å²	61	42.3 Å²	42.3	33%	0.326	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	2.6	173	-70.3	-31.4	0	0	0	113.7	S143 L145 L166 K170	S143-N168 WeakPolarHBondContact O-CB 3.48Å; S143-N168 PolarHBondContact O-ND2 3.06Å; L145-N168 CarbonylContact O-C 3.56Å; L166-N168 VanDerWaalsContact C-N 3.25Å; L166-N168 PolarHBondContact O-N 2.89Å; N168-K170 PolarHBondContact O-N 2.78Å
169	L	98	Very high	92.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.205	C	C	.	.			trans	-62.4	130	179.3	-161.9	75.3	0	0	0	109.8	L145 L148 L166 L172 L190 S192 L193	L145-L169 HydrophobicContact CB-CD1 4.36Å; L145-L169 HydrophobicContact CD2-CD1 4.04Å; L145-L169 HydrophobicContact CG-CD1 4.06Å; L145-L169 VanDerWaalsContact O-CA 3.3Å; L145-L169 WeakPolarHBondContact O-CA 3.23Å; L145-L169 PolarHBondContact O-N 2.7Å; L148-L169 HydrophobicContact CB-CD1 3.84Å; L148-L169 HydrophobicContact CB-CD2 4.12Å; L166-L169 HydrophobicContact CB-CB 4.03Å; L166-L169 HydrophobicContact CB-CD2 4.37Å; L166-L169 HydrophobicContact CD1-CD2 4.2Å; L166-L169 WeakPolarHBondContact O-CB 3.34Å; L166-L169 PolarHBondContact O-N 3.03Å; L169-L172 HydrophobicContact CD2-CB 3.94Å; L169-L172 HydrophobicContact CD2-CD1 4.17Å; L169-L172 HydrophobicContact CD2-CG 4.47Å; L169-L190 HydrophobicContact CB-CD2 4.03Å; L169-L190 HydrophobicContact CD2-CD2 3.89Å; L169-S192 CarbonylContact O-C 3.14Å; L169-L193 HydrophobicContact CB-CD1 4.26Å; L169-L193 HydrophobicContact CD2-CD1 3.98Å; L169-L193 HydrophobicContact CG-CD1 4.08Å; L169-L193 WeakPolarHBondContact O-CA 3.44Å; L169-L193 PolarHBondContact O-N 2.94Å; L169-L193 VanDerWaalsContact O-N 3.1Å
170	K	98.1	Very high	92.2	Very high	100 Å²	100	41.5 Å²	41.5	44%	0.435	20%	0.204	S	C	.	.			trans	-103.6	-35.9	-179.1	-63.3	-167.3	175.4	-164.6	0	112.4	T146 N168 E194 Q195	T146-K170 WeakPolarHBondContact O-CA 3.48Å; T146-K170 PolarHBondContact O-N 2.75Å; N168-K170 PolarHBondContact O-N 2.78Å; K170-E194 PolarHBondContact O-N 3.09Å; K170-Q195 PolarHBondContact O-N 3.48Å
171	S	98.4	Very high	92	Very high	20 Å²	20	43.4 Å²	43.4	14%	0.14	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	124.8	-178.5	-174.9	0	0	0	0	110.6	T146 K147 L148 Q195	T146-S171 PolarHBondContact O-N 2.94Å; K147-S171 WeakPolarHBondContact CA-O 3.2Å; L148-S171 PolarHBondContact N-O 3.3Å; L148-S171 VanDerWaalsContact N-O 3.07Å; S171-Q195 WeakPolarHBondContact CA-O 3.41Å
172	L	97.7	Very high	91.9	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	127.8	174.1	178.4	62	0	0	0	109.6	L148 F163 L169 V174 F187 L190 L193 Q195 L196 T197	L148-L172 HydrophobicContact CB-CD1 4.09Å; L148-L172 HydrophobicContact CD2-CD1 3.93Å; L148-L172 HydrophobicContact CG-CD1 4.05Å; F163-L172 HydrophobicContact CD2-CD2 4.36Å; F163-L172 HydrophobicContact CE1-CD1 4.4Å; F163-L172 HydrophobicContact CE2-CD2 4.22Å; F163-L172 HydrophobicContact CZ-CD2 4.34Å; L169-L172 HydrophobicContact CD2-CB 3.94Å; L169-L172 HydrophobicContact CD2-CD1 4.17Å; L169-L172 HydrophobicContact CD2-CG 4.47Å; L172-V174 HydrophobicContact CD1-CG2 3.97Å; L172-V174 HydrophobicContact CD2-CG2 3.91Å; L172-V174 HydrophobicContact CG-CG2 3.7Å; L172-F187 HydrophobicContact CD2-CD1 4.35Å; L172-F187 HydrophobicContact CD2-CE1 4.17Å; L172-L190 HydrophobicContact CD2-CD1 3.9Å; L172-L193 HydrophobicContact CB-CD1 3.78Å; L172-L193 HydrophobicContact CB-CD2 4.31Å; L172-Q195 PolarHBondContact N-O 3.3Å; L172-L196 HydrophobicContact CB-CD1 4.07Å; L172-L196 HydrophobicContact CD2-CD1 4.03Å; L172-L196 HydrophobicContact CG-CD1 4.06Å; L172-L196 WeakPolarHBondContact O-CA 3.38Å; L172-T197 PolarHBondContact O-N 3.04Å
173	E	95.6	Very high	92	Very high	41 Å²	41	39.5 Å²	39.5	19%	0.192	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	116.3	173.2	-172	146	-144	0	0	109.2	L148 D149 I150 T197	L148-E173 PolarHBondContact O-N 3.28Å; D149-E173 HydrophobicContact CB-CB 4.41Å; I150-E173 WeakPolarHBondContact CG1-O 3.48Å; I150-E173 PolarHBondContact N-O 3.14Å; E173-T197 HydrophobicContact CG-CG2 4.36Å
174	V	91.8	Very high	92	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	120.6	176.2	-168	0	0	0	0	107.7	I150 L158 L172 T197 L198 E199	I150-V174 HydrophobicContact CD1-CG1 4.2Å; I150-V174 HydrophobicContact CD1-CG2 3.96Å; I150-V174 HydrophobicContact CG1-CB 4.44Å; I150-V174 HydrophobicContact CG1-CG1 4.34Å; I150-V174 HydrophobicContact CG1-CG2 4.01Å; L158-V174 HydrophobicContact CD1-CG1 4.3Å; L158-V174 HydrophobicContact CD2-CG1 4.48Å; L172-V174 HydrophobicContact CD1-CG2 3.97Å; L172-V174 HydrophobicContact CD2-CG2 3.91Å; L172-V174 HydrophobicContact CG-CG2 3.7Å; V174-T197 PolarHBondContact N-O 2.98Å; V174-T197 VanDerWaalsContact O-O 3.09Å; V174-L198 HydrophobicContact CB-CD2 3.98Å; V174-L198 HydrophobicContact CG2-CD2 4.45Å; V174-L198 CarbonylContact O-C 3.54Å; V174-L198 VanDerWaalsContact O-CA 3.24Å; V174-L198 WeakPolarHBondContact O-CA 3.39Å; V174-E199 PolarHBondContact O-N 3.19Å
175	G	79.2	Confident	92.1	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.9	176.9	174.7	0	0	0	0	0	115	S151 E152 N177 E199	S151-G175 CarbonylContact C-O 3.41Å; S151-G175 VanDerWaalsContact C-O 3.27Å; S151-G175 WeakPolarHBondContact CA-O 3.17Å; E152-G175 PolarHBondContact N-O 2.86Å; G175-N177 PolarHBondContact O-N 2.62Å; G175-N177 PolarHBondContact O-ND2 3.19Å; G175-E199 CarbonylContact C-O 3.39Å; G175-E199 VanDerWaalsContact C-O 3.29Å; G175-E199 WeakPolarHBondContact CA-O 3.33Å
176	D	78	Confident	92.2	Very high	58 Å²	58	43.9 Å²	43.9	31%	0.31	21%	0.206	S	C	.	.	S	Bend	trans	49.3	38.2	-177.6	-150.5	-2.1	0	0	0	112.9	E152 N153 E199 K200	E152-D176 VanDerWaalsContact CA-O 3.32Å; E152-D176 WeakPolarHBondContact CA-O 3.21Å; E152-D176 HydrophobicContact CB-CB 4.2Å; E152-D176 HydrophobicContact CG-CB 3.59Å; N153-D176 PolarHBondContact N-O 3.16Å; D176-E199 PolarHBondContact N-O 3.11Å; D176-K200 HydrophobicContact CB-CB 3.97Å; D176-K200 HydrophobicContact CB-CD 3.56Å; D176-K200 HydrophobicContact CB-CG 4.43Å; D176-K200 WeakPolarHBondContact OD2-CD 3.49Å; D176-K200 IonicContact OD2-NZ 2.78Å; D176-K200 PolarHBondContact OD2-NZ 3.27Å
177	N	77.1	Confident	92.3	Very high	7 Å²	7	43.9 Å²	43.9	4%	0.037	21%	0.206	C	C	.	.	S	Bend	trans	-105.3	162.9	175.6	-86.9	-74.8	0	0	0	107.5	I150 N153 K154 I155 G175 L179	I150-N177 PolarHBondContact O-ND2 3.43Å; N153-N177 WeakPolarHBondContact CA-OD1 3.4Å; N153-N177 WeakPolarHBondContact CB-OD1 3.17Å; N153-N177 PolarHBondContact N-OD1 2.95Å; N153-N177 PolarHBondContact O-OD1 2.83Å; K154-N177 PolarHBondContact N-OD1 3.34Å; K154-N177 VanDerWaalsContact N-OD1 3.14Å; I155-N177 HydrophobicContact CB-CB 4.2Å; I155-N177 WeakPolarHBondContact CB-OD1 3.45Å; I155-N177 WeakPolarHBondContact CG1-OD1 3.45Å; I155-N177 PolarHBondContact N-OD1 2.75Å; I155-N177 WeakPolarHBondContact O-CB 3.22Å; G175-N177 PolarHBondContact O-N 2.62Å; G175-N177 PolarHBondContact O-ND2 3.19Å; N177-L179 HydrophobicContact CB-CB 3.97Å; N177-L179 PolarHBondContact O-N 2.82Å
178	D	86.1	Confident	92.3	Very high	82 Å²	82	40.2 Å²	40.2	44%	0.439	20%	0.196	S	C	.	.			trans	-73.8	35.2	169.4	-58.2	-41.7	0	0	0	110.7	K154 I155 V156 V180	K154-D178 WeakPolarHBondContact CD-OD2 3.44Å; K154-D178 IonicContact NZ-OD1 3.81Å; K154-D178 IonicContact NZ-OD2 3.85Å; I155-D178 CarbonylContact O-C 3.07Å; I155-D178 VanDerWaalsContact O-C 3.29Å; I155-D178 PolarHBondContact O-N 2.75Å; V156-D178 WeakPolarHBondContact CA-O 3.45Å; V156-D178 HydrophobicContact CG2-CB 4.34Å; D178-V180 WeakPolarHBondContact O-CG2 3.17Å; D178-V180 PolarHBondContact O-N 3.02Å
179	L	87.8	Confident	92.2	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.189	C	C	.	.			trans	-74.8	112.3	-167.4	-171.5	73.3	0	0	0	110.1	I155 V156 L158 N177 I182 C201 N202	I155-L179 HydrophobicContact CG2-CD1 4.37Å; I155-L179 WeakPolarHBondContact O-CA 3.3Å; I155-L179 PolarHBondContact O-N 3.35Å; I155-L179 VanDerWaalsContact O-N 3.16Å; V156-L179 WeakPolarHBondContact O-CA 3.14Å; L158-L179 HydrophobicContact CD1-CD2 4.41Å; L158-L179 HydrophobicContact CD2-CD1 4.43Å; L158-L179 HydrophobicContact CG-CD1 3.85Å; L158-L179 HydrophobicContact CG-CD2 4.42Å; N177-L179 HydrophobicContact CB-CB 3.97Å; N177-L179 PolarHBondContact O-N 2.82Å; L179-I182 HydrophobicContact CD1-CG1 4.5Å; L179-I182 HydrophobicContact CD2-CD1 3.83Å; L179-I182 HydrophobicContact CD2-CG1 3.78Å; L179-I182 HydrophobicContact CG-CG1 4.33Å; L179-C201 HydrophobicContact CB-CB 4.22Å; L179-C201 HydrophobicContact CD2-CB 4.21Å; L179-C201 VanDerWaalsContact CD2-SG 3.58Å; L179-N202 PolarHBondContact O-N 2.8Å
180	V	89.1	Confident	92.1	Very high	84 Å²	84	38.3 Å²	38.3	51%	0.509	19%	0.19	S	C	.	.			trans	-104.9	-28.8	179.7	-176.3	0	0	0	0	111.5	V156 D178	V156-V180 HydrophobicContact CG1-CG2 4.49Å; V156-V180 PolarHBondContact O-N 3Å; D178-V180 WeakPolarHBondContact O-CG2 3.17Å; D178-V180 PolarHBondContact O-N 3.02Å
181	Y	91.1	Very high	92	Very high	112 Å²	112	39 Å²	39	44%	0.439	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	139.1	-173	-175.9	-106.3	0	0	0	112.5	I157 L158	I157-Y181 WeakPolarHBondContact CA-O 3.31Å; I157-Y181 HydrophobicContact CG2-CD1 3.94Å; L158-Y181 PolarHBondContact N-O 3.18Å
182	I	95	Very high	91.9	Very high	9 Å²	9	40.1 Å²	40.1	5%	0.046	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	118.2	172.2	-61.4	174	0	0	0	106.6	L158 L179 A186 F187 L198 L203 P207 A210	L158-I182 HydrophobicContact CB-CG1 4.48Å; L158-I182 HydrophobicContact CB-CG2 4.32Å; L158-I182 HydrophobicContact CD1-CD1 4.28Å; L158-I182 HydrophobicContact CD1-CG1 4.05Å; L158-I182 HydrophobicContact CD1-CG2 4.29Å; L158-I182 HydrophobicContact CG-CG1 4.37Å; L179-I182 HydrophobicContact CD1-CG1 4.5Å; L179-I182 HydrophobicContact CD2-CD1 3.83Å; L179-I182 HydrophobicContact CD2-CG1 3.78Å; L179-I182 HydrophobicContact CG-CG1 4.33Å; I182-A186 HydrophobicContact CG2-CB 3.78Å; I182-F187 HydrophobicContact CD1-CZ 4.47Å; I182-F187 HydrophobicContact CG2-CE2 3.87Å; I182-F187 HydrophobicContact CG2-CZ 4.17Å; I182-L198 HydrophobicContact CD1-CD1 4.31Å; I182-L203 HydrophobicContact CD1-CD1 4Å; I182-L203 HydrophobicContact CD1-CD2 4.3Å; I182-L203 HydrophobicContact CG1-CD2 4.26Å; I182-P207 HydrophobicContact CB-CB 4.24Å; I182-P207 HydrophobicContact CD1-CB 4.2Å; I182-P207 HydrophobicContact CD1-CG 4.01Å; I182-A210 HydrophobicContact CG2-CB 3.68Å
183	S	95.2	Very high	91.9	Very high	10 Å²	10	40.1 Å²	40.1	7%	0.07	21%	0.206	C	C	.	.			trans	-67.9	157.8	179.1	74.3	0	0	0	0	111.8	L158 D160 R185 A186 A210	L158-S183 WeakPolarHBondContact O-CB 3.38Å; L158-S183 PolarHBondContact O-N 3.1Å; L158-S183 PolarHBondContact O-OG 3.04Å; L158-S183 VanDerWaalsContact O-OG 3.11Å; D160-S183 WeakPolarHBondContact CA-OG 3.25Å; D160-S183 PolarHBondContact N-OG 3.21Å; D160-S183 WeakPolarHBondContact OD1-CB 3.39Å; D160-S183 PolarHBondContact OD1-OG 3.21Å; S183-R185 VanDerWaalsContact C-N 3.25Å; S183-R185 PolarHBondContact O-N 3.43Å; S183-A186 WeakPolarHBondContact O-CB 3.17Å; S183-A186 PolarHBondContact O-N 3.03Å; S183-A186 PolarHBondContact OG-N 2.89Å; S183-A210 WeakPolarHBondContact O-CB 3.38Å
184	H	96.5	Very high	92	Very high	106 Å²	106	42.2 Å²	42.2	49%	0.491	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-28	-172.5	-62.7	-39.8	0	0	0	114	E209 A210 H213	H184-E209 HydrophobicContact CB-CB 4.5Å; H184-A210 WeakPolarHBondContact O-CA 3.5Å; H184-H213 PolarHBondContact O-CE1 3.13Å; H184-H213 PolarHBondContact O-ND1 2.96Å; H184-H213 VanDerWaalsContact O-ND1 3.1Å
185	R	97.2	Very high	92.4	Very high	124 Å²	124	45 Å²	45	47%	0.468	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112	19.5	179.6	-56	-177.5	179.3	173.1	0.8	112.4	D160 Y161 S183 F187 S188	D160-R185 HydrophobicContact CB-CB 4.07Å; D160-R185 WeakPolarHBondContact OD1-CA 3.49Å; D160-R185 WeakPolarHBondContact OD1-CB 3.1Å; D160-R185 PolarHBondContact OD1-N 3.46Å; Y161-R185 HydrophobicContact CE1-CB 4.27Å; Y161-R185 PolarHBondContact N-O 3.28Å; Y161-R185 WeakPolarHBondContact OH-CD 3.22Å; Y161-R185 PolarHBondContact OH-NH1 3.04Å; S183-R185 VanDerWaalsContact C-N 3.25Å; S183-R185 PolarHBondContact O-N 3.43Å; R185-F187 VanDerWaalsContact C-N 3.26Å; R185-F187 PolarHBondContact O-N 3.48Å; R185-S188 VanDerWaalsContact O-CB 3.24Å; R185-S188 WeakPolarHBondContact O-CB 3.26Å; R185-S188 PolarHBondContact O-N 2.84Å
186	A	95.9	Very high	93.3	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-41.5	179.6	0	0	0	0	0	112.9	L158 L159 I182 S183	L158-A186 HydrophobicContact CB-CB 3.87Å; L159-A186 WeakPolarHBondContact O-CA 3.17Å; I182-A186 HydrophobicContact CG2-CB 3.78Å; S183-A186 WeakPolarHBondContact O-CB 3.17Å; S183-A186 PolarHBondContact O-N 3.03Å; S183-A186 PolarHBondContact OG-N 2.89Å
187	F	97.1	Very high	94.2	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	9.1	179.9	-56.6	-55.3	0	0	0	114	L158 F163 L172 I182 R185 G189 L190 L196 L198 A210 L211 L214	L158-F187 HydrophobicContact CD1-CE1 3.95Å; L158-F187 HydrophobicContact CD1-CZ 3.9Å; F163-F187 HydrophobicContact CD2-CD1 4.27Å; F163-F187 HydrophobicContact CE2-CD1 4.4Å; F163-F187 HydrophobicContact CE2-CE1 4.32Å; L172-F187 HydrophobicContact CD2-CD1 4.35Å; L172-F187 HydrophobicContact CD2-CE1 4.17Å; I182-F187 HydrophobicContact CD1-CZ 4.47Å; I182-F187 HydrophobicContact CG2-CE2 3.87Å; I182-F187 HydrophobicContact CG2-CZ 4.17Å; R185-F187 VanDerWaalsContact C-N 3.26Å; R185-F187 PolarHBondContact O-N 3.48Å; F187-G189 PolarHBondContact O-N 3.23Å; F187-L190 HydrophobicContact CB-CD1 4.22Å; F187-L190 HydrophobicContact CD1-CD1 3.97Å; F187-L190 WeakPolarHBondContact O-CB 3.16Å; F187-L190 PolarHBondContact O-N 2.91Å; F187-L196 HydrophobicContact CE2-CD2 4.43Å; F187-L196 HydrophobicContact CZ-CD2 4.33Å; F187-L198 HydrophobicContact CZ-CD2 4.17Å; F187-A210 HydrophobicContact CD2-CB 3.96Å; F187-A210 HydrophobicContact CE2-CB 4.13Å; F187-L211 HydrophobicContact CE2-CD2 4.31Å; F187-L214 HydrophobicContact CB-CD1 4.22Å; F187-L214 HydrophobicContact CB-CD2 3.79Å; F187-L214 HydrophobicContact CB-CG 3.93Å; F187-L214 HydrophobicContact CD2-CD1 4.16Å; F187-L214 HydrophobicContact CG-CD1 4.16Å; F187-L214 HydrophobicContact CG-CD2 4.48Å; F187-L214 HydrophobicContact CG-CG 4.41Å
188	S	96.6	Very high	95	Very high	31 Å²	31	42 Å²	42	22%	0.217	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	132.3	177.4	-176	0	0	0	0	110.5	R185	R185-S188 VanDerWaalsContact O-CB 3.24Å; R185-S188 WeakPolarHBondContact O-CB 3.26Å; R185-S188 PolarHBondContact O-N 2.84Å
189	G	94.5	Very high	95.4	Very high	18 Å²	18	39.1 Å²	39.1	19%	0.186	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	100.8	-16.6	-179.1	0	0	0	0	0	114.3	Y167 F187 N191	Y167-G189 WeakPolarHBondContact CA-O 3.42Å; Y167-G189 WeakPolarHBondContact CB-O 3.31Å; F187-G189 PolarHBondContact O-N 3.23Å; G189-N191 PolarHBondContact O-N 3.45Å
190	L	96.9	Very high	95.4	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.01	21%	0.213	C	C	.	.			trans	-75.9	60.7	176	-68.8	178.5	0	0	0	112.3	F163 L166 L169 L172 F187 S192 L193 L214	F163-L190 HydrophobicContact CB-CD1 3.86Å; F163-L190 HydrophobicContact CB-CD2 3.72Å; F163-L190 HydrophobicContact CB-CG 3.79Å; F163-L190 HydrophobicContact CD2-CD1 4.2Å; F163-L190 HydrophobicContact CG-CD1 4.22Å; L166-L190 HydrophobicContact CB-CD2 4.07Å; L166-L190 WeakPolarHBondContact O-CD2 3.41Å; L169-L190 HydrophobicContact CB-CD2 4.03Å; L169-L190 HydrophobicContact CD2-CD2 3.89Å; L172-L190 HydrophobicContact CD2-CD1 3.9Å; F187-L190 HydrophobicContact CB-CD1 4.22Å; F187-L190 HydrophobicContact CD1-CD1 3.97Å; F187-L190 WeakPolarHBondContact O-CB 3.16Å; F187-L190 PolarHBondContact O-N 2.91Å; L190-S192 VanDerWaalsContact C-N 3.33Å; L190-S192 PolarHBondContact O-N 3.09Å; L190-L193 HydrophobicContact CB-CB 4.11Å; L190-L193 HydrophobicContact CD1-CD2 4.15Å; L190-L193 PolarHBondContact O-N 3.32Å; L190-L214 HydrophobicContact CB-CD2 3.83Å; L190-L214 HydrophobicContact CD1-CD2 4.34Å
191	N	94.4	Very high	95.4	Very high	115 Å²	115	39 Å²	39	62%	0.615	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-29.7	-169.7	-59.7	-28.6	0	0	0	113.4	G189	G189-N191 PolarHBondContact O-N 3.45Å
192	S	97.1	Very high	95.3	Very high	43 Å²	43	38.2 Å²	38.2	30%	0.301	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	6.4	-178	-52.7	0	0	0	0	113.6	Y167 L169 L190 E194	Y167-S192 VanDerWaalsContact O-CB 3.23Å; Y167-S192 WeakPolarHBondContact O-CB 3.49Å; Y167-S192 PolarHBondContact O-N 3.08Å; Y167-S192 PolarHBondContact O-OG 3.19Å; L169-S192 CarbonylContact O-C 3.14Å; L190-S192 VanDerWaalsContact C-N 3.33Å; L190-S192 PolarHBondContact O-N 3.09Å; S192-E194 PolarHBondContact O-N 3.13Å
193	L	98.3	Very high	95	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.194	C	C	.	.			trans	-70.1	118.8	-174.4	-158.5	79.7	0	0	0	110.6	L169 L172 L190 L196 L214 G216 L217	L169-L193 HydrophobicContact CB-CD1 4.26Å; L169-L193 HydrophobicContact CD2-CD1 3.98Å; L169-L193 HydrophobicContact CG-CD1 4.08Å; L169-L193 WeakPolarHBondContact O-CA 3.44Å; L169-L193 PolarHBondContact O-N 2.94Å; L169-L193 VanDerWaalsContact O-N 3.1Å; L172-L193 HydrophobicContact CB-CD1 3.78Å; L172-L193 HydrophobicContact CB-CD2 4.31Å; L190-L193 HydrophobicContact CB-CB 4.11Å; L190-L193 HydrophobicContact CD1-CD2 4.15Å; L190-L193 PolarHBondContact O-N 3.32Å; L193-L196 HydrophobicContact CD2-CB 4.15Å; L193-L196 HydrophobicContact CD2-CD1 4.48Å; L193-L214 HydrophobicContact CB-CD2 4.17Å; L193-L214 HydrophobicContact CD2-CD1 4.12Å; L193-L214 HydrophobicContact CD2-CD2 3.63Å; L193-L214 HydrophobicContact CD2-CG 4.5Å; L193-G216 CarbonylContact O-C 3.29Å; L193-L217 HydrophobicContact CD2-CD1 4.15Å; L193-L217 HydrophobicContact CG-CD1 4.4Å; L193-L217 WeakPolarHBondContact O-CA 3.31Å; L193-L217 PolarHBondContact O-N 3.05Å
194	E	98.3	Very high	94.7	Very high	86 Å²	86	43.9 Å²	43.9	40%	0.402	23%	0.228	S	C	.	.			trans	-101.4	-31.9	179.9	-68.4	174.7	-162	0	0	111.1	K170 S192 I218 V219	K170-E194 PolarHBondContact O-N 3.09Å; S192-E194 PolarHBondContact O-N 3.13Å; E194-I218 HydrophobicContact CB-CD1 4.21Å; E194-I218 HydrophobicContact CB-CG1 4.4Å; E194-I218 HydrophobicContact CG-CD1 4.02Å; E194-I218 WeakPolarHBondContact O-CA 3.49Å; E194-I218 PolarHBondContact O-N 3.35Å; E194-V219 PolarHBondContact O-N 3.03Å
195	Q	98.5	Very high	94.6	Very high	58 Å²	58	42.3 Å²	42.3	27%	0.271	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	128.6	-175.6	-178.8	173.7	-56	0	0	111.7	K170 S171 L172 V219	K170-Q195 PolarHBondContact O-N 3.48Å; S171-Q195 WeakPolarHBondContact CA-O 3.41Å; L172-Q195 PolarHBondContact N-O 3.3Å; Q195-V219 WeakPolarHBondContact CA-O 3.46Å; Q195-V219 HydrophobicContact CB-CB 4.33Å; Q195-V219 HydrophobicContact CG-CB 4.16Å; Q195-V219 HydrophobicContact CG-CG1 4.28Å
196	L	98.3	Very high	94.6	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	127.6	172.1	178.2	64.9	0	0	0	109.9	L172 F187 L193 L198 L211 L214 L217 V219 L220 R221	L172-L196 HydrophobicContact CB-CD1 4.07Å; L172-L196 HydrophobicContact CD2-CD1 4.03Å; L172-L196 HydrophobicContact CG-CD1 4.06Å; L172-L196 WeakPolarHBondContact O-CA 3.38Å; F187-L196 HydrophobicContact CE2-CD2 4.43Å; F187-L196 HydrophobicContact CZ-CD2 4.33Å; L193-L196 HydrophobicContact CD2-CB 4.15Å; L193-L196 HydrophobicContact CD2-CD1 4.48Å; L196-L198 HydrophobicContact CD1-CD2 4.04Å; L196-L198 HydrophobicContact CD1-CG 4.39Å; L196-L198 HydrophobicContact CD2-CD1 4.2Å; L196-L198 HydrophobicContact CD2-CD2 4.3Å; L196-L198 HydrophobicContact CD2-CG 4.02Å; L196-L198 HydrophobicContact CG-CD2 4.28Å; L196-L198 HydrophobicContact CG-CG 4.08Å; L196-L211 HydrophobicContact CD2-CD2 3.53Å; L196-L214 HydrophobicContact CD2-CD1 3.61Å; L196-L217 HydrophobicContact CB-CD1 3.75Å; L196-L217 HydrophobicContact CB-CD2 4.36Å; L196-V219 PolarHBondContact N-O 2.92Å; L196-L220 HydrophobicContact CB-CD1 4.21Å; L196-L220 HydrophobicContact CD2-CD1 4.04Å; L196-L220 HydrophobicContact CG-CD1 4.25Å; L196-R221 PolarHBondContact O-N 3.38Å
197	T	97.3	Very high	94.6	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.018	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	122.1	165.6	-57.7	0	0	0	0	108.7	L172 E173 V174 E199 R221	L172-T197 PolarHBondContact O-N 3.04Å; E173-T197 HydrophobicContact CG-CG2 4.36Å; V174-T197 PolarHBondContact N-O 2.98Å; V174-T197 VanDerWaalsContact O-O 3.09Å; T197-E199 HydrophobicContact CG2-CB 4.39Å; T197-E199 HydrophobicContact CG2-CG 4.47Å; T197-R221 WeakPolarHBondContact CA-O 3.49Å; T197-R221 HydrophobicContact CG2-CB 4.17Å
198	L	94.9	Very high	94.6	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	115.1	166.8	-62.5	-179.7	0	0	0	108.5	V174 I182 F187 L196 P207 L211 R221 L222 R223	V174-L198 HydrophobicContact CB-CD2 3.98Å; V174-L198 HydrophobicContact CG2-CD2 4.45Å; V174-L198 CarbonylContact O-C 3.54Å; V174-L198 VanDerWaalsContact O-CA 3.24Å; V174-L198 WeakPolarHBondContact O-CA 3.39Å; I182-L198 HydrophobicContact CD1-CD1 4.31Å; F187-L198 HydrophobicContact CZ-CD2 4.17Å; L196-L198 HydrophobicContact CD1-CD2 4.04Å; L196-L198 HydrophobicContact CD1-CG 4.39Å; L196-L198 HydrophobicContact CD2-CD1 4.2Å; L196-L198 HydrophobicContact CD2-CD2 4.3Å; L196-L198 HydrophobicContact CD2-CG 4.02Å; L196-L198 HydrophobicContact CG-CD2 4.28Å; L196-L198 HydrophobicContact CG-CG 4.08Å; L198-P207 HydrophobicContact CD1-CG 4.09Å; L198-L211 HydrophobicContact CD1-CD2 4.28Å; L198-R221 PolarHBondContact N-O 3Å; L198-L222 HydrophobicContact CB-CD2 3.86Å; L198-L222 HydrophobicContact CD1-CD2 3.97Å; L198-L222 HydrophobicContact CG-CD2 4.25Å; L198-L222 CarbonylContact O-C 3.5Å; L198-L222 VanDerWaalsContact O-CA 3.31Å; L198-L222 WeakPolarHBondContact O-CA 3.38Å; L198-R223 PolarHBondContact O-N 3.42Å
199	E	93.1	Very high	94.6	Very high	21 Å²	21	41.2 Å²	41.2	10%	0.098	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	151	-178	70.3	173.2	166	0	0	115.8	V174 G175 D176 T197 C201 R223	V174-E199 PolarHBondContact O-N 3.19Å; G175-E199 CarbonylContact C-O 3.39Å; G175-E199 VanDerWaalsContact C-O 3.29Å; G175-E199 WeakPolarHBondContact CA-O 3.33Å; D176-E199 PolarHBondContact N-O 3.11Å; T197-E199 HydrophobicContact CG2-CB 4.39Å; T197-E199 HydrophobicContact CG2-CG 4.47Å; E199-C201 PolarHBondContact O-N 2.54Å; E199-C201 VanDerWaalsContact O-N 3.08Å; E199-C201 PolarHBondContact O-SG 3.24Å; E199-R223 CarbonylContact C-O 3.57Å; E199-R223 WeakPolarHBondContact CA-O 3.47Å; E199-R223 HydrophobicContact CB-CB 3.78Å
200	K	89.1	Confident	94.7	Very high	77 Å²	77	40.4 Å²	40.4	34%	0.335	22%	0.221	S	C	.	.	S	Bend	trans	51.3	38.2	173.1	-63.2	173.3	177.2	170.1	0	113.3	D176 R223 H224	D176-K200 HydrophobicContact CB-CB 3.97Å; D176-K200 HydrophobicContact CB-CD 3.56Å; D176-K200 HydrophobicContact CB-CG 4.43Å; D176-K200 WeakPolarHBondContact OD2-CD 3.49Å; D176-K200 IonicContact OD2-NZ 2.78Å; D176-K200 PolarHBondContact OD2-NZ 3.27Å; K200-R223 PolarHBondContact N-O 3.41Å; K200-H224 VanDerWaalsContact CA-O 3.25Å; K200-H224 WeakPolarHBondContact CA-O 3.32Å; K200-H224 HydrophobicContact CB-CB 4.24Å; K200-H224 HydrophobicContact CG-CB 3.41Å; K200-H224 VanDerWaalsContact CG-CB 3.41Å; K200-H224 PolarHBondContact N-O 2.99Å
201	C	88.4	Confident	94.8	Very high	3 Å²	3	40.3 Å²	40.3	2%	0.02	22%	0.221	C	C	.	.			trans	-97.2	146	175.7	-54.5	0	0	0	0	109.9	L179 E199 L203 L225	L179-C201 HydrophobicContact CB-CB 4.22Å; L179-C201 HydrophobicContact CD2-CB 4.21Å; L179-C201 VanDerWaalsContact CD2-SG 3.58Å; E199-C201 PolarHBondContact O-N 2.54Å; E199-C201 VanDerWaalsContact O-N 3.08Å; E199-C201 PolarHBondContact O-SG 3.24Å; C201-L203 HydrophobicContact CB-CD1 3.88Å; C201-L203 HydrophobicContact CB-CG 3.7Å; C201-L203 PolarHBondContact O-N 3.15Å; C201-L225 HydrophobicContact CB-CD2 3.81Å; C201-L225 WeakPolarHBondContact O-CD2 3.33Å
202	N	89.1	Confident	94.9	Very high	96 Å²	96	35 Å²	35	51%	0.513	19%	0.192	S	C	.	.			trans	-88.6	49.8	176.2	-159.5	24.3	0	0	0	111.5	L179 N226	L179-N202 PolarHBondContact O-N 2.8Å; N202-N226 PolarHBondContact OD1-ND2 2.81Å
203	L	89.2	Confident	94.9	Very high	10 Å²	10	35.6 Å²	35.6	5%	0.052	19%	0.19	C	C	.	.			trans	-80.7	136.2	179.2	-61.9	171.3	0	0	0	110	I182 C201 P207	I182-L203 HydrophobicContact CD1-CD1 4Å; I182-L203 HydrophobicContact CD1-CD2 4.3Å; I182-L203 HydrophobicContact CG1-CD2 4.26Å; C201-L203 HydrophobicContact CB-CD1 3.88Å; C201-L203 HydrophobicContact CB-CG 3.7Å; C201-L203 PolarHBondContact O-N 3.15Å; L203-P207 HydrophobicContact CD1-CG 4.4Å
204	T	88.9	Confident	94.9	Very high	129 Å²	129	35.6 Å²	35.6	79%	0.791	19%	0.19	S	C	*	.	S	Bend	trans	-80	-23.6	175.8	53.9	0	0	0	0	113
205	S	93.6	Very high	94.7	Very high	73 Å²	73	36.3 Å²	36.3	51%	0.51	19%	0.193	S	C	.	.	S	Bend	trans	-153.2	166.6	178.6	60.5	0	0	0	0	111.3
206	I	96.4	Very high	94.6	Very high	8 Å²	8	34 Å²	34	4%	0.041	19%	0.185	C	C	.	.			trans	-64.3	129.1	176.7	-63	170.7	0	0	0	108.6	T208 L211 I227 I230 F235 W249	I206-T208 PolarHBondContact O-N 3.28Å; I206-T208 PolarHBondContact O-OG1 3.31Å; I206-T208 VanDerWaalsContact O-OG1 3.13Å; I206-L211 HydrophobicContact CG2-CD1 3.88Å; I206-I227 HydrophobicContact CG1-CD1 3.96Å; I206-I230 HydrophobicContact CD1-CB 4.49Å; I206-I230 HydrophobicContact CD1-CG1 4.14Å; I206-I230 HydrophobicContact CD1-CG2 3.8Å; I206-F235 HydrophobicContact CD1-CE1 4.41Å; I206-F235 HydrophobicContact CD1-CE2 4.18Å; I206-F235 HydrophobicContact CD1-CZ 3.79Å; I206-F235 HydrophobicContact CG2-CE1 4.18Å; I206-W249 HydrophobicContact CD1-CH2 3.93Å; I206-W249 HydrophobicContact CD1-CZ3 4.41Å; I206-W249 HydrophobicContact CG1-CH2 3.85Å; I206-W249 HydrophobicContact CG1-CZ3 4.48Å
207	P	96	Very high	94.6	Very high	19 Å²	19	34 Å²	34	12%	0.123	19%	0.185	C	C	.	.			trans	-74.1	66.8	-177.4	32.3	-37.2	0	0	0	111.4	I182 L198 L203 E209 A210 L211	I182-P207 HydrophobicContact CB-CB 4.24Å; I182-P207 HydrophobicContact CD1-CB 4.2Å; I182-P207 HydrophobicContact CD1-CG 4.01Å; L198-P207 HydrophobicContact CD1-CG 4.09Å; L203-P207 HydrophobicContact CD1-CG 4.4Å; P207-E209 PolarHBondContact O-N 3.07Å; P207-A210 HydrophobicContact CB-CB 4.26Å; P207-A210 PolarHBondContact O-N 3.14Å; P207-L211 HydrophobicContact CG-CD1 4.08Å; P207-L211 HydrophobicContact CG-CG 4.13Å; P207-L211 WeakPolarHBondContact O-CG 3.03Å; P207-L211 PolarHBondContact O-N 3.05Å
208	T	97.4	Very high	94.7	Very high	27 Å²	27	36.9 Å²	36.9	17%	0.166	20%	0.2	C	C	.	.	H	α-helix	trans	-57.6	-48.8	-166.7	-58	0	0	0	0	112.4	I206 S212 S234 K236	I206-T208 PolarHBondContact O-N 3.28Å; I206-T208 PolarHBondContact O-OG1 3.31Å; I206-T208 VanDerWaalsContact O-OG1 3.13Å; T208-S212 PolarHBondContact O-N 3.4Å; T208-S212 VanDerWaalsContact O-N 3.09Å; T208-S234 WeakPolarHBondContact CG2-O 3.41Å; T208-S234 PolarHBondContact OG1-O 3.22Å; T208-K236 HydrophobicContact CG2-CB 4.27Å; T208-K236 HydrophobicContact CG2-CD 3.87Å; T208-K236 HydrophobicContact CG2-CG 3.73Å
209	E	96.9	Very high	94.9	Very high	77 Å²	77	37.9 Å²	37.9	36%	0.36	21%	0.206	S	C	.	.	H	α-helix	trans	-68.9	-38.4	-178.7	-66.2	-58.2	138.5	0	0	111.9	H184 P207 S212 H213 K236	H184-E209 HydrophobicContact CB-CB 4.5Å; P207-E209 PolarHBondContact O-N 3.07Å; E209-S212 WeakPolarHBondContact O-CB 3.4Å; E209-S212 PolarHBondContact O-N 2.98Å; E209-S212 PolarHBondContact O-OG 3.23Å; E209-H213 PolarHBondContact O-CE1 2.68Å; E209-H213 PolarHBondContact O-ND1 3.16Å; E209-K236 IonicContact OE1-NZ 2.82Å; E209-K236 PolarHBondContact OE1-NZ 2.89Å
210	A	97.2	Very high	95.1	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.008	20%	0.201	C	C	.	.	H	α-helix	trans	-64.5	-48	176.8	0	0	0	0	0	111.4	I182 S183 H184 F187 P207 S212 H213	I182-A210 HydrophobicContact CG2-CB 3.68Å; S183-A210 WeakPolarHBondContact O-CB 3.38Å; H184-A210 WeakPolarHBondContact O-CA 3.5Å; F187-A210 HydrophobicContact CD2-CB 3.96Å; F187-A210 HydrophobicContact CE2-CB 4.13Å; P207-A210 HydrophobicContact CB-CB 4.26Å; P207-A210 PolarHBondContact O-N 3.14Å; A210-S212 PolarHBondContact O-N 3.19Å; A210-H213 PolarHBondContact O-N 3.17Å; A210-H213 PolarHBondContact O-ND1 3.39Å
211	L	97.9	Very high	95.6	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-61.7	-28.9	177	-68.3	172.9	0	0	0	112.4	F187 L196 L198 I206 P207 H213 L214 L220 L238	F187-L211 HydrophobicContact CE2-CD2 4.31Å; L196-L211 HydrophobicContact CD2-CD2 3.53Å; L198-L211 HydrophobicContact CD1-CD2 4.28Å; I206-L211 HydrophobicContact CG2-CD1 3.88Å; P207-L211 HydrophobicContact CG-CD1 4.08Å; P207-L211 HydrophobicContact CG-CG 4.13Å; P207-L211 WeakPolarHBondContact O-CG 3.03Å; P207-L211 PolarHBondContact O-N 3.05Å; L211-H213 PolarHBondContact O-N 3.34Å; L211-H213 VanDerWaalsContact O-N 3.08Å; L211-L214 HydrophobicContact CD2-CD1 4.08Å; L211-L214 WeakPolarHBondContact O-CB 3.08Å; L211-L214 PolarHBondContact O-N 2.77Å; L211-L220 HydrophobicContact CD1-CD2 4.18Å; L211-L220 HydrophobicContact CD2-CD1 4.21Å; L211-L238 HydrophobicContact CB-CD1 4.48Å; L211-L238 VanDerWaalsContact O-CD2 3.28Å; L211-L238 WeakPolarHBondContact O-CD2 3.21Å
212	S	97.4	Very high	96	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.014	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-17	-177.3	82.4	0	0	0	0	114.9	T208 E209 A210 L214 H215 K236	T208-S212 PolarHBondContact O-N 3.4Å; T208-S212 VanDerWaalsContact O-N 3.09Å; E209-S212 WeakPolarHBondContact O-CB 3.4Å; E209-S212 PolarHBondContact O-N 2.98Å; E209-S212 PolarHBondContact O-OG 3.23Å; A210-S212 PolarHBondContact O-N 3.19Å; S212-L214 VanDerWaalsContact C-N 3.33Å; S212-H215 PolarHBondContact O-CE1 3.44Å; S212-H215 PolarHBondContact O-ND1 3.42Å; S212-K236 WeakPolarHBondContact CA-O 3.19Å; S212-K236 WeakPolarHBondContact CB-O 3.24Å
213	H	97.3	Very high	96.3	Very high	57 Å²	57	34.3 Å²	34.3	26%	0.264	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-14.1	175.9	-64	84.3	0	0	0	112.8	H184 E209 A210 L211 H215	H184-H213 PolarHBondContact O-CE1 3.13Å; H184-H213 PolarHBondContact O-ND1 2.96Å; H184-H213 VanDerWaalsContact O-ND1 3.1Å; E209-H213 PolarHBondContact O-CE1 2.68Å; E209-H213 PolarHBondContact O-ND1 3.16Å; A210-H213 PolarHBondContact O-N 3.17Å; A210-H213 PolarHBondContact O-ND1 3.39Å; L211-H213 PolarHBondContact O-N 3.34Å; L211-H213 VanDerWaalsContact O-N 3.08Å; H213-H215 VanDerWaalsContact C-N 3.32Å; H213-H215 PolarHBondContact O-N 2.81Å
214	L	97.5	Very high	96.6	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.195	C	C	.	.			trans	-87.1	67.8	-178	-63.9	172.8	0	0	0	111.3	F187 L190 L193 L196 L211 S212 G216 L217 L238	F187-L214 HydrophobicContact CB-CD1 4.22Å; F187-L214 HydrophobicContact CB-CD2 3.79Å; F187-L214 HydrophobicContact CB-CG 3.93Å; F187-L214 HydrophobicContact CD2-CD1 4.16Å; F187-L214 HydrophobicContact CG-CD1 4.16Å; F187-L214 HydrophobicContact CG-CD2 4.48Å; F187-L214 HydrophobicContact CG-CG 4.41Å; L190-L214 HydrophobicContact CB-CD2 3.83Å; L190-L214 HydrophobicContact CD1-CD2 4.34Å; L193-L214 HydrophobicContact CB-CD2 4.17Å; L193-L214 HydrophobicContact CD2-CD1 4.12Å; L193-L214 HydrophobicContact CD2-CD2 3.63Å; L193-L214 HydrophobicContact CD2-CG 4.5Å; L196-L214 HydrophobicContact CD2-CD1 3.61Å; L211-L214 HydrophobicContact CD2-CD1 4.08Å; L211-L214 WeakPolarHBondContact O-CB 3.08Å; L211-L214 PolarHBondContact O-N 2.77Å; S212-L214 VanDerWaalsContact C-N 3.33Å; L214-G216 PolarHBondContact O-N 3.31Å; L214-L217 HydrophobicContact CB-CB 4.05Å; L214-L217 HydrophobicContact CB-CD2 4.35Å; L214-L217 HydrophobicContact CD1-CD1 4.48Å; L214-L217 HydrophobicContact CD1-CD2 4.18Å; L214-L217 WeakPolarHBondContact O-CB 3.44Å; L214-L217 PolarHBondContact O-N 3.4Å; L214-L238 HydrophobicContact CB-CD2 4.25Å; L214-L238 WeakPolarHBondContact O-CD2 3.23Å
215	H	94.7	Very high	96.8	Very high	101 Å²	101	31 Å²	31	47%	0.468	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-24.6	-175.8	-54.8	-45.8	0	0	0	114	S212 H213	S212-H215 PolarHBondContact O-CE1 3.44Å; S212-H215 PolarHBondContact O-ND1 3.42Å; H213-H215 VanDerWaalsContact C-N 3.32Å; H213-H215 PolarHBondContact O-N 2.81Å
216	G	96.1	Very high	96.9	Very high	10 Å²	10	31.5 Å²	31.5	10%	0.103	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-10.2	178.6	0	0	0	0	0	115.1	L193 L214 I218	L193-G216 CarbonylContact O-C 3.29Å; L214-G216 PolarHBondContact O-N 3.31Å; G216-I218 PolarHBondContact O-N 3.43Å
217	L	98.4	Very high	96.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.152	C	C	.	.			trans	-65.9	128.6	-165.2	-159.3	69	0	0	0	112.5	L193 L196 L214 L220 L238 R240 L241	L193-L217 HydrophobicContact CD2-CD1 4.15Å; L193-L217 HydrophobicContact CG-CD1 4.4Å; L193-L217 WeakPolarHBondContact O-CA 3.31Å; L193-L217 PolarHBondContact O-N 3.05Å; L196-L217 HydrophobicContact CB-CD1 3.75Å; L196-L217 HydrophobicContact CB-CD2 4.36Å; L214-L217 HydrophobicContact CB-CB 4.05Å; L214-L217 HydrophobicContact CB-CD2 4.35Å; L214-L217 HydrophobicContact CD1-CD1 4.48Å; L214-L217 HydrophobicContact CD1-CD2 4.18Å; L214-L217 WeakPolarHBondContact O-CB 3.44Å; L214-L217 PolarHBondContact O-N 3.4Å; L217-L220 HydrophobicContact CD2-CB 3.99Å; L217-L220 HydrophobicContact CD2-CD1 4.12Å; L217-L220 HydrophobicContact CD2-CG 4.46Å; L217-L238 HydrophobicContact CB-CD2 4.22Å; L217-L238 HydrophobicContact CD2-CD2 4.1Å; L217-R240 CarbonylContact O-C 3.52Å; L217-L241 HydrophobicContact CB-CD1 4.39Å; L217-L241 HydrophobicContact CD2-CD1 4.05Å; L217-L241 HydrophobicContact CG-CD1 4.01Å; L217-L241 VanDerWaalsContact O-CA 3.27Å; L217-L241 WeakPolarHBondContact O-CA 3.04Å; L217-L241 PolarHBondContact O-N 3.38Å; L217-L241 VanDerWaalsContact O-N 3.07Å
218	I	98.6	Very high	96.8	Very high	63 Å²	63	34.7 Å²	34.7	32%	0.323	17%	0.17	S	C	.	.			trans	-107.6	-40.6	179.8	-56.5	178.8	0	0	0	110.3	E194 G216 L241 K242 V243	E194-I218 HydrophobicContact CB-CD1 4.21Å; E194-I218 HydrophobicContact CB-CG1 4.4Å; E194-I218 HydrophobicContact CG-CD1 4.02Å; E194-I218 WeakPolarHBondContact O-CA 3.49Å; E194-I218 PolarHBondContact O-N 3.35Å; G216-I218 PolarHBondContact O-N 3.43Å; I218-L241 WeakPolarHBondContact O-CD1 3.19Å; I218-K242 HydrophobicContact CG2-CB 4.1Å; I218-K242 HydrophobicContact CG2-CG 4.28Å; I218-K242 PolarHBondContact O-N 3.5Å; I218-V243 PolarHBondContact O-N 3.4Å
219	V	98.8	Very high	96.8	Very high	21 Å²	21	34.5 Å²	34.5	13%	0.127	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	121.9	-176.7	-176.5	0	0	0	0	109.8	E194 Q195 L196 R221 V243	E194-V219 PolarHBondContact O-N 3.03Å; Q195-V219 WeakPolarHBondContact CA-O 3.46Å; Q195-V219 HydrophobicContact CB-CB 4.33Å; Q195-V219 HydrophobicContact CG-CB 4.16Å; Q195-V219 HydrophobicContact CG-CG1 4.28Å; L196-V219 PolarHBondContact N-O 2.92Å; V219-R221 HydrophobicContact CG1-CG 4.13Å; V219-V243 HydrophobicContact CB-CB 4.4Å; V219-V243 HydrophobicContact CG1-CB 4.17Å; V219-V243 HydrophobicContact CG1-CG1 4.26Å; V219-V243 HydrophobicContact CG2-CB 4.08Å; V219-V243 HydrophobicContact CG2-CG2 4.19Å
220	L	98.7	Very high	96.9	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	121.7	173.1	178.6	60.2	0	0	0	109.1	L196 L211 L217 L222 F235 L238 L241 V243 L244 E245	L196-L220 HydrophobicContact CB-CD1 4.21Å; L196-L220 HydrophobicContact CD2-CD1 4.04Å; L196-L220 HydrophobicContact CG-CD1 4.25Å; L211-L220 HydrophobicContact CD1-CD2 4.18Å; L211-L220 HydrophobicContact CD2-CD1 4.21Å; L217-L220 HydrophobicContact CD2-CB 3.99Å; L217-L220 HydrophobicContact CD2-CD1 4.12Å; L217-L220 HydrophobicContact CD2-CG 4.46Å; L220-L222 HydrophobicContact CD1-CD2 3.8Å; L220-L222 HydrophobicContact CD1-CG 4.37Å; L220-L222 HydrophobicContact CD2-CD1 4.48Å; L220-L222 HydrophobicContact CD2-CD2 4.43Å; L220-L222 HydrophobicContact CD2-CG 4.44Å; L220-L222 HydrophobicContact CG-CD2 4.1Å; L220-L222 HydrophobicContact CG-CG 4.14Å; L220-F235 HydrophobicContact CD2-CD1 4.07Å; L220-F235 HydrophobicContact CD2-CE1 3.74Å; L220-L238 HydrophobicContact CD2-CD1 4.24Å; L220-L241 HydrophobicContact CB-CD1 3.66Å; L220-L241 HydrophobicContact CB-CD2 4.21Å; L220-V243 PolarHBondContact N-O 3.31Å; L220-L244 HydrophobicContact CB-CD1 4.22Å; L220-L244 HydrophobicContact CD2-CD1 4.04Å; L220-L244 HydrophobicContact CG-CD1 4.16Å; L220-E245 PolarHBondContact O-N 2.76Å
221	R	98.5	Very high	96.9	Very high	53 Å²	53	39.4 Å²	39.4	20%	0.2	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	123.5	174.3	-54.9	-165.3	172.4	89.7	2	109.6	L196 T197 L198 V219 E245	L196-R221 PolarHBondContact O-N 3.38Å; T197-R221 WeakPolarHBondContact CA-O 3.49Å; T197-R221 HydrophobicContact CG2-CB 4.17Å; L198-R221 PolarHBondContact N-O 3Å; V219-R221 HydrophobicContact CG1-CG 4.13Å; R221-E245 CarbonylContact C-O 3.03Å; R221-E245 WeakPolarHBondContact CA-O 3.34Å; R221-E245 HydrophobicContact CB-CB 4.37Å; R221-E245 WeakPolarHBondContact CD-OE2 3.18Å; R221-E245 HydrophobicContact CG-CB 4.06Å; R221-E245 IonicContact NE-OE2 2.97Å; R221-E245 PolarHBondContact NE-OE2 2.83Å
222	L	97.4	Very high	96.9	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	104.6	174.7	-51.5	176.6	0	0	0	108.7	L198 L220 L225 F235 E245 I246 S247 W249	L198-L222 HydrophobicContact CB-CD2 3.86Å; L198-L222 HydrophobicContact CD1-CD2 3.97Å; L198-L222 HydrophobicContact CG-CD2 4.25Å; L198-L222 CarbonylContact O-C 3.5Å; L198-L222 VanDerWaalsContact O-CA 3.31Å; L198-L222 WeakPolarHBondContact O-CA 3.38Å; L220-L222 HydrophobicContact CD1-CD2 3.8Å; L220-L222 HydrophobicContact CD1-CG 4.37Å; L220-L222 HydrophobicContact CD2-CD1 4.48Å; L220-L222 HydrophobicContact CD2-CD2 4.43Å; L220-L222 HydrophobicContact CD2-CG 4.44Å; L220-L222 HydrophobicContact CG-CD2 4.1Å; L220-L222 HydrophobicContact CG-CG 4.14Å; L222-L225 HydrophobicContact CB-CD1 4.19Å; L222-F235 HydrophobicContact CD1-CE1 4.18Å; L222-F235 HydrophobicContact CD1-CZ 4.31Å; L222-E245 PolarHBondContact N-O 3.28Å; L222-I246 HydrophobicContact CB-CG1 4.49Å; L222-I246 HydrophobicContact CD1-CG1 4.44Å; L222-I246 WeakPolarHBondContact O-CA 3.19Å; L222-S247 PolarHBondContact O-N 3.16Å; L222-S247 VanDerWaalsContact O-N 3.09Å; L222-W249 HydrophobicContact CB-CZ2 3.52Å; L222-W249 HydrophobicContact CD1-CH2 4.01Å; L222-W249 HydrophobicContact CD1-CZ2 3.77Å; L222-W249 HydrophobicContact CG-CZ2 4.3Å; L222-W249 PolarHBondContact O-NE1 3.09Å; L222-W249 VanDerWaalsContact O-NE1 3.07Å
223	R	95.9	Very high	96.9	Very high	68 Å²	68	48 Å²	48	26%	0.257	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	148	-171.8	-52.7	-174.3	167.6	162.2	-6.5	112	L198 E199 K200 L225 E245 S247	L198-R223 PolarHBondContact O-N 3.42Å; E199-R223 CarbonylContact C-O 3.57Å; E199-R223 WeakPolarHBondContact CA-O 3.47Å; E199-R223 HydrophobicContact CB-CB 3.78Å; K200-R223 PolarHBondContact N-O 3.41Å; R223-L225 VanDerWaalsContact C-N 3.33Å; R223-L225 WeakPolarHBondContact O-CD2 3.32Å; R223-L225 PolarHBondContact O-N 2.66Å; R223-E245 IonicContact CZ-OE1 2.62Å; R223-E245 IonicContact NE-OE1 3.16Å; R223-E245 PolarHBondContact NE-OE1 3Å; R223-E245 IonicContact NH2-OE1 3.88Å; R223-E245 PolarHBondContact NH2-OE1 3.01Å; R223-E245 IonicContact NH2-OE2 2.7Å; R223-E245 PolarHBondContact NH2-OE2 2.88Å; R223-E245 VanDerWaalsContact NH2-OE2 3.16Å; R223-S247 CarbonylContact C-O 3.58Å; R223-S247 VanDerWaalsContact CA-O 3.26Å; R223-S247 WeakPolarHBondContact CA-O 3.23Å; R223-S247 WeakPolarHBondContact CG-OG 3.32Å
224	H	95.1	Very high	97	Very high	70 Å²	70	45.9 Å²	45.9	32%	0.324	22%	0.215	S	C	.	.	S	Bend	trans	53.5	44.1	170.2	-57.2	97	0	0	0	113.8	K200 S247 H248	K200-H224 VanDerWaalsContact CA-O 3.25Å; K200-H224 WeakPolarHBondContact CA-O 3.32Å; K200-H224 HydrophobicContact CB-CB 4.24Å; K200-H224 HydrophobicContact CG-CB 3.41Å; K200-H224 VanDerWaalsContact CG-CB 3.41Å; K200-H224 PolarHBondContact N-O 2.99Å; H224-S247 PolarHBondContact N-O 3.23Å; H224-H248 WeakPolarHBondContact CA-O 3.36Å; H224-H248 HydrophobicContact CB-CB 4.5Å; H224-H248 VanDerWaalsContact CD2-CB 3.42Å; H224-H248 WeakPolarHBondContact CD2-CB 3.33Å; H224-H248 AromaticContact CD2-CG 3.77Å; H224-H248 AromaticContact CE1-CG 3.94Å; H224-H248 AromaticContact CE1-ND1 3.9Å; H224-H248 PolarHBondContact N-O 3.07Å; H224-H248 AromaticContact NE2-CD2 3.68Å; H224-H248 AromaticContact NE2-CG 3.45Å; H224-H248 AromaticContact NE2-ND1 3.83Å
225	L	94.1	Very high	97	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	22%	0.216	C	C	.	.			trans	-103.6	152.5	177.7	-54.2	-173.1	0	0	0	111.3	C201 L222 R223 I227 W249	C201-L225 HydrophobicContact CB-CD2 3.81Å; C201-L225 WeakPolarHBondContact O-CD2 3.33Å; L222-L225 HydrophobicContact CB-CD1 4.19Å; R223-L225 VanDerWaalsContact C-N 3.33Å; R223-L225 WeakPolarHBondContact O-CD2 3.32Å; R223-L225 PolarHBondContact O-N 2.66Å; L225-I227 VanDerWaalsContact C-N 3.26Å; L225-I227 HydrophobicContact CB-CD1 4.24Å; L225-I227 HydrophobicContact CB-CG1 4.28Å; L225-I227 HydrophobicContact CD1-CD1 3.89Å; L225-I227 PolarHBondContact O-N 2.89Å; L225-W249 HydrophobicContact CB-CD2 4.19Å; L225-W249 HydrophobicContact CB-CG 4.34Å; L225-W249 HydrophobicContact CB-CZ2 4.2Å; L225-W249 HydrophobicContact CD1-CH2 4.46Å; L225-W249 HydrophobicContact CD1-CZ2 3.61Å; L225-W249 HydrophobicContact CG-CZ2 4.18Å; L225-W249 WeakPolarHBondContact O-CA 3.41Å
226	N	93.7	Very high	97	Very high	83 Å²	83	45.4 Å²	45.4	44%	0.444	21%	0.212	S	C	.	.			trans	-90.2	25.7	-179.1	-66.6	-31.4	0	0	0	113.5	N202 Y251	N202-N226 PolarHBondContact OD1-ND2 2.81Å; N226-Y251 HydrophobicContact CB-CD2 4.31Å; N226-Y251 HydrophobicContact CB-CE2 4.39Å
227	I	95.4	Very high	97	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.01	23%	0.233	C	C	.	.			trans	-85.2	129.7	-177.3	-59.8	167.9	0	0	0	109.1	I206 L225 A229 W249	I206-I227 HydrophobicContact CG1-CD1 3.96Å; L225-I227 VanDerWaalsContact C-N 3.26Å; L225-I227 HydrophobicContact CB-CD1 4.24Å; L225-I227 HydrophobicContact CB-CG1 4.28Å; L225-I227 HydrophobicContact CD1-CD1 3.89Å; L225-I227 PolarHBondContact O-N 2.89Å; I227-A229 WeakPolarHBondContact CG2-O 3.46Å; I227-W249 HydrophobicContact CB-CD2 4.44Å; I227-W249 HydrophobicContact CB-CE3 3.73Å; I227-W249 HydrophobicContact CB-CH2 4.31Å; I227-W249 HydrophobicContact CB-CZ3 3.66Å; I227-W249 HydrophobicContact CD1-CH2 3.8Å; I227-W249 HydrophobicContact CD1-CZ2 4.23Å; I227-W249 HydrophobicContact CD1-CZ3 4.04Å; I227-W249 HydrophobicContact CG1-CZ3 4.44Å; I227-W249 HydrophobicContact CG2-CE3 4.14Å; I227-W249 HydrophobicContact CG2-CZ3 3.72Å
228	N	96.3	Very high	97	Very high	92 Å²	92	52 Å²	52	49%	0.492	23%	0.234	S	C	.	.			trans	-95.5	-21.2	-178.4	67.7	-13.9	0	0	0	114.8	Y251 L252 D253 T254	N228-Y251 VanDerWaalsContact CA-O 3.24Å; N228-Y251 WeakPolarHBondContact CA-O 3.41Å; N228-Y251 VanDerWaalsContact CB-O 3.31Å; N228-Y251 WeakPolarHBondContact CB-O 3.37Å; N228-L252 WeakPolarHBondContact O-CA 3.2Å; N228-D253 PolarHBondContact O-N 2.88Å; N228-D253 VanDerWaalsContact O-OD1 3.05Å; N228-T254 PolarHBondContact O-OG1 3.22Å
229	A	97.4	Very high	96.8	Very high	22 Å²	22	56.5 Å²	56.5	18%	0.182	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	136.3	-175.5	0	0	0	0	0	111.7	I227 T254	I227-A229 WeakPolarHBondContact CG2-O 3.46Å; A229-T254 WeakPolarHBondContact CA-O 3.48Å; A229-T254 WeakPolarHBondContact CB-OG1 3.34Å
230	I	98.3	Very high	96.7	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	111.8	168.3	-53.2	174.3	0	0	0	107.5	I206 F235 I246 W249 L252 T254 M255 T256 C259	I206-I230 HydrophobicContact CD1-CB 4.49Å; I206-I230 HydrophobicContact CD1-CG1 4.14Å; I206-I230 HydrophobicContact CD1-CG2 3.8Å; I230-F235 HydrophobicContact CG2-CE2 4.19Å; I230-I246 HydrophobicContact CD1-CD1 3.59Å; I230-W249 HydrophobicContact CD1-CZ3 3.98Å; I230-W249 HydrophobicContact CG1-CZ3 3.83Å; I230-L252 HydrophobicContact CD1-CD1 4.15Å; I230-L252 HydrophobicContact CD1-CD2 3.99Å; I230-L252 HydrophobicContact CG1-CD1 3.8Å; I230-T254 PolarHBondContact N-O 2.87Å; I230-M255 HydrophobicContact CB-CG 4.39Å; I230-M255 HydrophobicContact CD1-CE 4.05Å; I230-M255 HydrophobicContact CD1-CG 4.29Å; I230-T256 PolarHBondContact O-N 3.06Å; I230-T256 PolarHBondContact O-OG1 2.77Å; I230-C259 HydrophobicContact CB-CB 4.21Å; I230-C259 HydrophobicContact CG2-CB 3.64Å; I230-C259 VanDerWaalsContact O-CB 3.32Å; I230-C259 WeakPolarHBondContact O-CB 3.48Å
231	R	97.8	Very high	96.7	Very high	182 Å²	182	63.5 Å²	63.5	69%	0.687	27%	0.272	S	S	*	.			trans	-90.7	167.4	-174.5	-60.4	-171.5	-178.2	-143.7	0.3	111.8	Y233 S234 T256 C259	R231-Y233 PolarHBondContact O-N 3.22Å; R231-S234 PolarHBondContact N-OG 2.96Å; R231-S234 WeakPolarHBondContact O-CB 3.49Å; R231-S234 PolarHBondContact O-N 3.5Å; R231-S234 PolarHBondContact O-OG 2.79Å; R231-T256 WeakPolarHBondContact CA-OG1 3.5Å; R231-C259 VanDerWaalsContact O-CA 3.24Å; R231-C259 WeakPolarHBondContact O-CA 3.41Å; R231-C259 VanDerWaalsContact O-CB 3.26Å; R231-C259 WeakPolarHBondContact O-CB 3.49Å
232	D	98.3	Very high	96.7	Very high	69 Å²	69	64.3 Å²	64.3	37%	0.369	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	137.5	-178.9	-69.1	-23.8	0	0	0	111.4	S234 T256 N258 C259	D232-S234 VanDerWaalsContact C-N 3.27Å; D232-S234 PolarHBondContact O-N 3.37Å; D232-T256 VanDerWaalsContact CG-OG1 3.31Å; D232-T256 PolarHBondContact N-OG1 3.24Å; D232-T256 WeakPolarHBondContact OD1-CB 3.19Å; D232-T256 PolarHBondContact OD1-OG1 3.26Å; D232-N258 HydrophobicContact CB-CB 4.08Å; D232-N258 VanDerWaalsContact OD1-CA 3.32Å; D232-N258 WeakPolarHBondContact OD1-CA 3.39Å; D232-N258 WeakPolarHBondContact OD1-CB 3.42Å; D232-N258 PolarHBondContact OD1-N 3.28Å; D232-C259 PolarHBondContact OD1-N 3.44Å
233	Y	97.4	Very high	96.8	Very high	114 Å²	114	66.1 Å²	66.1	45%	0.447	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.5	29.3	177.9	-38.9	-71.6	0	0	0	114.8	R231 F235 N258 Y261	R231-Y233 PolarHBondContact O-N 3.22Å; Y233-F235 PolarHBondContact O-N 2.8Å; Y233-N258 HydrophobicContact CE1-CB 4.17Å; Y233-N258 PolarHBondContact N-O 3.21Å; Y233-Y261 AromaticContact CD1-CD1 3.83Å; Y233-Y261 HydrophobicContact CD1-CD1 3.83Å; Y233-Y261 HydrophobicContact CD1-CG 4.09Å; Y233-Y261 AromaticContact CE1-CD1 3.8Å; Y233-Y261 HydrophobicContact CE1-CD1 3.8Å; Y233-Y261 HydrophobicContact CE1-CE1 4.41Å; Y233-Y261 AromaticContact CE1-CG 3.89Å; Y233-Y261 HydrophobicContact CE1-CG 3.89Å
234	S	98.1	Very high	96.9	Very high	12 Å²	12	62.9 Å²	62.9	8%	0.084	28%	0.276	C	S	.	.			trans	-64.3	-14.8	176.1	-68	0	0	0	0	114	T208 R231 D232	T208-S234 WeakPolarHBondContact CG2-O 3.41Å; T208-S234 PolarHBondContact OG1-O 3.22Å; R231-S234 PolarHBondContact N-OG 2.96Å; R231-S234 WeakPolarHBondContact O-CB 3.49Å; R231-S234 PolarHBondContact O-N 3.5Å; R231-S234 PolarHBondContact O-OG 2.79Å; D232-S234 VanDerWaalsContact C-N 3.27Å; D232-S234 PolarHBondContact O-N 3.37Å
235	F	98	Very high	97.1	Very high	5 Å²	5	61.2 Å²	61.2	2%	0.022	27%	0.268	C	S	.	.	S	Bend	trans	-124.7	107	177.4	-57.6	-81.1	0	0	0	109.8	I206 L220 L222 I230 Y233 L238 L244 L260 L263	I206-F235 HydrophobicContact CD1-CE1 4.41Å; I206-F235 HydrophobicContact CD1-CE2 4.18Å; I206-F235 HydrophobicContact CD1-CZ 3.79Å; I206-F235 HydrophobicContact CG2-CE1 4.18Å; L220-F235 HydrophobicContact CD2-CD1 4.07Å; L220-F235 HydrophobicContact CD2-CE1 3.74Å; L222-F235 HydrophobicContact CD1-CE1 4.18Å; L222-F235 HydrophobicContact CD1-CZ 4.31Å; I230-F235 HydrophobicContact CG2-CE2 4.19Å; Y233-F235 PolarHBondContact O-N 2.8Å; F235-L238 HydrophobicContact CB-CD1 4.29Å; F235-L238 HydrophobicContact CD1-CD1 4.06Å; F235-L244 HydrophobicContact CE1-CD1 4.12Å; F235-L244 HydrophobicContact CE2-CD2 4.09Å; F235-L244 HydrophobicContact CZ-CD1 4.11Å; F235-L244 HydrophobicContact CZ-CD2 3.98Å; F235-L260 HydrophobicContact CD2-CD2 4.03Å; F235-L260 HydrophobicContact CE2-CD2 3.73Å; F235-L263 HydrophobicContact CB-CD1 3.88Å; F235-L263 HydrophobicContact CB-CD2 3.81Å; F235-L263 HydrophobicContact CB-CG 3.93Å; F235-L263 HydrophobicContact CD2-CD1 3.78Å; F235-L263 HydrophobicContact CE2-CD1 4.46Å; F235-L263 HydrophobicContact CG-CD1 3.82Å; F235-L263 HydrophobicContact CG-CG 4.42Å
236	K	95.9	Very high	97.3	Very high	87 Å²	87	61.2 Å²	61.2	38%	0.378	27%	0.268	S	S	.	.			trans	-111.1	141.3	-178.8	-64.2	-178	-170.1	170	0	110.7	T208 E209 S212 L238	T208-K236 HydrophobicContact CG2-CB 4.27Å; T208-K236 HydrophobicContact CG2-CD 3.87Å; T208-K236 HydrophobicContact CG2-CG 3.73Å; E209-K236 IonicContact OE1-NZ 2.82Å; E209-K236 PolarHBondContact OE1-NZ 2.89Å; S212-K236 WeakPolarHBondContact CA-O 3.19Å; S212-K236 WeakPolarHBondContact CB-O 3.24Å; K236-L238 PolarHBondContact O-N 2.93Å
237	R	96.1	Very high	97.5	Very high	145 Å²	145	57.5 Å²	57.5	55%	0.547	25%	0.249	S	C	.	.	S	Bend	trans	58.5	17.1	170.2	-51.9	-178.2	173.7	167.9	-1.9	116	Y239	R237-Y239 VanDerWaalsContact C-N 3.25Å; R237-Y239 HydrophobicContact CB-CE2 3.93Å; R237-Y239 HydrophobicContact CG-CE2 4.45Å; R237-Y239 WeakPolarHBondContact O-CD2 3.24Å; R237-Y239 PolarHBondContact O-N 3Å; R237-Y239 VanDerWaalsContact O-N 3.16Å
238	L	97.3	Very high	97.6	Very high	3 Å²	3	60.6 Å²	60.6	2%	0.016	26%	0.263	C	S	.	.			trans	-87.9	56.9	173.9	-66.1	178.9	0	0	0	110.9	L211 L214 L217 L220 F235 K236 R240 L241 L263	L211-L238 HydrophobicContact CB-CD1 4.48Å; L211-L238 VanDerWaalsContact O-CD2 3.28Å; L211-L238 WeakPolarHBondContact O-CD2 3.21Å; L214-L238 HydrophobicContact CB-CD2 4.25Å; L214-L238 WeakPolarHBondContact O-CD2 3.23Å; L217-L238 HydrophobicContact CB-CD2 4.22Å; L217-L238 HydrophobicContact CD2-CD2 4.1Å; L220-L238 HydrophobicContact CD2-CD1 4.24Å; F235-L238 HydrophobicContact CB-CD1 4.29Å; F235-L238 HydrophobicContact CD1-CD1 4.06Å; K236-L238 PolarHBondContact O-N 2.93Å; L238-R240 VanDerWaalsContact C-N 3.26Å; L238-R240 PolarHBondContact O-N 3.02Å; L238-L241 HydrophobicContact CB-CB 4.12Å; L238-L241 HydrophobicContact CD1-CD2 4.24Å; L238-L241 WeakPolarHBondContact O-CB 3.29Å; L238-L241 PolarHBondContact O-N 3.26Å; L238-L263 HydrophobicContact CB-CD2 3.99Å
239	Y	94.1	Very high	97.7	Very high	158 Å²	158	56.2 Å²	56.2	62%	0.62	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	-26.2	-168.2	-51.3	-63	0	0	0	114.2	R237	R237-Y239 VanDerWaalsContact C-N 3.25Å; R237-Y239 HydrophobicContact CB-CE2 3.93Å; R237-Y239 HydrophobicContact CG-CE2 4.45Å; R237-Y239 WeakPolarHBondContact O-CD2 3.24Å; R237-Y239 PolarHBondContact O-N 3Å; R237-Y239 VanDerWaalsContact O-N 3.16Å
240	R	97.6	Very high	97.6	Very high	167 Å²	167	58.5 Å²	58.5	63%	0.63	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-4.3	-179.9	-70.5	-172.2	174.7	-176.3	1.1	113.7	L217 L238 K242	L217-R240 CarbonylContact O-C 3.52Å; L238-R240 VanDerWaalsContact C-N 3.26Å; L238-R240 PolarHBondContact O-N 3.02Å; R240-K242 WeakPolarHBondContact O-CG 3.28Å; R240-K242 PolarHBondContact O-N 3.39Å
241	L	98.6	Very high	97.6	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	28%	0.279	C	S	.	.			trans	-64.4	126.2	-174.7	-162.9	74.6	0	0	0	110.8	L217 I218 L220 L238 L263 L265	L217-L241 HydrophobicContact CB-CD1 4.39Å; L217-L241 HydrophobicContact CD2-CD1 4.05Å; L217-L241 HydrophobicContact CG-CD1 4.01Å; L217-L241 VanDerWaalsContact O-CA 3.27Å; L217-L241 WeakPolarHBondContact O-CA 3.04Å; L217-L241 PolarHBondContact O-N 3.38Å; L217-L241 VanDerWaalsContact O-N 3.07Å; I218-L241 WeakPolarHBondContact O-CD1 3.19Å; L220-L241 HydrophobicContact CB-CD1 3.66Å; L220-L241 HydrophobicContact CB-CD2 4.21Å; L238-L241 HydrophobicContact CB-CB 4.12Å; L238-L241 HydrophobicContact CD1-CD2 4.24Å; L238-L241 WeakPolarHBondContact O-CB 3.29Å; L238-L241 PolarHBondContact O-N 3.26Å; L241-L263 HydrophobicContact CB-CD2 4.3Å; L241-L263 HydrophobicContact CD2-CD1 4.27Å; L241-L263 HydrophobicContact CD2-CD2 3.82Å; L241-L265 HydrophobicContact CB-CD2 4.39Å; L241-L265 HydrophobicContact CD2-CD2 4.02Å; L241-L265 HydrophobicContact CG-CD2 4.04Å
242	K	98.4	Very high	97.6	Very high	70 Å²	70	56.5 Å²	56.5	30%	0.304	25%	0.246	S	C	.	.			trans	-117.5	-26.2	-179.5	-65.2	-57.3	167.3	-165.9	0	113.6	I218 R240 N264 T266 S267	I218-K242 HydrophobicContact CG2-CB 4.1Å; I218-K242 HydrophobicContact CG2-CG 4.28Å; I218-K242 PolarHBondContact O-N 3.5Å; R240-K242 WeakPolarHBondContact O-CG 3.28Å; R240-K242 PolarHBondContact O-N 3.39Å; K242-N264 PolarHBondContact NZ-O 3.19Å; K242-T266 HydrophobicContact CD-CG2 4.06Å; K242-T266 PolarHBondContact O-N 3.12Å; K242-T266 PolarHBondContact O-OG1 3.43Å; K242-T266 VanDerWaalsContact O-OG1 3.07Å; K242-S267 PolarHBondContact O-N 3.28Å
243	V	98.9	Very high	97.5	Very high	38 Å²	38	56.9 Å²	56.9	23%	0.23	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	120.5	-179.2	-174.6	0	0	0	0	108.6	I218 V219 L220 S267	I218-V243 PolarHBondContact O-N 3.4Å; V219-V243 HydrophobicContact CB-CB 4.4Å; V219-V243 HydrophobicContact CG1-CB 4.17Å; V219-V243 HydrophobicContact CG1-CG1 4.26Å; V219-V243 HydrophobicContact CG2-CB 4.08Å; V219-V243 HydrophobicContact CG2-CG2 4.19Å; L220-V243 PolarHBondContact N-O 3.31Å; V243-S267 WeakPolarHBondContact CA-O 3.4Å
244	L	98.8	Very high	97.5	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	120.6	169.9	178.7	61.4	0	0	0	108.7	L220 F235 I246 L260 L263 L265 S267 L268 S269	L220-L244 HydrophobicContact CB-CD1 4.22Å; L220-L244 HydrophobicContact CD2-CD1 4.04Å; L220-L244 HydrophobicContact CG-CD1 4.16Å; F235-L244 HydrophobicContact CE1-CD1 4.12Å; F235-L244 HydrophobicContact CE2-CD2 4.09Å; F235-L244 HydrophobicContact CZ-CD1 4.11Å; F235-L244 HydrophobicContact CZ-CD2 3.98Å; L244-I246 HydrophobicContact CD1-CD1 4.42Å; L244-I246 HydrophobicContact CD1-CG1 4.33Å; L244-I246 HydrophobicContact CD2-CD1 4.08Å; L244-I246 HydrophobicContact CG-CD1 4.21Å; L244-I246 HydrophobicContact CG-CG1 4.39Å; L244-L260 HydrophobicContact CD2-CD2 3.79Å; L244-L263 HydrophobicContact CD2-CD1 4.05Å; L244-L265 HydrophobicContact CB-CD1 3.71Å; L244-L265 HydrophobicContact CB-CD2 4.08Å; L244-L265 HydrophobicContact CD2-CD1 4.18Å; L244-S267 PolarHBondContact N-O 3.13Å; L244-S267 VanDerWaalsContact N-O 3.13Å; L244-L268 HydrophobicContact CB-CD1 4.06Å; L244-L268 HydrophobicContact CD2-CD1 3.95Å; L244-L268 HydrophobicContact CG-CD1 4.11Å; L244-L268 WeakPolarHBondContact O-CA 3.37Å; L244-S269 PolarHBondContact O-N 3.02Å
245	E	98.7	Very high	97.5	Very high	36 Å²	36	55.5 Å²	55.5	17%	0.168	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	118.1	174.4	-171.4	-169	138.6	0	0	109	L220 R221 L222 R223	L220-E245 PolarHBondContact O-N 2.76Å; R221-E245 CarbonylContact C-O 3.03Å; R221-E245 WeakPolarHBondContact CA-O 3.34Å; R221-E245 HydrophobicContact CB-CB 4.37Å; R221-E245 WeakPolarHBondContact CD-OE2 3.18Å; R221-E245 HydrophobicContact CG-CB 4.06Å; R221-E245 IonicContact NE-OE2 2.97Å; R221-E245 PolarHBondContact NE-OE2 2.83Å; L222-E245 PolarHBondContact N-O 3.28Å; R223-E245 IonicContact CZ-OE1 2.62Å; R223-E245 IonicContact NE-OE1 3.16Å; R223-E245 PolarHBondContact NE-OE1 3Å; R223-E245 IonicContact NH2-OE1 3.88Å; R223-E245 PolarHBondContact NH2-OE1 3.01Å; R223-E245 IonicContact NH2-OE2 2.7Å; R223-E245 PolarHBondContact NH2-OE2 2.88Å; R223-E245 VanDerWaalsContact NH2-OE2 3.16Å
246	I	98.5	Very high	97.5	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	118.8	169.4	-68.2	158.5	0	0	0	105.9	L222 I230 L244 W249 L252 S269 I270 T271	L222-I246 HydrophobicContact CB-CG1 4.49Å; L222-I246 HydrophobicContact CD1-CG1 4.44Å; L222-I246 WeakPolarHBondContact O-CA 3.19Å; I230-I246 HydrophobicContact CD1-CD1 3.59Å; L244-I246 HydrophobicContact CD1-CD1 4.42Å; L244-I246 HydrophobicContact CD1-CG1 4.33Å; L244-I246 HydrophobicContact CD2-CD1 4.08Å; L244-I246 HydrophobicContact CG-CD1 4.21Å; L244-I246 HydrophobicContact CG-CG1 4.39Å; I246-W249 HydrophobicContact CG1-CZ2 4.37Å; I246-W249 HydrophobicContact CG2-CD2 3.63Å; I246-W249 HydrophobicContact CG2-CE3 4Å; I246-W249 HydrophobicContact CG2-CG 3.97Å; I246-W249 HydrophobicContact CG2-CH2 4.33Å; I246-W249 HydrophobicContact CG2-CZ2 4Å; I246-W249 HydrophobicContact CG2-CZ3 4.34Å; I246-L252 HydrophobicContact CG2-CD2 3.99Å; I246-S269 PolarHBondContact N-O 3.42Å; I246-I270 HydrophobicContact CB-CG1 4.39Å; I246-I270 HydrophobicContact CB-CG2 4.45Å; I246-I270 HydrophobicContact CD1-CG1 4.5Å; I246-I270 HydrophobicContact CG2-CG2 4.28Å; I246-I270 CarbonylContact O-C 3.27Å; I246-I270 WeakPolarHBondContact O-CA 3.47Å; I246-T271 PolarHBondContact O-N 3.12Å
247	S	98.1	Very high	97.6	Very high	5 Å²	5	55.8 Å²	55.8	4%	0.035	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	149	179.9	68.3	0	0	0	0	113.3	L222 R223 H224 W249 T271	L222-S247 PolarHBondContact O-N 3.16Å; L222-S247 VanDerWaalsContact O-N 3.09Å; R223-S247 CarbonylContact C-O 3.58Å; R223-S247 VanDerWaalsContact CA-O 3.26Å; R223-S247 WeakPolarHBondContact CA-O 3.23Å; R223-S247 WeakPolarHBondContact CG-OG 3.32Å; H224-S247 PolarHBondContact N-O 3.23Å; S247-W249 VanDerWaalsContact O-CD1 3.25Å; S247-W249 PolarHBondContact O-N 3.29Å; S247-T271 CarbonylContact C-O 3.44Å; S247-T271 WeakPolarHBondContact CA-O 3.38Å; S247-T271 WeakPolarHBondContact CB-OG1 3.24Å
248	H	97.6	Very high	97.7	Very high	67 Å²	67	51 Å²	51	31%	0.31	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	58.2	46.9	179.4	-57.4	83.9	0	0	0	112.5	H224 P250 T271 H272	H224-H248 WeakPolarHBondContact CA-O 3.36Å; H224-H248 HydrophobicContact CB-CB 4.5Å; H224-H248 VanDerWaalsContact CD2-CB 3.42Å; H224-H248 WeakPolarHBondContact CD2-CB 3.33Å; H224-H248 AromaticContact CD2-CG 3.77Å; H224-H248 AromaticContact CE1-CG 3.94Å; H224-H248 AromaticContact CE1-ND1 3.9Å; H224-H248 PolarHBondContact N-O 3.07Å; H224-H248 AromaticContact NE2-CD2 3.68Å; H224-H248 AromaticContact NE2-CG 3.45Å; H224-H248 AromaticContact NE2-ND1 3.83Å; H248-P250 WeakPolarHBondContact O-CD 3.22Å; H248-T271 PolarHBondContact N-O 3.45Å; H248-H272 CarbonylContact C-O 3.11Å; H248-H272 WeakPolarHBondContact CA-O 3.19Å; H248-H272 AromaticContact CE1-CG 3.96Å; H248-H272 AromaticContact CE1-ND1 3.79Å; H248-H272 PolarHBondContact N-O 3.29Å; H248-H272 AromaticContact NE2-CD2 3.86Å; H248-H272 AromaticContact NE2-CG 3.69Å; H248-H272 AromaticContact NE2-ND1 3.91Å
249	W	97.4	Very high	97.8	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	84.6	169.4	-68	20.2	0	0	0	108	I206 L222 L225 I227 I230 I246 S247 Y251 L252 H272 C273	I206-W249 HydrophobicContact CD1-CH2 3.93Å; I206-W249 HydrophobicContact CD1-CZ3 4.41Å; I206-W249 HydrophobicContact CG1-CH2 3.85Å; I206-W249 HydrophobicContact CG1-CZ3 4.48Å; L222-W249 HydrophobicContact CB-CZ2 3.52Å; L222-W249 HydrophobicContact CD1-CH2 4.01Å; L222-W249 HydrophobicContact CD1-CZ2 3.77Å; L222-W249 HydrophobicContact CG-CZ2 4.3Å; L222-W249 PolarHBondContact O-NE1 3.09Å; L222-W249 VanDerWaalsContact O-NE1 3.07Å; L225-W249 HydrophobicContact CB-CD2 4.19Å; L225-W249 HydrophobicContact CB-CG 4.34Å; L225-W249 HydrophobicContact CB-CZ2 4.2Å; L225-W249 HydrophobicContact CD1-CH2 4.46Å; L225-W249 HydrophobicContact CD1-CZ2 3.61Å; L225-W249 HydrophobicContact CG-CZ2 4.18Å; L225-W249 WeakPolarHBondContact O-CA 3.41Å; I227-W249 HydrophobicContact CB-CD2 4.44Å; I227-W249 HydrophobicContact CB-CE3 3.73Å; I227-W249 HydrophobicContact CB-CH2 4.31Å; I227-W249 HydrophobicContact CB-CZ3 3.66Å; I227-W249 HydrophobicContact CD1-CH2 3.8Å; I227-W249 HydrophobicContact CD1-CZ2 4.23Å; I227-W249 HydrophobicContact CD1-CZ3 4.04Å; I227-W249 HydrophobicContact CG1-CZ3 4.44Å; I227-W249 HydrophobicContact CG2-CE3 4.14Å; I227-W249 HydrophobicContact CG2-CZ3 3.72Å; I230-W249 HydrophobicContact CD1-CZ3 3.98Å; I230-W249 HydrophobicContact CG1-CZ3 3.83Å; I246-W249 HydrophobicContact CG1-CZ2 4.37Å; I246-W249 HydrophobicContact CG2-CD2 3.63Å; I246-W249 HydrophobicContact CG2-CE3 4Å; I246-W249 HydrophobicContact CG2-CG 3.97Å; I246-W249 HydrophobicContact CG2-CH2 4.33Å; I246-W249 HydrophobicContact CG2-CZ2 4Å; I246-W249 HydrophobicContact CG2-CZ3 4.34Å; S247-W249 VanDerWaalsContact O-CD1 3.25Å; S247-W249 PolarHBondContact O-N 3.29Å; W249-Y251 PolarHBondContact O-N 3.39Å; W249-L252 HydrophobicContact CB-CB 3.66Å; W249-L252 HydrophobicContact CB-CD2 4.37Å; W249-L252 HydrophobicContact CD2-CD2 4.45Å; W249-L252 HydrophobicContact CE3-CB 4.16Å; W249-L252 HydrophobicContact CE3-CD1 4.29Å; W249-L252 HydrophobicContact CE3-CD2 3.82Å; W249-L252 HydrophobicContact CE3-CG 4.3Å; W249-L252 HydrophobicContact CZ3-CD2 4.44Å; W249-L252 WeakPolarHBondContact O-CB 3.41Å; W249-L252 PolarHBondContact O-N 3.43Å; W249-H272 PolarHBondContact N-O 2.91Å; W249-C273 WeakPolarHBondContact O-CA 3.36Å
250	P	96.4	Very high	98	Very high	71 Å²	71	43.3 Å²	43.3	46%	0.461	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-19.6	-168	27	-36.6	0	0	0	113.4	H248 N274	H248-P250 WeakPolarHBondContact O-CD 3.22Å; P250-N274 WeakPolarHBondContact O-CB 3.49Å
251	Y	96.8	Very high	97.9	Very high	140 Å²	140	41.9 Å²	41.9	55%	0.549	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-6.9	178.4	-53.8	-65	0	0	0	113.4	N226 N228 W249 D253	N226-Y251 HydrophobicContact CB-CD2 4.31Å; N226-Y251 HydrophobicContact CB-CE2 4.39Å; N228-Y251 VanDerWaalsContact CA-O 3.24Å; N228-Y251 WeakPolarHBondContact CA-O 3.41Å; N228-Y251 VanDerWaalsContact CB-O 3.31Å; N228-Y251 WeakPolarHBondContact CB-O 3.37Å; W249-Y251 PolarHBondContact O-N 3.39Å; Y251-D253 PolarHBondContact O-N 2.99Å; Y251-D253 VanDerWaalsContact O-N 3.09Å
252	L	97.9	Very high	97.8	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.234	C	C	.	.			trans	-72.1	104.7	-176.8	177.3	64.3	0	0	0	110.5	N228 I230 I246 W249 I270 C273 N274 L275	N228-L252 WeakPolarHBondContact O-CA 3.2Å; I230-L252 HydrophobicContact CD1-CD1 4.15Å; I230-L252 HydrophobicContact CD1-CD2 3.99Å; I230-L252 HydrophobicContact CG1-CD1 3.8Å; I246-L252 HydrophobicContact CG2-CD2 3.99Å; W249-L252 HydrophobicContact CB-CB 3.66Å; W249-L252 HydrophobicContact CB-CD2 4.37Å; W249-L252 HydrophobicContact CD2-CD2 4.45Å; W249-L252 HydrophobicContact CE3-CB 4.16Å; W249-L252 HydrophobicContact CE3-CD1 4.29Å; W249-L252 HydrophobicContact CE3-CD2 3.82Å; W249-L252 HydrophobicContact CE3-CG 4.3Å; W249-L252 HydrophobicContact CZ3-CD2 4.44Å; W249-L252 WeakPolarHBondContact O-CB 3.41Å; W249-L252 PolarHBondContact O-N 3.43Å; L252-I270 HydrophobicContact CD2-CG2 4.07Å; L252-C273 HydrophobicContact CB-CB 4.16Å; L252-C273 HydrophobicContact CD2-CB 4.23Å; L252-C273 HydrophobicContact CG-CB 4.48Å; L252-N274 CarbonylContact O-C 3.52Å; L252-N274 VanDerWaalsContact O-CA 3.25Å; L252-N274 WeakPolarHBondContact O-CA 3.31Å; L252-N274 WeakPolarHBondContact O-CB 3.28Å; L252-N274 PolarHBondContact O-N 2.92Å; L252-L275 HydrophobicContact CG-CD2 4.26Å; L252-L275 PolarHBondContact O-N 3.02Å
253	D	97	Very high	97.7	Very high	77 Å²	77	41.1 Å²	41.1	41%	0.412	22%	0.221	S	C	.	.			trans	-117	-19.4	178.3	65.1	-7.2	0	0	0	112.7	N228 Y251	N228-D253 PolarHBondContact O-N 2.88Å; N228-D253 VanDerWaalsContact O-OD1 3.05Å; Y251-D253 PolarHBondContact O-N 2.99Å; Y251-D253 VanDerWaalsContact O-N 3.09Å
254	T	96.8	Very high	97.6	Very high	67 Å²	67	42.1 Å²	42.1	41%	0.411	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	128.5	-168.7	45.6	0	0	0	0	112.9	N228 A229 I230	N228-T254 PolarHBondContact O-OG1 3.22Å; A229-T254 WeakPolarHBondContact CA-O 3.48Å; A229-T254 WeakPolarHBondContact CB-OG1 3.34Å; I230-T254 PolarHBondContact N-O 2.87Å
255	M	98.3	Very high	97.6	Very high	30 Å²	30	42.1 Å²	42.1	15%	0.148	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	118.2	171.2	-67.6	-176.8	76.6	0	0	109.3	I230 L260 I270 L275 P279 A282	I230-M255 HydrophobicContact CB-CG 4.39Å; I230-M255 HydrophobicContact CD1-CE 4.05Å; I230-M255 HydrophobicContact CD1-CG 4.29Å; M255-L260 HydrophobicContact CE-CD1 4.23Å; M255-L260 HydrophobicContact CE-CD2 4.32Å; M255-L260 HydrophobicContact CE-CG 4.29Å; M255-I270 HydrophobicContact CE-CD1 3.56Å; M255-I270 HydrophobicContact SD-CD1 3.54Å; M255-I270 VanDerWaalsContact SD-CD1 3.54Å; M255-L275 HydrophobicContact CG-CD2 4.32Å; M255-L275 HydrophobicContact SD-CD1 4.17Å; M255-P279 HydrophobicContact CB-CB 4.25Å; M255-P279 HydrophobicContact SD-CB 3.93Å; M255-P279 HydrophobicContact SD-CG 3.91Å; M255-A282 HydrophobicContact CB-CB 4.49Å
256	T	98.3	Very high	97.6	Very high	44 Å²	44	42.6 Å²	42.6	27%	0.27	23%	0.23	S	C	.	.			trans	-76.4	157	-179.4	61.5	0	0	0	0	111.5	I230 R231 D232 N258 C259	I230-T256 PolarHBondContact O-N 3.06Å; I230-T256 PolarHBondContact O-OG1 2.77Å; R231-T256 WeakPolarHBondContact CA-OG1 3.5Å; D232-T256 VanDerWaalsContact CG-OG1 3.31Å; D232-T256 PolarHBondContact N-OG1 3.24Å; D232-T256 WeakPolarHBondContact OD1-CB 3.19Å; D232-T256 PolarHBondContact OD1-OG1 3.26Å; T256-N258 VanDerWaalsContact C-N 3.29Å; T256-N258 PolarHBondContact O-N 3.48Å; T256-N258 VanDerWaalsContact O-N 3.15Å; T256-C259 VanDerWaalsContact O-CB 3.31Å; T256-C259 WeakPolarHBondContact O-CB 3.45Å; T256-C259 PolarHBondContact O-N 3.37Å; T256-C259 VanDerWaalsContact O-N 3.09Å; T256-C259 PolarHBondContact O-SG 3.06Å
257	P	98.2	Very high	97.6	Very high	53 Å²	53	43.6 Å²	43.6	34%	0.344	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-32.8	-172.3	-29.5	37.4	0	0	0	115.8	L281 A282	P257-L281 HydrophobicContact CB-CB 4.06Å; P257-L281 HydrophobicContact CG-CB 4.27Å; P257-L281 HydrophobicContact CG-CD1 4.16Å; P257-A282 WeakPolarHBondContact O-CA 3.48Å
258	N	98.4	Very high	97.7	Very high	45 Å²	45	43.4 Å²	43.4	24%	0.241	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.4	19.6	-178.5	-60.9	-36.2	0	0	0	111.9	D232 Y233 T256 L260 Y261	D232-N258 HydrophobicContact CB-CB 4.08Å; D232-N258 VanDerWaalsContact OD1-CA 3.32Å; D232-N258 WeakPolarHBondContact OD1-CA 3.39Å; D232-N258 WeakPolarHBondContact OD1-CB 3.42Å; D232-N258 PolarHBondContact OD1-N 3.28Å; Y233-N258 HydrophobicContact CE1-CB 4.17Å; Y233-N258 PolarHBondContact N-O 3.21Å; T256-N258 VanDerWaalsContact C-N 3.29Å; T256-N258 PolarHBondContact O-N 3.48Å; T256-N258 VanDerWaalsContact O-N 3.15Å; N258-L260 VanDerWaalsContact C-N 3.29Å; N258-L260 PolarHBondContact O-N 3.21Å; N258-Y261 WeakPolarHBondContact O-CB 3.21Å; N258-Y261 PolarHBondContact O-N 3.18Å; N258-Y261 VanDerWaalsContact O-N 3.15Å
259	C	98.3	Very high	97.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-32.9	-178.3	70.3	0	0	0	0	113.5	I230 R231 D232 T256	I230-C259 HydrophobicContact CB-CB 4.21Å; I230-C259 HydrophobicContact CG2-CB 3.64Å; I230-C259 VanDerWaalsContact O-CB 3.32Å; I230-C259 WeakPolarHBondContact O-CB 3.48Å; R231-C259 VanDerWaalsContact O-CA 3.24Å; R231-C259 WeakPolarHBondContact O-CA 3.41Å; R231-C259 VanDerWaalsContact O-CB 3.26Å; R231-C259 WeakPolarHBondContact O-CB 3.49Å; D232-C259 PolarHBondContact OD1-N 3.44Å; T256-C259 VanDerWaalsContact O-CB 3.31Å; T256-C259 WeakPolarHBondContact O-CB 3.45Å; T256-C259 PolarHBondContact O-N 3.37Å; T256-C259 VanDerWaalsContact O-N 3.09Å; T256-C259 PolarHBondContact O-SG 3.06Å
260	L	98.3	Very high	97.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	13.9	175.8	-54.7	-177.8	0	0	0	113	F235 L244 M255 N258 G262 L263 L268 V283 H285 L286	F235-L260 HydrophobicContact CD2-CD2 4.03Å; F235-L260 HydrophobicContact CE2-CD2 3.73Å; L244-L260 HydrophobicContact CD2-CD2 3.79Å; M255-L260 HydrophobicContact CE-CD1 4.23Å; M255-L260 HydrophobicContact CE-CD2 4.32Å; M255-L260 HydrophobicContact CE-CG 4.29Å; N258-L260 VanDerWaalsContact C-N 3.29Å; N258-L260 PolarHBondContact O-N 3.21Å; L260-G262 PolarHBondContact O-N 2.93Å; L260-L263 HydrophobicContact CB-CD1 4.39Å; L260-L263 HydrophobicContact CD2-CD1 4.17Å; L260-L263 WeakPolarHBondContact O-CB 3.4Å; L260-L263 PolarHBondContact O-N 2.79Å; L260-L268 HydrophobicContact CD1-CD2 3.95Å; L260-V283 HydrophobicContact CD1-CG1 4.3Å; L260-H285 PolarHBondContact O-CE1 3.27Å; L260-H285 PolarHBondContact O-NE2 3.44Å; L260-L286 HydrophobicContact CD1-CD1 4.1Å
261	Y	97	Very high	97.9	Very high	136 Å²	136	38.2 Å²	38.2	53%	0.533	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	138.1	-178.1	-174.4	-88.3	0	0	0	111.4	Y233 N258 L263	Y233-Y261 AromaticContact CD1-CD1 3.83Å; Y233-Y261 HydrophobicContact CD1-CD1 3.83Å; Y233-Y261 HydrophobicContact CD1-CG 4.09Å; Y233-Y261 AromaticContact CE1-CD1 3.8Å; Y233-Y261 HydrophobicContact CE1-CD1 3.8Å; Y233-Y261 HydrophobicContact CE1-CE1 4.41Å; Y233-Y261 AromaticContact CE1-CG 3.89Å; Y233-Y261 HydrophobicContact CE1-CG 3.89Å; N258-Y261 WeakPolarHBondContact O-CB 3.21Å; N258-Y261 PolarHBondContact O-N 3.18Å; N258-Y261 VanDerWaalsContact O-N 3.15Å; Y261-L263 VanDerWaalsContact C-N 3.27Å; Y261-L263 PolarHBondContact O-N 3.02Å
262	G	94.7	Very high	98	Very high	48 Å²	48	34.9 Å²	34.9	50%	0.495	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.5	-11	-177.5	0	0	0	0	0	114.6	L260	L260-G262 PolarHBondContact O-N 2.93Å
263	L	97.8	Very high	98	Very high	6 Å²	6	35.3 Å²	35.3	3%	0.031	20%	0.2	C	C	.	.			trans	-84.6	140.3	172	-58.9	-176.6	0	0	0	111.3	F235 L238 L241 L244 L260 Y261 L265 L286	F235-L263 HydrophobicContact CB-CD1 3.88Å; F235-L263 HydrophobicContact CB-CD2 3.81Å; F235-L263 HydrophobicContact CB-CG 3.93Å; F235-L263 HydrophobicContact CD2-CD1 3.78Å; F235-L263 HydrophobicContact CE2-CD1 4.46Å; F235-L263 HydrophobicContact CG-CD1 3.82Å; F235-L263 HydrophobicContact CG-CG 4.42Å; L238-L263 HydrophobicContact CB-CD2 3.99Å; L241-L263 HydrophobicContact CB-CD2 4.3Å; L241-L263 HydrophobicContact CD2-CD1 4.27Å; L241-L263 HydrophobicContact CD2-CD2 3.82Å; L244-L263 HydrophobicContact CD2-CD1 4.05Å; L260-L263 HydrophobicContact CB-CD1 4.39Å; L260-L263 HydrophobicContact CD2-CD1 4.17Å; L260-L263 WeakPolarHBondContact O-CB 3.4Å; L260-L263 PolarHBondContact O-N 2.79Å; Y261-L263 VanDerWaalsContact C-N 3.27Å; Y261-L263 PolarHBondContact O-N 3.02Å; L263-L265 HydrophobicContact CB-CD2 4.26Å; L263-L265 HydrophobicContact CB-CG 4.03Å; L263-L265 HydrophobicContact CD1-CD1 4.31Å; L263-L265 HydrophobicContact CD1-CD2 4.45Å; L263-L286 WeakPolarHBondContact O-CD2 3.44Å
264	N	97.1	Very high	98	Very high	60 Å²	60	35.1 Å²	35.1	32%	0.321	20%	0.199	S	C	.	.			trans	-125.7	71.6	174.9	-174.8	6	0	0	0	110.1	K242 Y288	K242-N264 PolarHBondContact NZ-O 3.19Å; N264-Y288 WeakPolarHBondContact OD1-CD2 3.25Å
265	L	98.6	Very high	98.1	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.181	C	C	.	.			trans	-78.4	154.2	-171.6	-56.8	177.5	0	0	0	112.7	L241 L244 L263 L268 L286 Y288 L289	L241-L265 HydrophobicContact CB-CD2 4.39Å; L241-L265 HydrophobicContact CD2-CD2 4.02Å; L241-L265 HydrophobicContact CG-CD2 4.04Å; L244-L265 HydrophobicContact CB-CD1 3.71Å; L244-L265 HydrophobicContact CB-CD2 4.08Å; L244-L265 HydrophobicContact CD2-CD1 4.18Å; L263-L265 HydrophobicContact CB-CD2 4.26Å; L263-L265 HydrophobicContact CB-CG 4.03Å; L263-L265 HydrophobicContact CD1-CD1 4.31Å; L263-L265 HydrophobicContact CD1-CD2 4.45Å; L265-L268 HydrophobicContact CD1-CB 4.33Å; L265-L268 HydrophobicContact CD1-CD1 4.04Å; L265-L286 HydrophobicContact CB-CD2 4.17Å; L265-L286 HydrophobicContact CD1-CD1 4.25Å; L265-L286 HydrophobicContact CD1-CD2 4.41Å; L265-L286 HydrophobicContact CG-CD2 4.18Å; L265-Y288 CarbonylContact O-C 3.56Å; L265-L289 HydrophobicContact CB-CD1 3.96Å; L265-L289 PolarHBondContact O-N 2.99Å
266	T	98.6	Very high	98	Very high	45 Å²	45	34.9 Å²	34.9	28%	0.276	20%	0.199	S	C	.	.	S	Bend	trans	-112.1	-23.8	168.7	57.2	0	0	0	0	112.2	K242 R290 F291	K242-T266 HydrophobicContact CD-CG2 4.06Å; K242-T266 PolarHBondContact O-N 3.12Å; K242-T266 PolarHBondContact O-OG1 3.43Å; K242-T266 VanDerWaalsContact O-OG1 3.07Å; T266-R290 PolarHBondContact O-N 3.13Å; T266-F291 PolarHBondContact O-N 3.4Å; T266-F291 VanDerWaalsContact O-N 3.13Å
267	S	98.9	Very high	98	Very high	22 Å²	22	34.8 Å²	34.8	15%	0.154	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	129.8	175.5	177.1	0	0	0	0	109.7	K242 V243 L244 F291	K242-S267 PolarHBondContact O-N 3.28Å; V243-S267 WeakPolarHBondContact CA-O 3.4Å; L244-S267 PolarHBondContact N-O 3.13Å; L244-S267 VanDerWaalsContact N-O 3.13Å; S267-F291 WeakPolarHBondContact CA-O 3.36Å; S267-F291 VanDerWaalsContact OG-CD1 3.24Å; S267-F291 WeakPolarHBondContact OG-CD1 3.42Å
268	L	98.9	Very high	98	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	124.1	175.7	176.4	62.3	0	0	0	108.6	L244 L260 L265 I270 V283 L286 L289 F291 L292 N293	L244-L268 HydrophobicContact CB-CD1 4.06Å; L244-L268 HydrophobicContact CD2-CD1 3.95Å; L244-L268 HydrophobicContact CG-CD1 4.11Å; L244-L268 WeakPolarHBondContact O-CA 3.37Å; L260-L268 HydrophobicContact CD1-CD2 3.95Å; L265-L268 HydrophobicContact CD1-CB 4.33Å; L265-L268 HydrophobicContact CD1-CD1 4.04Å; L268-I270 HydrophobicContact CD1-CD1 4.15Å; L268-I270 HydrophobicContact CD1-CG1 4.02Å; L268-I270 HydrophobicContact CD2-CD1 4.22Å; L268-I270 HydrophobicContact CG-CD1 4.27Å; L268-I270 HydrophobicContact CG-CG1 4.29Å; L268-V283 HydrophobicContact CD2-CG1 3.64Å; L268-L286 HydrophobicContact CD2-CD1 4.02Å; L268-L289 HydrophobicContact CB-CD1 3.77Å; L268-L289 HydrophobicContact CB-CD2 4.28Å; L268-F291 PolarHBondContact N-O 3.07Å; L268-L292 HydrophobicContact CB-CD1 4.27Å; L268-L292 HydrophobicContact CD2-CD1 4.07Å; L268-L292 HydrophobicContact CG-CD1 4.22Å; L268-L292 WeakPolarHBondContact O-CA 3.37Å; L268-N293 PolarHBondContact O-N 3.03Å
269	S	98.8	Very high	97.9	Very high	14 Å²	14	31.3 Å²	31.3	10%	0.098	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	124.8	173.6	-59.4	0	0	0	0	109.5	L244 I246 N293	L244-S269 PolarHBondContact O-N 3.02Å; I246-S269 PolarHBondContact N-O 3.42Å; S269-N293 CarbonylContact C-O 3.29Å; S269-N293 WeakPolarHBondContact CA-O 3.47Å
270	I	98.6	Very high	97.9	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	93.7	172.2	-52.8	166.5	0	0	0	106.4	I246 L252 M255 L268 C273 L275 N293 L294 N297	I246-I270 HydrophobicContact CB-CG1 4.39Å; I246-I270 HydrophobicContact CB-CG2 4.45Å; I246-I270 HydrophobicContact CD1-CG1 4.5Å; I246-I270 HydrophobicContact CG2-CG2 4.28Å; I246-I270 CarbonylContact O-C 3.27Å; I246-I270 WeakPolarHBondContact O-CA 3.47Å; L252-I270 HydrophobicContact CD2-CG2 4.07Å; M255-I270 HydrophobicContact CE-CD1 3.56Å; M255-I270 HydrophobicContact SD-CD1 3.54Å; M255-I270 VanDerWaalsContact SD-CD1 3.54Å; L268-I270 HydrophobicContact CD1-CD1 4.15Å; L268-I270 HydrophobicContact CD1-CG1 4.02Å; L268-I270 HydrophobicContact CD2-CD1 4.22Å; L268-I270 HydrophobicContact CG-CD1 4.27Å; L268-I270 HydrophobicContact CG-CG1 4.29Å; I270-C273 HydrophobicContact CG2-CB 4.36Å; I270-L275 HydrophobicContact CB-CD1 4.41Å; I270-L275 HydrophobicContact CG2-CD1 3.7Å; I270-N293 PolarHBondContact N-O 3.38Å; I270-L294 HydrophobicContact CB-CD2 3.95Å; I270-L294 HydrophobicContact CD1-CD2 4.36Å; I270-L294 WeakPolarHBondContact O-CA 3.41Å; I270-N297 PolarHBondContact O-ND2 3.45Å
271	T	98.6	Very high	97.9	Very high	15 Å²	15	36.6 Å²	36.6	9%	0.092	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	154.4	-167.7	60	0	0	0	0	112.3	I246 S247 H248 C273 N293 S295	I246-T271 PolarHBondContact O-N 3.12Å; S247-T271 CarbonylContact C-O 3.44Å; S247-T271 WeakPolarHBondContact CA-O 3.38Å; S247-T271 WeakPolarHBondContact CB-OG1 3.24Å; H248-T271 PolarHBondContact N-O 3.45Å; T271-C273 PolarHBondContact O-N 3.13Å; T271-C273 PolarHBondContact O-SG 3.37Å; T271-N293 HydrophobicContact CG2-CB 4.29Å; T271-N293 WeakPolarHBondContact CG2-OD1 3.46Å; T271-S295 WeakPolarHBondContact CA-O 3.31Å; T271-S295 VanDerWaalsContact CB-O 3.32Å; T271-S295 WeakPolarHBondContact CB-O 3.16Å
272	H	98.3	Very high	98	Very high	71 Å²	71	30.2 Å²	30.2	33%	0.329	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	52.4	45.1	-177.5	-57.1	86.5	0	0	0	111.6	H248 W249 S295 Y296	H248-H272 CarbonylContact C-O 3.11Å; H248-H272 WeakPolarHBondContact CA-O 3.19Å; H248-H272 AromaticContact CE1-CG 3.96Å; H248-H272 AromaticContact CE1-ND1 3.79Å; H248-H272 PolarHBondContact N-O 3.29Å; H248-H272 AromaticContact NE2-CD2 3.86Å; H248-H272 AromaticContact NE2-CG 3.69Å; H248-H272 AromaticContact NE2-ND1 3.91Å; W249-H272 PolarHBondContact N-O 2.91Å; H272-S295 PolarHBondContact N-O 2.81Å; H272-Y296 WeakPolarHBondContact CA-O 3.36Å; H272-Y296 AromaticContact CD2-CG 3.84Å; H272-Y296 AromaticContact CE1-CD2 3.17Å; H272-Y296 WeakPolarHBondContact CE1-CD2 3.31Å; H272-Y296 AromaticContact CE1-CE2 3.63Å; H272-Y296 AromaticContact CE1-CG 3.74Å; H272-Y296 PolarHBondContact N-O 2.02Å; H272-Y296 AromaticContact ND1-CD2 3.73Å; H272-Y296 AromaticContact NE2-CD2 3.4Å; H272-Y296 WeakPolarHBondContact NE2-CD2 3.24Å; H272-Y296 AromaticContact NE2-CE2 3.86Å; H272-Y296 AromaticContact NE2-CG 3.49Å
273	C	98.1	Very high	98.1	Very high	8 Å²	8	28 Å²	28	5%	0.054	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	-176.7	176.6	-59.6	0	0	0	0	109	W249 L252 I270 T271 Y296 N297 P298	W249-C273 WeakPolarHBondContact O-CA 3.36Å; L252-C273 HydrophobicContact CB-CB 4.16Å; L252-C273 HydrophobicContact CD2-CB 4.23Å; L252-C273 HydrophobicContact CG-CB 4.48Å; I270-C273 HydrophobicContact CG2-CB 4.36Å; T271-C273 PolarHBondContact O-N 3.13Å; T271-C273 PolarHBondContact O-SG 3.37Å; C273-Y296 PolarHBondContact N-O 3.07Å; C273-N297 WeakPolarHBondContact CA-OD1 3.41Å; C273-N297 WeakPolarHBondContact CB-OD1 3.43Å; C273-N297 PolarHBondContact N-OD1 2.81Å; C273-N297 PolarHBondContact O-OD1 2.87Å; C273-P298 WeakPolarHBondContact O-CD 3.15Å
274	N	97.9	Very high	98.1	Very high	73 Å²	73	33.8 Å²	33.8	39%	0.39	18%	0.183	S	C	.	.			trans	-108.6	32.6	-176.8	-161.1	33.8	0	0	0	112.5	P250 L252 T276 P298	P250-N274 WeakPolarHBondContact O-CB 3.49Å; L252-N274 CarbonylContact O-C 3.52Å; L252-N274 VanDerWaalsContact O-CA 3.25Å; L252-N274 WeakPolarHBondContact O-CA 3.31Å; L252-N274 WeakPolarHBondContact O-CB 3.28Å; L252-N274 PolarHBondContact O-N 2.92Å; N274-T276 PolarHBondContact O-N 2.82Å; N274-P298 WeakPolarHBondContact OD1-CG 3.24Å
275	L	97.9	Very high	98.1	Very high	5 Å²	5	33.9 Å²	33.9	3%	0.026	18%	0.182	C	C	.	.			trans	-71.9	121.2	178.2	-61.8	-178.4	0	0	0	110.6	L252 M255 I270 N297 P298 I299	L252-L275 HydrophobicContact CG-CD2 4.26Å; L252-L275 PolarHBondContact O-N 3.02Å; M255-L275 HydrophobicContact CG-CD2 4.32Å; M255-L275 HydrophobicContact SD-CD1 4.17Å; I270-L275 HydrophobicContact CB-CD1 4.41Å; I270-L275 HydrophobicContact CG2-CD1 3.7Å; L275-N297 HydrophobicContact CB-CB 4.21Å; L275-N297 WeakPolarHBondContact CB-OD1 3.39Å; L275-N297 PolarHBondContact N-OD1 3.08Å; L275-P298 CarbonylContact O-C 3.4Å; L275-P298 WeakPolarHBondContact O-CD 3.46Å; L275-P298 WeakPolarHBondContact O-CG 3.4Å; L275-I299 WeakPolarHBondContact O-CG1 3.22Å; L275-I299 PolarHBondContact O-N 3.38Å
276	T	96.9	Very high	98.1	Very high	87 Å²	87	33.9 Å²	33.9	53%	0.534	18%	0.182	S	C	.	.	S	Bend	trans	-87.6	-14.7	179.6	56.1	0	0	0	0	113.6	N274 P298 I299	N274-T276 PolarHBondContact O-N 2.82Å; T276-P298 WeakPolarHBondContact CA-O 3.39Å; T276-P298 HydrophobicContact CG2-CG 4.37Å; T276-I299 WeakPolarHBondContact O-CA 3.48Å
277	A	97.6	Very high	98	Very high	42 Å²	42	33.9 Å²	33.9	35%	0.347	18%	0.181	S	C	.	.	S	Bend	trans	-143	158	177.9	0	0	0	0	0	110.8
278	V	98.1	Very high	98	Very high	8 Å²	8	38 Å²	38	5%	0.048	19%	0.194	C	C	.	.			trans	-65.9	132.9	171.3	174.1	0	0	0	0	108.6	Y280 L294 I299 I302 L307	V278-Y280 HydrophobicContact CB-CD1 3.93Å; V278-Y280 HydrophobicContact CB-CE1 3.43Å; V278-Y280 VanDerWaalsContact CB-CE1 3.43Å; V278-Y280 HydrophobicContact CB-CE2 4.21Å; V278-Y280 HydrophobicContact CG1-CD1 3.57Å; V278-Y280 HydrophobicContact CG1-CE1 3.49Å; V278-Y280 VanDerWaalsContact CG1-CE1 3.49Å; V278-Y280 HydrophobicContact CG1-CG 4.33Å; V278-Y280 HydrophobicContact CG2-CE1 4.17Å; V278-Y280 WeakPolarHBondContact O-CD2 3.09Å; V278-Y280 WeakPolarHBondContact O-CE2 3.07Å; V278-Y280 PolarHBondContact O-N 3Å; V278-L294 HydrophobicContact CB-CD1 4.3Å; V278-L294 HydrophobicContact CG1-CD1 3.91Å; V278-L294 HydrophobicContact CG2-CD1 3.99Å; V278-I299 HydrophobicContact CG2-CD1 4.14Å; V278-I299 HydrophobicContact CG2-CG2 4.13Å; V278-I302 HydrophobicContact CG2-CG1 4.34Å; V278-L307 HydrophobicContact CG1-CD2 4.22Å
279	P	97.8	Very high	98	Very high	18 Å²	18	38 Å²	38	12%	0.117	19%	0.194	C	C	.	.			trans	-80.1	62.5	-176.6	33.9	-37.9	0	0	0	112.2	M255 L281 A282 V283	M255-P279 HydrophobicContact CB-CB 4.25Å; M255-P279 HydrophobicContact SD-CB 3.93Å; M255-P279 HydrophobicContact SD-CG 3.91Å; P279-L281 VanDerWaalsContact C-N 3.33Å; P279-L281 PolarHBondContact O-N 3.44Å; P279-A282 HydrophobicContact CB-CB 4.09Å; P279-A282 PolarHBondContact O-N 2.95Å; P279-V283 HydrophobicContact CG-CG1 4.31Å; P279-V283 PolarHBondContact O-N 2.72Å
280	Y	98.2	Very high	97.9	Very high	17 Å²	17	43.8 Å²	43.8	7%	0.067	21%	0.214	C	C	.	.	H	α-helix	trans	-50.9	-47.6	-171.9	-50.1	-70.6	0	0	0	113.2	V278 A282 V283 R284 E303 M306 L307	V278-Y280 HydrophobicContact CB-CD1 3.93Å; V278-Y280 HydrophobicContact CB-CE1 3.43Å; V278-Y280 VanDerWaalsContact CB-CE1 3.43Å; V278-Y280 HydrophobicContact CB-CE2 4.21Å; V278-Y280 HydrophobicContact CG1-CD1 3.57Å; V278-Y280 HydrophobicContact CG1-CE1 3.49Å; V278-Y280 VanDerWaalsContact CG1-CE1 3.49Å; V278-Y280 HydrophobicContact CG1-CG 4.33Å; V278-Y280 HydrophobicContact CG2-CE1 4.17Å; V278-Y280 WeakPolarHBondContact O-CD2 3.09Å; V278-Y280 WeakPolarHBondContact O-CE2 3.07Å; V278-Y280 PolarHBondContact O-N 3Å; Y280-A282 VanDerWaalsContact C-N 3.32Å; Y280-A282 PolarHBondContact O-N 3.19Å; Y280-V283 PolarHBondContact O-N 3.39Å; Y280-R284 PolarHBondContact O-N 2.81Å; Y280-R284 VanDerWaalsContact O-N 3.15Å; Y280-E303 HydrophobicContact CE2-CB 4.13Å; Y280-E303 HydrophobicContact CE2-CG 4.06Å; Y280-E303 PolarHBondContact OH-N 3.34Å; Y280-M306 HydrophobicContact CD1-CB 3.34Å; Y280-M306 HydrophobicContact CD1-CG 4.34Å; Y280-M306 HydrophobicContact CD2-CB 4.13Å; Y280-M306 HydrophobicContact CD2-CE 3.96Å; Y280-M306 HydrophobicContact CD2-CG 4.34Å; Y280-M306 HydrophobicContact CE1-CB 3.69Å; Y280-M306 HydrophobicContact CE1-CG 4.47Å; Y280-M306 HydrophobicContact CE2-CB 4.43Å; Y280-M306 HydrophobicContact CE2-CG 4.49Å; Y280-M306 HydrophobicContact CG-CB 3.6Å; Y280-M306 HydrophobicContact CG-CE 4.13Å; Y280-M306 HydrophobicContact CG-CG 4.28Å; Y280-L307 HydrophobicContact CD1-CD2 3.84Å; Y280-L307 HydrophobicContact CD1-CG 4.14Å; Y280-L307 HydrophobicContact CE1-CD2 4.44Å; Y280-L307 HydrophobicContact CE1-CG 4.39Å
281	L	97.9	Very high	98	Very high	93 Å²	93	46.2 Å²	46.2	49%	0.487	23%	0.225	S	C	.	.	H	α-helix	trans	-67.7	-31.5	-178.3	-64.7	178.3	0	0	0	113.1	P257 P279 R284	P257-L281 HydrophobicContact CB-CB 4.06Å; P257-L281 HydrophobicContact CG-CB 4.27Å; P257-L281 HydrophobicContact CG-CD1 4.16Å; P279-L281 VanDerWaalsContact C-N 3.33Å; P279-L281 PolarHBondContact O-N 3.44Å; L281-R284 WeakPolarHBondContact O-CG 3.02Å
282	A	98.3	Very high	98	Very high	2 Å²	2	45.7 Å²	45.7	2%	0.017	22%	0.221	C	C	.	.	H	α-helix	trans	-76.4	-27.5	-179.1	0	0	0	0	0	112.8	M255 P257 P279 Y280 H285	M255-A282 HydrophobicContact CB-CB 4.49Å; P257-A282 WeakPolarHBondContact O-CA 3.48Å; P279-A282 HydrophobicContact CB-CB 4.09Å; P279-A282 PolarHBondContact O-N 2.95Å; Y280-A282 VanDerWaalsContact C-N 3.32Å; Y280-A282 PolarHBondContact O-N 3.19Å; A282-H285 PolarHBondContact O-CE1 3.12Å; A282-H285 VanDerWaalsContact O-CE1 3.22Å
283	V	98.2	Very high	98	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.012	21%	0.214	C	C	.	.	H	α-helix	trans	-99.9	-12.9	-176.4	-58.8	0	0	0	0	113.7	L260 L268 P279 Y280 H285 L286 L307 L310	L260-V283 HydrophobicContact CD1-CG1 4.3Å; L268-V283 HydrophobicContact CD2-CG1 3.64Å; P279-V283 HydrophobicContact CG-CG1 4.31Å; P279-V283 PolarHBondContact O-N 2.72Å; Y280-V283 PolarHBondContact O-N 3.39Å; V283-H285 PolarHBondContact O-N 2.94Å; V283-L286 HydrophobicContact CB-CD1 4.09Å; V283-L286 HydrophobicContact CG1-CD1 4.22Å; V283-L286 VanDerWaalsContact O-CB 3.29Å; V283-L286 WeakPolarHBondContact O-CB 3.3Å; V283-L286 WeakPolarHBondContact O-CG 2.98Å; V283-L286 PolarHBondContact O-N 2.88Å; V283-L307 HydrophobicContact CG2-CD2 4.26Å; V283-L310 HydrophobicContact CG2-CD1 4.23Å; V283-L310 WeakPolarHBondContact O-CD2 3.25Å
284	R	97.2	Very high	98	Very high	128 Å²	128	43.6 Å²	43.6	48%	0.483	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-32.5	-172	70.4	-174.2	173.9	164.9	0.7	115.6	Y280 L281 L286 E309	Y280-R284 PolarHBondContact O-N 2.81Å; Y280-R284 VanDerWaalsContact O-N 3.15Å; L281-R284 WeakPolarHBondContact O-CG 3.02Å; R284-L286 VanDerWaalsContact C-N 3.33Å; R284-E309 VanDerWaalsContact O-CB 3.31Å; R284-E309 WeakPolarHBondContact O-CB 3.36Å
285	H	97.5	Very high	98.1	Very high	61 Å²	61	40.3 Å²	40.3	28%	0.282	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-6.4	-179.2	65	-78.2	0	0	0	113.8	L260 A282 V283 V287	L260-H285 PolarHBondContact O-CE1 3.27Å; L260-H285 PolarHBondContact O-NE2 3.44Å; A282-H285 PolarHBondContact O-CE1 3.12Å; A282-H285 VanDerWaalsContact O-CE1 3.22Å; V283-H285 PolarHBondContact O-N 2.94Å; H285-V287 PolarHBondContact O-N 2.81Å
286	L	97.9	Very high	98.1	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.214	C	C	.	.			trans	-79.6	57.1	-178.4	-57.1	176.4	0	0	0	111.3	L260 L263 L265 L268 V283 R284 Y288 L289 L310	L260-L286 HydrophobicContact CD1-CD1 4.1Å; L263-L286 WeakPolarHBondContact O-CD2 3.44Å; L265-L286 HydrophobicContact CB-CD2 4.17Å; L265-L286 HydrophobicContact CD1-CD1 4.25Å; L265-L286 HydrophobicContact CD1-CD2 4.41Å; L265-L286 HydrophobicContact CG-CD2 4.18Å; L268-L286 HydrophobicContact CD2-CD1 4.02Å; V283-L286 HydrophobicContact CB-CD1 4.09Å; V283-L286 HydrophobicContact CG1-CD1 4.22Å; V283-L286 VanDerWaalsContact O-CB 3.29Å; V283-L286 WeakPolarHBondContact O-CB 3.3Å; V283-L286 WeakPolarHBondContact O-CG 2.98Å; V283-L286 PolarHBondContact O-N 2.88Å; R284-L286 VanDerWaalsContact C-N 3.33Å; L286-Y288 PolarHBondContact O-N 2.89Å; L286-L289 HydrophobicContact CB-CB 4.02Å; L286-L289 HydrophobicContact CD1-CD1 4.38Å; L286-L289 HydrophobicContact CD1-CD2 4.4Å; L286-L289 WeakPolarHBondContact O-CB 3.14Å; L286-L289 PolarHBondContact O-N 2.89Å; L286-L310 HydrophobicContact CB-CD2 4.24Å; L286-L310 WeakPolarHBondContact O-CD2 3.41Å
287	V	96.9	Very high	98.1	Very high	45 Å²	45	41.3 Å²	41.3	27%	0.273	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-10	-175.9	-57.1	0	0	0	0	114.5	H285 R312	H285-V287 PolarHBondContact O-N 2.81Å; V287-R312 PolarHBondContact O-NH1 3.09Å
288	Y	98	Very high	98.1	Very high	108 Å²	108	40.7 Å²	40.7	42%	0.424	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	0.6	175.3	-67.3	-83.3	0	0	0	113.7	N264 L265 L286 R290	N264-Y288 WeakPolarHBondContact OD1-CD2 3.25Å; L265-Y288 CarbonylContact O-C 3.56Å; L286-Y288 PolarHBondContact O-N 2.89Å; Y288-R290 PolarHBondContact O-N 3.03Å
289	L	98.6	Very high	98.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	18%	0.179	C	C	.	.			trans	-62.6	130.2	178.6	-158.6	72	0	0	0	109.9	L265 L268 L286 L292 R312 L313	L265-L289 HydrophobicContact CB-CD1 3.96Å; L265-L289 PolarHBondContact O-N 2.99Å; L268-L289 HydrophobicContact CB-CD1 3.77Å; L268-L289 HydrophobicContact CB-CD2 4.28Å; L286-L289 HydrophobicContact CB-CB 4.02Å; L286-L289 HydrophobicContact CD1-CD1 4.38Å; L286-L289 HydrophobicContact CD1-CD2 4.4Å; L286-L289 WeakPolarHBondContact O-CB 3.14Å; L286-L289 PolarHBondContact O-N 2.89Å; L289-L292 HydrophobicContact CD2-CB 4.16Å; L289-L292 HydrophobicContact CD2-CD1 4.32Å; L289-R312 CarbonylContact O-C 3.57Å; L289-L313 HydrophobicContact CB-CD1 4.09Å; L289-L313 HydrophobicContact CD2-CD1 3.87Å; L289-L313 HydrophobicContact CG-CD1 3.86Å; L289-L313 VanDerWaalsContact O-CA 3.27Å; L289-L313 WeakPolarHBondContact O-CA 3.49Å; L289-L313 PolarHBondContact O-N 3Å; L289-L313 VanDerWaalsContact O-N 3.13Å
290	R	98.6	Very high	98.1	Very high	137 Å²	137	42.2 Å²	42.2	52%	0.517	19%	0.193	S	C	.	.			trans	-112	-33.6	177.4	-65.7	-177.5	-179.4	179.4	-1.2	111.7	T266 Y288 Q314 E315	T266-R290 PolarHBondContact O-N 3.13Å; Y288-R290 PolarHBondContact O-N 3.03Å; R290-Q314 WeakPolarHBondContact O-CA 3.43Å; R290-Q314 PolarHBondContact O-N 2.84Å; R290-E315 PolarHBondContact O-N 2.97Å
291	F	98.9	Very high	98.1	Very high	50 Å²	50	43.3 Å²	43.3	22%	0.219	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	126.3	-177.1	179.1	-89.1	0	0	0	110.2	T266 S267 L268 N293 E315 Q317	T266-F291 PolarHBondContact O-N 3.4Å; T266-F291 VanDerWaalsContact O-N 3.13Å; S267-F291 WeakPolarHBondContact CA-O 3.36Å; S267-F291 VanDerWaalsContact OG-CD1 3.24Å; S267-F291 WeakPolarHBondContact OG-CD1 3.42Å; L268-F291 PolarHBondContact N-O 3.07Å; F291-N293 HydrophobicContact CD1-CB 4.42Å; F291-N293 HydrophobicContact CE1-CB 3.5Å; F291-N293 VanDerWaalsContact CE1-CB 3.5Å; F291-N293 HydrophobicContact CZ-CB 3.78Å; F291-E315 HydrophobicContact CD2-CB 3.93Å; F291-E315 VanDerWaalsContact CD2-CD 3.48Å; F291-E315 HydrophobicContact CD2-CG 3.66Å; F291-E315 VanDerWaalsContact CE2-CD 3.47Å; F291-E315 HydrophobicContact CE2-CG 3.85Å; F291-E315 WeakPolarHBondContact CE2-OE1 3.49Å; F291-Q317 HydrophobicContact CE2-CG 3.97Å; F291-Q317 HydrophobicContact CZ-CG 4.14Å
292	L	98.8	Very high	98.1	Very high	4 Å²	4	39 Å²	39	2%	0.021	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	121.9	173.8	177.2	62.7	0	0	0	109.6	L268 L289 L294 L313 E315 I316 Q317	L268-L292 HydrophobicContact CB-CD1 4.27Å; L268-L292 HydrophobicContact CD2-CD1 4.07Å; L268-L292 HydrophobicContact CG-CD1 4.22Å; L268-L292 WeakPolarHBondContact O-CA 3.37Å; L289-L292 HydrophobicContact CD2-CB 4.16Å; L289-L292 HydrophobicContact CD2-CD1 4.32Å; L292-L294 HydrophobicContact CD1-CD1 4.37Å; L292-L294 HydrophobicContact CD1-CD2 4.18Å; L292-L294 HydrophobicContact CD1-CG 4.03Å; L292-L294 HydrophobicContact CD2-CD1 4.17Å; L292-L294 HydrophobicContact CG-CD1 4.32Å; L292-L294 HydrophobicContact CG-CG 4.15Å; L292-L313 HydrophobicContact CB-CD1 4.01Å; L292-L313 HydrophobicContact CB-CD2 4.38Å; L292-L313 HydrophobicContact CD2-CD2 4.47Å; L292-E315 PolarHBondContact N-O 3.23Å; L292-I316 WeakPolarHBondContact O-CA 3.48Å; L292-Q317 PolarHBondContact O-N 3.38Å
293	N	98.8	Very high	98.1	Very high	31 Å²	31	42.5 Å²	42.5	17%	0.166	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	115.9	175.3	-171.4	-5.2	0	0	0	110.8	L268 S269 I270 T271 F291 S295 Q317	L268-N293 PolarHBondContact O-N 3.03Å; S269-N293 CarbonylContact C-O 3.29Å; S269-N293 WeakPolarHBondContact CA-O 3.47Å; I270-N293 PolarHBondContact N-O 3.38Å; T271-N293 HydrophobicContact CG2-CB 4.29Å; T271-N293 WeakPolarHBondContact CG2-OD1 3.46Å; F291-N293 HydrophobicContact CD1-CB 4.42Å; F291-N293 HydrophobicContact CE1-CB 3.5Å; F291-N293 VanDerWaalsContact CE1-CB 3.5Å; F291-N293 HydrophobicContact CZ-CB 3.78Å; N293-S295 WeakPolarHBondContact OD1-CB 3.29Å; N293-S295 PolarHBondContact OD1-N 3.05Å; N293-S295 PolarHBondContact OD1-OG 2.83Å; N293-Q317 CarbonylContact C-O 3.17Å; N293-Q317 WeakPolarHBondContact CA-O 3.22Å; N293-Q317 HydrophobicContact CB-CB 4.03Å; N293-Q317 PolarHBondContact OD1-O 3.39Å
294	L	98.6	Very high	98	Very high	5 Å²	5	43.3 Å²	43.3	3%	0.026	20%	0.204	C	C	.	.			trans	-120	20.9	177	-61.9	175.9	0	0	0	111.5	I270 V278 L292 N297 I299 Q317 L318	I270-L294 HydrophobicContact CB-CD2 3.95Å; I270-L294 HydrophobicContact CD1-CD2 4.36Å; I270-L294 WeakPolarHBondContact O-CA 3.41Å; V278-L294 HydrophobicContact CB-CD1 4.3Å; V278-L294 HydrophobicContact CG1-CD1 3.91Å; V278-L294 HydrophobicContact CG2-CD1 3.99Å; L292-L294 HydrophobicContact CD1-CD1 4.37Å; L292-L294 HydrophobicContact CD1-CD2 4.18Å; L292-L294 HydrophobicContact CD1-CG 4.03Å; L292-L294 HydrophobicContact CD2-CD1 4.17Å; L292-L294 HydrophobicContact CG-CD1 4.32Å; L292-L294 HydrophobicContact CG-CG 4.15Å; L294-N297 PolarHBondContact O-ND2 3.34Å; L294-I299 HydrophobicContact CB-CD1 4.02Å; L294-I299 HydrophobicContact CD1-CD1 4.21Å; L294-Q317 PolarHBondContact N-O 2.99Å; L294-L318 HydrophobicContact CB-CG 4.24Å
295	S	98.6	Very high	97.9	Very high	4 Å²	4	39 Å²	39	3%	0.028	19%	0.194	C	C	.	.			trans	-59.4	149.1	-178.4	-55	0	0	0	0	112.4	T271 H272 N293 N297 Q317 V319	T271-S295 WeakPolarHBondContact CA-O 3.31Å; T271-S295 VanDerWaalsContact CB-O 3.32Å; T271-S295 WeakPolarHBondContact CB-O 3.16Å; H272-S295 PolarHBondContact N-O 2.81Å; N293-S295 WeakPolarHBondContact OD1-CB 3.29Å; N293-S295 PolarHBondContact OD1-N 3.05Å; N293-S295 PolarHBondContact OD1-OG 2.83Å; S295-N297 VanDerWaalsContact C-N 3.35Å; S295-N297 PolarHBondContact O-N 3.22Å; S295-N297 PolarHBondContact O-ND2 2.87Å; S295-Q317 PolarHBondContact N-O 2.97Å; S295-Q317 PolarHBondContact OG-O 2.81Å; S295-V319 CarbonylContact C-O 3.17Å; S295-V319 VanDerWaalsContact CA-O 3.28Å; S295-V319 WeakPolarHBondContact CA-O 3.46Å; S295-V319 WeakPolarHBondContact CB-O 3.48Å; S295-V319 PolarHBondContact OG-N 2.92Å
296	Y	98.3	Very high	97.9	Very high	110 Å²	110	39.7 Å²	39.7	43%	0.431	20%	0.198	S	C	.	.	S	Bend	trans	58.9	44.6	179.1	-46.1	-79.1	0	0	0	112.6	H272 C273 V319	H272-Y296 WeakPolarHBondContact CA-O 3.36Å; H272-Y296 AromaticContact CD2-CG 3.84Å; H272-Y296 AromaticContact CE1-CD2 3.17Å; H272-Y296 WeakPolarHBondContact CE1-CD2 3.31Å; H272-Y296 AromaticContact CE1-CE2 3.63Å; H272-Y296 AromaticContact CE1-CG 3.74Å; H272-Y296 PolarHBondContact N-O 2.02Å; H272-Y296 AromaticContact ND1-CD2 3.73Å; H272-Y296 AromaticContact NE2-CD2 3.4Å; H272-Y296 WeakPolarHBondContact NE2-CD2 3.24Å; H272-Y296 AromaticContact NE2-CE2 3.86Å; H272-Y296 AromaticContact NE2-CG 3.49Å; C273-Y296 PolarHBondContact N-O 3.07Å; Y296-V319 PolarHBondContact N-O 2.71Å
297	N	98.3	Very high	97.9	Very high	3 Å²	3	40 Å²	40	2%	0.016	20%	0.2	C	C	.	.	S	Bend	trans	-120.5	149	166.1	-72.5	-84.3	0	0	0	109.1	I270 C273 L275 L294 S295 I299 G321	I270-N297 PolarHBondContact O-ND2 3.45Å; C273-N297 WeakPolarHBondContact CA-OD1 3.41Å; C273-N297 WeakPolarHBondContact CB-OD1 3.43Å; C273-N297 PolarHBondContact N-OD1 2.81Å; C273-N297 PolarHBondContact O-OD1 2.87Å; L275-N297 HydrophobicContact CB-CB 4.21Å; L275-N297 WeakPolarHBondContact CB-OD1 3.39Å; L275-N297 PolarHBondContact N-OD1 3.08Å; L294-N297 PolarHBondContact O-ND2 3.34Å; S295-N297 VanDerWaalsContact C-N 3.35Å; S295-N297 PolarHBondContact O-N 3.22Å; S295-N297 PolarHBondContact O-ND2 2.87Å; N297-I299 HydrophobicContact CB-CD1 4.01Å; N297-I299 HydrophobicContact CB-CG1 3.88Å; N297-I299 PolarHBondContact O-N 3.24Å; N297-G321 VanDerWaalsContact O-CA 3.25Å; N297-G321 WeakPolarHBondContact O-CA 3.32Å
298	P	97.7	Very high	97.9	Very high	28 Å²	28	42 Å²	42	18%	0.182	21%	0.206	C	C	.	.			trans	-74.7	45.8	177.1	33.9	-37.8	0	0	0	113	C273 N274 L275 T276	C273-P298 WeakPolarHBondContact O-CD 3.15Å; N274-P298 WeakPolarHBondContact OD1-CG 3.24Å; L275-P298 CarbonylContact O-C 3.4Å; L275-P298 WeakPolarHBondContact O-CD 3.46Å; L275-P298 WeakPolarHBondContact O-CG 3.4Å; T276-P298 WeakPolarHBondContact CA-O 3.39Å; T276-P298 HydrophobicContact CG2-CG 4.37Å
299	I	98.1	Very high	97.9	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.206	C	C	.	.			trans	-76.8	123.8	176.6	-61.6	172.7	0	0	0	108.6	L275 T276 V278 L294 N297 L318 Q322 L323	L275-I299 WeakPolarHBondContact O-CG1 3.22Å; L275-I299 PolarHBondContact O-N 3.38Å; T276-I299 WeakPolarHBondContact O-CA 3.48Å; V278-I299 HydrophobicContact CG2-CD1 4.14Å; V278-I299 HydrophobicContact CG2-CG2 4.13Å; L294-I299 HydrophobicContact CB-CD1 4.02Å; L294-I299 HydrophobicContact CD1-CD1 4.21Å; N297-I299 HydrophobicContact CB-CD1 4.01Å; N297-I299 HydrophobicContact CB-CG1 3.88Å; N297-I299 PolarHBondContact O-N 3.24Å; I299-L318 HydrophobicContact CB-CD2 4.48Å; I299-L318 HydrophobicContact CD1-CD1 4.37Å; I299-L318 HydrophobicContact CG2-CD1 4.44Å; I299-Q322 CarbonylContact O-C 3.1Å; I299-Q322 PolarHBondContact O-N 2.72Å; I299-L323 WeakPolarHBondContact O-CA 3.28Å; I299-L323 PolarHBondContact O-N 3.38Å
300	S	97.1	Very high	97.8	Very high	58 Å²	58	41.2 Å²	41.2	41%	0.406	21%	0.206	S	C	.	.			trans	-98.4	-26.5	-176.8	57.8	0	0	0	0	114.5	Q322 A324	S300-Q322 WeakPolarHBondContact CA-O 3.49Å; S300-A324 PolarHBondContact O-N 2.61Å
301	T	97.8	Very high	97.7	Very high	40 Å²	40	38.8 Å²	38.8	25%	0.245	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	146.2	-177.7	-175.1	0	0	0	0	112	E303 M325	T301-E303 HydrophobicContact CG2-CG 4.49Å; T301-M325 WeakPolarHBondContact CA-O 3.43Å
302	I	98.3	Very high	97.6	Very high	4 Å²	4	40.9 Å²	40.9	2%	0.021	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	116.4	163	-58.9	173.6	0	0	0	107.5	V278 L318 L323 M325 V326 E327 A330 F331	V278-I302 HydrophobicContact CG2-CG1 4.34Å; I302-L318 HydrophobicContact CD1-CD1 3.87Å; I302-L318 HydrophobicContact CG1-CD1 4.18Å; I302-L323 HydrophobicContact CD1-CD1 4.34Å; I302-L323 HydrophobicContact CD1-CD2 4.06Å; I302-L323 HydrophobicContact CG1-CD1 3.79Å; I302-L323 HydrophobicContact CG1-CD2 4.43Å; I302-M325 PolarHBondContact N-O 3.27Å; I302-V326 HydrophobicContact CB-CG1 4.29Å; I302-V326 HydrophobicContact CD1-CG2 4.14Å; I302-E327 WeakPolarHBondContact O-CB 3.23Å; I302-E327 PolarHBondContact O-N 2.88Å; I302-A330 HydrophobicContact CG2-CB 3.78Å; I302-F331 HydrophobicContact CD1-CE1 4.36Å; I302-F331 HydrophobicContact CD1-CZ 4.06Å; I302-F331 HydrophobicContact CG2-CE1 4.29Å
303	E	97.3	Very high	97.6	Very high	74 Å²	74	40.7 Å²	40.7	35%	0.346	21%	0.208	S	C	.	.			trans	-76.9	146.9	-175.2	-66.8	180	-172.3	0	0	112.7	Y280 T301 M306	Y280-E303 HydrophobicContact CE2-CB 4.13Å; Y280-E303 HydrophobicContact CE2-CG 4.06Å; Y280-E303 PolarHBondContact OH-N 3.34Å; T301-E303 HydrophobicContact CG2-CG 4.49Å; E303-M306 HydrophobicContact CB-CB 4.46Å; E303-M306 HydrophobicContact CB-CG 3.71Å
304	G	96.2	Very high	97.6	Very high	20 Å²	20	41.4 Å²	41.4	21%	0.206	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	135.4	179.7	0	0	0	0	0	113.4	M306 E327 P328	G304-M306 PolarHBondContact O-N 2.99Å; G304-M306 VanDerWaalsContact O-N 3.11Å; G304-E327 PolarHBondContact N-OE2 3.19Å; G304-P328 WeakPolarHBondContact CA-O 3.41Å
305	S	96.1	Very high	97.6	Very high	38 Å²	38	44 Å²	44	27%	0.266	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	61	14.5	172.6	-52.6	0	0	0	0	116.1	H308 Y329	S305-H308 PolarHBondContact O-ND1 3.08Å; S305-Y329 WeakPolarHBondContact CA-O 3.38Å; S305-Y329 PolarHBondContact N-O 3.18Å
306	M	97.9	Very high	97.6	Very high	74 Å²	74	44.1 Å²	44.1	37%	0.365	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-15.7	-177.1	-66.4	-61.6	-80.4	0	0	114.4	Y280 E303 G304	Y280-M306 HydrophobicContact CD1-CB 3.34Å; Y280-M306 HydrophobicContact CD1-CG 4.34Å; Y280-M306 HydrophobicContact CD2-CB 4.13Å; Y280-M306 HydrophobicContact CD2-CE 3.96Å; Y280-M306 HydrophobicContact CD2-CG 4.34Å; Y280-M306 HydrophobicContact CE1-CB 3.69Å; Y280-M306 HydrophobicContact CE1-CG 4.47Å; Y280-M306 HydrophobicContact CE2-CB 4.43Å; Y280-M306 HydrophobicContact CE2-CG 4.49Å; Y280-M306 HydrophobicContact CG-CB 3.6Å; Y280-M306 HydrophobicContact CG-CE 4.13Å; Y280-M306 HydrophobicContact CG-CG 4.28Å; E303-M306 HydrophobicContact CB-CB 4.46Å; E303-M306 HydrophobicContact CB-CG 3.71Å; G304-M306 PolarHBondContact O-N 2.99Å; G304-M306 VanDerWaalsContact O-N 3.11Å
307	L	97.8	Very high	97.6	Very high	7 Å²	7	40.2 Å²	40.2	4%	0.037	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	9	-178.1	-63.7	173.9	0	0	0	114.2	V278 Y280 V283 E309 L310 F331 L334	V278-L307 HydrophobicContact CG1-CD2 4.22Å; Y280-L307 HydrophobicContact CD1-CD2 3.84Å; Y280-L307 HydrophobicContact CD1-CG 4.14Å; Y280-L307 HydrophobicContact CE1-CD2 4.44Å; Y280-L307 HydrophobicContact CE1-CG 4.39Å; V283-L307 HydrophobicContact CG2-CD2 4.26Å; L307-E309 PolarHBondContact O-N 3.06Å; L307-L310 HydrophobicContact CB-CD1 4.39Å; L307-L310 HydrophobicContact CD2-CD1 3.83Å; L307-L310 WeakPolarHBondContact O-CB 3.24Å; L307-L310 PolarHBondContact O-N 3.02Å; L307-F331 HydrophobicContact CD1-CD1 4.34Å; L307-F331 HydrophobicContact CD1-CE1 4.38Å; L307-L334 HydrophobicContact CB-CD1 4.09Å; L307-L334 VanDerWaalsContact O-CD1 3.23Å; L307-L334 WeakPolarHBondContact O-CD1 3.36Å
308	H	96.9	Very high	97.6	Very high	87 Å²	87	40.1 Å²	40.1	40%	0.403	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-22.7	-168.5	65.2	-86.1	0	0	0	115.9	S305 L310 L311 R332	S305-H308 PolarHBondContact O-ND1 3.08Å; H308-L310 VanDerWaalsContact C-N 3.29Å; H308-L310 PolarHBondContact O-N 3.28Å; H308-L311 WeakPolarHBondContact O-CD2 3.34Å; H308-R332 WeakPolarHBondContact CA-O 3.38Å; H308-R332 VanDerWaalsContact CB-O 3.24Å; H308-R332 WeakPolarHBondContact CB-O 3.31Å
309	E	96.7	Very high	97.6	Very high	91 Å²	91	39.9 Å²	39.9	43%	0.425	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-15.1	176.8	-64.8	-66.8	172.5	0	0	113.2	R284 L307 L311	R284-E309 VanDerWaalsContact O-CB 3.31Å; R284-E309 WeakPolarHBondContact O-CB 3.36Å; L307-E309 PolarHBondContact O-N 3.06Å; E309-L311 PolarHBondContact O-N 3.37Å
310	L	97.5	Very high	97.5	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	22%	0.221	C	C	.	.			trans	-82.5	59.6	-179.1	-55.6	-175.9	0	0	0	111.4	V283 L286 L307 H308 R312 L313	V283-L310 HydrophobicContact CG2-CD1 4.23Å; V283-L310 WeakPolarHBondContact O-CD2 3.25Å; L286-L310 HydrophobicContact CB-CD2 4.24Å; L286-L310 WeakPolarHBondContact O-CD2 3.41Å; L307-L310 HydrophobicContact CB-CD1 4.39Å; L307-L310 HydrophobicContact CD2-CD1 3.83Å; L307-L310 WeakPolarHBondContact O-CB 3.24Å; L307-L310 PolarHBondContact O-N 3.02Å; H308-L310 VanDerWaalsContact C-N 3.29Å; H308-L310 PolarHBondContact O-N 3.28Å; L310-R312 PolarHBondContact O-N 3.18Å; L310-L313 HydrophobicContact CB-CB 4.13Å; L310-L313 HydrophobicContact CB-CD2 4.36Å; L310-L313 HydrophobicContact CD1-CD2 4.01Å; L310-L313 WeakPolarHBondContact O-CB 3.27Å; L310-L313 PolarHBondContact O-N 2.98Å; L310-L313 VanDerWaalsContact O-N 3.07Å
311	L	96.3	Very high	97.3	Very high	86 Å²	86	39.3 Å²	39.3	45%	0.45	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-23.2	-168.3	-58.5	177.6	0	0	0	114.7	H308 E309 Y336	H308-L311 WeakPolarHBondContact O-CD2 3.34Å; E309-L311 PolarHBondContact O-N 3.37Å; L311-Y336 VanDerWaalsContact O-CD2 3.26Å; L311-Y336 WeakPolarHBondContact O-CD2 3.37Å
312	R	97.8	Very high	97.2	Very high	94 Å²	94	42.2 Å²	42.2	36%	0.355	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	7.2	-176.5	-65.7	-173.4	-179.9	80.1	-1.4	113.7	V287 L289 L310 Q314	V287-R312 PolarHBondContact O-NH1 3.09Å; L289-R312 CarbonylContact O-C 3.57Å; L310-R312 PolarHBondContact O-N 3.18Å; R312-Q314 WeakPolarHBondContact O-CG 3.37Å; R312-Q314 PolarHBondContact O-N 3.09Å
313	L	98.4	Very high	97.2	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.219	C	C	.	.			trans	-67.1	130.7	-177.2	-156.8	67.1	0	0	0	110.2	L289 L292 L310 I316 L334 Y336 L337	L289-L313 HydrophobicContact CB-CD1 4.09Å; L289-L313 HydrophobicContact CD2-CD1 3.87Å; L289-L313 HydrophobicContact CG-CD1 3.86Å; L289-L313 VanDerWaalsContact O-CA 3.27Å; L289-L313 WeakPolarHBondContact O-CA 3.49Å; L289-L313 PolarHBondContact O-N 3Å; L289-L313 VanDerWaalsContact O-N 3.13Å; L292-L313 HydrophobicContact CB-CD1 4.01Å; L292-L313 HydrophobicContact CB-CD2 4.38Å; L292-L313 HydrophobicContact CD2-CD2 4.47Å; L310-L313 HydrophobicContact CB-CB 4.13Å; L310-L313 HydrophobicContact CB-CD2 4.36Å; L310-L313 HydrophobicContact CD1-CD2 4.01Å; L310-L313 WeakPolarHBondContact O-CB 3.27Å; L310-L313 PolarHBondContact O-N 2.98Å; L310-L313 VanDerWaalsContact O-N 3.07Å; L313-I316 HydrophobicContact CD2-CD1 3.76Å; L313-I316 HydrophobicContact CD2-CG1 3.64Å; L313-I316 HydrophobicContact CG-CG1 4.25Å; L313-L334 HydrophobicContact CB-CD2 4.12Å; L313-L334 HydrophobicContact CB-CG 4.24Å; L313-L334 HydrophobicContact CD2-CD2 3.72Å; L313-L334 HydrophobicContact CG-CD2 4.43Å; L313-Y336 CarbonylContact O-C 3.54Å; L313-Y336 VanDerWaalsContact O-C 3.27Å; L313-L337 PolarHBondContact O-N 3.35Å
314	Q	98.4	Very high	97.2	Very high	46 Å²	46	40.7 Å²	40.7	22%	0.215	22%	0.221	C	C	.	.			trans	-118.9	-30.7	-174.8	-68.2	173.7	8.2	0	0	112.3	R290 R312 Y336 R338 V339	R290-Q314 WeakPolarHBondContact O-CA 3.43Å; R290-Q314 PolarHBondContact O-N 2.84Å; R312-Q314 WeakPolarHBondContact O-CG 3.37Å; R312-Q314 PolarHBondContact O-N 3.09Å; Q314-Y336 WeakPolarHBondContact CA-O 3.46Å; Q314-R338 PolarHBondContact O-N 3.29Å; Q314-V339 PolarHBondContact O-N 3.32Å
315	E	98.7	Very high	97.2	Very high	59 Å²	59	44.3 Å²	44.3	28%	0.276	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	128.4	-173.8	179	165.4	-178.5	0	0	110.9	R290 F291 L292 Q317 V339	R290-E315 PolarHBondContact O-N 2.97Å; F291-E315 HydrophobicContact CD2-CB 3.93Å; F291-E315 VanDerWaalsContact CD2-CD 3.48Å; F291-E315 HydrophobicContact CD2-CG 3.66Å; F291-E315 VanDerWaalsContact CE2-CD 3.47Å; F291-E315 HydrophobicContact CE2-CG 3.85Å; F291-E315 WeakPolarHBondContact CE2-OE1 3.49Å; L292-E315 PolarHBondContact N-O 3.23Å; E315-Q317 HydrophobicContact CG-CG 4.1Å; E315-Q317 PolarHBondContact OE1-NE2 3.1Å; E315-V339 WeakPolarHBondContact CA-O 3.32Å; E315-V339 HydrophobicContact CB-CB 4.09Å; E315-V339 HydrophobicContact CG-CB 3.84Å; E315-V339 HydrophobicContact CG-CG1 3.96Å
316	I	98.6	Very high	97.3	Very high	6 Å²	6	43 Å²	43	3%	0.031	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	120.9	173.5	-59.1	174	0	0	0	108.4	L292 L313 F331 L334 L337 V339 L340 N341	L292-I316 WeakPolarHBondContact O-CA 3.48Å; L313-I316 HydrophobicContact CD2-CD1 3.76Å; L313-I316 HydrophobicContact CD2-CG1 3.64Å; L313-I316 HydrophobicContact CG-CG1 4.25Å; I316-F331 HydrophobicContact CD1-CD1 3.71Å; I316-F331 HydrophobicContact CD1-CE1 3.48Å; I316-F331 VanDerWaalsContact CD1-CE1 3.48Å; I316-F331 HydrophobicContact CD1-CZ 4.27Å; I316-L334 HydrophobicContact CD1-CD2 3.95Å; I316-L337 HydrophobicContact CB-CD1 4.46Å; I316-L337 HydrophobicContact CD1-CD1 3.87Å; I316-L337 HydrophobicContact CD1-CD2 4.33Å; I316-L337 HydrophobicContact CG1-CD1 3.82Å; I316-V339 PolarHBondContact N-O 2.87Å; I316-L340 HydrophobicContact CB-CD1 3.98Å; I316-L340 HydrophobicContact CG2-CD1 4.09Å; I316-N341 PolarHBondContact O-N 2.91Å
317	Q	98.6	Very high	97.2	Very high	28 Å²	28	42 Å²	42	13%	0.131	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	116.8	176.4	-63.1	-75.3	-24.7	0	0	108.6	F291 L292 N293 L294 S295 E315 N341	F291-Q317 HydrophobicContact CE2-CG 3.97Å; F291-Q317 HydrophobicContact CZ-CG 4.14Å; L292-Q317 PolarHBondContact O-N 3.38Å; N293-Q317 CarbonylContact C-O 3.17Å; N293-Q317 WeakPolarHBondContact CA-O 3.22Å; N293-Q317 HydrophobicContact CB-CB 4.03Å; N293-Q317 PolarHBondContact OD1-O 3.39Å; L294-Q317 PolarHBondContact N-O 2.99Å; S295-Q317 PolarHBondContact N-O 2.97Å; S295-Q317 PolarHBondContact OG-O 2.81Å; E315-Q317 HydrophobicContact CG-CG 4.1Å; E315-Q317 PolarHBondContact OE1-NE2 3.1Å; Q317-N341 PolarHBondContact OE1-ND2 2.99Å
318	L	97.8	Very high	97.1	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.01	23%	0.23	C	C	.	.			trans	-138.6	58	178.5	-149.3	170.2	0	0	0	109.2	L294 I299 I302 N341 V342 N345	L294-L318 HydrophobicContact CB-CG 4.24Å; I299-L318 HydrophobicContact CB-CD2 4.48Å; I299-L318 HydrophobicContact CD1-CD1 4.37Å; I299-L318 HydrophobicContact CG2-CD1 4.44Å; I302-L318 HydrophobicContact CD1-CD1 3.87Å; I302-L318 HydrophobicContact CG1-CD1 4.18Å; L318-N341 PolarHBondContact N-O 2.81Å; L318-V342 HydrophobicContact CB-CG1 4.42Å; L318-N345 PolarHBondContact O-ND2 3.13Å
319	V	98.2	Very high	97.1	Very high	23 Å²	23	45.9 Å²	45.9	14%	0.139	24%	0.235	C	C	.	.			trans	-82.5	145.1	-176.3	-179.4	0	0	0	0	110.9	S295 Y296 G321 N341 S343	S295-V319 CarbonylContact C-O 3.17Å; S295-V319 VanDerWaalsContact CA-O 3.28Å; S295-V319 WeakPolarHBondContact CA-O 3.46Å; S295-V319 WeakPolarHBondContact CB-O 3.48Å; S295-V319 PolarHBondContact OG-N 2.92Å; Y296-V319 PolarHBondContact N-O 2.71Å; V319-G321 PolarHBondContact O-N 3.25Å; V319-N341 HydrophobicContact CG2-CB 4.3Å; V319-N341 VanDerWaalsContact CG2-CG 3.41Å; V319-N341 WeakPolarHBondContact CG2-ND2 3.41Å; V319-N341 WeakPolarHBondContact CG2-OD1 3.39Å; V319-S343 CarbonylContact C-O 3.19Å; V319-S343 VanDerWaalsContact CA-O 3.29Å; V319-S343 WeakPolarHBondContact CA-O 3.41Å
320	G	94.9	Very high	97.1	Very high	31 Å²	31	41.6 Å²	41.6	32%	0.32	22%	0.215	S	C	.	.	S	Bend	trans	65.5	35.8	166.6	0	0	0	0	0	114.2	S343 G344	G320-S343 PolarHBondContact N-O 2.81Å; G320-G344 VanDerWaalsContact CA-O 3.23Å; G320-G344 WeakPolarHBondContact CA-O 3.37Å; G320-G344 PolarHBondContact N-O 2.98Å
321	G	93.1	Very high	97.2	Very high	14 Å²	14	41.6 Å²	41.6	14%	0.144	22%	0.215	C	C	.	.	S	Bend	trans	-103.3	-148.1	179.1	0	0	0	0	0	112.8	N297 V319 G344 N345	N297-G321 VanDerWaalsContact O-CA 3.25Å; N297-G321 WeakPolarHBondContact O-CA 3.32Å; V319-G321 PolarHBondContact O-N 3.25Å; G321-G344 PolarHBondContact N-O 2.94Å; G321-N345 VanDerWaalsContact CA-OD1 3.23Å; G321-N345 WeakPolarHBondContact CA-OD1 3.29Å; G321-N345 PolarHBondContact N-OD1 3.13Å
322	Q	96.6	Very high	97.2	Very high	101 Å²	101	44 Å²	44	47%	0.472	22%	0.218	S	C	.	.			trans	-125.8	26.4	176.5	-65.2	-177.8	-6.9	0	0	111.5	I299 S300 A324 N345	I299-Q322 CarbonylContact O-C 3.1Å; I299-Q322 PolarHBondContact O-N 2.72Å; S300-Q322 WeakPolarHBondContact CA-O 3.49Å; Q322-A324 PolarHBondContact O-N 3.39Å; Q322-N345 PolarHBondContact N-OD1 3.39Å
323	L	97.9	Very high	97	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.208	C	C	.	.			trans	-67.3	111.8	-169.4	-173.9	67.4	0	0	0	110.4	I299 I302 M325 V326 V342 N345 Q346 L347	I299-L323 WeakPolarHBondContact O-CA 3.28Å; I299-L323 PolarHBondContact O-N 3.38Å; I302-L323 HydrophobicContact CD1-CD1 4.34Å; I302-L323 HydrophobicContact CD1-CD2 4.06Å; I302-L323 HydrophobicContact CG1-CD1 3.79Å; I302-L323 HydrophobicContact CG1-CD2 4.43Å; L323-M325 WeakPolarHBondContact CD1-O 3.44Å; L323-V326 HydrophobicContact CD2-CG2 3.77Å; L323-V326 HydrophobicContact CG-CG2 4.35Å; L323-V342 HydrophobicContact CD2-CB 4.38Å; L323-V342 HydrophobicContact CD2-CG1 3.95Å; L323-N345 HydrophobicContact CB-CB 3.87Å; L323-N345 VanDerWaalsContact CB-OD1 3.24Å; L323-N345 WeakPolarHBondContact CB-OD1 3.23Å; L323-N345 PolarHBondContact N-OD1 2.81Å; L323-Q346 CarbonylContact O-C 3.27Å; L323-Q346 WeakPolarHBondContact O-CA 3.39Å; L323-Q346 PolarHBondContact O-N 3.07Å; L323-L347 HydrophobicContact CD2-CD1 4.19Å; L323-L347 HydrophobicContact CD2-CD2 4.09Å; L323-L347 HydrophobicContact CD2-CG 4.35Å; L323-L347 HydrophobicContact CG-CD2 3.87Å; L323-L347 HydrophobicContact CG-CG 4.36Å; L323-L347 PolarHBondContact O-N 3.05Å; L323-L347 VanDerWaalsContact O-N 3.12Å
324	A	97	Very high	97	Very high	47 Å²	47	40.3 Å²	40.3	39%	0.388	21%	0.209	S	C	.	.			trans	-95	-32.9	-179.2	0	0	0	0	0	112.1	S300 Q322	S300-A324 PolarHBondContact O-N 2.61Å; Q322-A324 PolarHBondContact O-N 3.39Å
325	M	96.1	Very high	96.9	Very high	96 Å²	96	41.1 Å²	41.1	47%	0.473	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	139.1	-178.3	-173.8	172	-179.6	0	0	111.8	T301 I302 L323 E327	T301-M325 WeakPolarHBondContact CA-O 3.43Å; I302-M325 PolarHBondContact N-O 3.27Å; L323-M325 WeakPolarHBondContact CD1-O 3.44Å; M325-E327 HydrophobicContact CE-CG 4.28Å
326	V	98	Very high	96.8	Very high	9 Å²	9	45 Å²	45	6%	0.055	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	114.8	161.2	-178.5	0	0	0	0	106.5	I302 L323 A330 F331 L347 L350 V354	I302-V326 HydrophobicContact CB-CG1 4.29Å; I302-V326 HydrophobicContact CD1-CG2 4.14Å; L323-V326 HydrophobicContact CD2-CG2 3.77Å; L323-V326 HydrophobicContact CG-CG2 4.35Å; V326-A330 HydrophobicContact CG1-CB 3.54Å; V326-F331 HydrophobicContact CG1-CE2 4.09Å; V326-F331 HydrophobicContact CG1-CZ 4.25Å; V326-L347 HydrophobicContact CG2-CD2 4.08Å; V326-L350 HydrophobicContact CB-CD1 3.98Å; V326-L350 HydrophobicContact CG1-CD1 4.34Å; V326-L350 HydrophobicContact CG2-CD1 4.05Å; V326-V354 HydrophobicContact CB-CG1 4.22Å; V326-V354 HydrophobicContact CG1-CB 3.88Å; V326-V354 HydrophobicContact CG1-CG1 3.79Å; V326-V354 HydrophobicContact CG1-CG2 4.42Å
327	E	96.1	Very high	96.8	Very high	54 Å²	54	45 Å²	45	25%	0.252	23%	0.228	S	C	.	.			trans	-68.1	149.7	-176.5	-69.3	-165.6	145.2	0	0	111.9	I302 G304 M325 Y329 A330	I302-E327 WeakPolarHBondContact O-CB 3.23Å; I302-E327 PolarHBondContact O-N 2.88Å; G304-E327 PolarHBondContact N-OE2 3.19Å; M325-E327 HydrophobicContact CE-CG 4.28Å; E327-Y329 PolarHBondContact O-N 3.15Å; E327-A330 WeakPolarHBondContact O-CB 3.46Å; E327-A330 PolarHBondContact O-N 2.87Å
328	P	95.1	Very high	96.7	Very high	43 Å²	43	48.2 Å²	48.2	28%	0.279	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.2	139.7	168.9	-28.4	36.4	0	0	0	111.2	G304 A330 S353	G304-P328 WeakPolarHBondContact CA-O 3.41Å; P328-A330 PolarHBondContact O-N 3.03Å; P328-S353 WeakPolarHBondContact CB-OG 3.49Å
329	Y	97.2	Very high	96.8	Very high	133 Å²	133	49.3 Å²	49.3	52%	0.522	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.1	13.6	-176.4	-46.1	-67.9	0	0	0	115.7	S305 E327 F331 R332 S353	S305-Y329 WeakPolarHBondContact CA-O 3.38Å; S305-Y329 PolarHBondContact N-O 3.18Å; E327-Y329 PolarHBondContact O-N 3.15Å; Y329-F331 PolarHBondContact O-N 3.27Å; Y329-R332 WeakPolarHBondContact O-CB 3.36Å; Y329-R332 PolarHBondContact O-N 3.44Å; Y329-S353 WeakPolarHBondContact CA-O 3.36Å; Y329-S353 PolarHBondContact N-O 3.24Å
330	A	97.9	Very high	96.8	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.6	-44.1	175.5	0	0	0	0	0	113.4	I302 V326 E327 P328	I302-A330 HydrophobicContact CG2-CB 3.78Å; V326-A330 HydrophobicContact CG1-CB 3.54Å; E327-A330 WeakPolarHBondContact O-CB 3.46Å; E327-A330 PolarHBondContact O-N 2.87Å; P328-A330 PolarHBondContact O-N 3.03Å
331	F	97.9	Very high	96.9	Very high	1 Å²	1	47.7 Å²	47.7	0%	0.004	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-103.8	26.3	-179.3	-49.4	-53.6	0	0	0	112.7	I302 L307 I316 V326 Y329 G333 L334 L337 L340 V354 F355 H356	I302-F331 HydrophobicContact CD1-CE1 4.36Å; I302-F331 HydrophobicContact CD1-CZ 4.06Å; I302-F331 HydrophobicContact CG2-CE1 4.29Å; L307-F331 HydrophobicContact CD1-CD1 4.34Å; L307-F331 HydrophobicContact CD1-CE1 4.38Å; I316-F331 HydrophobicContact CD1-CD1 3.71Å; I316-F331 HydrophobicContact CD1-CE1 3.48Å; I316-F331 VanDerWaalsContact CD1-CE1 3.48Å; I316-F331 HydrophobicContact CD1-CZ 4.27Å; V326-F331 HydrophobicContact CG1-CE2 4.09Å; V326-F331 HydrophobicContact CG1-CZ 4.25Å; Y329-F331 PolarHBondContact O-N 3.27Å; F331-G333 PolarHBondContact O-N 3.39Å; F331-L334 HydrophobicContact CB-CB 4.33Å; F331-L334 HydrophobicContact CB-CD2 4.09Å; F331-L334 HydrophobicContact CD1-CD2 4.05Å; F331-L334 HydrophobicContact CG-CD2 4.45Å; F331-L334 WeakPolarHBondContact O-CB 3.19Å; F331-L334 PolarHBondContact O-N 3.33Å; F331-L334 VanDerWaalsContact O-N 3.11Å; F331-L337 HydrophobicContact CB-CD2 4.03Å; F331-L337 HydrophobicContact CD1-CD2 4.34Å; F331-L337 HydrophobicContact CD2-CD2 3.93Å; F331-L337 HydrophobicContact CG-CD2 3.83Å; F331-L340 HydrophobicContact CE2-CD1 4.24Å; F331-L340 HydrophobicContact CE2-CD2 3.81Å; F331-L340 HydrophobicContact CZ-CD1 3.91Å; F331-L340 HydrophobicContact CZ-CD2 4.27Å; F331-V354 WeakPolarHBondContact CA-O 3.47Å; F331-V354 WeakPolarHBondContact CB-O 3.44Å; F331-V354 HydrophobicContact CD2-CB 4.47Å; F331-V354 HydrophobicContact CD2-CG2 4.2Å; F331-V354 HydrophobicContact CE2-CG2 4.31Å; F331-V354 PolarHBondContact N-O 3.02Å; F331-F355 AromaticContact CD2-CD1 3.95Å; F331-F355 HydrophobicContact CD2-CD1 3.95Å; F331-F355 AromaticContact CD2-CE1 3.98Å; F331-F355 HydrophobicContact CD2-CE1 3.98Å; F331-F355 HydrophobicContact CE2-CE1 4.24Å; F331-H356 WeakPolarHBondContact O-CB 3.37Å
332	R	96.7	Very high	97.2	Very high	137 Å²	137	47 Å²	47	52%	0.517	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	130.7	174.2	-176.5	176.2	-176.5	175.8	2	110.1	H308 Y329 L334	H308-R332 WeakPolarHBondContact CA-O 3.38Å; H308-R332 VanDerWaalsContact CB-O 3.24Å; H308-R332 WeakPolarHBondContact CB-O 3.31Å; Y329-R332 WeakPolarHBondContact O-CB 3.36Å; Y329-R332 PolarHBondContact O-N 3.44Å; R332-L334 VanDerWaalsContact C-N 3.33Å
333	G	94.7	Very high	97.2	Very high	14 Å²	14	43 Å²	43	14%	0.144	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.6	-16.9	-178	0	0	0	0	0	114.5	F331 N335 H356	F331-G333 PolarHBondContact O-N 3.39Å; G333-N335 VanDerWaalsContact C-N 3.28Å; G333-N335 PolarHBondContact O-N 3.34Å; G333-H356 PolarHBondContact N-ND1 3.3Å
334	L	97.2	Very high	97.2	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.01	22%	0.219	C	C	.	.			trans	-81.3	75.7	178.4	-76.4	63.5	0	0	0	110.5	L307 L313 I316 F331 R332 Y336 L337	L307-L334 HydrophobicContact CB-CD1 4.09Å; L307-L334 VanDerWaalsContact O-CD1 3.23Å; L307-L334 WeakPolarHBondContact O-CD1 3.36Å; L313-L334 HydrophobicContact CB-CD2 4.12Å; L313-L334 HydrophobicContact CB-CG 4.24Å; L313-L334 HydrophobicContact CD2-CD2 3.72Å; L313-L334 HydrophobicContact CG-CD2 4.43Å; I316-L334 HydrophobicContact CD1-CD2 3.95Å; F331-L334 HydrophobicContact CB-CB 4.33Å; F331-L334 HydrophobicContact CB-CD2 4.09Å; F331-L334 HydrophobicContact CD1-CD2 4.05Å; F331-L334 HydrophobicContact CG-CD2 4.45Å; F331-L334 WeakPolarHBondContact O-CB 3.19Å; F331-L334 PolarHBondContact O-N 3.33Å; F331-L334 VanDerWaalsContact O-N 3.11Å; R332-L334 VanDerWaalsContact C-N 3.33Å; L334-Y336 VanDerWaalsContact C-N 3.25Å; L334-Y336 PolarHBondContact O-N 2.99Å; L334-L337 HydrophobicContact CB-CB 4.17Å; L334-L337 HydrophobicContact CD2-CD2 4.45Å
335	N	95.9	Very high	97.3	Very high	64 Å²	64	42.6 Å²	42.6	34%	0.342	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-29	-178.1	-91.1	-46.5	0	0	0	113.9	G333 H356 S357 N360	G333-N335 VanDerWaalsContact C-N 3.28Å; G333-N335 PolarHBondContact O-N 3.34Å; N335-H356 PolarHBondContact OD1-CD2 3.07Å; N335-H356 PolarHBondContact OD1-NE2 2.61Å; N335-S357 PolarHBondContact OD1-OG 3.29Å; N335-S357 VanDerWaalsContact OD1-OG 3.13Å; N335-N360 PolarHBondContact O-ND2 3.3Å
336	Y	97.3	Very high	97.4	Very high	139 Å²	139	43.4 Å²	43.4	55%	0.545	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	14.3	-172.8	-57.4	-81.9	0	0	0	113.5	L311 L313 Q314 L334 R338	L311-Y336 VanDerWaalsContact O-CD2 3.26Å; L311-Y336 WeakPolarHBondContact O-CD2 3.37Å; L313-Y336 CarbonylContact O-C 3.54Å; L313-Y336 VanDerWaalsContact O-C 3.27Å; Q314-Y336 WeakPolarHBondContact CA-O 3.46Å; L334-Y336 VanDerWaalsContact C-N 3.25Å; L334-Y336 PolarHBondContact O-N 2.99Å; Y336-R338 WeakPolarHBondContact O-CG 3.41Å; Y336-R338 PolarHBondContact O-N 2.93Å; Y336-R338 VanDerWaalsContact O-N 3.09Å
337	L	98.2	Very high	97.4	Very high	6 Å²	6	43 Å²	43	3%	0.031	20%	0.203	C	C	.	.			trans	-65.9	110.6	178.5	-174.8	64.9	0	0	0	109.9	L313 I316 F331 L334 F355	L313-L337 PolarHBondContact O-N 3.35Å; I316-L337 HydrophobicContact CB-CD1 4.46Å; I316-L337 HydrophobicContact CD1-CD1 3.87Å; I316-L337 HydrophobicContact CD1-CD2 4.33Å; I316-L337 HydrophobicContact CG1-CD1 3.82Å; F331-L337 HydrophobicContact CB-CD2 4.03Å; F331-L337 HydrophobicContact CD1-CD2 4.34Å; F331-L337 HydrophobicContact CD2-CD2 3.93Å; F331-L337 HydrophobicContact CG-CD2 3.83Å; L334-L337 HydrophobicContact CB-CB 4.17Å; L334-L337 HydrophobicContact CD2-CD2 4.45Å; L337-F355 HydrophobicContact CD2-CD1 4.03Å; L337-F355 HydrophobicContact CD2-CE1 4.03Å
338	R	97.9	Very high	97.4	Very high	97 Å²	97	43.7 Å²	43.7	37%	0.366	21%	0.211	S	C	.	.			trans	-104.3	-34.7	-178.3	-69.1	-177	-65.9	150.2	-0.7	112.4	Q314 Y336 E362 T363	Q314-R338 PolarHBondContact O-N 3.29Å; Y336-R338 WeakPolarHBondContact O-CG 3.41Å; Y336-R338 PolarHBondContact O-N 2.93Å; Y336-R338 VanDerWaalsContact O-N 3.09Å; R338-E362 HydrophobicContact CB-CB 4.5Å; R338-E362 HydrophobicContact CB-CG 4.42Å; R338-E362 WeakPolarHBondContact CD-OE1 3.43Å; R338-E362 HydrophobicContact CG-CG 4.46Å; R338-E362 IonicContact NH1-OE2 2.75Å; R338-E362 PolarHBondContact O-N 2.76Å; R338-T363 PolarHBondContact O-N 2.96Å
339	V	98.4	Very high	97.6	Very high	25 Å²	25	42.6 Å²	42.6	15%	0.152	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	121.2	-173.3	-176.8	0	0	0	0	109.8	Q314 E315 I316 T363	Q314-V339 PolarHBondContact O-N 3.32Å; E315-V339 WeakPolarHBondContact CA-O 3.32Å; E315-V339 HydrophobicContact CB-CB 4.09Å; E315-V339 HydrophobicContact CG-CB 3.84Å; E315-V339 HydrophobicContact CG-CG1 3.96Å; I316-V339 PolarHBondContact N-O 2.87Å; V339-T363 WeakPolarHBondContact CA-O 3.4Å; V339-T363 HydrophobicContact CG1-CG2 4.31Å
340	L	98.4	Very high	97.6	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	119.4	167.1	178.5	66.6	0	0	0	109.1	I316 F331 V342 L350 F355 L361 T363 L364 I365	I316-L340 HydrophobicContact CB-CD1 3.98Å; I316-L340 HydrophobicContact CG2-CD1 4.09Å; F331-L340 HydrophobicContact CE2-CD1 4.24Å; F331-L340 HydrophobicContact CE2-CD2 3.81Å; F331-L340 HydrophobicContact CZ-CD1 3.91Å; F331-L340 HydrophobicContact CZ-CD2 4.27Å; L340-V342 HydrophobicContact CD1-CG1 3.91Å; L340-V342 HydrophobicContact CG-CG1 4.14Å; L340-L350 HydrophobicContact CD2-CD2 4.24Å; L340-F355 HydrophobicContact CB-CE1 4.49Å; L340-F355 HydrophobicContact CD2-CE1 3.86Å; L340-F355 HydrophobicContact CD2-CZ 3.6Å; L340-L361 HydrophobicContact CB-CD1 4.4Å; L340-T363 PolarHBondContact N-O 3.36Å; L340-L364 HydrophobicContact CB-CD1 4.05Å; L340-L364 HydrophobicContact CD2-CD1 3.91Å; L340-L364 HydrophobicContact CG-CD1 4.19Å; L340-L364 WeakPolarHBondContact O-CA 3.36Å; L340-I365 PolarHBondContact O-N 3.27Å
341	N	98.3	Very high	97.5	Very high	20 Å²	20	39.5 Å²	39.5	11%	0.107	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	114.6	173.7	-174.1	0.1	0	0	0	110.1	I316 Q317 L318 V319 S343 I365	I316-N341 PolarHBondContact O-N 2.91Å; Q317-N341 PolarHBondContact OE1-ND2 2.99Å; L318-N341 PolarHBondContact N-O 2.81Å; V319-N341 HydrophobicContact CG2-CB 4.3Å; V319-N341 VanDerWaalsContact CG2-CG 3.41Å; V319-N341 WeakPolarHBondContact CG2-ND2 3.41Å; V319-N341 WeakPolarHBondContact CG2-OD1 3.39Å; N341-S343 VanDerWaalsContact OD1-CB 3.24Å; N341-S343 WeakPolarHBondContact OD1-CB 3.39Å; N341-S343 PolarHBondContact OD1-N 2.99Å; N341-S343 VanDerWaalsContact OD1-N 3.08Å; N341-I365 HydrophobicContact CB-CB 4.18Å; N341-I365 HydrophobicContact CB-CD1 4.42Å; N341-I365 WeakPolarHBondContact OD1-CB 3.32Å; N341-I365 WeakPolarHBondContact OD1-CG2 3.31Å
342	V	98.1	Very high	97.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.214	C	C	.	.			trans	-127	29.6	177.8	-68.4	0	0	0	0	110.2	L318 L323 L340 N345 L347 I365 L366 N369	L318-V342 HydrophobicContact CB-CG1 4.42Å; L323-V342 HydrophobicContact CD2-CB 4.38Å; L323-V342 HydrophobicContact CD2-CG1 3.95Å; L340-V342 HydrophobicContact CD1-CG1 3.91Å; L340-V342 HydrophobicContact CG-CG1 4.14Å; V342-N345 VanDerWaalsContact C-ND2 3.33Å; V342-N345 PolarHBondContact O-ND2 2.84Å; V342-L347 HydrophobicContact CB-CD1 3.94Å; V342-L347 HydrophobicContact CG2-CD1 3.58Å; V342-I365 WeakPolarHBondContact CG2-O 3.26Å; V342-I365 PolarHBondContact N-O 2.95Å; V342-L366 HydrophobicContact CG2-CD2 3.47Å; V342-L366 VanDerWaalsContact CG2-CD2 3.47Å; V342-L366 HydrophobicContact CG2-CG 4.35Å; V342-N369 PolarHBondContact O-ND2 3.21Å
343	S	97.9	Very high	97.4	Very high	17 Å²	17	39.1 Å²	39.1	12%	0.119	20%	0.202	C	C	.	.			trans	-55.2	142.1	175.9	-178	0	0	0	0	111.9	V319 G320 N341 N345 D367	V319-S343 CarbonylContact C-O 3.19Å; V319-S343 VanDerWaalsContact CA-O 3.29Å; V319-S343 WeakPolarHBondContact CA-O 3.41Å; G320-S343 PolarHBondContact N-O 2.81Å; N341-S343 VanDerWaalsContact OD1-CB 3.24Å; N341-S343 WeakPolarHBondContact OD1-CB 3.39Å; N341-S343 PolarHBondContact OD1-N 2.99Å; N341-S343 VanDerWaalsContact OD1-N 3.08Å; S343-N345 PolarHBondContact O-ND2 2.75Å; S343-D367 WeakPolarHBondContact CA-O 3.41Å; S343-D367 WeakPolarHBondContact CB-OD1 3.4Å; S343-D367 PolarHBondContact OG-OD1 3.25Å; S343-D367 PolarHBondContact OG-OD2 2.79Å; S343-D367 VanDerWaalsContact OG-OD2 3.13Å
344	G	97.7	Very high	97.6	Very high	28 Å²	28	38.4 Å²	38.4	29%	0.289	20%	0.195	S	C	.	.	S	Bend	trans	68.6	46.7	173.4	0	0	0	0	0	113.5	G320 G321 D367 S368	G320-G344 VanDerWaalsContact CA-O 3.23Å; G320-G344 WeakPolarHBondContact CA-O 3.37Å; G320-G344 PolarHBondContact N-O 2.98Å; G321-G344 PolarHBondContact N-O 2.94Å; G344-D367 PolarHBondContact N-O 3.49Å; G344-D367 VanDerWaalsContact N-O 3.16Å; G344-S368 WeakPolarHBondContact CA-O 3.34Å; G344-S368 PolarHBondContact N-O 3.34Å
345	N	98.4	Very high	97.6	Very high	10 Å²	10	39.1 Å²	39.1	5%	0.053	20%	0.198	C	C	.	.	S	Bend	trans	-123.9	-165.7	176.4	-78.1	-77.2	0	0	0	110.7	L318 G321 Q322 L323 V342 S343 L347 S368 N369	L318-N345 PolarHBondContact O-ND2 3.13Å; G321-N345 VanDerWaalsContact CA-OD1 3.23Å; G321-N345 WeakPolarHBondContact CA-OD1 3.29Å; G321-N345 PolarHBondContact N-OD1 3.13Å; Q322-N345 PolarHBondContact N-OD1 3.39Å; L323-N345 HydrophobicContact CB-CB 3.87Å; L323-N345 VanDerWaalsContact CB-OD1 3.24Å; L323-N345 WeakPolarHBondContact CB-OD1 3.23Å; L323-N345 PolarHBondContact N-OD1 2.81Å; V342-N345 VanDerWaalsContact C-ND2 3.33Å; V342-N345 PolarHBondContact O-ND2 2.84Å; S343-N345 PolarHBondContact O-ND2 2.75Å; N345-L347 HydrophobicContact CB-CG 4.47Å; N345-S368 PolarHBondContact N-O 3.35Å; N345-N369 VanDerWaalsContact CA-OD1 3.29Å; N345-N369 WeakPolarHBondContact CA-OD1 3.44Å; N345-N369 WeakPolarHBondContact CB-OD1 3.16Å; N345-N369 PolarHBondContact N-OD1 2.98Å; N345-N369 PolarHBondContact O-OD1 3.25Å
346	Q	97.8	Very high	97.6	Very high	113 Å²	113	40.3 Å²	40.3	53%	0.528	20%	0.202	S	C	.	.			trans	-112	26.2	-178.5	-59.6	-175.7	1.3	0	0	111.9	L323 T348 N369	L323-Q346 CarbonylContact O-C 3.27Å; L323-Q346 WeakPolarHBondContact O-CA 3.39Å; L323-Q346 PolarHBondContact O-N 3.07Å; Q346-T348 PolarHBondContact O-N 3Å; Q346-N369 PolarHBondContact N-OD1 3.38Å
347	L	98.1	Very high	97.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.187	C	C	.	.			trans	-68	129.4	-178	-67.4	172.9	0	0	0	110.7	L323 V326 V342 N345 L366 N369 P370	L323-L347 HydrophobicContact CD2-CD1 4.19Å; L323-L347 HydrophobicContact CD2-CD2 4.09Å; L323-L347 HydrophobicContact CD2-CG 4.35Å; L323-L347 HydrophobicContact CG-CD2 3.87Å; L323-L347 HydrophobicContact CG-CG 4.36Å; L323-L347 PolarHBondContact O-N 3.05Å; L323-L347 VanDerWaalsContact O-N 3.12Å; V326-L347 HydrophobicContact CG2-CD2 4.08Å; V342-L347 HydrophobicContact CB-CD1 3.94Å; V342-L347 HydrophobicContact CG2-CD1 3.58Å; N345-L347 HydrophobicContact CB-CG 4.47Å; L347-L366 HydrophobicContact CD1-CD2 4.12Å; L347-N369 HydrophobicContact CB-CB 4.25Å; L347-N369 VanDerWaalsContact CB-OD1 3.31Å; L347-N369 WeakPolarHBondContact CB-OD1 3.44Å; L347-N369 PolarHBondContact N-OD1 3.12Å; L347-P370 CarbonylContact O-C 3.4Å; L347-P370 WeakPolarHBondContact O-CD 3.19Å
348	T	97.4	Very high	97.1	Very high	69 Å²	69	35.8 Å²	35.8	42%	0.423	19%	0.19	S	C	.	.	S	Bend	trans	-89.9	-27.6	169.6	56.8	0	0	0	0	111.9	Q346 L371 A372	Q346-T348 PolarHBondContact O-N 3Å; T348-L371 CarbonylContact O-C 3.16Å; T348-A372 PolarHBondContact O-N 2.88Å
349	T	97.9	Very high	96.9	Very high	19 Å²	19	34.2 Å²	34.2	12%	0.117	20%	0.204	C	C	.	.			trans	-156	168.9	178.3	-165.5	0	0	0	0	110.5	E351 R376	T349-E351 HydrophobicContact CG2-CG 4.48Å; T349-R376 VanDerWaalsContact CG2-NH1 3.3Å; T349-R376 VanDerWaalsContact OG1-CB 3.3Å; T349-R376 WeakPolarHBondContact OG1-CB 3.47Å
350	L	97.9	Very high	96.7	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.005	22%	0.216	C	C	.	.			trans	-137.8	105.1	168.9	-173.2	70.1	0	0	0	108.1	V326 L340 V354 F355 L364 L366 L377 W379	V326-L350 HydrophobicContact CB-CD1 3.98Å; V326-L350 HydrophobicContact CG1-CD1 4.34Å; V326-L350 HydrophobicContact CG2-CD1 4.05Å; L340-L350 HydrophobicContact CD2-CD2 4.24Å; L350-V354 HydrophobicContact CD1-CG1 4.38Å; L350-V354 HydrophobicContact CD1-CG2 3.94Å; L350-V354 HydrophobicContact CG-CG2 4.28Å; L350-F355 HydrophobicContact CD2-CE2 3.88Å; L350-F355 HydrophobicContact CD2-CZ 3.94Å; L350-F355 HydrophobicContact CG-CE2 4.27Å; L350-L364 HydrophobicContact CD2-CD1 3.79Å; L350-L364 HydrophobicContact CD2-CD2 4.12Å; L350-L366 HydrophobicContact CB-CD2 4.4Å; L350-L366 HydrophobicContact CD2-CD1 4.1Å; L350-L366 HydrophobicContact CD2-CD2 4.11Å; L350-L377 HydrophobicContact CB-CD2 4.29Å; L350-W379 HydrophobicContact CD2-CZ2 4.2Å; L350-W379 HydrophobicContact CG-CZ2 4.34Å; L350-W379 PolarHBondContact O-NE1 3.2Å
351	E	96	Very high	96.6	Very high	67 Å²	67	37.1 Å²	37.1	31%	0.313	22%	0.219	S	C	.	.			trans	-72.2	149.8	-178.6	-61.9	-165.6	171.7	0	0	111.8	T349 S353 V354	T349-E351 HydrophobicContact CG2-CG 4.48Å; E351-S353 WeakPolarHBondContact CB-OG 3.44Å; E351-S353 PolarHBondContact O-N 2.84Å; E351-S353 PolarHBondContact OE2-OG 3.16Å; E351-V354 HydrophobicContact CB-CG1 4.29Å; E351-V354 WeakPolarHBondContact O-CG1 3.39Å; E351-V354 WeakPolarHBondContact O-CG2 3.39Å; E351-V354 PolarHBondContact O-N 3.29Å
352	E	96.5	Very high	96.5	Very high	91 Å²	91	40.6 Å²	40.6	43%	0.425	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-63.2	-31.3	176.5	-169.3	170.3	-168.3	0	0	111.8	V354 F355 V358 W379	E352-V354 PolarHBondContact O-N 2.83Å; E352-V354 VanDerWaalsContact O-N 3.16Å; E352-F355 PolarHBondContact O-N 3.18Å; E352-V358 HydrophobicContact CG-CG1 4.46Å; E352-V358 HydrophobicContact CG-CG2 3.55Å; E352-W379 HydrophobicContact CB-CB 4.49Å; E352-W379 HydrophobicContact CB-CD2 4.08Å; E352-W379 HydrophobicContact CB-CG 3.88Å; E352-W379 HydrophobicContact CG-CD2 4.21Å; E352-W379 HydrophobicContact CG-CG 4.23Å
353	S	96.1	Very high	96.5	Very high	39 Å²	39	41.8 Å²	41.8	27%	0.273	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-63.3	-16.8	-178.7	63.1	0	0	0	0	114.2	P328 Y329 E351 F355	P328-S353 WeakPolarHBondContact CB-OG 3.49Å; Y329-S353 WeakPolarHBondContact CA-O 3.36Å; Y329-S353 PolarHBondContact N-O 3.24Å; E351-S353 WeakPolarHBondContact CB-OG 3.44Å; E351-S353 PolarHBondContact O-N 2.84Å; E351-S353 PolarHBondContact OE2-OG 3.16Å; S353-F355 PolarHBondContact O-N 3.07Å
354	V	97.7	Very high	96.5	Very high	0 Å²	0	41 Å²	41	0%	0	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-66.2	-29.9	176.8	-50.8	0	0	0	0	111.4	V326 F331 L350 E351 E352	V326-V354 HydrophobicContact CB-CG1 4.22Å; V326-V354 HydrophobicContact CG1-CB 3.88Å; V326-V354 HydrophobicContact CG1-CG1 3.79Å; V326-V354 HydrophobicContact CG1-CG2 4.42Å; F331-V354 WeakPolarHBondContact CA-O 3.47Å; F331-V354 WeakPolarHBondContact CB-O 3.44Å; F331-V354 HydrophobicContact CD2-CB 4.47Å; F331-V354 HydrophobicContact CD2-CG2 4.2Å; F331-V354 HydrophobicContact CE2-CG2 4.31Å; F331-V354 PolarHBondContact N-O 3.02Å; L350-V354 HydrophobicContact CD1-CG1 4.38Å; L350-V354 HydrophobicContact CD1-CG2 3.94Å; L350-V354 HydrophobicContact CG-CG2 4.28Å; E351-V354 HydrophobicContact CB-CG1 4.29Å; E351-V354 WeakPolarHBondContact O-CG1 3.39Å; E351-V354 WeakPolarHBondContact O-CG2 3.39Å; E351-V354 PolarHBondContact O-N 3.29Å; E352-V354 PolarHBondContact O-N 2.83Å; E352-V354 VanDerWaalsContact O-N 3.16Å
355	F	97.6	Very high	96.5	Very high	16 Å²	16	40.9 Å²	40.9	7%	0.07	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-92.2	142.4	-177.1	-62.3	-79.6	0	0	0	111.5	F331 L337 L340 L350 E352 S353 V358 L361 L364 W379	F331-F355 AromaticContact CD2-CD1 3.95Å; F331-F355 HydrophobicContact CD2-CD1 3.95Å; F331-F355 AromaticContact CD2-CE1 3.98Å; F331-F355 HydrophobicContact CD2-CE1 3.98Å; F331-F355 HydrophobicContact CE2-CE1 4.24Å; L337-F355 HydrophobicContact CD2-CD1 4.03Å; L337-F355 HydrophobicContact CD2-CE1 4.03Å; L340-F355 HydrophobicContact CB-CE1 4.49Å; L340-F355 HydrophobicContact CD2-CE1 3.86Å; L340-F355 HydrophobicContact CD2-CZ 3.6Å; L350-F355 HydrophobicContact CD2-CE2 3.88Å; L350-F355 HydrophobicContact CD2-CZ 3.94Å; L350-F355 HydrophobicContact CG-CE2 4.27Å; E352-F355 PolarHBondContact O-N 3.18Å; S353-F355 PolarHBondContact O-N 3.07Å; F355-V358 HydrophobicContact CB-CG2 3.89Å; F355-L361 HydrophobicContact CE1-CD1 3.98Å; F355-L361 HydrophobicContact CE1-CD2 3.94Å; F355-L361 HydrophobicContact CE2-CD2 4.26Å; F355-L361 HydrophobicContact CZ-CD2 3.78Å; F355-L364 HydrophobicContact CZ-CD1 4.48Å; F355-W379 AromaticContact CD2-CH2 3.95Å; F355-W379 HydrophobicContact CD2-CH2 3.95Å; F355-W379 HydrophobicContact CD2-CZ2 4.21Å; F355-W379 AromaticContact CE2-CH2 3.44Å; F355-W379 HydrophobicContact CE2-CH2 3.44Å; F355-W379 VanDerWaalsContact CE2-CH2 3.44Å; F355-W379 AromaticContact CE2-CZ2 3.71Å; F355-W379 HydrophobicContact CE2-CZ2 3.71Å; F355-W379 HydrophobicContact CZ-CH2 4.29Å
356	H	95.6	Very high	96.4	Very high	90 Å²	90	40.4 Å²	40.4	42%	0.417	23%	0.226	S	C	.	.	S	Bend	trans	-74.3	-46.5	167.9	-170.1	84.3	0	0	0	112	F331 G333 N335	F331-H356 WeakPolarHBondContact O-CB 3.37Å; G333-H356 PolarHBondContact N-ND1 3.3Å; N335-H356 PolarHBondContact OD1-CD2 3.07Å; N335-H356 PolarHBondContact OD1-NE2 2.61Å
357	S	92.8	Very high	96.4	Very high	34 Å²	34	36.3 Å²	36.3	24%	0.238	21%	0.207	C	C	.	.			trans	-133.3	81.2	-174.3	-71.5	0	0	0	0	111	N335 G359 N360	N335-S357 PolarHBondContact OD1-OG 3.29Å; N335-S357 VanDerWaalsContact OD1-OG 3.13Å; S357-G359 PolarHBondContact O-N 3.31Å; S357-G359 VanDerWaalsContact O-N 3.11Å; S357-N360 PolarHBondContact O-N 3.19Å; S357-N360 VanDerWaalsContact O-N 3.11Å
358	V	93.6	Very high	96.3	Very high	16 Å²	16	40 Å²	40	10%	0.097	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-58.8	-25.8	179	-161.9	0	0	0	0	111.8	E352 F355 N360 L361 W379 R383	E352-V358 HydrophobicContact CG-CG1 4.46Å; E352-V358 HydrophobicContact CG-CG2 3.55Å; F355-V358 HydrophobicContact CB-CG2 3.89Å; V358-N360 PolarHBondContact O-N 3.46Å; V358-L361 WeakPolarHBondContact O-CB 3.33Å; V358-L361 PolarHBondContact O-N 2.89Å; V358-W379 HydrophobicContact CG1-CE3 3.78Å; V358-W379 HydrophobicContact CG1-CH2 4.33Å; V358-W379 HydrophobicContact CG1-CZ3 3.49Å; V358-W379 VanDerWaalsContact CG1-CZ3 3.49Å; V358-R383 PolarHBondContact O-NH1 3.22Å
359	G	92.3	Very high	96.4	Very high	64 Å²	64	37.3 Å²	37.3	66%	0.66	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-64	-25.6	178.3	0	0	0	0	0	114.4	S357	S357-G359 PolarHBondContact O-N 3.31Å; S357-G359 VanDerWaalsContact O-N 3.11Å
360	N	94.3	Very high	96.4	Very high	77 Å²	77	39.1 Å²	39.1	41%	0.412	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-92.1	-5.7	-178.8	-64.1	-19.8	0	0	0	112.9	N335 S357 V358 E362	N335-N360 PolarHBondContact O-ND2 3.3Å; S357-N360 PolarHBondContact O-N 3.19Å; S357-N360 VanDerWaalsContact O-N 3.11Å; V358-N360 PolarHBondContact O-N 3.46Å; N360-E362 PolarHBondContact O-N 3.45Å
361	L	96.4	Very high	96.4	Very high	9 Å²	9	39.1 Å²	39.1	5%	0.047	23%	0.228	C	C	.	.			trans	-74	116.4	178.8	-169.1	69.6	0	0	0	109.5	L340 F355 V358 L364 W379 L387	L340-L361 HydrophobicContact CB-CD1 4.4Å; F355-L361 HydrophobicContact CE1-CD1 3.98Å; F355-L361 HydrophobicContact CE1-CD2 3.94Å; F355-L361 HydrophobicContact CE2-CD2 4.26Å; F355-L361 HydrophobicContact CZ-CD2 3.78Å; V358-L361 WeakPolarHBondContact O-CB 3.33Å; V358-L361 PolarHBondContact O-N 2.89Å; L361-L364 HydrophobicContact CD2-CB 4.13Å; L361-L364 HydrophobicContact CD2-CD2 4.29Å; L361-W379 HydrophobicContact CD2-CH2 4.26Å; L361-W379 HydrophobicContact CD2-CZ3 4.41Å; L361-L387 HydrophobicContact CB-CD2 4.36Å; L361-L387 HydrophobicContact CD2-CD2 3.94Å; L361-L387 HydrophobicContact CG-CD2 3.99Å
362	E	96.1	Very high	96.5	Very high	92 Å²	92	36.5 Å²	36.5	43%	0.43	22%	0.219	S	C	.	.			trans	-101.4	-38.3	-178.3	-67.3	171.7	-174.5	0	0	111.3	R338 N360 L387 N388	R338-E362 HydrophobicContact CB-CB 4.5Å; R338-E362 HydrophobicContact CB-CG 4.42Å; R338-E362 WeakPolarHBondContact CD-OE1 3.43Å; R338-E362 HydrophobicContact CG-CG 4.46Å; R338-E362 IonicContact NH1-OE2 2.75Å; R338-E362 PolarHBondContact O-N 2.76Å; N360-E362 PolarHBondContact O-N 3.45Å; E362-L387 CarbonylContact O-C 3.42Å; E362-L387 VanDerWaalsContact O-CA 3.32Å; E362-L387 WeakPolarHBondContact O-CA 3.18Å; E362-N388 PolarHBondContact O-ND2 3.37Å
363	T	97.6	Very high	96.5	Very high	25 Å²	25	32.4 Å²	32.4	15%	0.153	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	122.1	-175.8	-53.6	0	0	0	0	110	R338 V339 L340 I365 L387 N388	R338-T363 PolarHBondContact O-N 2.96Å; V339-T363 WeakPolarHBondContact CA-O 3.4Å; V339-T363 HydrophobicContact CG1-CG2 4.31Å; L340-T363 PolarHBondContact N-O 3.36Å; T363-I365 HydrophobicContact CG2-CD1 4.31Å; T363-I365 HydrophobicContact CG2-CG1 4.03Å; T363-L387 WeakPolarHBondContact CA-O 3.33Å; T363-N388 HydrophobicContact CG2-CB 4.17Å; T363-N388 PolarHBondContact OG1-ND2 3.46Å
364	L	97.9	Very high	96.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	121.7	174.5	177.1	61.4	0	0	0	108.5	L340 L350 F355 L361 L366 W379 V380 L387 F389	L340-L364 HydrophobicContact CB-CD1 4.05Å; L340-L364 HydrophobicContact CD2-CD1 3.91Å; L340-L364 HydrophobicContact CG-CD1 4.19Å; L340-L364 WeakPolarHBondContact O-CA 3.36Å; L350-L364 HydrophobicContact CD2-CD1 3.79Å; L350-L364 HydrophobicContact CD2-CD2 4.12Å; F355-L364 HydrophobicContact CZ-CD1 4.48Å; L361-L364 HydrophobicContact CD2-CB 4.13Å; L361-L364 HydrophobicContact CD2-CD2 4.29Å; L364-L366 HydrophobicContact CD1-CD1 4.18Å; L364-L366 HydrophobicContact CD1-CG 4.04Å; L364-L366 HydrophobicContact CD2-CD1 3.59Å; L364-L366 HydrophobicContact CD2-CG 4.31Å; L364-L366 HydrophobicContact CG-CD1 3.8Å; L364-L366 HydrophobicContact CG-CG 3.96Å; L364-W379 HydrophobicContact CD2-CH2 3.95Å; L364-V380 HydrophobicContact CD2-CG1 4.12Å; L364-V380 HydrophobicContact CD2-CG2 4.27Å; L364-L387 HydrophobicContact CB-CB 4.25Å; L364-L387 HydrophobicContact CB-CD1 4.3Å; L364-L387 HydrophobicContact CB-CD2 4.32Å; L364-L387 HydrophobicContact CD2-CD1 4.03Å; L364-L387 PolarHBondContact N-O 3.48Å; L364-L387 VanDerWaalsContact N-O 3.13Å; L364-F389 HydrophobicContact CB-CE1 4.16Å; L364-F389 HydrophobicContact CG-CE1 4.47Å; L364-F389 WeakPolarHBondContact O-CD1 3.17Å; L364-F389 WeakPolarHBondContact O-CE1 3.13Å
365	I	97.9	Very high	96.5	Very high	27 Å²	27	32.7 Å²	32.7	14%	0.138	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	115.1	178.8	-52.9	-174.4	0	0	0	108.6	L340 N341 V342 T363 D367 Q392	L340-I365 PolarHBondContact O-N 3.27Å; N341-I365 HydrophobicContact CB-CB 4.18Å; N341-I365 HydrophobicContact CB-CD1 4.42Å; N341-I365 WeakPolarHBondContact OD1-CB 3.32Å; N341-I365 WeakPolarHBondContact OD1-CG2 3.31Å; V342-I365 WeakPolarHBondContact CG2-O 3.26Å; V342-I365 PolarHBondContact N-O 2.95Å; T363-I365 HydrophobicContact CG2-CD1 4.31Å; T363-I365 HydrophobicContact CG2-CG1 4.03Å; I365-D367 WeakPolarHBondContact CG2-OD1 3.24Å; I365-Q392 HydrophobicContact CG2-CB 3.92Å; I365-Q392 HydrophobicContact CG2-CG 4.33Å
366	L	97.3	Very high	96.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	21%	0.206	C	C	.	.			trans	-128.5	8.6	-173.5	-78.7	169.3	0	0	0	112.8	V342 L347 L350 L364 N369 L371 V380 P394	V342-L366 HydrophobicContact CG2-CD2 3.47Å; V342-L366 VanDerWaalsContact CG2-CD2 3.47Å; V342-L366 HydrophobicContact CG2-CG 4.35Å; L347-L366 HydrophobicContact CD1-CD2 4.12Å; L350-L366 HydrophobicContact CB-CD2 4.4Å; L350-L366 HydrophobicContact CD2-CD1 4.1Å; L350-L366 HydrophobicContact CD2-CD2 4.11Å; L364-L366 HydrophobicContact CD1-CD1 4.18Å; L364-L366 HydrophobicContact CD1-CG 4.04Å; L364-L366 HydrophobicContact CD2-CD1 3.59Å; L364-L366 HydrophobicContact CD2-CG 4.31Å; L364-L366 HydrophobicContact CG-CD1 3.8Å; L364-L366 HydrophobicContact CG-CG 3.96Å; L366-N369 PolarHBondContact O-ND2 3.41Å; L366-L371 HydrophobicContact CB-CD1 4.42Å; L366-V380 HydrophobicContact CD1-CG1 4.33Å; L366-P394 HydrophobicContact CB-CB 4.21Å; L366-P394 HydrophobicContact CB-CG 4.18Å
367	D	96.7	Very high	96.6	Very high	26 Å²	26	29.9 Å²	29.9	14%	0.139	19%	0.186	C	C	.	.			trans	-62	164	177.9	78.2	-72.9	0	0	0	111	S343 G344 I365 N369 Q392 Q393	S343-D367 WeakPolarHBondContact CA-O 3.41Å; S343-D367 WeakPolarHBondContact CB-OD1 3.4Å; S343-D367 PolarHBondContact OG-OD1 3.25Å; S343-D367 PolarHBondContact OG-OD2 2.79Å; S343-D367 VanDerWaalsContact OG-OD2 3.13Å; G344-D367 PolarHBondContact N-O 3.49Å; G344-D367 VanDerWaalsContact N-O 3.16Å; I365-D367 WeakPolarHBondContact CG2-OD1 3.24Å; D367-N369 PolarHBondContact O-N 3.23Å; D367-N369 PolarHBondContact O-ND2 3.08Å; D367-Q392 HydrophobicContact CB-CB 4.33Å; D367-Q393 WeakPolarHBondContact CB-O 3.48Å
368	S	97.4	Very high	96.8	Very high	78 Å²	78	30.1 Å²	30.1	55%	0.545	18%	0.184	S	C	.	.	S	Bend	trans	56.2	39.2	177.4	-51.9	0	0	0	0	113.2	G344 N345	G344-S368 WeakPolarHBondContact CA-O 3.34Å; G344-S368 PolarHBondContact N-O 3.34Å; N345-S368 PolarHBondContact N-O 3.35Å
369	N	98.3	Very high	96.9	Very high	12 Å²	12	30.3 Å²	30.3	6%	0.064	18%	0.183	C	C	.	.	S	Bend	trans	-128.3	144.9	172.4	-79	-88.2	0	0	0	109.9	V342 N345 Q346 L347 L366 D367 L371	V342-N369 PolarHBondContact O-ND2 3.21Å; N345-N369 VanDerWaalsContact CA-OD1 3.29Å; N345-N369 WeakPolarHBondContact CA-OD1 3.44Å; N345-N369 WeakPolarHBondContact CB-OD1 3.16Å; N345-N369 PolarHBondContact N-OD1 2.98Å; N345-N369 PolarHBondContact O-OD1 3.25Å; Q346-N369 PolarHBondContact N-OD1 3.38Å; L347-N369 HydrophobicContact CB-CB 4.25Å; L347-N369 VanDerWaalsContact CB-OD1 3.31Å; L347-N369 WeakPolarHBondContact CB-OD1 3.44Å; L347-N369 PolarHBondContact N-OD1 3.12Å; L366-N369 PolarHBondContact O-ND2 3.41Å; D367-N369 PolarHBondContact O-N 3.23Å; D367-N369 PolarHBondContact O-ND2 3.08Å; N369-L371 HydrophobicContact CB-CD2 3.91Å; N369-L371 HydrophobicContact CB-CG 4.07Å; N369-L371 PolarHBondContact O-N 2.83Å
370	P	97.8	Very high	97.2	Very high	58 Å²	58	27.2 Å²	27.2	38%	0.377	15%	0.152	S	C	.	.			trans	-77.7	64.9	178.6	33.7	-36.6	0	0	0	112.2	L347 A397	L347-P370 CarbonylContact O-C 3.4Å; L347-P370 WeakPolarHBondContact O-CD 3.19Å; P370-A397 HydrophobicContact CB-CB 4.06Å
371	L	98.3	Very high	97.3	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	135.3	-172.3	-59.2	175.6	0	0	0	112.8	T348 L366 N369 L377 P394 A397 T398	T348-L371 CarbonylContact O-C 3.16Å; L366-L371 HydrophobicContact CB-CD1 4.42Å; N369-L371 HydrophobicContact CB-CD2 3.91Å; N369-L371 HydrophobicContact CB-CG 4.07Å; N369-L371 PolarHBondContact O-N 2.83Å; L371-L377 HydrophobicContact CB-CD1 3.94Å; L371-L377 HydrophobicContact CD1-CD1 4.39Å; L371-L377 HydrophobicContact CD2-CD1 4.29Å; L371-L377 HydrophobicContact CG-CD1 4.44Å; L371-P394 HydrophobicContact CD1-CB 3.67Å; L371-A397 PolarHBondContact O-N 2.02Å; L371-T398 PolarHBondContact O-N 3.2Å; L371-T398 VanDerWaalsContact O-N 3.13Å
372	A	97.9	Very high	97.2	Very high	13 Å²	13	32.4 Å²	32.4	11%	0.107	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	105.3	166.9	0	0	0	0	0	109.7	T348 D374 L377 T398	T348-A372 PolarHBondContact O-N 2.88Å; A372-D374 PolarHBondContact O-N 3.3Å; A372-L377 WeakPolarHBondContact O-CD1 3.33Å; A372-T398 VanDerWaalsContact CA-OG1 3.23Å; A372-T398 WeakPolarHBondContact CA-OG1 3.38Å; A372-T398 VanDerWaalsContact CB-OG1 3.29Å; A372-T398 WeakPolarHBondContact CB-OG1 3.17Å
373	C	97.8	Very high	97.2	Very high	5 Å²	5	31.6 Å²	31.6	3%	0.034	16%	0.158	C	C	.	.			trans	-81.3	59.1	-175.8	-71.3	0	0	0	0	112.6	C396 T398 V402 F419	C373-C396 HydrophobicContact CB-CB 3.82Å; C373-C396 WeakPolarHBondContact CB-SG 3.47Å; C373-C396 WeakPolarHBondContact SG-CA 3.45Å; C373-C396 WeakPolarHBondContact SG-CB 3.29Å; C373-C396 CovalentContact SG-SG 2.02Å; C373-C396 PolarHBondContact SG-SG 2.82Å; C373-T398 PolarHBondContact N-O 3.09Å; C373-V402 HydrophobicContact CB-CG2 4.42Å; C373-F419 HydrophobicContact CB-CD1 4.3Å; C373-F419 HydrophobicContact CB-CE1 3.86Å; C373-F419 HydrophobicContact CB-CZ 4.25Å; C373-F419 WeakPolarHBondContact O-CA 3.43Å; C373-F419 PolarHBondContact O-N 3.42Å
374	D	96.9	Very high	97	Very high	14 Å²	14	31.4 Å²	31.4	8%	0.075	15%	0.154	C	C	.	.	S	Bend	trans	-99.1	-170.1	172.4	67.5	35.7	0	0	0	111.7	A372 R376 L377 F419	A372-D374 PolarHBondContact O-N 3.3Å; D374-R376 PolarHBondContact O-N 3.35Å; D374-R376 VanDerWaalsContact O-N 3.12Å; D374-R376 WeakPolarHBondContact OD1-CB 3.44Å; D374-R376 WeakPolarHBondContact OD1-CG 3.49Å; D374-R376 IonicContact OD1-CZ 3.23Å; D374-R376 PolarHBondContact OD1-N 3.3Å; D374-R376 IonicContact OD1-NE 3.09Å; D374-R376 PolarHBondContact OD1-NE 2.7Å; D374-R376 VanDerWaalsContact OD1-NE 3.07Å; D374-R376 IonicContact OD1-NH2 2.75Å; D374-R376 IonicContact OD2-CZ 2.7Å; D374-R376 VanDerWaalsContact OD2-CZ 3.24Å; D374-R376 IonicContact OD2-NE 2.64Å; D374-R376 PolarHBondContact OD2-NE 2.97Å; D374-R376 IonicContact OD2-NH2 3.21Å; D374-R376 PolarHBondContact OD2-NH2 3.13Å; D374-L377 PolarHBondContact O-N 3.07Å; D374-F419 WeakPolarHBondContact O-CD1 3.2Å
375	C	96.8	Very high	96.8	Very high	30 Å²	30	39.7 Å²	39.7	20%	0.203	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-62.3	-18.6	-177	74.3	0	0	0	0	114.9	L377 L378 F419 C421 A502	C375-L377 VanDerWaalsContact C-N 3.28Å; C375-L377 PolarHBondContact O-N 2.94Å; C375-L378 WeakPolarHBondContact O-CB 3.48Å; C375-L378 PolarHBondContact O-N 2.93Å; C375-F419 WeakPolarHBondContact CA-O 3.36Å; C375-F419 WeakPolarHBondContact CB-O 3.48Å; C375-F419 PolarHBondContact N-O 3.01Å; C375-C421 HydrophobicContact CB-CB 3.86Å; C375-C421 WeakPolarHBondContact CB-SG 3.24Å; C375-C421 PolarHBondContact N-SG 3.07Å; C375-C421 WeakPolarHBondContact SG-CB 3.23Å; C375-C421 CovalentContact SG-SG 2.02Å; C375-C421 PolarHBondContact SG-SG 3.19Å; C375-A502 VanDerWaalsContact SG-CB 3.58Å
376	R	97.1	Very high	96.6	Very high	48 Å²	48	48.3 Å²	48.3	18%	0.181	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-67.2	-29.2	178.6	-63.8	175.2	-69.4	169	0.7	112.4	T349 D374 W379 A502	T349-R376 VanDerWaalsContact CG2-NH1 3.3Å; T349-R376 VanDerWaalsContact OG1-CB 3.3Å; T349-R376 WeakPolarHBondContact OG1-CB 3.47Å; D374-R376 PolarHBondContact O-N 3.35Å; D374-R376 VanDerWaalsContact O-N 3.12Å; D374-R376 WeakPolarHBondContact OD1-CB 3.44Å; D374-R376 WeakPolarHBondContact OD1-CG 3.49Å; D374-R376 IonicContact OD1-CZ 3.23Å; D374-R376 PolarHBondContact OD1-N 3.3Å; D374-R376 IonicContact OD1-NE 3.09Å; D374-R376 PolarHBondContact OD1-NE 2.7Å; D374-R376 VanDerWaalsContact OD1-NE 3.07Å; D374-R376 IonicContact OD1-NH2 2.75Å; D374-R376 IonicContact OD2-CZ 2.7Å; D374-R376 VanDerWaalsContact OD2-CZ 3.24Å; D374-R376 IonicContact OD2-NE 2.64Å; D374-R376 PolarHBondContact OD2-NE 2.97Å; D374-R376 IonicContact OD2-NH2 3.21Å; D374-R376 PolarHBondContact OD2-NH2 3.13Å; R376-W379 PolarHBondContact O-NE1 3.41Å; R376-A502 HydrophobicContact CG-CB 3.39Å
377	L	97.8	Very high	96.4	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-93.9	2.5	176.5	-68.6	179.2	0	0	0	113.3	L350 L371 A372 D374 C375 W379 V380 F381 F407 F419	L350-L377 HydrophobicContact CB-CD2 4.29Å; L371-L377 HydrophobicContact CB-CD1 3.94Å; L371-L377 HydrophobicContact CD1-CD1 4.39Å; L371-L377 HydrophobicContact CD2-CD1 4.29Å; L371-L377 HydrophobicContact CG-CD1 4.44Å; A372-L377 WeakPolarHBondContact O-CD1 3.33Å; D374-L377 PolarHBondContact O-N 3.07Å; C375-L377 VanDerWaalsContact C-N 3.28Å; C375-L377 PolarHBondContact O-N 2.94Å; L377-W379 PolarHBondContact O-N 3.03Å; L377-V380 HydrophobicContact CD2-CG2 4.07Å; L377-V380 WeakPolarHBondContact O-CB 3.18Å; L377-V380 PolarHBondContact O-N 2.91Å; L377-V380 VanDerWaalsContact O-N 3.08Å; L377-F381 PolarHBondContact O-N 2.9Å; L377-F407 HydrophobicContact CB-CZ 4.37Å; L377-F407 HydrophobicContact CD1-CZ 4.34Å; L377-F419 HydrophobicContact CB-CD1 4.22Å; L377-F419 HydrophobicContact CB-CE1 4.11Å
378	L	96.7	Very high	96.3	Very high	39 Å²	39	51 Å²	51	20%	0.204	23%	0.23	C	C	.	.	H	α-helix	trans	-59.6	-35.7	-179	-176.9	61.4	0	0	0	112.4	C375 V380 F381 R382 L414 F419	C375-L378 WeakPolarHBondContact O-CB 3.48Å; C375-L378 PolarHBondContact O-N 2.93Å; L378-V380 VanDerWaalsContact C-N 3.32Å; L378-V380 PolarHBondContact O-N 3.33Å; L378-F381 HydrophobicContact CD1-CD1 4.42Å; L378-F381 PolarHBondContact O-N 3.22Å; L378-R382 HydrophobicContact CD1-CG 4.47Å; L378-R382 WeakPolarHBondContact O-CG 3.3Å; L378-R382 PolarHBondContact O-N 3Å; L378-L414 HydrophobicContact CD1-CD1 3.64Å; L378-F419 HydrophobicContact CB-CB 4.36Å; L378-F419 HydrophobicContact CD1-CB 3.9Å; L378-F419 HydrophobicContact CD1-CG 4.5Å
379	W	96.5	Very high	96	Very high	19 Å²	19	47.4 Å²	47.4	7%	0.072	21%	0.205	C	C	.	.	H	α-helix	trans	-64.4	-38.2	177.6	76.1	-91.5	0	0	0	111.7	L350 E352 F355 V358 L361 L364 R376 L377 R383	L350-W379 HydrophobicContact CD2-CZ2 4.2Å; L350-W379 HydrophobicContact CG-CZ2 4.34Å; L350-W379 PolarHBondContact O-NE1 3.2Å; E352-W379 HydrophobicContact CB-CB 4.49Å; E352-W379 HydrophobicContact CB-CD2 4.08Å; E352-W379 HydrophobicContact CB-CG 3.88Å; E352-W379 HydrophobicContact CG-CD2 4.21Å; E352-W379 HydrophobicContact CG-CG 4.23Å; F355-W379 AromaticContact CD2-CH2 3.95Å; F355-W379 HydrophobicContact CD2-CH2 3.95Å; F355-W379 HydrophobicContact CD2-CZ2 4.21Å; F355-W379 AromaticContact CE2-CH2 3.44Å; F355-W379 HydrophobicContact CE2-CH2 3.44Å; F355-W379 VanDerWaalsContact CE2-CH2 3.44Å; F355-W379 AromaticContact CE2-CZ2 3.71Å; F355-W379 HydrophobicContact CE2-CZ2 3.71Å; F355-W379 HydrophobicContact CZ-CH2 4.29Å; V358-W379 HydrophobicContact CG1-CE3 3.78Å; V358-W379 HydrophobicContact CG1-CH2 4.33Å; V358-W379 HydrophobicContact CG1-CZ3 3.49Å; V358-W379 VanDerWaalsContact CG1-CZ3 3.49Å; L361-W379 HydrophobicContact CD2-CH2 4.26Å; L361-W379 HydrophobicContact CD2-CZ3 4.41Å; L364-W379 HydrophobicContact CD2-CH2 3.95Å; R376-W379 PolarHBondContact O-NE1 3.41Å; L377-W379 PolarHBondContact O-N 3.03Å; W379-R383 WeakPolarHBondContact O-CG 3.34Å; W379-R383 PolarHBondContact O-N 3.23Å
380	V	97.4	Very high	95.6	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65.5	-49.2	174.4	-176.6	0	0	0	0	109.6	L364 L366 L377 L378 R382 R383 R384 L387 F389 F407	L364-V380 HydrophobicContact CD2-CG1 4.12Å; L364-V380 HydrophobicContact CD2-CG2 4.27Å; L366-V380 HydrophobicContact CD1-CG1 4.33Å; L377-V380 HydrophobicContact CD2-CG2 4.07Å; L377-V380 WeakPolarHBondContact O-CB 3.18Å; L377-V380 PolarHBondContact O-N 2.91Å; L377-V380 VanDerWaalsContact O-N 3.08Å; L378-V380 VanDerWaalsContact C-N 3.32Å; L378-V380 PolarHBondContact O-N 3.33Å; V380-R382 VanDerWaalsContact C-N 3.33Å; V380-R382 PolarHBondContact O-N 3.01Å; V380-R383 CarbonylContact O-C 3.23Å; V380-R383 WeakPolarHBondContact O-CA 3.17Å; V380-R383 PolarHBondContact O-N 3.02Å; V380-R384 PolarHBondContact O-N 3.42Å; V380-R384 VanDerWaalsContact O-N 3.15Å; V380-L387 HydrophobicContact CG1-CD1 4.25Å; V380-F389 HydrophobicContact CG1-CE2 4.44Å; V380-F389 HydrophobicContact CG1-CZ 3.67Å; V380-F407 HydrophobicContact CB-CE2 4.12Å; V380-F407 HydrophobicContact CG1-CD2 4.36Å; V380-F407 HydrophobicContact CG1-CE2 3.8Å
381	F	96.6	Very high	95.2	Very high	4 Å²	4	61 Å²	61	2%	0.018	26%	0.258	C	S	.	.	H	α-helix	trans	-57.9	-43.4	-179.8	177.4	-101.4	0	0	0	112.5	L377 L378 R383 R384 F407 F410 L414 F419	L377-F381 PolarHBondContact O-N 2.9Å; L378-F381 HydrophobicContact CD1-CD1 4.42Å; L378-F381 PolarHBondContact O-N 3.22Å; F381-R383 PolarHBondContact O-N 2.84Å; F381-R384 VanDerWaalsContact CE1-NH1 3.26Å; F381-R384 VanDerWaalsContact CZ-CZ 3.47Å; F381-R384 WeakPolarHBondContact O-CB 3.38Å; F381-R384 VanDerWaalsContact O-CG 3.31Å; F381-R384 WeakPolarHBondContact O-CG 3.27Å; F381-R384 PolarHBondContact O-N 2.89Å; F381-R384 PolarHBondContact O-NH1 3.43Å; F381-F407 HydrophobicContact CB-CD2 4.36Å; F381-F407 HydrophobicContact CB-CE2 4.16Å; F381-F407 HydrophobicContact CD2-CD2 4.2Å; F381-F410 HydrophobicContact CE2-CB 3.55Å; F381-F410 HydrophobicContact CE2-CD2 4.41Å; F381-F410 HydrophobicContact CE2-CG 4.15Å; F381-F410 HydrophobicContact CZ-CB 3.82Å; F381-L414 HydrophobicContact CD1-CD1 3.93Å; F381-L414 HydrophobicContact CD1-CD2 4.12Å; F381-L414 HydrophobicContact CD1-CG 4.3Å; F381-L414 HydrophobicContact CE1-CD1 3.82Å; F381-L414 HydrophobicContact CE1-CD2 3.4Å; F381-L414 VanDerWaalsContact CE1-CD2 3.4Å; F381-L414 HydrophobicContact CE1-CG 3.67Å; F381-L414 HydrophobicContact CZ-CD2 3.65Å; F381-L414 HydrophobicContact CZ-CG 4.36Å; F381-F419 HydrophobicContact CB-CD1 4.43Å; F381-F419 HydrophobicContact CB-CD2 4.46Å; F381-F419 HydrophobicContact CB-CE1 4.12Å; F381-F419 HydrophobicContact CB-CE2 4.15Å; F381-F419 HydrophobicContact CB-CZ 3.97Å; F381-F419 HydrophobicContact CD1-CD2 4.39Å; F381-F419 HydrophobicContact CD1-CE2 4.35Å; F381-F419 HydrophobicContact CD2-CD2 4.42Å; F381-F419 AromaticContact CD2-CE2 3.62Å; F381-F419 HydrophobicContact CD2-CE2 3.62Å; F381-F419 AromaticContact CD2-CZ 3.82Å; F381-F419 HydrophobicContact CD2-CZ 3.82Å; F381-F419 HydrophobicContact CE2-CE2 4.15Å; F381-F419 HydrophobicContact CG-CD2 4.13Å; F381-F419 AromaticContact CG-CE2 3.74Å; F381-F419 HydrophobicContact CG-CE2 3.74Å; F381-F419 AromaticContact CG-CZ 4Å; F381-F419 HydrophobicContact CG-CZ 4Å
382	R	95.6	Very high	94.9	Very high	191 Å²	191	65 Å²	65	72%	0.721	28%	0.276	S	S	*	.	H	α-helix	trans	-62.2	-21.7	176.4	-74.9	-178.8	-178.2	-171.5	1.8	113.3	L378 V380	L378-R382 HydrophobicContact CD1-CG 4.47Å; L378-R382 WeakPolarHBondContact O-CG 3.3Å; L378-R382 PolarHBondContact O-N 3Å; V380-R382 VanDerWaalsContact C-N 3.33Å; V380-R382 PolarHBondContact O-N 3.01Å
383	R	95.5	Very high	94.8	Very high	75 Å²	75	65.1 Å²	65.1	28%	0.283	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	12.2	-179.8	-63	-180	179.8	-142.4	10.6	113.3	V358 W379 V380 F381 W385 R386 L387	V358-R383 PolarHBondContact O-NH1 3.22Å; W379-R383 WeakPolarHBondContact O-CG 3.34Å; W379-R383 PolarHBondContact O-N 3.23Å; V380-R383 CarbonylContact O-C 3.23Å; V380-R383 WeakPolarHBondContact O-CA 3.17Å; V380-R383 PolarHBondContact O-N 3.02Å; F381-R383 PolarHBondContact O-N 2.84Å; R383-W385 PolarHBondContact O-N 3.15Å; R383-R386 PolarHBondContact O-N 3.2Å; R383-L387 HydrophobicContact CB-CD1 3.7Å; R383-L387 HydrophobicContact CB-CG 3.91Å; R383-L387 PolarHBondContact O-N 3.41Å
384	R	94.1	Very high	94.8	Very high	21 Å²	21	64.9 Å²	64.9	8%	0.079	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-28.1	-172.6	69.3	-173.6	172.3	-77.5	-0.2	115.8	V380 F381 F389 D412	V380-R384 PolarHBondContact O-N 3.42Å; V380-R384 VanDerWaalsContact O-N 3.15Å; F381-R384 VanDerWaalsContact CE1-NH1 3.26Å; F381-R384 VanDerWaalsContact CZ-CZ 3.47Å; F381-R384 WeakPolarHBondContact O-CB 3.38Å; F381-R384 VanDerWaalsContact O-CG 3.31Å; F381-R384 WeakPolarHBondContact O-CG 3.27Å; F381-R384 PolarHBondContact O-N 2.89Å; F381-R384 PolarHBondContact O-NH1 3.43Å; R384-F389 HydrophobicContact CB-CD2 4.2Å; R384-F389 HydrophobicContact CB-CE2 3.8Å; R384-F389 VanDerWaalsContact O-CD2 3.31Å; R384-F389 WeakPolarHBondContact O-CD2 3.37Å; R384-D412 IonicContact CZ-OD1 3.07Å; R384-D412 IonicContact NH2-OD1 3.97Å; R384-D412 PolarHBondContact NH2-OD1 2.98Å
385	W	92	Very high	94.8	Very high	173 Å²	173	66.1 Å²	66.1	66%	0.655	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-4	178.6	-54.5	121.7	0	0	0	114.1	R383 K408	R383-W385 PolarHBondContact O-N 3.15Å; W385-K408 HydrophobicContact CH2-CB 4.32Å
386	R	93.7	Very high	94.9	Very high	209 Å²	209	64.8 Å²	64.8	79%	0.789	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.8	-9.9	-176	-64.1	-175.4	-179.1	170.1	0.6	114.2	R383	R383-R386 PolarHBondContact O-N 3.2Å
387	L	94.1	Very high	95	Very high	2 Å²	2	64 Å²	64	1%	0.01	28%	0.275	C	S	.	.	S	Bend	trans	-97.8	20.8	-175.9	-69.8	174.5	0	0	0	113.8	L361 E362 T363 L364 V380 R383 F389	L361-L387 HydrophobicContact CB-CD2 4.36Å; L361-L387 HydrophobicContact CD2-CD2 3.94Å; L361-L387 HydrophobicContact CG-CD2 3.99Å; E362-L387 CarbonylContact O-C 3.42Å; E362-L387 VanDerWaalsContact O-CA 3.32Å; E362-L387 WeakPolarHBondContact O-CA 3.18Å; T363-L387 WeakPolarHBondContact CA-O 3.33Å; L364-L387 HydrophobicContact CB-CB 4.25Å; L364-L387 HydrophobicContact CB-CD1 4.3Å; L364-L387 HydrophobicContact CB-CD2 4.32Å; L364-L387 HydrophobicContact CD2-CD1 4.03Å; L364-L387 PolarHBondContact N-O 3.48Å; L364-L387 VanDerWaalsContact N-O 3.13Å; V380-L387 HydrophobicContact CG1-CD1 4.25Å; R383-L387 HydrophobicContact CB-CD1 3.7Å; R383-L387 HydrophobicContact CB-CG 3.91Å; R383-L387 PolarHBondContact O-N 3.41Å; L387-F389 VanDerWaalsContact C-N 3.26Å; L387-F389 HydrophobicContact CB-CD1 4.16Å; L387-F389 HydrophobicContact CB-CE1 3.68Å; L387-F389 HydrophobicContact CB-CZ 3.89Å; L387-F389 HydrophobicContact CD1-CE1 4.3Å; L387-F389 HydrophobicContact CD1-CZ 3.96Å; L387-F389 PolarHBondContact O-N 3.09Å; L387-F389 VanDerWaalsContact O-N 3.12Å
388	N	93.9	Very high	94.9	Very high	79 Å²	79	67.4 Å²	67.4	42%	0.422	30%	0.296	S	S	.	.			trans	47.3	41.5	176.6	-66.3	-16	0	0	0	114.9	E362 T363 N390	E362-N388 PolarHBondContact O-ND2 3.37Å; T363-N388 HydrophobicContact CG2-CB 4.17Å; T363-N388 PolarHBondContact OG1-ND2 3.46Å; N388-N390 PolarHBondContact O-N 3.42Å; N388-N390 PolarHBondContact O-ND2 2.98Å; N388-N390 VanDerWaalsContact O-ND2 3.14Å
389	F	90.6	Very high	94.9	Very high	3 Å²	3	67.7 Å²	67.7	1%	0.013	30%	0.301	C	S	.	.			trans	-61.6	-31.3	178.6	-65.3	-29.1	0	0	0	113.1	L364 V380 R384 L387 R391 Q392 Q393 P394 F407	L364-F389 HydrophobicContact CB-CE1 4.16Å; L364-F389 HydrophobicContact CG-CE1 4.47Å; L364-F389 WeakPolarHBondContact O-CD1 3.17Å; L364-F389 WeakPolarHBondContact O-CE1 3.13Å; V380-F389 HydrophobicContact CG1-CE2 4.44Å; V380-F389 HydrophobicContact CG1-CZ 3.67Å; R384-F389 HydrophobicContact CB-CD2 4.2Å; R384-F389 HydrophobicContact CB-CE2 3.8Å; R384-F389 VanDerWaalsContact O-CD2 3.31Å; R384-F389 WeakPolarHBondContact O-CD2 3.37Å; L387-F389 VanDerWaalsContact C-N 3.26Å; L387-F389 HydrophobicContact CB-CD1 4.16Å; L387-F389 HydrophobicContact CB-CE1 3.68Å; L387-F389 HydrophobicContact CB-CZ 3.89Å; L387-F389 HydrophobicContact CD1-CE1 4.3Å; L387-F389 HydrophobicContact CD1-CZ 3.96Å; L387-F389 PolarHBondContact O-N 3.09Å; L387-F389 VanDerWaalsContact O-N 3.12Å; F389-R391 PolarHBondContact O-N 2.87Å; F389-Q392 CarbonylContact O-C 3.43Å; F389-Q392 WeakPolarHBondContact O-CA 3.44Å; F389-Q392 PolarHBondContact O-N 3.35Å; F389-Q392 PolarHBondContact O-OE1 3.15Å; F389-Q393 VanDerWaalsContact CB-NE2 3.33Å; F389-P394 HydrophobicContact CD1-CG 4.31Å; F389-P394 HydrophobicContact CD2-CG 4.29Å; F389-P394 HydrophobicContact CE1-CG 3.97Å; F389-P394 HydrophobicContact CE2-CG 3.91Å; F389-P394 HydrophobicContact CG-CG 4.49Å; F389-P394 HydrophobicContact CZ-CG 3.77Å; F389-F407 HydrophobicContact CE2-CD2 4.37Å
390	N	91	Very high	94.8	Very high	124 Å²	124	74.7 Å²	74.7	66%	0.663	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	-117.2	-179.8	-62.1	-47.5	0	0	0	111.4	N388 Q393	N388-N390 PolarHBondContact O-N 3.42Å; N388-N390 PolarHBondContact O-ND2 2.98Å; N388-N390 VanDerWaalsContact O-ND2 3.14Å; N390-Q393 PolarHBondContact O-NE2 3.11Å; N390-Q393 VanDerWaalsContact O-NE2 3.15Å
391	R	89.1	Confident	94.8	Very high	233 Å²	233	80.7 Å²	80.7	88%	0.879	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-16.6	176.2	-68.9	-173	176.9	177.9	-0.5	113.5	F389 Q393	F389-R391 PolarHBondContact O-N 2.87Å; R391-Q393 VanDerWaalsContact C-N 3.35Å; R391-Q393 PolarHBondContact O-N 2.56Å
392	Q	92.9	Very high	94.8	Very high	82 Å²	82	80.7 Å²	80.7	38%	0.383	36%	0.361	S	S	.	.			trans	-90.3	66.6	-177.3	-63.3	77.9	15.3	0	0	110.6	I365 D367 F389	I365-Q392 HydrophobicContact CG2-CB 3.92Å; I365-Q392 HydrophobicContact CG2-CG 4.33Å; D367-Q392 HydrophobicContact CB-CB 4.33Å; F389-Q392 CarbonylContact O-C 3.43Å; F389-Q392 WeakPolarHBondContact O-CA 3.44Å; F389-Q392 PolarHBondContact O-N 3.35Å; F389-Q392 PolarHBondContact O-OE1 3.15Å
393	Q	95.8	Very high	94.8	Very high	16 Å²	16	78 Å²	78	8%	0.075	36%	0.357	C	S	.	.			trans	-76	136.3	-177.9	-67.7	-69.9	-39.2	0	0	111.8	D367 F389 N390 R391 T395 E406 K408	D367-Q393 WeakPolarHBondContact CB-O 3.48Å; F389-Q393 VanDerWaalsContact CB-NE2 3.33Å; N390-Q393 PolarHBondContact O-NE2 3.11Å; N390-Q393 VanDerWaalsContact O-NE2 3.15Å; R391-Q393 VanDerWaalsContact C-N 3.35Å; R391-Q393 PolarHBondContact O-N 2.56Å; Q393-T395 PolarHBondContact O-N 3.11Å; Q393-T395 PolarHBondContact O-OG1 2.73Å; Q393-E406 HydrophobicContact CB-CB 3.9Å; Q393-E406 HydrophobicContact CB-CG 3.98Å; Q393-E406 WeakPolarHBondContact CB-OE2 2.97Å; Q393-E406 HydrophobicContact CG-CB 4.5Å; Q393-E406 WeakPolarHBondContact CG-OE2 3.28Å; Q393-K408 HydrophobicContact CG-CD 4.05Å; Q393-K408 HydrophobicContact CG-CG 4.3Å
394	P	97.3	Very high	94.9	Very high	0 Å²	0	77 Å²	77	0%	0	37%	0.369	C	S	.	.			trans	-61	135.4	166.9	-15.2	27.5	0	0	0	109.7	L366 L371 F389 E406 F407	L366-P394 HydrophobicContact CB-CB 4.21Å; L366-P394 HydrophobicContact CB-CG 4.18Å; L371-P394 HydrophobicContact CD1-CB 3.67Å; F389-P394 HydrophobicContact CD1-CG 4.31Å; F389-P394 HydrophobicContact CD2-CG 4.29Å; F389-P394 HydrophobicContact CE1-CG 3.97Å; F389-P394 HydrophobicContact CE2-CG 3.91Å; F389-P394 HydrophobicContact CG-CG 4.49Å; F389-P394 HydrophobicContact CZ-CG 3.77Å; P394-E406 WeakPolarHBondContact O-CA 3.05Å; P394-F407 HydrophobicContact CB-CD1 3.8Å; P394-F407 HydrophobicContact CB-CD2 4.21Å; P394-F407 HydrophobicContact CB-CE1 3.85Å; P394-F407 HydrophobicContact CB-CE2 4.27Å; P394-F407 HydrophobicContact CB-CG 3.99Å; P394-F407 HydrophobicContact CB-CZ 4.09Å; P394-F407 HydrophobicContact CG-CD1 4.49Å; P394-F407 HydrophobicContact CG-CD2 4.14Å; P394-F407 HydrophobicContact CG-CE2 4.43Å; P394-F407 HydrophobicContact CG-CG 4.17Å; P394-F407 VanDerWaalsContact O-CD1 3.22Å; P394-F407 WeakPolarHBondContact O-CD1 3.26Å; P394-F407 PolarHBondContact O-N 2.86Å
395	T	97.5	Very high	95	Very high	41 Å²	41	78.4 Å²	78.4	25%	0.252	38%	0.376	S	S	.	.	B	Isolated β-bridge	trans	-120	135.1	-177.1	-52.9	0	0	0	0	109.8	Q393 G404	Q393-T395 PolarHBondContact O-N 3.11Å; Q393-T395 PolarHBondContact O-OG1 2.73Å; T395-G404 VanDerWaalsContact CG2-C 3.46Å; T395-G404 WeakPolarHBondContact CG2-O 3.37Å
396	C	98.2	Very high	95.3	Very high	2 Å²	2	72.8 Å²	72.8	1%	0.014	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	131.8	178.7	-60.9	0	0	0	0	111.2	C373 V402 Q403 G404 K405	C373-C396 HydrophobicContact CB-CB 3.82Å; C373-C396 WeakPolarHBondContact CB-SG 3.47Å; C373-C396 WeakPolarHBondContact SG-CA 3.45Å; C373-C396 WeakPolarHBondContact SG-CB 3.29Å; C373-C396 CovalentContact SG-SG 2.02Å; C373-C396 PolarHBondContact SG-SG 2.82Å; C396-V402 HydrophobicContact CB-CB 4.35Å; C396-V402 HydrophobicContact CB-CG2 3.91Å; C396-V402 WeakPolarHBondContact CB-O 3.41Å; C396-Q403 CarbonylContact O-C 3.54Å; C396-Q403 WeakPolarHBondContact O-CA 3.32Å; C396-G404 PolarHBondContact O-N 2.89Å; C396-K405 PolarHBondContact N-O 3.18Å
397	A	98.1	Very high	95.4	Very high	30 Å²	30	62.8 Å²	62.8	25%	0.248	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	-37.2	168.3	0	0	0	0	0	111.6	P370 L371 Q403	P370-A397 HydrophobicContact CB-CB 4.06Å; L371-A397 PolarHBondContact O-N 2.02Å; A397-Q403 WeakPolarHBondContact O-CG 3.13Å
398	T	96.8	Very high	95.5	Very high	72 Å²	72	67.5 Å²	67.5	44%	0.442	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	154.8	174.1	53.9	0	0	0	0	109.8	L371 A372 C373	L371-T398 PolarHBondContact O-N 3.2Å; L371-T398 VanDerWaalsContact O-N 3.13Å; A372-T398 VanDerWaalsContact CA-OG1 3.23Å; A372-T398 WeakPolarHBondContact CA-OG1 3.38Å; A372-T398 VanDerWaalsContact CB-OG1 3.29Å; A372-T398 WeakPolarHBondContact CB-OG1 3.17Å; C373-T398 PolarHBondContact N-O 3.09Å
399	P	96.3	Very high	95.6	Very high	46 Å²	46	67.7 Å²	67.7	30%	0.299	34%	0.34	S	S	.	.	S	Bend	cis	-70.9	164.3	-6.1	29.8	-35.8	0	0	0	113.5	F401 V402 Q403	P399-F401 VanDerWaalsContact C-N 3.25Å; P399-F401 HydrophobicContact CB-CD1 3.79Å; P399-F401 HydrophobicContact CB-CE1 3.49Å; P399-F401 VanDerWaalsContact CB-CE1 3.49Å; P399-F401 HydrophobicContact CB-CZ 4.35Å; P399-F401 HydrophobicContact CG-CD1 3.73Å; P399-F401 HydrophobicContact CG-CE1 3.07Å; P399-F401 HydrophobicContact CG-CE2 4.39Å; P399-F401 HydrophobicContact CG-CZ 3.45Å; P399-F401 VanDerWaalsContact CG-CZ 3.45Å; P399-F401 PolarHBondContact O-N 3.13Å; P399-F401 VanDerWaalsContact O-N 3.12Å; P399-V402 HydrophobicContact CG-CG2 3.92Å; P399-V402 VanDerWaalsContact O-CG2 3.3Å; P399-V402 WeakPolarHBondContact O-CG2 3.43Å; P399-V402 PolarHBondContact O-N 3.41Å; P399-Q403 PolarHBondContact O-N 2.81Å
400	E	95.4	Very high	95.9	Very high	166 Å²	166	68 Å²	68	78%	0.776	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-52.2	-37.6	-171.7	-171.3	176	-177.4	0	0	113.8	V402 Q403	E400-V402 PolarHBondContact O-N 3.16Å; E400-Q403 WeakPolarHBondContact O-CB 3.18Å; E400-Q403 PolarHBondContact O-N 3.31Å
401	F	96	Very high	96.1	Very high	125 Å²	125	64.7 Å²	64.7	55%	0.548	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-71	-9.5	-178.4	69.3	-89.8	0	0	0	115.1	P399 N417 Y418	P399-F401 VanDerWaalsContact C-N 3.25Å; P399-F401 HydrophobicContact CB-CD1 3.79Å; P399-F401 HydrophobicContact CB-CE1 3.49Å; P399-F401 VanDerWaalsContact CB-CE1 3.49Å; P399-F401 HydrophobicContact CB-CZ 4.35Å; P399-F401 HydrophobicContact CG-CD1 3.73Å; P399-F401 HydrophobicContact CG-CE1 3.07Å; P399-F401 HydrophobicContact CG-CE2 4.39Å; P399-F401 HydrophobicContact CG-CZ 3.45Å; P399-F401 VanDerWaalsContact CG-CZ 3.45Å; P399-F401 PolarHBondContact O-N 3.13Å; P399-F401 VanDerWaalsContact O-N 3.12Å; F401-N417 HydrophobicContact CZ-CB 4.01Å; F401-Y418 HydrophobicContact CD2-CE1 4.12Å; F401-Y418 AromaticContact CE2-CD1 3.71Å; F401-Y418 HydrophobicContact CE2-CD1 3.71Å; F401-Y418 AromaticContact CE2-CE1 3.62Å; F401-Y418 HydrophobicContact CE2-CE1 3.62Å
402	V	96.6	Very high	96.2	Very high	5 Å²	5	59.2 Å²	59.2	3%	0.03	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-121.1	13.1	172.5	-65.7	0	0	0	0	112.4	C373 C396 P399 E400 G404 K405 F410 Y418	C373-V402 HydrophobicContact CB-CG2 4.42Å; C396-V402 HydrophobicContact CB-CB 4.35Å; C396-V402 HydrophobicContact CB-CG2 3.91Å; C396-V402 WeakPolarHBondContact CB-O 3.41Å; P399-V402 HydrophobicContact CG-CG2 3.92Å; P399-V402 VanDerWaalsContact O-CG2 3.3Å; P399-V402 WeakPolarHBondContact O-CG2 3.43Å; P399-V402 PolarHBondContact O-N 3.41Å; E400-V402 PolarHBondContact O-N 3.16Å; V402-G404 PolarHBondContact O-N 2.94Å; V402-K405 HydrophobicContact CB-CB 4.38Å; V402-K405 WeakPolarHBondContact O-CB 3.42Å; V402-K405 PolarHBondContact O-N 3.04Å; V402-F410 HydrophobicContact CB-CE1 4.42Å; V402-F410 HydrophobicContact CB-CZ 4.09Å; V402-F410 HydrophobicContact CG1-CE1 3.85Å; V402-F410 HydrophobicContact CG1-CZ 4.03Å; V402-Y418 HydrophobicContact CG1-CD1 3.88Å; V402-Y418 HydrophobicContact CG1-CE1 3.43Å; V402-Y418 VanDerWaalsContact CG1-CE1 3.43Å
403	Q	96.8	Very high	96.2	Very high	135 Å²	135	61.2 Å²	61.2	63%	0.631	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	131	-179.5	-175.5	176.1	-3.1	0	0	111	C396 A397 P399 E400 K405	C396-Q403 CarbonylContact O-C 3.54Å; C396-Q403 WeakPolarHBondContact O-CA 3.32Å; A397-Q403 WeakPolarHBondContact O-CG 3.13Å; P399-Q403 PolarHBondContact O-N 2.81Å; E400-Q403 WeakPolarHBondContact O-CB 3.18Å; E400-Q403 PolarHBondContact O-N 3.31Å; Q403-K405 PolarHBondContact O-N 3.15Å
404	G	96.2	Very high	96.1	Very high	52 Å²	52	63 Å²	63	54%	0.536	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.6	-1	-177.6	0	0	0	0	0	114.9	T395 C396 V402	T395-G404 VanDerWaalsContact CG2-C 3.46Å; T395-G404 WeakPolarHBondContact CG2-O 3.37Å; C396-G404 PolarHBondContact O-N 2.89Å; V402-G404 PolarHBondContact O-N 2.94Å
405	K	97.1	Very high	96	Very high	52 Å²	52	67.9 Å²	67.9	23%	0.226	37%	0.368	C	S	.	.			trans	-81.4	130.7	-179.4	-166.5	168.6	-180	171.4	0	111.3	C396 V402 Q403 D409 F410	C396-K405 PolarHBondContact N-O 3.18Å; V402-K405 HydrophobicContact CB-CB 4.38Å; V402-K405 WeakPolarHBondContact O-CB 3.42Å; V402-K405 PolarHBondContact O-N 3.04Å; Q403-K405 PolarHBondContact O-N 3.15Å; K405-D409 HydrophobicContact CD-CB 4.48Å; K405-D409 VanDerWaalsContact CE-C 3.47Å; K405-D409 WeakPolarHBondContact CE-O 3.45Å; K405-D409 HydrophobicContact CG-CB 3.89Å; K405-D409 PolarHBondContact NZ-O 2.92Å; K405-F410 HydrophobicContact CB-CE2 4.29Å; K405-F410 HydrophobicContact CB-CZ 4.29Å; K405-F410 HydrophobicContact CD-CD1 4.43Å; K405-F410 HydrophobicContact CD-CD2 4.43Å; K405-F410 HydrophobicContact CD-CE1 4.05Å; K405-F410 HydrophobicContact CD-CE2 4.07Å; K405-F410 HydrophobicContact CD-CZ 3.86Å; K405-F410 HydrophobicContact CG-CD2 4.37Å; K405-F410 HydrophobicContact CG-CE2 3.88Å; K405-F410 HydrophobicContact CG-CZ 4.07Å
406	E	97.3	Very high	95.7	Very high	54 Å²	54	71 Å²	71	25%	0.252	39%	0.389	S	S	.	.	B	Isolated β-bridge	trans	-83.3	155	176.5	-65.6	-178.3	-169.5	0	0	111.6	Q393 P394 K408 D409 F410	Q393-E406 HydrophobicContact CB-CB 3.9Å; Q393-E406 HydrophobicContact CB-CG 3.98Å; Q393-E406 WeakPolarHBondContact CB-OE2 2.97Å; Q393-E406 HydrophobicContact CG-CB 4.5Å; Q393-E406 WeakPolarHBondContact CG-OE2 3.28Å; P394-E406 WeakPolarHBondContact O-CA 3.05Å; E406-K408 HydrophobicContact CB-CG 4.19Å; E406-K408 PolarHBondContact O-N 3.41Å; E406-K408 IonicContact OE1-NZ 3.78Å; E406-K408 WeakPolarHBondContact OE2-CE 3.44Å; E406-K408 IonicContact OE2-NZ 3.97Å; E406-K408 PolarHBondContact OE2-NZ 2.88Å; E406-D409 WeakPolarHBondContact CB-OD2 3.47Å; E406-D409 PolarHBondContact N-OD2 3.01Å; E406-D409 WeakPolarHBondContact O-CB 3.49Å; E406-D409 PolarHBondContact O-N 3.34Å; E406-F410 VanDerWaalsContact O-CD2 3.28Å; E406-F410 WeakPolarHBondContact O-CD2 3.42Å; E406-F410 WeakPolarHBondContact O-CE2 3.38Å
407	F	97	Very high	95.4	Very high	0 Å²	0	76 Å²	76	0%	0	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-60.1	-30.3	-178.5	-86.7	35.5	0	0	0	113.8	L377 V380 F381 F389 P394 D409 F419	L377-F407 HydrophobicContact CB-CZ 4.37Å; L377-F407 HydrophobicContact CD1-CZ 4.34Å; V380-F407 HydrophobicContact CB-CE2 4.12Å; V380-F407 HydrophobicContact CG1-CD2 4.36Å; V380-F407 HydrophobicContact CG1-CE2 3.8Å; F381-F407 HydrophobicContact CB-CD2 4.36Å; F381-F407 HydrophobicContact CB-CE2 4.16Å; F381-F407 HydrophobicContact CD2-CD2 4.2Å; F389-F407 HydrophobicContact CE2-CD2 4.37Å; P394-F407 HydrophobicContact CB-CD1 3.8Å; P394-F407 HydrophobicContact CB-CD2 4.21Å; P394-F407 HydrophobicContact CB-CE1 3.85Å; P394-F407 HydrophobicContact CB-CE2 4.27Å; P394-F407 HydrophobicContact CB-CG 3.99Å; P394-F407 HydrophobicContact CB-CZ 4.09Å; P394-F407 HydrophobicContact CG-CD1 4.49Å; P394-F407 HydrophobicContact CG-CD2 4.14Å; P394-F407 HydrophobicContact CG-CE2 4.43Å; P394-F407 HydrophobicContact CG-CG 4.17Å; P394-F407 VanDerWaalsContact O-CD1 3.22Å; P394-F407 WeakPolarHBondContact O-CD1 3.26Å; P394-F407 PolarHBondContact O-N 2.86Å; F407-D409 PolarHBondContact O-N 3.11Å; F407-F419 HydrophobicContact CD1-CZ 4.34Å; F407-F419 HydrophobicContact CE1-CE1 4.1Å; F407-F419 AromaticContact CE1-CZ 3.91Å; F407-F419 HydrophobicContact CE1-CZ 3.91Å; F407-F419 HydrophobicContact CE2-CE1 4.23Å; F407-F419 HydrophobicContact CE2-CZ 4.24Å; F407-F419 AromaticContact CZ-CE1 3.7Å; F407-F419 HydrophobicContact CZ-CE1 3.7Å; F407-F419 AromaticContact CZ-CZ 3.85Å; F407-F419 HydrophobicContact CZ-CZ 3.85Å
408	K	95.4	Very high	95.3	Very high	100 Å²	100	76.6 Å²	76.6	44%	0.435	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-68.1	-21.6	175.9	72	178.4	-171.1	-139	0	113.6	W385 Q393 E406 F410	W385-K408 HydrophobicContact CH2-CB 4.32Å; Q393-K408 HydrophobicContact CG-CD 4.05Å; Q393-K408 HydrophobicContact CG-CG 4.3Å; E406-K408 HydrophobicContact CB-CG 4.19Å; E406-K408 PolarHBondContact O-N 3.41Å; E406-K408 IonicContact OE1-NZ 3.78Å; E406-K408 WeakPolarHBondContact OE2-CE 3.44Å; E406-K408 IonicContact OE2-NZ 3.97Å; E406-K408 PolarHBondContact OE2-NZ 2.88Å; K408-F410 VanDerWaalsContact C-N 3.33Å
409	D	96	Very high	95.3	Very high	84 Å²	84	73.4 Å²	73.4	45%	0.449	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-88	-3.7	-174.1	-56.6	-34.5	0	0	0	112.9	K405 E406 F407	K405-D409 HydrophobicContact CD-CB 4.48Å; K405-D409 VanDerWaalsContact CE-C 3.47Å; K405-D409 WeakPolarHBondContact CE-O 3.45Å; K405-D409 HydrophobicContact CG-CB 3.89Å; K405-D409 PolarHBondContact NZ-O 2.92Å; E406-D409 WeakPolarHBondContact CB-OD2 3.47Å; E406-D409 PolarHBondContact N-OD2 3.01Å; E406-D409 WeakPolarHBondContact O-CB 3.49Å; E406-D409 PolarHBondContact O-N 3.34Å; F407-D409 PolarHBondContact O-N 3.11Å
410	F	96.4	Very high	95.3	Very high	9 Å²	9	74.5 Å²	74.5	4%	0.039	40%	0.398	C	S	.	.	S	Bend	trans	-84.2	143.2	174.5	-70.6	-91.3	0	0	0	110.9	F381 V402 K405 E406 K408 Y418 F419	F381-F410 HydrophobicContact CE2-CB 3.55Å; F381-F410 HydrophobicContact CE2-CD2 4.41Å; F381-F410 HydrophobicContact CE2-CG 4.15Å; F381-F410 HydrophobicContact CZ-CB 3.82Å; V402-F410 HydrophobicContact CB-CE1 4.42Å; V402-F410 HydrophobicContact CB-CZ 4.09Å; V402-F410 HydrophobicContact CG1-CE1 3.85Å; V402-F410 HydrophobicContact CG1-CZ 4.03Å; K405-F410 HydrophobicContact CB-CE2 4.29Å; K405-F410 HydrophobicContact CB-CZ 4.29Å; K405-F410 HydrophobicContact CD-CD1 4.43Å; K405-F410 HydrophobicContact CD-CD2 4.43Å; K405-F410 HydrophobicContact CD-CE1 4.05Å; K405-F410 HydrophobicContact CD-CE2 4.07Å; K405-F410 HydrophobicContact CD-CZ 3.86Å; K405-F410 HydrophobicContact CG-CD2 4.37Å; K405-F410 HydrophobicContact CG-CE2 3.88Å; K405-F410 HydrophobicContact CG-CZ 4.07Å; E406-F410 VanDerWaalsContact O-CD2 3.28Å; E406-F410 WeakPolarHBondContact O-CD2 3.42Å; E406-F410 WeakPolarHBondContact O-CE2 3.38Å; K408-F410 VanDerWaalsContact C-N 3.33Å; F410-Y418 HydrophobicContact CD1-CD1 4.36Å; F410-Y418 AromaticContact CD1-CD2 3.84Å; F410-Y418 HydrophobicContact CD1-CD2 3.84Å; F410-Y418 HydrophobicContact CD1-CE1 4.46Å; F410-Y418 AromaticContact CD1-CE2 3.93Å; F410-Y418 HydrophobicContact CD1-CE2 3.93Å; F410-Y418 HydrophobicContact CD1-CG 4.07Å; F410-Y418 AromaticContact CE1-CD1 3.93Å; F410-Y418 HydrophobicContact CE1-CD1 3.93Å; F410-Y418 HydrophobicContact CE1-CD2 4.25Å; F410-Y418 HydrophobicContact CE1-CE1 4.04Å; F410-Y418 HydrophobicContact CE1-CE2 4.33Å; F410-Y418 HydrophobicContact CE1-CG 4.06Å; F410-F419 HydrophobicContact CD1-CE2 4.13Å; F410-F419 HydrophobicContact CD2-CE2 4.36Å; F410-F419 HydrophobicContact CE1-CE2 4.09Å; F410-F419 HydrophobicContact CE2-CE2 4.33Å; F410-F419 HydrophobicContact CE2-CZ 4.35Å; F410-F419 HydrophobicContact CG-CE2 4.25Å; F410-F419 HydrophobicContact CZ-CE2 4.19Å; F410-F419 HydrophobicContact CZ-CZ 4.41Å
411	P	95.4	Very high	95.4	Very high	54 Å²	54	68 Å²	68	35%	0.351	37%	0.37	S	S	.	.			trans	-66	154.4	175.4	29.2	-35.1	0	0	0	111.3	V413 Y418	P411-V413 VanDerWaalsContact C-N 3.27Å; P411-V413 WeakPolarHBondContact CG-O 3.38Å; P411-V413 PolarHBondContact O-N 2.75Å; P411-Y418 HydrophobicContact CG-CE2 4.4Å
412	D	91.5	Very high	95.4	Very high	119 Å²	119	68.1 Å²	68.1	64%	0.636	37%	0.367	S	S	*	.	S	Bend	trans	-62.4	-36.2	176.7	-66.4	-37.7	0	0	0	112.5	R384	R384-D412 IonicContact CZ-OD1 3.07Å; R384-D412 IonicContact NH2-OD1 3.97Å; R384-D412 PolarHBondContact NH2-OD1 2.98Å
413	V	93.5	Very high	95.3	Very high	123 Å²	123	74 Å²	74	75%	0.745	39%	0.389	S	S	*	.	S	Bend	trans	-93	110.1	171.8	-177.2	0	0	0	0	108.6	P411 L415	P411-V413 VanDerWaalsContact C-N 3.27Å; P411-V413 WeakPolarHBondContact CG-O 3.38Å; P411-V413 PolarHBondContact O-N 2.75Å; V413-L415 PolarHBondContact O-N 2.7Å
414	L	94.4	Very high	95.3	Very high	55 Å²	55	67.6 Å²	67.6	29%	0.288	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-68.1	125.5	-179.5	-70.7	178.3	0	0	0	111.3	L378 F381 Y418 F419	L378-L414 HydrophobicContact CD1-CD1 3.64Å; F381-L414 HydrophobicContact CD1-CD1 3.93Å; F381-L414 HydrophobicContact CD1-CD2 4.12Å; F381-L414 HydrophobicContact CD1-CG 4.3Å; F381-L414 HydrophobicContact CE1-CD1 3.82Å; F381-L414 HydrophobicContact CE1-CD2 3.4Å; F381-L414 VanDerWaalsContact CE1-CD2 3.4Å; F381-L414 HydrophobicContact CE1-CG 3.67Å; F381-L414 HydrophobicContact CZ-CD2 3.65Å; F381-L414 HydrophobicContact CZ-CG 4.36Å; L414-Y418 HydrophobicContact CD2-CD2 4.24Å; L414-F419 HydrophobicContact CD1-CB 4.46Å; L414-F419 HydrophobicContact CD1-CD2 4.26Å; L414-F419 HydrophobicContact CD2-CD2 4.04Å; L414-F419 HydrophobicContact CD2-CE2 4.47Å
415	L	93.6	Very high	95.4	Very high	101 Å²	101	73.6 Å²	73.6	53%	0.529	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-68.5	158.8	168.7	-66.6	168.5	0	0	0	110.6	V413 Y418	V413-L415 PolarHBondContact O-N 2.7Å; L415-Y418 HydrophobicContact CB-CD2 3.98Å; L415-Y418 HydrophobicContact CB-CE2 4.08Å; L415-Y418 HydrophobicContact CD1-CE2 3.99Å; L415-Y418 HydrophobicContact CG-CE2 4.37Å; L415-Y418 PolarHBondContact O-N 2.64Å
416	P	91.6	Very high	95.3	Very high	106 Å²	106	71.5 Å²	71.5	69%	0.688	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	143.5	170	-24.6	34.2	0	0	0	111.4	Y418	P416-Y418 VanDerWaalsContact C-N 3.3Å; P416-Y418 PolarHBondContact O-N 3.3Å
417	N	91.8	Very high	95.1	Very high	109 Å²	109	76.8 Å²	76.8	58%	0.583	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	-10	-177.8	-46	-40	0	0	0	116.7	F401 T420	F401-N417 HydrophobicContact CZ-CB 4.01Å; N417-T420 WeakPolarHBondContact CA-OG1 3.47Å; N417-T420 PolarHBondContact O-OG1 3.23Å
418	Y	96.1	Very high	94.9	Very high	41 Å²	41	81 Å²	81	16%	0.161	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	125.7	170.5	-69.5	-22	0	0	0	111.5	F401 V402 F410 P411 L414 L415 P416 T420	F401-Y418 HydrophobicContact CD2-CE1 4.12Å; F401-Y418 AromaticContact CE2-CD1 3.71Å; F401-Y418 HydrophobicContact CE2-CD1 3.71Å; F401-Y418 AromaticContact CE2-CE1 3.62Å; F401-Y418 HydrophobicContact CE2-CE1 3.62Å; V402-Y418 HydrophobicContact CG1-CD1 3.88Å; V402-Y418 HydrophobicContact CG1-CE1 3.43Å; V402-Y418 VanDerWaalsContact CG1-CE1 3.43Å; F410-Y418 HydrophobicContact CD1-CD1 4.36Å; F410-Y418 AromaticContact CD1-CD2 3.84Å; F410-Y418 HydrophobicContact CD1-CD2 3.84Å; F410-Y418 HydrophobicContact CD1-CE1 4.46Å; F410-Y418 AromaticContact CD1-CE2 3.93Å; F410-Y418 HydrophobicContact CD1-CE2 3.93Å; F410-Y418 HydrophobicContact CD1-CG 4.07Å; F410-Y418 AromaticContact CE1-CD1 3.93Å; F410-Y418 HydrophobicContact CE1-CD1 3.93Å; F410-Y418 HydrophobicContact CE1-CD2 4.25Å; F410-Y418 HydrophobicContact CE1-CE1 4.04Å; F410-Y418 HydrophobicContact CE1-CE2 4.33Å; F410-Y418 HydrophobicContact CE1-CG 4.06Å; P411-Y418 HydrophobicContact CG-CE2 4.4Å; L414-Y418 HydrophobicContact CD2-CD2 4.24Å; L415-Y418 HydrophobicContact CB-CD2 3.98Å; L415-Y418 HydrophobicContact CB-CE2 4.08Å; L415-Y418 HydrophobicContact CD1-CE2 3.99Å; L415-Y418 HydrophobicContact CG-CE2 4.37Å; L415-Y418 PolarHBondContact O-N 2.64Å; P416-Y418 VanDerWaalsContact C-N 3.3Å; P416-Y418 PolarHBondContact O-N 3.3Å; Y418-T420 PolarHBondContact O-N 3.03Å
419	F	96.6	Very high	94.7	Very high	6 Å²	6	83.3 Å²	83.3	3%	0.026	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	41.2	180	-60.8	-85.2	0	0	0	113	C373 D374 C375 L377 L378 F381 F407 F410 L414	C373-F419 HydrophobicContact CB-CD1 4.3Å; C373-F419 HydrophobicContact CB-CE1 3.86Å; C373-F419 HydrophobicContact CB-CZ 4.25Å; C373-F419 WeakPolarHBondContact O-CA 3.43Å; C373-F419 PolarHBondContact O-N 3.42Å; D374-F419 WeakPolarHBondContact O-CD1 3.2Å; C375-F419 WeakPolarHBondContact CA-O 3.36Å; C375-F419 WeakPolarHBondContact CB-O 3.48Å; C375-F419 PolarHBondContact N-O 3.01Å; L377-F419 HydrophobicContact CB-CD1 4.22Å; L377-F419 HydrophobicContact CB-CE1 4.11Å; L378-F419 HydrophobicContact CB-CB 4.36Å; L378-F419 HydrophobicContact CD1-CB 3.9Å; L378-F419 HydrophobicContact CD1-CG 4.5Å; F381-F419 HydrophobicContact CB-CD1 4.43Å; F381-F419 HydrophobicContact CB-CD2 4.46Å; F381-F419 HydrophobicContact CB-CE1 4.12Å; F381-F419 HydrophobicContact CB-CE2 4.15Å; F381-F419 HydrophobicContact CB-CZ 3.97Å; F381-F419 HydrophobicContact CD1-CD2 4.39Å; F381-F419 HydrophobicContact CD1-CE2 4.35Å; F381-F419 HydrophobicContact CD2-CD2 4.42Å; F381-F419 AromaticContact CD2-CE2 3.62Å; F381-F419 HydrophobicContact CD2-CE2 3.62Å; F381-F419 AromaticContact CD2-CZ 3.82Å; F381-F419 HydrophobicContact CD2-CZ 3.82Å; F381-F419 HydrophobicContact CE2-CE2 4.15Å; F381-F419 HydrophobicContact CG-CD2 4.13Å; F381-F419 AromaticContact CG-CE2 3.74Å; F381-F419 HydrophobicContact CG-CE2 3.74Å; F381-F419 AromaticContact CG-CZ 4Å; F381-F419 HydrophobicContact CG-CZ 4Å; F407-F419 HydrophobicContact CD1-CZ 4.34Å; F407-F419 HydrophobicContact CE1-CE1 4.1Å; F407-F419 AromaticContact CE1-CZ 3.91Å; F407-F419 HydrophobicContact CE1-CZ 3.91Å; F407-F419 HydrophobicContact CE2-CE1 4.23Å; F407-F419 HydrophobicContact CE2-CZ 4.24Å; F407-F419 AromaticContact CZ-CE1 3.7Å; F407-F419 HydrophobicContact CZ-CE1 3.7Å; F407-F419 AromaticContact CZ-CZ 3.85Å; F407-F419 HydrophobicContact CZ-CZ 3.85Å; F410-F419 HydrophobicContact CD1-CE2 4.13Å; F410-F419 HydrophobicContact CD2-CE2 4.36Å; F410-F419 HydrophobicContact CE1-CE2 4.09Å; F410-F419 HydrophobicContact CE2-CE2 4.33Å; F410-F419 HydrophobicContact CE2-CZ 4.35Å; F410-F419 HydrophobicContact CG-CE2 4.25Å; F410-F419 HydrophobicContact CZ-CE2 4.19Å; F410-F419 HydrophobicContact CZ-CZ 4.41Å; L414-F419 HydrophobicContact CD1-CB 4.46Å; L414-F419 HydrophobicContact CD1-CD2 4.26Å; L414-F419 HydrophobicContact CD2-CD2 4.04Å; L414-F419 HydrophobicContact CD2-CE2 4.47Å
420	T	96.3	Very high	94.5	Very high	68 Å²	68	87.1 Å²	87.1	42%	0.417	42%	0.415	S	S	.	.			trans	-106.3	151.9	177.4	55.8	0	0	0	0	111.3	N417 Y418	N417-T420 WeakPolarHBondContact CA-OG1 3.47Å; N417-T420 PolarHBondContact O-OG1 3.23Å; Y418-T420 PolarHBondContact O-N 3.03Å
421	C	96.9	Very high	94.1	Very high	29 Å²	29	89.2 Å²	89.2	20%	0.196	43%	0.434	C	S	.	.			trans	-118.9	149.8	169.8	-67.3	0	0	0	0	110.1	C375 D451	C375-C421 HydrophobicContact CB-CB 3.86Å; C375-C421 WeakPolarHBondContact CB-SG 3.24Å; C375-C421 PolarHBondContact N-SG 3.07Å; C375-C421 WeakPolarHBondContact SG-CB 3.23Å; C375-C421 CovalentContact SG-SG 2.02Å; C375-C421 PolarHBondContact SG-SG 3.19Å; C421-D451 CarbonylContact C-O 3.51Å; C421-D451 WeakPolarHBondContact CA-O 3.45Å; C421-D451 VanDerWaalsContact CB-O 3.28Å; C421-D451 WeakPolarHBondContact CB-O 3.15Å
422	R	96.3	Very high	94	Very high	128 Å²	128	88.7 Å²	88.7	48%	0.483	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	112.2	169.4	-172.5	171.7	61.2	84.1	-1.5	109	G450 D451 N501	R422-G450 VanDerWaalsContact NH2-C 3.29Å; R422-G450 PolarHBondContact NH2-O 2.98Å; R422-G450 VanDerWaalsContact NH2-O 3.13Å; R422-G450 WeakPolarHBondContact O-CA 3.42Å; R422-D451 HydrophobicContact CB-CB 3.84Å; R422-D451 PolarHBondContact N-O 2.84Å; R422-D451 PolarHBondContact O-N 2.72Å; R422-N501 PolarHBondContact O-ND2 2.91Å
423	R	96	Very high	94.2	Very high	129 Å²	129	88.4 Å²	88.4	49%	0.487	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-49.9	138.1	179.9	-179.2	171.8	177.6	149.7	-0.9	112.1	R425 G503 N505	R423-R425 PolarHBondContact O-N 2.88Å; R423-G503 WeakPolarHBondContact CB-O 3.31Å; R423-N505 VanDerWaalsContact CZ-O 3.27Å; R423-N505 PolarHBondContact NE-O 3.07Å; R423-N505 PolarHBondContact NH2-O 2.9Å
424	A	97.1	Very high	94.2	Very high	0 Å²	0	84.7 Å²	84.7	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	131.2	172.3	0	0	0	0	0	111.3	D449 P454 A499 N501 D506	A424-D449 CarbonylContact C-O 3.46Å; A424-D449 WeakPolarHBondContact CA-O 3.39Å; A424-P454 HydrophobicContact CB-CB 3.72Å; A424-P454 HydrophobicContact CB-CG 4.45Å; A424-A499 HydrophobicContact CB-CB 4.31Å; A424-N501 HydrophobicContact CB-CB 4.47Å; A424-N501 PolarHBondContact N-OD1 3.49Å; A424-N501 VanDerWaalsContact N-OD1 3.09Å; A424-D506 WeakPolarHBondContact O-CB 3.46Å
425	R	96.6	Very high	94.2	Very high	179 Å²	179	87.2 Å²	87.2	68%	0.675	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.1	127.9	175.9	-70.9	-174.3	-178.4	177.3	0.8	110.5	R423 A448 D449 D506	R423-R425 PolarHBondContact O-N 2.88Å; R425-A448 CarbonylContact O-C 3.58Å; R425-A448 VanDerWaalsContact O-CA 3.23Å; R425-A448 WeakPolarHBondContact O-CA 3.48Å; R425-A448 WeakPolarHBondContact O-CB 3.47Å; R425-D449 PolarHBondContact N-O 3Å; R425-D449 PolarHBondContact O-N 2.96Å; R425-D506 WeakPolarHBondContact CA-OD2 3.36Å
426	I	96.1	Very high	94.3	Very high	8 Å²	8	83.1 Å²	83.1	4%	0.041	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	123.6	173	-59.7	171.7	0	0	0	107.8	R429 A448 C497 A499 D506 M508	I426-R429 WeakPolarHBondContact O-CD 3.37Å; I426-A448 HydrophobicContact CG1-CB 4.18Å; I426-C497 HydrophobicContact CD1-CB 4.44Å; I426-A499 HydrophobicContact CD1-CB 4.3Å; I426-A499 HydrophobicContact CG1-CB 3.82Å; I426-D506 HydrophobicContact CG1-CB 4.39Å; I426-D506 PolarHBondContact N-OD2 2.74Å; I426-M508 HydrophobicContact CD1-CB 3.68Å; I426-M508 HydrophobicContact CG2-CB 4.17Å
427	R	93.4	Very high	94.3	Very high	164 Å²	164	81.1 Å²	81.1	62%	0.619	37%	0.371	S	S	*	.	S	Bend	trans	-65.5	-53.6	-171.6	-70.4	-173.6	176.6	-170.5	-2.3	112.3	R447 D449	R427-R447 PolarHBondContact N-O 3.11Å; R427-D449 IonicContact CZ-OD1 2.81Å; R427-D449 VanDerWaalsContact CZ-OD1 3.31Å; R427-D449 IonicContact CZ-OD2 3.31Å; R427-D449 IonicContact NE-OD1 3.92Å; R427-D449 PolarHBondContact NE-OD1 3.15Å; R427-D449 IonicContact NE-OD2 3.79Å; R427-D449 PolarHBondContact NE-OD2 3.49Å; R427-D449 IonicContact NH2-OD1 2.61Å; R427-D449 PolarHBondContact NH2-OD1 2.81Å; R427-D449 IonicContact NH2-OD2 3.01Å; R427-D449 PolarHBondContact NH2-OD2 3.13Å
428	D	91.7	Very high	94.4	Very high	90 Å²	90	80.4 Å²	80.4	48%	0.481	36%	0.364	S	S	.	.			trans	-82.8	122.8	179.9	-170.1	1.1	0	0	0	109.6	K430	D428-K430 WeakPolarHBondContact OD1-CB 3.45Å; D428-K430 PolarHBondContact OD1-N 2.96Å
429	R	92.1	Very high	94.1	Very high	148 Å²	148	80.2 Å²	80.2	56%	0.558	37%	0.374	S	S	*	.			trans	-100.9	1.6	-180	-56.3	-62.6	-71.4	-175.7	-3.6	112.7	I426 D506 M508	I426-R429 WeakPolarHBondContact O-CD 3.37Å; R429-D506 IonicContact CZ-OD1 3.76Å; R429-D506 IonicContact CZ-OD2 2.82Å; R429-D506 IonicContact NH1-OD1 2.76Å; R429-D506 PolarHBondContact NH1-OD1 3.28Å; R429-D506 IonicContact NH1-OD2 3.97Å; R429-D506 PolarHBondContact NH1-OD2 2.96Å; R429-D506 IonicContact NH2-OD1 3.76Å; R429-M508 HydrophobicContact CB-CE 4.22Å; R429-M508 HydrophobicContact CG-CE 4.46Å
430	K	91.2	Very high	94	Very high	163 Å²	163	85.1 Å²	85.1	71%	0.709	40%	0.397	S	S	*	.	S	Bend	trans	-80.6	126.4	176.9	-168.3	176.6	-179.9	-178.6	0	109.8	D428 Q432	D428-K430 WeakPolarHBondContact OD1-CB 3.45Å; D428-K430 PolarHBondContact OD1-N 2.96Å; K430-Q432 PolarHBondContact O-N 3.45Å
431	A	87.3	Confident	94	Very high	54 Å²	54	85.1 Å²	85.1	45%	0.446	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-60.7	124.7	173.7	0	0	0	0	0	109.8
432	Q	93.9	Very high	94	Very high	42 Å²	42	84.4 Å²	84.4	20%	0.196	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	132.7	174.8	-77.3	169.1	70.1	0	0	109.1	K430 F444 V445 A510 H511	K430-Q432 PolarHBondContact O-N 3.45Å; Q432-F444 HydrophobicContact CB-CD1 4.12Å; Q432-V445 PolarHBondContact NE2-O 2.84Å; Q432-A510 HydrophobicContact CB-CB 4.08Å; Q432-A510 CarbonylContact O-C 3.52Å; Q432-A510 WeakPolarHBondContact O-CA 3.25Å; Q432-H511 PolarHBondContact O-N 3.43Å
433	Q	95.4	Very high	94	Very high	114 Å²	114	82.8 Å²	82.8	53%	0.533	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	120.8	175.5	-175	175.1	3.6	0	0	108.3	F435 H511 H513	Q433-F435 HydrophobicContact CG-CE2 4.05Å; Q433-F435 HydrophobicContact CG-CZ 4.44Å; Q433-H511 WeakPolarHBondContact CA-O 3.37Å; Q433-H511 HydrophobicContact CB-CB 4.39Å; Q433-H511 HydrophobicContact CG-CB 4.12Å; Q433-H513 PolarHBondContact NE2-NE2 2.83Å
434	V	94.9	Very high	94	Very high	44 Å²	44	76.7 Å²	76.7	27%	0.267	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	135.6	-176.7	-174.2	0	0	0	0	109.9	V442 F444 H511 H513	V434-V442 HydrophobicContact CB-CG2 4.01Å; V434-V442 HydrophobicContact CG1-CG2 3.49Å; V434-V442 VanDerWaalsContact CG1-CG2 3.49Å; V434-V442 HydrophobicContact CG2-CG2 4.38Å; V434-F444 HydrophobicContact CB-CE1 4.06Å; V434-F444 HydrophobicContact CB-CZ 4.43Å; V434-F444 HydrophobicContact CG2-CD1 4.28Å; V434-F444 HydrophobicContact CG2-CE1 3.72Å; V434-H511 PolarHBondContact N-O 3.15Å; V434-H513 PolarHBondContact O-N 2.87Å
435	F	94.6	Very high	94	Very high	109 Å²	109	79.5 Å²	79.5	48%	0.478	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	129.6	172.9	-62.8	-96.7	0	0	0	108.5	Q433 H513	Q433-F435 HydrophobicContact CG-CE2 4.05Å; Q433-F435 HydrophobicContact CG-CZ 4.44Å; F435-H513 WeakPolarHBondContact CA-O 3.37Å; F435-H513 HydrophobicContact CD1-CB 3.37Å; F435-H513 AromaticContact CD1-CD2 4Å; F435-H513 AromaticContact CD1-CG 3.87Å; F435-H513 HydrophobicContact CE1-CB 3.66Å; F435-H513 AromaticContact CE1-CD2 3.54Å; F435-H513 AromaticContact CE1-CG 3.62Å; F435-H513 HydrophobicContact CG-CB 4.07Å; F435-H513 AromaticContact CZ-CD2 3.62Å
436	V	94.7	Very high	93.9	Very high	15 Å²	15	71.1 Å²	71.1	9%	0.091	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	145.1	-175.8	72	0	0	0	0	110.3	H440 V442 A487 L512 H513 V514 R515	V436-H440 HydrophobicContact CG2-CB 3.56Å; V436-V442 HydrophobicContact CG2-CB 4.37Å; V436-A487 HydrophobicContact CG1-CB 3.81Å; V436-L512 HydrophobicContact CB-CD1 4.45Å; V436-L512 HydrophobicContact CG1-CD1 3.64Å; V436-L512 HydrophobicContact CG1-CG 4.43Å; V436-H513 PolarHBondContact N-O 3.06Å; V436-V514 HydrophobicContact CG1-CG2 3.99Å; V436-V514 CarbonylContact O-C 3.47Å; V436-V514 VanDerWaalsContact O-CA 3.31Å; V436-V514 WeakPolarHBondContact O-CA 3.33Å; V436-R515 PolarHBondContact O-N 3.09Å
437	D	92.6	Very high	93.9	Very high	63 Å²	63	78.2 Å²	78.2	34%	0.337	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	149.7	172.2	-62	-31.6	0	0	0	110.3	G439 H440 R515	D437-G439 PolarHBondContact O-N 3.13Å; D437-H440 WeakPolarHBondContact O-CB 3.23Å; D437-H440 PolarHBondContact O-N 3Å; D437-H440 VanDerWaalsContact O-N 3.15Å; D437-H440 PolarHBondContact O-ND1 2.97Å; D437-R515 WeakPolarHBondContact OD1-CB 3.31Å; D437-R515 WeakPolarHBondContact OD1-CD 3.19Å
438	E	92.7	Very high	94	Very high	95 Å²	95	71.3 Å²	71.3	44%	0.444	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	137.1	177	-174.1	168	-141.7	0	0	111.5	H440 A487 V514 R515	E438-H440 VanDerWaalsContact C-N 3.33Å; E438-H440 PolarHBondContact O-N 3.21Å; E438-A487 WeakPolarHBondContact CA-O 3.43Å; E438-V514 HydrophobicContact CB-CG1 4.34Å; E438-R515 PolarHBondContact N-O 3.03Å
439	G	90.8	Very high	94.2	Very high	36 Å²	36	69.6 Å²	69.6	37%	0.371	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.8	-11.4	-178.4	0	0	0	0	0	115.7	D437 Y486 A487	D437-G439 PolarHBondContact O-N 3.13Å; G439-Y486 WeakPolarHBondContact O-CD1 3.31Å; G439-A487 PolarHBondContact N-O 2.75Å
440	H	94.1	Very high	94.3	Very high	110 Å²	110	62.9 Å²	62.9	51%	0.509	33%	0.325	S	S	.	.			trans	-82.5	160.8	176.2	-70.1	73.5	0	0	0	112.4	V436 D437 E438 A487	V436-H440 HydrophobicContact CG2-CB 3.56Å; D437-H440 WeakPolarHBondContact O-CB 3.23Å; D437-H440 PolarHBondContact O-N 3Å; D437-H440 VanDerWaalsContact O-N 3.15Å; D437-H440 PolarHBondContact O-ND1 2.97Å; E438-H440 VanDerWaalsContact C-N 3.33Å; E438-H440 PolarHBondContact O-N 3.21Å; H440-A487 WeakPolarHBondContact O-CB 3.37Å; H440-A487 PolarHBondContact O-N 3.4Å
441	T	95.9	Very high	94.5	Very high	68 Å²	68	59.1 Å²	59.1	42%	0.417	31%	0.313	S	S	.	.			trans	-100	138.4	177.5	-61.5	0	0	0	0	110.3	E483 V484 R485	T441-E483 HydrophobicContact CG2-CG 3.76Å; T441-V484 WeakPolarHBondContact CA-O 3.41Å; T441-R485 HydrophobicContact CG2-CG 4.06Å
442	V	96.3	Very high	94.9	Very high	13 Å²	13	57.3 Å²	57.3	8%	0.079	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	154	-179.2	61.8	0	0	0	0	110.7	V434 V436 V484 L512	V434-V442 HydrophobicContact CB-CG2 4.01Å; V434-V442 HydrophobicContact CG1-CG2 3.49Å; V434-V442 VanDerWaalsContact CG1-CG2 3.49Å; V434-V442 HydrophobicContact CG2-CG2 4.38Å; V436-V442 HydrophobicContact CG2-CB 4.37Å; V442-V484 HydrophobicContact CG1-CB 3.73Å; V442-V484 HydrophobicContact CG1-CG1 4.47Å; V442-V484 HydrophobicContact CG1-CG2 4.17Å; V442-V484 PolarHBondContact N-O 3.2Å; V442-V484 VanDerWaalsContact N-O 3.07Å; V442-V484 PolarHBondContact O-N 2.93Å; V442-L512 HydrophobicContact CG1-CD1 3.78Å; V442-L512 HydrophobicContact CG1-CD2 4.28Å; V442-L512 HydrophobicContact CG2-CD1 4.32Å
443	Q	96.6	Very high	95	Very high	95 Å²	95	60.6 Å²	60.6	44%	0.444	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	145.5	179.9	-63	180	-3.5	0	0	111.9	T481 L482 E483	Q443-T481 HydrophobicContact CB-CG2 3.97Å; Q443-L482 CarbonylContact C-O 3.48Å; Q443-L482 WeakPolarHBondContact CA-O 3.46Å; Q443-E483 HydrophobicContact CG-CB 4Å; Q443-E483 HydrophobicContact CG-CG 3.96Å; Q443-E483 PolarHBondContact NE2-OE1 2.94Å
444	F	96.8	Very high	95	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	123	173.6	-63.5	-69.9	0	0	0	110.2	Q432 V434 W458 T481 L482 V484 Y495 A510 L512	Q432-F444 HydrophobicContact CB-CD1 4.12Å; V434-F444 HydrophobicContact CB-CE1 4.06Å; V434-F444 HydrophobicContact CB-CZ 4.43Å; V434-F444 HydrophobicContact CG2-CD1 4.28Å; V434-F444 HydrophobicContact CG2-CE1 3.72Å; F444-W458 HydrophobicContact CB-CH2 3.42Å; F444-W458 VanDerWaalsContact CB-CH2 3.42Å; F444-W458 HydrophobicContact CB-CZ2 3.88Å; F444-W458 HydrophobicContact CB-CZ3 4.12Å; F444-W458 HydrophobicContact CG-CH2 4.34Å; F444-W458 WeakPolarHBondContact O-CZ2 3.49Å; F444-T481 CarbonylContact O-C 3.59Å; F444-T481 VanDerWaalsContact O-CA 3.26Å; F444-T481 WeakPolarHBondContact O-CA 3.49Å; F444-T481 WeakPolarHBondContact O-CG2 3.2Å; F444-L482 HydrophobicContact CD2-CD2 4.26Å; F444-L482 PolarHBondContact N-O 2.87Å; F444-L482 PolarHBondContact O-N 2.89Å; F444-V484 HydrophobicContact CE2-CG2 4.48Å; F444-Y495 HydrophobicContact CE2-CD2 4.11Å; F444-Y495 HydrophobicContact CE2-CE2 4.49Å; F444-A510 HydrophobicContact CB-CB 4.32Å; F444-A510 HydrophobicContact CD1-CB 3.59Å; F444-A510 HydrophobicContact CD2-CB 4.5Å; F444-A510 HydrophobicContact CE1-CB 3.91Å; F444-A510 HydrophobicContact CG-CB 3.9Å; F444-A510 HydrophobicContact CZ-CB 4.49Å; F444-L512 HydrophobicContact CE2-CB 4.14Å; F444-L512 HydrophobicContact CE2-CD1 4.36Å; F444-L512 HydrophobicContact CZ-CB 3.77Å; F444-L512 HydrophobicContact CZ-CD1 3.93Å; F444-L512 HydrophobicContact CZ-CG 4.36Å
445	V	96.1	Very high	94.9	Very high	59 Å²	59	57.1 Å²	57.1	36%	0.358	32%	0.315	S	S	.	.			trans	-83.8	133.6	-175.3	178.6	0	0	0	0	110	Q432 R447 T481	Q432-V445 PolarHBondContact NE2-O 2.84Å; V445-R447 HydrophobicContact CG1-CG 3.86Å; V445-T481 HydrophobicContact CG2-CG2 4.39Å
446	C	95.6	Very high	95	Very high	3 Å²	3	53.2 Å²	53.2	2%	0.02	30%	0.298	C	S	.	.			trans	-137.6	83.4	172	-169.2	0	0	0	0	112	I456 W458 C497	C446-I456 HydrophobicContact CB-CG2 4.45Å; C446-W458 HydrophobicContact CB-CH2 4.29Å; C446-W458 HydrophobicContact CB-CZ2 3.48Å; C446-W458 VanDerWaalsContact CB-CZ2 3.48Å; C446-C497 HydrophobicContact CB-CB 3.77Å; C446-C497 WeakPolarHBondContact CB-SG 3.28Å; C446-C497 WeakPolarHBondContact SG-CB 3.27Å; C446-C497 CovalentContact SG-SG 2.01Å; C446-C497 PolarHBondContact SG-SG 2.96Å
447	R	95.4	Very high	95.1	Very high	157 Å²	157	54.8 Å²	54.8	59%	0.592	31%	0.306	S	S	*	.			trans	-85	117.8	177	-64.8	177.6	-175.8	172.2	1	110	R427 V445	R427-R447 PolarHBondContact N-O 3.11Å; V445-R447 HydrophobicContact CG1-CG 3.86Å
448	A	95.4	Very high	95.2	Very high	20 Å²	20	51.9 Å²	51.9	17%	0.165	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	148.6	176.3	0	0	0	0	0	112	R425 I426 P454 I456 A499	R425-A448 CarbonylContact O-C 3.58Å; R425-A448 VanDerWaalsContact O-CA 3.23Å; R425-A448 WeakPolarHBondContact O-CA 3.48Å; R425-A448 WeakPolarHBondContact O-CB 3.47Å; I426-A448 HydrophobicContact CG1-CB 4.18Å; A448-P454 HydrophobicContact CB-CG 3.92Å; A448-I456 HydrophobicContact CB-CD1 3.76Å; A448-A499 HydrophobicContact CB-CB 3.45Å; A448-A499 VanDerWaalsContact CB-CB 3.45Å
449	D	95.4	Very high	95.4	Very high	53 Å²	53	50 Å²	50	28%	0.283	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	150.5	170.9	-59.8	-44.7	0	0	0	110.8	A424 R425 R427	A424-D449 CarbonylContact C-O 3.46Å; A424-D449 WeakPolarHBondContact CA-O 3.39Å; R425-D449 PolarHBondContact N-O 3Å; R425-D449 PolarHBondContact O-N 2.96Å; R427-D449 IonicContact CZ-OD1 2.81Å; R427-D449 VanDerWaalsContact CZ-OD1 3.31Å; R427-D449 IonicContact CZ-OD2 3.31Å; R427-D449 IonicContact NE-OD1 3.92Å; R427-D449 PolarHBondContact NE-OD1 3.15Å; R427-D449 IonicContact NE-OD2 3.79Å; R427-D449 PolarHBondContact NE-OD2 3.49Å; R427-D449 IonicContact NH2-OD1 2.61Å; R427-D449 PolarHBondContact NH2-OD1 2.81Å; R427-D449 IonicContact NH2-OD2 3.01Å; R427-D449 PolarHBondContact NH2-OD2 3.13Å
450	G	95.5	Very high	95.6	Very high	8 Å²	8	48.7 Å²	48.7	8%	0.082	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.4	171	172.8	0	0	0	0	0	109.2	R422 P452	R422-G450 VanDerWaalsContact NH2-C 3.29Å; R422-G450 PolarHBondContact NH2-O 2.98Å; R422-G450 VanDerWaalsContact NH2-O 3.13Å; R422-G450 WeakPolarHBondContact O-CA 3.42Å; G450-P452 CarbonylContact C-O 3.5Å; G450-P452 VanDerWaalsContact C-O 3.23Å
451	D	95.1	Very high	95.6	Very high	84 Å²	84	45.6 Å²	45.6	45%	0.449	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	112.9	168.2	-172.5	42.3	0	0	0	108.6	C421 R422 N501	C421-D451 CarbonylContact C-O 3.51Å; C421-D451 WeakPolarHBondContact CA-O 3.45Å; C421-D451 VanDerWaalsContact CB-O 3.28Å; C421-D451 WeakPolarHBondContact CB-O 3.15Å; R422-D451 HydrophobicContact CB-CB 3.84Å; R422-D451 PolarHBondContact N-O 2.84Å; R422-D451 PolarHBondContact O-N 2.72Å; D451-N501 PolarHBondContact N-ND2 2.95Å
452	P	95.9	Very high	95.4	Very high	15 Å²	15	48.5 Å²	48.5	10%	0.097	26%	0.261	C	S	.	.	S	Bend	cis	-65.1	164.3	1.6	28.3	-36	0	0	0	113.3	G450 N501	G450-P452 CarbonylContact C-O 3.5Å; G450-P452 VanDerWaalsContact C-O 3.23Å; P452-N501 HydrophobicContact CG-CB 4.35Å; P452-N501 WeakPolarHBondContact O-CB 3.45Å; P452-N501 PolarHBondContact O-ND2 2.78Å
453	P	94.6	Very high	95.2	Very high	112 Å²	112	56.4 Å²	56.4	73%	0.727	30%	0.295	S	S	*	.	P	Polyproline II helix	trans	-51.4	129.6	177.8	-27.4	34.9	0	0	0	111.9
454	P	95.3	Very high	95	Very high	23 Å²	23	57 Å²	57	15%	0.149	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-75.1	141.4	-173.3	29.6	-34.1	0	0	0	112.5	A424 A448 I456 A499 A500 N501	A424-P454 HydrophobicContact CB-CB 3.72Å; A424-P454 HydrophobicContact CB-CG 4.45Å; A448-P454 HydrophobicContact CB-CG 3.92Å; P454-I456 HydrophobicContact CG-CD1 4.45Å; P454-A499 HydrophobicContact CB-CB 4.37Å; P454-A500 CarbonylContact C-O 3.6Å; P454-A500 WeakPolarHBondContact CA-O 3.24Å; P454-N501 HydrophobicContact CB-CB 4.38Å
455	A	94	Very high	94.8	Very high	62 Å²	62	61.9 Å²	61.9	51%	0.512	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	131.3	167	0	0	0	0	0	109.6	A500	A455-A500 PolarHBondContact N-O 3.48Å; A455-A500 PolarHBondContact O-N 2.86Å
456	I	96	Very high	94.7	Very high	27 Å²	27	59.5 Å²	59.5	14%	0.138	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	128.6	179	-49.3	-57.4	0	0	0	109.9	C446 A448 P454 A499	C446-I456 HydrophobicContact CB-CG2 4.45Å; A448-I456 HydrophobicContact CB-CD1 3.76Å; P454-I456 HydrophobicContact CG-CD1 4.45Å; I456-A499 HydrophobicContact CD1-CB 3.68Å
457	L	96	Very high	94.5	Very high	48 Å²	48	60.9 Å²	60.9	25%	0.251	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	146.9	177.7	-61.7	168.2	0	0	0	109.3	L465 V466 I498	L457-L465 HydrophobicContact CB-CD1 3.97Å; L457-L465 HydrophobicContact CD1-CD1 4.42Å; L457-L465 HydrophobicContact CD1-CD2 4.36Å; L457-L465 HydrophobicContact CD2-CG 4.48Å; L457-V466 WeakPolarHBondContact CA-O 3.45Å; L457-I498 HydrophobicContact CB-CB 4.39Å; L457-I498 PolarHBondContact N-O 3.03Å; L457-I498 PolarHBondContact O-N 2.76Å
458	W	96.7	Very high	94.2	Very high	2 Å²	2	57.1 Å²	57.1	1%	0.008	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	126.2	176.4	-78.1	89.4	0	0	0	110.6	F444 C446 V466 V476 G480 L482 L496 C497 A510	F444-W458 HydrophobicContact CB-CH2 3.42Å; F444-W458 VanDerWaalsContact CB-CH2 3.42Å; F444-W458 HydrophobicContact CB-CZ2 3.88Å; F444-W458 HydrophobicContact CB-CZ3 4.12Å; F444-W458 HydrophobicContact CG-CH2 4.34Å; F444-W458 WeakPolarHBondContact O-CZ2 3.49Å; C446-W458 HydrophobicContact CB-CH2 4.29Å; C446-W458 HydrophobicContact CB-CZ2 3.48Å; C446-W458 VanDerWaalsContact CB-CZ2 3.48Å; W458-V466 HydrophobicContact CB-CB 4.34Å; W458-V466 PolarHBondContact N-O 2.96Å; W458-V466 PolarHBondContact O-N 3.1Å; W458-V476 HydrophobicContact CB-CG2 4.45Å; W458-V476 HydrophobicContact CG-CG2 4.36Å; W458-G480 PolarHBondContact NE1-O 2.88Å; W458-L482 HydrophobicContact CB-CD1 4.29Å; W458-L482 HydrophobicContact CB-CD2 4.07Å; W458-L482 HydrophobicContact CD2-CB 3.62Å; W458-L482 HydrophobicContact CD2-CD2 3.77Å; W458-L482 HydrophobicContact CD2-CG 4.25Å; W458-L482 VanDerWaalsContact CE2-CB 3.43Å; W458-L482 HydrophobicContact CE3-CB 4.28Å; W458-L482 HydrophobicContact CE3-CD2 3.77Å; W458-L482 HydrophobicContact CG-CB 3.78Å; W458-L482 HydrophobicContact CG-CD1 4.31Å; W458-L482 HydrophobicContact CG-CD2 3.95Å; W458-L482 HydrophobicContact CG-CG 4.23Å; W458-L482 HydrophobicContact CZ2-CB 3.88Å; W458-L482 HydrophobicContact CZ3-CD2 4.4Å; W458-L496 CarbonylContact C-O 3.57Å; W458-L496 WeakPolarHBondContact CA-O 3.43Å; W458-C497 HydrophobicContact CD2-CB 3.98Å; W458-C497 HydrophobicContact CE3-CB 3.93Å; W458-C497 HydrophobicContact CH2-CB 3.7Å; W458-C497 HydrophobicContact CZ2-CB 3.76Å; W458-C497 HydrophobicContact CZ3-CB 3.78Å; W458-A510 HydrophobicContact CH2-CB 4.21Å; W458-A510 HydrophobicContact CZ3-CB 3.98Å
459	L	96.6	Very high	93.7	Very high	55 Å²	55	64 Å²	64	29%	0.288	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	121	171.8	-168.6	68.1	0	0	0	109	L465 Y495 L496	L459-L465 HydrophobicContact CD1-CD1 4.47Å; L459-Y495 WeakPolarHBondContact O-CA 3.33Å; L459-L496 HydrophobicContact CB-CB 4.1Å; L459-L496 PolarHBondContact N-O 2.81Å; L459-L496 PolarHBondContact O-N 3.04Å
460	S	94.9	Very high	93.3	Very high	8 Å²	8	63.3 Å²	63.3	6%	0.056	35%	0.346	C	S	.	.			trans	-76.3	163.7	176.2	80.6	0	0	0	0	111.9	R462 K463 H464	S460-R462 PolarHBondContact O-N 3.01Å; S460-R462 PolarHBondContact OG-N 3.17Å; S460-K463 WeakPolarHBondContact O-CA 3.33Å; S460-K463 PolarHBondContact O-N 2.92Å; S460-H464 PolarHBondContact N-O 3.46Å; S460-H464 WeakPolarHBondContact OG-CB 2.97Å; S460-H464 PolarHBondContact OG-N 2.86Å; S460-H464 VanDerWaalsContact OG-N 3.15Å
461	P	93.3	Very high	92.8	Very high	46 Å²	46	70.6 Å²	70.6	30%	0.299	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-24.6	173.2	-25.2	33.7	0	0	0	113.3	K463 Y495	P461-K463 VanDerWaalsContact C-N 3.28Å; P461-K463 PolarHBondContact O-N 3.15Å; P461-Y495 VanDerWaalsContact CD-CZ 3.41Å; P461-Y495 HydrophobicContact CG-CD2 4.02Å; P461-Y495 HydrophobicContact CG-CE2 3.71Å
462	R	92.1	Very high	92.5	Very high	129 Å²	129	68.4 Å²	68.4	49%	0.487	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	10.1	177.5	-59.9	-177.3	63.6	165.4	6.5	113.6	S460 H464 Q490	S460-R462 PolarHBondContact O-N 3.01Å; S460-R462 PolarHBondContact OG-N 3.17Å; R462-H464 PolarHBondContact O-CD2 3.22Å; R462-H464 PolarHBondContact O-N 3.09Å; R462-Q490 VanDerWaalsContact NH1-CD 3.3Å
463	K	91.8	Very high	92.3	Very high	179 Å²	179	70.9 Å²	70.9	78%	0.778	39%	0.387	S	S	*	.			trans	62.5	24.2	-177.2	-51	177.9	-179.5	178.4	0	113.9	S460 P461	S460-K463 WeakPolarHBondContact O-CA 3.33Å; S460-K463 PolarHBondContact O-N 2.92Å; P461-K463 VanDerWaalsContact C-N 3.28Å; P461-K463 PolarHBondContact O-N 3.15Å
464	H	91.4	Very high	92.3	Very high	108 Å²	108	66.8 Å²	66.8	50%	0.5	36%	0.359	S	S	.	.			trans	-84.5	130.7	171	-63.7	178.2	0	0	0	109.4	S460 R462	S460-H464 PolarHBondContact N-O 3.46Å; S460-H464 WeakPolarHBondContact OG-CB 2.97Å; S460-H464 PolarHBondContact OG-N 2.86Å; S460-H464 VanDerWaalsContact OG-N 3.15Å; R462-H464 PolarHBondContact O-CD2 3.22Å; R462-H464 PolarHBondContact O-N 3.09Å
465	L	93.4	Very high	92.3	Very high	102 Å²	102	67 Å²	67	53%	0.534	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	117.6	175.3	-168.6	70.2	0	0	0	109.6	L457 L459	L457-L465 HydrophobicContact CB-CD1 3.97Å; L457-L465 HydrophobicContact CD1-CD1 4.42Å; L457-L465 HydrophobicContact CD1-CD2 4.36Å; L457-L465 HydrophobicContact CD2-CG 4.48Å; L459-L465 HydrophobicContact CD1-CD1 4.47Å
466	V	93.9	Very high	92.4	Very high	9 Å²	9	64.8 Å²	64.8	6%	0.055	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	132.6	178.9	-166.1	0	0	0	0	108.5	L457 W458 L474 V476 L482	L457-V466 WeakPolarHBondContact CA-O 3.45Å; W458-V466 HydrophobicContact CB-CB 4.34Å; W458-V466 PolarHBondContact N-O 2.96Å; W458-V466 PolarHBondContact O-N 3.1Å; V466-L474 HydrophobicContact CG1-CB 4.06Å; V466-L474 HydrophobicContact CG2-CB 4.05Å; V466-L474 HydrophobicContact CG2-CD1 3.95Å; V466-V476 HydrophobicContact CB-CG2 4.28Å; V466-V476 HydrophobicContact CG1-CG2 3.84Å; V466-L482 HydrophobicContact CG1-CD1 4.42Å
467	S	92.6	Very high	92.3	Very high	31 Å²	31	67.2 Å²	67.2	22%	0.217	35%	0.35	C	S	.	.			trans	-128.7	174.8	-179.7	73	0	0	0	0	110.6	K469 S470	S467-K469 PolarHBondContact O-N 3.36Å; S467-K469 VanDerWaalsContact O-N 3.15Å; S467-K469 PolarHBondContact OG-N 3.02Å; S467-S470 PolarHBondContact N-OG 2.72Å; S467-S470 VanDerWaalsContact O-CB 3.3Å; S467-S470 WeakPolarHBondContact O-CB 3.08Å; S467-S470 PolarHBondContact O-N 3.16Å; S467-S470 PolarHBondContact O-OG 3.05Å; S467-S470 PolarHBondContact OG-OG 2.79Å
468	A	88	Confident	92	Very high	79 Å²	79	71.6 Å²	71.6	65%	0.653	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-21.8	172.5	0	0	0	0	0	113.6
469	K	86.1	Confident	91.7	Very high	165 Å²	165	75.4 Å²	75.4	72%	0.717	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-1.6	176.4	-59.2	-175.7	-177.6	-174.7	0	113.2	S467 N471	S467-K469 PolarHBondContact O-N 3.36Å; S467-K469 VanDerWaalsContact O-N 3.15Å; S467-K469 PolarHBondContact OG-N 3.02Å; K469-N471 PolarHBondContact O-OD1 2.85Å; K469-N471 VanDerWaalsContact O-OD1 3.09Å
470	S	86.8	Confident	91.5	Very high	38 Å²	38	72.8 Å²	72.8	27%	0.266	39%	0.388	S	S	.	.			trans	-80.7	130.9	-176.8	-63.2	0	0	0	0	111.2	S467	S467-S470 PolarHBondContact N-OG 2.72Å; S467-S470 VanDerWaalsContact O-CB 3.3Å; S467-S470 WeakPolarHBondContact O-CB 3.08Å; S467-S470 PolarHBondContact O-N 3.16Å; S467-S470 PolarHBondContact O-OG 3.05Å; S467-S470 PolarHBondContact OG-OG 2.79Å
471	N	84	Confident	91.5	Very high	161 Å²	161	72.7 Å²	72.7	86%	0.861	39%	0.387	S	S	*	.			trans	-105.6	121.8	177.6	-61.6	59.8	0	0	0	109.4	K469	K469-N471 PolarHBondContact O-OD1 2.85Å; K469-N471 VanDerWaalsContact O-OD1 3.09Å
472	G	88.5	Confident	91.7	Very high	37 Å²	37	70.5 Å²	70.5	38%	0.381	37%	0.373	S	S	.	.	S	Bend	trans	167.4	-163.1	177.7	0	0	0	0	0	113.7	L474 R485	G472-L474 VanDerWaalsContact C-N 3.27Å; G472-R485 PolarHBondContact O-NH2 2.82Å
473	R	92.9	Very high	91.9	Very high	68 Å²	68	65.9 Å²	65.9	26%	0.257	36%	0.357	S	S	.	.	S	Bend	trans	-66.6	-30.5	172.1	-69.6	-168.5	-57.1	99.3	0.1	112.6	R485 Y486 D491	R473-R485 HydrophobicContact CB-CB 4.48Å; R473-R485 WeakPolarHBondContact CD-O 3.12Å; R473-R485 PolarHBondContact NH1-O 2.8Å; R473-R485 PolarHBondContact O-N 3Å; R473-Y486 PolarHBondContact NH1-O 2.99Å; R473-Y486 VanDerWaalsContact NH1-O 3.13Å; R473-D491 IonicContact CZ-OD1 4Å; R473-D491 IonicContact CZ-OD2 3.37Å; R473-D491 IonicContact NH1-OD1 3.94Å; R473-D491 IonicContact NH1-OD2 2.74Å; R473-D491 PolarHBondContact NH1-OD2 2.85Å; R473-D491 IonicContact NH2-OD1 3.07Å; R473-D491 PolarHBondContact NH2-OD1 2.86Å; R473-D491 IonicContact NH2-OD2 3.08Å; R473-D491 PolarHBondContact NH2-OD2 2.79Å; R473-D491 VanDerWaalsContact NH2-OD2 3.08Å
474	L	94.3	Very high	92.1	Very high	26 Å²	26	57.3 Å²	57.3	14%	0.136	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	117.6	173.8	-60.6	174.4	0	0	0	109	V466 G472 L482 E483 V484 Y495	V466-L474 HydrophobicContact CG1-CB 4.06Å; V466-L474 HydrophobicContact CG2-CB 4.05Å; V466-L474 HydrophobicContact CG2-CD1 3.95Å; G472-L474 VanDerWaalsContact C-N 3.27Å; L474-L482 HydrophobicContact CB-CD1 4.33Å; L474-E483 VanDerWaalsContact CA-O 3.31Å; L474-E483 WeakPolarHBondContact CA-O 3.44Å; L474-V484 HydrophobicContact CD2-CB 3.9Å; L474-V484 HydrophobicContact CD2-CG1 3.68Å; L474-V484 HydrophobicContact CD2-CG2 3.53Å; L474-Y495 HydrophobicContact CD2-CE1 4.22Å
475	T	94.6	Very high	92.3	Very high	28 Å²	28	57 Å²	57	17%	0.172	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	139.4	-177.6	37.7	0	0	0	0	110.8	L482 E483	T475-L482 CarbonylContact O-C 3.59Å; T475-L482 WeakPolarHBondContact O-CA 3.17Å; T475-E483 PolarHBondContact N-O 2.82Å; T475-E483 PolarHBondContact O-N 3.31Å; T475-E483 PolarHBondContact OG1-OE2 3.43Å
476	V	95.8	Very high	92.3	Very high	15 Å²	15	59.5 Å²	59.5	9%	0.091	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	121.6	177.8	-178.7	0	0	0	0	109.1	W458 V466 T481 L482	W458-V476 HydrophobicContact CB-CG2 4.45Å; W458-V476 HydrophobicContact CG-CG2 4.36Å; V466-V476 HydrophobicContact CB-CG2 4.28Å; V466-V476 HydrophobicContact CG1-CG2 3.84Å; V476-T481 WeakPolarHBondContact CA-O 3.3Å; V476-L482 HydrophobicContact CG2-CD1 4.1Å
477	F	93.8	Very high	92.3	Very high	78 Å²	78	59.1 Å²	59.1	34%	0.342	32%	0.315	S	S	.	.			trans	-77.5	162	178	-70.8	-65.8	0	0	0	112.4	D479 G480 T481 E483	F477-D479 WeakPolarHBondContact CB-OD1 3.4Å; F477-D479 PolarHBondContact O-N 2.78Å; F477-D479 VanDerWaalsContact O-N 3.17Å; F477-G480 WeakPolarHBondContact O-CA 3.4Å; F477-G480 PolarHBondContact O-N 2.01Å; F477-T481 HydrophobicContact CD2-CG2 4.18Å; F477-T481 WeakPolarHBondContact CD2-O 3.49Å; F477-T481 PolarHBondContact N-O 2.88Å; F477-E483 HydrophobicContact CE2-CB 3.76Å; F477-E483 HydrophobicContact CZ-CB 4.36Å
478	P	90.8	Very high	92.4	Very high	140 Å²	140	60.8 Å²	60.8	91%	0.909	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-25	178.5	-25.9	35.3	0	0	0	114.9	G480	P478-G480 PolarHBondContact O-N 2.88Å
479	D	90.7	Very high	92.5	Very high	81 Å²	81	60.6 Å²	60.6	43%	0.433	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-1	175.7	73.5	-21.6	0	0	0	113.4	F477 T481	F477-D479 WeakPolarHBondContact CB-OD1 3.4Å; F477-D479 PolarHBondContact O-N 2.78Å; F477-D479 VanDerWaalsContact O-N 3.17Å; D479-T481 VanDerWaalsContact CG-OG1 3.31Å; D479-T481 VanDerWaalsContact OD1-CB 3.27Å; D479-T481 WeakPolarHBondContact OD1-CB 3.26Å; D479-T481 PolarHBondContact OD1-N 2.9Å; D479-T481 PolarHBondContact OD1-OG1 2.72Å; D479-T481 VanDerWaalsContact OD1-OG1 3.1Å; D479-T481 PolarHBondContact OD2-OG1 2.85Å
480	G	92.7	Very high	92.7	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.01	30%	0.297	C	S	.	.	S	Bend	trans	92.2	-1.5	-179.5	0	0	0	0	0	115.1	W458 F477 P478 L482	W458-G480 PolarHBondContact NE1-O 2.88Å; F477-G480 WeakPolarHBondContact O-CA 3.4Å; F477-G480 PolarHBondContact O-N 2.01Å; P478-G480 PolarHBondContact O-N 2.88Å; G480-L482 PolarHBondContact O-N 3.49Å
481	T	95.3	Very high	93	Very high	5 Å²	5	55.9 Å²	55.9	3%	0.031	29%	0.287	C	S	.	.			trans	-70.4	128.1	-178.5	-60.5	0	0	0	0	111.2	Q443 F444 V445 V476 F477 D479	Q443-T481 HydrophobicContact CB-CG2 3.97Å; F444-T481 CarbonylContact O-C 3.59Å; F444-T481 VanDerWaalsContact O-CA 3.26Å; F444-T481 WeakPolarHBondContact O-CA 3.49Å; F444-T481 WeakPolarHBondContact O-CG2 3.2Å; V445-T481 HydrophobicContact CG2-CG2 4.39Å; V476-T481 WeakPolarHBondContact CA-O 3.3Å; F477-T481 HydrophobicContact CD2-CG2 4.18Å; F477-T481 WeakPolarHBondContact CD2-O 3.49Å; F477-T481 PolarHBondContact N-O 2.88Å; D479-T481 VanDerWaalsContact CG-OG1 3.31Å; D479-T481 VanDerWaalsContact OD1-CB 3.27Å; D479-T481 WeakPolarHBondContact OD1-CB 3.26Å; D479-T481 PolarHBondContact OD1-N 2.9Å; D479-T481 PolarHBondContact OD1-OG1 2.72Å; D479-T481 VanDerWaalsContact OD1-OG1 3.1Å; D479-T481 PolarHBondContact OD2-OG1 2.85Å
482	L	96.8	Very high	93.5	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	128.5	171.5	173.2	68.4	0	0	0	109.7	Q443 F444 W458 V466 L474 T475 V476 G480 V484 Y495	Q443-L482 CarbonylContact C-O 3.48Å; Q443-L482 WeakPolarHBondContact CA-O 3.46Å; F444-L482 HydrophobicContact CD2-CD2 4.26Å; F444-L482 PolarHBondContact N-O 2.87Å; F444-L482 PolarHBondContact O-N 2.89Å; W458-L482 HydrophobicContact CB-CD1 4.29Å; W458-L482 HydrophobicContact CB-CD2 4.07Å; W458-L482 HydrophobicContact CD2-CB 3.62Å; W458-L482 HydrophobicContact CD2-CD2 3.77Å; W458-L482 HydrophobicContact CD2-CG 4.25Å; W458-L482 VanDerWaalsContact CE2-CB 3.43Å; W458-L482 HydrophobicContact CE3-CB 4.28Å; W458-L482 HydrophobicContact CE3-CD2 3.77Å; W458-L482 HydrophobicContact CG-CB 3.78Å; W458-L482 HydrophobicContact CG-CD1 4.31Å; W458-L482 HydrophobicContact CG-CD2 3.95Å; W458-L482 HydrophobicContact CG-CG 4.23Å; W458-L482 HydrophobicContact CZ2-CB 3.88Å; W458-L482 HydrophobicContact CZ3-CD2 4.4Å; V466-L482 HydrophobicContact CG1-CD1 4.42Å; L474-L482 HydrophobicContact CB-CD1 4.33Å; T475-L482 CarbonylContact O-C 3.59Å; T475-L482 WeakPolarHBondContact O-CA 3.17Å; V476-L482 HydrophobicContact CG2-CD1 4.1Å; G480-L482 PolarHBondContact O-N 3.49Å; L482-V484 HydrophobicContact CD2-CG2 4.29Å; L482-V484 HydrophobicContact CG-CG2 4.29Å; L482-Y495 HydrophobicContact CD2-CD1 3.44Å; L482-Y495 VanDerWaalsContact CD2-CD1 3.44Å; L482-Y495 HydrophobicContact CD2-CE1 3.86Å; L482-Y495 HydrophobicContact CD2-CG 4.17Å
483	E	96.2	Very high	93.8	Very high	32 Å²	32	50.9 Å²	50.9	15%	0.15	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	131	169.2	-178.9	177	-114.1	0	0	110.5	T441 Q443 L474 T475 F477 R485	T441-E483 HydrophobicContact CG2-CG 3.76Å; Q443-E483 HydrophobicContact CG-CB 4Å; Q443-E483 HydrophobicContact CG-CG 3.96Å; Q443-E483 PolarHBondContact NE2-OE1 2.94Å; L474-E483 VanDerWaalsContact CA-O 3.31Å; L474-E483 WeakPolarHBondContact CA-O 3.44Å; T475-E483 PolarHBondContact N-O 2.82Å; T475-E483 PolarHBondContact O-N 3.31Å; T475-E483 PolarHBondContact OG1-OE2 3.43Å; F477-E483 HydrophobicContact CE2-CB 3.76Å; F477-E483 HydrophobicContact CZ-CB 4.36Å; E483-R485 HydrophobicContact CG-CG 3.85Å
484	V	96.3	Very high	94	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	99.6	172.9	-174	0	0	0	0	107.9	T441 V442 F444 L474 L482 D491 L512	T441-V484 WeakPolarHBondContact CA-O 3.41Å; V442-V484 HydrophobicContact CG1-CB 3.73Å; V442-V484 HydrophobicContact CG1-CG1 4.47Å; V442-V484 HydrophobicContact CG1-CG2 4.17Å; V442-V484 PolarHBondContact N-O 3.2Å; V442-V484 VanDerWaalsContact N-O 3.07Å; V442-V484 PolarHBondContact O-N 2.93Å; F444-V484 HydrophobicContact CE2-CG2 4.48Å; L474-V484 HydrophobicContact CD2-CB 3.9Å; L474-V484 HydrophobicContact CD2-CG1 3.68Å; L474-V484 HydrophobicContact CD2-CG2 3.53Å; L482-V484 HydrophobicContact CD2-CG2 4.29Å; L482-V484 HydrophobicContact CG-CG2 4.29Å; V484-D491 HydrophobicContact CG1-CB 4.44Å; V484-L512 HydrophobicContact CG1-CD2 4.45Å
485	R	95.1	Very high	94.1	Very high	102 Å²	102	49.8 Å²	49.8	39%	0.385	26%	0.258	S	S	.	.	S	Bend	trans	-81.1	137.4	178.1	-61.9	-173.8	-71.9	173.2	-3.6	111.1	T441 G472 R473 E483	T441-R485 HydrophobicContact CG2-CG 4.06Å; G472-R485 PolarHBondContact O-NH2 2.82Å; R473-R485 HydrophobicContact CB-CB 4.48Å; R473-R485 WeakPolarHBondContact CD-O 3.12Å; R473-R485 PolarHBondContact NH1-O 2.8Å; R473-R485 PolarHBondContact O-N 3Å; E483-R485 HydrophobicContact CG-CG 3.85Å
486	Y	94.3	Very high	94.2	Very high	154 Å²	154	51 Å²	51	60%	0.604	26%	0.263	S	S	*	.	S	Bend	trans	48.4	68.9	-179.6	-52.2	-76.9	0	0	0	111.7	G439 R473 Q488	G439-Y486 WeakPolarHBondContact O-CD1 3.31Å; R473-Y486 PolarHBondContact NH1-O 2.99Å; R473-Y486 VanDerWaalsContact NH1-O 3.13Å; Y486-Q488 WeakPolarHBondContact O-CG 3.41Å; Y486-Q488 PolarHBondContact O-N 2.9Å
487	A	94	Very high	94.3	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.259	C	S	.	.			trans	-55.9	131	-175.8	0	0	0	0	0	111.3	V436 E438 G439 H440 V514	V436-A487 HydrophobicContact CG1-CB 3.81Å; E438-A487 WeakPolarHBondContact CA-O 3.43Å; G439-A487 PolarHBondContact N-O 2.75Å; H440-A487 WeakPolarHBondContact O-CB 3.37Å; H440-A487 PolarHBondContact O-N 3.4Å; A487-V514 HydrophobicContact CB-CG2 4.33Å
488	Q	93.1	Very high	94.4	Very high	66 Å²	66	48.4 Å²	48.4	31%	0.308	25%	0.252	S	S	.	.			trans	-113.8	158.5	180	-62.9	176.1	-20.4	0	0	110.2	Y486 Q490 D491	Y486-Q488 WeakPolarHBondContact O-CG 3.41Å; Y486-Q488 PolarHBondContact O-N 2.9Å; Q488-Q490 HydrophobicContact CB-CG 3.78Å; Q488-Q490 PolarHBondContact O-N 2.92Å; Q488-Q490 VanDerWaalsContact O-N 3.08Å; Q488-D491 PolarHBondContact N-OD2 2.92Å; Q488-D491 WeakPolarHBondContact O-CB 3.34Å; Q488-D491 PolarHBondContact O-N 2.93Å
489	V	90.2	Very high	94.7	Very high	76 Å²	76	41.8 Å²	41.8	46%	0.461	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-53.9	-33.6	176.5	-178.5	0	0	0	0	112	D491 N492	V489-D491 PolarHBondContact O-N 3.25Å; V489-N492 WeakPolarHBondContact O-CB 3.37Å; V489-N492 PolarHBondContact O-N 2.81Å
490	Q	90.7	Very high	94.9	Very high	95 Å²	95	39.4 Å²	39.4	44%	0.444	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-70.2	-14	176.8	61.7	173.3	5.4	0	0	115.2	R462 Q488	R462-Q490 VanDerWaalsContact NH1-CD 3.3Å; Q488-Q490 HydrophobicContact CB-CG 3.78Å; Q488-Q490 PolarHBondContact O-N 2.92Å; Q488-Q490 VanDerWaalsContact O-N 3.08Å
491	D	93.4	Very high	95.1	Very high	8 Å²	8	40.5 Å²	40.5	4%	0.043	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-88.5	-8.2	177.9	-58.4	-31.6	0	0	0	111.6	R473 V484 Q488 V489 Y495 L512	R473-D491 IonicContact CZ-OD1 4Å; R473-D491 IonicContact CZ-OD2 3.37Å; R473-D491 IonicContact NH1-OD1 3.94Å; R473-D491 IonicContact NH1-OD2 2.74Å; R473-D491 PolarHBondContact NH1-OD2 2.85Å; R473-D491 IonicContact NH2-OD1 3.07Å; R473-D491 PolarHBondContact NH2-OD1 2.86Å; R473-D491 IonicContact NH2-OD2 3.08Å; R473-D491 PolarHBondContact NH2-OD2 2.79Å; R473-D491 VanDerWaalsContact NH2-OD2 3.08Å; V484-D491 HydrophobicContact CG1-CB 4.44Å; Q488-D491 PolarHBondContact N-OD2 2.92Å; Q488-D491 WeakPolarHBondContact O-CB 3.34Å; Q488-D491 PolarHBondContact O-N 2.93Å; V489-D491 PolarHBondContact O-N 3.25Å; D491-Y495 VanDerWaalsContact O-CE2 3.28Å; D491-Y495 WeakPolarHBondContact O-CE2 3.49Å; D491-Y495 PolarHBondContact O-OH 2.91Å; D491-L512 HydrophobicContact CB-CD2 4.32Å
492	N	94.1	Very high	95.1	Very high	71 Å²	71	42.9 Å²	42.9	38%	0.38	23%	0.226	S	C	.	.			trans	-63	135.8	178.3	-179.5	64.8	0	0	0	111.9	V489 L512 H513 V514	V489-N492 WeakPolarHBondContact O-CB 3.37Å; V489-N492 PolarHBondContact O-N 2.81Å; N492-L512 PolarHBondContact OD1-O 3.31Å; N492-H513 WeakPolarHBondContact OD1-CA 3.37Å; N492-V514 HydrophobicContact CB-CB 4.33Å; N492-V514 HydrophobicContact CB-CG2 4.19Å; N492-V514 PolarHBondContact OD1-N 3.39Å
493	G	95.3	Very high	94.9	Very high	22 Å²	22	44.2 Å²	44.2	23%	0.227	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	135.8	-161.2	177.3	0	0	0	0	0	113.5	L512	G493-L512 PolarHBondContact N-O 3.5Å; G493-L512 PolarHBondContact O-N 3.37Å
494	T	96.7	Very high	94.8	Very high	70 Å²	70	43.8 Å²	43.8	43%	0.429	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	119.4	-176.1	-51.7	0	0	0	0	110.8	P509 A510 H511	T494-P509 HydrophobicContact CG2-CB 3.97Å; T494-A510 CarbonylContact C-O 3.51Å; T494-H511 PolarHBondContact OG1-CE1 2.85Å; T494-H511 PolarHBondContact OG1-ND1 3.35Å
495	Y	96.8	Very high	94.8	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.008	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	148	166.4	-70.6	-100	0	0	0	109.6	F444 L459 P461 L474 L482 D491 P509 A510 L512	F444-Y495 HydrophobicContact CE2-CD2 4.11Å; F444-Y495 HydrophobicContact CE2-CE2 4.49Å; L459-Y495 WeakPolarHBondContact O-CA 3.33Å; P461-Y495 VanDerWaalsContact CD-CZ 3.41Å; P461-Y495 HydrophobicContact CG-CD2 4.02Å; P461-Y495 HydrophobicContact CG-CE2 3.71Å; L474-Y495 HydrophobicContact CD2-CE1 4.22Å; L482-Y495 HydrophobicContact CD2-CD1 3.44Å; L482-Y495 VanDerWaalsContact CD2-CD1 3.44Å; L482-Y495 HydrophobicContact CD2-CE1 3.86Å; L482-Y495 HydrophobicContact CD2-CG 4.17Å; D491-Y495 VanDerWaalsContact O-CE2 3.28Å; D491-Y495 WeakPolarHBondContact O-CE2 3.49Å; D491-Y495 PolarHBondContact O-OH 2.91Å; Y495-P509 CarbonylContact O-C 3.6Å; Y495-P509 WeakPolarHBondContact O-CA 3.39Å; Y495-A510 PolarHBondContact N-O 3.07Å; Y495-A510 PolarHBondContact O-N 3.48Å; Y495-L512 HydrophobicContact CD2-CB 4.09Å; Y495-L512 HydrophobicContact CE2-CB 3.8Å; Y495-L512 HydrophobicContact CE2-CD2 3.85Å; Y495-L512 HydrophobicContact CE2-CG 4.48Å
496	L	96.7	Very high	94.8	Very high	53 Å²	53	44.6 Å²	44.6	28%	0.277	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	114.3	175.9	-174	69.9	0	0	0	109.5	W458 L459 I498	W458-L496 CarbonylContact C-O 3.57Å; W458-L496 WeakPolarHBondContact CA-O 3.43Å; L459-L496 HydrophobicContact CB-CB 4.1Å; L459-L496 PolarHBondContact N-O 2.81Å; L459-L496 PolarHBondContact O-N 3.04Å; L496-I498 HydrophobicContact CD2-CD1 4.23Å; L496-I498 HydrophobicContact CD2-CG1 4.12Å; L496-I498 HydrophobicContact CG-CG1 4.11Å
497	C	96.8	Very high	94.9	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	134.9	166.1	-177.4	0	0	0	0	109.2	I426 C446 W458 S507 M508	I426-C497 HydrophobicContact CD1-CB 4.44Å; C446-C497 HydrophobicContact CB-CB 3.77Å; C446-C497 WeakPolarHBondContact CB-SG 3.28Å; C446-C497 WeakPolarHBondContact SG-CB 3.27Å; C446-C497 CovalentContact SG-SG 2.01Å; C446-C497 PolarHBondContact SG-SG 2.96Å; W458-C497 HydrophobicContact CD2-CB 3.98Å; W458-C497 HydrophobicContact CE3-CB 3.93Å; W458-C497 HydrophobicContact CH2-CB 3.7Å; W458-C497 HydrophobicContact CZ2-CB 3.76Å; W458-C497 HydrophobicContact CZ3-CB 3.78Å; C497-S507 CarbonylContact O-C 3.55Å; C497-S507 WeakPolarHBondContact O-CA 3.45Å; C497-S507 WeakPolarHBondContact O-CB 3.45Å; C497-M508 PolarHBondContact N-O 3.39Å; C497-M508 PolarHBondContact O-N 3.13Å
498	I	96.9	Very high	95	Very high	39 Å²	39	41 Å²	41	20%	0.2	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	115.6	176.5	-55.7	171.1	0	0	0	107.1	L457 L496	L457-I498 HydrophobicContact CB-CB 4.39Å; L457-I498 PolarHBondContact N-O 3.03Å; L457-I498 PolarHBondContact O-N 2.76Å; L496-I498 HydrophobicContact CD2-CD1 4.23Å; L496-I498 HydrophobicContact CD2-CG1 4.12Å; L496-I498 HydrophobicContact CG-CG1 4.11Å
499	A	96.8	Very high	95.2	Very high	0 Å²	0	40 Å²	40	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	123.9	170.7	0	0	0	0	0	108.8	A424 I426 A448 P454 I456 N505 D506	A424-A499 HydrophobicContact CB-CB 4.31Å; I426-A499 HydrophobicContact CD1-CB 4.3Å; I426-A499 HydrophobicContact CG1-CB 3.82Å; A448-A499 HydrophobicContact CB-CB 3.45Å; A448-A499 VanDerWaalsContact CB-CB 3.45Å; P454-A499 HydrophobicContact CB-CB 4.37Å; I456-A499 HydrophobicContact CD1-CB 3.68Å; A499-N505 CarbonylContact O-C 3.51Å; A499-N505 VanDerWaalsContact O-CA 3.24Å; A499-N505 WeakPolarHBondContact O-CA 3.35Å; A499-D506 PolarHBondContact N-O 3.08Å; A499-D506 PolarHBondContact O-N 2.82Å
500	A	95.6	Very high	95.5	Very high	32 Å²	32	36.5 Å²	36.5	26%	0.264	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	136.5	-175.1	0	0	0	0	0	112.5	P454 A455 N505	P454-A500 CarbonylContact C-O 3.6Å; P454-A500 WeakPolarHBondContact CA-O 3.24Å; A455-A500 PolarHBondContact N-O 3.48Å; A455-A500 PolarHBondContact O-N 2.86Å; A500-N505 HydrophobicContact CB-CB 4.19Å
501	N	95.9	Very high	95.8	Very high	24 Å²	24	34.8 Å²	34.8	13%	0.128	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	-179.7	166.2	72.2	-1	0	0	0	110.4	R422 A424 D451 P452 P454 G503 G504	R422-N501 PolarHBondContact O-ND2 2.91Å; A424-N501 HydrophobicContact CB-CB 4.47Å; A424-N501 PolarHBondContact N-OD1 3.49Å; A424-N501 VanDerWaalsContact N-OD1 3.09Å; D451-N501 PolarHBondContact N-ND2 2.95Å; P452-N501 HydrophobicContact CG-CB 4.35Å; P452-N501 WeakPolarHBondContact O-CB 3.45Å; P452-N501 PolarHBondContact O-ND2 2.78Å; P454-N501 HydrophobicContact CB-CB 4.38Å; N501-G503 PolarHBondContact O-N 3.32Å; N501-G503 VanDerWaalsContact O-N 3.15Å; N501-G503 WeakPolarHBondContact OD1-CA 3.33Å; N501-G503 PolarHBondContact OD1-N 3.15Å; N501-G504 PolarHBondContact N-O 3.02Å; N501-G504 PolarHBondContact O-N 3.49Å; N501-G504 VanDerWaalsContact O-O 3.14Å; N501-G504 PolarHBondContact OD1-N 3.29Å; N501-G504 PolarHBondContact OD1-O 3.07Å; N501-G504 VanDerWaalsContact OD1-O 3.13Å
502	A	94.6	Very high	96	Very high	54 Å²	54	34.5 Å²	34.5	45%	0.446	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-20.6	179.3	0	0	0	0	0	114	C375 R376 G504	C375-A502 VanDerWaalsContact SG-CB 3.58Å; R376-A502 HydrophobicContact CG-CB 3.39Å; A502-G504 VanDerWaalsContact C-N 3.34Å
503	G	92.7	Very high	96	Very high	29 Å²	29	34.1 Å²	34.1	30%	0.299	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-10.6	173.9	0	0	0	0	0	114.4	R423 N501	R423-G503 WeakPolarHBondContact CB-O 3.31Å; N501-G503 PolarHBondContact O-N 3.32Å; N501-G503 VanDerWaalsContact O-N 3.15Å; N501-G503 WeakPolarHBondContact OD1-CA 3.33Å; N501-G503 PolarHBondContact OD1-N 3.15Å
504	G	94.4	Very high	96	Very high	22 Å²	22	34.1 Å²	34.1	23%	0.227	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	135	-174.3	177.3	0	0	0	0	0	113.1	N501 A502	N501-G504 PolarHBondContact N-O 3.02Å; N501-G504 PolarHBondContact O-N 3.49Å; N501-G504 VanDerWaalsContact O-O 3.14Å; N501-G504 PolarHBondContact OD1-N 3.29Å; N501-G504 PolarHBondContact OD1-O 3.07Å; N501-G504 VanDerWaalsContact OD1-O 3.13Å; A502-G504 VanDerWaalsContact C-N 3.34Å
505	N	95.9	Very high	95.7	Very high	91 Å²	91	37.3 Å²	37.3	49%	0.487	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	160.8	-176.6	57.4	4.8	0	0	0	112.4	R423 A499 A500	R423-N505 VanDerWaalsContact CZ-O 3.27Å; R423-N505 PolarHBondContact NE-O 3.07Å; R423-N505 PolarHBondContact NH2-O 2.9Å; A499-N505 CarbonylContact O-C 3.51Å; A499-N505 VanDerWaalsContact O-CA 3.24Å; A499-N505 WeakPolarHBondContact O-CA 3.35Å; A500-N505 HydrophobicContact CB-CB 4.19Å
506	D	96.9	Very high	95	Very high	29 Å²	29	40.3 Å²	40.3	16%	0.155	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	151.8	171	-171.5	18.7	0	0	0	108.7	A424 R425 I426 R429 A499	A424-D506 WeakPolarHBondContact O-CB 3.46Å; R425-D506 WeakPolarHBondContact CA-OD2 3.36Å; I426-D506 HydrophobicContact CG1-CB 4.39Å; I426-D506 PolarHBondContact N-OD2 2.74Å; R429-D506 IonicContact CZ-OD1 3.76Å; R429-D506 IonicContact CZ-OD2 2.82Å; R429-D506 IonicContact NH1-OD1 2.76Å; R429-D506 PolarHBondContact NH1-OD1 3.28Å; R429-D506 IonicContact NH1-OD2 3.97Å; R429-D506 PolarHBondContact NH1-OD2 2.96Å; R429-D506 IonicContact NH2-OD1 3.76Å; A499-D506 PolarHBondContact N-O 3.08Å; A499-D506 PolarHBondContact O-N 2.82Å
507	S	96.1	Very high	93.5	Very high	59 Å²	59	47.7 Å²	47.7	41%	0.413	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	144.2	-173.5	64.1	0	0	0	0	112.9	C497	C497-S507 CarbonylContact O-C 3.55Å; C497-S507 WeakPolarHBondContact O-CA 3.45Å; C497-S507 WeakPolarHBondContact O-CB 3.45Å
508	M	96.3	Very high	91.3	Very high	18 Å²	18	50.8 Å²	50.8	9%	0.089	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	126.1	-179.5	-169.1	59.6	51.4	0	0	110.8	I426 R429 C497	I426-M508 HydrophobicContact CD1-CB 3.68Å; I426-M508 HydrophobicContact CG2-CB 4.17Å; R429-M508 HydrophobicContact CB-CE 4.22Å; R429-M508 HydrophobicContact CG-CE 4.46Å; C497-M508 PolarHBondContact N-O 3.39Å; C497-M508 PolarHBondContact O-N 3.13Å
509	P	96.8	Very high	89.1	Confident	47 Å²	47	54.8 Å²	54.8	31%	0.305	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	148.7	175.8	31.5	-34.4	0	0	0	112.2	T494 Y495	T494-P509 HydrophobicContact CG2-CB 3.97Å; Y495-P509 CarbonylContact O-C 3.6Å; Y495-P509 WeakPolarHBondContact O-CA 3.39Å
510	A	96.8	Very high	86.6	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.008	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	133	169.4	0	0	0	0	0	109.9	Q432 F444 W458 T494 Y495	Q432-A510 HydrophobicContact CB-CB 4.08Å; Q432-A510 CarbonylContact O-C 3.52Å; Q432-A510 WeakPolarHBondContact O-CA 3.25Å; F444-A510 HydrophobicContact CB-CB 4.32Å; F444-A510 HydrophobicContact CD1-CB 3.59Å; F444-A510 HydrophobicContact CD2-CB 4.5Å; F444-A510 HydrophobicContact CE1-CB 3.91Å; F444-A510 HydrophobicContact CG-CB 3.9Å; F444-A510 HydrophobicContact CZ-CB 4.49Å; W458-A510 HydrophobicContact CH2-CB 4.21Å; W458-A510 HydrophobicContact CZ3-CB 3.98Å; T494-A510 CarbonylContact C-O 3.51Å; Y495-A510 PolarHBondContact N-O 3.07Å; Y495-A510 PolarHBondContact O-N 3.48Å
511	H	97.3	Very high	84	Confident	60 Å²	60	70.2 Å²	70.2	28%	0.278	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	123.2	-175	-59.5	-71.1	0	0	0	110.7	Q432 Q433 V434 T494	Q432-H511 PolarHBondContact O-N 3.43Å; Q433-H511 WeakPolarHBondContact CA-O 3.37Å; Q433-H511 HydrophobicContact CB-CB 4.39Å; Q433-H511 HydrophobicContact CG-CB 4.12Å; V434-H511 PolarHBondContact N-O 3.15Å; T494-H511 PolarHBondContact OG1-CE1 2.85Å; T494-H511 PolarHBondContact OG1-ND1 3.35Å
512	L	96.3	Very high	81.3	Confident	1 Å²	1	74.3 Å²	74.3	1%	0.005	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	123.9	173.1	-174.2	57.7	0	0	0	110.1	V436 V442 F444 V484 D491 N492 G493 Y495 V514	V436-L512 HydrophobicContact CB-CD1 4.45Å; V436-L512 HydrophobicContact CG1-CD1 3.64Å; V436-L512 HydrophobicContact CG1-CG 4.43Å; V442-L512 HydrophobicContact CG1-CD1 3.78Å; V442-L512 HydrophobicContact CG1-CD2 4.28Å; V442-L512 HydrophobicContact CG2-CD1 4.32Å; F444-L512 HydrophobicContact CE2-CB 4.14Å; F444-L512 HydrophobicContact CE2-CD1 4.36Å; F444-L512 HydrophobicContact CZ-CB 3.77Å; F444-L512 HydrophobicContact CZ-CD1 3.93Å; F444-L512 HydrophobicContact CZ-CG 4.36Å; V484-L512 HydrophobicContact CG1-CD2 4.45Å; D491-L512 HydrophobicContact CB-CD2 4.32Å; N492-L512 PolarHBondContact OD1-O 3.31Å; G493-L512 PolarHBondContact N-O 3.5Å; G493-L512 PolarHBondContact O-N 3.37Å; Y495-L512 HydrophobicContact CD2-CB 4.09Å; Y495-L512 HydrophobicContact CE2-CB 3.8Å; Y495-L512 HydrophobicContact CE2-CD2 3.85Å; Y495-L512 HydrophobicContact CE2-CG 4.48Å; L512-V514 HydrophobicContact CD2-CG2 4.07Å; L512-V514 HydrophobicContact CG-CG2 3.99Å
513	H	95.3	Very high	78.8	Confident	64 Å²	64	80.9 Å²	80.9	30%	0.296	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	109	173.1	-63.5	-70.1	0	0	0	110.5	Q433 V434 F435 V436 N492	Q433-H513 PolarHBondContact NE2-NE2 2.83Å; V434-H513 PolarHBondContact O-N 2.87Å; F435-H513 WeakPolarHBondContact CA-O 3.37Å; F435-H513 HydrophobicContact CD1-CB 3.37Å; F435-H513 AromaticContact CD1-CD2 4Å; F435-H513 AromaticContact CD1-CG 3.87Å; F435-H513 HydrophobicContact CE1-CB 3.66Å; F435-H513 AromaticContact CE1-CD2 3.54Å; F435-H513 AromaticContact CE1-CG 3.62Å; F435-H513 HydrophobicContact CG-CB 4.07Å; F435-H513 AromaticContact CZ-CD2 3.62Å; V436-H513 PolarHBondContact N-O 3.06Å; N492-H513 WeakPolarHBondContact OD1-CA 3.37Å
514	V	94	Very high	76.2	Confident	21 Å²	21	88.3 Å²	88.3	13%	0.127	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	126.7	179.7	-173.5	0	0	0	0	110.1	V436 E438 A487 N492 L512	V436-V514 HydrophobicContact CG1-CG2 3.99Å; V436-V514 CarbonylContact O-C 3.47Å; V436-V514 VanDerWaalsContact O-CA 3.31Å; V436-V514 WeakPolarHBondContact O-CA 3.33Å; E438-V514 HydrophobicContact CB-CG1 4.34Å; A487-V514 HydrophobicContact CB-CG2 4.33Å; N492-V514 HydrophobicContact CB-CB 4.33Å; N492-V514 HydrophobicContact CB-CG2 4.19Å; N492-V514 PolarHBondContact OD1-N 3.39Å; L512-V514 HydrophobicContact CD2-CG2 4.07Å; L512-V514 HydrophobicContact CG-CG2 3.99Å
515	R	90.3	Very high	73.8	Confident	138 Å²	138	92.4 Å²	92.4	52%	0.521	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	122.8	174.7	-53.3	-179.1	-164	170.7	3.7	109.3	V436 D437 E438	V436-R515 PolarHBondContact O-N 3.09Å; D437-R515 WeakPolarHBondContact OD1-CB 3.31Å; D437-R515 WeakPolarHBondContact OD1-CD 3.19Å; E438-R515 PolarHBondContact N-O 3.03Å
516	S	82.1	Confident	71.3	Confident	65 Å²	65	95.2 Å²	95.2	46%	0.455	49%	0.489	S	S	.	.			trans	-106.4	129.7	170.7	60.4	0	0	0	0	109.9
517	Y	65.5	Low	68.4	Low	207 Å²	207	103.5 Å²	103.5	81%	0.812	52%	0.524	S	S	*	.			trans	-85.7	112.7	166.4	-91.8	-88.4	0	0	0	108.9
518	S	51.3	Low	65.6	Low	66 Å²	66	106.8 Å²	106.8	46%	0.462	54%	0.542	S	S	.	.			trans	-88.3	120	166.6	-172.6	0	0	0	0	108.8	D520	S518-D520 VanDerWaalsContact C-N 3.26Å; S518-D520 PolarHBondContact O-N 3Å
519	P	49.6	Very low	62.8	Low	123 Å²	123	115.5 Å²	115.5	80%	0.799	58%	0.579	S	S	*	*	S	Bend	trans	-71.7	-15.3	177.3	-16.4	30.8	0	0	0	114.2	W521	P519-W521 PolarHBondContact O-N 3.01Å
520	D	45.9	Very low	59.7	Low	146 Å²	146	117.9 Å²	117.9	78%	0.781	60%	0.603	S	S	*	*			trans	-101.1	59.3	-173.5	-71.6	-30.2	0	0	0	113	S518	S518-D520 VanDerWaalsContact C-N 3.26Å; S518-D520 PolarHBondContact O-N 3Å
521	W	39.2	Very low	56.9	Low	209 Å²	209	127 Å²	127	79%	0.792	64%	0.643	S	S	*	*			trans	-121	121.8	160.6	-113.8	-74.1	0	0	0	110.2	P519 H523	P519-W521 PolarHBondContact O-N 3.01Å; W521-H523 PolarHBondContact O-N 2.94Å
522	P	40.4	Very low	53.9	Low	111 Å²	111	131.3 Å²	131.3	72%	0.721	67%	0.667	S	S	*	*			trans	-64.2	131.3	-179.4	25.5	-31.3	0	0	0	109.6	Q524	P522-Q524 PolarHBondContact O-N 3.26Å; P522-Q524 VanDerWaalsContact O-N 3.09Å
523	H	41.8	Very low	50.9	Low	192 Å²	192	135.1 Å²	135.1	89%	0.889	69%	0.693	S	S	*	*			trans	-42.8	114.3	174.1	-63.8	-73.4	0	0	0	111.8	W521	W521-H523 PolarHBondContact O-N 2.94Å
524	Q	37.5	Very low	48	Very low	184 Å²	184	139.3 Å²	139.3	86%	0.86	72%	0.718	S	S	*	*			trans	-116.7	115.4	153.7	-86.5	-174.2	-18.5	0	0	108.1	P522	P522-Q524 PolarHBondContact O-N 3.26Å; P522-Q524 VanDerWaalsContact O-N 3.09Å
525	P	45.3	Very low	45.1	Very low	109 Å²	109	146.1 Å²	146.1	71%	0.708	75%	0.748	S	S	*	*			trans	-73.8	134.2	170	31.4	-28.4	0	0	0	107.6
526	N	42	Very low	42.6	Very low	149 Å²	149	146 Å²	146	80%	0.797	77%	0.765	S	S	*	*			trans	81.7	88.6	174.1	-49.9	-26.9	0	0	0	116
527	K	36.3	Very low	40.2	Very low	203 Å²	203	146.4 Å²	146.4	88%	0.883	78%	0.78	S	S	*	*				-174.2	143.8	118.8	-98.1	162.8	-175.9	-178.9	0	111
528	T	36.8	Very low	39	Very low	129 Å²	129	146.3 Å²	146.3	79%	0.791	79%	0.787	S	S	*	*			trans	-22.9	133.6	171.7	22.4	0	0	0	0	117	A530	T528-A530 PolarHBondContact O-N 2.89Å
529	F	38.5	Very low	38.3	Very low	201 Å²	201	146.5 Å²	146.5	88%	0.882	80%	0.799	S	S	*	*			trans	-28	101.3	166.1	-72.6	-93.6	0	0	0	113.4	F531	F529-F531 PolarHBondContact O-N 2.9Å
530	A	31.7	Very low	37.5	Very low	97 Å²	97	150.3 Å²	150.3	80%	0.802	81%	0.806	S	S	*	*			trans	-85.2	109.2	168.8	0	0	0	0	0	108.8	T528 I532	T528-A530 PolarHBondContact O-N 2.89Å; A530-I532 PolarHBondContact O-N 3.28Å
531	F	37.8	Very low	37.4	Very low	191 Å²	191	147.5 Å²	147.5	84%	0.838	80%	0.803	S	S	*	*			trans	-61.1	124.2	171.5	-78.9	-102.2	0	0	0	110.6	F529 S533	F529-F531 PolarHBondContact O-N 2.9Å; F531-S533 VanDerWaalsContact C-N 3.29Å; F531-S533 PolarHBondContact O-N 3.31Å; F531-S533 VanDerWaalsContact O-N 3.16Å
532	I	35.1	Very low	37.2	Very low	152 Å²	152	145.2 Å²	145.2	78%	0.779	81%	0.807	S	S	*	*			trans	-83.6	84.4	159.6	-57.3	177.6	0	0	0	107	A530	A530-I532 PolarHBondContact O-N 3.28Å
533	S	32.2	Very low	36.8	Very low	80 Å²	80	145.6 Å²	145.6	56%	0.559	81%	0.812	S	S	*	*			trans	-84.9	102.3	164.2	157.6	0	0	0	0	108	F531 Q535	F531-S533 VanDerWaalsContact C-N 3.29Å; F531-S533 PolarHBondContact O-N 3.31Å; F531-S533 VanDerWaalsContact O-N 3.16Å; S533-Q535 VanDerWaalsContact C-N 3.28Å; S533-Q535 PolarHBondContact O-N 2.84Å; S533-Q535 VanDerWaalsContact O-N 3.17Å
534	N	34.9	Very low	36.4	Very low	153 Å²	153	142.6 Å²	142.6	82%	0.818	81%	0.807	S	S	*	*			trans	-83.1	79.4	162.4	-76.8	-11.9	0	0	0	108.8
535	Q	33.6	Very low	36.7	Very low	163 Å²	163	146 Å²	146	76%	0.762	81%	0.812	S	S	*	*			trans	-118	135	157.8	-86.4	-171.7	-17.1	0	0	108.1	S533 G537	S533-Q535 VanDerWaalsContact C-N 3.28Å; S533-Q535 PolarHBondContact O-N 2.84Å; S533-Q535 VanDerWaalsContact O-N 3.17Å; Q535-G537 PolarHBondContact O-N 3.08Å
536	P	37.9	Very low	36.1	Very low	136 Å²	136	145.2 Å²	145.2	88%	0.883	82%	0.815	S	S	*	*			trans	-81.6	115.8	171.9	31.1	-26.6	0	0	0	109.1
537	G	30.6	Very low	35.8	Very low	74 Å²	74	144.9 Å²	144.9	76%	0.763	82%	0.818	S	S	*	*			trans	-99	129.9	166.5	0	0	0	0	0	110	Q535	Q535-G537 PolarHBondContact O-N 3.08Å
538	E	41.2	Very low	36.1	Very low	204 Å²	204	141.1 Å²	141.1	95%	0.953	81%	0.813	S	S	*	*			trans	-66.3	134.4	172.3	-66.2	-178.9	150.4	0	0	110.8
539	G	36.3	Very low	36.4	Very low	70 Å²	70	140.7 Å²	140.7	72%	0.722	81%	0.812	S	S	*	*			trans	156.1	97.1	171	0	0	0	0	0	115.2
540	E	32.5	Very low	36.4	Very low	204 Å²	204	140.2 Å²	140.2	95%	0.953	81%	0.81	S	S	*	*			trans	77.3	138.9	149.2	-63.3	-177.3	163.7	0	0	121.2
541	A	43.6	Very low	37.2	Very low	86 Å²	86	140.5 Å²	140.5	71%	0.711	80%	0.803	S	S	*	*			trans	-94.6	168.5	-167.4	0	0	0	0	0	112.8
542	N	35.2	Very low	37.6	Very low	162 Å²	162	139.3 Å²	139.3	87%	0.866	80%	0.798	S	S	*	*			trans	79.9	94.9	166.5	-61.1	-17.9	0	0	0	117.2
543	S	31.8	Very low	38.8	Very low	118 Å²	118	136.9 Å²	136.9	83%	0.825	79%	0.787	S	S	*	*				-163.3	157.6	118.6	-153.3	0	0	0	0	111.8
544	T	34.2	Very low	40.3	Very low	130 Å²	130	138.9 Å²	138.9	80%	0.798	79%	0.79	S	S	*	*			trans	-64.3	146.2	-160.7	43.3	0	0	0	0	116.6	A546	T544-A546 PolarHBondContact O-N 2.81Å
545	R	43.1	Very low	41.5	Very low	254 Å²	254	138.9 Å²	138.9	96%	0.958	78%	0.783	S	S	*	*			trans	-35.6	120.6	170.1	-80.8	173.9	166.9	154.4	-4	113.8
546	A	33.5	Very low	42.8	Very low	94 Å²	94	135.4 Å²	135.4	78%	0.777	77%	0.772	S	S	*	*			trans	-116	120.1	154.1	0	0	0	0	0	108.7	T544	T544-A546 PolarHBondContact O-N 2.81Å
547	T	35.6	Very low	43.9	Very low	141 Å²	141	134.3 Å²	134.3	87%	0.865	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-69.1	120.7	179	41.4	0	0	0	0	111.3
548	V	42	Very low	45.6	Very low	125 Å²	125	135.3 Å²	135.3	76%	0.758	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-80.6	135.9	168.9	-175.4	0	0	0	0	108.7
549	P	42.3	Very low	47	Very low	119 Å²	119	130.1 Å²	130.1	77%	0.773	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-72.6	130.9	-178.5	29.3	-31.7	0	0	0	110.9
550	F	38.3	Very low	48.3	Very low	192 Å²	192	130 Å²	130	84%	0.842	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-75.1	141.8	173.6	-106.4	-93.7	0	0	0	110.8	F552	F550-F552 PolarHBondContact O-N 2.84Å
551	P	48.5	Very low	50	Low	102 Å²	102	124.4 Å²	124.4	66%	0.662	70%	0.695	S	S	*	*	S	Bend	trans	-97.3	63.8	-173.8	39	-33.8	0	0	0	111.3
552	F	48	Very low	51.3	Low	166 Å²	166	123.7 Å²	123.7	73%	0.728	68%	0.682	S	S	*	*			trans	-144.8	117.3	165.1	-70.1	-70.4	0	0	0	110.4	F550 I554	F550-F552 PolarHBondContact O-N 2.84Å; F552-I554 PolarHBondContact O-N 2.94Å
553	D	60	Low	52.9	Low	101 Å²	101	122.2 Å²	122.2	54%	0.54	67%	0.672	S	S	.	*			trans	-65.2	117.9	172.3	-178.2	4.4	0	0	0	108.8	K555 T556 L557	D553-K555 PolarHBondContact O-N 3.43Å; D553-K555 PolarHBondContact OD1-N 3.35Å; D553-T556 PolarHBondContact O-N 3.1Å; D553-T556 PolarHBondContact O-OG1 3.32Å; D553-T556 VanDerWaalsContact O-OG1 3.04Å; D553-L557 PolarHBondContact O-N 3.41Å
554	I	64.3	Low	54.8	Low	123 Å²	123	118.4 Å²	118.4	63%	0.631	65%	0.651	S	S	*	*	H	α-helix	trans	-56.3	-26.7	-176.4	-78.3	165.2	0	0	0	111.3	F552 T556 L557 I558	F552-I554 PolarHBondContact O-N 2.94Å; I554-T556 VanDerWaalsContact C-N 3.35Å; I554-T556 PolarHBondContact O-N 2.91Å; I554-L557 PolarHBondContact O-N 3.44Å; I554-I558 HydrophobicContact CG2-CD1 3.72Å; I554-I558 HydrophobicContact CG2-CG1 4.46Å; I554-I558 WeakPolarHBondContact O-CD1 3.46Å; I554-I558 VanDerWaalsContact O-CG1 3.28Å; I554-I558 WeakPolarHBondContact O-CG1 3.3Å; I554-I558 PolarHBondContact O-N 3.02Å
555	K	59.5	Low	56.6	Low	153 Å²	153	118.7 Å²	118.7	67%	0.665	64%	0.641	S	S	*	*	H	α-helix	trans	-65.5	-36.8	175.1	-67.5	-178.2	178.9	178.3	0	112.3	D553 I559	D553-K555 PolarHBondContact O-N 3.43Å; D553-K555 PolarHBondContact OD1-N 3.35Å; K555-I559 WeakPolarHBondContact O-CD1 3.36Å; K555-I559 VanDerWaalsContact O-CG1 3.23Å; K555-I559 WeakPolarHBondContact O-CG1 3.46Å; K555-I559 PolarHBondContact O-N 3.42Å
556	T	59.6	Low	58.1	Low	89 Å²	89	112.6 Å²	112.6	55%	0.546	63%	0.627	S	S	.	*	H	α-helix	trans	-73.4	-35.3	-179.8	-14.9	0	0	0	0	111.7	D553 I554 I559 A560	D553-T556 PolarHBondContact O-N 3.1Å; D553-T556 PolarHBondContact O-OG1 3.32Å; D553-T556 VanDerWaalsContact O-OG1 3.04Å; I554-T556 VanDerWaalsContact C-N 3.35Å; I554-T556 PolarHBondContact O-N 2.91Å; T556-I559 PolarHBondContact O-N 3.49Å; T556-A560 WeakPolarHBondContact O-CB 3.47Å; T556-A560 PolarHBondContact O-N 2.9Å
557	L	62.9	Low	60.1	Low	113 Å²	113	111.6 Å²	111.6	59%	0.592	61%	0.614	S	S	*	*	H	α-helix	trans	-67.8	-38.7	176.5	-165.8	81.5	0	0	0	111.8	D553 I554 T561	D553-L557 PolarHBondContact O-N 3.41Å; I554-L557 PolarHBondContact O-N 3.44Å; L557-T561 WeakPolarHBondContact O-CB 3.48Å; L557-T561 WeakPolarHBondContact O-CG2 3.39Å; L557-T561 PolarHBondContact O-N 3.35Å; L557-T561 PolarHBondContact O-OG1 3.49Å
558	I	66.3	Low	62	Low	95 Å²	95	111.2 Å²	111.2	49%	0.487	60%	0.6	S	S	.	*	H	α-helix	trans	-69.1	-38.3	178.2	-66.7	167.9	0	0	0	110.7	I554 T561 T562	I554-I558 HydrophobicContact CG2-CD1 3.72Å; I554-I558 HydrophobicContact CG2-CG1 4.46Å; I554-I558 WeakPolarHBondContact O-CD1 3.46Å; I554-I558 VanDerWaalsContact O-CG1 3.28Å; I554-I558 WeakPolarHBondContact O-CG1 3.3Å; I554-I558 PolarHBondContact O-N 3.02Å; I558-T561 WeakPolarHBondContact CA-OG1 3.43Å; I558-T561 PolarHBondContact O-OG1 3.22Å; I558-T562 HydrophobicContact CG2-CG2 4.48Å; I558-T562 WeakPolarHBondContact O-CB 3.32Å; I558-T562 VanDerWaalsContact O-CG2 3.26Å; I558-T562 WeakPolarHBondContact O-CG2 3.37Å; I558-T562 PolarHBondContact O-N 3.12Å; I558-T562 PolarHBondContact O-OG1 3.44Å
559	I	68.9	Low	63.8	Low	96 Å²	96	109 Å²	109	49%	0.492	58%	0.584	S	S	.	*	H	α-helix	trans	-68.4	-42.8	177	-65	164.2	0	0	0	111.2	K555 T556 T561 T562 M563	K555-I559 WeakPolarHBondContact O-CD1 3.36Å; K555-I559 VanDerWaalsContact O-CG1 3.23Å; K555-I559 WeakPolarHBondContact O-CG1 3.46Å; K555-I559 PolarHBondContact O-N 3.42Å; T556-I559 PolarHBondContact O-N 3.49Å; I559-T561 PolarHBondContact O-N 2.9Å; I559-T562 WeakPolarHBondContact CA-OG1 3.31Å; I559-T562 PolarHBondContact O-N 3.41Å; I559-T562 PolarHBondContact O-OG1 2.96Å; I559-T562 VanDerWaalsContact O-OG1 3.04Å; I559-M563 HydrophobicContact CG2-SD 4.13Å; I559-M563 WeakPolarHBondContact O-CG 3.45Å; I559-M563 PolarHBondContact O-N 3.32Å
560	A	63.6	Low	65.8	Low	67 Å²	67	105.4 Å²	105.4	55%	0.554	57%	0.568	S	S	*	*	H	α-helix	trans	-65.1	-39.7	178.1	0	0	0	0	0	112.8	T556 G564	T556-A560 WeakPolarHBondContact O-CB 3.47Å; T556-A560 PolarHBondContact O-N 2.9Å; A560-G564 PolarHBondContact O-N 2.99Å
561	T	68.4	Low	68	Low	87 Å²	87	100.8 Å²	100.8	53%	0.534	56%	0.555	S	S	.	*	H	α-helix	trans	-72.7	-36	179.4	44.3	0	0	0	0	112.4	L557 I558 I559 F565	L557-T561 WeakPolarHBondContact O-CB 3.48Å; L557-T561 WeakPolarHBondContact O-CG2 3.39Å; L557-T561 PolarHBondContact O-N 3.35Å; L557-T561 PolarHBondContact O-OG1 3.49Å; I558-T561 WeakPolarHBondContact CA-OG1 3.43Å; I558-T561 PolarHBondContact O-OG1 3.22Å; I559-T561 PolarHBondContact O-N 2.9Å; T561-F565 WeakPolarHBondContact O-CB 3.37Å; T561-F565 PolarHBondContact O-N 3.34Å; T561-F565 VanDerWaalsContact O-N 3.08Å
562	T	70.5	Confident	69.8	Low	70 Å²	70	98.9 Å²	98.9	43%	0.429	54%	0.542	S	S	.	.	H	α-helix	trans	-71.3	-39.1	177.1	49.2	0	0	0	0	113.3	I558 I559 F565 I566	I558-T562 HydrophobicContact CG2-CG2 4.48Å; I558-T562 WeakPolarHBondContact O-CB 3.32Å; I558-T562 VanDerWaalsContact O-CG2 3.26Å; I558-T562 WeakPolarHBondContact O-CG2 3.37Å; I558-T562 PolarHBondContact O-N 3.12Å; I558-T562 PolarHBondContact O-OG1 3.44Å; I559-T562 WeakPolarHBondContact CA-OG1 3.31Å; I559-T562 PolarHBondContact O-N 3.41Å; I559-T562 PolarHBondContact O-OG1 2.96Å; I559-T562 VanDerWaalsContact O-OG1 3.04Å; T562-F565 PolarHBondContact O-N 3.47Å; T562-I566 WeakPolarHBondContact O-CG1 3.34Å; T562-I566 PolarHBondContact O-N 3Å
563	M	70.2	Confident	71.4	Confident	132 Å²	132	95.9 Å²	95.9	65%	0.65	53%	0.533	S	S	*	.	H	α-helix	trans	-68.6	-36.6	175.1	-69.6	-175.5	81.5	0	0	112.7	I559 S567	I559-M563 HydrophobicContact CG2-SD 4.13Å; I559-M563 WeakPolarHBondContact O-CG 3.45Å; I559-M563 PolarHBondContact O-N 3.32Å; M563-S567 PolarHBondContact O-N 3.42Å; M563-S567 PolarHBondContact O-OG 3.01Å
564	G	71.3	Confident	72.5	Confident	38 Å²	38	97.5 Å²	97.5	39%	0.392	54%	0.535	S	S	.	.	H	α-helix	trans	-67.7	-37.2	175.2	0	0	0	0	0	113.1	A560 S567 F568	A560-G564 PolarHBondContact O-N 2.99Å; G564-S567 PolarHBondContact O-OG 3.17Å; G564-F568 WeakPolarHBondContact O-CB 3.43Å; G564-F568 PolarHBondContact O-N 3.16Å; G564-F568 VanDerWaalsContact O-N 3.13Å
565	F	72.4	Confident	73.2	Confident	135 Å²	135	94.8 Å²	94.8	59%	0.592	53%	0.526	S	S	*	.	H	α-helix	trans	-72.6	-39.7	-178.7	-161.4	-102	0	0	0	112.6	T561 T562 F568 L569	T561-F565 WeakPolarHBondContact O-CB 3.37Å; T561-F565 PolarHBondContact O-N 3.34Å; T561-F565 VanDerWaalsContact O-N 3.08Å; T562-F565 PolarHBondContact O-N 3.47Å; F565-F568 PolarHBondContact O-N 3.48Å; F565-L569 HydrophobicContact CD1-CD1 3.87Å; F565-L569 HydrophobicContact CE1-CD1 3.3Å; F565-L569 HydrophobicContact CZ-CD1 3.78Å; F565-L569 WeakPolarHBondContact O-CB 3.38Å; F565-L569 PolarHBondContact O-N 3.37Å
566	I	74.3	Confident	74.3	Confident	127 Å²	127	92.6 Å²	92.6	65%	0.651	52%	0.521	S	S	*	.	H	α-helix	trans	-67.6	-40.4	179.1	-67.3	167.3	0	0	0	111.3	T562 G570	T562-I566 WeakPolarHBondContact O-CG1 3.34Å; T562-I566 PolarHBondContact O-N 3Å; I566-G570 PolarHBondContact O-N 3.19Å
567	S	75.5	Confident	75.4	Confident	72 Å²	72	91.9 Å²	91.9	50%	0.503	52%	0.517	S	S	.	.	H	α-helix	trans	-67.5	-39.6	176.8	51.4	0	0	0	0	112.1	M563 G564 G570 V571	M563-S567 PolarHBondContact O-N 3.42Å; M563-S567 PolarHBondContact O-OG 3.01Å; G564-S567 PolarHBondContact O-OG 3.17Å; S567-G570 PolarHBondContact O-N 3.04Å; S567-V571 WeakPolarHBondContact O-CG2 3.47Å; S567-V571 PolarHBondContact O-N 3.31Å
568	F	76.3	Confident	76.1	Confident	134 Å²	134	90.7 Å²	90.7	59%	0.588	51%	0.511	S	S	*	.	H	α-helix	trans	-63.5	-46.5	174.6	-179.2	-101.9	0	0	0	112.3	G564 F565 G570 V571 V572	G564-F568 WeakPolarHBondContact O-CB 3.43Å; G564-F568 PolarHBondContact O-N 3.16Å; G564-F568 VanDerWaalsContact O-N 3.13Å; F565-F568 PolarHBondContact O-N 3.48Å; F568-G570 VanDerWaalsContact C-N 3.32Å; F568-G570 PolarHBondContact O-N 3.42Å; F568-V571 PolarHBondContact O-N 3.13Å; F568-V572 HydrophobicContact CD1-CG2 4.4Å; F568-V572 HydrophobicContact CE1-CG2 4.03Å; F568-V572 HydrophobicContact CE2-CG2 4.32Å; F568-V572 HydrophobicContact CZ-CG2 3.99Å; F568-V572 WeakPolarHBondContact O-CG2 3.42Å; F568-V572 PolarHBondContact O-N 2.98Å; F568-V572 VanDerWaalsContact O-N 3.12Å
569	L	80.1	Confident	76.8	Confident	79 Å²	79	91.1 Å²	91.1	41%	0.414	51%	0.513	S	S	.	.	H	α-helix	trans	-64.8	-37.5	-179.9	-127.4	128.7	0	0	0	111.9	F565 V572 L573	F565-L569 HydrophobicContact CD1-CD1 3.87Å; F565-L569 HydrophobicContact CE1-CD1 3.3Å; F565-L569 HydrophobicContact CZ-CD1 3.78Å; F565-L569 WeakPolarHBondContact O-CB 3.38Å; F565-L569 PolarHBondContact O-N 3.37Å; L569-V572 PolarHBondContact O-N 3.46Å; L569-L573 HydrophobicContact CD2-CD1 4.32Å; L569-L573 WeakPolarHBondContact O-CB 3.45Å; L569-L573 PolarHBondContact O-N 3.08Å
570	G	82.8	Confident	77.2	Confident	42 Å²	42	92.3 Å²	92.3	43%	0.433	52%	0.515	S	S	.	.	H	α-helix	trans	-61.5	-43	175.7	0	0	0	0	0	113.3	I566 S567 F568 F574	I566-G570 PolarHBondContact O-N 3.19Å; S567-G570 PolarHBondContact O-N 3.04Å; F568-G570 VanDerWaalsContact C-N 3.32Å; F568-G570 PolarHBondContact O-N 3.42Å; G570-F574 WeakPolarHBondContact O-CB 3.47Å; G570-F574 PolarHBondContact O-N 3.44Å
571	V	85.3	Confident	77.7	Confident	95 Å²	95	94.3 Å²	94.3	58%	0.576	52%	0.516	S	S	*	.	H	α-helix	trans	-67.3	-40.7	178.1	174.8	0	0	0	0	111.3	S567 F568 F574 C575	S567-V571 WeakPolarHBondContact O-CG2 3.47Å; S567-V571 PolarHBondContact O-N 3.31Å; F568-V571 PolarHBondContact O-N 3.13Å; V571-F574 PolarHBondContact O-N 3.01Å; V571-C575 WeakPolarHBondContact O-CB 3.39Å; V571-C575 PolarHBondContact O-N 2.9Å
572	V	85.1	Confident	77.5	Confident	62 Å²	62	98.8 Å²	98.8	38%	0.376	52%	0.523	S	S	.	.	H	α-helix	trans	-65.3	-43.3	178.4	174	0	0	0	0	111.2	F568 L569 C575 L576	F568-V572 HydrophobicContact CD1-CG2 4.4Å; F568-V572 HydrophobicContact CE1-CG2 4.03Å; F568-V572 HydrophobicContact CE2-CG2 4.32Å; F568-V572 HydrophobicContact CZ-CG2 3.99Å; F568-V572 WeakPolarHBondContact O-CG2 3.42Å; F568-V572 PolarHBondContact O-N 2.98Å; F568-V572 VanDerWaalsContact O-N 3.12Å; L569-V572 PolarHBondContact O-N 3.46Å; V572-C575 PolarHBondContact O-N 3.32Å; V572-L576 HydrophobicContact CG1-CD1 4.16Å; V572-L576 WeakPolarHBondContact O-CG 3.47Å; V572-L576 PolarHBondContact O-N 3.48Å
573	L	81.6	Confident	77.4	Confident	103 Å²	103	99.7 Å²	99.7	54%	0.539	53%	0.532	S	S	.	.	H	α-helix	trans	-66	-40.3	178.4	-127.9	142.9	0	0	0	111.6	L569 L576 V577	L569-L573 HydrophobicContact CD2-CD1 4.32Å; L569-L573 WeakPolarHBondContact O-CB 3.45Å; L569-L573 PolarHBondContact O-N 3.08Å; L573-L576 PolarHBondContact O-N 3.03Å; L573-V577 WeakPolarHBondContact O-CG2 3.43Å; L573-V577 PolarHBondContact O-N 2.71Å
574	F	83.6	Confident	77	Confident	136 Å²	136	102.6 Å²	102.6	60%	0.596	54%	0.536	S	S	*	.	H	α-helix	trans	-63.2	-43.6	174.7	-176.4	-102.9	0	0	0	112.4	G570 V571 L576 V577 L578	G570-F574 WeakPolarHBondContact O-CB 3.47Å; G570-F574 PolarHBondContact O-N 3.44Å; V571-F574 PolarHBondContact O-N 3.01Å; F574-L576 PolarHBondContact O-N 3.15Å; F574-V577 PolarHBondContact O-N 3.33Å; F574-L578 HydrophobicContact CD1-CD1 3.94Å; F574-L578 HydrophobicContact CE1-CD1 3.45Å; F574-L578 VanDerWaalsContact CE1-CD1 3.45Å; F574-L578 HydrophobicContact CE1-CG 4.21Å; F574-L578 HydrophobicContact CZ-CD1 3.97Å; F574-L578 HydrophobicContact CZ-CG 4.35Å; F574-L578 PolarHBondContact O-N 3.04Å
575	C	79.6	Confident	76.3	Confident	65 Å²	65	103.3 Å²	103.3	44%	0.439	54%	0.544	S	S	.	.	H	α-helix	trans	-61.9	-40.2	174.4	-90.9	0	0	0	0	112.6	V571 V572 L578 L579	V571-C575 WeakPolarHBondContact O-CB 3.39Å; V571-C575 PolarHBondContact O-N 2.9Å; V572-C575 PolarHBondContact O-N 3.32Å; C575-L578 PolarHBondContact O-N 3.47Å; C575-L579 WeakPolarHBondContact O-CG 3.28Å; C575-L579 PolarHBondContact O-N 3.05Å
576	L	82.1	Confident	75.3	Confident	108 Å²	108	105 Å²	105	57%	0.565	55%	0.551	S	S	*	*	H	α-helix	trans	-65.9	-38.2	177	-76.2	168.3	0	0	0	112.1	V572 L573 F574 L579 F580	V572-L576 HydrophobicContact CG1-CD1 4.16Å; V572-L576 WeakPolarHBondContact O-CG 3.47Å; V572-L576 PolarHBondContact O-N 3.48Å; L573-L576 PolarHBondContact O-N 3.03Å; F574-L576 PolarHBondContact O-N 3.15Å; L576-L579 PolarHBondContact O-N 3.48Å; L576-F580 WeakPolarHBondContact O-CB 3.39Å; L576-F580 PolarHBondContact O-N 3.04Å
577	V	82.4	Confident	74.3	Confident	74 Å²	74	101.7 Å²	101.7	45%	0.448	55%	0.548	S	S	.	.	H	α-helix	trans	-65	-42.3	174.3	172.2	0	0	0	0	111.2	L573 F574 F580 L581	L573-V577 WeakPolarHBondContact O-CG2 3.43Å; L573-V577 PolarHBondContact O-N 2.71Å; F574-V577 PolarHBondContact O-N 3.33Å; V577-F580 PolarHBondContact O-N 2.72Å; V577-L581 HydrophobicContact CG1-CD1 3.95Å; V577-L581 HydrophobicContact CG1-CG 4.42Å; V577-L581 WeakPolarHBondContact O-CB 3.4Å; V577-L581 VanDerWaalsContact O-CG 3.31Å; V577-L581 WeakPolarHBondContact O-CG 3.34Å; V577-L581 PolarHBondContact O-N 3.43Å
578	L	79	Confident	73.2	Confident	88 Å²	88	105.5 Å²	105.5	46%	0.461	56%	0.562	S	S	.	*	H	α-helix	trans	-63.5	-42.9	175.5	-75.4	176.5	0	0	0	112.3	F574 C575 F580 L581 W582	F574-L578 HydrophobicContact CD1-CD1 3.94Å; F574-L578 HydrophobicContact CE1-CD1 3.45Å; F574-L578 VanDerWaalsContact CE1-CD1 3.45Å; F574-L578 HydrophobicContact CE1-CG 4.21Å; F574-L578 HydrophobicContact CZ-CD1 3.97Å; F574-L578 HydrophobicContact CZ-CG 4.35Å; F574-L578 PolarHBondContact O-N 3.04Å; C575-L578 PolarHBondContact O-N 3.47Å; L578-F580 VanDerWaalsContact C-N 3.34Å; L578-F580 PolarHBondContact O-N 3.49Å; L578-L581 PolarHBondContact O-N 3.03Å; L578-W582 VanDerWaalsContact O-CB 3.25Å; L578-W582 WeakPolarHBondContact O-CB 3.35Å; L578-W582 PolarHBondContact O-N 3.21Å
579	L	79.2	Confident	71.8	Confident	104 Å²	104	104.7 Å²	104.7	55%	0.545	57%	0.569	S	S	.	*	H	α-helix	trans	-65.3	-37.1	176	-72.4	171.4	0	0	0	112	C575 L576 W582 S583	C575-L579 WeakPolarHBondContact O-CG 3.28Å; C575-L579 PolarHBondContact O-N 3.05Å; L576-L579 PolarHBondContact O-N 3.48Å; L579-W582 PolarHBondContact O-N 3.07Å; L579-S583 VanDerWaalsContact O-CB 3.3Å; L579-S583 WeakPolarHBondContact O-CB 3.23Å; L579-S583 PolarHBondContact O-N 3.29Å
580	F	77.2	Confident	70	Confident	121 Å²	121	110.2 Å²	110.2	53%	0.531	59%	0.589	S	S	.	*	H	α-helix	trans	-67.7	-42.6	175.9	-175	-100.5	0	0	0	112.4	L576 V577 L578 W582 S583 R584	L576-F580 WeakPolarHBondContact O-CB 3.39Å; L576-F580 PolarHBondContact O-N 3.04Å; V577-F580 PolarHBondContact O-N 2.72Å; L578-F580 VanDerWaalsContact C-N 3.34Å; L578-F580 PolarHBondContact O-N 3.49Å; F580-W582 VanDerWaalsContact C-N 3.35Å; F580-S583 PolarHBondContact O-N 3.27Å; F580-R584 PolarHBondContact O-N 3.06Å; F580-R584 VanDerWaalsContact O-N 3.1Å
581	L	75.4	Confident	68.2	Low	109 Å²	109	116.6 Å²	116.6	57%	0.571	61%	0.607	S	S	*	*	H	α-helix	trans	-64.7	-39.7	174	-72.1	170.6	0	0	0	111.5	V577 L578 R584 G585	V577-L581 HydrophobicContact CG1-CD1 3.95Å; V577-L581 HydrophobicContact CG1-CG 4.42Å; V577-L581 WeakPolarHBondContact O-CB 3.4Å; V577-L581 VanDerWaalsContact O-CG 3.31Å; V577-L581 WeakPolarHBondContact O-CG 3.34Å; V577-L581 PolarHBondContact O-N 3.43Å; L578-L581 PolarHBondContact O-N 3.03Å; L581-R584 PolarHBondContact O-N 3.04Å; L581-G585 PolarHBondContact O-N 3.49Å
582	W	64.8	Low	65.9	Low	181 Å²	181	118.1 Å²	118.1	69%	0.686	61%	0.612	S	S	*	*	H	α-helix	trans	-68.4	-35.2	176.5	-163.2	57.9	0	0	0	112.3	L578 L579 F580 G585	L578-W582 VanDerWaalsContact O-CB 3.25Å; L578-W582 WeakPolarHBondContact O-CB 3.35Å; L578-W582 PolarHBondContact O-N 3.21Å; L579-W582 PolarHBondContact O-N 3.07Å; F580-W582 VanDerWaalsContact C-N 3.35Å; W582-G585 PolarHBondContact O-N 3.09Å
583	S	67.6	Low	64	Low	89 Å²	89	122.2 Å²	122.2	62%	0.622	63%	0.631	S	S	*	*	H	α-helix	trans	-67	-34.3	174.5	-178.4	0	0	0	0	112.9	L579 F580	L579-S583 VanDerWaalsContact O-CB 3.3Å; L579-S583 WeakPolarHBondContact O-CB 3.23Å; L579-S583 PolarHBondContact O-N 3.29Å; F580-S583 PolarHBondContact O-N 3.27Å
584	R	61.8	Low	61.9	Low	192 Å²	192	123.1 Å²	123.1	73%	0.725	63%	0.632	S	S	*	*	H	α-helix	trans	-81.7	-20.8	175.9	-72.3	-174.8	102.7	143.1	2.4	113.3	F580 L581 K586	F580-R584 PolarHBondContact O-N 3.06Å; F580-R584 VanDerWaalsContact O-N 3.1Å; L581-R584 PolarHBondContact O-N 3.04Å; R584-K586 VanDerWaalsContact C-N 3.34Å; R584-K586 PolarHBondContact O-N 2.91Å
585	G	56	Low	60.3	Low	54 Å²	54	123.6 Å²	123.6	56%	0.557	64%	0.639	S	S	*	*	S	Bend	trans	-78.3	-8.9	178.2	0	0	0	0	0	115.4	L581 W582 G587	L581-G585 PolarHBondContact O-N 3.49Å; W582-G585 PolarHBondContact O-N 3.09Å; G585-G587 VanDerWaalsContact C-N 3.3Å; G585-G587 PolarHBondContact O-N 3.5Å
586	K	52.2	Low	58.2	Low	171 Å²	171	127.1 Å²	127.1	74%	0.743	65%	0.649	S	S	*	*	S	Bend	trans	-92.3	27.4	-174.2	-141.8	177	-173.5	175.7	0	114.5	R584	R584-K586 VanDerWaalsContact C-N 3.34Å; R584-K586 PolarHBondContact O-N 2.91Å
587	G	53	Low	56.4	Low	57 Å²	57	130.7 Å²	130.7	59%	0.588	66%	0.657	S	S	*	*	S	Bend	trans	-134.6	42.6	-177.8	0	0	0	0	0	113.8	G585	G585-G587 VanDerWaalsContact C-N 3.3Å; G585-G587 PolarHBondContact O-N 3.5Å
588	N	52	Low	54.5	Low	151 Å²	151	132.8 Å²	132.8	81%	0.807	67%	0.67	S	S	*	*			trans	167.5	91.3	152	-94.1	-26.1	0	0	0	110.5
589	T	47.4	Very low	52.7	Low	117 Å²	117	133 Å²	133	72%	0.718	68%	0.676	S	S	*	*			trans	-128.2	92.2	159.2	48	0	0	0	0	109.2	H591	T589-H591 PolarHBondContact O-N 3.07Å; T589-H591 PolarHBondContact O-ND1 3.28Å
590	K	41.2	Very low	50.8	Low	195 Å²	195	139.9 Å²	139.9	85%	0.848	70%	0.695	S	S	*	*			trans	-57.2	125	167.3	-73.9	177.1	175.2	177.2	0	108.6	N592	K590-N592 PolarHBondContact O-N 3.45Å; K590-N592 VanDerWaalsContact O-N 3.16Å
591	H	45.7	Very low	49	Very low	176 Å²	176	143.9 Å²	143.9	82%	0.815	71%	0.712	S	S	*	*			trans	-76.1	94.4	172.5	-66.9	-3	0	0	0	109.7	T589	T589-H591 PolarHBondContact O-N 3.07Å; T589-H591 PolarHBondContact O-ND1 3.28Å
592	N	38	Very low	47.4	Very low	127 Å²	127	143.9 Å²	143.9	68%	0.679	72%	0.721	S	S	*	*			trans	-146.6	118.6	160.4	-86.8	-14.9	0	0	0	107	K590	K590-N592 PolarHBondContact O-N 3.45Å; K590-N592 VanDerWaalsContact O-N 3.16Å
593	I	44.7	Very low	46.3	Very low	149 Å²	149	143.6 Å²	143.6	76%	0.764	73%	0.733	S	S	*	*			trans	-106.8	115.9	171.2	-63.3	174.1	0	0	0	106.4	I595	I593-I595 HydrophobicContact CG2-CD1 4.43Å; I593-I595 HydrophobicContact CG2-CG1 3.9Å
594	E	37.9	Very low	44.9	Very low	122 Å²	122	143.9 Å²	143.9	57%	0.57	74%	0.741	S	S	*	*			trans	-88.6	120	171.6	-127.6	-176.7	-176.1	0	0	107.6	K614	E594-K614 WeakPolarHBondContact OE1-CD 3.48Å; E594-K614 WeakPolarHBondContact OE1-CE 3.26Å; E594-K614 IonicContact OE1-NZ 3.02Å; E594-K614 PolarHBondContact OE1-NZ 3.2Å; E594-K614 IonicContact OE2-NZ 2.79Å; E594-K614 PolarHBondContact OE2-NZ 3.18Å
595	I	48.3	Very low	43.7	Very low	145 Å²	145	138.3 Å²	138.3	74%	0.744	74%	0.743	S	S	*	*			trans	-109.1	120.5	175.4	-57.3	178.4	0	0	0	108	I593	I593-I595 HydrophobicContact CG2-CD1 4.43Å; I593-I595 HydrophobicContact CG2-CG1 3.9Å
596	E	36.6	Very low	42.9	Very low	139 Å²	139	143.4 Å²	143.4	65%	0.65	76%	0.756	S	S	*	*			trans	-93	118.5	175.1	-164.3	170.2	-154.6	0	0	109.2
597	Y	44.4	Very low	42.2	Very low	183 Å²	183	140.3 Å²	140.3	72%	0.718	76%	0.755	S	S	*	*			trans	-97.5	118.8	179.8	-174.9	-95.9	0	0	0	110.3	P599	Y597-P599 HydrophobicContact CD1-CG 4.23Å; Y597-P599 HydrophobicContact CE1-CB 4.07Å; Y597-P599 HydrophobicContact CE1-CG 4.08Å
598	V	43	Very low	41.4	Very low	119 Å²	119	143.2 Å²	143.2	72%	0.721	77%	0.767	S	S	*	*			trans	-104.5	114.7	171.9	-177.9	0	0	0	0	108.5
599	P	40.9	Very low	41.1	Very low	92 Å²	92	141 Å²	141	60%	0.597	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-73	134.9	177.6	-4.5	18.9	0	0	0	110.8	Y597	Y597-P599 HydrophobicContact CD1-CG 4.23Å; Y597-P599 HydrophobicContact CE1-CB 4.07Å; Y597-P599 HydrophobicContact CE1-CG 4.08Å
600	R	39.4	Very low	40.8	Very low	248 Å²	248	143 Å²	143	94%	0.936	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-73.5	125.9	165.1	-81.3	-178.2	174.6	164.1	-1.5	109.6
601	K	38.4	Very low	41	Very low	205 Å²	205	137.6 Å²	137.6	89%	0.891	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-76.4	124.3	176	-139.6	177.3	-173.7	179.4	0	109.6
602	S	42.2	Very low	40.8	Very low	109 Å²	109	133.5 Å²	133.5	76%	0.762	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-84.5	139.4	160.4	49.6	0	0	0	0	109.3	A604	S602-A604 PolarHBondContact O-N 3.49Å
603	D	42.3	Very low	41.5	Very low	175 Å²	175	137.9 Å²	137.9	94%	0.936	76%	0.764	S	S	*	*	S	Bend	trans	-58.6	111.7	-179.5	-80	-40.7	0	0	0	113
604	A	37.9	Very low	41.3	Very low	96 Å²	96	137.2 Å²	137.2	79%	0.793	76%	0.755	S	S	*	*			trans	-178.9	125.8	139.9	0	0	0	0	0	110.2	S602	S602-A604 PolarHBondContact O-N 3.49Å
605	G	37	Very low	41.8	Very low	74 Å²	74	140 Å²	140	76%	0.763	77%	0.766	S	S	*	*			trans	67	99.8	147.2	0	0	0	0	0	120.4
606	I	39.3	Very low	41.2	Very low	162 Å²	162	138.6 Å²	138.6	83%	0.831	76%	0.76	S	S	*	*			trans	36.6	126.3	137	-58.7	171.6	0	0	0	120.8
607	S	35.8	Very low	41.3	Very low	105 Å²	105	140.7 Å²	140.7	73%	0.734	77%	0.771	S	S	*	*			trans	98.9	141.4	148.8	75.8	0	0	0	0	121.3
608	S	36.5	Very low	40.7	Very low	119 Å²	119	141.1 Å²	141.1	83%	0.832	78%	0.777	S	S	*	*			trans	66.5	122.9	173.9	65.8	0	0	0	0	120.3
609	A	46.6	Very low	40.2	Very low	104 Å²	104	144.4 Å²	144.4	86%	0.86	79%	0.787	S	S	*	*			trans	-74.6	130.2	170.3	0	0	0	0	0	110
610	D	40.3	Very low	40.2	Very low	160 Å²	160	151.5 Å²	151.5	86%	0.856	82%	0.817	S	S	*	*			trans	-128.6	127.1	168.1	-133.1	-2.6	0	0	0	108.9
611	A	46.6	Very low	40.3	Very low	80 Å²	80	146.7 Å²	146.7	66%	0.661	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-73	151.7	-173.7	0	0	0	0	0	112.1	R613	A611-R613 PolarHBondContact O-N 3.38Å
612	P	40.6	Very low	40.4	Very low	91 Å²	91	143.6 Å²	143.6	59%	0.591	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-66.8	125.7	-177.5	25.6	-32.4	0	0	0	112
613	R	52.5	Low	40.3	Very low	219 Å²	219	145.5 Å²	145.5	83%	0.826	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-84.7	123	172	-75	-176.6	177.1	175.7	0.5	110.5	A611 F615	A611-R613 PolarHBondContact O-N 3.38Å; R613-F615 HydrophobicContact CB-CE2 4.39Å
614	K	41.3	Very low	40.1	Very low	134 Å²	134	143.8 Å²	143.8	58%	0.583	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-87.3	129.8	174.6	-72.5	179.9	163.5	-158.5	0	110.9	E594	E594-K614 WeakPolarHBondContact OE1-CD 3.48Å; E594-K614 WeakPolarHBondContact OE1-CE 3.26Å; E594-K614 IonicContact OE1-NZ 3.02Å; E594-K614 PolarHBondContact OE1-NZ 3.2Å; E594-K614 IonicContact OE2-NZ 2.79Å; E594-K614 PolarHBondContact OE2-NZ 3.18Å
615	F	47.2	Very low	40.3	Very low	181 Å²	181	146.8 Å²	146.8	79%	0.794	80%	0.803	S	S	*	*			trans	-115.9	130.4	169.1	-76.9	-86.1	0	0	0	110	R613	R613-F615 HydrophobicContact CB-CE2 4.39Å
616	N	36.9	Very low	40.5	Very low	115 Å²	115	151.6 Å²	151.6	62%	0.615	81%	0.805	S	S	*	*			trans	-99.5	116.3	171.5	-90.9	-49	0	0	0	109.1
617	M	38.3	Very low	40.6	Very low	183 Å²	183	150.9 Å²	150.9	90%	0.901	80%	0.803	S	S	*	*			trans	-105.2	127.6	168.2	-90.1	174.8	69.8	0	0	110
618	K	30.8	Very low	41	Very low	193 Å²	193	154.4 Å²	154.4	84%	0.839	81%	0.809	S	S	*	*			trans	-93.2	115.2	175.3	-162.8	178	-175.4	-177.7	0	107.8
619	M	33.8	Very low	41.3	Very low	188 Å²	188	157.3 Å²	157.3	93%	0.926	81%	0.807	S	S	*	*			trans	-72	127.7	170	-74.6	-150.7	-71.7	0	0	108.9
620	I	41.1	Very low	40.9	Very low	240 Å²	240	162.2 Å²	162.2	100%	1.231	80%	0.802	S	S	*	*			trans	-82.5	0	167.5	-61.1	174.3	0	0	0	108.2

Retrieved 620 of 620 residues in 2443.9 ms (Link to these results)

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