A0A077YX09_TRITR Loading...

DDI1 homolog 2

AlphaFold DB , UniProt , Accession A0A077YX09, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 525 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	34.6	Very low	32.5	Very low	239 Å²	239	160.8 Å²	160.8	100%	1.177	81%	0.812	S	S	*	*				0	142	0	-76.2	-76	-169.8	0	0	107.7
2	P	35.8	Very low	32.3	Very low	102 Å²	102	157.7 Å²	157.7	66%	0.662	82%	0.816	S	S	*	*				-109	148	-72.3	2.1	21.1	0	0	0	111.1
3	K	34.3	Very low	31.8	Very low	190 Å²	190	155.8 Å²	155.8	83%	0.826	82%	0.815	S	S	*	*				63.2	131.9	92.6	-59.6	-178.4	175	177.5	0	115.3
4	L	37.2	Very low	31.4	Very low	154 Å²	154	161.8 Å²	161.8	81%	0.806	82%	0.822	S	S	*	*				159.2	112	109.2	-80	164	0	0	0	107.8
5	A	34.2	Very low	31.1	Very low	79 Å²	79	158.9 Å²	158.9	65%	0.653	82%	0.819	S	S	*	*				89.6	136	52.8	0	0	0	0	0	114.6
6	N	34.9	Very low	30.9	Very low	140 Å²	140	162.1 Å²	162.1	75%	0.749	83%	0.825	S	S	*	*			trans	110.5	114.8	143.3	-67	-23.5	0	0	0	117
7	Q	33.7	Very low	30.6	Very low	198 Å²	198	166.6 Å²	166.6	93%	0.925	83%	0.829	S	S	*	*				-154.6	136.4	84.5	-94.6	174.6	12.7	0	0	111.6
8	S	28.1	Very low	30.5	Very low	85 Å²	85	170.7 Å²	170.7	59%	0.594	84%	0.835	S	S	*	*			trans	-108.2	158.5	-178.9	58.5	0	0	0	0	109.7
9	W	30	Very low	30.5	Very low	258 Å²	258	165.6 Å²	165.6	98%	0.977	83%	0.831	S	S	*	*			trans	-153.8	144.6	139	-93.7	94.6	0	0	0	110.2
10	R	26.6	Very low	30.3	Very low	218 Å²	218	165.5 Å²	165.5	82%	0.823	83%	0.832	S	S	*	*			trans	-98.6	151.4	-155	-69.4	173.5	164.3	-138.8	-1.9	115.2
11	S	28.2	Very low	30.1	Very low	106 Å²	106	169.6 Å²	169.6	74%	0.741	84%	0.837	S	S	*	*			trans	60.5	120.9	133.4	69	0	0	0	0	122.3
12	S	29.8	Very low	29.9	Very low	123 Å²	123	166.5 Å²	166.5	86%	0.86	82%	0.817	S	S	*	*				-178	144.6	110.4	40.3	0	0	0	0	111.6
13	V	26.1	Very low	29.6	Very low	133 Å²	133	164.6 Å²	164.6	81%	0.806	81%	0.807	S	S	*	*			trans	-78.5	136.9	-171.6	171.2	0	0	0	0	111.8
14	R	26.5	Very low	29.5	Very low	240 Å²	240	163.1 Å²	163.1	91%	0.906	80%	0.802	S	S	*	*			trans	-178.8	137.8	130.1	-97.9	174.1	-157.5	-132.3	8.1	111.3
15	P	25.9	Very low	29.3	Very low	119 Å²	119	162.5 Å²	162.5	77%	0.773	80%	0.796	S	S	*	*			trans	-91.2	141.1	-176.1	35.5	-30.7	0	0	0	111.4
16	K	29.3	Very low	29.3	Very low	210 Å²	210	162.7 Å²	162.7	91%	0.913	79%	0.785	S	S	*	*			trans	-140.3	132.1	164.2	-86.3	-168.9	177.3	-179.8	0	112.5
17	R	24.7	Very low	29.2	Very low	239 Å²	239	161.8 Å²	161.8	90%	0.902	78%	0.778	S	S	*	*			trans	-66.3	150	178.7	-64	172.5	173.1	-176.3	-3.8	113.2
18	Y	29.6	Very low	29.2	Very low	240 Å²	240	158.1 Å²	158.1	94%	0.941	76%	0.761	S	S	*	*			trans	-155	136.4	146.3	-80.5	-81.4	0	0	0	106.5
19	G	29.4	Very low	29.6	Very low	74 Å²	74	160.5 Å²	160.5	76%	0.763	76%	0.761	S	S	*	*			cis	174.3	122.6	-0.2	0	0	0	0	0	106.2
20	I	26.1	Very low	29.7	Very low	163 Å²	163	153.1 Å²	153.1	84%	0.836	74%	0.741	S	S	*	*			trans	-85.4	131.1	-179.4	-65.6	166.8	0	0	0	108.4
21	R	26.4	Very low	30	Very low	251 Å²	251	149.4 Å²	149.4	95%	0.947	73%	0.733	S	S	*	*			trans	-127.3	88.9	154.4	-88	-172.8	175.5	-177.3	-1.2	108
22	K	30.7	Very low	30.2	Very low	174 Å²	174	150.8 Å²	150.8	76%	0.757	73%	0.727	S	S	*	*			trans	-126.4	127.3	152.5	-84.4	-169.2	172.7	-173.1	0	105.9
23	S	30.2	Very low	30.3	Very low	63 Å²	63	150.4 Å²	150.4	44%	0.441	72%	0.715	S	S	.	*			trans	-58.4	144.9	-165.6	38.5	0	0	0	0	112.7	E25 D26	S23-E25 PolarHBondContact O-N 3.18Å; S23-E25 VanDerWaalsContact O-N 3.1Å; S23-D26 PolarHBondContact O-N 3.24Å; S23-D26 VanDerWaalsContact O-N 3.07Å
24	E	30.9	Very low	30.5	Very low	158 Å²	158	149.7 Å²	149.7	74%	0.738	71%	0.706	S	S	*	*	H	α-helix	trans	-56.8	-20.2	173.4	-77.4	170.5	138.8	0	0	112.9	D26 M27 Q28	E24-D26 PolarHBondContact O-N 2.81Å; E24-M27 PolarHBondContact O-N 2.95Å; E24-Q28 PolarHBondContact O-N 2.74Å; E24-Q28 VanDerWaalsContact O-N 3.12Å
25	E	33.9	Very low	30.7	Very low	142 Å²	142	141.2 Å²	141.2	66%	0.664	69%	0.688	S	S	*	*	H	α-helix	trans	-66.6	-29	173.9	-68.9	179.7	157.3	0	0	114.1	S23 K29	S23-E25 PolarHBondContact O-N 3.18Å; S23-E25 VanDerWaalsContact O-N 3.1Å; E25-K29 WeakPolarHBondContact O-CB 3.44Å; E25-K29 PolarHBondContact O-N 3.09Å
26	D	34.4	Very low	30.9	Very low	82 Å²	82	139.7 Å²	139.7	44%	0.439	68%	0.679	S	S	.	*	H	α-helix	trans	-82.6	-22	180	-76.5	-18.2	0	0	0	112.7	S23 E24 N30	S23-D26 PolarHBondContact O-N 3.24Å; S23-D26 VanDerWaalsContact O-N 3.07Å; E24-D26 PolarHBondContact O-N 2.81Å; D26-N30 WeakPolarHBondContact O-CB 3.31Å; D26-N30 PolarHBondContact O-N 2.69Å; D26-N30 PolarHBondContact O-ND2 3.28Å
27	M	31.9	Very low	30.7	Very low	122 Å²	122	137 Å²	137	60%	0.601	67%	0.67	S	S	*	*	H	α-helix	trans	-82.1	-36.5	170.4	-88.4	-171.2	-53.7	0	0	111.7	E24 N30 Q31	E24-M27 PolarHBondContact O-N 2.95Å; M27-N30 PolarHBondContact O-N 3.05Å; M27-Q31 WeakPolarHBondContact O-CB 3.27Å; M27-Q31 WeakPolarHBondContact O-CG 3.41Å; M27-Q31 PolarHBondContact O-N 3.28Å
28	Q	35.1	Very low	30.7	Very low	120 Å²	120	135.8 Å²	135.8	56%	0.561	67%	0.666	S	S	*	*	H	α-helix	trans	-67.7	-40.3	172.9	-94.8	171.3	-27.7	0	0	112	E24 N30 Q31 E32	E24-Q28 PolarHBondContact O-N 2.74Å; E24-Q28 VanDerWaalsContact O-N 3.12Å; Q28-N30 PolarHBondContact O-N 3.24Å; Q28-Q31 PolarHBondContact O-N 2.85Å; Q28-E32 WeakPolarHBondContact O-CB 3.39Å; Q28-E32 WeakPolarHBondContact O-CG 3.44Å; Q28-E32 PolarHBondContact O-N 3.27Å
29	K	36.5	Very low	30.5	Very low	135 Å²	135	129.4 Å²	129.4	59%	0.587	66%	0.656	S	S	*	*	H	α-helix	trans	-64.4	-35.4	173	-91.9	175.5	175.6	168.9	0	113.9	E25 L33	E25-K29 WeakPolarHBondContact O-CB 3.44Å; E25-K29 PolarHBondContact O-N 3.09Å; K29-L33 WeakPolarHBondContact O-CB 3.49Å; K29-L33 VanDerWaalsContact O-CD1 3.28Å; K29-L33 WeakPolarHBondContact O-CD1 3.32Å; K29-L33 PolarHBondContact O-N 2.82Å
30	N	32.4	Very low	30.3	Very low	104 Å²	104	132.8 Å²	132.8	56%	0.556	66%	0.655	S	S	*	*	H	α-helix	trans	-76.3	-30.8	175.5	-84.4	-54.6	0	0	0	112.8	D26 M27 Q28 L34	D26-N30 WeakPolarHBondContact O-CB 3.31Å; D26-N30 PolarHBondContact O-N 2.69Å; D26-N30 PolarHBondContact O-ND2 3.28Å; M27-N30 PolarHBondContact O-N 3.05Å; Q28-N30 PolarHBondContact O-N 3.24Å; N30-L34 WeakPolarHBondContact O-CB 3.26Å; N30-L34 WeakPolarHBondContact O-CD1 3.37Å; N30-L34 VanDerWaalsContact O-CG 3.29Å; N30-L34 WeakPolarHBondContact O-CG 3.39Å; N30-L34 PolarHBondContact O-N 3.11Å; N30-L34 VanDerWaalsContact O-N 3.15Å
31	Q	31.8	Very low	30.3	Very low	140 Å²	140	131.1 Å²	131.1	65%	0.654	65%	0.653	S	S	*	*	H	α-helix	trans	-75.7	-31.2	172.3	-79.5	-177.5	-19	0	0	112.6	M27 Q28 A35	M27-Q31 WeakPolarHBondContact O-CB 3.27Å; M27-Q31 WeakPolarHBondContact O-CG 3.41Å; M27-Q31 PolarHBondContact O-N 3.28Å; Q28-Q31 PolarHBondContact O-N 2.85Å; Q31-A35 VanDerWaalsContact O-CB 3.26Å; Q31-A35 WeakPolarHBondContact O-CB 3.43Å; Q31-A35 PolarHBondContact O-N 3.1Å
32	E	33.2	Very low	30.3	Very low	134 Å²	134	124.3 Å²	124.3	63%	0.626	63%	0.634	S	S	*	*	H	α-helix	trans	-73.3	-35.1	171.8	-76.1	177.6	167.1	0	0	112.3	Q28 L34 A35 S36	Q28-E32 WeakPolarHBondContact O-CB 3.39Å; Q28-E32 WeakPolarHBondContact O-CG 3.44Å; Q28-E32 PolarHBondContact O-N 3.27Å; E32-L34 VanDerWaalsContact C-N 3.35Å; E32-A35 PolarHBondContact O-N 2.71Å; E32-S36 PolarHBondContact O-N 2.82Å
33	L	31.3	Very low	29.9	Very low	115 Å²	115	127.3 Å²	127.3	60%	0.602	64%	0.64	S	S	*	*	H	α-helix	trans	-69.6	-28.4	171.4	-104.1	108.4	0	0	0	113.6	K29 S36	K29-L33 WeakPolarHBondContact O-CB 3.49Å; K29-L33 VanDerWaalsContact O-CD1 3.28Å; K29-L33 WeakPolarHBondContact O-CD1 3.32Å; K29-L33 PolarHBondContact O-N 2.82Å; L33-S36 PolarHBondContact O-OG 3.39Å
34	L	30.7	Very low	29.8	Very low	118 Å²	118	130 Å²	130	62%	0.618	65%	0.649	S	S	*	*	H	α-helix	trans	-83.2	-21.8	173.6	-74.7	164.6	0	0	0	112.2	N30 E32	N30-L34 WeakPolarHBondContact O-CB 3.26Å; N30-L34 WeakPolarHBondContact O-CD1 3.37Å; N30-L34 VanDerWaalsContact O-CG 3.29Å; N30-L34 WeakPolarHBondContact O-CG 3.39Å; N30-L34 PolarHBondContact O-N 3.11Å; N30-L34 VanDerWaalsContact O-N 3.15Å; E32-L34 VanDerWaalsContact C-N 3.35Å
35	A	30.3	Very low	29.5	Very low	63 Å²	63	126.9 Å²	126.9	52%	0.521	65%	0.651	S	S	.	*	H	α-helix	trans	-84.6	-22.9	173.5	0	0	0	0	0	113.3	Q31 E32 Q37	Q31-A35 VanDerWaalsContact O-CB 3.26Å; Q31-A35 WeakPolarHBondContact O-CB 3.43Å; Q31-A35 PolarHBondContact O-N 3.1Å; E32-A35 PolarHBondContact O-N 2.71Å; A35-Q37 VanDerWaalsContact C-N 3.28Å; A35-Q37 PolarHBondContact O-N 3.31Å
36	S	29.5	Very low	29.1	Very low	86 Å²	86	129.3 Å²	129.3	60%	0.601	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	1.6	174.1	72.5	0	0	0	0	114.4	E32 L33 R38	E32-S36 PolarHBondContact O-N 2.82Å; L33-S36 PolarHBondContact O-OG 3.39Å; S36-R38 PolarHBondContact O-N 2.83Å
37	Q	26.7	Very low	28.7	Very low	153 Å²	153	131.6 Å²	131.6	72%	0.715	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	4.7	173.1	-77	-171.8	-26.7	0	0	113.6	A35	A35-Q37 VanDerWaalsContact C-N 3.28Å; A35-Q37 PolarHBondContact O-N 3.31Å
38	R	23.9	Very low	28.5	Very low	215 Å²	215	132.2 Å²	132.2	81%	0.811	67%	0.671	S	S	*	*	S	Bend	trans	-90.3	119.5	170.3	-69.6	179.8	174	-178.9	-2.5	109.2	S36	S36-R38 PolarHBondContact O-N 2.83Å
39	S	24.6	Very low	28.2	Very low	106 Å²	106	131.9 Å²	131.9	74%	0.741	67%	0.671	S	S	*	*			trans	83.7	67.9	174.6	77.3	0	0	0	0	117.6
40	I	26.2	Very low	28	Very low	144 Å²	144	136 Å²	136	74%	0.738	68%	0.683	S	S	*	*			trans	-108.2	74.1	142.2	-65.7	-175.4	0	0	0	106.6	I42	I40-I42 HydrophobicContact CG2-CB 4.16Å; I40-I42 HydrophobicContact CG2-CD1 3.18Å; I40-I42 HydrophobicContact CG2-CG1 3.34Å; I40-I42 PolarHBondContact O-N 2.84Å
41	T	25.9	Very low	28	Very low	129 Å²	129	135.5 Å²	135.5	79%	0.791	68%	0.678	S	S	*	*			trans	-76.3	70.5	162.9	-49.5	0	0	0	0	107	R43	T41-R43 PolarHBondContact O-N 3.09Å
42	I	25.5	Very low	28	Very low	107 Å²	107	137.9 Å²	137.9	55%	0.549	69%	0.686	S	S	.	*			trans	-78.4	116.8	170.5	-71.6	167.5	0	0	0	106.7	I40 L44	I40-I42 HydrophobicContact CG2-CB 4.16Å; I40-I42 HydrophobicContact CG2-CD1 3.18Å; I40-I42 HydrophobicContact CG2-CG1 3.34Å; I40-I42 PolarHBondContact O-N 2.84Å; I42-L44 VanDerWaalsContact C-N 3.28Å; I42-L44 HydrophobicContact CG2-CD2 3.89Å; I42-L44 HydrophobicContact CG2-CG 4.07Å; I42-L44 PolarHBondContact O-N 2.88Å
43	R	23.6	Very low	28.2	Very low	237 Å²	237	134 Å²	134	89%	0.894	68%	0.677	S	S	*	*			trans	-60.5	89	168.1	-73.1	179	178.7	178.7	-1.3	109	T41 A45	T41-R43 PolarHBondContact O-N 3.09Å; R43-A45 VanDerWaalsContact C-N 3.26Å; R43-A45 PolarHBondContact O-N 2.85Å
44	L	26.7	Very low	28.4	Very low	120 Å²	120	137.3 Å²	137.3	63%	0.628	68%	0.682	S	S	*	*			trans	-81.3	68.1	178.4	-69.3	167	0	0	0	110.3	I42 F47	I42-L44 VanDerWaalsContact C-N 3.28Å; I42-L44 HydrophobicContact CG2-CD2 3.89Å; I42-L44 HydrophobicContact CG2-CG 4.07Å; I42-L44 PolarHBondContact O-N 2.88Å; L44-F47 HydrophobicContact CD2-CD2 3.31Å; L44-F47 HydrophobicContact CD2-CE2 3.65Å; L44-F47 HydrophobicContact CD2-CG 4.15Å
45	A	25	Very low	28.8	Very low	93 Å²	93	136.7 Å²	136.7	77%	0.769	67%	0.672	S	S	*	*	S	Bend	trans	-93.2	6.8	174.8	0	0	0	0	0	113.4	R43	R43-A45 VanDerWaalsContact C-N 3.26Å; R43-A45 PolarHBondContact O-N 2.85Å
46	K	25.2	Very low	29.4	Very low	192 Å²	192	137.3 Å²	137.3	84%	0.835	66%	0.663	S	S	*	*	S	Bend	trans	-148.1	32	-169.3	-71	-169.5	176	-178.5	0	115.6
47	F	27	Very low	30	Very low	131 Å²	131	137.1 Å²	137.1	58%	0.575	65%	0.652	S	S	*	*			trans	-120	128.1	177.2	-78.6	-86	0	0	0	112.3	L44	L44-F47 HydrophobicContact CD2-CD2 3.31Å; L44-F47 HydrophobicContact CD2-CE2 3.65Å; L44-F47 HydrophobicContact CD2-CG 4.15Å
48	D	27.5	Very low	30.7	Very low	135 Å²	135	136.1 Å²	136.1	72%	0.722	64%	0.641	S	S	*	*			trans	-97.1	109.1	166.4	-170.9	10.4	0	0	0	107.9
49	M	29.7	Very low	31.4	Very low	113 Å²	113	131.6 Å²	131.6	56%	0.557	63%	0.633	S	S	*	*			trans	-99.3	114.3	178.6	-97.5	-169.4	169.6	0	0	110.1
50	R	31	Very low	32.1	Very low	222 Å²	222	133.7 Å²	133.7	84%	0.838	63%	0.631	S	S	*	*			trans	-100.4	111.9	168	-65.9	-175.9	-177.3	-175.4	-1.5	110.1
51	M	33.1	Very low	32.4	Very low	93 Å²	93	133.5 Å²	133.5	46%	0.458	63%	0.627	S	S	.	*			trans	-89.8	134.5	171.1	-67.7	-157.6	-173.7	0	0	111	I73 L111	M51-I73 HydrophobicContact CE-CD1 3.5Å; M51-I73 HydrophobicContact CG-CD1 4.36Å; M51-I73 HydrophobicContact SD-CD1 3.69Å; M51-L111 HydrophobicContact SD-CD2 4.48Å
52	K	32.3	Very low	33.4	Very low	190 Å²	190	134.5 Å²	134.5	83%	0.826	62%	0.617	S	S	*	*			trans	-120.3	107.5	165.5	-77.5	-175	176.8	-179	0	108.3	R54	K52-R54 PolarHBondContact O-N 3.06Å
53	A	36.3	Very low	34.2	Very low	53 Å²	53	131.7 Å²	131.7	44%	0.438	60%	0.604	S	S	.	*			trans	-70.2	123.4	168.4	0	0	0	0	0	108.8
54	R	35.2	Very low	35	Very low	183 Å²	183	128.2 Å²	128.2	69%	0.691	59%	0.591	S	S	*	*			trans	-88.8	-32.9	-179.8	-68.7	-170.7	-173.5	-174.4	3.2	112.9	K52	K52-R54 PolarHBondContact O-N 3.06Å
55	Y	40.3	Very low	35.9	Very low	105 Å²	105	124 Å²	124	41%	0.412	57%	0.571	S	S	.	*			trans	-156	152	-177.6	-58.4	-88.2	0	0	0	111.3	V63 R64	Y55-V63 CarbonylContact C-O 3.58Å; Y55-V63 VanDerWaalsContact CA-O 3.31Å; Y55-V63 WeakPolarHBondContact CA-O 3.11Å; Y55-R64 HydrophobicContact CD1-CB 4.21Å; Y55-R64 HydrophobicContact CE1-CB 4.1Å; Y55-R64 HydrophobicContact CE1-CG 4.39Å
56	F	42.7	Very low	36.5	Very low	76 Å²	76	128 Å²	128	33%	0.333	57%	0.573	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-126.4	159.1	166.1	65	-85.4	0	0	0	110.2	R58 V63 P65	F56-R58 HydrophobicContact CD2-CB 4.43Å; F56-R58 HydrophobicContact CE2-CB 4.09Å; F56-V63 WeakPolarHBondContact CD1-O 3.44Å; F56-V63 HydrophobicContact CE1-CB 4.14Å; F56-V63 HydrophobicContact CE1-CG1 4.18Å; F56-V63 HydrophobicContact CE2-CB 4.08Å; F56-V63 HydrophobicContact CE2-CG1 4.47Å; F56-V63 HydrophobicContact CZ-CB 3.88Å; F56-V63 HydrophobicContact CZ-CG1 3.87Å; F56-V63 PolarHBondContact N-O 2.87Å; F56-V63 PolarHBondContact O-N 2.94Å; F56-P65 HydrophobicContact CE1-CB 4.28Å
57	K	42.4	Very low	36.8	Very low	83 Å²	83	123.6 Å²	123.6	36%	0.361	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.3	117.9	-178.4	-167.6	178.9	177.6	-174.2	0	109.9	E60 Q61	K57-E60 VanDerWaalsContact CE-CA 3.49Å; K57-E60 WeakPolarHBondContact CE-OE2 3.48Å; K57-E60 IonicContact NZ-OE1 3.81Å; K57-E60 PolarHBondContact NZ-OE1 3.25Å; K57-E60 IonicContact NZ-OE2 2.71Å; K57-E60 PolarHBondContact NZ-OE2 3.04Å; K57-Q61 CarbonylContact C-O 3.6Å; K57-Q61 VanDerWaalsContact CA-O 3.31Å; K57-Q61 WeakPolarHBondContact CA-O 3.32Å
58	R	40	Very low	37	Very low	131 Å²	131	122.8 Å²	122.8	49%	0.494	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-122.8	125.3	173.4	-175.9	179.6	176.3	163	1.7	107.9	F56 E60 Q61 V63	F56-R58 HydrophobicContact CD2-CB 4.43Å; F56-R58 HydrophobicContact CE2-CB 4.09Å; R58-E60 PolarHBondContact O-N 2.84Å; R58-Q61 PolarHBondContact N-O 2.98Å; R58-Q61 CarbonylContact O-C 3.55Å; R58-Q61 WeakPolarHBondContact O-CA 3.46Å; R58-Q61 WeakPolarHBondContact O-CB 3.38Å; R58-Q61 PolarHBondContact O-N 3.35Å; R58-V63 HydrophobicContact CB-CG2 3.67Å
59	D	38.5	Very low	37.2	Very low	121 Å²	121	121 Å²	121	65%	0.647	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	49.9	51.5	176.7	-58.5	-42.8	0	0	0	115.2	Q61	D59-Q61 PolarHBondContact O-N 3.28Å
60	E	39.6	Very low	37.1	Very low	149 Å²	149	121.3 Å²	121.3	70%	0.696	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	64.2	1.7	-175.3	-69.3	-68.3	133.4	0	0	115.4	K57 R58	K57-E60 VanDerWaalsContact CE-CA 3.49Å; K57-E60 WeakPolarHBondContact CE-OE2 3.48Å; K57-E60 IonicContact NZ-OE1 3.81Å; K57-E60 PolarHBondContact NZ-OE1 3.25Å; K57-E60 IonicContact NZ-OE2 2.71Å; K57-E60 PolarHBondContact NZ-OE2 3.04Å; R58-E60 PolarHBondContact O-N 2.84Å
61	Q	33.2	Very low	37.1	Very low	140 Å²	140	113.9 Å²	113.9	65%	0.654	56%	0.561	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-111.1	146.1	179.4	-65.1	-171.9	-22.1	0	0	112.3	K57 R58 D59	K57-Q61 CarbonylContact C-O 3.6Å; K57-Q61 VanDerWaalsContact CA-O 3.31Å; K57-Q61 WeakPolarHBondContact CA-O 3.32Å; R58-Q61 PolarHBondContact N-O 2.98Å; R58-Q61 CarbonylContact O-C 3.55Å; R58-Q61 WeakPolarHBondContact O-CA 3.46Å; R58-Q61 WeakPolarHBondContact O-CB 3.38Å; R58-Q61 PolarHBondContact O-N 3.35Å; D59-Q61 PolarHBondContact O-N 3.28Å
62	W	47.1	Very low	36.8	Very low	151 Å²	151	115.3 Å²	115.3	57%	0.572	57%	0.565	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-84.5	122.5	173.5	-70.1	93	0	0	0	109.5
63	V	42.3	Very low	36.7	Very low	47 Å²	47	109.8 Å²	109.8	29%	0.285	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	134.1	-177.6	-170.4	0	0	0	0	109.2	Y55 F56 R58	Y55-V63 CarbonylContact C-O 3.58Å; Y55-V63 VanDerWaalsContact CA-O 3.31Å; Y55-V63 WeakPolarHBondContact CA-O 3.11Å; F56-V63 WeakPolarHBondContact CD1-O 3.44Å; F56-V63 HydrophobicContact CE1-CB 4.14Å; F56-V63 HydrophobicContact CE1-CG1 4.18Å; F56-V63 HydrophobicContact CE2-CB 4.08Å; F56-V63 HydrophobicContact CE2-CG1 4.47Å; F56-V63 HydrophobicContact CZ-CB 3.88Å; F56-V63 HydrophobicContact CZ-CG1 3.87Å; F56-V63 PolarHBondContact N-O 2.87Å; F56-V63 PolarHBondContact O-N 2.94Å; R58-V63 HydrophobicContact CB-CG2 3.67Å
64	R	39.7	Very low	36.3	Very low	164 Å²	164	110.4 Å²	110.4	62%	0.619	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-83	129.7	175.2	-168.4	178.7	-178.8	176.4	0.3	108.1	Y55 H66	Y55-R64 HydrophobicContact CD1-CB 4.21Å; Y55-R64 HydrophobicContact CE1-CB 4.1Å; Y55-R64 HydrophobicContact CE1-CG 4.39Å; R64-H66 PolarHBondContact O-N 3.41Å
65	P	45.9	Very low	36	Very low	32 Å²	32	110.2 Å²	110.2	21%	0.208	55%	0.549	C	S	.	.	P	Polyproline II helix	trans	-63.9	130.6	176.5	24	-29.5	0	0	0	110.1	F56 L69	F56-P65 HydrophobicContact CE1-CB 4.28Å; P65-L69 HydrophobicContact CB-CB 4.47Å; P65-L69 HydrophobicContact CB-CD1 3.89Å
66	H	38.4	Very low	35.4	Very low	176 Å²	176	112.3 Å²	112.3	82%	0.815	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-62.6	146.3	164	-136.2	-86.6	0	0	0	107.8	R64	R64-H66 PolarHBondContact O-N 3.41Å
67	S	30.4	Very low	34.7	Very low	101 Å²	101	114.2 Å²	114.2	71%	0.706	59%	0.589	S	S	*	*	S	Bend	trans	-25.2	132.3	-176.6	47.9	0	0	0	0	116.3
68	S	32.2	Very low	34.1	Very low	113 Å²	113	116.5 Å²	116.5	79%	0.79	61%	0.605	S	S	*	*			trans	72.7	69.3	174.5	74.4	0	0	0	0	118.4
69	L	30.2	Very low	33.6	Very low	97 Å²	97	119.1 Å²	119.1	51%	0.508	62%	0.623	S	S	.	*			trans	-99.6	86.2	156.2	-130.1	146.9	0	0	0	108.2	P65	P65-L69 HydrophobicContact CB-CB 4.47Å; P65-L69 HydrophobicContact CB-CD1 3.89Å
70	V	29	Very low	33.2	Very low	121 Å²	121	122 Å²	122	73%	0.733	63%	0.633	S	S	*	*			trans	-91	93.7	170.7	-179.7	0	0	0	0	106.8	K72	V70-K72 PolarHBondContact O-N 2.99Å; V70-K72 VanDerWaalsContact O-N 3.15Å
71	A	29.6	Very low	32.6	Very low	65 Å²	65	121 Å²	121	54%	0.537	63%	0.632	S	S	.	*			trans	-70.5	107.6	169.2	0	0	0	0	0	108.6	I73	A71-I73 PolarHBondContact O-N 2.98Å
72	K	27.3	Very low	32.5	Very low	124 Å²	124	119.8 Å²	119.8	54%	0.539	63%	0.634	S	S	.	*			trans	-75.9	110.4	162.4	-87.1	174.4	177	155.2	0	107.6	V70 A74 A225	V70-K72 PolarHBondContact O-N 2.99Å; V70-K72 VanDerWaalsContact O-N 3.15Å; K72-A74 PolarHBondContact O-N 3.29Å; K72-A225 HydrophobicContact CD-CB 4.06Å
73	I	30.1	Very low	31.6	Very low	73 Å²	73	121 Å²	121	37%	0.374	64%	0.643	S	S	.	*			trans	-84.8	106.3	172.7	-60.9	173.1	0	0	0	107	M51 A71 Y75	M51-I73 HydrophobicContact CE-CD1 3.5Å; M51-I73 HydrophobicContact CG-CD1 4.36Å; M51-I73 HydrophobicContact SD-CD1 3.69Å; A71-I73 PolarHBondContact O-N 2.98Å; I73-Y75 HydrophobicContact CG2-CD2 4.27Å; I73-Y75 HydrophobicContact CG2-CE2 4.11Å
74	A	28.8	Very low	31	Very low	66 Å²	66	121.2 Å²	121.2	55%	0.545	64%	0.642	S	S	.	*			trans	-80.2	122.5	163	0	0	0	0	0	108.3	K72 I167	K72-A74 PolarHBondContact O-N 3.29Å; A74-I167 HydrophobicContact CB-CD1 4.26Å
75	Y	28.5	Very low	30.6	Very low	179 Å²	179	117.2 Å²	117.2	70%	0.702	64%	0.644	S	S	*	*			trans	-81.7	121.6	174.1	-77.2	-96.3	0	0	0	109.2	I73	I73-Y75 HydrophobicContact CG2-CD2 4.27Å; I73-Y75 HydrophobicContact CG2-CE2 4.11Å
76	I	28.4	Very low	29.9	Very low	149 Å²	149	118.4 Å²	118.4	76%	0.764	65%	0.651	S	S	*	*			trans	-112.5	109.8	162.6	-57.5	176.8	0	0	0	106.6
77	S	28	Very low	29.5	Very low	116 Å²	116	118.3 Å²	118.3	81%	0.811	65%	0.651	S	S	*	*			trans	-86.8	112.2	174.2	155.4	0	0	0	0	108.4
78	D	27.8	Very low	29.5	Very low	131 Å²	131	118.7 Å²	118.7	70%	0.701	65%	0.652	S	S	*	*			trans	-132.3	138.7	160.1	-148.8	-3	0	0	0	108.6	Q80	D78-Q80 PolarHBondContact O-N 3.14Å
79	E	30.7	Very low	29.4	Very low	187 Å²	187	120 Å²	120	87%	0.874	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	5.9	-149.2	-71.4	-174.2	142.9	0	0	117.7
80	Q	29.1	Very low	29.4	Very low	182 Å²	182	120.6 Å²	120.6	85%	0.85	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.9	-3.5	-173.4	-66.8	-165.9	-7.8	0	0	118	D78	D78-Q80 PolarHBondContact O-N 3.14Å
81	D	27.7	Very low	29.6	Very low	128 Å²	128	123.1 Å²	123.1	68%	0.684	66%	0.658	S	S	*	*			trans	-160.8	123.4	176.5	-93.5	-36.4	0	0	0	111.9	K83	D81-K83 PolarHBondContact O-N 2.88Å
82	T	30.2	Very low	29.5	Very low	113 Å²	113	131.5 Å²	131.5	69%	0.693	68%	0.675	S	S	*	*			trans	-81.1	103.2	171.6	-41	0	0	0	0	109.8
83	K	29.3	Very low	29.8	Very low	176 Å²	176	128.8 Å²	128.8	77%	0.765	68%	0.683	S	S	*	*			trans	-96.1	125.6	170.8	-67.9	177.3	-175.7	167.8	0	109.6	D81	D81-K83 PolarHBondContact O-N 2.88Å
84	I	30.2	Very low	29.9	Very low	53 Å²	53	134.2 Å²	134.2	27%	0.272	71%	0.707	S	S	.	*			trans	-90.5	134.8	169	-57.3	174.1	0	0	0	106	V86 F133 I135	I84-V86 HydrophobicContact CG2-CG2 4.1Å; I84-F133 HydrophobicContact CD1-CB 4.18Å; I84-F133 HydrophobicContact CD1-CD1 3.89Å; I84-F133 HydrophobicContact CD1-CD2 4.03Å; I84-F133 HydrophobicContact CD1-CE1 4.26Å; I84-F133 HydrophobicContact CD1-CE2 4.38Å; I84-F133 HydrophobicContact CD1-CG 3.77Å; I84-F133 HydrophobicContact CD1-CZ 4.49Å; I84-F133 HydrophobicContact CG1-CD1 4.44Å; I84-I135 HydrophobicContact CB-CD1 3.73Å; I84-I135 HydrophobicContact CB-CG1 4.29Å; I84-I135 HydrophobicContact CG2-CD1 3.71Å; I84-I135 WeakPolarHBondContact O-CD1 3.17Å; I84-I135 WeakPolarHBondContact O-CG1 3.35Å; I84-I135 WeakPolarHBondContact O-CG2 3.39Å
85	A	30.6	Very low	30.1	Very low	79 Å²	79	138.8 Å²	138.8	65%	0.653	72%	0.722	S	S	*	*			trans	-107.6	133.3	166.6	0	0	0	0	0	108.1	M137	A85-M137 HydrophobicContact CB-CE 4.45Å
86	V	31.2	Very low	30.6	Very low	58 Å²	58	133.7 Å²	133.7	35%	0.352	72%	0.724	S	S	.	*			trans	-124.3	114.5	175	176.4	0	0	0	0	106.2	I84 I135	I84-V86 HydrophobicContact CG2-CG2 4.1Å; V86-I135 HydrophobicContact CB-CD1 4.15Å; V86-I135 HydrophobicContact CG2-CD1 3.54Å
87	E	30.5	Very low	30.5	Very low	174 Å²	174	131.6 Å²	131.6	81%	0.813	72%	0.722	S	S	*	*			trans	-89.3	130.5	166.3	-81.1	178.8	151.6	0	0	109	M137	E87-M137 HydrophobicContact CG-CE 3.6Å
88	C	29.8	Very low	30.7	Very low	108 Å²	108	130.6 Å²	130.6	73%	0.73	71%	0.707	S	S	*	*			trans	-117.2	130	168.6	-83	0	0	0	0	107.7
89	D	30.1	Very low	30.5	Very low	140 Å²	140	133.3 Å²	133.3	75%	0.749	72%	0.716	S	S	*	*			trans	-102.6	116.4	172.5	-125.6	-9.6	0	0	0	108.5
90	D	30.5	Very low	30.4	Very low	110 Å²	110	131.2 Å²	131.2	59%	0.588	71%	0.706	S	S	*	*			trans	-131.5	102.9	175.2	-122.5	-1.6	0	0	0	110.1
91	Q	33.3	Very low	30.1	Very low	175 Å²	175	131.6 Å²	131.6	82%	0.818	71%	0.708	S	S	*	*			trans	50.5	141.8	137.2	-52.5	-156.6	-8.2	0	0	123.4
92	R	28.1	Very low	30.1	Very low	240 Å²	240	132.6 Å²	132.6	91%	0.906	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-93.2	126.9	153.5	-93.7	-171.8	178.1	-169.1	0.4	110.9
93	G	33	Very low	29.7	Very low	68 Å²	68	136.2 Å²	136.2	70%	0.701	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-93.8	161.1	154.5	0	0	0	0	0	112
94	E	32.5	Very low	29.5	Very low	187 Å²	187	134.8 Å²	134.8	87%	0.874	72%	0.724	S	S	*	*	S	Bend	trans	-70	138.2	167.9	-64.1	172.7	155.1	0	0	108.8
95	D	32.2	Very low	29.3	Very low	162 Å²	162	142.4 Å²	142.4	87%	0.866	75%	0.75	S	S	*	*			trans	140.4	-11.3	163.9	-68	4.2	0	0	0	115.4	S97	D95-S97 PolarHBondContact O-N 3.38Å
96	G	39.4	Very low	29.1	Very low	72 Å²	72	146.4 Å²	146.4	74%	0.742	76%	0.755	S	S	*	*			trans	27.4	85.2	161	0	0	0	0	0	121.2
97	S	26.4	Very low	29	Very low	104 Å²	104	149.6 Å²	149.6	73%	0.727	77%	0.769	S	S	*	*			trans	-177.3	159.6	147.4	49	0	0	0	0	112.3	D95	D95-S97 PolarHBondContact O-N 3.38Å
98	I	31.5	Very low	28.9	Very low	96 Å²	96	144.7 Å²	144.7	49%	0.492	75%	0.753	S	S	.	*			trans	-68.3	146.4	-161.2	-52.4	158.8	0	0	0	114.6	S143	I98-S143 WeakPolarHBondContact CG1-OG 3.49Å
99	Q	25.2	Very low	28.9	Very low	188 Å²	188	144 Å²	144	88%	0.879	74%	0.741	S	S	*	*				179	131.6	113.3	-93.6	-170.8	7.3	0	0	115.4
100	Q	26.9	Very low	28.9	Very low	142 Å²	142	147 Å²	147	66%	0.664	74%	0.742	S	S	*	*			trans	-57.7	128.2	179.1	-73.7	157.5	-48.9	0	0	113.6
101	Q	23.7	Very low	28.8	Very low	191 Å²	191	145.5 Å²	145.5	89%	0.893	73%	0.733	S	S	*	*			trans	-174.3	80.2	144.4	-104.9	178.3	26.8	0	0	109.9	K103	Q101-K103 PolarHBondContact O-N 2.84Å
102	L	26.8	Very low	28.6	Very low	149 Å²	149	141.8 Å²	141.8	78%	0.78	73%	0.726	S	S	*	*			trans	-89	104.9	175.1	-79.4	165.8	0	0	0	110.8	E139	L102-E139 VanDerWaalsContact CB-OE1 3.31Å; L102-E139 WeakPolarHBondContact CB-OE1 3.38Å; L102-E139 WeakPolarHBondContact CD1-OE1 3.48Å
103	K	23.7	Very low	28.7	Very low	189 Å²	189	135.4 Å²	135.4	82%	0.822	71%	0.709	S	S	*	*			trans	-77.6	125.8	164.6	-86.9	176.3	174.6	171.4	0	109.4	Q101 R105	Q101-K103 PolarHBondContact O-N 2.84Å; K103-R105 PolarHBondContact O-N 3.28Å
104	T	24.1	Very low	28.5	Very low	145 Å²	145	140.1 Å²	140.1	89%	0.89	71%	0.713	S	S	*	*			trans	-33.8	119.1	164.8	29.6	0	0	0	0	113.4
105	R	25.4	Very low	28.4	Very low	213 Å²	213	137.7 Å²	137.7	80%	0.804	70%	0.704	S	S	*	*			trans	-128	127.5	162.7	-77.2	-171.4	171.9	-175.4	-1.4	109.9	K103	K103-R105 PolarHBondContact O-N 3.28Å
106	E	27	Very low	28.2	Very low	163 Å²	163	135.8 Å²	135.8	76%	0.762	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-71.3	130.7	-179.5	-60.7	177.5	134.5	0	0	111.1
107	I	28.9	Very low	27.7	Very low	126 Å²	126	135.1 Å²	135.1	65%	0.646	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-96.8	119.4	169.8	-59.4	174.8	0	0	0	108.1	I109	I107-I109 HydrophobicContact CG2-CG1 4.15Å
108	C	28.3	Very low	28	Very low	71 Å²	71	136.5 Å²	136.5	48%	0.48	69%	0.686	S	S	.	*	P	Polyproline II helix	trans	-96.5	121.4	170.2	-88.3	0	0	0	0	109.7
109	I	30.7	Very low	28	Very low	94 Å²	94	138.1 Å²	138.1	48%	0.482	70%	0.696	S	S	.	*			trans	-105.6	128.9	172.3	-54.1	176.1	0	0	0	108.3	I107 L111	I107-I109 HydrophobicContact CG2-CG1 4.15Å; I109-L111 HydrophobicContact CG2-CD2 4.07Å; I109-L111 HydrophobicContact CG2-CG 4.1Å
110	R	28.5	Very low	28.2	Very low	203 Å²	203	137.8 Å²	137.8	77%	0.766	70%	0.7	S	S	*	*			trans	-97.9	111.4	171.6	-166.7	175.6	-172	166.8	1.2	108.7
111	L	29.8	Very low	28.3	Very low	77 Å²	77	140 Å²	140	40%	0.403	71%	0.71	S	S	.	*			trans	-97.5	141	177	-65.5	165.9	0	0	0	109.8	M51 I109	M51-L111 HydrophobicContact SD-CD2 4.48Å; I109-L111 HydrophobicContact CG2-CD2 4.07Å; I109-L111 HydrophobicContact CG2-CG 4.1Å
112	S	28.3	Very low	28.6	Very low	97 Å²	97	136.5 Å²	136.5	68%	0.678	70%	0.696	S	S	*	*			trans	-117.6	114	165.6	-60.8	0	0	0	0	107.1
113	I	30.5	Very low	28.6	Very low	106 Å²	106	136.4 Å²	136.4	54%	0.544	70%	0.697	S	S	.	*	P	Polyproline II helix	trans	-97.8	121.1	-178.4	-57	173.6	0	0	0	107.1	I115	I113-I115 HydrophobicContact CG2-CG1 3.97Å
114	H	29.9	Very low	29	Very low	168 Å²	168	132.5 Å²	132.5	78%	0.778	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-99.8	122.9	165.7	-79.1	-89.4	0	0	0	108.3
115	I	28.7	Very low	29	Very low	135 Å²	135	129.8 Å²	129.8	69%	0.692	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-103.3	126.3	175.3	-55.1	175.3	0	0	0	106.7	I113	I113-I115 HydrophobicContact CG2-CG1 3.97Å
116	V	28.5	Very low	29	Very low	122 Å²	122	128.4 Å²	128.4	74%	0.739	68%	0.682	S	S	*	*			trans	-114.7	122.5	173.1	-175.8	0	0	0	0	107.4
117	S	28.6	Very low	29	Very low	58 Å²	58	132.1 Å²	132.1	41%	0.406	69%	0.689	S	S	.	*			trans	-71.7	146.2	174.5	178.4	0	0	0	0	110.3	D119	S117-D119 PolarHBondContact OG-N 3.41Å; S117-D119 VanDerWaalsContact OG-N 3.14Å; S117-D119 PolarHBondContact OG-O 3.37Å
118	V	32.8	Very low	28.8	Very low	133 Å²	133	132.2 Å²	132.2	81%	0.806	70%	0.695	S	S	*	*	S	Bend	trans	-93.8	-0.6	174.4	-164.8	0	0	0	0	111.5
119	D	30.9	Very low	28.6	Very low	130 Å²	130	134.1 Å²	134.1	70%	0.695	70%	0.704	S	S	*	*	S	Bend	trans	-122.4	132.5	177.3	-61.6	-47.7	0	0	0	111	S117 E121	S117-D119 PolarHBondContact OG-N 3.41Å; S117-D119 VanDerWaalsContact OG-N 3.14Å; S117-D119 PolarHBondContact OG-O 3.37Å; D119-E121 PolarHBondContact O-N 2.82Å
120	D	30.4	Very low	28.3	Very low	181 Å²	181	134.7 Å²	134.7	97%	0.968	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	23	-167	-87.1	-30.1	0	0	0	116.7
121	E	29.9	Very low	28.2	Very low	188 Å²	188	129.4 Å²	129.4	88%	0.879	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.3	15.3	-171.8	-86.4	-166.7	161.3	0	0	117.3	D119	D119-E121 PolarHBondContact O-N 2.82Å
122	I	29.8	Very low	27.9	Very low	118 Å²	118	136.3 Å²	136.3	61%	0.605	73%	0.726	S	S	*	*			trans	-131.1	102.9	180	-51.2	-179.8	0	0	0	112.5	C124	I122-C124 VanDerWaalsContact CG2-SG 3.56Å; I122-C124 PolarHBondContact O-N 3.1Å
123	D	27.1	Very low	27.8	Very low	147 Å²	147	136.4 Å²	136.4	79%	0.786	72%	0.715	S	S	*	*			trans	-71.2	101	164.6	-169.7	8	0	0	0	109.4
124	C	30.4	Very low	27.5	Very low	108 Å²	108	139.3 Å²	139.3	73%	0.73	73%	0.726	S	S	*	*			trans	-107.5	64.9	173.9	-87.7	0	0	0	0	109.9	I122 E126	I122-C124 VanDerWaalsContact CG2-SG 3.56Å; I122-C124 PolarHBondContact O-N 3.1Å; C124-E126 PolarHBondContact O-N 3.02Å
125	S	25.5	Very low	27.3	Very low	87 Å²	87	134.7 Å²	134.7	61%	0.608	71%	0.707	S	S	*	*			trans	-65.6	122.9	160.6	61.3	0	0	0	0	110
126	E	25.3	Very low	26.9	Very low	185 Å²	185	138.1 Å²	138.1	86%	0.864	72%	0.716	S	S	*	*			trans	54.3	82.2	161.9	-62.2	-172.4	155.5	0	0	117.9	C124	C124-E126 PolarHBondContact O-N 3.02Å
127	R	25.7	Very low	26.8	Very low	240 Å²	240	138 Å²	138	91%	0.906	71%	0.709	S	S	*	*			trans	-134	93.1	155.3	-74.4	-170.5	174.2	178	-0.6	111.4	V129	R127-V129 PolarHBondContact O-N 3.01Å
128	V	25.4	Very low	26.6	Very low	128 Å²	128	141.3 Å²	141.3	78%	0.776	73%	0.732	S	S	*	*			trans	-77.9	104.4	169.3	177.9	0	0	0	0	108.5
129	V	25.1	Very low	26.3	Very low	112 Å²	112	141.3 Å²	141.3	68%	0.679	72%	0.723	S	S	*	*			trans	-90.1	106.9	166.9	-177.7	0	0	0	0	107.8	R127 T131	R127-V129 PolarHBondContact O-N 3.01Å; V129-T131 PolarHBondContact O-N 2.88Å
130	C	24.1	Very low	26.2	Very low	106 Å²	106	140.6 Å²	140.6	72%	0.716	73%	0.728	S	S	*	*			trans	-83.3	102.2	171.2	-108.3	0	0	0	0	108.9
131	T	25.1	Very low	26	Very low	92 Å²	92	136.5 Å²	136.5	56%	0.564	71%	0.71	S	S	*	*			trans	-107.6	129	170	-36.4	0	0	0	0	109.6	V129 F133	V129-T131 PolarHBondContact O-N 2.88Å; T131-F133 HydrophobicContact CG2-CE2 4.01Å; T131-F133 HydrophobicContact CG2-CZ 4.05Å
132	R	23.9	Very low	25.9	Very low	221 Å²	221	132.3 Å²	132.3	83%	0.834	70%	0.701	S	S	*	*			trans	-92.3	120.3	-176.6	-154	178.4	-164.9	177.6	1.6	108.2
133	F	26.8	Very low	26	Very low	100 Å²	100	129.3 Å²	129.3	44%	0.439	69%	0.691	S	S	.	*			trans	-112.6	139.8	175.2	-68.4	-83.5	0	0	0	110.6	I84 T131	I84-F133 HydrophobicContact CD1-CB 4.18Å; I84-F133 HydrophobicContact CD1-CD1 3.89Å; I84-F133 HydrophobicContact CD1-CD2 4.03Å; I84-F133 HydrophobicContact CD1-CE1 4.26Å; I84-F133 HydrophobicContact CD1-CE2 4.38Å; I84-F133 HydrophobicContact CD1-CG 3.77Å; I84-F133 HydrophobicContact CD1-CZ 4.49Å; I84-F133 HydrophobicContact CG1-CD1 4.44Å; T131-F133 HydrophobicContact CG2-CE2 4.01Å; T131-F133 HydrophobicContact CG2-CZ 4.05Å
134	Q	23.1	Very low	26	Very low	166 Å²	166	127.8 Å²	127.8	78%	0.776	68%	0.683	S	S	*	*			trans	-112.8	137.8	173.4	-84.2	-173.7	-39.2	0	0	109.6
135	I	25.6	Very low	25.8	Very low	72 Å²	72	128.4 Å²	128.4	37%	0.369	69%	0.688	S	S	.	*			trans	-131	135.8	177.4	-50.1	177.3	0	0	0	108.9	I84 V86	I84-I135 HydrophobicContact CB-CD1 3.73Å; I84-I135 HydrophobicContact CB-CG1 4.29Å; I84-I135 HydrophobicContact CG2-CD1 3.71Å; I84-I135 WeakPolarHBondContact O-CD1 3.17Å; I84-I135 WeakPolarHBondContact O-CG1 3.35Å; I84-I135 WeakPolarHBondContact O-CG2 3.39Å; V86-I135 HydrophobicContact CB-CD1 4.15Å; V86-I135 HydrophobicContact CG2-CD1 3.54Å
136	K	21.5	Very low	25.9	Very low	206 Å²	206	130.4 Å²	130.4	90%	0.896	70%	0.696	S	S	*	*			trans	-115.1	132.1	178.8	-112.4	-178.8	176.1	-178.9	0	108.7
137	M	25.3	Very low	25.8	Very low	121 Å²	121	129.2 Å²	129.2	60%	0.596	69%	0.693	S	S	*	*			trans	-130.3	143.8	170.1	-72.2	-74.5	-140.7	0	0	110	A85 E87	A85-M137 HydrophobicContact CB-CE 4.45Å; E87-M137 HydrophobicContact CG-CE 3.6Å
138	S	25.7	Very low	25.8	Very low	126 Å²	126	123.9 Å²	123.9	88%	0.881	69%	0.687	S	S	*	*			trans	-109.1	155	-172.4	47.8	0	0	0	0	113.7
139	E	25	Very low	25.8	Very low	133 Å²	133	126.8 Å²	126.8	62%	0.621	69%	0.692	S	S	*	*			trans	-100.3	154.8	-162.9	-62	174.8	154	0	0	118.1	L102	L102-E139 VanDerWaalsContact CB-OE1 3.31Å; L102-E139 WeakPolarHBondContact CB-OE1 3.38Å; L102-E139 WeakPolarHBondContact CD1-OE1 3.48Å
140	S	29.3	Very low	25.9	Very low	115 Å²	115	126.3 Å²	126.3	80%	0.804	69%	0.694	S	S	*	*			trans	-171.7	120.4	138.8	49.4	0	0	0	0	109.8
141	V	27.1	Very low	26.3	Very low	95 Å²	95	127.1 Å²	127.1	58%	0.576	70%	0.696	S	S	*	*				72.3	126.5	57.2	-173.2	0	0	0	0	112.6
142	S	28.3	Very low	26.8	Very low	100 Å²	100	127.2 Å²	127.2	70%	0.699	71%	0.706	S	S	*	*			cis	-162.5	169.7	17.9	39.2	0	0	0	0	113.4
143	S	30.6	Very low	28.2	Very low	56 Å²	56	120.9 Å²	120.9	39%	0.392	70%	0.701	S	S	.	*			trans	-74.6	158.7	-177.7	54.1	0	0	0	0	117.6	I98	I98-S143 WeakPolarHBondContact CG1-OG 3.49Å
144	D	26.8	Very low	30.3	Very low	114 Å²	114	119.3 Å²	119.3	61%	0.61	70%	0.7	S	S	*	*				175.2	148.5	118.3	-84.6	-6.3	0	0	0	113.9
145	S	26.7	Very low	33.2	Very low	121 Å²	121	116.6 Å²	116.6	85%	0.846	69%	0.687	S	S	*	*			trans	95.9	141	158.8	79.4	0	0	0	0	121
146	V	27.2	Very low	36	Very low	129 Å²	129	113.5 Å²	113.5	78%	0.782	67%	0.671	S	S	*	*			trans	-94.7	160.5	-161.5	176.2	0	0	0	0	110.4
147	M	24.3	Very low	39.2	Very low	161 Å²	161	109 Å²	109	79%	0.793	65%	0.653	S	S	*	*			trans	105.8	132.9	164.1	-56.2	-69	-81.6	0	0	115.1
148	T	25.7	Very low	42.2	Very low	127 Å²	127	103.4 Å²	103.4	78%	0.779	63%	0.626	S	S	*	*			trans	89.4	109.7	163.5	64.9	0	0	0	0	118.4
149	E	25.5	Very low	45.2	Very low	189 Å²	189	99.9 Å²	99.9	88%	0.883	60%	0.599	S	S	*	*	S	Bend	trans	-49.9	151.5	150.2	-70.2	169.5	137.8	0	0	110.4
150	S	26.7	Very low	48.2	Very low	102 Å²	102	93.5 Å²	93.5	71%	0.713	57%	0.569	S	S	*	*			trans	88.2	106.4	-179	90.1	0	0	0	0	114.9
151	T	31.9	Very low	50.9	Low	123 Å²	123	89.3 Å²	89.3	76%	0.755	54%	0.538	S	S	*	.	S	Bend	trans	154.9	-18.8	150.4	42.2	0	0	0	0	113.3	A153 T154	T151-A153 PolarHBondContact O-N 2.95Å; T151-T154 PolarHBondContact O-OG1 2.84Å
152	A	36.5	Very low	53.6	Low	95 Å²	95	84.9 Å²	84.9	79%	0.785	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-15	-174.8	0	0	0	0	0	115.9	T154	A152-T154 VanDerWaalsContact C-N 3.3Å; A152-T154 PolarHBondContact O-N 2.88Å
153	A	53.2	Low	56	Low	88 Å²	88	83.7 Å²	83.7	73%	0.727	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-1.8	-177.3	0	0	0	0	0	114.4	T151	T151-A153 PolarHBondContact O-N 2.95Å
154	T	71.7	Confident	57.9	Low	67 Å²	67	83.9 Å²	83.9	41%	0.411	51%	0.508	S	S	.	.	S	Bend	trans	-102.2	-16.9	-174.2	37.6	0	0	0	0	114.3	T151 A152 Q173 R174	T151-T154 PolarHBondContact O-OG1 2.84Å; A152-T154 VanDerWaalsContact C-N 3.3Å; A152-T154 PolarHBondContact O-N 2.88Å; T154-Q173 CarbonylContact O-C 3.51Å; T154-Q173 VanDerWaalsContact O-CA 3.24Å; T154-Q173 WeakPolarHBondContact O-CA 3.28Å; T154-R174 PolarHBondContact O-N 3.26Å
155	E	82.3	Confident	60.1	Low	109 Å²	109	86.6 Å²	86.6	51%	0.509	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	139	-177.9	-162.1	170.8	121.6	0	0	111.3	V171 A172	E155-V171 HydrophobicContact CG-CG1 3.37Å; E155-V171 WeakPolarHBondContact OE1-CG1 3.34Å; E155-A172 CarbonylContact C-O 3.54Å
156	L	86.1	Confident	62.6	Low	6 Å²	6	84 Å²	84	3%	0.031	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	121.6	-178.9	-59.8	175.6	0	0	0	108.8	L158 V171 A172 R174 L215 V220 N222	L156-L158 HydrophobicContact CB-CD1 4.44Å; L156-L158 HydrophobicContact CB-CD2 4.06Å; L156-L158 HydrophobicContact CB-CG 4.09Å; L156-V171 WeakPolarHBondContact O-CA 3.47Å; L156-A172 PolarHBondContact N-O 2.9Å; L156-A172 PolarHBondContact O-N 3.08Å; L156-R174 HydrophobicContact CD1-CB 4.07Å; L156-R174 HydrophobicContact CG-CB 4.28Å; L156-L215 HydrophobicContact CD1-CB 4.15Å; L156-L215 HydrophobicContact CD1-CD1 4.38Å; L156-V220 HydrophobicContact CD1-CG1 4.49Å; L156-N222 HydrophobicContact CD2-CB 4.37Å
157	Q	87.2	Confident	65.3	Low	113 Å²	113	82.2 Å²	82.2	53%	0.528	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	117.1	165.1	-60.9	-161.4	-8.7	0	0	109.1	N222 G223	Q157-N222 WeakPolarHBondContact CB-OD1 3.26Å; Q157-N222 PolarHBondContact N-OD1 3.02Å; Q157-G223 WeakPolarHBondContact O-CA 3.48Å; Q157-G223 PolarHBondContact O-N 3.02Å
158	L	88.6	Confident	68.3	Low	2 Å²	2	75.8 Å²	75.8	1%	0.01	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	147.5	-173.4	-57.4	176.1	0	0	0	110.2	L156 I160 P169 V170 A172 L181 L215 V220 K221 D224 L226	L156-L158 HydrophobicContact CB-CD1 4.44Å; L156-L158 HydrophobicContact CB-CD2 4.06Å; L156-L158 HydrophobicContact CB-CG 4.09Å; L158-I160 HydrophobicContact CB-CD1 4.38Å; L158-P169 CarbonylContact O-C 3.54Å; L158-P169 VanDerWaalsContact O-CA 3.31Å; L158-P169 WeakPolarHBondContact O-CA 3.4Å; L158-V170 PolarHBondContact N-O 2.91Å; L158-V170 PolarHBondContact O-N 3.38Å; L158-A172 HydrophobicContact CD1-CB 3.84Å; L158-L181 HydrophobicContact CD1-CD1 4.36Å; L158-L181 HydrophobicContact CD1-CD2 4.33Å; L158-L215 HydrophobicContact CD1-CD1 4.01Å; L158-V220 HydrophobicContact CD1-CG1 4.32Å; L158-V220 HydrophobicContact CD2-CG1 3.52Å; L158-K221 WeakPolarHBondContact CD2-O 3.47Å; L158-D224 WeakPolarHBondContact CA-O 3.49Å; L158-D224 HydrophobicContact CD2-CB 4.29Å; L158-L226 HydrophobicContact CB-CD1 4.32Å; L158-L226 HydrophobicContact CD1-CD1 3.98Å; L158-L226 HydrophobicContact CD2-CD1 4.13Å; L158-L226 HydrophobicContact CG-CD1 4.38Å
159	T	88.2	Confident	71.2	Confident	52 Å²	52	75 Å²	75	32%	0.319	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	117.6	168.5	-51.6	0	0	0	0	109.6	V161 I167 D224 A225 L226	T159-V161 HydrophobicContact CG2-CG2 4.48Å; T159-I167 HydrophobicContact CG2-CG2 3.53Å; T159-D224 PolarHBondContact N-O 3.2Å; T159-A225 HydrophobicContact CG2-CB 4.46Å; T159-A225 CarbonylContact O-C 3.57Å; T159-A225 WeakPolarHBondContact O-CA 3.27Å; T159-A225 WeakPolarHBondContact O-CB 3.37Å; T159-L226 PolarHBondContact O-N 3.26Å
160	I	88.4	Confident	74.2	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	130.9	176.6	-54	-56.6	0	0	0	109	L158 V162 I167 F168 V170 L181 L226 F228	L158-I160 HydrophobicContact CB-CD1 4.38Å; I160-V162 HydrophobicContact CG2-CG2 4.18Å; I160-I167 VanDerWaalsContact O-CA 3.31Å; I160-I167 WeakPolarHBondContact O-CA 3.36Å; I160-F168 HydrophobicContact CB-CD2 4.23Å; I160-F168 HydrophobicContact CB-CE1 4.33Å; I160-F168 HydrophobicContact CB-CE2 3.85Å; I160-F168 HydrophobicContact CB-CZ 3.91Å; I160-F168 HydrophobicContact CG1-CE2 4.14Å; I160-F168 HydrophobicContact CG2-CE1 4.15Å; I160-F168 HydrophobicContact CG2-CE2 4.14Å; I160-F168 HydrophobicContact CG2-CZ 3.72Å; I160-F168 PolarHBondContact N-O 2.83Å; I160-F168 PolarHBondContact O-N 3.33Å; I160-V170 HydrophobicContact CB-CG2 4.43Å; I160-V170 HydrophobicContact CG1-CB 3.97Å; I160-V170 HydrophobicContact CG1-CG2 3.55Å; I160-L181 HydrophobicContact CD1-CD2 4.5Å; I160-L226 WeakPolarHBondContact CA-O 3.45Å; I160-L226 HydrophobicContact CD1-CB 4.12Å; I160-L226 HydrophobicContact CD1-CD1 4.44Å; I160-F228 HydrophobicContact CD1-CE2 3.88Å; I160-F228 HydrophobicContact CD1-CZ 4.35Å; I160-F228 HydrophobicContact CG2-CB 4.44Å; I160-F228 HydrophobicContact CG2-CD1 4.27Å; I160-F228 HydrophobicContact CG2-CD2 3.67Å; I160-F228 HydrophobicContact CG2-CE1 4.47Å; I160-F228 HydrophobicContact CG2-CE2 3.92Å; I160-F228 HydrophobicContact CG2-CG 3.88Å; I160-F228 HydrophobicContact CG2-CZ 4.32Å
161	V	85.8	Confident	77.1	Confident	26 Å²	26	64.7 Å²	64.7	16%	0.158	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	108.4	177.8	-178.2	0	0	0	0	108.7	T159 E166 I167 L226 S227 F228	T159-V161 HydrophobicContact CG2-CG2 4.48Å; V161-E166 CarbonylContact C-O 3.56Å; V161-E166 WeakPolarHBondContact CA-O 3.42Å; V161-I167 HydrophobicContact CG1-CG1 4.27Å; V161-I167 HydrophobicContact CG2-CG1 4.22Å; V161-I167 HydrophobicContact CG2-CG2 4.39Å; V161-L226 PolarHBondContact N-O 3.44Å; V161-S227 CarbonylContact O-C 3.51Å; V161-S227 VanDerWaalsContact O-CA 3.25Å; V161-S227 WeakPolarHBondContact O-CA 3.47Å; V161-F228 PolarHBondContact O-N 3.27Å
162	V	84.9	Confident	79.9	Confident	2 Å²	2	59 Å²	59	1%	0.012	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	118.6	179.8	-171.4	0	0	0	0	109.5	I160 G164 E165 E166 F168 T191 L192 F228 V230	I160-V162 HydrophobicContact CG2-CG2 4.18Å; V162-G164 PolarHBondContact O-N 2.94Å; V162-E165 PolarHBondContact O-N 3.28Å; V162-E166 HydrophobicContact CB-CB 4.13Å; V162-E166 PolarHBondContact N-O 2.7Å; V162-E166 PolarHBondContact O-N 2.98Å; V162-F168 HydrophobicContact CG2-CE1 3.67Å; V162-F168 HydrophobicContact CG2-CZ 4.2Å; V162-T191 HydrophobicContact CG1-CG2 4.29Å; V162-L192 HydrophobicContact CG1-CD2 3.89Å; V162-L192 HydrophobicContact CG1-CG 4.4Å; V162-L192 HydrophobicContact CG2-CD1 4.32Å; V162-L192 HydrophobicContact CG2-CD2 4.2Å; V162-L192 HydrophobicContact CG2-CG 4.28Å; V162-F228 CarbonylContact C-O 3.51Å; V162-F228 WeakPolarHBondContact CA-O 3.36Å; V162-F228 HydrophobicContact CG2-CB 4.12Å; V162-V230 HydrophobicContact CG1-CG2 3.69Å
163	N	76.8	Confident	82.4	Confident	75 Å²	75	59.3 Å²	59.3	40%	0.401	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	51	16.7	-179	-71.8	-10.2	0	0	0	115.6	E165 F228 H229 V230	N163-E165 VanDerWaalsContact C-N 3.26Å; N163-E165 PolarHBondContact O-N 3.13Å; N163-F228 PolarHBondContact N-O 3.04Å; N163-H229 WeakPolarHBondContact OD1-CA 3.27Å; N163-V230 PolarHBondContact ND2-O 3Å; N163-V230 PolarHBondContact OD1-N 3.07Å
164	G	71.7	Confident	83.9	Confident	60 Å²	60	60.5 Å²	60.5	62%	0.619	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.9	2.7	-175.2	0	0	0	0	0	114.9	V162	V162-G164 PolarHBondContact O-N 2.94Å
165	E	73.1	Confident	84.7	Confident	172 Å²	172	60.7 Å²	60.7	80%	0.804	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.9	-52.4	-174.5	-63.5	-173	162	0	0	112	V162 N163	V162-E165 PolarHBondContact O-N 3.28Å; N163-E165 VanDerWaalsContact C-N 3.26Å; N163-E165 PolarHBondContact O-N 3.13Å
166	E	79.2	Confident	85	Confident	66 Å²	66	57.2 Å²	57.2	31%	0.308	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	127.7	178.6	-57	176.4	-172.6	0	0	110.1	V161 V162 S189 T191	V161-E166 CarbonylContact C-O 3.56Å; V161-E166 WeakPolarHBondContact CA-O 3.42Å; V162-E166 HydrophobicContact CB-CB 4.13Å; V162-E166 PolarHBondContact N-O 2.7Å; V162-E166 PolarHBondContact O-N 2.98Å; E166-S189 WeakPolarHBondContact OE2-CB 3.38Å; E166-S189 PolarHBondContact OE2-OG 3.05Å; E166-T191 PolarHBondContact OE1-OG1 3.27Å
167	I	84.4	Confident	85.3	Confident	91 Å²	91	59 Å²	59	47%	0.467	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	123.7	177	-54.1	178.8	0	0	0	108.5	A74 T159 I160 V161	A74-I167 HydrophobicContact CB-CD1 4.26Å; T159-I167 HydrophobicContact CG2-CG2 3.53Å; I160-I167 VanDerWaalsContact O-CA 3.31Å; I160-I167 WeakPolarHBondContact O-CA 3.36Å; V161-I167 HydrophobicContact CG1-CG1 4.27Å; V161-I167 HydrophobicContact CG2-CG1 4.22Å; V161-I167 HydrophobicContact CG2-CG2 4.39Å
168	F	85.4	Confident	85.3	Confident	26 Å²	26	53.6 Å²	53.6	11%	0.114	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	145.1	176.4	56.3	-87.8	0	0	0	112.1	I160 V162 V170 C185 Y188 L192	I160-F168 HydrophobicContact CB-CD2 4.23Å; I160-F168 HydrophobicContact CB-CE1 4.33Å; I160-F168 HydrophobicContact CB-CE2 3.85Å; I160-F168 HydrophobicContact CB-CZ 3.91Å; I160-F168 HydrophobicContact CG1-CE2 4.14Å; I160-F168 HydrophobicContact CG2-CE1 4.15Å; I160-F168 HydrophobicContact CG2-CE2 4.14Å; I160-F168 HydrophobicContact CG2-CZ 3.72Å; I160-F168 PolarHBondContact N-O 2.83Å; I160-F168 PolarHBondContact O-N 3.33Å; V162-F168 HydrophobicContact CG2-CE1 3.67Å; V162-F168 HydrophobicContact CG2-CZ 4.2Å; F168-V170 HydrophobicContact CD2-CG2 3.44Å; F168-V170 VanDerWaalsContact CD2-CG2 3.44Å; F168-V170 HydrophobicContact CE2-CG2 3.36Å; F168-C185 HydrophobicContact CE2-CB 4.42Å; F168-C185 HydrophobicContact CZ-CB 4.34Å; F168-Y188 HydrophobicContact CD2-CD2 4.46Å; F168-Y188 HydrophobicContact CD2-CG 4.19Å; F168-Y188 HydrophobicContact CE2-CD2 4.09Å; F168-Y188 HydrophobicContact CE2-CG 4.09Å; F168-L192 HydrophobicContact CZ-CD1 4.45Å
169	P	87.8	Confident	85.2	Confident	110 Å²	110	59.6 Å²	59.6	71%	0.714	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	143.7	172.6	31.4	-33.5	0	0	0	110.6	L158	L158-P169 CarbonylContact O-C 3.54Å; L158-P169 VanDerWaalsContact O-CA 3.31Å; L158-P169 WeakPolarHBondContact O-CA 3.4Å
170	V	88.5	Confident	85.3	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.024	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	135.5	175.6	175.3	0	0	0	0	109.4	L158 I160 F168 L181 Y188	L158-V170 PolarHBondContact N-O 2.91Å; L158-V170 PolarHBondContact O-N 3.38Å; I160-V170 HydrophobicContact CB-CG2 4.43Å; I160-V170 HydrophobicContact CG1-CB 3.97Å; I160-V170 HydrophobicContact CG1-CG2 3.55Å; F168-V170 HydrophobicContact CD2-CG2 3.44Å; F168-V170 VanDerWaalsContact CD2-CG2 3.44Å; F168-V170 HydrophobicContact CE2-CG2 3.36Å; V170-L181 HydrophobicContact CG1-CD1 4.23Å; V170-Y188 HydrophobicContact CG2-CD2 4.16Å; V170-Y188 HydrophobicContact CG2-CE2 4.31Å
171	V	88.3	Confident	85.4	Confident	71 Å²	71	58.9 Å²	58.9	43%	0.43	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	120.1	169.3	-179.2	0	0	0	0	108.1	E155 L156	E155-V171 HydrophobicContact CG-CG1 3.37Å; E155-V171 WeakPolarHBondContact OE1-CG1 3.34Å; L156-V171 WeakPolarHBondContact O-CA 3.47Å
172	A	89.7	Confident	85.6	Confident	3 Å²	3	58.2 Å²	58.2	3%	0.025	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	161.6	179.8	0	0	0	0	0	110.8	E155 L156 L158 M176 L181 L215	E155-A172 CarbonylContact C-O 3.54Å; L156-A172 PolarHBondContact N-O 2.9Å; L156-A172 PolarHBondContact O-N 3.08Å; L158-A172 HydrophobicContact CD1-CB 3.84Å; A172-M176 HydrophobicContact CB-SD 4.02Å; A172-L181 HydrophobicContact CB-CD1 3.77Å; A172-L215 HydrophobicContact CB-CD1 3.86Å
173	Q	88.5	Confident	85.7	Confident	103 Å²	103	61.9 Å²	61.9	48%	0.481	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	143	169.2	-58.4	-173.9	-27.1	0	0	110.5	T154 S175 M176	T154-Q173 CarbonylContact O-C 3.51Å; T154-Q173 VanDerWaalsContact O-CA 3.24Å; T154-Q173 WeakPolarHBondContact O-CA 3.28Å; Q173-S175 PolarHBondContact O-N 3.03Å; Q173-S175 VanDerWaalsContact O-N 3.14Å; Q173-M176 HydrophobicContact CB-CG 4.02Å; Q173-M176 HydrophobicContact CB-SD 4.34Å; Q173-M176 PolarHBondContact N-SD 3.46Å; Q173-M176 VanDerWaalsContact O-CB 3.25Å; Q173-M176 WeakPolarHBondContact O-CB 3.31Å; Q173-M176 PolarHBondContact O-N 3.17Å
174	R	85.6	Confident	86.2	Confident	112 Å²	112	61 Å²	61	42%	0.423	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-29.5	175.3	-175.7	175	-109.5	-143.6	-3.9	112.8	T154 L156 L215 G216	T154-R174 PolarHBondContact O-N 3.26Å; L156-R174 HydrophobicContact CD1-CB 4.07Å; L156-R174 HydrophobicContact CG-CB 4.28Å; R174-L215 PolarHBondContact O-N 3.38Å; R174-G216 PolarHBondContact O-N 3.22Å
175	S	88.1	Confident	87	Confident	72 Å²	72	58.1 Å²	58.1	50%	0.503	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-12.6	175.4	54	0	0	0	0	114.2	Q173 T177	Q173-S175 PolarHBondContact O-N 3.03Å; Q173-S175 VanDerWaalsContact O-N 3.14Å; S175-T177 PolarHBondContact O-N 3.32Å
176	M	89.6	Confident	87.7	Confident	36 Å²	36	53.1 Å²	53.1	18%	0.177	28%	0.278	C	S	.	.			trans	-63.3	138.9	175.1	-74.6	173.9	68.9	0	0	109.7	A172 Q173 A180 L181 H184 T214 L215	A172-M176 HydrophobicContact CB-SD 4.02Å; Q173-M176 HydrophobicContact CB-CG 4.02Å; Q173-M176 HydrophobicContact CB-SD 4.34Å; Q173-M176 PolarHBondContact N-SD 3.46Å; Q173-M176 VanDerWaalsContact O-CB 3.25Å; Q173-M176 WeakPolarHBondContact O-CB 3.31Å; Q173-M176 PolarHBondContact O-N 3.17Å; M176-A180 HydrophobicContact CB-CB 4.28Å; M176-A180 HydrophobicContact CE-CB 4.15Å; M176-A180 WeakPolarHBondContact CE-O 3.47Å; M176-L181 HydrophobicContact CE-CB 4.43Å; M176-H184 HydrophobicContact CE-CB 3.82Å; M176-T214 CarbonylContact O-C 3.48Å; M176-T214 WeakPolarHBondContact O-CA 3.4Å; M176-L215 HydrophobicContact CB-CD1 4.33Å; M176-L215 WeakPolarHBondContact O-CG 3.33Å; M176-L215 PolarHBondContact O-N 3.14Å
177	T	91	Very high	87.9	Confident	43 Å²	43	55.9 Å²	55.9	26%	0.264	29%	0.291	S	S	.	.	B	Isolated β-bridge	trans	-76.3	159	170.7	64.6	0	0	0	0	110.2	S175 K179 A180 L181 S212 R213	S175-T177 PolarHBondContact O-N 3.32Å; T177-K179 PolarHBondContact O-N 3.3Å; T177-A180 PolarHBondContact O-N 3.14Å; T177-A180 WeakPolarHBondContact OG1-CB 3.27Å; T177-A180 PolarHBondContact OG1-N 3.15Å; T177-A180 VanDerWaalsContact OG1-N 3.12Å; T177-L181 PolarHBondContact O-N 3.37Å; T177-S212 WeakPolarHBondContact CG2-O 3.36Å; T177-R213 VanDerWaalsContact CA-O 3.31Å; T177-R213 WeakPolarHBondContact CA-O 3.42Å
178	V	87.5	Confident	87.8	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-55.9	-36.6	174.3	177.5	0	0	0	0	110.9	L181 T182 V201 L208 R213 L215	V178-L181 PolarHBondContact O-N 3.5Å; V178-T182 WeakPolarHBondContact O-CB 3.47Å; V178-T182 PolarHBondContact O-N 2.96Å; V178-T182 PolarHBondContact O-OG1 3.25Å; V178-V201 HydrophobicContact CG1-CB 3.89Å; V178-V201 HydrophobicContact CG1-CG1 4.19Å; V178-V201 HydrophobicContact CG1-CG2 3.95Å; V178-L208 HydrophobicContact CG1-CB 4.11Å; V178-L208 HydrophobicContact CG1-CD1 4.29Å; V178-L208 HydrophobicContact CG2-CB 4.11Å; V178-L208 HydrophobicContact CG2-CD1 3.75Å; V178-R213 PolarHBondContact N-O 3.31Å; V178-R213 VanDerWaalsContact N-O 3.1Å; V178-L215 HydrophobicContact CG2-CD2 4.41Å
179	K	87.9	Confident	87.7	Confident	128 Å²	128	56.2 Å²	56.2	56%	0.557	29%	0.287	S	S	*	.	H	α-helix	trans	-61.9	-49.1	172.5	-171.9	-179.7	176.4	-171.6	0	112.3	T177 L181 T182 D183 H211	T177-K179 PolarHBondContact O-N 3.3Å; K179-L181 VanDerWaalsContact C-N 3.3Å; K179-L181 PolarHBondContact O-N 2.92Å; K179-T182 WeakPolarHBondContact O-CB 3.44Å; K179-T182 PolarHBondContact O-N 2.78Å; K179-T182 VanDerWaalsContact O-N 3.09Å; K179-D183 PolarHBondContact O-N 3.09Å; K179-H211 HydrophobicContact CB-CB 4.12Å; K179-H211 WeakPolarHBondContact CB-O 3.19Å; K179-H211 PolarHBondContact N-O 3.21Å
180	A	88.7	Confident	87.4	Confident	37 Å²	37	54.9 Å²	54.9	31%	0.306	29%	0.285	S	S	.	.	H	α-helix	trans	-62.4	-38.2	179.8	0	0	0	0	0	111.9	M176 T177 H184	M176-A180 HydrophobicContact CB-CB 4.28Å; M176-A180 HydrophobicContact CE-CB 4.15Å; M176-A180 WeakPolarHBondContact CE-O 3.47Å; T177-A180 PolarHBondContact O-N 3.14Å; T177-A180 WeakPolarHBondContact OG1-CB 3.27Å; T177-A180 PolarHBondContact OG1-N 3.15Å; T177-A180 VanDerWaalsContact OG1-N 3.12Å; A180-H184 VanDerWaalsContact O-CB 3.27Å; A180-H184 WeakPolarHBondContact O-CB 3.42Å; A180-H184 PolarHBondContact O-N 3.26Å
181	L	91.5	Very high	86.9	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-62.3	-45.6	171.7	179.9	67.9	0	0	0	110.8	L158 I160 V170 A172 M176 T177 V178 K179 D183 H184 C185 L215 L226 F228	L158-L181 HydrophobicContact CD1-CD1 4.36Å; L158-L181 HydrophobicContact CD1-CD2 4.33Å; I160-L181 HydrophobicContact CD1-CD2 4.5Å; V170-L181 HydrophobicContact CG1-CD1 4.23Å; A172-L181 HydrophobicContact CB-CD1 3.77Å; M176-L181 HydrophobicContact CE-CB 4.43Å; T177-L181 PolarHBondContact O-N 3.37Å; V178-L181 PolarHBondContact O-N 3.5Å; K179-L181 VanDerWaalsContact C-N 3.3Å; K179-L181 PolarHBondContact O-N 2.92Å; L181-D183 VanDerWaalsContact C-N 3.34Å; L181-D183 PolarHBondContact O-N 3.42Å; L181-H184 WeakPolarHBondContact O-CB 3.42Å; L181-H184 PolarHBondContact O-N 2.94Å; L181-C185 PolarHBondContact O-N 3.38Å; L181-C185 PolarHBondContact O-SG 3.34Å; L181-L215 HydrophobicContact CB-CD1 4.38Å; L181-L215 HydrophobicContact CB-CD2 4.4Å; L181-L215 HydrophobicContact CD1-CD1 4.38Å; L181-L215 HydrophobicContact CD2-CD1 4.06Å; L181-L215 HydrophobicContact CD2-CD2 3.68Å; L181-L226 HydrophobicContact CD2-CD2 3.94Å; L181-F228 HydrophobicContact CD2-CE2 4.4Å; L181-F228 HydrophobicContact CD2-CZ 4.21Å; L181-F228 HydrophobicContact CG-CZ 4.18Å
182	T	88.6	Confident	86.5	Confident	12 Å²	12	53.4 Å²	53.4	7%	0.074	28%	0.276	C	S	.	.	H	α-helix	trans	-59.6	-45.9	179.6	-53.5	0	0	0	0	111.6	V178 K179 H184 C185 K186 V199 V201 F228	V178-T182 WeakPolarHBondContact O-CB 3.47Å; V178-T182 PolarHBondContact O-N 2.96Å; V178-T182 PolarHBondContact O-OG1 3.25Å; K179-T182 WeakPolarHBondContact O-CB 3.44Å; K179-T182 PolarHBondContact O-N 2.78Å; K179-T182 VanDerWaalsContact O-N 3.09Å; T182-H184 VanDerWaalsContact C-N 3.33Å; T182-H184 PolarHBondContact O-N 2.91Å; T182-C185 PolarHBondContact O-N 2.99Å; T182-K186 PolarHBondContact O-N 3.4Å; T182-V199 HydrophobicContact CG2-CB 3.85Å; T182-V199 HydrophobicContact CG2-CG1 3.86Å; T182-V199 HydrophobicContact CG2-CG2 4.34Å; T182-V201 WeakPolarHBondContact OG1-CG2 3.41Å; T182-F228 HydrophobicContact CG2-CE1 4.18Å
183	D	87.4	Confident	85.9	Confident	79 Å²	79	57.4 Å²	57.4	42%	0.422	30%	0.297	S	S	.	.	H	α-helix	trans	-67.3	-33.7	177.4	-69.9	-29.4	0	0	0	112.2	K179 L181 K186	K179-D183 PolarHBondContact O-N 3.09Å; L181-D183 VanDerWaalsContact C-N 3.34Å; L181-D183 PolarHBondContact O-N 3.42Å; D183-K186 WeakPolarHBondContact O-CB 3.11Å; D183-K186 IonicContact OD1-NZ 3.77Å; D183-K186 PolarHBondContact OD1-NZ 3.22Å
184	H	88.4	Confident	85.2	Confident	56 Å²	56	57 Å²	57	26%	0.259	30%	0.295	S	S	.	.	H	α-helix	trans	-68.5	-40.2	173.7	-173.6	74.3	0	0	0	112.2	M176 A180 L181 T182 K186 Q187 Y188	M176-H184 HydrophobicContact CE-CB 3.82Å; A180-H184 VanDerWaalsContact O-CB 3.27Å; A180-H184 WeakPolarHBondContact O-CB 3.42Å; A180-H184 PolarHBondContact O-N 3.26Å; L181-H184 WeakPolarHBondContact O-CB 3.42Å; L181-H184 PolarHBondContact O-N 2.94Å; T182-H184 VanDerWaalsContact C-N 3.33Å; T182-H184 PolarHBondContact O-N 2.91Å; H184-K186 VanDerWaalsContact C-N 3.27Å; H184-K186 PolarHBondContact O-N 3.45Å; H184-Q187 PolarHBondContact CE1-NE2 3.06Å; H184-Q187 PolarHBondContact ND1-NE2 2.84Å; H184-Q187 PolarHBondContact NE2-NE2 2.78Å; H184-Q187 VanDerWaalsContact O-CG 3.23Å; H184-Q187 WeakPolarHBondContact O-CG 3.26Å; H184-Q187 PolarHBondContact O-N 2.75Å; H184-Q187 PolarHBondContact O-NE2 3.47Å; H184-Y188 AromaticContact CD2-CE2 3.99Å; H184-Y188 AromaticContact NE2-CE2 3.74Å
185	C	88.9	Confident	84.3	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-66.6	-26.5	179.1	-69.6	0	0	0	0	113.3	F168 L181 T182 Q187 Y188 S189 L192 F228	F168-C185 HydrophobicContact CE2-CB 4.42Å; F168-C185 HydrophobicContact CZ-CB 4.34Å; L181-C185 PolarHBondContact O-N 3.38Å; L181-C185 PolarHBondContact O-SG 3.34Å; T182-C185 PolarHBondContact O-N 2.99Å; C185-Q187 PolarHBondContact O-N 2.79Å; C185-Q187 VanDerWaalsContact O-N 3.09Å; C185-Y188 PolarHBondContact O-N 2.88Å; C185-S189 PolarHBondContact O-N 2.92Å; C185-L192 HydrophobicContact CB-CD1 3.67Å; C185-F228 HydrophobicContact CB-CD1 4.44Å; C185-F228 HydrophobicContact CB-CE1 3.66Å; C185-F228 HydrophobicContact CB-CZ 4.16Å
186	K	87.2	Confident	83	Confident	67 Å²	67	59.9 Å²	59.9	29%	0.291	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-22.4	177.5	-78.3	174.9	-172.7	162.6	0	114.2	T182 D183 H184 Y188 L192 N193	T182-K186 PolarHBondContact O-N 3.4Å; D183-K186 WeakPolarHBondContact O-CB 3.11Å; D183-K186 IonicContact OD1-NZ 3.77Å; D183-K186 PolarHBondContact OD1-NZ 3.22Å; H184-K186 VanDerWaalsContact C-N 3.27Å; H184-K186 PolarHBondContact O-N 3.45Å; K186-Y188 VanDerWaalsContact C-N 3.28Å; K186-L192 HydrophobicContact CG-CB 3.9Å; K186-N193 WeakPolarHBondContact CB-OD1 3.43Å; K186-N193 WeakPolarHBondContact CG-OD1 3.27Å; K186-N193 PolarHBondContact O-ND2 3.06Å
187	Q	83.6	Confident	82	Confident	124 Å²	124	62.2 Å²	62.2	58%	0.579	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-15.9	176.3	78.7	-165.1	-21.8	0	0	113.5	H184 C185	H184-Q187 PolarHBondContact CE1-NE2 3.06Å; H184-Q187 PolarHBondContact ND1-NE2 2.84Å; H184-Q187 PolarHBondContact NE2-NE2 2.78Å; H184-Q187 VanDerWaalsContact O-CG 3.23Å; H184-Q187 WeakPolarHBondContact O-CG 3.26Å; H184-Q187 PolarHBondContact O-N 2.75Å; H184-Q187 PolarHBondContact O-NE2 3.47Å; C185-Q187 PolarHBondContact O-N 2.79Å; C185-Q187 VanDerWaalsContact O-N 3.09Å
188	Y	82.7	Confident	81.1	Confident	120 Å²	120	61.6 Å²	61.6	47%	0.471	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-17.2	-175.6	-60	-72.3	0	0	0	113.7	F168 V170 H184 C185 K186	F168-Y188 HydrophobicContact CD2-CD2 4.46Å; F168-Y188 HydrophobicContact CD2-CG 4.19Å; F168-Y188 HydrophobicContact CE2-CD2 4.09Å; F168-Y188 HydrophobicContact CE2-CG 4.09Å; V170-Y188 HydrophobicContact CG2-CD2 4.16Å; V170-Y188 HydrophobicContact CG2-CE2 4.31Å; H184-Y188 AromaticContact CD2-CE2 3.99Å; H184-Y188 AromaticContact NE2-CE2 3.74Å; C185-Y188 PolarHBondContact O-N 2.88Å; K186-Y188 VanDerWaalsContact C-N 3.28Å
189	S	83	Confident	80.9	Confident	4 Å²	4	62.6 Å²	62.6	3%	0.028	33%	0.333	C	S	.	.			trans	-133.2	122.3	-177.8	170.3	0	0	0	0	110.6	E166 C185 T191 L192	E166-S189 WeakPolarHBondContact OE2-CB 3.38Å; E166-S189 PolarHBondContact OE2-OG 3.05Å; C185-S189 PolarHBondContact O-N 2.92Å; S189-T191 VanDerWaalsContact C-N 3.26Å; S189-T191 PolarHBondContact O-N 2.92Å; S189-T191 PolarHBondContact OG-N 3.2Å; S189-L192 PolarHBondContact O-N 3.45Å; S189-L192 PolarHBondContact OG-N 3.08Å
190	A	79.9	Confident	80.5	Confident	81 Å²	81	56.7 Å²	56.7	67%	0.669	31%	0.308	S	S	*	.	S	Bend	trans	-65.6	-33.8	174.1	0	0	0	0	0	111.4	L192 N193	A190-L192 PolarHBondContact O-N 3.14Å; A190-N193 PolarHBondContact O-N 2.72Å
191	T	78.3	Confident	80.3	Confident	35 Å²	35	55 Å²	55	22%	0.215	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-59.8	-32	178.6	-52.1	0	0	0	0	111.9	V162 E166 S189 N193 V230	V162-T191 HydrophobicContact CG1-CG2 4.29Å; E166-T191 PolarHBondContact OE1-OG1 3.27Å; S189-T191 VanDerWaalsContact C-N 3.26Å; S189-T191 PolarHBondContact O-N 2.92Å; S189-T191 PolarHBondContact OG-N 3.2Å; T191-N193 VanDerWaalsContact C-N 3.25Å; T191-N193 PolarHBondContact O-N 3.14Å; T191-V230 HydrophobicContact CG2-CB 4.37Å; T191-V230 HydrophobicContact CG2-CG1 4.48Å; T191-V230 HydrophobicContact CG2-CG2 4.16Å; T191-V230 WeakPolarHBondContact O-CG1 3.34Å
192	L	80.7	Confident	79.9	Confident	9 Å²	9	55.3 Å²	55.3	5%	0.047	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-73.2	-11.7	174.8	-62.6	179.3	0	0	0	114.4	V162 F168 C185 K186 S189 A190 V199 F228 V230	V162-L192 HydrophobicContact CG1-CD2 3.89Å; V162-L192 HydrophobicContact CG1-CG 4.4Å; V162-L192 HydrophobicContact CG2-CD1 4.32Å; V162-L192 HydrophobicContact CG2-CD2 4.2Å; V162-L192 HydrophobicContact CG2-CG 4.28Å; F168-L192 HydrophobicContact CZ-CD1 4.45Å; C185-L192 HydrophobicContact CB-CD1 3.67Å; K186-L192 HydrophobicContact CG-CB 3.9Å; S189-L192 PolarHBondContact O-N 3.45Å; S189-L192 PolarHBondContact OG-N 3.08Å; A190-L192 PolarHBondContact O-N 3.14Å; L192-V199 HydrophobicContact CD2-CG1 3.85Å; L192-V199 HydrophobicContact CD2-CG2 3.79Å; L192-F228 HydrophobicContact CD1-CD1 3.96Å; L192-F228 HydrophobicContact CD1-CE1 4.31Å; L192-F228 HydrophobicContact CD2-CB 4.24Å; L192-F228 HydrophobicContact CD2-CD1 3.79Å; L192-V230 HydrophobicContact CD2-CG2 3.54Å
193	N	76.5	Confident	79.7	Confident	87 Å²	87	55.6 Å²	55.6	47%	0.465	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-105.5	4.7	-178.5	-71.3	-42.9	0	0	0	113.8	K186 A190 T191 H195	K186-N193 WeakPolarHBondContact CB-OD1 3.43Å; K186-N193 WeakPolarHBondContact CG-OD1 3.27Å; K186-N193 PolarHBondContact O-ND2 3.06Å; A190-N193 PolarHBondContact O-N 2.72Å; T191-N193 VanDerWaalsContact C-N 3.25Å; T191-N193 PolarHBondContact O-N 3.14Å; N193-H195 PolarHBondContact O-N 2.89Å
194	E	73.1	Confident	79.3	Confident	96 Å²	96	57.6 Å²	57.6	45%	0.449	31%	0.307	S	S	.	.			trans	-64.6	125.8	-178.8	-68.9	-167.6	161.7	0	0	111.9	G196 F197	E194-G196 PolarHBondContact O-N 2.89Å; E194-F197 HydrophobicContact CB-CB 4.44Å; E194-F197 HydrophobicContact CB-CD2 3.59Å; E194-F197 HydrophobicContact CB-CE2 4.2Å; E194-F197 HydrophobicContact CB-CG 4.25Å; E194-F197 PolarHBondContact O-N 2.99Å
195	H	67.4	Low	78.3	Confident	188 Å²	188	57.7 Å²	57.7	87%	0.87	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	133.4	177.4	-68.9	-55.7	0	0	0	111.1	N193	N193-H195 PolarHBondContact O-N 2.89Å
196	G	60	Low	77.3	Confident	56 Å²	56	64.1 Å²	64.1	58%	0.577	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.1	-8.7	-178.5	0	0	0	0	0	114.2	E194 T233	E194-G196 PolarHBondContact O-N 2.89Å; G196-T233 WeakPolarHBondContact O-CB 3.32Å; G196-T233 PolarHBondContact O-N 2.76Å; G196-T233 PolarHBondContact O-OG1 2.8Å
197	F	70	Confident	76.7	Confident	85 Å²	85	62.3 Å²	62.3	37%	0.373	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	148.9	176.6	-62.8	-98.7	0	0	0	111.7	E194 V230 V231 P232	E194-F197 HydrophobicContact CB-CB 4.44Å; E194-F197 HydrophobicContact CB-CD2 3.59Å; E194-F197 HydrophobicContact CB-CE2 4.2Å; E194-F197 HydrophobicContact CB-CG 4.25Å; E194-F197 PolarHBondContact O-N 2.99Å; F197-V230 HydrophobicContact CB-CG1 3.58Å; F197-V230 HydrophobicContact CD1-CG1 4.05Å; F197-V230 HydrophobicContact CG-CG1 4.03Å; F197-V231 CarbonylContact C-O 3.15Å; F197-V231 VanDerWaalsContact CA-O 3.3Å; F197-V231 WeakPolarHBondContact CA-O 3.45Å; F197-V231 VanDerWaalsContact CD1-C 3.5Å; F197-P232 HydrophobicContact CD1-CG 4.16Å; F197-P232 HydrophobicContact CE1-CG 3.8Å
198	S	72.4	Confident	76.5	Confident	29 Å²	29	57.5 Å²	57.5	20%	0.203	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	150.1	173.5	-71.7	0	0	0	0	109.8	V231 T233	S198-V231 PolarHBondContact N-O 2.89Å; S198-V231 PolarHBondContact O-N 3.25Å; S198-T233 WeakPolarHBondContact OG-CB 3.42Å; S198-T233 WeakPolarHBondContact OG-CG2 3.37Å; S198-T233 PolarHBondContact OG-OG1 3.29Å
199	V	81.5	Confident	76	Confident	22 Å²	22	55.5 Å²	55.5	13%	0.133	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	114.9	-175.8	-174.8	0	0	0	0	109.6	T182 L192 F228 H229 V230	T182-V199 HydrophobicContact CG2-CB 3.85Å; T182-V199 HydrophobicContact CG2-CG1 3.86Å; T182-V199 HydrophobicContact CG2-CG2 4.34Å; L192-V199 HydrophobicContact CD2-CG1 3.85Å; L192-V199 HydrophobicContact CD2-CG2 3.79Å; V199-F228 HydrophobicContact CG1-CB 4.14Å; V199-F228 HydrophobicContact CG1-CD1 3.55Å; V199-F228 HydrophobicContact CG1-CE1 4.27Å; V199-F228 HydrophobicContact CG1-CG 4.11Å; V199-H229 WeakPolarHBondContact CA-O 3.38Å; V199-V230 HydrophobicContact CG2-CG2 4.38Å
200	G	80.9	Confident	75.7	Confident	3 Å²	3	59 Å²	59	3%	0.031	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	134.9	166.5	0	0	0	0	0	110.6	F228 H229	G200-F228 CarbonylContact O-C 3.51Å; G200-F228 WeakPolarHBondContact O-CA 3.29Å; G200-H229 PolarHBondContact N-O 2.9Å; G200-H229 PolarHBondContact O-N 2.9Å
201	V	84.9	Confident	75.8	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.006	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	134.3	178.5	-177.7	0	0	0	0	109.1	V178 T182 F207 L208 L226 F228	V178-V201 HydrophobicContact CG1-CB 3.89Å; V178-V201 HydrophobicContact CG1-CG1 4.19Å; V178-V201 HydrophobicContact CG1-CG2 3.95Å; T182-V201 WeakPolarHBondContact OG1-CG2 3.41Å; V201-F207 CarbonylContact O-C 3.54Å; V201-F207 WeakPolarHBondContact O-CA 3.18Å; V201-L208 HydrophobicContact CG1-CD1 3.99Å; V201-L208 PolarHBondContact O-N 2.97Å; V201-L226 HydrophobicContact CG1-CB 4.41Å; V201-L226 HydrophobicContact CG1-CD2 3.79Å; V201-F228 HydrophobicContact CB-CE2 4.44Å; V201-F228 HydrophobicContact CG1-CD2 4.11Å; V201-F228 HydrophobicContact CG1-CE2 3.75Å; V201-F228 HydrophobicContact CG1-CZ 4.45Å; V201-F228 HydrophobicContact CG2-CD1 4.45Å; V201-F228 HydrophobicContact CG2-CD2 4.16Å; V201-F228 HydrophobicContact CG2-CE1 4.22Å; V201-F228 HydrophobicContact CG2-CE2 3.91Å; V201-F228 HydrophobicContact CG2-CG 4.42Å; V201-F228 HydrophobicContact CG2-CZ 3.93Å
202	S	81.3	Confident	75.9	Confident	7 Å²	7	61.1 Å²	61.1	5%	0.049	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	143.8	175.8	67.4	0	0	0	0	112.1	Q206 L226 S227 H229	S202-Q206 CarbonylContact C-O 3.57Å; S202-Q206 WeakPolarHBondContact CA-O 3.44Å; S202-Q206 WeakPolarHBondContact CB-O 3.27Å; S202-L226 WeakPolarHBondContact O-CA 3.41Å; S202-S227 PolarHBondContact N-O 2.86Å; S202-S227 PolarHBondContact O-N 3.29Å; S202-S227 WeakPolarHBondContact OG-CB 3.29Å; S202-S227 PolarHBondContact OG-O 2.92Å; S202-S227 VanDerWaalsContact OG-O 3.06Å; S202-H229 PolarHBondContact OG-CD2 3.46Å; S202-H229 PolarHBondContact OG-NE2 3.21Å
203	F	85.5	Confident	76	Confident	18 Å²	18	66.8 Å²	66.8	8%	0.079	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	127.6	179	175.7	-125.2	0	0	0	108.4	G205 Q206 L208 V220 D224 L226	F203-G205 PolarHBondContact O-N 2.79Å; F203-G205 VanDerWaalsContact O-N 3.13Å; F203-Q206 PolarHBondContact N-O 3.12Å; F203-Q206 PolarHBondContact O-N 2.85Å; F203-L208 HydrophobicContact CB-CD1 4.17Å; F203-L208 HydrophobicContact CB-CD2 4.24Å; F203-L208 HydrophobicContact CB-CG 4.27Å; F203-V220 HydrophobicContact CD1-CG2 3.91Å; F203-V220 HydrophobicContact CD2-CG2 4.37Å; F203-V220 HydrophobicContact CE1-CG2 3.97Å; F203-V220 HydrophobicContact CE2-CG2 4.45Å; F203-V220 HydrophobicContact CG-CG2 4.12Å; F203-V220 HydrophobicContact CZ-CG2 4.25Å; F203-D224 HydrophobicContact CE2-CB 3.75Å; F203-D224 HydrophobicContact CZ-CB 4.36Å; F203-D224 VanDerWaalsContact CZ-OD2 3.27Å; F203-D224 WeakPolarHBondContact CZ-OD2 3.19Å; F203-L226 HydrophobicContact CB-CG 4.44Å; F203-L226 HydrophobicContact CD2-CG 4.3Å
204	N	78.7	Confident	76.6	Confident	122 Å²	122	64.3 Å²	64.3	65%	0.652	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	37.7	-175.3	-66.2	-25.2	0	0	0	114.3	Q206	N204-Q206 VanDerWaalsContact C-N 3.29Å; N204-Q206 PolarHBondContact O-N 2.93Å
205	G	67.7	Low	77.3	Confident	58 Å²	58	59.7 Å²	59.7	60%	0.598	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.6	-2.4	179.4	0	0	0	0	0	115.3	F203	F203-G205 PolarHBondContact O-N 2.79Å; F203-G205 VanDerWaalsContact O-N 3.13Å
206	Q	68.2	Low	78	Confident	134 Å²	134	51.8 Å²	51.8	63%	0.626	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.2	133.4	176.4	-66.6	-175.6	-15.9	0	0	110.8	S202 F203 N204	S202-Q206 CarbonylContact C-O 3.57Å; S202-Q206 WeakPolarHBondContact CA-O 3.44Å; S202-Q206 WeakPolarHBondContact CB-O 3.27Å; F203-Q206 PolarHBondContact N-O 3.12Å; F203-Q206 PolarHBondContact O-N 2.85Å; N204-Q206 VanDerWaalsContact C-N 3.29Å; N204-Q206 PolarHBondContact O-N 2.93Å
207	F	73.9	Confident	79.2	Confident	30 Å²	30	53.6 Å²	53.6	13%	0.132	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	130.5	174.6	-88.7	-115.7	0	0	0	110.6	V201 T209 H229 Q243	V201-F207 CarbonylContact O-C 3.54Å; V201-F207 WeakPolarHBondContact O-CA 3.18Å; F207-T209 HydrophobicContact CB-CG2 4.44Å; F207-T209 PolarHBondContact O-N 2.87Å; F207-T209 VanDerWaalsContact O-N 3.1Å; F207-H229 HydrophobicContact CE1-CB 4.21Å; F207-H229 AromaticContact CE1-CD2 3.63Å; F207-H229 AromaticContact CE2-CD2 3.73Å; F207-H229 AromaticContact CE2-NE2 3.64Å; F207-H229 HydrophobicContact CZ-CB 4.04Å; F207-H229 AromaticContact CZ-CD2 3.06Å; F207-H229 WeakPolarHBondContact CZ-CD2 3.31Å; F207-H229 AromaticContact CZ-CG 3.47Å; F207-H229 VanDerWaalsContact CZ-CG 3.47Å; F207-H229 AromaticContact CZ-NE2 3.43Å; F207-H229 WeakPolarHBondContact CZ-NE2 3.43Å; F207-Q243 VanDerWaalsContact CD2-CD 3.41Å; F207-Q243 VanDerWaalsContact CZ-OE1 3.23Å
208	L	79.8	Confident	79.8	Confident	23 Å²	23	50.7 Å²	50.7	12%	0.12	29%	0.288	C	S	.	.			trans	-80.8	86.3	174.2	-58.1	-177	0	0	0	108.3	V178 V201 F203 H211 C218 L226	V178-L208 HydrophobicContact CG1-CB 4.11Å; V178-L208 HydrophobicContact CG1-CD1 4.29Å; V178-L208 HydrophobicContact CG2-CB 4.11Å; V178-L208 HydrophobicContact CG2-CD1 3.75Å; V201-L208 HydrophobicContact CG1-CD1 3.99Å; V201-L208 PolarHBondContact O-N 2.97Å; F203-L208 HydrophobicContact CB-CD1 4.17Å; F203-L208 HydrophobicContact CB-CD2 4.24Å; F203-L208 HydrophobicContact CB-CG 4.27Å; L208-H211 PolarHBondContact O-CE1 2.9Å; L208-C218 HydrophobicContact CD1-CB 4.42Å; L208-C218 HydrophobicContact CD2-CB 4.11Å; L208-L226 HydrophobicContact CD1-CD2 4.14Å
209	T	72.7	Confident	80.3	Confident	77 Å²	77	51.1 Å²	51.1	47%	0.472	30%	0.297	S	S	.	.			trans	-76.2	-29	-175.5	55.9	0	0	0	0	113.5	F207 H211	F207-T209 HydrophobicContact CB-CG2 4.44Å; F207-T209 PolarHBondContact O-N 2.87Å; F207-T209 VanDerWaalsContact O-N 3.1Å; T209-H211 PolarHBondContact O-N 2.71Å
210	D	77.3	Confident	80.5	Confident	79 Å²	79	50.1 Å²	50.1	42%	0.422	29%	0.291	S	S	.	.			trans	-87.1	94.6	174.2	-175.7	-2.7	0	0	0	110	S212 R213	D210-S212 PolarHBondContact O-N 3.06Å; D210-S212 WeakPolarHBondContact OD1-CB 3.29Å; D210-S212 PolarHBondContact OD1-N 3.28Å; D210-S212 PolarHBondContact OD1-OG 3.2Å; D210-R213 HydrophobicContact CB-CB 4.23Å; D210-R213 PolarHBondContact O-N 3.26Å; D210-R213 PolarHBondContact OD1-N 2.91Å
211	H	81.5	Confident	80.7	Confident	71 Å²	71	56.4 Å²	56.4	33%	0.329	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-9	-178.8	-60.2	-69.8	0	0	0	114.2	K179 L208 T209	K179-H211 HydrophobicContact CB-CB 4.12Å; K179-H211 WeakPolarHBondContact CB-O 3.19Å; K179-H211 PolarHBondContact N-O 3.21Å; L208-H211 PolarHBondContact O-CE1 2.9Å; T209-H211 PolarHBondContact O-N 2.71Å
212	S	80.3	Confident	80.8	Confident	89 Å²	89	60.3 Å²	60.3	62%	0.622	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-17.9	178.1	75.5	0	0	0	0	113.2	T177 D210	T177-S212 WeakPolarHBondContact CG2-O 3.36Å; D210-S212 PolarHBondContact O-N 3.06Å; D210-S212 WeakPolarHBondContact OD1-CB 3.29Å; D210-S212 PolarHBondContact OD1-N 3.28Å; D210-S212 PolarHBondContact OD1-OG 3.2Å
213	R	83.3	Confident	80.8	Confident	128 Å²	128	62.4 Å²	62.4	48%	0.483	36%	0.361	S	S	.	.	S	Bend	trans	-70.3	143.3	179.5	-166.4	166.3	176.9	-177.6	-1.1	111.1	T177 V178 D210 D217	T177-R213 VanDerWaalsContact CA-O 3.31Å; T177-R213 WeakPolarHBondContact CA-O 3.42Å; V178-R213 PolarHBondContact N-O 3.31Å; V178-R213 VanDerWaalsContact N-O 3.1Å; D210-R213 HydrophobicContact CB-CB 4.23Å; D210-R213 PolarHBondContact O-N 3.26Å; D210-R213 PolarHBondContact OD1-N 2.91Å; R213-D217 HydrophobicContact CG-CB 3.52Å; R213-D217 VanDerWaalsContact CZ-O 3.25Å; R213-D217 PolarHBondContact NE-O 3.33Å; R213-D217 PolarHBondContact NH2-O 2.9Å
214	T	88.3	Confident	81	Confident	34 Å²	34	63.2 Å²	63.2	21%	0.209	37%	0.366	C	S	.	.	B	Isolated β-bridge	trans	-76.2	155.3	-180	72.6	0	0	0	0	111.4	M176 G216 D217 C218	M176-T214 CarbonylContact O-C 3.48Å; M176-T214 WeakPolarHBondContact O-CA 3.4Å; T214-G216 PolarHBondContact O-N 3.43Å; T214-D217 PolarHBondContact O-N 3.1Å; T214-D217 VanDerWaalsContact O-N 3.11Å; T214-D217 PolarHBondContact OG1-N 2.9Å; T214-D217 VanDerWaalsContact OG1-N 3.13Å; T214-D217 PolarHBondContact OG1-OD2 2.92Å; T214-C218 PolarHBondContact O-N 2.74Å; T214-C218 PolarHBondContact O-SG 2.82Å; T214-C218 VanDerWaalsContact O-SG 3.39Å
215	L	87	Confident	81.4	Confident	0 Å²	0	58 Å²	58	0%	0	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-37.3	175.6	-63.7	177.6	0	0	0	111.6	L156 L158 A172 R174 M176 V178 L181 C218 G219 V220	L156-L215 HydrophobicContact CD1-CB 4.15Å; L156-L215 HydrophobicContact CD1-CD1 4.38Å; L158-L215 HydrophobicContact CD1-CD1 4.01Å; A172-L215 HydrophobicContact CB-CD1 3.86Å; R174-L215 PolarHBondContact O-N 3.38Å; M176-L215 HydrophobicContact CB-CD1 4.33Å; M176-L215 WeakPolarHBondContact O-CG 3.33Å; M176-L215 PolarHBondContact O-N 3.14Å; V178-L215 HydrophobicContact CG2-CD2 4.41Å; L181-L215 HydrophobicContact CB-CD1 4.38Å; L181-L215 HydrophobicContact CB-CD2 4.4Å; L181-L215 HydrophobicContact CD1-CD1 4.38Å; L181-L215 HydrophobicContact CD2-CD1 4.06Å; L181-L215 HydrophobicContact CD2-CD2 3.68Å; L215-C218 PolarHBondContact O-N 3.49Å; L215-G219 PolarHBondContact O-N 2.73Å; L215-V220 HydrophobicContact CB-CB 4.21Å; L215-V220 HydrophobicContact CB-CG2 4.49Å; L215-V220 HydrophobicContact CD2-CG2 4.42Å; L215-V220 WeakPolarHBondContact O-CB 3.47Å; L215-V220 PolarHBondContact O-N 2.81Å
216	G	84	Confident	82.3	Confident	21 Å²	21	55.2 Å²	55.2	22%	0.216	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-46.3	173.2	0	0	0	0	0	112.9	R174 T214 C218 G219	R174-G216 PolarHBondContact O-N 3.22Å; T214-G216 PolarHBondContact O-N 3.43Å; G216-C218 VanDerWaalsContact C-N 3.26Å; G216-C218 PolarHBondContact O-N 3.33Å; G216-G219 PolarHBondContact O-N 2.92Å
217	D	84.8	Confident	83.1	Confident	95 Å²	95	51 Å²	51	51%	0.508	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-28.3	178.9	-60.8	-36.6	0	0	0	112.2	R213 T214 G219	R213-D217 HydrophobicContact CG-CB 3.52Å; R213-D217 VanDerWaalsContact CZ-O 3.25Å; R213-D217 PolarHBondContact NE-O 3.33Å; R213-D217 PolarHBondContact NH2-O 2.9Å; T214-D217 PolarHBondContact O-N 3.1Å; T214-D217 VanDerWaalsContact O-N 3.11Å; T214-D217 PolarHBondContact OG1-N 2.9Å; T214-D217 VanDerWaalsContact OG1-N 3.13Å; T214-D217 PolarHBondContact OG1-OD2 2.92Å; D217-G219 PolarHBondContact O-N 3.04Å
218	C	81.6	Confident	83.8	Confident	24 Å²	24	49.5 Å²	49.5	16%	0.162	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-3	172.7	-67.5	0	0	0	0	113.3	L208 T214 L215 G216 V220	L208-C218 HydrophobicContact CD1-CB 4.42Å; L208-C218 HydrophobicContact CD2-CB 4.11Å; T214-C218 PolarHBondContact O-N 2.74Å; T214-C218 PolarHBondContact O-SG 2.82Å; T214-C218 VanDerWaalsContact O-SG 3.39Å; L215-C218 PolarHBondContact O-N 3.49Å; G216-C218 VanDerWaalsContact C-N 3.26Å; G216-C218 PolarHBondContact O-N 3.33Å; C218-V220 HydrophobicContact CB-CG2 4.19Å
219	G	83.9	Confident	83.9	Confident	38 Å²	38	51.1 Å²	51.1	39%	0.392	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.2	12.4	178.9	0	0	0	0	0	114.8	L215 G216 D217	L215-G219 PolarHBondContact O-N 2.73Å; G216-G219 PolarHBondContact O-N 2.92Å; D217-G219 PolarHBondContact O-N 3.04Å
220	V	85.5	Confident	84.3	Confident	0 Å²	0	48 Å²	48	0%	0	28%	0.278	C	S	.	.			trans	-71.3	132	178.9	-176.4	0	0	0	0	109.9	L156 L158 F203 L215 C218 D224 L226	L156-V220 HydrophobicContact CD1-CG1 4.49Å; L158-V220 HydrophobicContact CD1-CG1 4.32Å; L158-V220 HydrophobicContact CD2-CG1 3.52Å; F203-V220 HydrophobicContact CD1-CG2 3.91Å; F203-V220 HydrophobicContact CD2-CG2 4.37Å; F203-V220 HydrophobicContact CE1-CG2 3.97Å; F203-V220 HydrophobicContact CE2-CG2 4.45Å; F203-V220 HydrophobicContact CG-CG2 4.12Å; F203-V220 HydrophobicContact CZ-CG2 4.25Å; L215-V220 HydrophobicContact CB-CB 4.21Å; L215-V220 HydrophobicContact CB-CG2 4.49Å; L215-V220 HydrophobicContact CD2-CG2 4.42Å; L215-V220 WeakPolarHBondContact O-CB 3.47Å; L215-V220 PolarHBondContact O-N 2.81Å; C218-V220 HydrophobicContact CB-CG2 4.19Å; V220-D224 HydrophobicContact CG1-CB 4.13Å; V220-L226 HydrophobicContact CG1-CD1 3.97Å; V220-L226 HydrophobicContact CG2-CD2 4.44Å
221	K	85.6	Confident	84	Confident	135 Å²	135	45.2 Å²	45.2	59%	0.587	26%	0.263	S	S	*	.			trans	-118.5	169.2	-178.6	-59.7	-177.5	-176.6	-177.8	0	111.1	L158 G223 D224	L158-K221 WeakPolarHBondContact CD2-O 3.47Å; K221-G223 PolarHBondContact O-N 2.92Å; K221-D224 WeakPolarHBondContact CA-OD2 3.17Å; K221-D224 WeakPolarHBondContact CB-OD2 3.33Å; K221-D224 PolarHBondContact N-OD2 3.33Å; K221-D224 WeakPolarHBondContact O-CB 3.32Å; K221-D224 PolarHBondContact O-N 2.99Å
222	N	86.8	Confident	83.4	Confident	84 Å²	84	43.7 Å²	43.7	45%	0.449	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	134	174.8	-168.7	59.2	0	0	0	110.1	L156 Q157	L156-N222 HydrophobicContact CD2-CB 4.37Å; Q157-N222 WeakPolarHBondContact CB-OD1 3.26Å; Q157-N222 PolarHBondContact N-OD1 3.02Å
223	G	81.2	Confident	82.8	Confident	51 Å²	51	43 Å²	43	53%	0.526	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.9	0.7	-176.6	0	0	0	0	0	115.1	Q157 K221	Q157-G223 WeakPolarHBondContact O-CA 3.48Å; Q157-G223 PolarHBondContact O-N 3.02Å; K221-G223 PolarHBondContact O-N 2.92Å
224	D	88.7	Confident	81.7	Confident	34 Å²	34	44 Å²	44	18%	0.182	26%	0.262	C	S	.	.			trans	-73.5	157	177.6	-82.8	-29.7	0	0	0	112.6	L158 T159 F203 V220 K221	L158-D224 WeakPolarHBondContact CA-O 3.49Å; L158-D224 HydrophobicContact CD2-CB 4.29Å; T159-D224 PolarHBondContact N-O 3.2Å; F203-D224 HydrophobicContact CE2-CB 3.75Å; F203-D224 HydrophobicContact CZ-CB 4.36Å; F203-D224 VanDerWaalsContact CZ-OD2 3.27Å; F203-D224 WeakPolarHBondContact CZ-OD2 3.19Å; V220-D224 HydrophobicContact CG1-CB 4.13Å; K221-D224 WeakPolarHBondContact CA-OD2 3.17Å; K221-D224 WeakPolarHBondContact CB-OD2 3.33Å; K221-D224 PolarHBondContact N-OD2 3.33Å; K221-D224 WeakPolarHBondContact O-CB 3.32Å; K221-D224 PolarHBondContact O-N 2.99Å
225	A	86.9	Confident	80.7	Confident	13 Å²	13	43.8 Å²	43.8	11%	0.107	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	136.4	172.6	0	0	0	0	0	111.2	K72 T159	K72-A225 HydrophobicContact CD-CB 4.06Å; T159-A225 HydrophobicContact CG2-CB 4.46Å; T159-A225 CarbonylContact O-C 3.57Å; T159-A225 WeakPolarHBondContact O-CA 3.27Å; T159-A225 WeakPolarHBondContact O-CB 3.37Å
226	L	87.3	Confident	79.5	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	136.4	174.2	-67.6	88	0	0	0	109.2	L158 T159 I160 V161 L181 V201 S202 F203 L208 V220 F228	L158-L226 HydrophobicContact CB-CD1 4.32Å; L158-L226 HydrophobicContact CD1-CD1 3.98Å; L158-L226 HydrophobicContact CD2-CD1 4.13Å; L158-L226 HydrophobicContact CG-CD1 4.38Å; T159-L226 PolarHBondContact O-N 3.26Å; I160-L226 WeakPolarHBondContact CA-O 3.45Å; I160-L226 HydrophobicContact CD1-CB 4.12Å; I160-L226 HydrophobicContact CD1-CD1 4.44Å; V161-L226 PolarHBondContact N-O 3.44Å; L181-L226 HydrophobicContact CD2-CD2 3.94Å; V201-L226 HydrophobicContact CG1-CB 4.41Å; V201-L226 HydrophobicContact CG1-CD2 3.79Å; S202-L226 WeakPolarHBondContact O-CA 3.41Å; F203-L226 HydrophobicContact CB-CG 4.44Å; F203-L226 HydrophobicContact CD2-CG 4.3Å; L208-L226 HydrophobicContact CD1-CD2 4.14Å; V220-L226 HydrophobicContact CG1-CD1 3.97Å; V220-L226 HydrophobicContact CG2-CD2 4.44Å; L226-F228 HydrophobicContact CB-CD2 4.43Å; L226-F228 HydrophobicContact CB-CE2 4.15Å
227	S	85.3	Confident	78.3	Confident	44 Å²	44	51.5 Å²	51.5	31%	0.308	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	124.1	176	-55.5	0	0	0	0	110.4	V161 S202 H229	V161-S227 CarbonylContact O-C 3.51Å; V161-S227 VanDerWaalsContact O-CA 3.25Å; V161-S227 WeakPolarHBondContact O-CA 3.47Å; S202-S227 PolarHBondContact N-O 2.86Å; S202-S227 PolarHBondContact O-N 3.29Å; S202-S227 WeakPolarHBondContact OG-CB 3.29Å; S202-S227 PolarHBondContact OG-O 2.92Å; S202-S227 VanDerWaalsContact OG-O 3.06Å; S227-H229 PolarHBondContact O-CD2 2.96Å
228	F	88.4	Confident	77.3	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	124.8	178.1	-81.5	-137.7	0	0	0	108.2	I160 V161 V162 N163 L181 T182 C185 L192 V199 G200 V201 L226	I160-F228 HydrophobicContact CD1-CE2 3.88Å; I160-F228 HydrophobicContact CD1-CZ 4.35Å; I160-F228 HydrophobicContact CG2-CB 4.44Å; I160-F228 HydrophobicContact CG2-CD1 4.27Å; I160-F228 HydrophobicContact CG2-CD2 3.67Å; I160-F228 HydrophobicContact CG2-CE1 4.47Å; I160-F228 HydrophobicContact CG2-CE2 3.92Å; I160-F228 HydrophobicContact CG2-CG 3.88Å; I160-F228 HydrophobicContact CG2-CZ 4.32Å; V161-F228 PolarHBondContact O-N 3.27Å; V162-F228 CarbonylContact C-O 3.51Å; V162-F228 WeakPolarHBondContact CA-O 3.36Å; V162-F228 HydrophobicContact CG2-CB 4.12Å; N163-F228 PolarHBondContact N-O 3.04Å; L181-F228 HydrophobicContact CD2-CE2 4.4Å; L181-F228 HydrophobicContact CD2-CZ 4.21Å; L181-F228 HydrophobicContact CG-CZ 4.18Å; T182-F228 HydrophobicContact CG2-CE1 4.18Å; C185-F228 HydrophobicContact CB-CD1 4.44Å; C185-F228 HydrophobicContact CB-CE1 3.66Å; C185-F228 HydrophobicContact CB-CZ 4.16Å; L192-F228 HydrophobicContact CD1-CD1 3.96Å; L192-F228 HydrophobicContact CD1-CE1 4.31Å; L192-F228 HydrophobicContact CD2-CB 4.24Å; L192-F228 HydrophobicContact CD2-CD1 3.79Å; V199-F228 HydrophobicContact CG1-CB 4.14Å; V199-F228 HydrophobicContact CG1-CD1 3.55Å; V199-F228 HydrophobicContact CG1-CE1 4.27Å; V199-F228 HydrophobicContact CG1-CG 4.11Å; G200-F228 CarbonylContact O-C 3.51Å; G200-F228 WeakPolarHBondContact O-CA 3.29Å; V201-F228 HydrophobicContact CB-CE2 4.44Å; V201-F228 HydrophobicContact CG1-CD2 4.11Å; V201-F228 HydrophobicContact CG1-CE2 3.75Å; V201-F228 HydrophobicContact CG1-CZ 4.45Å; V201-F228 HydrophobicContact CG2-CD1 4.45Å; V201-F228 HydrophobicContact CG2-CD2 4.16Å; V201-F228 HydrophobicContact CG2-CE1 4.22Å; V201-F228 HydrophobicContact CG2-CE2 3.91Å; V201-F228 HydrophobicContact CG2-CG 4.42Å; V201-F228 HydrophobicContact CG2-CZ 3.93Å; L226-F228 HydrophobicContact CB-CD2 4.43Å; L226-F228 HydrophobicContact CB-CE2 4.15Å
229	H	81.3	Confident	76.4	Confident	56 Å²	56	47.3 Å²	47.3	26%	0.259	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	105.7	-176.8	-57.9	-91.1	0	0	0	107.9	N163 V199 G200 S202 F207 S227	N163-H229 WeakPolarHBondContact OD1-CA 3.27Å; V199-H229 WeakPolarHBondContact CA-O 3.38Å; G200-H229 PolarHBondContact N-O 2.9Å; G200-H229 PolarHBondContact O-N 2.9Å; S202-H229 PolarHBondContact OG-CD2 3.46Å; S202-H229 PolarHBondContact OG-NE2 3.21Å; F207-H229 HydrophobicContact CE1-CB 4.21Å; F207-H229 AromaticContact CE1-CD2 3.63Å; F207-H229 AromaticContact CE2-CD2 3.73Å; F207-H229 AromaticContact CE2-NE2 3.64Å; F207-H229 HydrophobicContact CZ-CB 4.04Å; F207-H229 AromaticContact CZ-CD2 3.06Å; F207-H229 WeakPolarHBondContact CZ-CD2 3.31Å; F207-H229 AromaticContact CZ-CG 3.47Å; F207-H229 VanDerWaalsContact CZ-CG 3.47Å; F207-H229 AromaticContact CZ-NE2 3.43Å; F207-H229 WeakPolarHBondContact CZ-NE2 3.43Å; S227-H229 PolarHBondContact O-CD2 2.96Å
230	V	80.7	Confident	75.4	Confident	11 Å²	11	47.1 Å²	47.1	7%	0.067	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	111.6	176.4	-175.7	0	0	0	0	107.7	V162 N163 T191 L192 F197 V199	V162-V230 HydrophobicContact CG1-CG2 3.69Å; N163-V230 PolarHBondContact ND2-O 3Å; N163-V230 PolarHBondContact OD1-N 3.07Å; T191-V230 HydrophobicContact CG2-CB 4.37Å; T191-V230 HydrophobicContact CG2-CG1 4.48Å; T191-V230 HydrophobicContact CG2-CG2 4.16Å; T191-V230 WeakPolarHBondContact O-CG1 3.34Å; L192-V230 HydrophobicContact CD2-CG2 3.54Å; F197-V230 HydrophobicContact CB-CG1 3.58Å; F197-V230 HydrophobicContact CD1-CG1 4.05Å; F197-V230 HydrophobicContact CG-CG1 4.03Å; V199-V230 HydrophobicContact CG2-CG2 4.38Å
231	V	71.3	Confident	74.3	Confident	21 Å²	21	48.7 Å²	48.7	13%	0.127	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	150.2	-174.8	-62.1	0	0	0	0	109.8	F197 S198 T233 L236 I239	F197-V231 CarbonylContact C-O 3.15Å; F197-V231 VanDerWaalsContact CA-O 3.3Å; F197-V231 WeakPolarHBondContact CA-O 3.45Å; F197-V231 VanDerWaalsContact CD1-C 3.5Å; S198-V231 PolarHBondContact N-O 2.89Å; S198-V231 PolarHBondContact O-N 3.25Å; V231-T233 PolarHBondContact O-N 3.39Å; V231-L236 HydrophobicContact CG2-CB 4.11Å; V231-L236 HydrophobicContact CG2-CD1 3.3Å; V231-L236 HydrophobicContact CG2-CG 4.31Å; V231-I239 HydrophobicContact CB-CD1 3.86Å; V231-I239 HydrophobicContact CG1-CD1 3.61Å; V231-I239 HydrophobicContact CG2-CD1 4.08Å
232	P	69.9	Low	73.3	Confident	40 Å²	40	43 Å²	43	26%	0.26	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-50.6	135.1	172.8	-26.5	35.1	0	0	0	110	F197 E234 D235 L236	F197-P232 HydrophobicContact CD1-CG 4.16Å; F197-P232 HydrophobicContact CE1-CG 3.8Å; P232-E234 HydrophobicContact CB-CG 3.92Å; P232-E234 PolarHBondContact O-N 3.1Å; P232-D235 HydrophobicContact CB-CB 4.44Å; P232-D235 WeakPolarHBondContact CG-OD2 3.41Å; P232-D235 WeakPolarHBondContact O-CA 3.33Å; P232-D235 WeakPolarHBondContact O-CB 3.31Å; P232-D235 PolarHBondContact O-N 3.43Å; P232-L236 PolarHBondContact O-N 2.87Å
233	T	66.5	Low	72	Confident	74 Å²	74	41.4 Å²	41.4	45%	0.454	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-32	-173.6	-59.8	0	0	0	0	111.9	G196 S198 V231 D235	G196-T233 WeakPolarHBondContact O-CB 3.32Å; G196-T233 PolarHBondContact O-N 2.76Å; G196-T233 PolarHBondContact O-OG1 2.8Å; S198-T233 WeakPolarHBondContact OG-CB 3.42Å; S198-T233 WeakPolarHBondContact OG-CG2 3.37Å; S198-T233 PolarHBondContact OG-OG1 3.29Å; V231-T233 PolarHBondContact O-N 3.39Å; T233-D235 VanDerWaalsContact C-N 3.3Å; T233-D235 PolarHBondContact O-N 2.84Å
234	E	61	Low	70.8	Confident	148 Å²	148	43.9 Å²	43.9	69%	0.692	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-20	175.3	57.4	178.8	-178.5	0	0	114.8	P232 K275	P232-E234 HydrophobicContact CB-CG 3.92Å; P232-E234 PolarHBondContact O-N 3.1Å; E234-K275 VanDerWaalsContact C-NZ 3.34Å; E234-K275 WeakPolarHBondContact O-CE 3.34Å; E234-K275 PolarHBondContact O-NZ 2.85Å
235	D	66.1	Low	69.5	Low	30 Å²	30	43 Å²	43	16%	0.16	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93	-21.7	179.6	-70.9	-29.2	0	0	0	113	P232 T233 E237 A238 I239 K275	P232-D235 HydrophobicContact CB-CB 4.44Å; P232-D235 WeakPolarHBondContact CG-OD2 3.41Å; P232-D235 WeakPolarHBondContact O-CA 3.33Å; P232-D235 WeakPolarHBondContact O-CB 3.31Å; P232-D235 PolarHBondContact O-N 3.43Å; T233-D235 VanDerWaalsContact C-N 3.3Å; T233-D235 PolarHBondContact O-N 2.84Å; D235-E237 VanDerWaalsContact C-N 3.33Å; D235-E237 PolarHBondContact O-N 3.06Å; D235-A238 PolarHBondContact O-N 2.67Å; D235-A238 VanDerWaalsContact O-N 3.08Å; D235-I239 HydrophobicContact CB-CD1 3.97Å; D235-I239 WeakPolarHBondContact O-CG1 3.18Å; D235-I239 PolarHBondContact O-N 3.09Å; D235-K275 WeakPolarHBondContact OD1-CE 3.32Å; D235-K275 IonicContact OD1-NZ 3.11Å; D235-K275 PolarHBondContact OD1-NZ 3.24Å
236	L	63.1	Low	68.2	Low	32 Å²	32	46 Å²	46	17%	0.168	25%	0.246	C	C	.	.	H	α-helix	trans	-57.7	-42.6	-169.4	-166.3	77.1	0	0	0	112.7	V231 P232 I239 N240	V231-L236 HydrophobicContact CG2-CB 4.11Å; V231-L236 HydrophobicContact CG2-CD1 3.3Å; V231-L236 HydrophobicContact CG2-CG 4.31Å; P232-L236 PolarHBondContact O-N 2.87Å; L236-I239 PolarHBondContact O-N 3.32Å; L236-N240 WeakPolarHBondContact O-CB 3.26Å; L236-N240 VanDerWaalsContact O-CG 3.25Å; L236-N240 PolarHBondContact O-N 2.96Å; L236-N240 PolarHBondContact O-ND2 2.88Å
237	E	58.2	Low	66.6	Low	152 Å²	152	50.4 Å²	50.4	71%	0.71	27%	0.27	S	S	*	.	H	α-helix	trans	-63.4	-44.3	177.4	-68.7	-171.9	167.1	0	0	112	D235 I239 N240 V241	D235-E237 VanDerWaalsContact C-N 3.33Å; D235-E237 PolarHBondContact O-N 3.06Å; E237-I239 VanDerWaalsContact C-N 3.34Å; E237-I239 PolarHBondContact O-N 3.18Å; E237-N240 PolarHBondContact O-N 2.9Å; E237-V241 WeakPolarHBondContact O-CB 3.26Å; E237-V241 VanDerWaalsContact O-CG2 3.3Å; E237-V241 WeakPolarHBondContact O-CG2 3.29Å; E237-V241 PolarHBondContact O-N 3.08Å
238	A	63.8	Low	65.3	Low	3 Å²	3	51.7 Å²	51.7	3%	0.025	27%	0.273	C	S	.	.	H	α-helix	trans	-64.6	-40.9	179.2	0	0	0	0	0	111.2	D235 V241 V242 L271 V274 K275	D235-A238 PolarHBondContact O-N 2.67Å; D235-A238 VanDerWaalsContact O-N 3.08Å; A238-V241 PolarHBondContact O-N 3.32Å; A238-V242 WeakPolarHBondContact O-CB 3.34Å; A238-V242 WeakPolarHBondContact O-CG2 3.49Å; A238-V242 PolarHBondContact O-N 3.17Å; A238-L271 HydrophobicContact CB-CD2 4.41Å; A238-V274 HydrophobicContact CB-CG1 3.98Å; A238-K275 HydrophobicContact CB-CG 3.97Å
239	I	63.8	Low	63.7	Low	27 Å²	27	55 Å²	55	14%	0.138	30%	0.295	C	S	.	.	H	α-helix	trans	-65.8	-46.7	178.6	-67.6	172.1	0	0	0	111.1	V231 D235 L236 E237 V241 V242 Q243 L271	V231-I239 HydrophobicContact CB-CD1 3.86Å; V231-I239 HydrophobicContact CG1-CD1 3.61Å; V231-I239 HydrophobicContact CG2-CD1 4.08Å; D235-I239 HydrophobicContact CB-CD1 3.97Å; D235-I239 WeakPolarHBondContact O-CG1 3.18Å; D235-I239 PolarHBondContact O-N 3.09Å; L236-I239 PolarHBondContact O-N 3.32Å; E237-I239 VanDerWaalsContact C-N 3.34Å; E237-I239 PolarHBondContact O-N 3.18Å; I239-V241 VanDerWaalsContact C-N 3.28Å; I239-V241 PolarHBondContact O-N 2.84Å; I239-V242 PolarHBondContact O-N 3.14Å; I239-Q243 WeakPolarHBondContact O-CB 3.26Å; I239-Q243 WeakPolarHBondContact O-CG 2.73Å; I239-Q243 PolarHBondContact O-N 2.9Å; I239-L271 HydrophobicContact CD1-CD1 4.32Å; I239-L271 HydrophobicContact CG1-CD1 4.21Å; I239-L271 HydrophobicContact CG1-CD2 3.8Å
240	N	61.1	Low	62.5	Low	35 Å²	35	57 Å²	57	19%	0.187	31%	0.307	C	S	.	.	H	α-helix	trans	-58.3	-42.9	176.9	-76.6	-20.8	0	0	0	111.1	L236 E237 Q243 Q244	L236-N240 WeakPolarHBondContact O-CB 3.26Å; L236-N240 VanDerWaalsContact O-CG 3.25Å; L236-N240 PolarHBondContact O-N 2.96Å; L236-N240 PolarHBondContact O-ND2 2.88Å; E237-N240 PolarHBondContact O-N 2.9Å; N240-Q243 PolarHBondContact O-N 3.3Å; N240-Q244 WeakPolarHBondContact O-CB 3.38Å; N240-Q244 VanDerWaalsContact O-CG 3.29Å; N240-Q244 WeakPolarHBondContact O-CG 3.48Å; N240-Q244 PolarHBondContact O-N 3.09Å
241	V	62.7	Low	61.3	Low	33 Å²	33	57.6 Å²	57.6	20%	0.2	31%	0.314	C	S	.	.	H	α-helix	trans	-69	-44.8	178.7	171.6	0	0	0	0	111.9	E237 A238 I239 Q243 Q244 I245 L278	E237-V241 WeakPolarHBondContact O-CB 3.26Å; E237-V241 VanDerWaalsContact O-CG2 3.3Å; E237-V241 WeakPolarHBondContact O-CG2 3.29Å; E237-V241 PolarHBondContact O-N 3.08Å; A238-V241 PolarHBondContact O-N 3.32Å; I239-V241 VanDerWaalsContact C-N 3.28Å; I239-V241 PolarHBondContact O-N 2.84Å; V241-Q243 PolarHBondContact O-N 3.44Å; V241-Q244 PolarHBondContact O-N 2.79Å; V241-I245 HydrophobicContact CG1-CD1 3.38Å; V241-I245 HydrophobicContact CG1-CG1 4.29Å; V241-I245 WeakPolarHBondContact O-CB 3.17Å; V241-I245 WeakPolarHBondContact O-CD1 3.31Å; V241-I245 VanDerWaalsContact O-CG1 3.26Å; V241-I245 WeakPolarHBondContact O-CG1 3.46Å; V241-I245 PolarHBondContact O-N 3.11Å; V241-L278 HydrophobicContact CB-CD1 4.44Å; V241-L278 HydrophobicContact CB-CD2 4.18Å; V241-L278 HydrophobicContact CG1-CD1 3.65Å; V241-L278 HydrophobicContact CG1-CD2 4.26Å; V241-L278 HydrophobicContact CG2-CD1 4.42Å; V241-L278 HydrophobicContact CG2-CD2 3.97Å
242	V	65	Low	60.5	Low	16 Å²	16	57.4 Å²	57.4	10%	0.097	31%	0.314	C	S	.	.	H	α-helix	trans	-54.1	-44.1	174.5	163.3	0	0	0	0	110.6	A238 I239 S246 I266 V274	A238-V242 WeakPolarHBondContact O-CB 3.34Å; A238-V242 WeakPolarHBondContact O-CG2 3.49Å; A238-V242 PolarHBondContact O-N 3.17Å; I239-V242 PolarHBondContact O-N 3.14Å; V242-S246 VanDerWaalsContact O-CB 3.27Å; V242-S246 WeakPolarHBondContact O-CB 3.42Å; V242-S246 PolarHBondContact O-N 2.77Å; V242-S246 PolarHBondContact O-OG 3.11Å; V242-I266 HydrophobicContact CG1-CG2 4.17Å; V242-I266 HydrophobicContact CG2-CG1 4.05Å; V242-I266 HydrophobicContact CG2-CG2 4.46Å; V242-V274 HydrophobicContact CG2-CG1 4Å; V242-V274 HydrophobicContact CG2-CG2 3.96Å
243	Q	59.3	Low	59.8	Low	49 Å²	49	57.4 Å²	57.4	23%	0.229	32%	0.318	C	S	.	.	H	α-helix	trans	-73.5	-41.7	-179.8	-76.4	170.2	-21.5	0	0	113.3	F207 I239 N240 V241 I245 S246 N247	F207-Q243 VanDerWaalsContact CD2-CD 3.41Å; F207-Q243 VanDerWaalsContact CZ-OE1 3.23Å; I239-Q243 WeakPolarHBondContact O-CB 3.26Å; I239-Q243 WeakPolarHBondContact O-CG 2.73Å; I239-Q243 PolarHBondContact O-N 2.9Å; N240-Q243 PolarHBondContact O-N 3.3Å; V241-Q243 PolarHBondContact O-N 3.44Å; Q243-I245 VanDerWaalsContact C-N 3.28Å; Q243-I245 PolarHBondContact O-N 3.39Å; Q243-S246 PolarHBondContact O-N 3.42Å; Q243-N247 VanDerWaalsContact O-CB 3.27Å; Q243-N247 WeakPolarHBondContact O-CB 3.27Å; Q243-N247 PolarHBondContact O-N 2.85Å; Q243-N247 PolarHBondContact O-ND2 3.11Å
244	Q	57.1	Low	59.5	Low	104 Å²	104	54.6 Å²	54.6	49%	0.486	30%	0.302	S	S	.	.	H	α-helix	trans	-57.6	-44.7	174	-79.5	178.9	-14	0	0	111	N240 V241 N247 D248	N240-Q244 WeakPolarHBondContact O-CB 3.38Å; N240-Q244 VanDerWaalsContact O-CG 3.29Å; N240-Q244 WeakPolarHBondContact O-CG 3.48Å; N240-Q244 PolarHBondContact O-N 3.09Å; V241-Q244 PolarHBondContact O-N 2.79Å; Q244-N247 PolarHBondContact O-N 3.34Å; Q244-D248 WeakPolarHBondContact O-CB 3.1Å; Q244-D248 PolarHBondContact O-N 2.97Å
245	I	60.7	Low	59.4	Low	16 Å²	16	48.6 Å²	48.6	8%	0.082	27%	0.274	C	S	.	.	H	α-helix	trans	-69.9	-36.4	178.7	-65.5	160.7	0	0	0	111.4	V241 Q243 N247 A251 A252 I255 I266	V241-I245 HydrophobicContact CG1-CD1 3.38Å; V241-I245 HydrophobicContact CG1-CG1 4.29Å; V241-I245 WeakPolarHBondContact O-CB 3.17Å; V241-I245 WeakPolarHBondContact O-CD1 3.31Å; V241-I245 VanDerWaalsContact O-CG1 3.26Å; V241-I245 WeakPolarHBondContact O-CG1 3.46Å; V241-I245 PolarHBondContact O-N 3.11Å; Q243-I245 VanDerWaalsContact C-N 3.28Å; Q243-I245 PolarHBondContact O-N 3.39Å; I245-N247 VanDerWaalsContact C-N 3.29Å; I245-N247 PolarHBondContact O-N 2.84Å; I245-A251 HydrophobicContact CG1-CB 4.39Å; I245-A252 HydrophobicContact CG2-CB 4.22Å; I245-I255 HydrophobicContact CB-CD1 4.35Å; I245-I255 HydrophobicContact CD1-CD1 3.26Å; I245-I255 HydrophobicContact CG1-CD1 3.62Å; I245-I255 HydrophobicContact CG2-CD1 3.77Å; I245-I266 HydrophobicContact CB-CD1 4.3Å; I245-I266 HydrophobicContact CD1-CD1 3.41Å; I245-I266 VanDerWaalsContact CD1-CD1 3.41Å; I245-I266 HydrophobicContact CG1-CD1 4.45Å; I245-I266 HydrophobicContact CG2-CD1 4.02Å; I245-I266 HydrophobicContact CG2-CG2 4.5Å
246	S	59.7	Low	59.1	Low	74 Å²	74	52.1 Å²	52.1	52%	0.517	29%	0.292	S	S	.	.	H	α-helix	trans	-67.5	-31.5	176.2	-60.9	0	0	0	0	112.4	V242 Q243	V242-S246 VanDerWaalsContact O-CB 3.27Å; V242-S246 WeakPolarHBondContact O-CB 3.42Å; V242-S246 PolarHBondContact O-N 2.77Å; V242-S246 PolarHBondContact O-OG 3.11Å; Q243-S246 PolarHBondContact O-N 3.42Å
247	N	53.3	Low	58.9	Low	93 Å²	93	55.4 Å²	55.4	50%	0.497	32%	0.318	S	S	.	.	H	α-helix	trans	-91.6	-17.8	-178	-69.4	-17.2	0	0	0	113.5	Q243 Q244 I245 P249	Q243-N247 VanDerWaalsContact O-CB 3.27Å; Q243-N247 WeakPolarHBondContact O-CB 3.27Å; Q243-N247 PolarHBondContact O-N 2.85Å; Q243-N247 PolarHBondContact O-ND2 3.11Å; Q244-N247 PolarHBondContact O-N 3.34Å; I245-N247 VanDerWaalsContact C-N 3.29Å; I245-N247 PolarHBondContact O-N 2.84Å; N247-P249 WeakPolarHBondContact O-CD 3.45Å
248	D	57.8	Low	59.2	Low	72 Å²	72	52 Å²	52	39%	0.385	31%	0.31	S	S	.	.			trans	-111.2	101.7	175.5	-177.3	0	0	0	0	111.3	Q244 N250 A251 A252	Q244-D248 WeakPolarHBondContact O-CB 3.1Å; Q244-D248 PolarHBondContact O-N 2.97Å; D248-N250 PolarHBondContact O-N 3.43Å; D248-N250 VanDerWaalsContact O-N 3.14Å; D248-N250 WeakPolarHBondContact OD1-CB 3.49Å; D248-N250 PolarHBondContact OD1-N 3Å; D248-A251 HydrophobicContact CB-CB 3.8Å; D248-A251 WeakPolarHBondContact O-CB 3.48Å; D248-A251 PolarHBondContact O-N 3.08Å; D248-A251 PolarHBondContact OD1-N 3.13Å; D248-A252 PolarHBondContact O-N 3.06Å
249	P	55.1	Low	59.5	Low	69 Å²	69	53.1 Å²	53.1	45%	0.448	32%	0.316	S	S	.	.	H	α-helix	trans	-58.5	-27.1	177.8	-20.8	30.8	0	0	0	113.5	N247 A253	N247-P249 WeakPolarHBondContact O-CD 3.45Å; P249-A253 WeakPolarHBondContact O-CB 3.38Å; P249-A253 PolarHBondContact O-N 3.23Å
250	N	56.1	Low	60.1	Low	97 Å²	97	56 Å²	56	52%	0.519	34%	0.336	S	S	.	.	H	α-helix	trans	-77.3	-33.4	178.3	-65.4	-45.5	0	0	0	111.6	D248 A253 A254	D248-N250 PolarHBondContact O-N 3.43Å; D248-N250 VanDerWaalsContact O-N 3.14Å; D248-N250 WeakPolarHBondContact OD1-CB 3.49Å; D248-N250 PolarHBondContact OD1-N 3Å; N250-A253 PolarHBondContact O-N 3.01Å; N250-A254 WeakPolarHBondContact O-CB 3.38Å; N250-A254 PolarHBondContact O-N 3.2Å
251	A	56.4	Low	60.9	Low	25 Å²	25	60.2 Å²	60.2	21%	0.207	36%	0.355	C	S	.	.	H	α-helix	trans	-66.3	-42.9	171	0	0	0	0	0	111.1	I245 D248 A253 A254 I255	I245-A251 HydrophobicContact CG1-CB 4.39Å; D248-A251 HydrophobicContact CB-CB 3.8Å; D248-A251 WeakPolarHBondContact O-CB 3.48Å; D248-A251 PolarHBondContact O-N 3.08Å; D248-A251 PolarHBondContact OD1-N 3.13Å; A251-A253 PolarHBondContact O-N 3.48Å; A251-A254 WeakPolarHBondContact O-CB 3.32Å; A251-A254 PolarHBondContact O-N 3.02Å; A251-I255 WeakPolarHBondContact O-CG1 3.35Å; A251-I255 PolarHBondContact O-N 3.39Å; A251-I255 VanDerWaalsContact O-N 3.11Å
252	A	54.3	Low	61.4	Low	17 Å²	17	58.8 Å²	58.8	14%	0.14	35%	0.346	C	S	.	.	H	α-helix	trans	-60.7	-45.2	173.6	0	0	0	0	0	112	I245 D248 A254 I255 I256	I245-A252 HydrophobicContact CG2-CB 4.22Å; D248-A252 PolarHBondContact O-N 3.06Å; A252-A254 VanDerWaalsContact C-N 3.32Å; A252-A254 PolarHBondContact O-N 2.84Å; A252-I255 PolarHBondContact O-N 3.17Å; A252-I255 VanDerWaalsContact O-N 3.16Å; A252-I256 WeakPolarHBondContact O-CG1 3.4Å; A252-I256 PolarHBondContact O-N 3.28Å
253	A	55	Low	61.6	Low	40 Å²	40	60 Å²	60	33%	0.331	35%	0.352	S	S	.	.	H	α-helix	trans	-62.8	-35.8	176.8	0	0	0	0	0	113.3	P249 N250 A251	P249-A253 WeakPolarHBondContact O-CB 3.38Å; P249-A253 PolarHBondContact O-N 3.23Å; N250-A253 PolarHBondContact O-N 3.01Å; A251-A253 PolarHBondContact O-N 3.48Å
254	A	59.5	Low	62.4	Low	15 Å²	15	61.7 Å²	61.7	12%	0.124	36%	0.36	C	S	.	.	H	α-helix	trans	-61.3	-45.1	173	0	0	0	0	0	111.6	N250 A251 A252 S257 S258	N250-A254 WeakPolarHBondContact O-CB 3.38Å; N250-A254 PolarHBondContact O-N 3.2Å; A251-A254 WeakPolarHBondContact O-CB 3.32Å; A251-A254 PolarHBondContact O-N 3.02Å; A252-A254 VanDerWaalsContact C-N 3.32Å; A252-A254 PolarHBondContact O-N 2.84Å; A254-S257 PolarHBondContact O-N 3Å; A254-S257 PolarHBondContact O-OG 3.01Å; A254-S258 PolarHBondContact O-N 3.5Å; A254-S258 PolarHBondContact O-OG 3.48Å; A254-S258 VanDerWaalsContact O-OG 3.06Å
255	I	60.2	Low	63.3	Low	22 Å²	22	56.8 Å²	56.8	11%	0.113	34%	0.337	C	S	.	.	H	α-helix	trans	-72.6	-35.2	-176.6	-64.9	169.9	0	0	0	111.5	I245 A251 A252 S257 S258 N259 L262 L263 I266	I245-I255 HydrophobicContact CB-CD1 4.35Å; I245-I255 HydrophobicContact CD1-CD1 3.26Å; I245-I255 HydrophobicContact CG1-CD1 3.62Å; I245-I255 HydrophobicContact CG2-CD1 3.77Å; A251-I255 WeakPolarHBondContact O-CG1 3.35Å; A251-I255 PolarHBondContact O-N 3.39Å; A251-I255 VanDerWaalsContact O-N 3.11Å; A252-I255 PolarHBondContact O-N 3.17Å; A252-I255 VanDerWaalsContact O-N 3.16Å; I255-S257 PolarHBondContact O-N 3.39Å; I255-S258 PolarHBondContact O-N 3.44Å; I255-N259 WeakPolarHBondContact CG2-O 3.45Å; I255-N259 CarbonylContact O-C 3.44Å; I255-N259 VanDerWaalsContact O-C 3.28Å; I255-N259 PolarHBondContact O-N 2.92Å; I255-L262 HydrophobicContact CD1-CD2 4.44Å; I255-L262 HydrophobicContact CG2-CB 4.2Å; I255-L262 HydrophobicContact CG2-CD2 4.19Å; I255-L262 HydrophobicContact CG2-CG 4.26Å; I255-L263 HydrophobicContact CG2-CB 4.06Å; I255-I266 HydrophobicContact CD1-CD1 4.46Å
256	I	59.3	Low	63.6	Low	104 Å²	104	56.4 Å²	56.4	53%	0.533	34%	0.336	S	S	.	.	H	α-helix	trans	-50.7	-43.4	171.3	-73	166.1	0	0	0	111	A252 L263	A252-I256 WeakPolarHBondContact O-CG1 3.4Å; A252-I256 PolarHBondContact O-N 3.28Å; I256-L263 HydrophobicContact CB-CD2 4.44Å; I256-L263 HydrophobicContact CD1-CD2 4.2Å; I256-L263 HydrophobicContact CG1-CD1 4.38Å; I256-L263 HydrophobicContact CG1-CD2 3.32Å; I256-L263 HydrophobicContact CG1-CG 4.44Å
257	S	58	Low	64	Low	101 Å²	101	58 Å²	58	71%	0.706	34%	0.342	S	S	*	.	H	α-helix	trans	-79.9	-24.6	-175.9	68.4	0	0	0	0	114.7	A254 I255	A254-S257 PolarHBondContact O-N 3Å; A254-S257 PolarHBondContact O-OG 3.01Å; I255-S257 PolarHBondContact O-N 3.39Å
258	S	65.1	Low	65	Low	79 Å²	79	61.7 Å²	61.7	55%	0.552	35%	0.349	S	S	*	.	H	α-helix	trans	-111.4	-32.4	-170.3	61.1	0	0	0	0	114.3	A254 I255	A254-S258 PolarHBondContact O-N 3.5Å; A254-S258 PolarHBondContact O-OG 3.48Å; A254-S258 VanDerWaalsContact O-OG 3.06Å; I255-S258 PolarHBondContact O-N 3.44Å
259	N	70.8	Confident	65.3	Low	28 Å²	28	68.1 Å²	68.1	15%	0.15	37%	0.368	C	S	.	.			trans	-154	82.5	-177.1	-166.7	-18.4	0	0	0	111.5	I255 E261 L262 L263	I255-N259 WeakPolarHBondContact CG2-O 3.45Å; I255-N259 CarbonylContact O-C 3.44Å; I255-N259 VanDerWaalsContact O-C 3.28Å; I255-N259 PolarHBondContact O-N 2.92Å; N259-E261 VanDerWaalsContact C-N 3.27Å; N259-E261 PolarHBondContact O-N 3.46Å; N259-E261 PolarHBondContact OD1-N 3.09Å; N259-L262 HydrophobicContact CB-CB 4.08Å; N259-L262 PolarHBondContact O-N 2.87Å; N259-L262 PolarHBondContact OD1-N 2.88Å; N259-L262 VanDerWaalsContact OD1-N 3.12Å; N259-L263 PolarHBondContact O-N 3.43Å
260	P	75.3	Confident	66.2	Low	86 Å²	86	67.5 Å²	67.5	56%	0.558	36%	0.361	S	S	*	.	H	α-helix	trans	-64.2	-29.2	179.7	25.1	-33.7	0	0	0	113.2	L262 L263 E264	P260-L262 VanDerWaalsContact C-N 3.34Å; P260-L262 PolarHBondContact O-N 3.39Å; P260-L263 WeakPolarHBondContact O-CB 3.47Å; P260-L263 PolarHBondContact O-N 3.18Å; P260-E264 PolarHBondContact O-N 2.74Å
261	E	79.4	Confident	66.8	Low	125 Å²	125	65.3 Å²	65.3	58%	0.584	35%	0.349	S	S	*	.	H	α-helix	trans	-65.1	-38.1	176.1	-67.6	-173.8	170.6	0	0	111.8	N259 E264 A265 L277	N259-E261 VanDerWaalsContact C-N 3.27Å; N259-E261 PolarHBondContact O-N 3.46Å; N259-E261 PolarHBondContact OD1-N 3.09Å; E261-E264 PolarHBondContact O-N 3.17Å; E261-A265 WeakPolarHBondContact O-CB 3.49Å; E261-A265 PolarHBondContact O-N 3.16Å; E261-L277 HydrophobicContact CB-CD1 3.78Å
262	L	73.2	Confident	67.6	Low	3 Å²	3	67.5 Å²	67.5	2%	0.016	37%	0.367	C	S	.	.	H	α-helix	trans	-66.5	-40.3	175	178.5	63.1	0	0	0	111	I255 N259 P260 A265 I266 V274 L277 A281	I255-L262 HydrophobicContact CD1-CD2 4.44Å; I255-L262 HydrophobicContact CG2-CB 4.2Å; I255-L262 HydrophobicContact CG2-CD2 4.19Å; I255-L262 HydrophobicContact CG2-CG 4.26Å; N259-L262 HydrophobicContact CB-CB 4.08Å; N259-L262 PolarHBondContact O-N 2.87Å; N259-L262 PolarHBondContact OD1-N 2.88Å; N259-L262 VanDerWaalsContact OD1-N 3.12Å; P260-L262 VanDerWaalsContact C-N 3.34Å; P260-L262 PolarHBondContact O-N 3.39Å; L262-A265 PolarHBondContact O-N 3.28Å; L262-I266 HydrophobicContact CD1-CD1 4.18Å; L262-I266 HydrophobicContact CD1-CG1 4.35Å; L262-I266 HydrophobicContact CG-CD1 3.92Å; L262-I266 HydrophobicContact CG-CG1 4.5Å; L262-I266 VanDerWaalsContact O-CG1 3.22Å; L262-I266 WeakPolarHBondContact O-CG1 3.3Å; L262-I266 PolarHBondContact O-N 3.42Å; L262-V274 HydrophobicContact CD1-CG1 4.37Å; L262-L277 HydrophobicContact CB-CB 4.31Å; L262-L277 HydrophobicContact CB-CD1 4.45Å; L262-L277 HydrophobicContact CD1-CB 3.98Å; L262-A281 HydrophobicContact CD2-CB 3.6Å
263	L	68.6	Low	68.6	Low	42 Å²	42	71 Å²	71	22%	0.22	38%	0.379	C	S	.	.	H	α-helix	trans	-61.6	-46.3	175.5	-172.8	75.7	0	0	0	111.1	I255 I256 N259 P260 A265 I266 T267	I255-L263 HydrophobicContact CG2-CB 4.06Å; I256-L263 HydrophobicContact CB-CD2 4.44Å; I256-L263 HydrophobicContact CD1-CD2 4.2Å; I256-L263 HydrophobicContact CG1-CD1 4.38Å; I256-L263 HydrophobicContact CG1-CD2 3.32Å; I256-L263 HydrophobicContact CG1-CG 4.44Å; N259-L263 PolarHBondContact O-N 3.43Å; P260-L263 WeakPolarHBondContact O-CB 3.47Å; P260-L263 PolarHBondContact O-N 3.18Å; L263-A265 VanDerWaalsContact C-N 3.28Å; L263-A265 PolarHBondContact O-N 2.86Å; L263-I266 PolarHBondContact O-N 2.7Å; L263-I266 VanDerWaalsContact O-N 3.15Å; L263-T267 WeakPolarHBondContact O-CB 3.5Å; L263-T267 PolarHBondContact O-N 3.4Å; L263-T267 PolarHBondContact O-OG1 3.41Å
264	E	75.2	Confident	69.3	Low	83 Å²	83	69.1 Å²	69.1	39%	0.388	36%	0.363	S	S	.	.	H	α-helix	trans	-59.2	-41.5	177.5	-169.5	-176.4	171.1	0	0	111.3	P260 E261 T267 R268	P260-E264 PolarHBondContact O-N 2.74Å; E261-E264 PolarHBondContact O-N 3.17Å; E264-T267 PolarHBondContact O-N 2.93Å; E264-R268 WeakPolarHBondContact O-CB 3.43Å; E264-R268 WeakPolarHBondContact O-CG 3.46Å; E264-R268 PolarHBondContact O-N 3.48Å; E264-R268 IonicContact OE1-CZ 3.33Å; E264-R268 IonicContact OE1-NE 2.67Å; E264-R268 IonicContact OE1-NH1 3.72Å; E264-R268 PolarHBondContact OE1-NH1 3.5Å; E264-R268 IonicContact OE1-NH2 2.89Å; E264-R268 PolarHBondContact OE1-NH2 3.28Å
265	A	76.7	Confident	69.8	Low	2 Å²	2	71.6 Å²	71.6	2%	0.017	37%	0.371	C	S	.	.	H	α-helix	trans	-62.7	-43	175.1	0	0	0	0	0	112.2	E261 L262 L263 R269 D270 K273 V274	E261-A265 WeakPolarHBondContact O-CB 3.49Å; E261-A265 PolarHBondContact O-N 3.16Å; L262-A265 PolarHBondContact O-N 3.28Å; L263-A265 VanDerWaalsContact C-N 3.28Å; L263-A265 PolarHBondContact O-N 2.86Å; A265-R269 PolarHBondContact O-N 3.28Å; A265-D270 PolarHBondContact O-N 3.25Å; A265-K273 HydrophobicContact CB-CB 3.63Å; A265-V274 HydrophobicContact CB-CG2 3.79Å
266	I	67.5	Low	70.8	Confident	8 Å²	8	77.6 Å²	77.6	4%	0.041	40%	0.399	C	S	.	.	H	α-helix	trans	-64.6	-46.8	176.4	-68.5	168.2	0	0	0	110.6	V242 I245 I255 L262 L263 R268 R269 V274	V242-I266 HydrophobicContact CG1-CG2 4.17Å; V242-I266 HydrophobicContact CG2-CG1 4.05Å; V242-I266 HydrophobicContact CG2-CG2 4.46Å; I245-I266 HydrophobicContact CB-CD1 4.3Å; I245-I266 HydrophobicContact CD1-CD1 3.41Å; I245-I266 VanDerWaalsContact CD1-CD1 3.41Å; I245-I266 HydrophobicContact CG1-CD1 4.45Å; I245-I266 HydrophobicContact CG2-CD1 4.02Å; I245-I266 HydrophobicContact CG2-CG2 4.5Å; I255-I266 HydrophobicContact CD1-CD1 4.46Å; L262-I266 HydrophobicContact CD1-CD1 4.18Å; L262-I266 HydrophobicContact CD1-CG1 4.35Å; L262-I266 HydrophobicContact CG-CD1 3.92Å; L262-I266 HydrophobicContact CG-CG1 4.5Å; L262-I266 VanDerWaalsContact O-CG1 3.22Å; L262-I266 WeakPolarHBondContact O-CG1 3.3Å; L262-I266 PolarHBondContact O-N 3.42Å; L263-I266 PolarHBondContact O-N 2.7Å; L263-I266 VanDerWaalsContact O-N 3.15Å; I266-R268 PolarHBondContact O-N 2.99Å; I266-R269 PolarHBondContact O-N 2.92Å; I266-V274 HydrophobicContact CG1-CG2 3.92Å
267	T	67.9	Low	71.6	Confident	106 Å²	106	74 Å²	74	65%	0.65	38%	0.38	S	S	*	.	H	α-helix	trans	-63.4	-40.7	179.9	-56.3	0	0	0	0	111.7	L263 E264 R269	L263-T267 WeakPolarHBondContact O-CB 3.5Å; L263-T267 PolarHBondContact O-N 3.4Å; L263-T267 PolarHBondContact O-OG1 3.41Å; E264-T267 PolarHBondContact O-N 2.93Å; T267-R269 PolarHBondContact O-N 3.48Å
268	R	73.8	Confident	72	Confident	171 Å²	171	70.3 Å²	70.3	65%	0.645	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-4	175.1	-70.7	-175.4	174.5	163.3	1.4	113.8	E264 I266 D270	E264-R268 WeakPolarHBondContact O-CB 3.43Å; E264-R268 WeakPolarHBondContact O-CG 3.46Å; E264-R268 PolarHBondContact O-N 3.48Å; E264-R268 IonicContact OE1-CZ 3.33Å; E264-R268 IonicContact OE1-NE 2.67Å; E264-R268 IonicContact OE1-NH1 3.72Å; E264-R268 PolarHBondContact OE1-NH1 3.5Å; E264-R268 IonicContact OE1-NH2 2.89Å; E264-R268 PolarHBondContact OE1-NH2 3.28Å; I266-R268 PolarHBondContact O-N 2.99Å; R268-D270 HydrophobicContact CB-CB 4.49Å; R268-D270 PolarHBondContact O-N 3Å
269	R	64.4	Low	72.2	Confident	208 Å²	208	70.5 Å²	70.5	79%	0.785	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	33.6	-172.1	-58.3	-175.9	175.2	-169.9	-1.6	112.8	A265 I266 T267 L271	A265-R269 PolarHBondContact O-N 3.28Å; I266-R269 PolarHBondContact O-N 2.92Å; T267-R269 PolarHBondContact O-N 3.48Å; R269-L271 PolarHBondContact O-N 3.11Å; R269-L271 VanDerWaalsContact O-N 3.09Å
270	D	74	Confident	72.1	Confident	55 Å²	55	72.4 Å²	72.4	29%	0.294	37%	0.372	S	S	.	.			trans	-81.4	85.1	177	-174.2	-15.3	0	0	0	109.6	A265 R268 A272 K273 V274	A265-D270 PolarHBondContact O-N 3.25Å; R268-D270 HydrophobicContact CB-CB 4.49Å; R268-D270 PolarHBondContact O-N 3Å; D270-A272 PolarHBondContact O-N 2.88Å; D270-A272 PolarHBondContact OD1-N 3.37Å; D270-K273 HydrophobicContact CB-CB 4.29Å; D270-K273 PolarHBondContact O-N 2.93Å; D270-K273 PolarHBondContact OD1-N 2.85Å; D270-K273 VanDerWaalsContact OD1-N 3.16Å; D270-K273 VanDerWaalsContact OD2-CD 3.26Å; D270-K273 WeakPolarHBondContact OD2-CD 3.36Å; D270-K273 WeakPolarHBondContact OD2-CG 3.26Å; D270-V274 WeakPolarHBondContact O-CG2 3.19Å; D270-V274 PolarHBondContact O-N 2.8Å
271	L	69.1	Low	71.6	Confident	52 Å²	52	69 Å²	69	27%	0.272	35%	0.351	S	S	.	.	H	α-helix	trans	-57.4	-32.4	-177.8	-66.1	176.1	0	0	0	112.7	A238 I239 R269 V274 K275	A238-L271 HydrophobicContact CB-CD2 4.41Å; I239-L271 HydrophobicContact CD1-CD1 4.32Å; I239-L271 HydrophobicContact CG1-CD1 4.21Å; I239-L271 HydrophobicContact CG1-CD2 3.8Å; R269-L271 PolarHBondContact O-N 3.11Å; R269-L271 VanDerWaalsContact O-N 3.09Å; L271-V274 PolarHBondContact O-N 3.44Å; L271-K275 WeakPolarHBondContact O-CG 3.32Å; L271-K275 PolarHBondContact O-N 3.19Å
272	A	73.5	Confident	70.5	Confident	71 Å²	71	66.1 Å²	66.1	59%	0.587	34%	0.342	S	S	*	.	H	α-helix	trans	-67	-45.9	179.6	0	0	0	0	0	111.4	D270 K275 Q276	D270-A272 PolarHBondContact O-N 2.88Å; D270-A272 PolarHBondContact OD1-N 3.37Å; A272-K275 PolarHBondContact O-N 3.35Å; A272-Q276 PolarHBondContact O-N 2.99Å; A272-Q276 VanDerWaalsContact O-N 3.16Å
273	K	74.5	Confident	69.7	Low	91 Å²	91	71 Å²	71	40%	0.396	37%	0.365	S	S	.	.	H	α-helix	trans	-67.7	-38	173.7	-80.3	-174.5	-174.9	172.8	0	112.7	A265 D270 K275 Q276 L277	A265-K273 HydrophobicContact CB-CB 3.63Å; D270-K273 HydrophobicContact CB-CB 4.29Å; D270-K273 PolarHBondContact O-N 2.93Å; D270-K273 PolarHBondContact OD1-N 2.85Å; D270-K273 VanDerWaalsContact OD1-N 3.16Å; D270-K273 VanDerWaalsContact OD2-CD 3.26Å; D270-K273 WeakPolarHBondContact OD2-CD 3.36Å; D270-K273 WeakPolarHBondContact OD2-CG 3.26Å; K273-K275 VanDerWaalsContact C-N 3.32Å; K273-K275 PolarHBondContact O-N 3.26Å; K273-Q276 PolarHBondContact O-N 3.44Å; K273-L277 WeakPolarHBondContact O-CB 3.43Å; K273-L277 WeakPolarHBondContact O-CG 3.19Å; K273-L277 PolarHBondContact O-N 3.29Å
274	V	69.4	Low	69.3	Low	0 Å²	0	72.1 Å²	72.1	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-57.8	-47.9	175	172.9	0	0	0	0	109.9	A238 V242 L262 A265 I266 D270 L271 Q276 L277 L278	A238-V274 HydrophobicContact CB-CG1 3.98Å; V242-V274 HydrophobicContact CG2-CG1 4Å; V242-V274 HydrophobicContact CG2-CG2 3.96Å; L262-V274 HydrophobicContact CD1-CG1 4.37Å; A265-V274 HydrophobicContact CB-CG2 3.79Å; I266-V274 HydrophobicContact CG1-CG2 3.92Å; D270-V274 WeakPolarHBondContact O-CG2 3.19Å; D270-V274 PolarHBondContact O-N 2.8Å; L271-V274 PolarHBondContact O-N 3.44Å; V274-Q276 VanDerWaalsContact C-N 3.29Å; V274-Q276 PolarHBondContact O-N 3.46Å; V274-L277 PolarHBondContact O-N 3.49Å; V274-L278 WeakPolarHBondContact O-CB 3.26Å; V274-L278 PolarHBondContact O-N 3.48Å
275	K	70.9	Confident	68.2	Low	66 Å²	66	71.5 Å²	71.5	29%	0.287	39%	0.385	S	S	.	.	H	α-helix	trans	-58.6	-38.4	176.4	-75.1	-177	-175	-168.9	0	113.3	E234 D235 A238 L271 A272 K273 P279	E234-K275 VanDerWaalsContact C-NZ 3.34Å; E234-K275 WeakPolarHBondContact O-CE 3.34Å; E234-K275 PolarHBondContact O-NZ 2.85Å; D235-K275 WeakPolarHBondContact OD1-CE 3.32Å; D235-K275 IonicContact OD1-NZ 3.11Å; D235-K275 PolarHBondContact OD1-NZ 3.24Å; A238-K275 HydrophobicContact CB-CG 3.97Å; L271-K275 WeakPolarHBondContact O-CG 3.32Å; L271-K275 PolarHBondContact O-N 3.19Å; A272-K275 PolarHBondContact O-N 3.35Å; K273-K275 VanDerWaalsContact C-N 3.32Å; K273-K275 PolarHBondContact O-N 3.26Å; K275-P279 WeakPolarHBondContact O-CD 3.46Å
276	Q	79.7	Confident	66.6	Low	148 Å²	148	80.6 Å²	80.6	69%	0.692	42%	0.419	S	S	*	.	H	α-helix	trans	-70.3	-40.7	179.8	-172.1	-178.3	7.4	0	0	112.4	A272 K273 V274	A272-Q276 PolarHBondContact O-N 2.99Å; A272-Q276 VanDerWaalsContact O-N 3.16Å; K273-Q276 PolarHBondContact O-N 3.44Å; V274-Q276 VanDerWaalsContact C-N 3.29Å; V274-Q276 PolarHBondContact O-N 3.46Å
277	L	77.3	Confident	65.8	Low	28 Å²	28	85.7 Å²	85.7	15%	0.147	45%	0.446	C	S	.	.	H	α-helix	trans	-90.7	-27	-171.4	-64.3	175.4	0	0	0	113.3	E261 L262 K273 V274 A280 A281	E261-L277 HydrophobicContact CB-CD1 3.78Å; L262-L277 HydrophobicContact CB-CB 4.31Å; L262-L277 HydrophobicContact CB-CD1 4.45Å; L262-L277 HydrophobicContact CD1-CB 3.98Å; K273-L277 WeakPolarHBondContact O-CB 3.43Å; K273-L277 WeakPolarHBondContact O-CG 3.19Å; K273-L277 PolarHBondContact O-N 3.29Å; V274-L277 PolarHBondContact O-N 3.49Å; L277-A280 PolarHBondContact O-N 3.42Å; L277-A281 PolarHBondContact O-N 2.81Å; L277-A281 VanDerWaalsContact O-N 3.1Å
278	L	66.9	Low	64.9	Low	24 Å²	24	83.4 Å²	83.4	13%	0.126	44%	0.438	C	S	.	.	H	α-helix	trans	-60	-46	-175.2	179.7	64.7	0	0	0	113.8	V241 V274 A280 A281 V282	V241-L278 HydrophobicContact CB-CD1 4.44Å; V241-L278 HydrophobicContact CB-CD2 4.18Å; V241-L278 HydrophobicContact CG1-CD1 3.65Å; V241-L278 HydrophobicContact CG1-CD2 4.26Å; V241-L278 HydrophobicContact CG2-CD1 4.42Å; V241-L278 HydrophobicContact CG2-CD2 3.97Å; V274-L278 WeakPolarHBondContact O-CB 3.26Å; V274-L278 PolarHBondContact O-N 3.48Å; L278-A280 VanDerWaalsContact C-N 3.31Å; L278-A280 PolarHBondContact O-N 3.41Å; L278-A281 PolarHBondContact O-N 2.79Å; L278-V282 HydrophobicContact CD1-CG2 3.83Å; L278-V282 HydrophobicContact CG-CG2 4.19Å; L278-V282 WeakPolarHBondContact O-CG2 3.38Å; L278-V282 PolarHBondContact O-N 3.21Å
279	P	67.3	Low	63.5	Low	84 Å²	84	80.5 Å²	80.5	55%	0.545	44%	0.441	S	S	.	.	H	α-helix	trans	-60	-41	-179	-24.1	34.3	0	0	0	112.7	K275 Q283	K275-P279 WeakPolarHBondContact O-CD 3.46Å; P279-Q283 WeakPolarHBondContact O-CB 3.38Å; P279-Q283 PolarHBondContact O-N 2.95Å
280	A	69.6	Low	62.7	Low	68 Å²	68	72.4 Å²	72.4	56%	0.562	42%	0.422	S	S	*	.	H	α-helix	trans	-67.6	-41.6	177.7	0	0	0	0	0	111.7	L277 L278 Q283 S284	L277-A280 PolarHBondContact O-N 3.42Å; L278-A280 VanDerWaalsContact C-N 3.31Å; L278-A280 PolarHBondContact O-N 3.41Å; A280-Q283 PolarHBondContact O-N 3.15Å; A280-S284 WeakPolarHBondContact O-CB 3.45Å; A280-S284 PolarHBondContact O-N 3.4Å; A280-S284 PolarHBondContact O-OG 2.92Å
281	A	64.2	Low	61.1	Low	15 Å²	15	78 Å²	78	12%	0.124	44%	0.439	C	S	.	.	H	α-helix	trans	-63.3	-45.8	176.5	0	0	0	0	0	111.9	L262 L277 L278 Q283 S284 A285	L262-A281 HydrophobicContact CD2-CB 3.6Å; L277-A281 PolarHBondContact O-N 2.81Å; L277-A281 VanDerWaalsContact O-N 3.1Å; L278-A281 PolarHBondContact O-N 2.79Å; A281-Q283 VanDerWaalsContact C-N 3.34Å; A281-Q283 PolarHBondContact O-N 3.38Å; A281-S284 PolarHBondContact O-N 3.06Å; A281-S284 PolarHBondContact O-OG 2.94Å; A281-A285 WeakPolarHBondContact O-CB 3.38Å; A281-A285 PolarHBondContact O-N 3.12Å
282	V	57.4	Low	60	Low	64 Å²	64	79.3 Å²	79.3	39%	0.388	46%	0.458	S	S	.	.	H	α-helix	trans	-61.6	-42.2	177.1	172.8	0	0	0	0	111.2	L278 A285 R286	L278-V282 HydrophobicContact CD1-CG2 3.83Å; L278-V282 HydrophobicContact CG-CG2 4.19Å; L278-V282 WeakPolarHBondContact O-CG2 3.38Å; L278-V282 PolarHBondContact O-N 3.21Å; V282-A285 PolarHBondContact O-N 3.2Å; V282-R286 WeakPolarHBondContact O-CB 3.46Å; V282-R286 WeakPolarHBondContact O-CG 3.32Å; V282-R286 PolarHBondContact O-N 3.19Å
283	Q	56.3	Low	58.6	Low	105 Å²	105	81.7 Å²	81.7	49%	0.491	46%	0.456	S	S	.	.	H	α-helix	trans	-66.5	-40.4	178.4	-160.3	69.4	1.9	0	0	112	P279 A280 A281 R286 N287	P279-Q283 WeakPolarHBondContact O-CB 3.38Å; P279-Q283 PolarHBondContact O-N 2.95Å; A280-Q283 PolarHBondContact O-N 3.15Å; A281-Q283 VanDerWaalsContact C-N 3.34Å; A281-Q283 PolarHBondContact O-N 3.38Å; Q283-R286 PolarHBondContact O-N 3.23Å; Q283-N287 WeakPolarHBondContact O-CB 3.41Å; Q283-N287 VanDerWaalsContact O-CG 3.3Å; Q283-N287 PolarHBondContact O-N 3.44Å; Q283-N287 PolarHBondContact O-ND2 3.36Å
284	S	59.7	Low	57.3	Low	65 Å²	65	84.6 Å²	84.6	46%	0.455	47%	0.469	S	S	.	.	H	α-helix	trans	-65.8	-38.3	175.5	73.2	0	0	0	0	112.4	A280 A281 N287 A288	A280-S284 WeakPolarHBondContact O-CB 3.45Å; A280-S284 PolarHBondContact O-N 3.4Å; A280-S284 PolarHBondContact O-OG 2.92Å; A281-S284 PolarHBondContact O-N 3.06Å; A281-S284 PolarHBondContact O-OG 2.94Å; S284-N287 PolarHBondContact O-N 2.85Å; S284-A288 WeakPolarHBondContact O-CB 3.25Å; S284-A288 PolarHBondContact O-N 3.36Å; S284-A288 VanDerWaalsContact O-N 3.14Å
285	A	53.1	Low	56.3	Low	70 Å²	70	92.1 Å²	92.1	58%	0.579	51%	0.506	S	S	*	.	H	α-helix	trans	-69.9	-37.9	176.4	0	0	0	0	0	112.3	A281 V282 N287 A288	A281-A285 WeakPolarHBondContact O-CB 3.38Å; A281-A285 PolarHBondContact O-N 3.12Å; V282-A285 PolarHBondContact O-N 3.2Å; A285-N287 VanDerWaalsContact C-N 3.33Å; A285-A288 PolarHBondContact O-N 2.89Å
286	R	42.2	Very low	55.4	Low	193 Å²	193	98.6 Å²	98.6	73%	0.728	53%	0.529	S	S	*	.	H	α-helix	trans	-65	-35.4	174	-83.2	-177.9	164.3	177.9	-3.1	112.7	V282 Q283	V282-R286 WeakPolarHBondContact O-CB 3.46Å; V282-R286 WeakPolarHBondContact O-CG 3.32Å; V282-R286 PolarHBondContact O-N 3.19Å; Q283-R286 PolarHBondContact O-N 3.23Å
287	N	50.4	Low	54.2	Low	116 Å²	116	95.4 Å²	95.4	62%	0.62	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-2.3	-178.4	-67.5	-17	0	0	0	113.7	Q283 S284 A285 P289	Q283-N287 WeakPolarHBondContact O-CB 3.41Å; Q283-N287 VanDerWaalsContact O-CG 3.3Å; Q283-N287 PolarHBondContact O-N 3.44Å; Q283-N287 PolarHBondContact O-ND2 3.36Å; S284-N287 PolarHBondContact O-N 2.85Å; A285-N287 VanDerWaalsContact C-N 3.33Å; N287-P289 VanDerWaalsContact O-CD 3.24Å; N287-P289 WeakPolarHBondContact O-CD 3.39Å
288	A	50	Low	53.2	Low	58 Å²	58	98 Å²	98	48%	0.479	54%	0.535	S	S	.	.			trans	-80.9	111.2	179.5	0	0	0	0	0	111.3	S284 A285 G290	S284-A288 WeakPolarHBondContact O-CB 3.25Å; S284-A288 PolarHBondContact O-N 3.36Å; S284-A288 VanDerWaalsContact O-N 3.14Å; A285-A288 PolarHBondContact O-N 2.89Å; A288-G290 PolarHBondContact O-N 3.45Å
289	P	44.4	Very low	53.2	Low	110 Å²	110	102.2 Å²	102.2	71%	0.714	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	49.4	-173.6	34.3	-34.7	0	0	0	113	N287	N287-P289 VanDerWaalsContact O-CD 3.24Å; N287-P289 WeakPolarHBondContact O-CD 3.39Å
290	G	46.6	Very low	53.4	Low	37 Å²	37	100.9 Å²	100.9	38%	0.381	55%	0.55	S	S	.	*	T	Hydrogen-bonded Turn	trans	-136.1	-30.9	-167.3	0	0	0	0	0	117.8	A288 K294	A288-G290 PolarHBondContact O-N 3.45Å; G290-K294 WeakPolarHBondContact O-CG 3.18Å
291	R	41.1	Very low	53.7	Low	174 Å²	174	102.5 Å²	102.5	66%	0.657	56%	0.555	S	S	*	*	H	α-helix	trans	-100.4	-38.6	-174.9	-97.9	177.9	169.6	148.1	-6.9	113.7	E293	R291-E293 VanDerWaalsContact C-N 3.33Å
292	A	45.3	Very low	53.9	Low	79 Å²	79	108 Å²	108	65%	0.653	58%	0.582	S	S	*	*	H	α-helix	trans	-73.3	-24.4	176.3	0	0	0	0	0	112.9	R296	A292-R296 WeakPolarHBondContact O-CB 3.3Å
293	E	45.3	Very low	54.1	Low	120 Å²	120	106.1 Å²	106.1	56%	0.561	57%	0.571	S	S	*	*	H	α-helix	trans	-81.9	-35.6	177.2	-89.4	173.2	158.3	0	0	113.6	R291 M295 R296	R291-E293 VanDerWaalsContact C-N 3.33Å; E293-M295 VanDerWaalsContact C-N 3.33Å; E293-M295 PolarHBondContact O-N 3.15Å; E293-R296 WeakPolarHBondContact O-CB 3.3Å; E293-R296 PolarHBondContact O-N 2.89Å; E293-R296 VanDerWaalsContact O-N 3.11Å
294	K	46.2	Very low	54.7	Low	152 Å²	152	105.6 Å²	105.6	66%	0.661	57%	0.569	S	S	*	*	H	α-helix	trans	-67.3	-32	177.3	-77.6	-175.1	175.9	-170.9	0	113.1	G290 R296 V303	G290-K294 WeakPolarHBondContact O-CG 3.18Å; K294-R296 VanDerWaalsContact C-N 3.29Å; K294-V303 WeakPolarHBondContact O-CG2 3.49Å
295	M	49.4	Very low	55.4	Low	158 Å²	158	109.5 Å²	109.5	78%	0.778	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-7	173.9	-126.6	130.4	74	0	0	113.5	E293	E293-M295 VanDerWaalsContact C-N 3.33Å; E293-M295 PolarHBondContact O-N 3.15Å
296	R	50.9	Low	56.2	Low	202 Å²	202	111.4 Å²	111.4	76%	0.762	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-13.3	-177.7	-113.6	177.5	166.8	-169.3	-3.6	113.6	A292 E293 K294 P298	A292-R296 WeakPolarHBondContact O-CB 3.3Å; E293-R296 WeakPolarHBondContact O-CB 3.3Å; E293-R296 PolarHBondContact O-N 2.89Å; E293-R296 VanDerWaalsContact O-N 3.11Å; K294-R296 VanDerWaalsContact C-N 3.29Å; R296-P298 VanDerWaalsContact C-CD 3.44Å; R296-P298 WeakPolarHBondContact O-CD 3.27Å
297	N	54.7	Low	57.4	Low	81 Å²	81	105.2 Å²	105.2	43%	0.433	56%	0.558	S	S	.	*			trans	-111.7	85	174.7	-163.7	5.3	0	0	0	111.3	T299 D300	N297-T299 VanDerWaalsContact CG-OG1 3.3Å; N297-T299 PolarHBondContact ND2-OG1 2.92Å; N297-T299 PolarHBondContact O-N 2.86Å; N297-T299 PolarHBondContact OD1-N 2.94Å; N297-T299 PolarHBondContact OD1-OG1 2.96Å; N297-D300 PolarHBondContact O-N 3Å
298	P	56.6	Low	58.5	Low	83 Å²	83	105.9 Å²	105.9	54%	0.539	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.4	3	174.9	19	-26.1	0	0	0	114.5	R296 Q304	R296-P298 VanDerWaalsContact C-CD 3.44Å; R296-P298 WeakPolarHBondContact O-CD 3.27Å; P298-Q304 PolarHBondContact O-OE1 2.71Å
299	T	66.7	Low	59.4	Low	112 Å²	112	107.1 Å²	107.1	69%	0.687	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	-0.3	174	69.7	0	0	0	0	114.1	N297	N297-T299 VanDerWaalsContact CG-OG1 3.3Å; N297-T299 PolarHBondContact ND2-OG1 2.92Å; N297-T299 PolarHBondContact O-N 2.86Å; N297-T299 PolarHBondContact OD1-N 2.94Å; N297-T299 PolarHBondContact OD1-OG1 2.96Å
300	D	72.2	Confident	60.3	Low	57 Å²	57	105.6 Å²	105.6	31%	0.305	54%	0.539	S	S	.	.			trans	-73.1	123.6	174.5	-169.6	-33.8	0	0	0	110.5	N297 D302 V303 Q304	N297-D300 PolarHBondContact O-N 3Å; D300-D302 VanDerWaalsContact C-N 3.25Å; D300-D302 PolarHBondContact O-N 2.92Å; D300-D302 PolarHBondContact OD1-N 3.06Å; D300-D302 VanDerWaalsContact OD1-N 3.12Å; D300-V303 HydrophobicContact CB-CB 4.15Å; D300-V303 HydrophobicContact CB-CG2 3.91Å; D300-V303 PolarHBondContact O-N 2.86Å; D300-Q304 WeakPolarHBondContact O-CB 3.47Å; D300-Q304 PolarHBondContact O-N 3.43Å
301	P	75	Confident	61.5	Low	102 Å²	102	107.8 Å²	107.8	66%	0.662	54%	0.541	S	S	*	.	H	α-helix	trans	-53.9	-36.1	-179.1	-26.3	33.7	0	0	0	114.7	K305	P301-K305 WeakPolarHBondContact O-CB 3.27Å; P301-K305 PolarHBondContact O-N 2.97Å
302	D	68.7	Low	63.2	Low	129 Å²	129	106.4 Å²	106.4	69%	0.69	54%	0.536	S	S	*	.	H	α-helix	trans	-74.4	-36.5	-177.7	-74.6	-26.6	0	0	0	111.6	D300 L306	D300-D302 VanDerWaalsContact C-N 3.25Å; D300-D302 PolarHBondContact O-N 2.92Å; D300-D302 PolarHBondContact OD1-N 3.06Å; D300-D302 VanDerWaalsContact OD1-N 3.12Å; D302-L306 PolarHBondContact O-N 3.32Å
303	V	61.7	Low	64.2	Low	26 Å²	26	105.9 Å²	105.9	16%	0.158	52%	0.522	C	S	.	.	H	α-helix	trans	-70	-42.1	175.2	179.4	0	0	0	0	110	K294 D300 K305 L306 I307	K294-V303 WeakPolarHBondContact O-CG2 3.49Å; D300-V303 HydrophobicContact CB-CB 4.15Å; D300-V303 HydrophobicContact CB-CG2 3.91Å; D300-V303 PolarHBondContact O-N 2.86Å; V303-K305 VanDerWaalsContact C-N 3.3Å; V303-K305 PolarHBondContact O-N 3.34Å; V303-L306 PolarHBondContact O-N 3.5Å; V303-I307 HydrophobicContact CG1-CD1 3.88Å; V303-I307 HydrophobicContact CG1-CG1 4.44Å; V303-I307 VanDerWaalsContact O-CG1 3.32Å; V303-I307 WeakPolarHBondContact O-CG1 3.43Å; V303-I307 PolarHBondContact O-N 3.22Å
304	Q	69.2	Low	65.2	Low	94 Å²	94	106.2 Å²	106.2	44%	0.439	52%	0.523	S	S	.	.	H	α-helix	trans	-61.3	-39.8	177.2	-172	61.8	17.8	0	0	111.8	P298 D300 I307 E308	P298-Q304 PolarHBondContact O-OE1 2.71Å; D300-Q304 WeakPolarHBondContact O-CB 3.47Å; D300-Q304 PolarHBondContact O-N 3.43Å; Q304-I307 PolarHBondContact O-N 3.43Å; Q304-E308 WeakPolarHBondContact O-CB 3.38Å; Q304-E308 PolarHBondContact O-N 2.8Å
305	K	74.2	Confident	66.7	Low	147 Å²	147	103.7 Å²	103.7	64%	0.639	52%	0.517	S	S	*	.	H	α-helix	trans	-64.7	-39	175.6	-172.4	178	-179.9	-179.1	0	112.7	P301 V303 E308 E309	P301-K305 WeakPolarHBondContact O-CB 3.27Å; P301-K305 PolarHBondContact O-N 2.97Å; V303-K305 VanDerWaalsContact C-N 3.3Å; V303-K305 PolarHBondContact O-N 3.34Å; K305-E308 PolarHBondContact O-N 3.26Å; K305-E309 WeakPolarHBondContact O-CB 3.46Å; K305-E309 PolarHBondContact O-N 3.42Å
306	L	69.6	Low	67.6	Low	110 Å²	110	100.2 Å²	100.2	58%	0.576	50%	0.501	S	S	*	.	H	α-helix	trans	-67.7	-40.7	175.7	-175.4	65.9	0	0	0	111.6	D302 V303 E309 N310	D302-L306 PolarHBondContact O-N 3.32Å; V303-L306 PolarHBondContact O-N 3.5Å; L306-E309 PolarHBondContact O-N 3.02Å; L306-N310 WeakPolarHBondContact O-CB 3.23Å; L306-N310 VanDerWaalsContact O-CG 3.3Å; L306-N310 PolarHBondContact O-N 3.41Å; L306-N310 PolarHBondContact O-ND2 2.9Å
307	I	67	Low	68.4	Low	63 Å²	63	95.4 Å²	95.4	32%	0.323	49%	0.49	S	S	.	.	H	α-helix	trans	-62.2	-47.1	174.1	-68.1	167.2	0	0	0	110.2	V303 Q304 E309 N310 I311	V303-I307 HydrophobicContact CG1-CD1 3.88Å; V303-I307 HydrophobicContact CG1-CG1 4.44Å; V303-I307 VanDerWaalsContact O-CG1 3.32Å; V303-I307 WeakPolarHBondContact O-CG1 3.43Å; V303-I307 PolarHBondContact O-N 3.22Å; Q304-I307 PolarHBondContact O-N 3.43Å; I307-E309 VanDerWaalsContact C-N 3.35Å; I307-E309 PolarHBondContact O-N 2.97Å; I307-N310 PolarHBondContact O-N 3.24Å; I307-I311 HydrophobicContact CG2-CD1 3.6Å; I307-I311 HydrophobicContact CG2-CG1 4.29Å; I307-I311 WeakPolarHBondContact O-CB 3.5Å; I307-I311 VanDerWaalsContact O-CG1 3.27Å; I307-I311 WeakPolarHBondContact O-CG1 3.47Å; I307-I311 PolarHBondContact O-N 3.5Å
308	E	73.8	Confident	69.2	Low	129 Å²	129	95 Å²	95	60%	0.603	49%	0.494	S	S	*	.	H	α-helix	trans	-58.4	-45.1	178.1	-175.6	-179.6	179.2	0	0	111.8	Q304 K305 I311 R312	Q304-E308 WeakPolarHBondContact O-CB 3.38Å; Q304-E308 PolarHBondContact O-N 2.8Å; K305-E308 PolarHBondContact O-N 3.26Å; E308-I311 PolarHBondContact O-N 3.39Å; E308-R312 WeakPolarHBondContact O-CB 3.36Å; E308-R312 PolarHBondContact O-N 3.42Å
309	E	69.2	Low	70	Confident	84 Å²	84	96.7 Å²	96.7	39%	0.393	50%	0.496	S	S	.	.	H	α-helix	trans	-67.2	-40	178.2	-173.1	64.2	-176.8	0	0	112.1	K305 L306 I307 R312 L313	K305-E309 WeakPolarHBondContact O-CB 3.46Å; K305-E309 PolarHBondContact O-N 3.42Å; L306-E309 PolarHBondContact O-N 3.02Å; I307-E309 VanDerWaalsContact C-N 3.35Å; I307-E309 PolarHBondContact O-N 2.97Å; E309-R312 WeakPolarHBondContact O-CB 3.19Å; E309-R312 PolarHBondContact O-N 3.25Å; E309-R312 IonicContact OE2-NH1 3.57Å; E309-L313 HydrophobicContact CG-CD1 4.48Å; E309-L313 WeakPolarHBondContact O-CG 3.42Å; E309-L313 PolarHBondContact O-N 3.48Å
310	N	63.3	Low	70.2	Confident	79 Å²	79	95.4 Å²	95.4	42%	0.422	48%	0.481	S	S	.	.	H	α-helix	trans	-63.5	-45.8	175	-74	-20	0	0	0	111.7	L306 I307 R312 L313 E314	L306-N310 WeakPolarHBondContact O-CB 3.23Å; L306-N310 VanDerWaalsContact O-CG 3.3Å; L306-N310 PolarHBondContact O-N 3.41Å; L306-N310 PolarHBondContact O-ND2 2.9Å; I307-N310 PolarHBondContact O-N 3.24Å; N310-R312 VanDerWaalsContact C-N 3.26Å; N310-R312 PolarHBondContact O-N 3.05Å; N310-L313 PolarHBondContact O-N 2.92Å; N310-E314 WeakPolarHBondContact O-CG 3.38Å; N310-E314 PolarHBondContact O-N 2.84Å
311	I	71.9	Confident	70	Confident	82 Å²	82	96.1 Å²	96.1	42%	0.421	49%	0.487	S	S	.	.	H	α-helix	trans	-59.9	-40.4	175.4	-69.6	169.2	0	0	0	110.4	I307 E308 E314 N315	I307-I311 HydrophobicContact CG2-CD1 3.6Å; I307-I311 HydrophobicContact CG2-CG1 4.29Å; I307-I311 WeakPolarHBondContact O-CB 3.5Å; I307-I311 VanDerWaalsContact O-CG1 3.27Å; I307-I311 WeakPolarHBondContact O-CG1 3.47Å; I307-I311 PolarHBondContact O-N 3.5Å; E308-I311 PolarHBondContact O-N 3.39Å; I311-E314 PolarHBondContact O-N 2.85Å; I311-N315 WeakPolarHBondContact O-CB 3.39Å; I311-N315 PolarHBondContact O-N 3.04Å; I311-N315 PolarHBondContact O-ND2 3.36Å; I311-N315 VanDerWaalsContact O-ND2 3.15Å
312	R	76.1	Confident	70	Confident	145 Å²	145	95.7 Å²	95.7	55%	0.547	48%	0.476	S	S	.	.	H	α-helix	trans	-61.8	-46.7	176.2	179.6	-171.2	170.1	176.9	-1.4	111.5	E308 E309 N310 N315 I316	E308-R312 WeakPolarHBondContact O-CB 3.36Å; E308-R312 PolarHBondContact O-N 3.42Å; E309-R312 WeakPolarHBondContact O-CB 3.19Å; E309-R312 PolarHBondContact O-N 3.25Å; E309-R312 IonicContact OE2-NH1 3.57Å; N310-R312 VanDerWaalsContact C-N 3.26Å; N310-R312 PolarHBondContact O-N 3.05Å; R312-N315 PolarHBondContact O-N 3.42Å; R312-I316 HydrophobicContact CG-CD1 4.08Å; R312-I316 VanDerWaalsContact O-CG1 3.32Å; R312-I316 WeakPolarHBondContact O-CG1 3.32Å; R312-I316 PolarHBondContact O-N 3.44Å
313	L	66.9	Low	70.3	Confident	69 Å²	69	90.6 Å²	90.6	36%	0.361	45%	0.452	S	S	.	.	H	α-helix	trans	-63	-45.3	177.8	-70.2	172.4	0	0	0	111.2	E309 N310 N315 I316 D317	E309-L313 HydrophobicContact CG-CD1 4.48Å; E309-L313 WeakPolarHBondContact O-CG 3.42Å; E309-L313 PolarHBondContact O-N 3.48Å; N310-L313 PolarHBondContact O-N 2.92Å; L313-N315 VanDerWaalsContact C-N 3.31Å; L313-N315 PolarHBondContact O-N 3.31Å; L313-I316 PolarHBondContact O-N 3.34Å; L313-I316 VanDerWaalsContact O-N 3.11Å; L313-D317 PolarHBondContact O-N 3.09Å
314	E	66.8	Low	70.7	Confident	127 Å²	127	94.2 Å²	94.2	59%	0.593	47%	0.468	S	S	*	.	H	α-helix	trans	-58.4	-41.4	174.9	-73.4	174.3	-176.4	0	0	112.2	N310 I311 D317 S318	N310-E314 WeakPolarHBondContact O-CG 3.38Å; N310-E314 PolarHBondContact O-N 2.84Å; I311-E314 PolarHBondContact O-N 2.85Å; E314-D317 PolarHBondContact O-N 3.36Å; E314-S318 VanDerWaalsContact O-CB 3.24Å; E314-S318 WeakPolarHBondContact O-CB 3.48Å; E314-S318 PolarHBondContact O-N 3.14Å
315	N	76.4	Confident	70.8	Confident	98 Å²	98	96.1 Å²	96.1	52%	0.524	48%	0.477	S	S	.	.	H	α-helix	trans	-64.9	-40.4	175.4	-74.6	-30.2	0	0	0	112	I311 R312 L313 M319	I311-N315 WeakPolarHBondContact O-CB 3.39Å; I311-N315 PolarHBondContact O-N 3.04Å; I311-N315 PolarHBondContact O-ND2 3.36Å; I311-N315 VanDerWaalsContact O-ND2 3.15Å; R312-N315 PolarHBondContact O-N 3.42Å; L313-N315 VanDerWaalsContact C-N 3.31Å; L313-N315 PolarHBondContact O-N 3.31Å; N315-M319 WeakPolarHBondContact O-CB 3.27Å; N315-M319 WeakPolarHBondContact O-CG 3.48Å; N315-M319 PolarHBondContact O-N 3.4Å
316	I	70	Confident	70.9	Confident	85 Å²	85	94.7 Å²	94.7	44%	0.436	47%	0.472	S	S	.	.	H	α-helix	trans	-65	-46.3	176.3	-69.7	166.6	0	0	0	110.2	R312 L313 M319 F320	R312-I316 HydrophobicContact CG-CD1 4.08Å; R312-I316 VanDerWaalsContact O-CG1 3.32Å; R312-I316 WeakPolarHBondContact O-CG1 3.32Å; R312-I316 PolarHBondContact O-N 3.44Å; L313-I316 PolarHBondContact O-N 3.34Å; L313-I316 VanDerWaalsContact O-N 3.11Å; I316-M319 PolarHBondContact O-N 2.81Å; I316-F320 VanDerWaalsContact O-CB 3.32Å; I316-F320 WeakPolarHBondContact O-CB 3.49Å; I316-F320 PolarHBondContact O-N 2.61Å
317	D	66.9	Low	71.1	Confident	102 Å²	102	94.2 Å²	94.2	55%	0.545	47%	0.469	S	S	.	.	H	α-helix	trans	-64.2	-42	179.4	-72.8	-17.7	0	0	0	111.3	L313 E314 F320 V321	L313-D317 PolarHBondContact O-N 3.09Å; E314-D317 PolarHBondContact O-N 3.36Å; D317-F320 WeakPolarHBondContact O-CB 3.44Å; D317-F320 PolarHBondContact O-N 2.93Å; D317-V321 WeakPolarHBondContact O-CG2 3.32Å; D317-V321 PolarHBondContact O-N 2.92Å
318	S	70.6	Confident	71.3	Confident	73 Å²	73	94.5 Å²	94.5	51%	0.51	47%	0.474	S	S	.	.	H	α-helix	trans	-61.1	-45.5	174.2	-178.3	0	0	0	0	111.9	E314 F320 V321 H322	E314-S318 VanDerWaalsContact O-CB 3.24Å; E314-S318 WeakPolarHBondContact O-CB 3.48Å; E314-S318 PolarHBondContact O-N 3.14Å; S318-F320 VanDerWaalsContact C-N 3.33Å; S318-F320 PolarHBondContact O-N 3.15Å; S318-V321 PolarHBondContact O-N 2.89Å; S318-H322 WeakPolarHBondContact O-CB 3.36Å; S318-H322 PolarHBondContact O-N 3.37Å
319	M	74.2	Confident	71	Confident	118 Å²	118	94.5 Å²	94.5	58%	0.581	48%	0.475	S	S	*	.	H	α-helix	trans	-65.2	-36.2	175.3	-72.3	-71.6	95.4	0	0	112.5	N315 I316 H322 A323	N315-M319 WeakPolarHBondContact O-CB 3.27Å; N315-M319 WeakPolarHBondContact O-CG 3.48Å; N315-M319 PolarHBondContact O-N 3.4Å; I316-M319 PolarHBondContact O-N 2.81Å; M319-H322 HydrophobicContact CE-CB 4.44Å; M319-H322 PolarHBondContact O-N 3.34Å; M319-A323 VanDerWaalsContact O-CB 3.26Å; M319-A323 WeakPolarHBondContact O-CB 3.29Å; M319-A323 PolarHBondContact O-N 2.83Å
320	F	70.1	Confident	71	Confident	84 Å²	84	94.1 Å²	94.1	37%	0.368	48%	0.478	S	S	.	.	H	α-helix	trans	-64.5	-48.1	176.4	177.3	-101.2	0	0	0	111.2	I316 D317 S318 H322 A323 M324 F331 L476	I316-F320 VanDerWaalsContact O-CB 3.32Å; I316-F320 WeakPolarHBondContact O-CB 3.49Å; I316-F320 PolarHBondContact O-N 2.61Å; D317-F320 WeakPolarHBondContact O-CB 3.44Å; D317-F320 PolarHBondContact O-N 2.93Å; S318-F320 VanDerWaalsContact C-N 3.33Å; S318-F320 PolarHBondContact O-N 3.15Å; F320-H322 VanDerWaalsContact C-N 3.33Å; F320-H322 PolarHBondContact O-N 3.16Å; F320-A323 PolarHBondContact O-N 3.31Å; F320-M324 HydrophobicContact CD1-CG 4.41Å; F320-M324 HydrophobicContact CD1-SD 3.91Å; F320-M324 HydrophobicContact CE1-CG 4.05Å; F320-M324 HydrophobicContact CE1-SD 3.19Å; F320-M324 WeakPolarHBondContact CE1-SD 3.37Å; F320-M324 HydrophobicContact CE2-CG 4.38Å; F320-M324 HydrophobicContact CE2-SD 4.36Å; F320-M324 HydrophobicContact CZ-CG 4.03Å; F320-M324 HydrophobicContact CZ-SD 3.46Å; F320-M324 WeakPolarHBondContact CZ-SD 3.38Å; F320-M324 WeakPolarHBondContact O-CG 3.34Å; F320-M324 PolarHBondContact O-N 3.36Å; F320-F331 HydrophobicContact CD2-CE1 4.07Å; F320-F331 HydrophobicContact CD2-CZ 4.12Å; F320-F331 HydrophobicContact CE2-CD1 4.44Å; F320-F331 AromaticContact CE2-CE1 3.59Å; F320-F331 HydrophobicContact CE2-CE1 3.59Å; F320-F331 HydrophobicContact CE2-CZ 4Å; F320-F331 HydrophobicContact CZ-CE1 4.5Å; F320-L476 HydrophobicContact CE2-CD2 4.28Å; F320-L476 HydrophobicContact CZ-CD2 3.87Å
321	V	68.1	Low	70.9	Confident	73 Å²	73	93.5 Å²	93.5	44%	0.442	47%	0.471	S	S	.	.	H	α-helix	trans	-59	-46.6	174.2	173.1	0	0	0	0	110.4	D317 S318 A323 M324 E325	D317-V321 WeakPolarHBondContact O-CG2 3.32Å; D317-V321 PolarHBondContact O-N 2.92Å; S318-V321 PolarHBondContact O-N 2.89Å; V321-A323 VanDerWaalsContact C-N 3.33Å; V321-A323 PolarHBondContact O-N 3.07Å; V321-M324 PolarHBondContact O-N 3.4Å; V321-M324 VanDerWaalsContact O-N 3.15Å; V321-E325 HydrophobicContact CG1-CG 4.5Å; V321-E325 WeakPolarHBondContact O-CG 3.24Å; V321-E325 PolarHBondContact O-N 2.82Å
322	H	74.9	Confident	70.1	Confident	93 Å²	93	91.6 Å²	91.6	43%	0.431	47%	0.473	S	S	.	.	H	α-helix	trans	-60.2	-42.1	177.9	-172.3	-77.1	0	0	0	112.2	S318 M319 F320 E325 H326	S318-H322 WeakPolarHBondContact O-CB 3.36Å; S318-H322 PolarHBondContact O-N 3.37Å; M319-H322 HydrophobicContact CE-CB 4.44Å; M319-H322 PolarHBondContact O-N 3.34Å; F320-H322 VanDerWaalsContact C-N 3.33Å; F320-H322 PolarHBondContact O-N 3.16Å; H322-E325 PolarHBondContact O-N 2.88Å; H322-H326 AromaticContact CD2-CE1 3.85Å; H322-H326 AromaticContact CD2-ND1 3.72Å; H322-H326 AromaticContact CE1-CG 3.82Å; H322-H326 AromaticContact CE1-ND1 3.59Å; H322-H326 AromaticContact CG-ND1 3.79Å; H322-H326 AromaticContact ND1-ND1 3.71Å; H322-H326 AromaticContact NE2-CE1 3.74Å; H322-H326 AromaticContact NE2-ND1 3.62Å; H322-H326 WeakPolarHBondContact O-CB 3.38Å; H322-H326 PolarHBondContact O-N 3.01Å; H322-H326 PolarHBondContact O-ND1 3.42Å
323	A	75.3	Confident	69.7	Low	21 Å²	21	88.7 Å²	88.7	17%	0.174	47%	0.474	C	S	.	.	H	α-helix	trans	-66.1	-39.6	175.7	0	0	0	0	0	111.5	M319 F320 V321 E325 M327 F331	M319-A323 VanDerWaalsContact O-CB 3.26Å; M319-A323 WeakPolarHBondContact O-CB 3.29Å; M319-A323 PolarHBondContact O-N 2.83Å; F320-A323 PolarHBondContact O-N 3.31Å; V321-A323 VanDerWaalsContact C-N 3.33Å; V321-A323 PolarHBondContact O-N 3.07Å; A323-E325 VanDerWaalsContact C-N 3.32Å; A323-E325 PolarHBondContact O-N 2.85Å; A323-M327 CarbonylContact O-C 3.51Å; A323-M327 WeakPolarHBondContact O-CA 3.43Å; A323-M327 WeakPolarHBondContact O-CB 3.41Å; A323-M327 PolarHBondContact O-N 2.87Å; A323-F331 HydrophobicContact CB-CE2 3.84Å; A323-F331 HydrophobicContact CB-CZ 3.84Å
324	M	70.8	Confident	69.9	Low	102 Å²	102	90.1 Å²	90.1	50%	0.502	49%	0.486	S	S	.	.	H	α-helix	trans	-63.6	-39	176.1	-75.4	-172.2	70.2	0	0	112.1	F320 V321 F331	F320-M324 HydrophobicContact CD1-CG 4.41Å; F320-M324 HydrophobicContact CD1-SD 3.91Å; F320-M324 HydrophobicContact CE1-CG 4.05Å; F320-M324 HydrophobicContact CE1-SD 3.19Å; F320-M324 WeakPolarHBondContact CE1-SD 3.37Å; F320-M324 HydrophobicContact CE2-CG 4.38Å; F320-M324 HydrophobicContact CE2-SD 4.36Å; F320-M324 HydrophobicContact CZ-CG 4.03Å; F320-M324 HydrophobicContact CZ-SD 3.46Å; F320-M324 WeakPolarHBondContact CZ-SD 3.38Å; F320-M324 WeakPolarHBondContact O-CG 3.34Å; F320-M324 PolarHBondContact O-N 3.36Å; V321-M324 PolarHBondContact O-N 3.4Å; V321-M324 VanDerWaalsContact O-N 3.15Å; M324-F331 HydrophobicContact CB-CE2 4.38Å; M324-F331 HydrophobicContact CG-CD2 4.22Å; M324-F331 HydrophobicContact CG-CE2 3.85Å; M324-F331 HydrophobicContact CG-CZ 4.05Å
325	E	70.5	Confident	70.7	Confident	135 Å²	135	86.2 Å²	86.2	63%	0.631	47%	0.472	S	S	*	.	H	α-helix	trans	-73.6	-44	179.3	-72.9	-179.8	169.1	0	0	112.6	V321 H322 A323	V321-E325 HydrophobicContact CG1-CG 4.5Å; V321-E325 WeakPolarHBondContact O-CG 3.24Å; V321-E325 PolarHBondContact O-N 2.82Å; H322-E325 PolarHBondContact O-N 2.88Å; A323-E325 VanDerWaalsContact C-N 3.32Å; A323-E325 PolarHBondContact O-N 2.85Å
326	H	76.2	Confident	71.3	Confident	116 Å²	116	85 Å²	85	54%	0.537	46%	0.464	S	S	.	.	H	α-helix	trans	-104.5	-13.8	-169.4	-60.1	84.5	0	0	0	114.2	H322	H322-H326 AromaticContact CD2-CE1 3.85Å; H322-H326 AromaticContact CD2-ND1 3.72Å; H322-H326 AromaticContact CE1-CG 3.82Å; H322-H326 AromaticContact CE1-ND1 3.59Å; H322-H326 AromaticContact CG-ND1 3.79Å; H322-H326 AromaticContact ND1-ND1 3.71Å; H322-H326 AromaticContact NE2-CE1 3.74Å; H322-H326 AromaticContact NE2-ND1 3.62Å; H322-H326 WeakPolarHBondContact O-CB 3.38Å; H322-H326 PolarHBondContact O-N 3.01Å; H322-H326 PolarHBondContact O-ND1 3.42Å
327	M	75.5	Confident	72.5	Confident	101 Å²	101	82.8 Å²	82.8	50%	0.498	45%	0.453	S	S	.	.			trans	-139.8	56.3	-176	-56.5	-178.4	64	0	0	112.2	A323 E329 T330	A323-M327 CarbonylContact O-C 3.51Å; A323-M327 WeakPolarHBondContact O-CA 3.43Å; A323-M327 WeakPolarHBondContact O-CB 3.41Å; A323-M327 PolarHBondContact O-N 2.87Å; M327-E329 PolarHBondContact O-N 2.92Å; M327-E329 VanDerWaalsContact O-N 3.13Å; M327-T330 WeakPolarHBondContact CB-OG1 3.43Å; M327-T330 VanDerWaalsContact O-CB 3.26Å; M327-T330 WeakPolarHBondContact O-CB 3.24Å; M327-T330 PolarHBondContact O-N 2.77Å; M327-T330 PolarHBondContact O-OG1 2.92Å; M327-T330 VanDerWaalsContact O-OG1 3.06Å
328	P	70.7	Confident	73.8	Confident	68 Å²	68	78.1 Å²	78.1	44%	0.442	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-59.3	-27.1	-178.1	26.8	-35.4	0	0	0	112.9	T330 F331 G332	P328-T330 PolarHBondContact O-N 2.79Å; P328-F331 PolarHBondContact O-N 3.01Å; P328-G332 PolarHBondContact O-N 2.89Å; P328-G332 VanDerWaalsContact O-N 3.08Å
329	E	68	Low	75.1	Confident	130 Å²	130	74.6 Å²	74.6	61%	0.607	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-62.3	-24.4	177.1	-59.1	77.3	-168.4	0	0	112.5	M327 F331 G332	M327-E329 PolarHBondContact O-N 2.92Å; M327-E329 VanDerWaalsContact O-N 3.13Å; E329-F331 PolarHBondContact O-N 3.31Å; E329-G332 PolarHBondContact O-N 3.44Å
330	T	68.3	Low	76.1	Confident	75 Å²	75	75.5 Å²	75.5	46%	0.46	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-64.2	-28.8	173.6	-50	0	0	0	0	111.7	M327 P328	M327-T330 WeakPolarHBondContact CB-OG1 3.43Å; M327-T330 VanDerWaalsContact O-CB 3.26Å; M327-T330 WeakPolarHBondContact O-CB 3.24Å; M327-T330 PolarHBondContact O-N 2.77Å; M327-T330 PolarHBondContact O-OG1 2.92Å; M327-T330 VanDerWaalsContact O-OG1 3.06Å; P328-T330 PolarHBondContact O-N 2.79Å
331	F	61	Low	77.3	Confident	66 Å²	66	71.8 Å²	71.8	29%	0.289	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-7.4	-176.8	-53.5	-77.5	0	0	0	112.9	F320 A323 M324 P328 E329 L474	F320-F331 HydrophobicContact CD2-CE1 4.07Å; F320-F331 HydrophobicContact CD2-CZ 4.12Å; F320-F331 HydrophobicContact CE2-CD1 4.44Å; F320-F331 AromaticContact CE2-CE1 3.59Å; F320-F331 HydrophobicContact CE2-CE1 3.59Å; F320-F331 HydrophobicContact CE2-CZ 4Å; F320-F331 HydrophobicContact CZ-CE1 4.5Å; A323-F331 HydrophobicContact CB-CE2 3.84Å; A323-F331 HydrophobicContact CB-CZ 3.84Å; M324-F331 HydrophobicContact CB-CE2 4.38Å; M324-F331 HydrophobicContact CG-CD2 4.22Å; M324-F331 HydrophobicContact CG-CE2 3.85Å; M324-F331 HydrophobicContact CG-CZ 4.05Å; P328-F331 PolarHBondContact O-N 3.01Å; E329-F331 PolarHBondContact O-N 3.31Å; F331-L474 HydrophobicContact CD1-CD1 3.99Å; F331-L474 HydrophobicContact CE1-CD1 4.29Å
332	G	56	Low	78.7	Confident	43 Å²	43	71.8 Å²	71.8	44%	0.443	38%	0.379	S	S	.	.	S	Bend	trans	-101.7	157.2	-179.6	0	0	0	0	0	113.3	P328 E329	P328-G332 PolarHBondContact O-N 2.89Å; P328-G332 VanDerWaalsContact O-N 3.08Å; E329-G332 PolarHBondContact O-N 3.44Å
333	S	66.5	Low	79.7	Confident	83 Å²	83	67.5 Å²	67.5	58%	0.58	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-80.8	125.9	165.5	54.5	0	0	0	0	109.8
334	V	72.3	Confident	80.6	Confident	100 Å²	100	70.2 Å²	70.2	61%	0.606	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-86.4	137.6	174.5	-178.6	0	0	0	0	109.6	Q465	V334-Q465 PolarHBondContact O-NE2 2.74Å
335	S	82	Confident	81.5	Confident	44 Å²	44	71.8 Å²	71.8	31%	0.308	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-73.7	131.3	174.7	-66.6	0	0	0	0	111.2
336	M	90.4	Very high	82.7	Confident	72 Å²	72	69.9 Å²	69.9	36%	0.355	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-73.4	152.5	177.6	-63.8	-55.8	-69.3	0	0	111.1	F338 F351 M457 Q465	M336-F338 HydrophobicContact CB-CD2 4.3Å; M336-F338 HydrophobicContact CB-CE2 3.96Å; M336-F338 PolarHBondContact O-N 3.11Å; M336-F351 HydrophobicContact CB-CE2 3.94Å; M336-F351 HydrophobicContact CE-CE2 3.56Å; M336-F351 HydrophobicContact CE-CZ 3.46Å; M336-F351 VanDerWaalsContact CE-CZ 3.46Å; M336-M457 HydrophobicContact CB-CE 4.04Å; M336-Q465 HydrophobicContact CG-CB 4.3Å; M336-Q465 HydrophobicContact CG-CG 3.99Å
337	L	94.4	Very high	83.6	Confident	39 Å²	39	69.6 Å²	69.6	20%	0.204	37%	0.373	C	S	.	.			trans	-80.9	110.6	-173.8	-54	-177.8	0	0	0	111.2	F351 V352 I435 L437 F451	L337-F351 WeakPolarHBondContact O-CD2 3.43Å; L337-V352 HydrophobicContact CB-CB 4.05Å; L337-V352 PolarHBondContact O-N 3.18Å; L337-I435 HydrophobicContact CD1-CG2 3.78Å; L337-L437 HydrophobicContact CD1-CD2 4.02Å; L337-L437 HydrophobicContact CD2-CD2 3.89Å; L337-F451 HydrophobicContact CB-CD1 3.89Å; L337-F451 HydrophobicContact CB-CE1 3.84Å; L337-F451 HydrophobicContact CB-CG 4.48Å; L337-F451 HydrophobicContact CB-CZ 4.4Å; L337-F451 HydrophobicContact CD1-CE1 4.34Å; L337-F451 HydrophobicContact CD1-CE2 4.43Å; L337-F451 HydrophobicContact CD1-CZ 4.09Å; L337-F451 HydrophobicContact CD2-CD1 4.27Å; L337-F451 HydrophobicContact CD2-CD2 3.9Å; L337-F451 HydrophobicContact CD2-CE1 4.42Å; L337-F451 HydrophobicContact CD2-CE2 4.07Å; L337-F451 HydrophobicContact CD2-CG 4.04Å; L337-F451 HydrophobicContact CD2-CZ 4.34Å; L337-F451 HydrophobicContact CG-CE1 4.42Å
338	F	95.2	Very high	84.5	Confident	4 Å²	4	65.5 Å²	65.5	2%	0.018	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	146.1	172.3	-77.4	-101.2	0	0	0	110.8	M336 A350 F351 M419 F451 L452 M457 C461	M336-F338 HydrophobicContact CB-CD2 4.3Å; M336-F338 HydrophobicContact CB-CE2 3.96Å; M336-F338 PolarHBondContact O-N 3.11Å; F338-A350 VanDerWaalsContact CA-O 3.29Å; F338-A350 WeakPolarHBondContact CA-O 3.17Å; F338-F351 HydrophobicContact CD1-CB 4.13Å; F338-F351 HydrophobicContact CD2-CD2 4.07Å; F338-F351 HydrophobicContact CE1-CB 3.6Å; F338-F351 HydrophobicContact CE1-CD2 4.31Å; F338-F351 HydrophobicContact CE1-CG 4.33Å; F338-F351 HydrophobicContact CE2-CB 4.4Å; F338-F351 AromaticContact CE2-CD2 3.55Å; F338-F351 HydrophobicContact CE2-CD2 3.55Å; F338-F351 HydrophobicContact CE2-CE2 4.29Å; F338-F351 HydrophobicContact CE2-CG 4.3Å; F338-F351 HydrophobicContact CZ-CB 3.75Å; F338-F351 AromaticContact CZ-CD2 3.69Å; F338-F351 HydrophobicContact CZ-CD2 3.69Å; F338-F351 AromaticContact CZ-CG 3.97Å; F338-F351 HydrophobicContact CZ-CG 3.97Å; F338-M419 HydrophobicContact CE1-CG 4.46Å; F338-M419 HydrophobicContact CE1-SD 3.91Å; F338-M419 HydrophobicContact CZ-CG 4.47Å; F338-M419 HydrophobicContact CZ-SD 3.58Å; F338-M419 VanDerWaalsContact CZ-SD 3.58Å; F338-F451 CarbonylContact O-C 3.52Å; F338-F451 VanDerWaalsContact O-CA 3.26Å; F338-F451 WeakPolarHBondContact O-CA 3.37Å; F338-L452 HydrophobicContact CB-CB 4.09Å; F338-L452 HydrophobicContact CB-CD1 3.78Å; F338-L452 HydrophobicContact CB-CG 4.07Å; F338-L452 PolarHBondContact O-N 3.01Å; F338-M457 HydrophobicContact CD2-CE 3.63Å; F338-M457 HydrophobicContact CD2-CG 4.35Å; F338-M457 HydrophobicContact CD2-SD 4.5Å; F338-M457 HydrophobicContact CE2-CE 3.5Å; F338-M457 VanDerWaalsContact CE2-CE 3.5Å; F338-C461 HydrophobicContact CE1-CB 4.14Å; F338-C461 HydrophobicContact CE2-CB 4.22Å; F338-C461 HydrophobicContact CZ-CB 3.61Å
339	I	96	Very high	85.6	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	154.4	174.7	60.8	168	0	0	0	110.7	T349 A350 V352 I402 L442 T449 F451	I339-T349 CarbonylContact O-C 3.48Å; I339-T349 VanDerWaalsContact O-CA 3.26Å; I339-T349 WeakPolarHBondContact O-CA 3.38Å; I339-A350 HydrophobicContact CG1-CB 4.05Å; I339-A350 PolarHBondContact N-O 3.33Å; I339-A350 PolarHBondContact O-N 3.4Å; I339-V352 HydrophobicContact CD1-CG2 4.18Å; I339-V352 HydrophobicContact CG1-CG2 3.96Å; I339-V352 HydrophobicContact CG2-CG2 4Å; I339-I402 HydrophobicContact CD1-CD1 3.73Å; I339-I402 HydrophobicContact CD1-CG1 4.36Å; I339-L442 HydrophobicContact CD1-CD2 3.69Å; I339-L442 HydrophobicContact CG2-CB 4.04Å; I339-L442 HydrophobicContact CG2-CD2 4.49Å; I339-T449 HydrophobicContact CB-CG2 3.94Å; I339-T449 HydrophobicContact CD1-CG2 4.21Å; I339-T449 HydrophobicContact CG2-CG2 3.75Å; I339-F451 HydrophobicContact CG2-CD1 3.63Å; I339-F451 HydrophobicContact CG2-CE1 3.78Å
340	R	95.5	Very high	86.9	Confident	137 Å²	137	57.4 Å²	57.4	52%	0.517	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	137.9	168.6	-63	-172.5	174.2	140.6	5.8	109.6	L452 E456	R340-L452 HydrophobicContact CG-CD2 3.73Å; R340-E456 IonicContact CZ-OE1 3.88Å; R340-E456 IonicContact NH2-OE1 2.71Å; R340-E456 PolarHBondContact NH2-OE1 3.07Å
341	C	96.3	Very high	88.2	Confident	5 Å²	5	54.8 Å²	54.8	3%	0.034	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	168.5	176.1	63	0	0	0	0	110.8	T348 L400 Q401 I402	C341-T348 PolarHBondContact N-O 3.46Å; C341-T348 PolarHBondContact O-N 3.26Å; C341-L400 HydrophobicContact CB-CD1 3.8Å; C341-L400 HydrophobicContact CB-CG 4.42Å; C341-Q401 CarbonylContact C-O 3.58Å; C341-Q401 VanDerWaalsContact CA-O 3.27Å; C341-Q401 WeakPolarHBondContact CA-O 3.39Å; C341-Q401 WeakPolarHBondContact CB-O 3.45Å; C341-I402 HydrophobicContact CB-CG1 4.17Å
342	K	96.8	Very high	89.8	Confident	73 Å²	73	51.9 Å²	51.9	32%	0.317	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	145.2	176.6	-65.3	169.3	174.7	177.7	0	111	F346 D347 Q401	K342-F346 VanDerWaalsContact CA-O 3.27Å; K342-F346 WeakPolarHBondContact CA-O 3.39Å; K342-D347 WeakPolarHBondContact CE-OD1 3.44Å; K342-D347 VanDerWaalsContact CE-OD2 3.31Å; K342-D347 WeakPolarHBondContact CE-OD2 3.44Å; K342-D347 WeakPolarHBondContact CG-OD1 3.4Å; K342-D347 IonicContact NZ-OD1 2.99Å; K342-Q401 HydrophobicContact CB-CB 4.1Å; K342-Q401 PolarHBondContact N-O 3.31Å; K342-Q401 PolarHBondContact O-N 2.89Å
343	V	96.2	Very high	91.6	Very high	4 Å²	4	52.1 Å²	52.1	2%	0.024	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	123.6	168.2	-177.7	0	0	0	0	108.1	N345 F346 F365 C369 L371 L400 I421	V343-N345 VanDerWaalsContact C-N 3.27Å; V343-N345 PolarHBondContact O-N 2.93Å; V343-F346 PolarHBondContact N-O 3.1Å; V343-F346 VanDerWaalsContact N-O 3.09Å; V343-F346 WeakPolarHBondContact O-CB 3.42Å; V343-F346 PolarHBondContact O-N 3.36Å; V343-F365 HydrophobicContact CB-CE1 4.03Å; V343-F365 HydrophobicContact CB-CZ 4.21Å; V343-F365 HydrophobicContact CG2-CE1 3.99Å; V343-F365 HydrophobicContact CG2-CZ 4.44Å; V343-C369 HydrophobicContact CG1-CB 4.29Å; V343-C369 PolarHBondContact O-SG 3.32Å; V343-C369 VanDerWaalsContact O-SG 3.38Å; V343-L371 HydrophobicContact CG1-CD1 3.93Å; V343-L400 HydrophobicContact CG2-CD1 3.52Å; V343-I421 HydrophobicContact CG2-CD1 3.85Å
344	N	93.3	Very high	93	Very high	78 Å²	78	51.5 Å²	51.5	42%	0.417	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	44.5	-174.6	-69.2	-12.2	0	0	0	113.6	F346 C369	N344-F346 VanDerWaalsContact O-CD2 3.29Å; N344-F346 WeakPolarHBondContact O-CD2 3.31Å; N344-F346 PolarHBondContact O-N 3.45Å; N344-C369 PolarHBondContact ND2-O 2.98Å
345	N	91.4	Very high	93.9	Very high	135 Å²	135	50 Å²	50	72%	0.722	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	10.4	-176.5	-62.7	-15.1	0	0	0	116.5	V343	V343-N345 VanDerWaalsContact C-N 3.27Å; V343-N345 PolarHBondContact O-N 2.93Å
346	F	95.6	Very high	94.3	Very high	95 Å²	95	48.9 Å²	48.9	42%	0.417	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	117.7	169	-69.6	-91.3	0	0	0	110.3	K342 V343 N344 F365 R368 C369	K342-F346 VanDerWaalsContact CA-O 3.27Å; K342-F346 WeakPolarHBondContact CA-O 3.39Å; V343-F346 PolarHBondContact N-O 3.1Å; V343-F346 VanDerWaalsContact N-O 3.09Å; V343-F346 WeakPolarHBondContact O-CB 3.42Å; V343-F346 PolarHBondContact O-N 3.36Å; N344-F346 VanDerWaalsContact O-CD2 3.29Å; N344-F346 WeakPolarHBondContact O-CD2 3.31Å; N344-F346 PolarHBondContact O-N 3.45Å; F346-F365 HydrophobicContact CB-CE2 4.19Å; F346-F365 HydrophobicContact CB-CZ 4.42Å; F346-R368 WeakPolarHBondContact CE2-O 3.44Å; F346-R368 WeakPolarHBondContact CZ-O 3.28Å; F346-C369 HydrophobicContact CD2-CB 4.47Å
347	D	94.4	Very high	94.4	Very high	109 Å²	109	54 Å²	54	58%	0.583	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.3	135.4	172.7	-75.1	-82.3	0	0	0	111.8	K342	K342-D347 WeakPolarHBondContact CE-OD1 3.44Å; K342-D347 VanDerWaalsContact CE-OD2 3.31Å; K342-D347 WeakPolarHBondContact CE-OD2 3.44Å; K342-D347 WeakPolarHBondContact CG-OD1 3.4Å; K342-D347 IonicContact NZ-OD1 2.99Å
348	T	94.2	Very high	94.3	Very high	15 Å²	15	53.3 Å²	53.3	9%	0.092	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	179	171.4	-164.9	0	0	0	0	111.5	C341 F365 D420 I421	C341-T348 PolarHBondContact N-O 3.46Å; C341-T348 PolarHBondContact O-N 3.26Å; T348-F365 HydrophobicContact CG2-CD1 4.47Å; T348-F365 HydrophobicContact CG2-CE1 3.67Å; T348-F365 HydrophobicContact CG2-CE2 3.91Å; T348-F365 HydrophobicContact CG2-CZ 3.31Å; T348-D420 HydrophobicContact CG2-CB 4.42Å; T348-D420 WeakPolarHBondContact OG1-CB 3.39Å; T348-D420 PolarHBondContact OG1-OD2 3.11Å; T348-I421 HydrophobicContact CG2-CD1 3.73Å; T348-I421 HydrophobicContact CG2-CG1 4.16Å
349	T	94.1	Very high	94.3	Very high	28 Å²	28	53.4 Å²	53.4	17%	0.172	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	131.7	172.7	61.3	0	0	0	0	109.8	I339 L452 P458	I339-T349 CarbonylContact O-C 3.48Å; I339-T349 VanDerWaalsContact O-CA 3.26Å; I339-T349 WeakPolarHBondContact O-CA 3.38Å; T349-L452 HydrophobicContact CG2-CD1 3.51Å; T349-P458 HydrophobicContact CG2-CG 4.39Å; T349-P458 WeakPolarHBondContact OG1-CG 3.31Å
350	A	95.2	Very high	94.2	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	133.9	174.2	0	0	0	0	0	110.7	F338 I339 I421 F423	F338-A350 VanDerWaalsContact CA-O 3.29Å; F338-A350 WeakPolarHBondContact CA-O 3.17Å; I339-A350 HydrophobicContact CG1-CB 4.05Å; I339-A350 PolarHBondContact N-O 3.33Å; I339-A350 PolarHBondContact O-N 3.4Å; A350-I421 WeakPolarHBondContact CA-O 3.48Å; A350-I421 HydrophobicContact CB-CB 3.87Å; A350-I421 HydrophobicContact CB-CG2 3.88Å; A350-F423 HydrophobicContact CB-CB 4.38Å
351	F	94.9	Very high	94.2	Very high	21 Å²	21	48.2 Å²	48.2	9%	0.092	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	122.2	170.7	176.8	-127.2	0	0	0	109.9	M336 L337 F338 D353 M419 I421 L422 F423	M336-F351 HydrophobicContact CB-CE2 3.94Å; M336-F351 HydrophobicContact CE-CE2 3.56Å; M336-F351 HydrophobicContact CE-CZ 3.46Å; M336-F351 VanDerWaalsContact CE-CZ 3.46Å; L337-F351 WeakPolarHBondContact O-CD2 3.43Å; F338-F351 HydrophobicContact CD1-CB 4.13Å; F338-F351 HydrophobicContact CD2-CD2 4.07Å; F338-F351 HydrophobicContact CE1-CB 3.6Å; F338-F351 HydrophobicContact CE1-CD2 4.31Å; F338-F351 HydrophobicContact CE1-CG 4.33Å; F338-F351 HydrophobicContact CE2-CB 4.4Å; F338-F351 AromaticContact CE2-CD2 3.55Å; F338-F351 HydrophobicContact CE2-CD2 3.55Å; F338-F351 HydrophobicContact CE2-CE2 4.29Å; F338-F351 HydrophobicContact CE2-CG 4.3Å; F338-F351 HydrophobicContact CZ-CB 3.75Å; F338-F351 AromaticContact CZ-CD2 3.69Å; F338-F351 HydrophobicContact CZ-CD2 3.69Å; F338-F351 AromaticContact CZ-CG 3.97Å; F338-F351 HydrophobicContact CZ-CG 3.97Å; F351-D353 HydrophobicContact CD1-CB 3.98Å; F351-D353 HydrophobicContact CE1-CB 3.58Å; F351-D353 HydrophobicContact CZ-CB 4.04Å; F351-M419 HydrophobicContact CB-CE 3.76Å; F351-M419 HydrophobicContact CB-SD 3.37Å; F351-M419 WeakPolarHBondContact CB-SD 3.26Å; F351-M419 HydrophobicContact CD1-CE 3.25Å; F351-M419 HydrophobicContact CD1-SD 3.73Å; F351-M419 HydrophobicContact CD2-SD 4.33Å; F351-M419 HydrophobicContact CE1-CE 4.05Å; F351-M419 HydrophobicContact CG-CE 3.72Å; F351-M419 HydrophobicContact CG-SD 3.54Å; F351-M419 VanDerWaalsContact CG-SD 3.54Å; F351-I421 PolarHBondContact N-O 3.42Å; F351-L422 HydrophobicContact CD1-CD1 4.12Å; F351-L422 HydrophobicContact CD1-CG 4Å; F351-L422 CarbonylContact O-C 3.58Å; F351-F423 PolarHBondContact O-N 3.45Å
352	V	95.9	Very high	94.1	Very high	5 Å²	5	48.1 Å²	48.1	3%	0.03	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	111.3	-177.7	-178.7	0	0	0	0	109	L337 I339 L428 I435 L442 F451	L337-V352 HydrophobicContact CB-CB 4.05Å; L337-V352 PolarHBondContact O-N 3.18Å; I339-V352 HydrophobicContact CD1-CG2 4.18Å; I339-V352 HydrophobicContact CG1-CG2 3.96Å; I339-V352 HydrophobicContact CG2-CG2 4Å; V352-L428 HydrophobicContact CG1-CD1 4.19Å; V352-L428 HydrophobicContact CG1-CD2 4.06Å; V352-I435 HydrophobicContact CG1-CD1 3.94Å; V352-I435 HydrophobicContact CG1-CG1 4.27Å; V352-L442 HydrophobicContact CG1-CD1 4.41Å; V352-L442 HydrophobicContact CG2-CD2 4.44Å; V352-F451 HydrophobicContact CB-CE1 4.43Å; V352-F451 HydrophobicContact CG2-CE1 4.22Å
353	D	94	Very high	94	Very high	47 Å²	47	47.4 Å²	47.4	25%	0.251	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	104.2	-174.5	-170.8	-5.7	0	0	0	111.2	F351 G355 A356 L422 F423 G424	F351-D353 HydrophobicContact CD1-CB 3.98Å; F351-D353 HydrophobicContact CE1-CB 3.58Å; F351-D353 HydrophobicContact CZ-CB 4.04Å; D353-G355 PolarHBondContact O-N 2.76Å; D353-G355 VanDerWaalsContact OD1-CA 3.31Å; D353-G355 WeakPolarHBondContact OD1-CA 3.34Å; D353-G355 PolarHBondContact OD1-N 3.31Å; D353-A356 HydrophobicContact CB-CB 4.04Å; D353-A356 PolarHBondContact O-N 3.2Å; D353-A356 PolarHBondContact OD1-N 3.06Å; D353-L422 HydrophobicContact CB-CD2 4.21Å; D353-L422 HydrophobicContact CB-CG 4.42Å; D353-F423 PolarHBondContact N-O 3.46Å; D353-G424 WeakPolarHBondContact O-CA 3.22Å
354	S	94.5	Very high	93.9	Very high	70 Å²	70	52.1 Å²	52.1	49%	0.49	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-15.1	174.7	61.2	0	0	0	0	113.2
355	G	92.7	Very high	94	Very high	70 Å²	70	48.4 Å²	48.4	72%	0.722	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-19	173.7	0	0	0	0	0	113.5	D353	D353-G355 PolarHBondContact O-N 2.76Å; D353-G355 VanDerWaalsContact OD1-CA 3.31Å; D353-G355 WeakPolarHBondContact OD1-CA 3.34Å; D353-G355 PolarHBondContact OD1-N 3.31Å
356	A	90.5	Very high	94.2	Very high	19 Å²	19	42 Å²	42	16%	0.157	24%	0.242	C	C	.	.			trans	-83.1	126.3	176.7	0	0	0	0	0	111.9	D353 A358 L422 L425	D353-A356 HydrophobicContact CB-CB 4.04Å; D353-A356 PolarHBondContact O-N 3.2Å; D353-A356 PolarHBondContact OD1-N 3.06Å; A356-A358 VanDerWaalsContact C-N 3.3Å; A356-A358 PolarHBondContact O-N 3.16Å; A356-L422 HydrophobicContact CB-CD1 4.4Å; A356-L422 HydrophobicContact CB-CD2 3.41Å; A356-L422 VanDerWaalsContact CB-CD2 3.41Å; A356-L425 VanDerWaalsContact O-CB 3.26Å; A356-L425 WeakPolarHBondContact O-CB 3.32Å; A356-L425 PolarHBondContact O-N 2.94Å
357	Q	91	Very high	94.2	Very high	180 Å²	180	43.7 Å²	43.7	84%	0.841	25%	0.251	S	S	*	.	S	Bend	trans	-68.4	-28.3	-179.6	-175.4	175.5	-13.6	0	0	113.4	D426	Q357-D426 WeakPolarHBondContact O-CB 3.33Å
358	A	92.6	Very high	94.3	Very high	25 Å²	25	43.9 Å²	43.9	21%	0.207	24%	0.244	C	C	.	.	S	Bend	trans	-135.4	146.5	-172.4	0	0	0	0	0	112	A356 M412 D426	A356-A358 VanDerWaalsContact C-N 3.3Å; A356-A358 PolarHBondContact O-N 3.16Å; A358-M412 HydrophobicContact CB-CE 3.42Å; A358-M412 VanDerWaalsContact CB-CE 3.42Å; A358-M412 HydrophobicContact CB-SD 4.4Å; A358-D426 WeakPolarHBondContact CA-OD2 3.49Å
359	T	95.4	Very high	94.3	Very high	5 Å²	5	43.4 Å²	43.4	3%	0.031	24%	0.241	C	C	.	.			trans	-78.4	133.2	173.9	-66.8	0	0	0	0	110.2	C411 M412 L422 F423 G424 D426 M427	T359-C411 HydrophobicContact CG2-CB 3.96Å; T359-C411 VanDerWaalsContact O-CA 3.28Å; T359-C411 WeakPolarHBondContact O-CA 3.27Å; T359-M412 PolarHBondContact O-N 3.5Å; T359-L422 CarbonylContact C-O 3.5Å; T359-L422 VanDerWaalsContact CA-O 3.27Å; T359-L422 WeakPolarHBondContact CA-O 3.3Å; T359-L422 VanDerWaalsContact CG2-O 3.31Å; T359-L422 WeakPolarHBondContact CG2-O 3.44Å; T359-F423 HydrophobicContact CG2-CD2 4.25Å; T359-G424 PolarHBondContact OG1-N 3.28Å; T359-D426 WeakPolarHBondContact CB-OD1 3.31Å; T359-D426 VanDerWaalsContact N-CG 3.32Å; T359-D426 PolarHBondContact N-OD1 3.11Å; T359-D426 PolarHBondContact N-OD2 3.4Å; T359-D426 VanDerWaalsContact N-OD2 3.08Å; T359-D426 PolarHBondContact OG1-OD1 3.02Å; T359-M427 HydrophobicContact CG2-CG 4.12Å; T359-M427 WeakPolarHBondContact OG1-CB 3.43Å; T359-M427 WeakPolarHBondContact OG1-CG 3.39Å
360	I	94.5	Very high	94.3	Very high	23 Å²	23	44 Å²	44	12%	0.118	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	142.3	-174.4	-50.9	176.4	0	0	0	110.1	M412 V414 I421 L422	I360-M412 CarbonylContact C-O 3.58Å; I360-M412 WeakPolarHBondContact CA-O 3.48Å; I360-M412 HydrophobicContact CD1-CE 4.37Å; I360-M412 HydrophobicContact CG1-CE 4.07Å; I360-M412 WeakPolarHBondContact CG2-O 3.39Å; I360-V414 HydrophobicContact CG2-CB 3.64Å; I360-V414 HydrophobicContact CG2-CG2 3.41Å; I360-V414 VanDerWaalsContact CG2-CG2 3.41Å; I360-I421 WeakPolarHBondContact O-CA 3.1Å; I360-L422 HydrophobicContact CB-CB 4.23Å; I360-L422 PolarHBondContact N-O 2.97Å; I360-L422 PolarHBondContact O-N 3.45Å
361	I	95.4	Very high	94.3	Very high	5 Å²	5	44 Å²	44	3%	0.026	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	138.6	171.2	-168.7	164.7	0	0	0	109.4	F365 A366 L371 C411 M412 V413 V414 D420 I421	I361-F365 HydrophobicContact CD1-CD1 3.56Å; I361-F365 HydrophobicContact CD1-CE1 4.05Å; I361-F365 HydrophobicContact CG1-CB 4.38Å; I361-F365 HydrophobicContact CG1-CD1 3.71Å; I361-A366 HydrophobicContact CG1-CB 4.49Å; I361-A366 HydrophobicContact CG2-CB 4.43Å; I361-L371 HydrophobicContact CD1-CD1 3.66Å; I361-C411 HydrophobicContact CB-CB 4.45Å; I361-C411 HydrophobicContact CG2-CB 4.22Å; I361-M412 PolarHBondContact N-O 2.79Å; I361-V413 HydrophobicContact CG2-CB 4.16Å; I361-V413 HydrophobicContact CG2-CG1 4.23Å; I361-V413 HydrophobicContact CG2-CG2 3.67Å; I361-V413 WeakPolarHBondContact O-CA 3.35Å; I361-V414 PolarHBondContact O-N 3.39Å; I361-D420 WeakPolarHBondContact CA-O 3.32Å; I361-I421 HydrophobicContact CG1-CG1 4.37Å
362	S	94.1	Very high	94.4	Very high	3 Å²	3	46.2 Å²	46.2	2%	0.021	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	149.9	176	70.8	0	0	0	0	111.2	D364 F365 A366 D420	S362-D364 VanDerWaalsContact C-N 3.34Å; S362-D364 PolarHBondContact O-N 3.14Å; S362-F365 PolarHBondContact O-N 3.15Å; S362-F365 WeakPolarHBondContact OG-CB 3.49Å; S362-F365 PolarHBondContact OG-N 3.4Å; S362-F365 VanDerWaalsContact OG-N 3.15Å; S362-A366 WeakPolarHBondContact O-CB 3.34Å; S362-A366 PolarHBondContact O-N 3.49Å; S362-D420 PolarHBondContact N-O 3.31Å
363	E	94.9	Very high	94.4	Very high	58 Å²	58	55.7 Å²	55.7	27%	0.271	30%	0.299	S	S	.	.	H	α-helix	trans	-54.1	-50.1	172.1	-179.8	174.2	-149.6	0	0	111.6	F365 A366 E367 M372 L392 V414	E363-F365 VanDerWaalsContact C-N 3.29Å; E363-F365 PolarHBondContact O-N 3.49Å; E363-A366 PolarHBondContact O-N 3.07Å; E363-A366 VanDerWaalsContact O-N 3.14Å; E363-E367 PolarHBondContact O-N 3.05Å; E363-M372 HydrophobicContact CG-CE 4.38Å; E363-L392 HydrophobicContact CB-CD1 3.78Å; E363-L392 VanDerWaalsContact CD-CD1 3.42Å; E363-L392 HydrophobicContact CG-CD1 3.56Å; E363-L392 WeakPolarHBondContact OE1-CD1 3.34Å; E363-V414 PolarHBondContact N-O 3.01Å
364	D	94	Very high	94.5	Very high	104 Å²	104	56.4 Å²	56.4	56%	0.556	30%	0.302	S	S	*	.	H	α-helix	trans	-57.8	-40.6	-178.9	-61.3	-13.8	0	0	0	112.2	S362 R368	S362-D364 VanDerWaalsContact C-N 3.34Å; S362-D364 PolarHBondContact O-N 3.14Å; D364-R368 WeakPolarHBondContact O-CG 3.49Å; D364-R368 PolarHBondContact O-N 3.44Å; D364-R368 VanDerWaalsContact O-N 3.14Å
365	F	95.2	Very high	94.5	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-74.8	-38.9	177.8	-170.8	-119.4	0	0	0	112	V343 F346 T348 I361 S362 E363 E367 R368 C369 D420 I421	V343-F365 HydrophobicContact CB-CE1 4.03Å; V343-F365 HydrophobicContact CB-CZ 4.21Å; V343-F365 HydrophobicContact CG2-CE1 3.99Å; V343-F365 HydrophobicContact CG2-CZ 4.44Å; F346-F365 HydrophobicContact CB-CE2 4.19Å; F346-F365 HydrophobicContact CB-CZ 4.42Å; T348-F365 HydrophobicContact CG2-CD1 4.47Å; T348-F365 HydrophobicContact CG2-CE1 3.67Å; T348-F365 HydrophobicContact CG2-CE2 3.91Å; T348-F365 HydrophobicContact CG2-CZ 3.31Å; I361-F365 HydrophobicContact CD1-CD1 3.56Å; I361-F365 HydrophobicContact CD1-CE1 4.05Å; I361-F365 HydrophobicContact CG1-CB 4.38Å; I361-F365 HydrophobicContact CG1-CD1 3.71Å; S362-F365 PolarHBondContact O-N 3.15Å; S362-F365 WeakPolarHBondContact OG-CB 3.49Å; S362-F365 PolarHBondContact OG-N 3.4Å; S362-F365 VanDerWaalsContact OG-N 3.15Å; E363-F365 VanDerWaalsContact C-N 3.29Å; E363-F365 PolarHBondContact O-N 3.49Å; F365-E367 VanDerWaalsContact C-N 3.27Å; F365-E367 PolarHBondContact O-N 3.43Å; F365-R368 VanDerWaalsContact CD2-CZ 3.43Å; F365-R368 VanDerWaalsContact CE2-NH2 3.32Å; F365-R368 PolarHBondContact O-N 2.99Å; F365-C369 VanDerWaalsContact CE1-SG 3.58Å; F365-C369 VanDerWaalsContact CE2-SG 3.51Å; F365-C369 WeakPolarHBondContact CZ-SG 3.36Å; F365-C369 WeakPolarHBondContact O-CB 3.47Å; F365-C369 PolarHBondContact O-N 2.93Å; F365-C369 PolarHBondContact O-SG 2.91Å; F365-D420 HydrophobicContact CB-CB 3.91Å; F365-D420 HydrophobicContact CD1-CB 4.05Å; F365-D420 HydrophobicContact CD2-CB 4.13Å; F365-D420 WeakPolarHBondContact CD2-OD2 3.15Å; F365-D420 HydrophobicContact CG-CB 3.75Å; F365-I421 HydrophobicContact CD1-CD1 4.26Å; F365-I421 HydrophobicContact CD1-CG1 3.88Å; F365-I421 HydrophobicContact CE1-CD1 3.72Å; F365-I421 HydrophobicContact CE1-CG1 3.86Å
366	A	95.8	Very high	94.7	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-61.2	-36.4	174.6	0	0	0	0	0	112.2	I361 S362 E363 G370 L371 M372 V413	I361-A366 HydrophobicContact CG1-CB 4.49Å; I361-A366 HydrophobicContact CG2-CB 4.43Å; S362-A366 WeakPolarHBondContact O-CB 3.34Å; S362-A366 PolarHBondContact O-N 3.49Å; E363-A366 PolarHBondContact O-N 3.07Å; E363-A366 VanDerWaalsContact O-N 3.14Å; A366-G370 PolarHBondContact O-N 2.73Å; A366-L371 HydrophobicContact CB-CB 4.24Å; A366-L371 WeakPolarHBondContact O-CB 3.35Å; A366-L371 PolarHBondContact O-N 3.2Å; A366-M372 HydrophobicContact CB-SD 4.15Å; A366-V413 HydrophobicContact CB-CG1 3.88Å
367	E	96	Very high	94.9	Very high	130 Å²	130	59.1 Å²	59.1	61%	0.607	28%	0.279	S	S	*	.	H	α-helix	trans	-65.2	-51.6	173	-171.2	172.5	-158.5	0	0	111.8	E363 F365 C369 G370 M372	E363-E367 PolarHBondContact O-N 3.05Å; F365-E367 VanDerWaalsContact C-N 3.27Å; F365-E367 PolarHBondContact O-N 3.43Å; E367-C369 VanDerWaalsContact C-N 3.28Å; E367-C369 PolarHBondContact O-N 3.5Å; E367-G370 PolarHBondContact O-N 3.12Å; E367-M372 HydrophobicContact CB-CG 4.04Å; E367-M372 HydrophobicContact CB-SD 4.15Å; E367-M372 HydrophobicContact CG-CG 4.27Å
368	R	94.8	Very high	95	Very high	114 Å²	114	59.9 Å²	59.9	43%	0.43	27%	0.274	S	S	.	.	H	α-helix	trans	-53.5	-43.4	176	-79.5	162	43.8	-156.3	-5.3	112.5	F346 D364 F365 G370 D420	F346-R368 WeakPolarHBondContact CE2-O 3.44Å; F346-R368 WeakPolarHBondContact CZ-O 3.28Å; D364-R368 WeakPolarHBondContact O-CG 3.49Å; D364-R368 PolarHBondContact O-N 3.44Å; D364-R368 VanDerWaalsContact O-N 3.14Å; F365-R368 VanDerWaalsContact CD2-CZ 3.43Å; F365-R368 VanDerWaalsContact CE2-NH2 3.32Å; F365-R368 PolarHBondContact O-N 2.99Å; R368-G370 VanDerWaalsContact C-N 3.27Å; R368-G370 PolarHBondContact O-N 2.81Å; R368-D420 IonicContact CZ-OD2 2.79Å; R368-D420 IonicContact NH1-OD1 2.88Å; R368-D420 PolarHBondContact NH1-OD1 3.04Å; R368-D420 IonicContact NH1-OD2 2.86Å; R368-D420 PolarHBondContact NH1-OD2 2.66Å; R368-D420 VanDerWaalsContact NH1-OD2 3.14Å; R368-D420 IonicContact NH2-OD2 2.92Å; R368-D420 PolarHBondContact NH2-OD2 3.13Å; R368-D420 VanDerWaalsContact NH2-OD2 3.08Å
369	C	95.2	Very high	94.9	Very high	5 Å²	5	63.4 Å²	63.4	3%	0.034	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-2.4	-180	-68.2	0	0	0	0	114.4	V343 N344 F346 F365 E367 L371	V343-C369 HydrophobicContact CG1-CB 4.29Å; V343-C369 PolarHBondContact O-SG 3.32Å; V343-C369 VanDerWaalsContact O-SG 3.38Å; N344-C369 PolarHBondContact ND2-O 2.98Å; F346-C369 HydrophobicContact CD2-CB 4.47Å; F365-C369 VanDerWaalsContact CE1-SG 3.58Å; F365-C369 VanDerWaalsContact CE2-SG 3.51Å; F365-C369 WeakPolarHBondContact CZ-SG 3.36Å; F365-C369 WeakPolarHBondContact O-CB 3.47Å; F365-C369 PolarHBondContact O-N 2.93Å; F365-C369 PolarHBondContact O-SG 2.91Å; E367-C369 VanDerWaalsContact C-N 3.28Å; E367-C369 PolarHBondContact O-N 3.5Å; C369-L371 VanDerWaalsContact C-N 3.29Å; C369-L371 HydrophobicContact CB-CD1 4.07Å; C369-L371 HydrophobicContact CB-CG 3.85Å; C369-L371 PolarHBondContact O-N 3.3Å
370	G	94.8	Very high	94.5	Very high	39 Å²	39	66.6 Å²	66.6	40%	0.402	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.9	25.9	-177.1	0	0	0	0	0	114.1	A366 E367 R368	A366-G370 PolarHBondContact O-N 2.73Å; E367-G370 PolarHBondContact O-N 3.12Å; R368-G370 VanDerWaalsContact C-N 3.27Å; R368-G370 PolarHBondContact O-N 2.81Å
371	L	95.2	Very high	94.2	Very high	2 Å²	2	67.2 Å²	67.2	1%	0.01	32%	0.32	C	S	.	.			trans	-84.7	-10	179.8	-61.8	177.5	0	0	0	113.2	V343 I361 A366 C369 R373 L374 A398	V343-L371 HydrophobicContact CG1-CD1 3.93Å; I361-L371 HydrophobicContact CD1-CD1 3.66Å; A366-L371 HydrophobicContact CB-CB 4.24Å; A366-L371 WeakPolarHBondContact O-CB 3.35Å; A366-L371 PolarHBondContact O-N 3.2Å; C369-L371 VanDerWaalsContact C-N 3.29Å; C369-L371 HydrophobicContact CB-CD1 4.07Å; C369-L371 HydrophobicContact CB-CG 3.85Å; C369-L371 PolarHBondContact O-N 3.3Å; L371-R373 PolarHBondContact O-N 2.92Å; L371-R373 VanDerWaalsContact O-N 3.09Å; L371-L374 HydrophobicContact CD2-CD1 3.92Å; L371-L374 WeakPolarHBondContact O-CA 3.42Å; L371-L374 WeakPolarHBondContact O-CB 3.4Å; L371-L374 PolarHBondContact O-N 3.44Å; L371-A398 HydrophobicContact CD2-CB 4.33Å
372	M	95.6	Very high	93.4	Very high	66 Å²	66	71.5 Å²	71.5	33%	0.325	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-53.2	-36.2	-176.8	-61.2	-58.5	-81.7	0	0	113.4	E363 A366 E367 L374 I375	E363-M372 HydrophobicContact CG-CE 4.38Å; A366-M372 HydrophobicContact CB-SD 4.15Å; E367-M372 HydrophobicContact CB-CG 4.04Å; E367-M372 HydrophobicContact CB-SD 4.15Å; E367-M372 HydrophobicContact CG-CG 4.27Å; M372-L374 PolarHBondContact O-N 3.45Å; M372-I375 HydrophobicContact CE-CD1 4.28Å; M372-I375 PolarHBondContact O-N 3.26Å; M372-I375 HydrophobicContact SD-CD1 3.67Å
373	R	95.6	Very high	92.3	Very high	204 Å²	204	72.3 Å²	72.3	77%	0.77	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-69.5	-15.4	177.4	70.6	-177.2	-179.8	83.5	1.2	114.4	L371	L371-R373 PolarHBondContact O-N 2.92Å; L371-R373 VanDerWaalsContact O-N 3.09Å
374	L	95.8	Very high	90.7	Very high	62 Å²	62	77.7 Å²	77.7	33%	0.325	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-99.4	-1.8	-178	-58.7	178.5	0	0	0	112.5	L371 M372 D376 V395	L371-L374 HydrophobicContact CD2-CD1 3.92Å; L371-L374 WeakPolarHBondContact O-CA 3.42Å; L371-L374 WeakPolarHBondContact O-CB 3.4Å; L371-L374 PolarHBondContact O-N 3.44Å; M372-L374 PolarHBondContact O-N 3.45Å; L374-D376 PolarHBondContact O-N 3.15Å; L374-V395 HydrophobicContact CB-CG1 4.08Å; L374-V395 HydrophobicContact CB-CG2 4.38Å
375	I	95.7	Very high	89.2	Confident	20 Å²	20	76 Å²	76	10%	0.103	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	111.7	-178.2	-57.4	-179.3	0	0	0	109.7	M372 R377 V395 V413	M372-I375 HydrophobicContact CE-CD1 4.28Å; M372-I375 PolarHBondContact O-N 3.26Å; M372-I375 HydrophobicContact SD-CD1 3.67Å; I375-R377 HydrophobicContact CG2-CG 4.42Å; I375-R377 PolarHBondContact O-N 2.95Å; I375-V395 HydrophobicContact CG1-CG2 4.08Å; I375-V413 HydrophobicContact CD1-CB 4.08Å; I375-V413 HydrophobicContact CD1-CG1 3.94Å; I375-V413 HydrophobicContact CD1-CG2 3.82Å; I375-V413 HydrophobicContact CG1-CG2 3.84Å; I375-V413 HydrophobicContact CG2-CG2 4.49Å
376	D	96.1	Very high	87.3	Confident	25 Å²	25	84.2 Å²	84.2	13%	0.134	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	101.4	169.7	-171.9	-9.8	0	0	0	110.2	L374 R378 F379 G393 R394 H396	L374-D376 PolarHBondContact O-N 3.15Å; D376-R378 PolarHBondContact O-N 3.5Å; D376-R378 VanDerWaalsContact OD1-CB 3.27Å; D376-R378 WeakPolarHBondContact OD1-CB 3.48Å; D376-R378 VanDerWaalsContact OD1-CG 3.31Å; D376-R378 WeakPolarHBondContact OD1-CG 3.47Å; D376-R378 IonicContact OD1-CZ 3.86Å; D376-R378 PolarHBondContact OD1-N 2.96Å; D376-R378 VanDerWaalsContact OD1-N 3.09Å; D376-R378 IonicContact OD1-NE 2.95Å; D376-R378 PolarHBondContact OD1-NE 2.81Å; D376-R378 IonicContact OD1-NH2 3.21Å; D376-R378 IonicContact OD2-CZ 3.34Å; D376-R378 IonicContact OD2-NE 3.18Å; D376-R378 PolarHBondContact OD2-NE 3.15Å; D376-R378 IonicContact OD2-NH2 2.82Å; D376-R378 PolarHBondContact OD2-NH2 3.25Å; D376-F379 HydrophobicContact CB-CD2 4.16Å; D376-F379 PolarHBondContact O-N 3.37Å; D376-F379 WeakPolarHBondContact OD2-CE2 3.24Å; D376-G393 WeakPolarHBondContact O-CA 3.4Å; D376-R394 WeakPolarHBondContact CB-O 3.26Å; D376-R394 PolarHBondContact N-O 3.41Å; D376-R394 PolarHBondContact O-N 3.36Å; D376-R394 VanDerWaalsContact O-N 3.1Å; D376-H396 WeakPolarHBondContact CB-NE2 3.46Å; D376-H396 IonicContact OD2-CD2 2.71Å; D376-H396 IonicContact OD2-CE1 3.61Å; D376-H396 IonicContact OD2-NE2 3.58Å; D376-H396 PolarHBondContact OD2-NE2 3.31Å
377	R	95.2	Very high	85.8	Confident	171 Å²	171	86.4 Å²	86.4	65%	0.645	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-69.6	-10	-178	-65.4	-176.8	178.5	-111.8	-0.1	113.9	I375 F379 S380	I375-R377 HydrophobicContact CG2-CG 4.42Å; I375-R377 PolarHBondContact O-N 2.95Å; R377-F379 PolarHBondContact O-N 3.42Å; R377-S380 VanDerWaalsContact O-CB 3.26Å; R377-S380 WeakPolarHBondContact O-CB 3.4Å; R377-S380 PolarHBondContact O-N 3.28Å; R377-S380 PolarHBondContact O-OG 3.41Å
378	R	92.2	Very high	84.5	Confident	197 Å²	197	85.9 Å²	85.9	74%	0.743	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-63.8	-21.5	172.6	-61.3	177.4	-64.9	172.8	2.1	112.2	D376	D376-R378 PolarHBondContact O-N 3.5Å; D376-R378 VanDerWaalsContact OD1-CB 3.27Å; D376-R378 WeakPolarHBondContact OD1-CB 3.48Å; D376-R378 VanDerWaalsContact OD1-CG 3.31Å; D376-R378 WeakPolarHBondContact OD1-CG 3.47Å; D376-R378 IonicContact OD1-CZ 3.86Å; D376-R378 PolarHBondContact OD1-N 2.96Å; D376-R378 VanDerWaalsContact OD1-N 3.09Å; D376-R378 IonicContact OD1-NE 2.95Å; D376-R378 PolarHBondContact OD1-NE 2.81Å; D376-R378 IonicContact OD1-NH2 3.21Å; D376-R378 IonicContact OD2-CZ 3.34Å; D376-R378 IonicContact OD2-NE 3.18Å; D376-R378 PolarHBondContact OD2-NE 3.15Å; D376-R378 IonicContact OD2-NH2 2.82Å; D376-R378 PolarHBondContact OD2-NH2 3.25Å
379	F	90.8	Very high	83.8	Confident	98 Å²	98	82.4 Å²	82.4	43%	0.43	46%	0.457	S	S	.	.	G	3₁₀ helix	trans	-98.2	20.3	175.7	-64.8	-96.1	0	0	0	112.4	D376 R377 R394 H396	D376-F379 HydrophobicContact CB-CD2 4.16Å; D376-F379 PolarHBondContact O-N 3.37Å; D376-F379 WeakPolarHBondContact OD2-CE2 3.24Å; R377-F379 PolarHBondContact O-N 3.42Å; F379-R394 HydrophobicContact CB-CB 3.64Å; F379-R394 HydrophobicContact CD2-CB 4.32Å; F379-R394 HydrophobicContact CG-CB 3.96Å; F379-H396 AromaticContact CD2-CE1 3.92Å; F379-H396 AromaticContact CE2-CE1 3.44Å; F379-H396 VanDerWaalsContact CE2-CE1 3.44Å; F379-H396 WeakPolarHBondContact CE2-CE1 3.34Å; F379-H396 AromaticContact CE2-NE2 3.8Å; F379-H396 AromaticContact CZ-CE1 3.87Å
380	S	88.3	Confident	83.6	Confident	73 Å²	73	87.6 Å²	87.6	51%	0.51	48%	0.479	S	S	.	.			trans	-70	153.5	171.3	57.4	0	0	0	0	110.9	R377 I391 L392	R377-S380 VanDerWaalsContact O-CB 3.26Å; R377-S380 WeakPolarHBondContact O-CB 3.4Å; R377-S380 PolarHBondContact O-N 3.28Å; R377-S380 PolarHBondContact O-OG 3.41Å; S380-I391 VanDerWaalsContact CA-O 3.32Å; S380-I391 WeakPolarHBondContact CA-O 3.49Å; S380-I391 WeakPolarHBondContact CB-O 3.49Å; S380-L392 WeakPolarHBondContact CB-O 3.37Å
381	G	86.6	Confident	83.5	Confident	36 Å²	36	86.5 Å²	86.5	37%	0.371	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	173.4	-160.6	-175.5	0	0	0	0	0	112	I391	G381-I391 PolarHBondContact N-O 3.23Å; G381-I391 VanDerWaalsContact N-O 3.11Å; G381-I391 PolarHBondContact O-N 2.67Å
382	V	78.7	Confident	83.4	Confident	95 Å²	95	87.2 Å²	87.2	58%	0.576	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.2	122.3	173.7	-178.4	0	0	0	0	107.4	C389	V382-C389 CarbonylContact C-O 3.14Å; V382-C389 WeakPolarHBondContact CA-O 3.39Å
383	A	70.6	Confident	83.3	Confident	20 Å²	20	84.1 Å²	84.1	17%	0.165	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	123.5	170.1	0	0	0	0	0	108	T388 C389 I391	A383-T388 WeakPolarHBondContact O-CA 3.36Å; A383-C389 WeakPolarHBondContact CB-SG 3.29Å; A383-C389 PolarHBondContact N-O 3.33Å; A383-C389 PolarHBondContact O-N 2.87Å; A383-C389 VanDerWaalsContact O-N 3.1Å; A383-I391 HydrophobicContact CB-CD1 3.7Å; A383-I391 HydrophobicContact CB-CG1 3.75Å
384	M	61.5	Low	83.3	Confident	171 Å²	171	78.1 Å²	78.1	84%	0.842	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.9	121.1	172.3	-62.8	-174.9	-65.1	0	0	108.2
385	G	63.8	Low	83.4	Confident	67 Å²	67	75.1 Å²	75.1	69%	0.691	41%	0.414	S	S	*	.	S	Bend	trans	-157.2	-131	174.5	0	0	0	0	0	109.5	G387	G385-G387 PolarHBondContact N-O 3.48Å; G385-G387 PolarHBondContact O-N 2.83Å
386	V	55.3	Low	83.4	Confident	174 Å²	174	78 Å²	78	100%	1.055	43%	0.427	S	S	*	.	S	Bend	trans	-66.2	3.8	171.7	-129	0	0	0	0	113.6
387	G	63.9	Low	83.4	Confident	45 Å²	45	82.4 Å²	82.4	46%	0.464	45%	0.45	S	S	.	.	S	Bend	trans	-169.4	175.7	171.5	0	0	0	0	0	109.9	G385	G385-G387 PolarHBondContact N-O 3.48Å; G385-G387 PolarHBondContact O-N 2.83Å
388	T	68.8	Low	83.4	Confident	120 Å²	120	74.8 Å²	74.8	74%	0.736	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.4	115.5	170.4	54	0	0	0	0	108.9	A383	A383-T388 WeakPolarHBondContact O-CA 3.36Å
389	C	80.8	Confident	83.6	Confident	40 Å²	40	70.9 Å²	70.9	27%	0.27	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	145.8	175.8	58	0	0	0	0	110.7	V382 A383 V414	V382-C389 CarbonylContact C-O 3.14Å; V382-C389 WeakPolarHBondContact CA-O 3.39Å; A383-C389 WeakPolarHBondContact CB-SG 3.29Å; A383-C389 PolarHBondContact N-O 3.33Å; A383-C389 PolarHBondContact O-N 2.87Å; A383-C389 VanDerWaalsContact O-N 3.1Å; C389-V414 HydrophobicContact CB-CG1 3.5Å; C389-V414 VanDerWaalsContact CB-CG1 3.5Å; C389-V414 WeakPolarHBondContact SG-CG1 3.42Å
390	K	90	Very high	83.9	Confident	114 Å²	114	66.4 Å²	66.4	50%	0.496	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	123	-178.6	-177.6	171.6	162.2	-136.1	0	109.2	V414 E415	K390-V414 WeakPolarHBondContact O-CA 3.44Å; K390-E415 HydrophobicContact CB-CB 4.48Å; K390-E415 HydrophobicContact CB-CG 4.32Å; K390-E415 WeakPolarHBondContact CD-OE1 3.46Å; K390-E415 WeakPolarHBondContact CE-OE1 3.05Å; K390-E415 IonicContact NZ-OE1 2.81Å; K390-E415 PolarHBondContact NZ-OE1 3.35Å; K390-E415 IonicContact NZ-OE2 3.73Å; K390-E415 PolarHBondContact O-N 3.32Å
391	I	91.9	Very high	84.3	Confident	17 Å²	17	64.3 Å²	64.3	9%	0.087	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	117.7	174.7	-56.2	166.5	0	0	0	107.6	S380 G381 A383 M412 V413 V414	S380-I391 VanDerWaalsContact CA-O 3.32Å; S380-I391 WeakPolarHBondContact CA-O 3.49Å; S380-I391 WeakPolarHBondContact CB-O 3.49Å; G381-I391 PolarHBondContact N-O 3.23Å; G381-I391 VanDerWaalsContact N-O 3.11Å; G381-I391 PolarHBondContact O-N 2.67Å; A383-I391 HydrophobicContact CB-CD1 3.7Å; A383-I391 HydrophobicContact CB-CG1 3.75Å; I391-M412 HydrophobicContact CD1-SD 4.13Å; I391-M412 HydrophobicContact CG2-CB 4.29Å; I391-V413 CarbonylContact C-O 3.57Å; I391-V413 WeakPolarHBondContact CA-O 3.37Å; I391-V414 HydrophobicContact CG1-CG2 4.03Å
392	L	93.9	Very high	84.7	Confident	17 Å²	17	62.7 Å²	62.7	9%	0.089	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	-32.9	176.2	-66.6	176.7	0	0	0	112.3	E363 S380 V413 E415	E363-L392 HydrophobicContact CB-CD1 3.78Å; E363-L392 VanDerWaalsContact CD-CD1 3.42Å; E363-L392 HydrophobicContact CG-CD1 3.56Å; E363-L392 WeakPolarHBondContact OE1-CD1 3.34Å; S380-L392 WeakPolarHBondContact CB-O 3.37Å; L392-V413 HydrophobicContact CB-CB 4.34Å; L392-V413 HydrophobicContact CD1-CG1 4.05Å; L392-V413 PolarHBondContact N-O 2.92Å; L392-E415 HydrophobicContact CD1-CG 4.08Å; L392-E415 HydrophobicContact CD2-CG 3.62Å; L392-E415 WeakPolarHBondContact CD2-OE1 3.35Å; L392-E415 HydrophobicContact CG-CG 3.76Å
393	G	94.5	Very high	85.5	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	160.5	-162	179.9	0	0	0	0	0	111.3	D376 V413	D376-G393 WeakPolarHBondContact O-CA 3.4Å; G393-V413 PolarHBondContact O-N 2.75Å
394	R	95.7	Very high	86.6	Confident	78 Å²	78	68.2 Å²	68.2	29%	0.294	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	135.5	-178.3	-174.6	176.4	-177.2	140.3	6.4	111.2	D376 F379 S410	D376-R394 WeakPolarHBondContact CB-O 3.26Å; D376-R394 PolarHBondContact N-O 3.41Å; D376-R394 PolarHBondContact O-N 3.36Å; D376-R394 VanDerWaalsContact O-N 3.1Å; F379-R394 HydrophobicContact CB-CB 3.64Å; F379-R394 HydrophobicContact CD2-CB 4.32Å; F379-R394 HydrophobicContact CG-CB 3.96Å; R394-S410 PolarHBondContact NE-OG 2.89Å; R394-S410 PolarHBondContact NH2-OG 3.43Å
395	V	96.8	Very high	88.2	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	114.4	162.9	179.8	0	0	0	0	107.3	L374 I375 A398 S410 C411 V413	L374-V395 HydrophobicContact CB-CG1 4.08Å; L374-V395 HydrophobicContact CB-CG2 4.38Å; I375-V395 HydrophobicContact CG1-CG2 4.08Å; V395-A398 HydrophobicContact CG1-CB 3.99Å; V395-S410 WeakPolarHBondContact O-CA 3.48Å; V395-S410 PolarHBondContact O-OG 3.37Å; V395-S410 VanDerWaalsContact O-OG 3.04Å; V395-C411 PolarHBondContact N-O 3.39Å; V395-C411 PolarHBondContact O-N 2.74Å; V395-V413 HydrophobicContact CG2-CG2 3.82Å
396	H	96.7	Very high	89.7	Confident	79 Å²	79	64.5 Å²	64.5	37%	0.366	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	-41.9	-175.4	-69.4	-61.2	0	0	0	112.3	D376 F379 S410	D376-H396 WeakPolarHBondContact CB-NE2 3.46Å; D376-H396 IonicContact OD2-CD2 2.71Å; D376-H396 IonicContact OD2-CE1 3.61Å; D376-H396 IonicContact OD2-NE2 3.58Å; D376-H396 PolarHBondContact OD2-NE2 3.31Å; F379-H396 AromaticContact CD2-CE1 3.92Å; F379-H396 AromaticContact CE2-CE1 3.44Å; F379-H396 VanDerWaalsContact CE2-CE1 3.44Å; F379-H396 WeakPolarHBondContact CE2-CE1 3.34Å; F379-H396 AromaticContact CE2-NE2 3.8Å; F379-H396 AromaticContact CZ-CE1 3.87Å; H396-S410 WeakPolarHBondContact O-CB 3.44Å; H396-S410 PolarHBondContact O-OG 3.01Å
397	I	96	Very high	91.6	Very high	119 Å²	119	56.7 Å²	56.7	61%	0.61	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.4	123	178.7	-57.8	179.7	0	0	0	108.8	A408 V409	I397-A408 HydrophobicContact CG2-CB 4.38Å; I397-V409 CarbonylContact C-O 3.57Å; I397-V409 WeakPolarHBondContact CA-O 3.27Å
398	A	95.6	Very high	93.1	Very high	10 Å²	10	56.8 Å²	56.8	8%	0.083	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	158.2	164.3	0	0	0	0	0	109.1	L371 V395 V409	L371-A398 HydrophobicContact CD2-CB 4.33Å; V395-A398 HydrophobicContact CG1-CB 3.99Å; A398-V409 HydrophobicContact CB-CG2 4.26Å; A398-V409 PolarHBondContact N-O 3.13Å; A398-V409 WeakPolarHBondContact O-CG2 3.44Å; A398-V409 PolarHBondContact O-N 3.43Å
399	Q	95.7	Very high	94.5	Very high	115 Å²	115	51.6 Å²	51.6	54%	0.537	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	115	173.7	-72.4	-173	-12.5	0	0	109.9	L407	Q399-L407 WeakPolarHBondContact CA-O 3.27Å
400	L	96.6	Very high	95.2	Very high	4 Å²	4	50.1 Å²	50.1	2%	0.021	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	117	169.1	-179.4	70	0	0	0	108.2	C341 V343 I402 L407 V409 I421 F423	C341-L400 HydrophobicContact CB-CD1 3.8Å; C341-L400 HydrophobicContact CB-CG 4.42Å; V343-L400 HydrophobicContact CG2-CD1 3.52Å; L400-I402 HydrophobicContact CD2-CD1 4.11Å; L400-I402 HydrophobicContact CD2-CG1 4.3Å; L400-I402 HydrophobicContact CG-CG1 4.24Å; L400-L407 HydrophobicContact CB-CB 4.49Å; L400-L407 PolarHBondContact N-O 2.94Å; L400-L407 WeakPolarHBondContact O-CB 3.16Å; L400-L407 PolarHBondContact O-N 3.14Å; L400-V409 HydrophobicContact CB-CB 4.47Å; L400-V409 HydrophobicContact CB-CG1 3.81Å; L400-V409 HydrophobicContact CB-CG2 3.79Å; L400-V409 HydrophobicContact CD2-CG1 4.12Å; L400-I421 HydrophobicContact CD1-CD1 3.86Å; L400-F423 HydrophobicContact CD2-CD2 4.02Å; L400-F423 HydrophobicContact CD2-CE2 3.79Å; L400-F423 HydrophobicContact CD2-CZ 4.46Å
401	Q	96.9	Very high	95.5	Very high	30 Å²	30	45 Å²	45	14%	0.14	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	126	174.6	176.8	-174.6	0.7	0	0	109.7	C341 K342 E403 V405 F406	C341-Q401 CarbonylContact C-O 3.58Å; C341-Q401 VanDerWaalsContact CA-O 3.27Å; C341-Q401 WeakPolarHBondContact CA-O 3.39Å; C341-Q401 WeakPolarHBondContact CB-O 3.45Å; K342-Q401 HydrophobicContact CB-CB 4.1Å; K342-Q401 PolarHBondContact N-O 3.31Å; K342-Q401 PolarHBondContact O-N 2.89Å; Q401-E403 WeakPolarHBondContact CG-O 3.44Å; Q401-E403 PolarHBondContact NE2-O 2.84Å; Q401-V405 WeakPolarHBondContact CA-O 3.29Å; Q401-F406 HydrophobicContact CB-CD1 3.91Å; Q401-F406 HydrophobicContact CB-CE1 3.83Å; Q401-F406 HydrophobicContact CB-CZ 4.46Å; Q401-F406 HydrophobicContact CG-CD1 4.28Å; Q401-F406 HydrophobicContact CG-CE1 3.93Å; Q401-F406 HydrophobicContact CG-CZ 4.05Å
402	I	96.1	Very high	95.6	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	119	171.2	-58.8	179.9	0	0	0	106.6	I339 C341 L400 N404 V405 L407 V444 T449	I339-I402 HydrophobicContact CD1-CD1 3.73Å; I339-I402 HydrophobicContact CD1-CG1 4.36Å; C341-I402 HydrophobicContact CB-CG1 4.17Å; L400-I402 HydrophobicContact CD2-CD1 4.11Å; L400-I402 HydrophobicContact CD2-CG1 4.3Å; L400-I402 HydrophobicContact CG-CG1 4.24Å; I402-N404 PolarHBondContact O-N 3.42Å; I402-N404 VanDerWaalsContact O-N 3.12Å; I402-V405 PolarHBondContact N-O 3.28Å; I402-V405 PolarHBondContact O-N 2.98Å; I402-L407 HydrophobicContact CD1-CD1 3.66Å; I402-L407 HydrophobicContact CG1-CD1 4.25Å; I402-V444 HydrophobicContact CD1-CG2 4.42Å; I402-T449 HydrophobicContact CG2-CG2 3.54Å
403	E	95.1	Very high	95.7	Very high	82 Å²	82	45.5 Å²	45.5	38%	0.383	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	-116.6	-168	-54.6	-57.3	148.4	0	0	111.2	Q401 A447 T449	Q401-E403 WeakPolarHBondContact CG-O 3.44Å; Q401-E403 PolarHBondContact NE2-O 2.84Å; E403-A447 HydrophobicContact CB-CB 4.32Å; E403-T449 VanDerWaalsContact OE1-CB 3.29Å; E403-T449 WeakPolarHBondContact OE1-CB 3.38Å; E403-T449 PolarHBondContact OE1-OG1 2.89Å
404	N	93.1	Very high	95.6	Very high	148 Å²	148	45.5 Å²	45.5	79%	0.791	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.6	4.8	179.6	-62.7	-18.8	0	0	0	113.3	I402	I402-N404 PolarHBondContact O-N 3.42Å; I402-N404 VanDerWaalsContact O-N 3.12Å
405	V	94.4	Very high	95.3	Very high	47 Å²	47	43.9 Å²	43.9	29%	0.285	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	133.5	-175.9	179.4	0	0	0	0	110.2	Q401 I402 L407 A447	Q401-V405 WeakPolarHBondContact CA-O 3.29Å; I402-V405 PolarHBondContact N-O 3.28Å; I402-V405 PolarHBondContact O-N 2.98Å; V405-L407 HydrophobicContact CG1-CD2 3.62Å; V405-L407 HydrophobicContact CG1-CG 4.34Å; V405-A447 HydrophobicContact CB-CB 4.42Å; V405-A447 HydrophobicContact CG2-CB 3.57Å
406	F	95.3	Very high	94.5	Very high	114 Å²	114	53.2 Å²	53.2	50%	0.5	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	114.1	177.3	-66.8	-95.4	0	0	0	110.3	Q401	Q401-F406 HydrophobicContact CB-CD1 3.91Å; Q401-F406 HydrophobicContact CB-CE1 3.83Å; Q401-F406 HydrophobicContact CB-CZ 4.46Å; Q401-F406 HydrophobicContact CG-CD1 4.28Å; Q401-F406 HydrophobicContact CG-CE1 3.93Å; Q401-F406 HydrophobicContact CG-CZ 4.05Å
407	L	95.8	Very high	93.7	Very high	10 Å²	10	51 Å²	51	5%	0.052	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	128.6	-177.6	-54.8	179.4	0	0	0	110.7	Q399 L400 I402 V405 V409 H431 V444	Q399-L407 WeakPolarHBondContact CA-O 3.27Å; L400-L407 HydrophobicContact CB-CB 4.49Å; L400-L407 PolarHBondContact N-O 2.94Å; L400-L407 WeakPolarHBondContact O-CB 3.16Å; L400-L407 PolarHBondContact O-N 3.14Å; I402-L407 HydrophobicContact CD1-CD1 3.66Å; I402-L407 HydrophobicContact CG1-CD1 4.25Å; V405-L407 HydrophobicContact CG1-CD2 3.62Å; V405-L407 HydrophobicContact CG1-CG 4.34Å; L407-V409 HydrophobicContact CB-CG1 4.15Å; L407-V409 PolarHBondContact O-N 3.43Å; L407-H431 HydrophobicContact CD1-CB 4.49Å; L407-H431 HydrophobicContact CD2-CB 4.34Å; L407-V444 HydrophobicContact CD1-CG1 3.87Å; L407-V444 HydrophobicContact CD2-CG1 3.74Å; L407-V444 HydrophobicContact CG-CG1 4.43Å
408	A	96.5	Very high	93.1	Very high	46 Å²	46	48.6 Å²	48.6	38%	0.38	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	107.8	169.4	0	0	0	0	0	109.8	I397 H431	I397-A408 HydrophobicContact CG2-CB 4.38Å; A408-H431 PolarHBondContact O-CE1 3.47Å; A408-H431 PolarHBondContact O-NE2 3.12Å
409	V	96.8	Very high	92.8	Very high	11 Å²	11	49 Å²	49	7%	0.067	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	146.7	-177	-62	0	0	0	0	112.1	I397 A398 L400 L407 F423 M427	I397-V409 CarbonylContact C-O 3.57Å; I397-V409 WeakPolarHBondContact CA-O 3.27Å; A398-V409 HydrophobicContact CB-CG2 4.26Å; A398-V409 PolarHBondContact N-O 3.13Å; A398-V409 WeakPolarHBondContact O-CG2 3.44Å; A398-V409 PolarHBondContact O-N 3.43Å; L400-V409 HydrophobicContact CB-CB 4.47Å; L400-V409 HydrophobicContact CB-CG1 3.81Å; L400-V409 HydrophobicContact CB-CG2 3.79Å; L400-V409 HydrophobicContact CD2-CG1 4.12Å; L407-V409 HydrophobicContact CB-CG1 4.15Å; L407-V409 PolarHBondContact O-N 3.43Å; V409-F423 HydrophobicContact CG1-CE2 4.23Å; V409-M427 VanDerWaalsContact CA-SD 3.59Å; V409-M427 HydrophobicContact CB-CG 4.18Å; V409-M427 HydrophobicContact CB-SD 3.86Å; V409-M427 HydrophobicContact CG1-CG 4.2Å; V409-M427 HydrophobicContact CG1-SD 4.08Å
410	S	96.1	Very high	92.7	Very high	10 Å²	10	45.2 Å²	45.2	7%	0.07	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	134.1	166.7	-173.2	0	0	0	0	108.4	R394 V395 H396 M427	R394-S410 PolarHBondContact NE-OG 2.89Å; R394-S410 PolarHBondContact NH2-OG 3.43Å; V395-S410 WeakPolarHBondContact O-CA 3.48Å; V395-S410 PolarHBondContact O-OG 3.37Å; V395-S410 VanDerWaalsContact O-OG 3.04Å; H396-S410 WeakPolarHBondContact O-CB 3.44Å; H396-S410 PolarHBondContact O-OG 3.01Å; S410-M427 PolarHBondContact N-SD 3.06Å
411	C	95.3	Very high	92.6	Very high	6 Å²	6	45.3 Å²	45.3	4%	0.041	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	148.1	-177.6	55.7	0	0	0	0	112.2	T359 I361 V395	T359-C411 HydrophobicContact CG2-CB 3.96Å; T359-C411 VanDerWaalsContact O-CA 3.28Å; T359-C411 WeakPolarHBondContact O-CA 3.27Å; I361-C411 HydrophobicContact CB-CB 4.45Å; I361-C411 HydrophobicContact CG2-CB 4.22Å; V395-C411 PolarHBondContact N-O 3.39Å; V395-C411 PolarHBondContact O-N 2.74Å
412	M	94.7	Very high	92.5	Very high	44 Å²	44	44.8 Å²	44.8	22%	0.217	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	137.5	168	-62.8	-174.3	-57.2	0	0	109.1	A358 T359 I360 I361 I391	A358-M412 HydrophobicContact CB-CE 3.42Å; A358-M412 VanDerWaalsContact CB-CE 3.42Å; A358-M412 HydrophobicContact CB-SD 4.4Å; T359-M412 PolarHBondContact O-N 3.5Å; I360-M412 CarbonylContact C-O 3.58Å; I360-M412 WeakPolarHBondContact CA-O 3.48Å; I360-M412 HydrophobicContact CD1-CE 4.37Å; I360-M412 HydrophobicContact CG1-CE 4.07Å; I360-M412 WeakPolarHBondContact CG2-O 3.39Å; I361-M412 PolarHBondContact N-O 2.79Å; I391-M412 HydrophobicContact CD1-SD 4.13Å; I391-M412 HydrophobicContact CG2-CB 4.29Å
413	V	95.4	Very high	92.5	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	124.8	175.7	-168	0	0	0	0	108.9	I361 A366 I375 I391 L392 G393 V395	I361-V413 HydrophobicContact CG2-CB 4.16Å; I361-V413 HydrophobicContact CG2-CG1 4.23Å; I361-V413 HydrophobicContact CG2-CG2 3.67Å; I361-V413 WeakPolarHBondContact O-CA 3.35Å; A366-V413 HydrophobicContact CB-CG1 3.88Å; I375-V413 HydrophobicContact CD1-CB 4.08Å; I375-V413 HydrophobicContact CD1-CG1 3.94Å; I375-V413 HydrophobicContact CD1-CG2 3.82Å; I375-V413 HydrophobicContact CG1-CG2 3.84Å; I375-V413 HydrophobicContact CG2-CG2 4.49Å; I391-V413 CarbonylContact C-O 3.57Å; I391-V413 WeakPolarHBondContact CA-O 3.37Å; L392-V413 HydrophobicContact CB-CB 4.34Å; L392-V413 HydrophobicContact CD1-CG1 4.05Å; L392-V413 PolarHBondContact N-O 2.92Å; G393-V413 PolarHBondContact O-N 2.75Å; V395-V413 HydrophobicContact CG2-CG2 3.82Å
414	V	92.9	Very high	92.5	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	137.6	-171.4	171.6	0	0	0	0	111.4	I360 I361 E363 C389 K390 I391	I360-V414 HydrophobicContact CG2-CB 3.64Å; I360-V414 HydrophobicContact CG2-CG2 3.41Å; I360-V414 VanDerWaalsContact CG2-CG2 3.41Å; I361-V414 PolarHBondContact O-N 3.39Å; E363-V414 PolarHBondContact N-O 3.01Å; C389-V414 HydrophobicContact CB-CG1 3.5Å; C389-V414 VanDerWaalsContact CB-CG1 3.5Å; C389-V414 WeakPolarHBondContact SG-CG1 3.42Å; K390-V414 WeakPolarHBondContact O-CA 3.44Å; I391-V414 HydrophobicContact CG1-CG2 4.03Å
415	E	89.7	Confident	92.7	Very high	44 Å²	44	36.5 Å²	36.5	21%	0.206	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	140.2	173.7	-58.5	-176.2	-175.2	0	0	110.8	K390 L392 Q417	K390-E415 HydrophobicContact CB-CB 4.48Å; K390-E415 HydrophobicContact CB-CG 4.32Å; K390-E415 WeakPolarHBondContact CD-OE1 3.46Å; K390-E415 WeakPolarHBondContact CE-OE1 3.05Å; K390-E415 IonicContact NZ-OE1 2.81Å; K390-E415 PolarHBondContact NZ-OE1 3.35Å; K390-E415 IonicContact NZ-OE2 3.73Å; K390-E415 PolarHBondContact O-N 3.32Å; L392-E415 HydrophobicContact CD1-CG 4.08Å; L392-E415 HydrophobicContact CD2-CG 3.62Å; L392-E415 WeakPolarHBondContact CD2-OE1 3.35Å; L392-E415 HydrophobicContact CG-CG 3.76Å; E415-Q417 PolarHBondContact O-N 3.38Å
416	K	80.8	Confident	92.8	Very high	196 Å²	196	36.2 Å²	36.2	85%	0.852	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.3	40.1	168.7	-54.8	178.8	-178.9	178.8	0	115.6
417	Q	80.1	Confident	92.9	Very high	32 Å²	32	31.1 Å²	31.1	15%	0.15	17%	0.165	C	C	.	.			trans	-84.6	135.3	170	-177.2	175.5	-69.3	0	0	110.7	E415 M419	E415-Q417 PolarHBondContact O-N 3.38Å; Q417-M419 WeakPolarHBondContact CG-O 3.44Å; Q417-M419 PolarHBondContact NE2-O 2.99Å; Q417-M419 PolarHBondContact O-N 3.33Å
418	P	83	Confident	92.9	Very high	68 Å²	68	31.1 Å²	31.1	44%	0.442	17%	0.165	S	C	.	.	S	Bend	trans	-68.2	-18.7	-179.9	25	-34.2	0	0	0	114.5	I460 V464	P418-I460 HydrophobicContact CB-CG2 3.7Å; P418-I460 WeakPolarHBondContact O-CG2 3.37Å; P418-V464 HydrophobicContact CB-CG2 4.02Å; P418-V464 HydrophobicContact CG-CG2 3.95Å
419	M	88	Confident	93	Very high	18 Å²	18	36 Å²	36	9%	0.089	18%	0.177	C	C	.	.	S	Bend	trans	-114.7	143.2	-176.4	-55.4	-178.5	-65.3	0	0	109.5	F338 F351 Q417 L422	F338-M419 HydrophobicContact CE1-CG 4.46Å; F338-M419 HydrophobicContact CE1-SD 3.91Å; F338-M419 HydrophobicContact CZ-CG 4.47Å; F338-M419 HydrophobicContact CZ-SD 3.58Å; F338-M419 VanDerWaalsContact CZ-SD 3.58Å; F351-M419 HydrophobicContact CB-CE 3.76Å; F351-M419 HydrophobicContact CB-SD 3.37Å; F351-M419 WeakPolarHBondContact CB-SD 3.26Å; F351-M419 HydrophobicContact CD1-CE 3.25Å; F351-M419 HydrophobicContact CD1-SD 3.73Å; F351-M419 HydrophobicContact CD2-SD 4.33Å; F351-M419 HydrophobicContact CE1-CE 4.05Å; F351-M419 HydrophobicContact CG-CE 3.72Å; F351-M419 HydrophobicContact CG-SD 3.54Å; F351-M419 VanDerWaalsContact CG-SD 3.54Å; Q417-M419 WeakPolarHBondContact CG-O 3.44Å; Q417-M419 PolarHBondContact NE2-O 2.99Å; Q417-M419 PolarHBondContact O-N 3.33Å; M419-L422 HydrophobicContact CE-CD1 4.19Å
420	D	93.5	Very high	93	Very high	36 Å²	36	43 Å²	43	19%	0.193	20%	0.202	C	C	.	.	S	Bend	trans	-63.7	-45.9	178.3	-83.5	-1.3	0	0	0	111.5	T348 I361 S362 F365 R368	T348-D420 HydrophobicContact CG2-CB 4.42Å; T348-D420 WeakPolarHBondContact OG1-CB 3.39Å; T348-D420 PolarHBondContact OG1-OD2 3.11Å; I361-D420 WeakPolarHBondContact CA-O 3.32Å; S362-D420 PolarHBondContact N-O 3.31Å; F365-D420 HydrophobicContact CB-CB 3.91Å; F365-D420 HydrophobicContact CD1-CB 4.05Å; F365-D420 HydrophobicContact CD2-CB 4.13Å; F365-D420 WeakPolarHBondContact CD2-OD2 3.15Å; F365-D420 HydrophobicContact CG-CB 3.75Å; R368-D420 IonicContact CZ-OD2 2.79Å; R368-D420 IonicContact NH1-OD1 2.88Å; R368-D420 PolarHBondContact NH1-OD1 3.04Å; R368-D420 IonicContact NH1-OD2 2.86Å; R368-D420 PolarHBondContact NH1-OD2 2.66Å; R368-D420 VanDerWaalsContact NH1-OD2 3.14Å; R368-D420 IonicContact NH2-OD2 2.92Å; R368-D420 PolarHBondContact NH2-OD2 3.13Å; R368-D420 VanDerWaalsContact NH2-OD2 3.08Å
421	I	94.9	Very high	93	Very high	7 Å²	7	44.3 Å²	44.3	4%	0.036	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	133	178.6	-55.7	178.8	0	0	0	109.9	V343 T348 A350 F351 I360 I361 F365 L400	V343-I421 HydrophobicContact CG2-CD1 3.85Å; T348-I421 HydrophobicContact CG2-CD1 3.73Å; T348-I421 HydrophobicContact CG2-CG1 4.16Å; A350-I421 WeakPolarHBondContact CA-O 3.48Å; A350-I421 HydrophobicContact CB-CB 3.87Å; A350-I421 HydrophobicContact CB-CG2 3.88Å; F351-I421 PolarHBondContact N-O 3.42Å; I360-I421 WeakPolarHBondContact O-CA 3.1Å; I361-I421 HydrophobicContact CG1-CG1 4.37Å; F365-I421 HydrophobicContact CD1-CD1 4.26Å; F365-I421 HydrophobicContact CD1-CG1 3.88Å; F365-I421 HydrophobicContact CE1-CD1 3.72Å; F365-I421 HydrophobicContact CE1-CG1 3.86Å; L400-I421 HydrophobicContact CD1-CD1 3.86Å
422	L	94.6	Very high	93.1	Very high	19 Å²	19	52 Å²	52	10%	0.099	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	113.8	161	-173.8	160.2	0	0	0	107.6	F351 D353 A356 T359 I360 M419 G424	F351-L422 HydrophobicContact CD1-CD1 4.12Å; F351-L422 HydrophobicContact CD1-CG 4Å; F351-L422 CarbonylContact O-C 3.58Å; D353-L422 HydrophobicContact CB-CD2 4.21Å; D353-L422 HydrophobicContact CB-CG 4.42Å; A356-L422 HydrophobicContact CB-CD1 4.4Å; A356-L422 HydrophobicContact CB-CD2 3.41Å; A356-L422 VanDerWaalsContact CB-CD2 3.41Å; T359-L422 CarbonylContact C-O 3.5Å; T359-L422 VanDerWaalsContact CA-O 3.27Å; T359-L422 WeakPolarHBondContact CA-O 3.3Å; T359-L422 VanDerWaalsContact CG2-O 3.31Å; T359-L422 WeakPolarHBondContact CG2-O 3.44Å; I360-L422 HydrophobicContact CB-CB 4.23Å; I360-L422 PolarHBondContact N-O 2.97Å; I360-L422 PolarHBondContact O-N 3.45Å; M419-L422 HydrophobicContact CE-CD1 4.19Å; L422-G424 PolarHBondContact O-N 2.98Å
423	F	96.1	Very high	93.2	Very high	0 Å²	0	51 Å²	51	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	98.5	179	-165.2	-126.2	0	0	0	110	A350 F351 D353 T359 L400 V409 M427 L428 L442	A350-F423 HydrophobicContact CB-CB 4.38Å; F351-F423 PolarHBondContact O-N 3.45Å; D353-F423 PolarHBondContact N-O 3.46Å; T359-F423 HydrophobicContact CG2-CD2 4.25Å; L400-F423 HydrophobicContact CD2-CD2 4.02Å; L400-F423 HydrophobicContact CD2-CE2 3.79Å; L400-F423 HydrophobicContact CD2-CZ 4.46Å; V409-F423 HydrophobicContact CG1-CE2 4.23Å; F423-M427 HydrophobicContact CD2-CB 3.9Å; F423-M427 HydrophobicContact CE2-CB 3.25Å; F423-M427 HydrophobicContact CE2-CG 4.14Å; F423-M427 HydrophobicContact CZ-CB 3.75Å; F423-L428 HydrophobicContact CD1-CD2 3.63Å; F423-L428 HydrophobicContact CD1-CG 3.93Å; F423-L428 HydrophobicContact CE1-CD2 3.5Å; F423-L428 VanDerWaalsContact CE1-CD2 3.5Å; F423-L428 HydrophobicContact CE1-CG 3.94Å; F423-L442 HydrophobicContact CD1-CD2 4.45Å; F423-L442 HydrophobicContact CE1-CD2 4.25Å
424	G	95.5	Very high	93.3	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	175.4	-170.3	0	0	0	0	0	114.1	D353 T359 L422 D426 M427 L428	D353-G424 WeakPolarHBondContact O-CA 3.22Å; T359-G424 PolarHBondContact OG1-N 3.28Å; L422-G424 PolarHBondContact O-N 2.98Å; G424-D426 PolarHBondContact O-N 3.03Å; G424-M427 PolarHBondContact O-N 2.85Å; G424-L428 WeakPolarHBondContact O-CG 3.15Å; G424-L428 PolarHBondContact O-N 3.38Å
425	L	96.8	Very high	93.6	Very high	57 Å²	57	57.3 Å²	57.3	30%	0.298	28%	0.275	S	S	.	.	H	α-helix	trans	-60.4	-29.7	-178	-170.4	63.3	0	0	0	113.4	A356 K429	A356-L425 VanDerWaalsContact O-CB 3.26Å; A356-L425 WeakPolarHBondContact O-CB 3.32Å; A356-L425 PolarHBondContact O-N 2.94Å; L425-K429 HydrophobicContact CD1-CD 4.35Å; L425-K429 HydrophobicContact CD1-CG 4.09Å; L425-K429 HydrophobicContact CG-CD 4.1Å; L425-K429 HydrophobicContact CG-CG 4.21Å; L425-K429 VanDerWaalsContact O-CB 3.29Å; L425-K429 WeakPolarHBondContact O-CB 3.47Å; L425-K429 WeakPolarHBondContact O-CG 3.38Å; L425-K429 PolarHBondContact O-N 2.9Å
426	D	96.4	Very high	93.9	Very high	41 Å²	41	56.8 Å²	56.8	22%	0.219	27%	0.274	C	S	.	.	H	α-helix	trans	-58.9	-48.5	177.1	59.4	-19	0	0	0	112.4	Q357 A358 T359 G424 R430	Q357-D426 WeakPolarHBondContact O-CB 3.33Å; A358-D426 WeakPolarHBondContact CA-OD2 3.49Å; T359-D426 WeakPolarHBondContact CB-OD1 3.31Å; T359-D426 VanDerWaalsContact N-CG 3.32Å; T359-D426 PolarHBondContact N-OD1 3.11Å; T359-D426 PolarHBondContact N-OD2 3.4Å; T359-D426 VanDerWaalsContact N-OD2 3.08Å; T359-D426 PolarHBondContact OG1-OD1 3.02Å; G424-D426 PolarHBondContact O-N 3.03Å; D426-R430 VanDerWaalsContact O-CB 3.27Å; D426-R430 WeakPolarHBondContact O-CB 3.45Å; D426-R430 PolarHBondContact O-N 3.39Å
427	M	97.1	Very high	94.6	Very high	8 Å²	8	53 Å²	53	4%	0.039	26%	0.263	C	S	.	.	H	α-helix	trans	-81.7	-33.9	180	-65	-58.5	102.2	0	0	112	T359 V409 S410 F423 G424 K429 R430 H431	T359-M427 HydrophobicContact CG2-CG 4.12Å; T359-M427 WeakPolarHBondContact OG1-CB 3.43Å; T359-M427 WeakPolarHBondContact OG1-CG 3.39Å; V409-M427 VanDerWaalsContact CA-SD 3.59Å; V409-M427 HydrophobicContact CB-CG 4.18Å; V409-M427 HydrophobicContact CB-SD 3.86Å; V409-M427 HydrophobicContact CG1-CG 4.2Å; V409-M427 HydrophobicContact CG1-SD 4.08Å; S410-M427 PolarHBondContact N-SD 3.06Å; F423-M427 HydrophobicContact CD2-CB 3.9Å; F423-M427 HydrophobicContact CE2-CB 3.25Å; F423-M427 HydrophobicContact CE2-CG 4.14Å; F423-M427 HydrophobicContact CZ-CB 3.75Å; G424-M427 PolarHBondContact O-N 2.85Å; M427-K429 VanDerWaalsContact C-N 3.33Å; M427-K429 PolarHBondContact O-N 3.47Å; M427-R430 HydrophobicContact CE-CB 4.43Å; M427-R430 PolarHBondContact O-N 3.06Å; M427-H431 PolarHBondContact O-CD2 3.43Å; M427-H431 VanDerWaalsContact O-CD2 3.26Å; M427-H431 PolarHBondContact O-N 3.06Å
428	L	97.6	Very high	95.2	Very high	10 Å²	10	60.1 Å²	60.1	5%	0.052	29%	0.293	C	S	.	.	H	α-helix	trans	-56.8	-47.3	171.1	-72.4	167.2	0	0	0	111.2	V352 F423 G424 Q432 C433 I435 L442	V352-L428 HydrophobicContact CG1-CD1 4.19Å; V352-L428 HydrophobicContact CG1-CD2 4.06Å; F423-L428 HydrophobicContact CD1-CD2 3.63Å; F423-L428 HydrophobicContact CD1-CG 3.93Å; F423-L428 HydrophobicContact CE1-CD2 3.5Å; F423-L428 VanDerWaalsContact CE1-CD2 3.5Å; F423-L428 HydrophobicContact CE1-CG 3.94Å; G424-L428 WeakPolarHBondContact O-CG 3.15Å; G424-L428 PolarHBondContact O-N 3.38Å; L428-Q432 PolarHBondContact O-N 2.99Å; L428-C433 HydrophobicContact CB-CB 4.5Å; L428-C433 HydrophobicContact CD2-CB 3.71Å; L428-C433 PolarHBondContact O-N 2.63Å; L428-I435 HydrophobicContact CD1-CD1 4.27Å; L428-L442 HydrophobicContact CD2-CD1 3.99Å
429	K	97.3	Very high	95.8	Very high	149 Å²	149	62.4 Å²	62.4	65%	0.648	30%	0.298	S	S	*	.	H	α-helix	trans	-68.5	-43.4	176.4	-77	-174.9	173.6	-178.5	0	112.4	L425 M427 H431 Q432	L425-K429 HydrophobicContact CD1-CD 4.35Å; L425-K429 HydrophobicContact CD1-CG 4.09Å; L425-K429 HydrophobicContact CG-CD 4.1Å; L425-K429 HydrophobicContact CG-CG 4.21Å; L425-K429 VanDerWaalsContact O-CB 3.29Å; L425-K429 WeakPolarHBondContact O-CB 3.47Å; L425-K429 WeakPolarHBondContact O-CG 3.38Å; L425-K429 PolarHBondContact O-N 2.9Å; M427-K429 VanDerWaalsContact C-N 3.33Å; M427-K429 PolarHBondContact O-N 3.47Å; K429-H431 VanDerWaalsContact C-N 3.26Å; K429-H431 PolarHBondContact O-N 3.26Å; K429-Q432 PolarHBondContact O-N 3.44Å; K429-Q432 VanDerWaalsContact O-N 3.17Å
430	R	96.9	Very high	96.1	Very high	157 Å²	157	65.4 Å²	65.4	59%	0.592	31%	0.314	S	S	*	.	H	α-helix	trans	-57.2	-40.8	-179.2	-179	179.1	-177.9	107.3	2	112.2	D426 M427	D426-R430 VanDerWaalsContact O-CB 3.27Å; D426-R430 WeakPolarHBondContact O-CB 3.45Å; D426-R430 PolarHBondContact O-N 3.39Å; M427-R430 HydrophobicContact CE-CB 4.43Å; M427-R430 PolarHBondContact O-N 3.06Å
431	H	96.7	Very high	96.3	Very high	37 Å²	37	64.1 Å²	64.1	17%	0.171	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	14.6	-177.9	-60.9	-64.2	0	0	0	113.1	L407 A408 M427 K429 C433 V444	L407-H431 HydrophobicContact CD1-CB 4.49Å; L407-H431 HydrophobicContact CD2-CB 4.34Å; A408-H431 PolarHBondContact O-CE1 3.47Å; A408-H431 PolarHBondContact O-NE2 3.12Å; M427-H431 PolarHBondContact O-CD2 3.43Å; M427-H431 VanDerWaalsContact O-CD2 3.26Å; M427-H431 PolarHBondContact O-N 3.06Å; K429-H431 VanDerWaalsContact C-N 3.26Å; K429-H431 PolarHBondContact O-N 3.26Å; H431-C433 PolarHBondContact O-N 3.32Å; H431-C433 VanDerWaalsContact O-N 3.14Å; H431-V444 HydrophobicContact CB-CG1 4.1Å
432	Q	96.9	Very high	96.4	Very high	168 Å²	168	63.8 Å²	63.8	79%	0.785	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.9	43.1	178.4	-58	-176	-74.8	0	0	113.2	L428 K429	L428-Q432 PolarHBondContact O-N 2.99Å; K429-Q432 PolarHBondContact O-N 3.44Å; K429-Q432 VanDerWaalsContact O-N 3.17Å
433	C	97.5	Very high	96.6	Very high	23 Å²	23	64.1 Å²	64.1	16%	0.155	31%	0.308	C	S	.	.			trans	-68.5	146.2	-177.3	-52.2	0	0	0	0	111	L428 H431 L442 I443 V444	L428-C433 HydrophobicContact CB-CB 4.5Å; L428-C433 HydrophobicContact CD2-CB 3.71Å; L428-C433 PolarHBondContact O-N 2.63Å; H431-C433 PolarHBondContact O-N 3.32Å; H431-C433 VanDerWaalsContact O-N 3.14Å; C433-L442 HydrophobicContact CB-CD1 4.03Å; C433-L442 HydrophobicContact CB-CG 4.5Å; C433-I443 CarbonylContact C-O 3.28Å; C433-I443 VanDerWaalsContact CA-O 3.26Å; C433-I443 WeakPolarHBondContact CA-O 3.47Å; C433-V444 HydrophobicContact CB-CG2 4.19Å; C433-V444 VanDerWaalsContact SG-CG2 3.6Å
434	V	97.7	Very high	96.5	Very high	79 Å²	79	64.4 Å²	64.4	48%	0.479	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	117.6	171.6	-176.1	0	0	0	0	108.3	D436 I443	V434-D436 PolarHBondContact O-N 3Å; V434-I443 HydrophobicContact CB-CB 4.09Å; V434-I443 HydrophobicContact CB-CD1 4.36Å; V434-I443 HydrophobicContact CB-CG1 4.43Å; V434-I443 PolarHBondContact N-O 2.83Å; V434-I443 PolarHBondContact O-N 3.36Å
435	I	97.5	Very high	96.2	Very high	54 Å²	54	67.5 Å²	67.5	28%	0.277	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	98	169.7	-63.4	172.8	0	0	0	106.4	L337 V352 L428 L437 L442 F451	L337-I435 HydrophobicContact CD1-CG2 3.78Å; V352-I435 HydrophobicContact CG1-CD1 3.94Å; V352-I435 HydrophobicContact CG1-CG1 4.27Å; L428-I435 HydrophobicContact CD1-CD1 4.27Å; I435-L437 HydrophobicContact CG2-CD2 3.79Å; I435-L437 HydrophobicContact CG2-CG 4.12Å; I435-L442 HydrophobicContact CG1-CD1 3.66Å; I435-F451 HydrophobicContact CG2-CE2 4.22Å; I435-F451 HydrophobicContact CG2-CZ 3.92Å
436	D	96.7	Very high	95.9	Very high	33 Å²	33	74.4 Å²	74.4	18%	0.176	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	95.2	-179.2	-170.4	-17.9	0	0	0	109.5	V434 K438 E439 N440 C441 I443	V434-D436 PolarHBondContact O-N 3Å; D436-K438 VanDerWaalsContact C-N 3.28Å; D436-K438 WeakPolarHBondContact OD1-CB 3.4Å; D436-K438 PolarHBondContact OD1-N 2.87Å; D436-E439 PolarHBondContact OD1-N 2.94Å; D436-E439 WeakPolarHBondContact OD2-CG 3.33Å; D436-N440 CarbonylContact O-C 3.5Å; D436-N440 WeakPolarHBondContact O-CA 3.3Å; D436-N440 PolarHBondContact O-N 2.94Å; D436-C441 WeakPolarHBondContact CA-O 3.49Å; D436-C441 PolarHBondContact N-O 3.3Å; D436-C441 PolarHBondContact O-N 3.44Å; D436-I443 HydrophobicContact CB-CD1 4.06Å; D436-I443 HydrophobicContact CB-CG1 4.31Å
437	L	95	Very high	95.8	Very high	117 Å²	117	73.2 Å²	73.2	61%	0.613	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-16.8	178.2	-59.1	180	0	0	0	112.7	L337 I435 F451	L337-L437 HydrophobicContact CD1-CD2 4.02Å; L337-L437 HydrophobicContact CD2-CD2 3.89Å; I435-L437 HydrophobicContact CG2-CD2 3.79Å; I435-L437 HydrophobicContact CG2-CG 4.12Å; L437-F451 HydrophobicContact CD2-CE2 4.21Å
438	K	94.4	Very high	95.7	Very high	182 Å²	182	79.8 Å²	79.8	79%	0.791	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-46.6	176.7	-179.7	-176.4	173.7	-175.6	0	110.2	D436 N440	D436-K438 VanDerWaalsContact C-N 3.28Å; D436-K438 WeakPolarHBondContact OD1-CB 3.4Å; D436-K438 PolarHBondContact OD1-N 2.87Å; K438-N440 VanDerWaalsContact C-N 3.32Å
439	E	95.2	Very high	95.7	Very high	115 Å²	115	79.4 Å²	79.4	54%	0.537	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	3.8	176.4	-58.1	-60.4	139	0	0	112.8	D436 C441	D436-E439 PolarHBondContact OD1-N 2.94Å; D436-E439 WeakPolarHBondContact OD2-CG 3.33Å; E439-C441 VanDerWaalsContact C-N 3.34Å; E439-C441 PolarHBondContact O-N 3.3Å
440	N	94.7	Very high	95.7	Very high	82 Å²	82	76.2 Å²	76.2	44%	0.439	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	48.3	-178	-164.9	46.6	0	0	0	113.6	D436 K438 F451	D436-N440 CarbonylContact O-C 3.5Å; D436-N440 WeakPolarHBondContact O-CA 3.3Å; D436-N440 PolarHBondContact O-N 2.94Å; K438-N440 VanDerWaalsContact C-N 3.32Å; N440-F451 PolarHBondContact O-N 3.45Å
441	C	96.7	Very high	95.7	Very high	8 Å²	8	69.2 Å²	69.2	5%	0.054	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	157.9	-178.8	70.4	0	0	0	0	113.3	D436 E439 T449 F451	D436-C441 WeakPolarHBondContact CA-O 3.49Å; D436-C441 PolarHBondContact N-O 3.3Å; D436-C441 PolarHBondContact O-N 3.44Å; E439-C441 VanDerWaalsContact C-N 3.34Å; E439-C441 PolarHBondContact O-N 3.3Å; C441-T449 CarbonylContact C-O 3.59Å; C441-T449 VanDerWaalsContact CA-O 3.27Å; C441-T449 WeakPolarHBondContact CA-O 3.49Å; C441-T449 VanDerWaalsContact CB-O 3.26Å; C441-T449 WeakPolarHBondContact CB-O 3.43Å; C441-F451 VanDerWaalsContact C-CE2 3.42Å; C441-F451 WeakPolarHBondContact O-CE2 3.4Å
442	L	98	Very high	95.5	Very high	1 Å²	1	68 Å²	68	1%	0.005	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	125.4	165.1	-173.2	75.1	0	0	0	109	I339 V352 F423 L428 C433 I435 V444 T449 F451	I339-L442 HydrophobicContact CD1-CD2 3.69Å; I339-L442 HydrophobicContact CG2-CB 4.04Å; I339-L442 HydrophobicContact CG2-CD2 4.49Å; V352-L442 HydrophobicContact CG1-CD1 4.41Å; V352-L442 HydrophobicContact CG2-CD2 4.44Å; F423-L442 HydrophobicContact CD1-CD2 4.45Å; F423-L442 HydrophobicContact CE1-CD2 4.25Å; L428-L442 HydrophobicContact CD2-CD1 3.99Å; C433-L442 HydrophobicContact CB-CD1 4.03Å; C433-L442 HydrophobicContact CB-CG 4.5Å; I435-L442 HydrophobicContact CG1-CD1 3.66Å; L442-V444 HydrophobicContact CD2-CG2 3.99Å; L442-V444 HydrophobicContact CG-CG2 4.09Å; L442-T449 HydrophobicContact CB-CG2 3.85Å; L442-T449 PolarHBondContact N-O 2.97Å; L442-T449 PolarHBondContact O-N 2.89Å; L442-F451 HydrophobicContact CB-CE1 3.95Å; L442-F451 HydrophobicContact CB-CZ 4Å
443	I	97.6	Very high	95.1	Very high	26 Å²	26	61.8 Å²	61.8	13%	0.133	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	127.5	176.3	-46.4	179.2	0	0	0	108.5	C433 V434 D436 A447 R448	C433-I443 CarbonylContact C-O 3.28Å; C433-I443 VanDerWaalsContact CA-O 3.26Å; C433-I443 WeakPolarHBondContact CA-O 3.47Å; V434-I443 HydrophobicContact CB-CB 4.09Å; V434-I443 HydrophobicContact CB-CD1 4.36Å; V434-I443 HydrophobicContact CB-CG1 4.43Å; V434-I443 PolarHBondContact N-O 2.83Å; V434-I443 PolarHBondContact O-N 3.36Å; D436-I443 HydrophobicContact CB-CD1 4.06Å; D436-I443 HydrophobicContact CB-CG1 4.31Å; I443-A447 WeakPolarHBondContact CA-O 3.39Å; I443-R448 HydrophobicContact CG1-CG 4.23Å; I443-R448 HydrophobicContact CG2-CG 4.32Å
444	V	94.9	Very high	94.5	Very high	5 Å²	5	64.2 Å²	64.2	3%	0.03	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	108.7	174.1	-167.7	0	0	0	0	109.6	I402 L407 H431 C433 L442 E446 A447	I402-V444 HydrophobicContact CD1-CG2 4.42Å; L407-V444 HydrophobicContact CD1-CG1 3.87Å; L407-V444 HydrophobicContact CD2-CG1 3.74Å; L407-V444 HydrophobicContact CG-CG1 4.43Å; H431-V444 HydrophobicContact CB-CG1 4.1Å; C433-V444 HydrophobicContact CB-CG2 4.19Å; C433-V444 VanDerWaalsContact SG-CG2 3.6Å; L442-V444 HydrophobicContact CD2-CG2 3.99Å; L442-V444 HydrophobicContact CG-CG2 4.09Å; V444-E446 PolarHBondContact O-N 3.42Å; V444-A447 PolarHBondContact N-O 2.75Å; V444-A447 PolarHBondContact O-N 3.3Å
445	G	89.2	Confident	93.9	Very high	66 Å²	66	67.1 Å²	67.1	68%	0.68	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	-120.9	-171	0	0	0	0	0	110.9
446	E	89	Confident	93.2	Very high	202 Å²	202	68.2 Å²	68.2	94%	0.944	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-11.1	176.5	-61.8	-176.3	170	0	0	113.3	V444	V444-E446 PolarHBondContact O-N 3.42Å
447	A	94.4	Very high	92.4	Very high	16 Å²	16	66.7 Å²	66.7	13%	0.132	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	141.5	-179.2	0	0	0	0	0	111.7	E403 V405 I443 V444	E403-A447 HydrophobicContact CB-CB 4.32Å; V405-A447 HydrophobicContact CB-CB 4.42Å; V405-A447 HydrophobicContact CG2-CB 3.57Å; I443-A447 WeakPolarHBondContact CA-O 3.39Å; V444-A447 PolarHBondContact N-O 2.75Å; V444-A447 PolarHBondContact O-N 3.3Å
448	R	96.6	Very high	91.4	Very high	145 Å²	145	63.3 Å²	63.3	55%	0.547	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	123.4	171.3	-62.8	-179.9	172.2	-109	-0	107.8	I443	I443-R448 HydrophobicContact CG1-CG 4.23Å; I443-R448 HydrophobicContact CG2-CG 4.32Å
449	T	96.7	Very high	90.3	Very high	2 Å²	2	57.9 Å²	57.9	1%	0.012	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	122.1	174.2	-167.6	0	0	0	0	109.2	I339 I402 E403 C441 L442	I339-T449 HydrophobicContact CB-CG2 3.94Å; I339-T449 HydrophobicContact CD1-CG2 4.21Å; I339-T449 HydrophobicContact CG2-CG2 3.75Å; I402-T449 HydrophobicContact CG2-CG2 3.54Å; E403-T449 VanDerWaalsContact OE1-CB 3.29Å; E403-T449 WeakPolarHBondContact OE1-CB 3.38Å; E403-T449 PolarHBondContact OE1-OG1 2.89Å; C441-T449 CarbonylContact C-O 3.59Å; C441-T449 VanDerWaalsContact CA-O 3.27Å; C441-T449 WeakPolarHBondContact CA-O 3.49Å; C441-T449 VanDerWaalsContact CB-O 3.26Å; C441-T449 WeakPolarHBondContact CB-O 3.43Å; L442-T449 HydrophobicContact CB-CG2 3.85Å; L442-T449 PolarHBondContact N-O 2.97Å; L442-T449 PolarHBondContact O-N 2.89Å
450	P	96.9	Very high	89	Confident	82 Å²	82	57.1 Å²	57.1	53%	0.532	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	145.6	-179.3	27.4	-33.6	0	0	0	111
451	F	96.7	Very high	87.6	Confident	10 Å²	10	53.5 Å²	53.5	4%	0.044	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-68	141.1	168	-66.2	-57.9	0	0	0	109.9	L337 F338 I339 V352 I435 L437 N440 C441 L442	L337-F451 HydrophobicContact CB-CD1 3.89Å; L337-F451 HydrophobicContact CB-CE1 3.84Å; L337-F451 HydrophobicContact CB-CG 4.48Å; L337-F451 HydrophobicContact CB-CZ 4.4Å; L337-F451 HydrophobicContact CD1-CE1 4.34Å; L337-F451 HydrophobicContact CD1-CE2 4.43Å; L337-F451 HydrophobicContact CD1-CZ 4.09Å; L337-F451 HydrophobicContact CD2-CD1 4.27Å; L337-F451 HydrophobicContact CD2-CD2 3.9Å; L337-F451 HydrophobicContact CD2-CE1 4.42Å; L337-F451 HydrophobicContact CD2-CE2 4.07Å; L337-F451 HydrophobicContact CD2-CG 4.04Å; L337-F451 HydrophobicContact CD2-CZ 4.34Å; L337-F451 HydrophobicContact CG-CE1 4.42Å; F338-F451 CarbonylContact O-C 3.52Å; F338-F451 VanDerWaalsContact O-CA 3.26Å; F338-F451 WeakPolarHBondContact O-CA 3.37Å; I339-F451 HydrophobicContact CG2-CD1 3.63Å; I339-F451 HydrophobicContact CG2-CE1 3.78Å; V352-F451 HydrophobicContact CB-CE1 4.43Å; V352-F451 HydrophobicContact CG2-CE1 4.22Å; I435-F451 HydrophobicContact CG2-CE2 4.22Å; I435-F451 HydrophobicContact CG2-CZ 3.92Å; L437-F451 HydrophobicContact CD2-CE2 4.21Å; N440-F451 PolarHBondContact O-N 3.45Å; C441-F451 VanDerWaalsContact C-CE2 3.42Å; C441-F451 WeakPolarHBondContact O-CE2 3.4Å; L442-F451 HydrophobicContact CB-CE1 3.95Å; L442-F451 HydrophobicContact CB-CZ 4Å
452	L	93.6	Very high	86	Confident	11 Å²	11	57.8 Å²	57.8	6%	0.058	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-63.5	140.5	178.9	-66.5	-175.4	0	0	0	111.3	F338 R340 T349 E456	F338-L452 HydrophobicContact CB-CB 4.09Å; F338-L452 HydrophobicContact CB-CD1 3.78Å; F338-L452 HydrophobicContact CB-CG 4.07Å; F338-L452 PolarHBondContact O-N 3.01Å; R340-L452 HydrophobicContact CG-CD2 3.73Å; T349-L452 HydrophobicContact CG2-CD1 3.51Å; L452-E456 HydrophobicContact CB-CB 4.24Å; L452-E456 HydrophobicContact CD2-CB 4.26Å
453	A	89.1	Confident	84.2	Confident	39 Å²	39	63.6 Å²	63.6	32%	0.322	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-71.8	157.5	169.8	0	0	0	0	0	111.1	H455 E456 M457	A453-H455 VanDerWaalsContact CB-CE1 3.43Å; A453-H455 WeakPolarHBondContact CB-CE1 3.4Å; A453-H455 WeakPolarHBondContact CB-ND1 3.1Å; A453-H455 PolarHBondContact O-N 2.92Å; A453-E456 HydrophobicContact CB-CG 4.38Å; A453-E456 PolarHBondContact N-OE2 3.04Å; A453-E456 VanDerWaalsContact N-OE2 3.11Å; A453-E456 WeakPolarHBondContact O-CA 3.31Å; A453-E456 WeakPolarHBondContact O-CB 3.2Å; A453-E456 PolarHBondContact O-N 3.2Å; A453-M457 PolarHBondContact O-N 3.06Å
454	E	84.2	Confident	82.4	Confident	73 Å²	73	64.6 Å²	64.6	34%	0.341	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-38.5	-178.1	-167.6	-176	163.5	0	0	113.5	E456 M457 R462	E454-E456 VanDerWaalsContact C-N 3.3Å; E454-E456 PolarHBondContact O-N 3.41Å; E454-M457 PolarHBondContact O-N 2.79Å; E454-R462 PolarHBondContact O-NE 3.32Å; E454-R462 VanDerWaalsContact O-NE 3.09Å
455	H	84.3	Confident	80.6	Confident	140 Å²	140	65.2 Å²	65.2	65%	0.648	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-16.3	-180	70.4	-86.6	0	0	0	114.1	A453 R462	A453-H455 VanDerWaalsContact CB-CE1 3.43Å; A453-H455 WeakPolarHBondContact CB-CE1 3.4Å; A453-H455 WeakPolarHBondContact CB-ND1 3.1Å; A453-H455 PolarHBondContact O-N 2.92Å; H455-R462 VanDerWaalsContact C-NH2 3.3Å; H455-R462 PolarHBondContact O-NH2 3.21Å
456	E	83.6	Confident	78.9	Confident	77 Å²	77	67.9 Å²	67.9	36%	0.36	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-16.4	177.6	-57.8	-176.7	113.1	0	0	112.2	R340 L452 A453 E454	R340-E456 IonicContact CZ-OE1 3.88Å; R340-E456 IonicContact NH2-OE1 2.71Å; R340-E456 PolarHBondContact NH2-OE1 3.07Å; L452-E456 HydrophobicContact CB-CB 4.24Å; L452-E456 HydrophobicContact CD2-CB 4.26Å; A453-E456 HydrophobicContact CB-CG 4.38Å; A453-E456 PolarHBondContact N-OE2 3.04Å; A453-E456 VanDerWaalsContact N-OE2 3.11Å; A453-E456 WeakPolarHBondContact O-CA 3.31Å; A453-E456 WeakPolarHBondContact O-CB 3.2Å; A453-E456 PolarHBondContact O-N 3.2Å; E454-E456 VanDerWaalsContact C-N 3.3Å; E454-E456 PolarHBondContact O-N 3.41Å
457	M	79.3	Confident	77	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.01	34%	0.34	C	S	.	.	S	Bend	trans	-63.4	139	177.2	-64.6	173.2	64.3	0	0	110.8	M336 F338 A453 E454 R462 Q465	M336-M457 HydrophobicContact CB-CE 4.04Å; F338-M457 HydrophobicContact CD2-CE 3.63Å; F338-M457 HydrophobicContact CD2-CG 4.35Å; F338-M457 HydrophobicContact CD2-SD 4.5Å; F338-M457 HydrophobicContact CE2-CE 3.5Å; F338-M457 VanDerWaalsContact CE2-CE 3.5Å; A453-M457 PolarHBondContact O-N 3.06Å; E454-M457 PolarHBondContact O-N 2.79Å; M457-R462 HydrophobicContact CB-CG 4.27Å; M457-R462 PolarHBondContact O-NE 2.78Å; M457-R462 PolarHBondContact O-NH2 2.88Å; M457-Q465 VanDerWaalsContact CE-OE1 3.22Å
458	P	74.7	Confident	74.8	Confident	45 Å²	45	68.5 Å²	68.5	29%	0.292	36%	0.36	S	S	.	.			trans	-55.5	141.1	175.4	-22.6	31.2	0	0	0	111.5	T349 I460 C461 R462	T349-P458 HydrophobicContact CG2-CG 4.39Å; T349-P458 WeakPolarHBondContact OG1-CG 3.31Å; P458-I460 PolarHBondContact O-N 2.8Å; P458-C461 HydrophobicContact CB-CB 4.32Å; P458-C461 WeakPolarHBondContact O-CA 3.41Å; P458-C461 WeakPolarHBondContact O-CB 3.42Å; P458-C461 PolarHBondContact O-N 3.1Å; P458-R462 PolarHBondContact O-N 3.31Å
459	A	72	Confident	72.3	Confident	68 Å²	68	63.2 Å²	63.2	56%	0.562	35%	0.351	S	S	*	.	H	α-helix	trans	-57.8	-37	-176.1	0	0	0	0	0	113	C461 R462 Q463	A459-C461 VanDerWaalsContact C-N 3.28Å; A459-C461 PolarHBondContact O-N 2.91Å; A459-R462 PolarHBondContact O-N 2.92Å; A459-Q463 PolarHBondContact O-N 2.91Å
460	I	67.3	Low	69.4	Low	100 Å²	100	67.9 Å²	67.9	51%	0.513	38%	0.381	S	S	.	.	H	α-helix	trans	-62.2	-38.3	175.2	-62	169.8	0	0	0	110.4	P418 P458 Q463 V464	P418-I460 HydrophobicContact CB-CG2 3.7Å; P418-I460 WeakPolarHBondContact O-CG2 3.37Å; P458-I460 PolarHBondContact O-N 2.8Å; I460-Q463 WeakPolarHBondContact O-CB 3.31Å; I460-Q463 PolarHBondContact O-N 3.39Å; I460-V464 PolarHBondContact O-N 3.49Å
461	C	64.9	Low	66.4	Low	6 Å²	6	70.3 Å²	70.3	4%	0.041	40%	0.4	C	S	.	.	H	α-helix	trans	-71.6	-32.2	177.6	-57.6	0	0	0	0	112.8	F338 P458 A459 Q463 V464 Q465	F338-C461 HydrophobicContact CE1-CB 4.14Å; F338-C461 HydrophobicContact CE2-CB 4.22Å; F338-C461 HydrophobicContact CZ-CB 3.61Å; P458-C461 HydrophobicContact CB-CB 4.32Å; P458-C461 WeakPolarHBondContact O-CA 3.41Å; P458-C461 WeakPolarHBondContact O-CB 3.42Å; P458-C461 PolarHBondContact O-N 3.1Å; A459-C461 VanDerWaalsContact C-N 3.28Å; A459-C461 PolarHBondContact O-N 2.91Å; C461-Q463 VanDerWaalsContact C-N 3.26Å; C461-Q463 PolarHBondContact O-N 3.46Å; C461-V464 WeakPolarHBondContact O-CB 3.46Å; C461-V464 PolarHBondContact O-N 3.32Å; C461-V464 VanDerWaalsContact O-N 3.14Å; C461-Q465 PolarHBondContact O-N 2.82Å
462	R	64.2	Low	63.5	Low	98 Å²	98	75.2 Å²	75.2	37%	0.37	43%	0.425	S	S	.	.	H	α-helix	trans	-62	-37.5	172.7	-64.2	-173.5	-158.8	153.1	13.3	111.5	E454 H455 M457 P458 A459 V464 Q465 D466	E454-R462 PolarHBondContact O-NE 3.32Å; E454-R462 VanDerWaalsContact O-NE 3.09Å; H455-R462 VanDerWaalsContact C-NH2 3.3Å; H455-R462 PolarHBondContact O-NH2 3.21Å; M457-R462 HydrophobicContact CB-CG 4.27Å; M457-R462 PolarHBondContact O-NE 2.78Å; M457-R462 PolarHBondContact O-NH2 2.88Å; P458-R462 PolarHBondContact O-N 3.31Å; A459-R462 PolarHBondContact O-N 2.92Å; R462-V464 VanDerWaalsContact C-N 3.33Å; R462-Q465 WeakPolarHBondContact O-CB 3.41Å; R462-Q465 PolarHBondContact O-N 3.1Å; R462-D466 PolarHBondContact O-N 2.83Å
463	Q	59.7	Low	60.6	Low	122 Å²	122	84.7 Å²	84.7	57%	0.57	46%	0.46	S	S	*	.	H	α-helix	trans	-65.9	-36.8	173.9	-64.6	177.3	-17.7	0	0	112	A459 I460 C461 Q465 D466 Q467	A459-Q463 PolarHBondContact O-N 2.91Å; I460-Q463 WeakPolarHBondContact O-CB 3.31Å; I460-Q463 PolarHBondContact O-N 3.39Å; C461-Q463 VanDerWaalsContact C-N 3.26Å; C461-Q463 PolarHBondContact O-N 3.46Å; Q463-Q465 VanDerWaalsContact C-N 3.34Å; Q463-D466 PolarHBondContact O-N 2.91Å; Q463-Q467 WeakPolarHBondContact O-CG 3.47Å; Q463-Q467 PolarHBondContact O-N 3.5Å
464	V	58.8	Low	58.1	Low	47 Å²	47	87.1 Å²	87.1	29%	0.285	47%	0.468	S	S	.	.	H	α-helix	trans	-64.6	-40.5	172.4	178.3	0	0	0	0	110.5	P418 I460 C461 R462 D466 Q467 A468	P418-V464 HydrophobicContact CB-CG2 4.02Å; P418-V464 HydrophobicContact CG-CG2 3.95Å; I460-V464 PolarHBondContact O-N 3.49Å; C461-V464 WeakPolarHBondContact O-CB 3.46Å; C461-V464 PolarHBondContact O-N 3.32Å; C461-V464 VanDerWaalsContact O-N 3.14Å; R462-V464 VanDerWaalsContact C-N 3.33Å; V464-D466 VanDerWaalsContact C-N 3.34Å; V464-D466 PolarHBondContact O-N 2.6Å; V464-Q467 CarbonylContact O-C 3.55Å; V464-Q467 PolarHBondContact O-N 2.95Å; V464-Q467 VanDerWaalsContact O-N 3.1Å; V464-A468 HydrophobicContact CG1-CB 4.45Å; V464-A468 WeakPolarHBondContact O-CB 3.14Å; V464-A468 PolarHBondContact O-N 2.88Å
465	Q	57.1	Low	55.8	Low	19 Å²	19	92.4 Å²	92.4	9%	0.089	48%	0.484	C	S	.	.	H	α-helix	trans	-62.6	-39.3	175.8	-174.3	-179.7	-11.6	0	0	112.2	V334 M336 M457 C461 R462 Q463 Q467 A468 G469	V334-Q465 PolarHBondContact O-NE2 2.74Å; M336-Q465 HydrophobicContact CG-CB 4.3Å; M336-Q465 HydrophobicContact CG-CG 3.99Å; M457-Q465 VanDerWaalsContact CE-OE1 3.22Å; C461-Q465 PolarHBondContact O-N 2.82Å; R462-Q465 WeakPolarHBondContact O-CB 3.41Å; R462-Q465 PolarHBondContact O-N 3.1Å; Q463-Q465 VanDerWaalsContact C-N 3.34Å; Q465-Q467 PolarHBondContact O-N 3.49Å; Q465-A468 PolarHBondContact O-N 3.14Å; Q465-G469 PolarHBondContact O-N 2.74Å
466	D	54.4	Low	53.7	Low	121 Å²	121	91.2 Å²	91.2	65%	0.647	48%	0.482	S	S	*	.	H	α-helix	trans	-65.5	-24.2	174.5	-72.3	-25.7	0	0	0	113.2	R462 Q463 V464	R462-D466 PolarHBondContact O-N 2.83Å; Q463-D466 PolarHBondContact O-N 2.91Å; V464-D466 VanDerWaalsContact C-N 3.34Å; V464-D466 PolarHBondContact O-N 2.6Å
467	Q	49.2	Very low	51.6	Low	165 Å²	165	93 Å²	93	77%	0.771	49%	0.494	S	S	*	.	H	α-helix	trans	-96.6	-28.4	179.2	-68.3	179.9	15.1	0	0	113.6	Q463 V464 Q465	Q463-Q467 WeakPolarHBondContact O-CG 3.47Å; Q463-Q467 PolarHBondContact O-N 3.5Å; V464-Q467 CarbonylContact O-C 3.55Å; V464-Q467 PolarHBondContact O-N 2.95Å; V464-Q467 VanDerWaalsContact O-N 3.1Å; Q465-Q467 PolarHBondContact O-N 3.49Å
468	A	48.3	Very low	49.8	Very low	67 Å²	67	95.9 Å²	95.9	55%	0.554	52%	0.524	S	S	*	.	H	α-helix	trans	-95.7	-10.9	-178.9	0	0	0	0	0	113.2	V464 Q465	V464-A468 HydrophobicContact CG1-CB 4.45Å; V464-A468 WeakPolarHBondContact O-CB 3.14Å; V464-A468 PolarHBondContact O-N 2.88Å; Q465-A468 PolarHBondContact O-N 3.14Å
469	G	43.9	Very low	48.3	Very low	33 Å²	33	94.9 Å²	94.9	34%	0.34	52%	0.52	S	S	.	.	S	Bend	trans	-53.8	154.8	162.9	0	0	0	0	0	110	Q465 S471	Q465-G469 PolarHBondContact O-N 2.74Å; G469-S471 PolarHBondContact O-N 3.28Å
470	P	35.2	Very low	47.5	Very low	101 Å²	101	98.8 Å²	98.8	66%	0.656	53%	0.531	S	S	*	.			trans	-48.6	126.4	177.2	20.5	-30.7	0	0	0	108	I472	P470-I472 HydrophobicContact CB-CB 4.32Å; P470-I472 HydrophobicContact CB-CG1 4.36Å; P470-I472 CarbonylContact O-C 3.54Å; P470-I472 WeakPolarHBondContact O-CA 3.19Å; P470-I472 PolarHBondContact O-N 2.93Å
471	S	33.8	Very low	47.6	Very low	132 Å²	132	95.7 Å²	95.7	92%	0.923	51%	0.514	S	S	*	.	S	Bend	trans	-54.2	-5.9	173.3	40.2	0	0	0	0	112.7	G469 R473	G469-S471 PolarHBondContact O-N 3.28Å; S471-R473 VanDerWaalsContact C-N 3.27Å; S471-R473 PolarHBondContact O-N 3.16Å; S471-R473 VanDerWaalsContact O-N 3.1Å
472	I	35.1	Very low	48	Very low	113 Å²	113	97.9 Å²	97.9	58%	0.579	53%	0.532	S	S	*	.			trans	-73.8	77.6	158.1	-36.3	180	0	0	0	109.7	P470 L474	P470-I472 HydrophobicContact CB-CB 4.32Å; P470-I472 HydrophobicContact CB-CG1 4.36Å; P470-I472 CarbonylContact O-C 3.54Å; P470-I472 WeakPolarHBondContact O-CA 3.19Å; P470-I472 PolarHBondContact O-N 2.93Å; I472-L474 HydrophobicContact CG2-CB 4.48Å; I472-L474 HydrophobicContact CG2-CD2 3.68Å; I472-L474 HydrophobicContact CG2-CG 3.61Å; I472-L474 PolarHBondContact O-N 3.3Å
473	R	33.8	Very low	48.7	Very low	211 Å²	211	99.3 Å²	99.3	80%	0.796	54%	0.543	S	S	*	.			trans	-61.6	94.5	142.8	-79.5	-173	-172.8	172.7	3.5	105.3	S471 R475	S471-R473 VanDerWaalsContact C-N 3.27Å; S471-R473 PolarHBondContact O-N 3.16Å; S471-R473 VanDerWaalsContact O-N 3.1Å; R473-R475 PolarHBondContact O-N 2.96Å
474	L	37.1	Very low	49.8	Very low	90 Å²	90	99.1 Å²	99.1	47%	0.471	54%	0.542	S	S	.	.			trans	-57.9	96.1	167	-77.9	165.6	0	0	0	105.7	F331 I472 L476	F331-L474 HydrophobicContact CD1-CD1 3.99Å; F331-L474 HydrophobicContact CE1-CD1 4.29Å; I472-L474 HydrophobicContact CG2-CB 4.48Å; I472-L474 HydrophobicContact CG2-CD2 3.68Å; I472-L474 HydrophobicContact CG2-CG 3.61Å; I472-L474 PolarHBondContact O-N 3.3Å; L474-L476 PolarHBondContact O-N 3.42Å
475	R	36	Very low	51	Low	184 Å²	184	98.8 Å²	98.8	69%	0.694	54%	0.539	S	S	*	.			trans	-68.4	90.8	167.8	-74.8	-173.8	179.9	169	-0.1	105.2	R473 D477	R473-R475 PolarHBondContact O-N 2.96Å; R475-D477 PolarHBondContact O-N 3.17Å
476	L	39.8	Very low	52.3	Low	115 Å²	115	99.3 Å²	99.3	60%	0.602	54%	0.542	S	S	*	.			trans	-56.8	-5	171.1	-78.7	144.2	0	0	0	112.4	F320 L474 G478	F320-L476 HydrophobicContact CE2-CD2 4.28Å; F320-L476 HydrophobicContact CZ-CD2 3.87Å; L474-L476 PolarHBondContact O-N 3.42Å; L476-G478 VanDerWaalsContact C-N 3.27Å; L476-G478 PolarHBondContact O-N 3.45Å
477	D	38.6	Very low	53.8	Low	114 Å²	114	100.3 Å²	100.3	61%	0.61	54%	0.537	S	S	*	.	S	Bend	trans	-84.7	29.4	178.6	-49.8	-20.2	0	0	0	113.9	R475 A479 K504	R475-D477 PolarHBondContact O-N 3.17Å; D477-A479 WeakPolarHBondContact O-CB 3.38Å; D477-A479 PolarHBondContact O-N 3.22Å; D477-K504 VanDerWaalsContact O-CE 3.27Å; D477-K504 WeakPolarHBondContact O-CE 3.03Å; D477-K504 PolarHBondContact O-NZ 2.95Å; D477-K504 VanDerWaalsContact O-NZ 3.17Å
478	G	41.5	Very low	55.6	Low	62 Å²	62	95.8 Å²	95.8	64%	0.639	52%	0.515	S	S	*	.			trans	50.1	19	164.5	0	0	0	0	0	118	L476	L476-G478 VanDerWaalsContact C-N 3.27Å; L476-G478 PolarHBondContact O-N 3.45Å
479	A	43.5	Very low	57.3	Low	24 Å²	24	92.6 Å²	92.6	20%	0.198	49%	0.488	C	S	.	.			trans	-123.4	66.8	-170.4	0	0	0	0	0	111.6	D477 F481 I500	D477-A479 WeakPolarHBondContact O-CB 3.38Å; D477-A479 PolarHBondContact O-N 3.22Å; A479-F481 HydrophobicContact CB-CD2 4.3Å; A479-F481 HydrophobicContact CB-CE2 4.03Å; A479-I500 HydrophobicContact CB-CG2 3.8Å
480	N	55.2	Low	59.3	Low	151 Å²	151	93.3 Å²	93.3	81%	0.807	49%	0.486	S	S	*	.			trans	-105.2	67.6	154.8	-82.5	-11.5	0	0	0	108.1
481	F	68.9	Low	61.8	Low	34 Å²	34	97.2 Å²	97.2	15%	0.149	49%	0.488	C	S	.	.			trans	-73	139.9	162.3	-56.7	-66.5	0	0	0	108.2	A479 E483 I486 L503 K504 G508	A479-F481 HydrophobicContact CB-CD2 4.3Å; A479-F481 HydrophobicContact CB-CE2 4.03Å; F481-E483 PolarHBondContact O-N 2.94Å; F481-I486 HydrophobicContact CB-CD1 4.42Å; F481-I486 HydrophobicContact CB-CG1 4.04Å; F481-L503 HydrophobicContact CB-CB 4.46Å; F481-L503 HydrophobicContact CB-CD1 3.78Å; F481-L503 HydrophobicContact CD1-CB 3.75Å; F481-L503 HydrophobicContact CD1-CD1 4.47Å; F481-L503 HydrophobicContact CD1-CG 4.48Å; F481-L503 HydrophobicContact CD2-CB 3.45Å; F481-L503 VanDerWaalsContact CD2-CB 3.45Å; F481-L503 HydrophobicContact CD2-CD1 4.06Å; F481-L503 HydrophobicContact CD2-CG 4.38Å; F481-L503 HydrophobicContact CE1-CB 3.82Å; F481-L503 WeakPolarHBondContact CE1-O 3.13Å; F481-L503 HydrophobicContact CE2-CB 3.52Å; F481-L503 HydrophobicContact CG-CB 3.58Å; F481-L503 HydrophobicContact CG-CD1 3.82Å; F481-L503 HydrophobicContact CG-CG 4.21Å; F481-L503 HydrophobicContact CZ-CB 3.73Å; F481-L503 VanDerWaalsContact CZ-O 3.23Å; F481-L503 WeakPolarHBondContact CZ-O 3.32Å; F481-K504 HydrophobicContact CE2-CB 4.46Å; F481-K504 HydrophobicContact CE2-CG 3.76Å; F481-K504 HydrophobicContact CZ-CB 4.46Å; F481-K504 HydrophobicContact CZ-CG 4.05Å; F481-K504 VanDerWaalsContact CZ-N 3.34Å; F481-G508 VanDerWaalsContact CE1-CA 3.45Å
482	A	75.2	Confident	64.1	Low	52 Å²	52	94.3 Å²	94.3	43%	0.43	47%	0.467	S	S	.	.			trans	-53.8	138.8	176.8	0	0	0	0	0	109.3	E484 D485 I486	A482-E484 PolarHBondContact O-N 3.21Å; A482-D485 HydrophobicContact CB-CB 4.5Å; A482-D485 WeakPolarHBondContact O-CA 3.24Å; A482-D485 WeakPolarHBondContact O-CB 3.26Å; A482-D485 PolarHBondContact O-N 2.88Å; A482-I486 PolarHBondContact O-N 3.1Å; A482-I486 VanDerWaalsContact O-N 3.11Å
483	E	77.6	Confident	66.3	Low	128 Å²	128	92.3 Å²	92.3	60%	0.598	47%	0.474	S	S	*	.	H	α-helix	trans	-56.2	-29.5	179.3	-161.3	-173.8	156	0	0	111.1	F481 R487	F481-E483 PolarHBondContact O-N 2.94Å; E483-R487 VanDerWaalsContact O-CB 3.31Å; E483-R487 WeakPolarHBondContact O-CB 3.33Å; E483-R487 WeakPolarHBondContact O-CG 3.42Å; E483-R487 PolarHBondContact O-N 3.09Å; E483-R487 IonicContact OE1-CZ 3.8Å; E483-R487 IonicContact OE1-NE 3.89Å; E483-R487 PolarHBondContact OE1-NE 2.87Å; E483-R487 IonicContact OE1-NH2 2.69Å; E483-R487 PolarHBondContact OE1-NH2 3.29Å
484	E	83.3	Confident	68.7	Low	118 Å²	118	83.3 Å²	83.3	55%	0.551	44%	0.44	S	S	*	.	H	α-helix	trans	-62.6	-39.7	173	-158.3	-168.3	138.1	0	0	113.3	A482 R487 K488	A482-E484 PolarHBondContact O-N 3.21Å; E484-R487 PolarHBondContact O-N 3.49Å; E484-K488 VanDerWaalsContact O-CG 3.3Å; E484-K488 WeakPolarHBondContact O-CG 3.35Å; E484-K488 PolarHBondContact O-N 3.33Å; E484-K488 WeakPolarHBondContact OE1-CE 3.25Å; E484-K488 IonicContact OE1-NZ 2.63Å; E484-K488 PolarHBondContact OE1-NZ 2.95Å
485	D	83.8	Confident	71	Confident	40 Å²	40	82.8 Å²	82.8	21%	0.214	44%	0.441	C	S	.	.	H	α-helix	trans	-74.3	-40.7	-179.8	-66.6	-25.8	0	0	0	111.1	A482 R487 K488 V489 L503 V510	A482-D485 HydrophobicContact CB-CB 4.5Å; A482-D485 WeakPolarHBondContact O-CA 3.24Å; A482-D485 WeakPolarHBondContact O-CB 3.26Å; A482-D485 PolarHBondContact O-N 2.88Å; D485-R487 VanDerWaalsContact C-N 3.31Å; D485-R487 PolarHBondContact O-N 3.41Å; D485-K488 PolarHBondContact O-N 2.96Å; D485-K488 VanDerWaalsContact O-N 3.14Å; D485-K488 IonicContact OD1-NZ 3.45Å; D485-K488 PolarHBondContact OD1-NZ 3.48Å; D485-K488 VanDerWaalsContact OD1-NZ 3.11Å; D485-V489 WeakPolarHBondContact O-CG2 3.37Å; D485-V489 PolarHBondContact O-N 3.41Å; D485-V489 VanDerWaalsContact O-N 3.08Å; D485-L503 HydrophobicContact CB-CD1 4.43Å; D485-V510 HydrophobicContact CB-CG2 3.61Å
486	I	84.3	Confident	73.1	Confident	30 Å²	30	78 Å²	78	15%	0.154	43%	0.432	C	S	.	.	H	α-helix	trans	-56.8	-49.1	169.3	-59.7	175	0	0	0	109.1	F481 A482 K488 V489 T490 V496 A499 I500 L503	F481-I486 HydrophobicContact CB-CD1 4.42Å; F481-I486 HydrophobicContact CB-CG1 4.04Å; A482-I486 PolarHBondContact O-N 3.1Å; A482-I486 VanDerWaalsContact O-N 3.11Å; I486-K488 VanDerWaalsContact C-N 3.29Å; I486-K488 PolarHBondContact O-N 3.43Å; I486-V489 PolarHBondContact O-N 3.26Å; I486-V489 VanDerWaalsContact O-N 3.17Å; I486-T490 WeakPolarHBondContact O-CB 3.04Å; I486-T490 PolarHBondContact O-N 3.08Å; I486-T490 PolarHBondContact O-OG1 3.5Å; I486-V496 HydrophobicContact CG2-CG1 4.11Å; I486-A499 HydrophobicContact CG2-CB 4.09Å; I486-I500 HydrophobicContact CD1-CG1 4.07Å; I486-I500 HydrophobicContact CG1-CG1 4.45Å; I486-L503 HydrophobicContact CG1-CD1 3.97Å
487	R	86.7	Confident	75.1	Confident	142 Å²	142	75.9 Å²	75.9	54%	0.536	43%	0.431	S	S	.	.	H	α-helix	trans	-62	-30.8	177.5	-75.8	174.2	-173	-162.9	5.2	113.5	E483 E484 D485 R491	E483-R487 VanDerWaalsContact O-CB 3.31Å; E483-R487 WeakPolarHBondContact O-CB 3.33Å; E483-R487 WeakPolarHBondContact O-CG 3.42Å; E483-R487 PolarHBondContact O-N 3.09Å; E483-R487 IonicContact OE1-CZ 3.8Å; E483-R487 IonicContact OE1-NE 3.89Å; E483-R487 PolarHBondContact OE1-NE 2.87Å; E483-R487 IonicContact OE1-NH2 2.69Å; E483-R487 PolarHBondContact OE1-NH2 3.29Å; E484-R487 PolarHBondContact O-N 3.49Å; D485-R487 VanDerWaalsContact C-N 3.31Å; D485-R487 PolarHBondContact O-N 3.41Å; R487-R491 WeakPolarHBondContact O-CB 3.06Å; R487-R491 WeakPolarHBondContact O-CG 3.36Å; R487-R491 PolarHBondContact O-N 2.85Å; R487-R491 VanDerWaalsContact O-N 3.09Å; R487-R491 PolarHBondContact O-NE 2.77Å
488	K	86.8	Confident	77.2	Confident	71 Å²	71	72.7 Å²	72.7	31%	0.309	41%	0.412	S	S	.	.	H	α-helix	trans	-68.4	-43.6	174.9	-75	165.6	-168.4	152.8	0	110.7	E484 D485 I486 V510	E484-K488 VanDerWaalsContact O-CG 3.3Å; E484-K488 WeakPolarHBondContact O-CG 3.35Å; E484-K488 PolarHBondContact O-N 3.33Å; E484-K488 WeakPolarHBondContact OE1-CE 3.25Å; E484-K488 IonicContact OE1-NZ 2.63Å; E484-K488 PolarHBondContact OE1-NZ 2.95Å; D485-K488 PolarHBondContact O-N 2.96Å; D485-K488 VanDerWaalsContact O-N 3.14Å; D485-K488 IonicContact OD1-NZ 3.45Å; D485-K488 PolarHBondContact OD1-NZ 3.48Å; D485-K488 VanDerWaalsContact OD1-NZ 3.11Å; I486-K488 VanDerWaalsContact C-N 3.29Å; I486-K488 PolarHBondContact O-N 3.43Å; K488-V510 HydrophobicContact CB-CG1 3.62Å; K488-V510 HydrophobicContact CD-CG1 4.22Å; K488-V510 HydrophobicContact CD-CG2 4.29Å
489	V	83.5	Confident	79.2	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-69.9	-42.6	177.2	-176.2	0	0	0	0	111.3	D485 I486 R491 C492 F494 A499 L503 V510 A513 I514 L517	D485-V489 WeakPolarHBondContact O-CG2 3.37Å; D485-V489 PolarHBondContact O-N 3.41Å; D485-V489 VanDerWaalsContact O-N 3.08Å; I486-V489 PolarHBondContact O-N 3.26Å; I486-V489 VanDerWaalsContact O-N 3.17Å; V489-R491 VanDerWaalsContact C-N 3.27Å; V489-R491 PolarHBondContact O-N 2.8Å; V489-C492 WeakPolarHBondContact O-CB 3.35Å; V489-C492 PolarHBondContact O-N 3.03Å; V489-F494 HydrophobicContact CG1-CB 4.35Å; V489-F494 HydrophobicContact CG1-CD2 3.9Å; V489-F494 HydrophobicContact CG1-CG 4.5Å; V489-A499 HydrophobicContact CB-CB 3.76Å; V489-A499 HydrophobicContact CG1-CB 3.71Å; V489-L503 HydrophobicContact CG2-CD1 4.18Å; V489-L503 HydrophobicContact CG2-CD2 4.09Å; V489-L503 HydrophobicContact CG2-CG 4.06Å; V489-V510 HydrophobicContact CG2-CG1 3.99Å; V489-A513 HydrophobicContact CG2-CB 4.07Å; V489-I514 HydrophobicContact CB-CG1 4.47Å; V489-I514 HydrophobicContact CG1-CG1 4.25Å; V489-I514 HydrophobicContact CG2-CG1 4.21Å; V489-L517 HydrophobicContact CG1-CD1 3.44Å; V489-L517 VanDerWaalsContact CG1-CD1 3.44Å
490	T	86.1	Confident	81	Confident	48 Å²	48	71 Å²	71	29%	0.294	39%	0.385	S	S	.	.	H	α-helix	trans	-63	-32.3	177.4	-55.2	0	0	0	0	112.4	I486 C492 G493 F494	I486-T490 WeakPolarHBondContact O-CB 3.04Å; I486-T490 PolarHBondContact O-N 3.08Å; I486-T490 PolarHBondContact O-OG1 3.5Å; T490-C492 PolarHBondContact O-N 3.37Å; T490-G493 PolarHBondContact O-N 3.33Å; T490-F494 WeakPolarHBondContact CA-O 3.33Å; T490-F494 WeakPolarHBondContact CG2-O 3.37Å
491	R	87.2	Confident	82.2	Confident	183 Å²	183	67.5 Å²	67.5	69%	0.691	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-20	173.4	-90.6	-177.7	-84.5	-179.4	-7.4	113.8	R487 V489 G493	R487-R491 WeakPolarHBondContact O-CB 3.06Å; R487-R491 WeakPolarHBondContact O-CG 3.36Å; R487-R491 PolarHBondContact O-N 2.85Å; R487-R491 VanDerWaalsContact O-N 3.09Å; R487-R491 PolarHBondContact O-NE 2.77Å; V489-R491 VanDerWaalsContact C-N 3.27Å; V489-R491 PolarHBondContact O-N 2.8Å; R491-G493 VanDerWaalsContact C-N 3.25Å; R491-G493 PolarHBondContact O-N 3.04Å
492	C	82.6	Confident	82.8	Confident	71 Å²	71	65.9 Å²	65.9	48%	0.48	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	6	174.1	-62.3	0	0	0	0	113.6	V489 T490 F494 I514	V489-C492 WeakPolarHBondContact O-CB 3.35Å; V489-C492 PolarHBondContact O-N 3.03Å; T490-C492 PolarHBondContact O-N 3.37Å; C492-F494 HydrophobicContact CB-CD2 3.98Å; C492-F494 HydrophobicContact CB-CE2 3.93Å; C492-I514 HydrophobicContact CB-CG1 4.49Å; C492-I514 HydrophobicContact CB-CG2 4.47Å; C492-I514 VanDerWaalsContact SG-CD1 3.59Å
493	G	81.8	Confident	83.2	Confident	70 Å²	70	63.4 Å²	63.4	72%	0.722	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.7	2.6	176.4	0	0	0	0	0	115.1	T490 R491	T490-G493 PolarHBondContact O-N 3.33Å; R491-G493 VanDerWaalsContact C-N 3.25Å; R491-G493 PolarHBondContact O-N 3.04Å
494	F	83.8	Confident	83.3	Confident	23 Å²	23	62 Å²	62	10%	0.101	33%	0.328	C	S	.	.			trans	-85.2	146.7	178	-58.6	-64.5	0	0	0	112.3	V489 T490 C492 Q498 I514 L517 V518	V489-F494 HydrophobicContact CG1-CB 4.35Å; V489-F494 HydrophobicContact CG1-CD2 3.9Å; V489-F494 HydrophobicContact CG1-CG 4.5Å; T490-F494 WeakPolarHBondContact CA-O 3.33Å; T490-F494 WeakPolarHBondContact CG2-O 3.37Å; C492-F494 HydrophobicContact CB-CD2 3.98Å; C492-F494 HydrophobicContact CB-CE2 3.93Å; F494-Q498 HydrophobicContact CB-CB 3.99Å; F494-I514 HydrophobicContact CE2-CG2 4.36Å; F494-L517 HydrophobicContact CB-CD1 4.12Å; F494-L517 HydrophobicContact CD1-CB 3.92Å; F494-L517 HydrophobicContact CD1-CD1 4.21Å; F494-L517 HydrophobicContact CD2-CB 4.08Å; F494-L517 HydrophobicContact CD2-CD1 3.74Å; F494-L517 HydrophobicContact CE1-CB 3.59Å; F494-L517 HydrophobicContact CE2-CB 3.75Å; F494-L517 HydrophobicContact CE2-CD1 4.22Å; F494-L517 HydrophobicContact CG-CB 4.16Å; F494-L517 HydrophobicContact CG-CD1 3.74Å; F494-L517 HydrophobicContact CG-CG 4.49Å; F494-L517 HydrophobicContact CZ-CB 3.49Å; F494-L517 VanDerWaalsContact CZ-CB 3.49Å; F494-V518 HydrophobicContact CE2-CG2 4.37Å; F494-V518 HydrophobicContact CZ-CG2 3.8Å
495	T	84.1	Confident	82.9	Confident	79 Å²	79	62 Å²	62	49%	0.485	32%	0.324	S	S	.	.			trans	-66	161.4	174.1	70.2	0	0	0	0	111.2	A497 Q498 A499	T495-A497 PolarHBondContact O-N 3.47Å; T495-Q498 PolarHBondContact O-N 2.96Å; T495-Q498 VanDerWaalsContact O-N 3.17Å; T495-Q498 WeakPolarHBondContact OG1-CG 3.31Å; T495-Q498 PolarHBondContact OG1-N 3.36Å; T495-A499 WeakPolarHBondContact O-CB 3.25Å; T495-A499 PolarHBondContact O-N 3.23Å
496	V	81.5	Confident	82.7	Confident	82 Å²	82	60.8 Å²	60.8	50%	0.497	32%	0.318	S	S	.	.	H	α-helix	trans	-58.5	-36.9	175.8	175.6	0	0	0	0	111.3	I486 A499 I500	I486-V496 HydrophobicContact CG2-CG1 4.11Å; V496-A499 PolarHBondContact O-N 3Å; V496-I500 HydrophobicContact CG1-CD1 3.97Å; V496-I500 WeakPolarHBondContact O-CG1 3.34Å; V496-I500 PolarHBondContact O-N 2.75Å
497	A	80.8	Confident	82.2	Confident	71 Å²	71	66.2 Å²	66.2	59%	0.587	35%	0.348	S	S	*	.	H	α-helix	trans	-63.2	-47.6	175.7	0	0	0	0	0	111.6	T495 A499 I500 E501	T495-A497 PolarHBondContact O-N 3.47Å; A497-A499 VanDerWaalsContact C-N 3.35Å; A497-A499 PolarHBondContact O-N 3.22Å; A497-I500 PolarHBondContact O-N 2.84Å; A497-E501 WeakPolarHBondContact O-CB 3.42Å; A497-E501 PolarHBondContact O-N 2.87Å
498	Q	82.5	Confident	81.5	Confident	47 Å²	47	60.6 Å²	60.6	22%	0.22	33%	0.334	C	S	.	.	H	α-helix	trans	-62.3	-41.2	175.4	-74.5	174.1	-28.4	0	0	111.9	F494 T495 I500 E501 G502 L517	F494-Q498 HydrophobicContact CB-CB 3.99Å; T495-Q498 PolarHBondContact O-N 2.96Å; T495-Q498 VanDerWaalsContact O-N 3.17Å; T495-Q498 WeakPolarHBondContact OG1-CG 3.31Å; T495-Q498 PolarHBondContact OG1-N 3.36Å; Q498-I500 PolarHBondContact O-N 2.89Å; Q498-E501 PolarHBondContact O-N 2.72Å; Q498-G502 PolarHBondContact O-N 2.99Å; Q498-L517 HydrophobicContact CB-CD1 4.49Å; Q498-L517 HydrophobicContact CB-CD2 4Å; Q498-L517 WeakPolarHBondContact O-CD1 3.27Å; Q498-L517 WeakPolarHBondContact O-CD2 3.43Å
499	A	83.4	Confident	81.2	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-60.2	-47.4	177.7	0	0	0	0	0	111.9	I486 V489 T495 V496 A497 E501 G502 L503	I486-A499 HydrophobicContact CG2-CB 4.09Å; V489-A499 HydrophobicContact CB-CB 3.76Å; V489-A499 HydrophobicContact CG1-CB 3.71Å; T495-A499 WeakPolarHBondContact O-CB 3.25Å; T495-A499 PolarHBondContact O-N 3.23Å; V496-A499 PolarHBondContact O-N 3Å; A497-A499 VanDerWaalsContact C-N 3.35Å; A497-A499 PolarHBondContact O-N 3.22Å; A499-E501 VanDerWaalsContact C-N 3.31Å; A499-E501 PolarHBondContact O-N 2.93Å; A499-G502 PolarHBondContact O-N 3.09Å; A499-L503 VanDerWaalsContact O-CB 3.3Å; A499-L503 WeakPolarHBondContact O-CB 3.44Å; A499-L503 WeakPolarHBondContact O-CD1 3.13Å; A499-L503 WeakPolarHBondContact O-CG 3.44Å; A499-L503 PolarHBondContact O-N 3.48Å
500	I	81.6	Confident	81.2	Confident	50 Å²	50	61.4 Å²	61.4	26%	0.256	34%	0.342	S	S	.	.	H	α-helix	trans	-61.8	-42.5	176.2	-68	167.1	0	0	0	110.3	A479 I486 V496 A497 Q498 L503 K504	A479-I500 HydrophobicContact CB-CG2 3.8Å; I486-I500 HydrophobicContact CD1-CG1 4.07Å; I486-I500 HydrophobicContact CG1-CG1 4.45Å; V496-I500 HydrophobicContact CG1-CD1 3.97Å; V496-I500 WeakPolarHBondContact O-CG1 3.34Å; V496-I500 PolarHBondContact O-N 2.75Å; A497-I500 PolarHBondContact O-N 2.84Å; Q498-I500 PolarHBondContact O-N 2.89Å; I500-L503 PolarHBondContact O-N 3.41Å; I500-K504 HydrophobicContact CG2-CD 4.46Å; I500-K504 VanDerWaalsContact O-CG 3.3Å; I500-K504 WeakPolarHBondContact O-CG 3.37Å; I500-K504 PolarHBondContact O-N 3.03Å
501	E	80.8	Confident	81	Confident	79 Å²	79	67.6 Å²	67.6	37%	0.369	37%	0.365	S	S	.	.	H	α-helix	trans	-65.6	-44.7	179.4	-163.5	-177.6	179.2	0	0	112.6	A497 Q498 A499 L503 K504 Y505 W516 R520	A497-E501 WeakPolarHBondContact O-CB 3.42Å; A497-E501 PolarHBondContact O-N 2.87Å; Q498-E501 PolarHBondContact O-N 2.72Å; A499-E501 VanDerWaalsContact C-N 3.31Å; A499-E501 PolarHBondContact O-N 2.93Å; E501-L503 VanDerWaalsContact C-N 3.33Å; E501-L503 PolarHBondContact O-N 3.12Å; E501-K504 WeakPolarHBondContact O-CB 3.41Å; E501-K504 PolarHBondContact O-N 2.77Å; E501-Y505 PolarHBondContact O-N 3.16Å; E501-W516 HydrophobicContact CG-CH2 4.01Å; E501-W516 HydrophobicContact CG-CZ3 4.22Å; E501-R520 IonicContact OE1-CZ 3.14Å; E501-R520 IonicContact OE1-NH1 3.08Å; E501-R520 PolarHBondContact OE1-NH1 3.4Å; E501-R520 IonicContact OE1-NH2 3.41Å; E501-R520 PolarHBondContact OE1-NH2 3.36Å; E501-R520 IonicContact OE2-CZ 3.63Å; E501-R520 IonicContact OE2-NH1 2.79Å; E501-R520 PolarHBondContact OE2-NH1 3.43Å; E501-R520 IonicContact OE2-NH2 2.57Å
502	G	81.2	Confident	80.7	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-63.3	-40.1	175.8	0	0	0	0	0	112.2	Q498 A499 Y505 S506 A513	Q498-G502 PolarHBondContact O-N 2.99Å; A499-G502 PolarHBondContact O-N 3.09Å; G502-Y505 PolarHBondContact O-N 2.86Å; G502-S506 WeakPolarHBondContact O-CB 2.83Å; G502-S506 PolarHBondContact O-N 3.2Å; G502-S506 PolarHBondContact O-OG 3.42Å; G502-S506 VanDerWaalsContact O-OG 3.05Å; G502-A513 VanDerWaalsContact C-CB 3.43Å; G502-A513 WeakPolarHBondContact O-CB 3.5Å
503	L	83.1	Confident	80.8	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-68.2	-35.3	175.3	-71.3	165.6	0	0	0	112.2	F481 D485 I486 V489 A499 I500 E501 S506 N507 G508 V510 A513	F481-L503 HydrophobicContact CB-CB 4.46Å; F481-L503 HydrophobicContact CB-CD1 3.78Å; F481-L503 HydrophobicContact CD1-CB 3.75Å; F481-L503 HydrophobicContact CD1-CD1 4.47Å; F481-L503 HydrophobicContact CD1-CG 4.48Å; F481-L503 HydrophobicContact CD2-CB 3.45Å; F481-L503 VanDerWaalsContact CD2-CB 3.45Å; F481-L503 HydrophobicContact CD2-CD1 4.06Å; F481-L503 HydrophobicContact CD2-CG 4.38Å; F481-L503 HydrophobicContact CE1-CB 3.82Å; F481-L503 WeakPolarHBondContact CE1-O 3.13Å; F481-L503 HydrophobicContact CE2-CB 3.52Å; F481-L503 HydrophobicContact CG-CB 3.58Å; F481-L503 HydrophobicContact CG-CD1 3.82Å; F481-L503 HydrophobicContact CG-CG 4.21Å; F481-L503 HydrophobicContact CZ-CB 3.73Å; F481-L503 VanDerWaalsContact CZ-O 3.23Å; F481-L503 WeakPolarHBondContact CZ-O 3.32Å; D485-L503 HydrophobicContact CB-CD1 4.43Å; I486-L503 HydrophobicContact CG1-CD1 3.97Å; V489-L503 HydrophobicContact CG2-CD1 4.18Å; V489-L503 HydrophobicContact CG2-CD2 4.09Å; V489-L503 HydrophobicContact CG2-CG 4.06Å; A499-L503 VanDerWaalsContact O-CB 3.3Å; A499-L503 WeakPolarHBondContact O-CB 3.44Å; A499-L503 WeakPolarHBondContact O-CD1 3.13Å; A499-L503 WeakPolarHBondContact O-CG 3.44Å; A499-L503 PolarHBondContact O-N 3.48Å; I500-L503 PolarHBondContact O-N 3.41Å; E501-L503 VanDerWaalsContact C-N 3.33Å; E501-L503 PolarHBondContact O-N 3.12Å; L503-S506 WeakPolarHBondContact CA-OG 3.43Å; L503-S506 PolarHBondContact O-N 2.52Å; L503-S506 PolarHBondContact O-OG 2.81Å; L503-N507 PolarHBondContact O-N 2.57Å; L503-N507 VanDerWaalsContact O-N 3.09Å; L503-G508 PolarHBondContact O-N 2.97Å; L503-V510 HydrophobicContact CD2-CG2 4.08Å; L503-A513 HydrophobicContact CD2-CB 3.88Å; L503-A513 HydrophobicContact CG-CB 4.06Å
504	K	80	Confident	80.8	Confident	99 Å²	99	58.5 Å²	58.5	43%	0.43	30%	0.304	S	S	.	.	H	α-helix	trans	-59.7	-48.6	170	-76.7	-177	179.2	-171	0	110.8	D477 F481 I500 E501 S506 N507	D477-K504 VanDerWaalsContact O-CE 3.27Å; D477-K504 WeakPolarHBondContact O-CE 3.03Å; D477-K504 PolarHBondContact O-NZ 2.95Å; D477-K504 VanDerWaalsContact O-NZ 3.17Å; F481-K504 HydrophobicContact CE2-CB 4.46Å; F481-K504 HydrophobicContact CE2-CG 3.76Å; F481-K504 HydrophobicContact CZ-CB 4.46Å; F481-K504 HydrophobicContact CZ-CG 4.05Å; F481-K504 VanDerWaalsContact CZ-N 3.34Å; I500-K504 HydrophobicContact CG2-CD 4.46Å; I500-K504 VanDerWaalsContact O-CG 3.3Å; I500-K504 WeakPolarHBondContact O-CG 3.37Å; I500-K504 PolarHBondContact O-N 3.03Å; E501-K504 WeakPolarHBondContact O-CB 3.41Å; E501-K504 PolarHBondContact O-N 2.77Å; K504-S506 VanDerWaalsContact C-N 3.3Å; K504-S506 PolarHBondContact O-N 3.4Å; K504-N507 PolarHBondContact O-N 3.39Å
505	Y	76.1	Confident	80.5	Confident	118 Å²	118	60 Å²	60	46%	0.463	32%	0.321	S	S	.	.	H	α-helix	trans	-64.8	-36.3	-179.2	-173.1	-91.5	0	0	0	112.4	E501 G502 N507 W516	E501-Y505 PolarHBondContact O-N 3.16Å; G502-Y505 PolarHBondContact O-N 2.86Å; Y505-N507 VanDerWaalsContact C-N 3.34Å; Y505-W516 HydrophobicContact CD1-CB 4.07Å; Y505-W516 AromaticContact CD1-CD1 3.2Å; Y505-W516 AromaticContact CD1-CD2 3.82Å; Y505-W516 HydrophobicContact CD1-CD2 3.82Å; Y505-W516 AromaticContact CD1-CE2 3.77Å; Y505-W516 AromaticContact CD1-CG 3.43Å; Y505-W516 HydrophobicContact CD1-CG 3.43Å; Y505-W516 VanDerWaalsContact CD1-CG 3.43Å; Y505-W516 AromaticContact CD1-NE1 3.39Å; Y505-W516 AromaticContact CD2-CE2 3.79Å; Y505-W516 AromaticContact CD2-CZ2 3.95Å; Y505-W516 HydrophobicContact CD2-CZ2 3.95Å; Y505-W516 AromaticContact CD2-NE1 3.64Å; Y505-W516 HydrophobicContact CE1-CB 4.48Å; Y505-W516 AromaticContact CE1-CD1 3.1Å; Y505-W516 HydrophobicContact CE1-CD2 4.46Å; Y505-W516 AromaticContact CE1-CG 3.81Å; Y505-W516 HydrophobicContact CE1-CG 3.81Å; Y505-W516 AromaticContact CE1-NE1 3.36Å; Y505-W516 AromaticContact CE2-NE1 3.61Å; Y505-W516 AromaticContact CG-CD1 3.84Å; Y505-W516 AromaticContact CG-CD2 3.87Å; Y505-W516 HydrophobicContact CG-CD2 3.87Å; Y505-W516 AromaticContact CG-CE2 3.54Å; Y505-W516 HydrophobicContact CG-CG 4.01Å; Y505-W516 AromaticContact CG-CZ2 3.98Å; Y505-W516 HydrophobicContact CG-CZ2 3.98Å; Y505-W516 AromaticContact CG-NE1 3.53Å; Y505-W516 AromaticContact CZ-CD1 3.67Å; Y505-W516 AromaticContact CZ-NE1 3.46Å
506	S	78.6	Confident	80.4	Confident	13 Å²	13	58.8 Å²	58.8	9%	0.091	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	7.9	-178.5	70.1	0	0	0	0	114.9	G502 L503 K504 G508 D509 A513	G502-S506 WeakPolarHBondContact O-CB 2.83Å; G502-S506 PolarHBondContact O-N 3.2Å; G502-S506 PolarHBondContact O-OG 3.42Å; G502-S506 VanDerWaalsContact O-OG 3.05Å; L503-S506 WeakPolarHBondContact CA-OG 3.43Å; L503-S506 PolarHBondContact O-N 2.52Å; L503-S506 PolarHBondContact O-OG 2.81Å; K504-S506 VanDerWaalsContact C-N 3.3Å; K504-S506 PolarHBondContact O-N 3.4Å; S506-G508 PolarHBondContact O-N 2.76Å; S506-D509 VanDerWaalsContact CB-O 3.27Å; S506-D509 WeakPolarHBondContact CB-O 3.37Å; S506-D509 PolarHBondContact O-N 3.31Å; S506-D509 VanDerWaalsContact O-N 3.16Å; S506-D509 PolarHBondContact OG-N 3.05Å; S506-D509 PolarHBondContact OG-O 3.29Å; S506-A513 WeakPolarHBondContact OG-CB 3.15Å; S506-A513 PolarHBondContact OG-N 3.09Å
507	N	73.2	Confident	80.4	Confident	144 Å²	144	54.9 Å²	54.9	77%	0.77	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	42.2	-174.7	-154.3	30.1	0	0	0	113	L503 K504 Y505	L503-N507 PolarHBondContact O-N 2.57Å; L503-N507 VanDerWaalsContact O-N 3.09Å; K504-N507 PolarHBondContact O-N 3.39Å; Y505-N507 VanDerWaalsContact C-N 3.34Å
508	G	72.8	Confident	80.3	Confident	24 Å²	24	54.8 Å²	54.8	25%	0.247	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.2	-5.7	178.5	0	0	0	0	0	116.1	F481 L503 S506 V510	F481-G508 VanDerWaalsContact CE1-CA 3.45Å; L503-G508 PolarHBondContact O-N 2.97Å; S506-G508 PolarHBondContact O-N 2.76Å; G508-V510 PolarHBondContact O-N 3.17Å
509	D	80.6	Confident	79.9	Confident	64 Å²	64	57.1 Å²	57.1	34%	0.342	29%	0.293	S	S	.	.			trans	-74.3	109.6	175.7	-177	-30.9	0	0	0	110.5	S506 K511 K512 A513	S506-D509 VanDerWaalsContact CB-O 3.27Å; S506-D509 WeakPolarHBondContact CB-O 3.37Å; S506-D509 PolarHBondContact O-N 3.31Å; S506-D509 VanDerWaalsContact O-N 3.16Å; S506-D509 PolarHBondContact OG-N 3.05Å; S506-D509 PolarHBondContact OG-O 3.29Å; D509-K511 VanDerWaalsContact C-N 3.34Å; D509-K511 PolarHBondContact O-N 2.85Å; D509-K511 WeakPolarHBondContact OD1-CB 3.43Å; D509-K511 PolarHBondContact OD1-N 2.95Å; D509-K512 HydrophobicContact CB-CB 4.01Å; D509-K512 HydrophobicContact CB-CD 4.09Å; D509-K512 HydrophobicContact CB-CG 4.22Å; D509-K512 PolarHBondContact O-N 3.34Å; D509-K512 PolarHBondContact OD1-N 3.33Å; D509-K512 VanDerWaalsContact OD1-N 3.09Å; D509-A513 WeakPolarHBondContact O-CB 3.3Å; D509-A513 PolarHBondContact O-N 3.5Å
510	V	83.2	Confident	79.5	Confident	24 Å²	24	62.5 Å²	62.5	15%	0.145	31%	0.313	C	S	.	.	H	α-helix	trans	-58.5	-40.3	-179.4	175.2	0	0	0	0	112.7	D485 K488 V489 L503 G508 A513 I514	D485-V510 HydrophobicContact CB-CG2 3.61Å; K488-V510 HydrophobicContact CB-CG1 3.62Å; K488-V510 HydrophobicContact CD-CG1 4.22Å; K488-V510 HydrophobicContact CD-CG2 4.29Å; V489-V510 HydrophobicContact CG2-CG1 3.99Å; L503-V510 HydrophobicContact CD2-CG2 4.08Å; G508-V510 PolarHBondContact O-N 3.17Å; V510-A513 PolarHBondContact O-N 3.43Å; V510-I514 HydrophobicContact CG1-CD1 3.88Å; V510-I514 WeakPolarHBondContact O-CD1 3.33Å; V510-I514 VanDerWaalsContact O-CG1 3.25Å; V510-I514 WeakPolarHBondContact O-CG1 3.43Å; V510-I514 PolarHBondContact O-N 2.94Å
511	K	82.4	Confident	78.7	Confident	178 Å²	178	62.4 Å²	62.4	77%	0.774	31%	0.313	S	S	*	.	H	α-helix	trans	-70.2	-43.6	-177.3	-69.4	-177.7	-179.7	178	0	110.5	D509 I514 A515	D509-K511 VanDerWaalsContact C-N 3.34Å; D509-K511 PolarHBondContact O-N 2.85Å; D509-K511 WeakPolarHBondContact OD1-CB 3.43Å; D509-K511 PolarHBondContact OD1-N 2.95Å; K511-I514 PolarHBondContact O-N 2.9Å; K511-A515 WeakPolarHBondContact O-CB 3.42Å; K511-A515 PolarHBondContact O-N 3.06Å
512	K	81.5	Confident	77.7	Confident	94 Å²	94	64.6 Å²	64.6	41%	0.409	33%	0.327	S	S	.	.	H	α-helix	trans	-65.4	-38.2	174.6	-73.8	-176.9	-174	-179.9	0	111.7	D509 A515 W516	D509-K512 HydrophobicContact CB-CB 4.01Å; D509-K512 HydrophobicContact CB-CD 4.09Å; D509-K512 HydrophobicContact CB-CG 4.22Å; D509-K512 PolarHBondContact O-N 3.34Å; D509-K512 PolarHBondContact OD1-N 3.33Å; D509-K512 VanDerWaalsContact OD1-N 3.09Å; K512-A515 PolarHBondContact O-N 2.63Å; K512-W516 VanDerWaalsContact O-CB 3.3Å; K512-W516 WeakPolarHBondContact O-CB 3.46Å; K512-W516 PolarHBondContact O-N 2.88Å
513	A	83.5	Confident	76.1	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-59	-48.2	174.9	0	0	0	0	0	111.1	V489 G502 L503 S506 D509 V510 W516 L517	V489-A513 HydrophobicContact CG2-CB 4.07Å; G502-A513 VanDerWaalsContact C-CB 3.43Å; G502-A513 WeakPolarHBondContact O-CB 3.5Å; L503-A513 HydrophobicContact CD2-CB 3.88Å; L503-A513 HydrophobicContact CG-CB 4.06Å; S506-A513 WeakPolarHBondContact OG-CB 3.15Å; S506-A513 PolarHBondContact OG-N 3.09Å; D509-A513 WeakPolarHBondContact O-CB 3.3Å; D509-A513 PolarHBondContact O-N 3.5Å; V510-A513 PolarHBondContact O-N 3.43Å; A513-W516 PolarHBondContact O-N 3.41Å; A513-L517 WeakPolarHBondContact O-CB 3.48Å; A513-L517 VanDerWaalsContact O-CG 3.24Å; A513-L517 WeakPolarHBondContact O-CG 3.23Å; A513-L517 PolarHBondContact O-N 3.43Å
514	I	82.4	Confident	73.9	Confident	40 Å²	40	79.1 Å²	79.1	21%	0.205	40%	0.397	C	S	.	.	H	α-helix	trans	-61.3	-48.6	177.1	-67.8	161.3	0	0	0	110.3	V489 C492 F494 V510 K511 W516 L517 V518	V489-I514 HydrophobicContact CB-CG1 4.47Å; V489-I514 HydrophobicContact CG1-CG1 4.25Å; V489-I514 HydrophobicContact CG2-CG1 4.21Å; C492-I514 HydrophobicContact CB-CG1 4.49Å; C492-I514 HydrophobicContact CB-CG2 4.47Å; C492-I514 VanDerWaalsContact SG-CD1 3.59Å; F494-I514 HydrophobicContact CE2-CG2 4.36Å; V510-I514 HydrophobicContact CG1-CD1 3.88Å; V510-I514 WeakPolarHBondContact O-CD1 3.33Å; V510-I514 VanDerWaalsContact O-CG1 3.25Å; V510-I514 WeakPolarHBondContact O-CG1 3.43Å; V510-I514 PolarHBondContact O-N 2.94Å; K511-I514 PolarHBondContact O-N 2.9Å; I514-W516 VanDerWaalsContact C-N 3.35Å; I514-W516 PolarHBondContact O-N 3.33Å; I514-L517 PolarHBondContact O-N 3.48Å; I514-V518 HydrophobicContact CG2-CG2 4.32Å; I514-V518 VanDerWaalsContact O-CG2 3.29Å; I514-V518 WeakPolarHBondContact O-CG2 3.47Å; I514-V518 PolarHBondContact O-N 2.84Å
515	A	78	Confident	71.6	Confident	54 Å²	54	83.9 Å²	83.9	45%	0.446	44%	0.438	S	S	.	.	H	α-helix	trans	-59.4	-45.5	179.5	0	0	0	0	0	112	K511 K512 V518 V519	K511-A515 WeakPolarHBondContact O-CB 3.42Å; K511-A515 PolarHBondContact O-N 3.06Å; K512-A515 PolarHBondContact O-N 2.63Å; A515-V518 PolarHBondContact O-N 2.9Å; A515-V519 WeakPolarHBondContact O-CG2 3.48Å; A515-V519 PolarHBondContact O-N 3.35Å
516	W	81.7	Confident	71.4	Confident	54 Å²	54	82.2 Å²	82.2	21%	0.205	44%	0.437	C	S	.	.	H	α-helix	trans	-63.1	-43.2	177	-179.4	81.5	0	0	0	112.3	E501 Y505 K512 A513 I514 V519 R520	E501-W516 HydrophobicContact CG-CH2 4.01Å; E501-W516 HydrophobicContact CG-CZ3 4.22Å; Y505-W516 HydrophobicContact CD1-CB 4.07Å; Y505-W516 AromaticContact CD1-CD1 3.2Å; Y505-W516 AromaticContact CD1-CD2 3.82Å; Y505-W516 HydrophobicContact CD1-CD2 3.82Å; Y505-W516 AromaticContact CD1-CE2 3.77Å; Y505-W516 AromaticContact CD1-CG 3.43Å; Y505-W516 HydrophobicContact CD1-CG 3.43Å; Y505-W516 VanDerWaalsContact CD1-CG 3.43Å; Y505-W516 AromaticContact CD1-NE1 3.39Å; Y505-W516 AromaticContact CD2-CE2 3.79Å; Y505-W516 AromaticContact CD2-CZ2 3.95Å; Y505-W516 HydrophobicContact CD2-CZ2 3.95Å; Y505-W516 AromaticContact CD2-NE1 3.64Å; Y505-W516 HydrophobicContact CE1-CB 4.48Å; Y505-W516 AromaticContact CE1-CD1 3.1Å; Y505-W516 HydrophobicContact CE1-CD2 4.46Å; Y505-W516 AromaticContact CE1-CG 3.81Å; Y505-W516 HydrophobicContact CE1-CG 3.81Å; Y505-W516 AromaticContact CE1-NE1 3.36Å; Y505-W516 AromaticContact CE2-NE1 3.61Å; Y505-W516 AromaticContact CG-CD1 3.84Å; Y505-W516 AromaticContact CG-CD2 3.87Å; Y505-W516 HydrophobicContact CG-CD2 3.87Å; Y505-W516 AromaticContact CG-CE2 3.54Å; Y505-W516 HydrophobicContact CG-CG 4.01Å; Y505-W516 AromaticContact CG-CZ2 3.98Å; Y505-W516 HydrophobicContact CG-CZ2 3.98Å; Y505-W516 AromaticContact CG-NE1 3.53Å; Y505-W516 AromaticContact CZ-CD1 3.67Å; Y505-W516 AromaticContact CZ-NE1 3.46Å; K512-W516 VanDerWaalsContact O-CB 3.3Å; K512-W516 WeakPolarHBondContact O-CB 3.46Å; K512-W516 PolarHBondContact O-N 2.88Å; A513-W516 PolarHBondContact O-N 3.41Å; I514-W516 VanDerWaalsContact C-N 3.35Å; I514-W516 PolarHBondContact O-N 3.33Å; W516-V519 PolarHBondContact O-N 2.94Å; W516-R520 VanDerWaalsContact O-CB 3.32Å; W516-R520 WeakPolarHBondContact O-CB 3.35Å; W516-R520 PolarHBondContact O-N 3.27Å
517	L	81.6	Confident	71	Confident	0 Å²	0	85.8 Å²	85.8	0%	0	46%	0.455	C	S	.	.	H	α-helix	trans	-67.5	-35.9	177.8	-74.5	171.6	0	0	0	113	V489 F494 Q498 A513 I514 N521	V489-L517 HydrophobicContact CG1-CD1 3.44Å; V489-L517 VanDerWaalsContact CG1-CD1 3.44Å; F494-L517 HydrophobicContact CB-CD1 4.12Å; F494-L517 HydrophobicContact CD1-CB 3.92Å; F494-L517 HydrophobicContact CD1-CD1 4.21Å; F494-L517 HydrophobicContact CD2-CB 4.08Å; F494-L517 HydrophobicContact CD2-CD1 3.74Å; F494-L517 HydrophobicContact CE1-CB 3.59Å; F494-L517 HydrophobicContact CE2-CB 3.75Å; F494-L517 HydrophobicContact CE2-CD1 4.22Å; F494-L517 HydrophobicContact CG-CB 4.16Å; F494-L517 HydrophobicContact CG-CD1 3.74Å; F494-L517 HydrophobicContact CG-CG 4.49Å; F494-L517 HydrophobicContact CZ-CB 3.49Å; F494-L517 VanDerWaalsContact CZ-CB 3.49Å; Q498-L517 HydrophobicContact CB-CD1 4.49Å; Q498-L517 HydrophobicContact CB-CD2 4Å; Q498-L517 WeakPolarHBondContact O-CD1 3.27Å; Q498-L517 WeakPolarHBondContact O-CD2 3.43Å; A513-L517 WeakPolarHBondContact O-CB 3.48Å; A513-L517 VanDerWaalsContact O-CG 3.24Å; A513-L517 WeakPolarHBondContact O-CG 3.23Å; A513-L517 PolarHBondContact O-N 3.43Å; I514-L517 PolarHBondContact O-N 3.48Å; L517-N521 WeakPolarHBondContact O-CB 3.49Å; L517-N521 PolarHBondContact O-N 3.49Å; L517-N521 VanDerWaalsContact O-N 3.16Å; L517-N521 PolarHBondContact O-ND2 3.44Å
518	V	78.6	Confident	70.8	Confident	68 Å²	68	82.6 Å²	82.6	41%	0.412	44%	0.438	S	S	.	.	H	α-helix	trans	-62.4	-53.3	172.4	170.8	0	0	0	0	109.1	F494 I514 A515 R520 N521 L522	F494-V518 HydrophobicContact CE2-CG2 4.37Å; F494-V518 HydrophobicContact CZ-CG2 3.8Å; I514-V518 HydrophobicContact CG2-CG2 4.32Å; I514-V518 VanDerWaalsContact O-CG2 3.29Å; I514-V518 WeakPolarHBondContact O-CG2 3.47Å; I514-V518 PolarHBondContact O-N 2.84Å; A515-V518 PolarHBondContact O-N 2.9Å; V518-R520 VanDerWaalsContact C-N 3.34Å; V518-R520 PolarHBondContact O-N 3.46Å; V518-N521 PolarHBondContact O-N 3.46Å; V518-N521 VanDerWaalsContact O-N 3.15Å; V518-L522 HydrophobicContact CG1-CD1 4.1Å; V518-L522 HydrophobicContact CG1-CG 4.35Å; V518-L522 WeakPolarHBondContact O-CG 3.44Å; V518-L522 PolarHBondContact O-N 3.27Å
519	V	74.5	Confident	70.7	Confident	97 Å²	97	86.1 Å²	86.1	59%	0.588	45%	0.449	S	S	*	.	H	α-helix	trans	-57.9	-45.8	-179.3	172.9	0	0	0	0	111.6	A515 W516 N521 L522	A515-V519 WeakPolarHBondContact O-CG2 3.48Å; A515-V519 PolarHBondContact O-N 3.35Å; W516-V519 PolarHBondContact O-N 2.94Å; V519-N521 VanDerWaalsContact C-N 3.28Å; V519-N521 PolarHBondContact O-N 2.79Å; V519-L522 PolarHBondContact O-N 3.31Å
520	R	73.4	Confident	70.1	Confident	113 Å²	113	87.4 Å²	87.4	43%	0.426	46%	0.456	S	S	.	.	H	α-helix	trans	-64.8	-29.2	-179.7	-174.1	175.4	174.6	-149.6	4.4	113.8	E501 W516 V518	E501-R520 IonicContact OE1-CZ 3.14Å; E501-R520 IonicContact OE1-NH1 3.08Å; E501-R520 PolarHBondContact OE1-NH1 3.4Å; E501-R520 IonicContact OE1-NH2 3.41Å; E501-R520 PolarHBondContact OE1-NH2 3.36Å; E501-R520 IonicContact OE2-CZ 3.63Å; E501-R520 IonicContact OE2-NH1 2.79Å; E501-R520 PolarHBondContact OE2-NH1 3.43Å; E501-R520 IonicContact OE2-NH2 2.57Å; W516-R520 VanDerWaalsContact O-CB 3.32Å; W516-R520 WeakPolarHBondContact O-CB 3.35Å; W516-R520 PolarHBondContact O-N 3.27Å; V518-R520 VanDerWaalsContact C-N 3.34Å; V518-R520 PolarHBondContact O-N 3.46Å
521	N	66.1	Low	69.2	Low	48 Å²	48	91.7 Å²	91.7	26%	0.257	48%	0.476	S	S	.	.	H	α-helix	trans	-94.8	-3.6	179.4	-70.6	-61.8	0	0	0	113.7	L517 V518 V519 D523	L517-N521 WeakPolarHBondContact O-CB 3.49Å; L517-N521 PolarHBondContact O-N 3.49Å; L517-N521 VanDerWaalsContact O-N 3.16Å; L517-N521 PolarHBondContact O-ND2 3.44Å; V518-N521 PolarHBondContact O-N 3.46Å; V518-N521 VanDerWaalsContact O-N 3.15Å; V519-N521 VanDerWaalsContact C-N 3.28Å; V519-N521 PolarHBondContact O-N 2.79Å; N521-D523 PolarHBondContact O-N 2.78Å
522	L	58.3	Low	68.3	Low	125 Å²	125	85.5 Å²	85.5	65%	0.654	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-15.8	173.4	-78	168.8	0	0	0	113	V518 V519	V518-L522 HydrophobicContact CG1-CD1 4.1Å; V518-L522 HydrophobicContact CG1-CG 4.35Å; V518-L522 WeakPolarHBondContact O-CG 3.44Å; V518-L522 PolarHBondContact O-N 3.27Å; V519-L522 PolarHBondContact O-N 3.31Å
523	D	49.5	Very low	67.3	Low	149 Å²	149	84.8 Å²	84.8	80%	0.797	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	13.6	-179.2	-75.9	-26.3	0	0	0	114.5	N521	N521-D523 PolarHBondContact O-N 2.78Å
524	K	35	Very low	65.9	Low	155 Å²	155	91.9 Å²	91.9	67%	0.674	50%	0.497	S	S	*	.			trans	-98.1	123.1	171	-70.7	-172.4	177.9	-174.6	0	109.8
525	P	32.3	Very low	64.4	Low	200 Å²	200	96.6 Å²	96.6	100%	1.299	52%	0.523	S	S	*	.			trans	-63.1	0	174.6	27.8	-34.3	0	0	0	112.8

Retrieved 525 of 525 residues in 1436.2 ms (Link to these results)

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