A0A5K4EX16_SCHMA Loading...

GOLD domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4EX16, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 393 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	37.8	Very low	35.9	Very low	254 Å²	254	151.6 Å²	151.6	100%	1.251	85%	0.848	S	S	*	*				0	113.6	0	-82	-135.3	-96.7	0	0	107.5
2	G	38.3	Very low	35.6	Very low	85 Å²	85	150.5 Å²	150.5	88%	0.876	84%	0.839	S	S	*	*			trans	101.6	77.7	166.9	0	0	0	0	0	115.9
3	E	33.3	Very low	35.3	Very low	183 Å²	183	153.6 Å²	153.6	86%	0.855	84%	0.838	S	S	*	*			trans	-80.5	143.5	162.4	-67.7	170.8	160.5	0	0	109.4
4	F	41.5	Very low	35.3	Very low	200 Å²	200	157.9 Å²	157.9	88%	0.877	85%	0.845	S	S	*	*			trans	-131.1	98.8	169.1	-130.8	-88.7	0	0	0	108.2	T6	F4-T6 HydrophobicContact CD1-CG2 4.21Å; F4-T6 HydrophobicContact CE1-CG2 4.49Å
5	E	33.6	Very low	35.2	Very low	170 Å²	170	158.5 Å²	158.5	79%	0.794	84%	0.841	S	S	*	*			trans	-89.7	132	165.8	-67.6	-177.5	149.7	0	0	108.5
6	T	44	Very low	34.6	Very low	120 Å²	120	156.3 Å²	156.3	74%	0.736	84%	0.836	S	S	*	*			trans	-116.1	109.4	167.3	51.2	0	0	0	0	109.4	F4	F4-T6 HydrophobicContact CD1-CG2 4.21Å; F4-T6 HydrophobicContact CE1-CG2 4.49Å
7	N	32.2	Very low	34.5	Very low	149 Å²	149	157.1 Å²	157.1	80%	0.797	84%	0.839	S	S	*	*			trans	-65.9	138.5	170.9	-88.9	-58.8	0	0	0	111.7
8	V	31	Very low	34.3	Very low	144 Å²	144	153.7 Å²	153.7	87%	0.873	83%	0.83	S	S	*	*			trans	-91.6	125.1	167.3	175.2	0	0	0	0	107.8
9	S	36.4	Very low	34.2	Very low	114 Å²	114	153.3 Å²	153.3	80%	0.797	83%	0.826	S	S	*	*			trans	-125.1	131.1	173.6	-72.2	0	0	0	0	111.4
10	N	29.6	Very low	34.3	Very low	128 Å²	128	153 Å²	153	68%	0.684	82%	0.824	S	S	*	*			trans	-45.5	153.1	177.8	-158.8	26.4	0	0	0	116.6
11	P	37.6	Very low	34.4	Very low	121 Å²	121	153.2 Å²	153.2	79%	0.786	83%	0.825	S	S	*	*			trans	-122.3	93.8	158.1	36.1	-19.7	0	0	0	112.2
12	D	31.3	Very low	34.5	Very low	138 Å²	138	146.2 Å²	146.2	74%	0.738	80%	0.799	S	S	*	*			trans	-106.4	109.6	151	-81.5	-45.2	0	0	0	107.4
13	K	32.1	Very low	34.7	Very low	191 Å²	191	148.3 Å²	148.3	83%	0.83	80%	0.8	S	S	*	*			trans	-168.7	107.5	164.1	-108.6	173.5	-171.2	-171.4	0	109.9
14	F	35.7	Very low	34.7	Very low	214 Å²	214	147 Å²	147	94%	0.939	80%	0.799	S	S	*	*			trans	-122.7	121.8	149.6	-128.5	-89.6	0	0	0	108.2
15	E	32.8	Very low	34.6	Very low	166 Å²	166	142 Å²	142	78%	0.776	79%	0.789	S	S	*	*			trans	-76.2	138.8	-171.7	-73.7	172.4	143.5	0	0	112.2
16	T	27	Very low	34.9	Very low	124 Å²	124	140.6 Å²	140.6	76%	0.761	79%	0.787	S	S	*	*			trans	-90.9	132.6	166	-37.1	0	0	0	0	109
17	L	33	Very low	34.5	Very low	169 Å²	169	143.1 Å²	143.1	89%	0.885	79%	0.79	S	S	*	*			trans	-122.6	117.8	165.7	-73.1	176.9	0	0	0	109.9
18	S	29.6	Very low	35	Very low	97 Å²	97	142.7 Å²	142.7	68%	0.678	79%	0.786	S	S	*	*			trans	-97.1	170.5	176.8	-65.1	0	0	0	0	112.6
19	L	32.1	Very low	35.2	Very low	146 Å²	146	143.1 Å²	143.1	76%	0.764	78%	0.779	S	S	*	*			trans	101.9	105.5	145.9	-72.9	146.1	0	0	0	118.4
20	N	37.7	Very low	35.1	Very low	147 Å²	147	145.1 Å²	145.1	79%	0.786	78%	0.775	S	S	*	*				169.2	116.7	94.3	-82.5	-43	0	0	0	114.2
21	D	34.7	Very low	35	Very low	158 Å²	158	144.9 Å²	144.9	85%	0.845	78%	0.778	S	S	*	*			trans	-14	173.8	153.7	-104.9	-17.1	0	0	0	124.4
22	P	40.1	Very low	34.6	Very low	107 Å²	107	144.3 Å²	144.3	70%	0.695	78%	0.777	S	S	*	*				-122	-174.9	-126.1	34.8	-12.5	0	0	0	114.5
23	S	42.2	Very low	34.7	Very low	129 Å²	129	144.3 Å²	144.3	90%	0.902	78%	0.782	S	S	*	*			trans	-141.1	129.6	171.7	-55.3	0	0	0	0	112.4
24	D	34.4	Very low	34.5	Very low	155 Å²	155	146.3 Å²	146.3	83%	0.829	78%	0.784	S	S	*	*			trans	-79.6	153.5	-170.4	-159.1	-0.5	0	0	0	113
25	S	39.2	Very low	34.3	Very low	96 Å²	96	142.5 Å²	142.5	67%	0.671	78%	0.778	S	S	*	*			trans	150.4	135	131.1	59.1	0	0	0	0	115.8
26	N	40.2	Very low	34.2	Very low	140 Å²	140	144.1 Å²	144.1	75%	0.749	78%	0.783	S	S	*	*			trans	98.1	82.6	151.3	-57.9	-22.3	0	0	0	119.5
27	E	36.5	Very low	34.4	Very low	173 Å²	173	146.9 Å²	146.9	81%	0.808	79%	0.787	S	S	*	*				44.1	122.5	103.7	-138.4	178.9	-148.2	0	0	118.4
28	I	40.8	Very low	34.3	Very low	140 Å²	140	143 Å²	143	72%	0.718	79%	0.788	S	S	*	*				156.2	116.7	122.3	-77.9	161.4	0	0	0	112.5
29	H	37	Very low	34.3	Very low	153 Å²	153	147.9 Å²	147.9	71%	0.708	80%	0.797	S	S	*	*			trans	62.3	108	147.2	-77.5	-95.6	0	0	0	123.5
30	E	32.6	Very low	34.2	Very low	156 Å²	156	146.6 Å²	146.6	73%	0.729	80%	0.799	S	S	*	*				53.5	110.2	109.6	-132.1	177.9	-175.4	0	0	118.5
31	T	28	Very low	34.4	Very low	122 Å²	122	146.8 Å²	146.8	75%	0.748	80%	0.8	S	S	*	*				145	124.8	102.8	-24.8	0	0	0	0	111.7
32	S	29.7	Very low	35	Very low	109 Å²	109	146.1 Å²	146.1	76%	0.762	80%	0.797	S	S	*	*			trans	84.7	132.7	142.9	-145.9	0	0	0	0	121.5
33	V	33.5	Very low	35.1	Very low	139 Å²	139	149.9 Å²	149.9	84%	0.842	81%	0.805	S	S	*	*			trans	92.4	110.8	158.2	-159.8	0	0	0	0	117.4
34	R	28.6	Very low	35.6	Very low	232 Å²	232	146.5 Å²	146.5	88%	0.875	79%	0.79	S	S	*	*			trans	-82.4	156.6	-177	-145	179.8	-160.6	-177.3	3.2	110.5
35	V	29.7	Very low	37.2	Very low	134 Å²	134	142.9 Å²	142.9	81%	0.812	77%	0.771	S	S	*	*			trans	86.8	80.8	166.5	-158.4	0	0	0	0	114.7
36	K	31.7	Very low	38.7	Very low	200 Å²	200	142.5 Å²	142.5	87%	0.87	76%	0.761	S	S	*	*			trans	-108.3	112.4	155.5	-79.7	-174.6	175.5	179.5	0	108.6
37	E	30.6	Very low	40.7	Very low	182 Å²	182	137.3 Å²	137.3	85%	0.85	74%	0.741	S	S	*	*			trans	11.7	111.4	143.6	-65.1	166.6	165.3	0	0	116.2	F39	E37-F39 PolarHBondContact O-N 2.68Å
38	G	30.4	Very low	42.9	Very low	87 Å²	87	133.6 Å²	133.6	90%	0.897	72%	0.723	S	S	*	*			trans	-76.8	107.7	168	0	0	0	0	0	110
39	F	29.7	Very low	44.7	Very low	200 Å²	200	128.6 Å²	128.6	88%	0.877	70%	0.697	S	S	*	*			trans	-130.9	73.8	175.9	-151.9	-83.9	0	0	0	107.4	E37	E37-F39 PolarHBondContact O-N 2.68Å
40	C	30.2	Very low	47	Very low	120 Å²	120	125.2 Å²	125.2	81%	0.811	68%	0.681	S	S	*	*			trans	-162.2	120.1	172.7	-84.3	0	0	0	0	109.7
41	D	41.4	Very low	49.7	Very low	151 Å²	151	122.8 Å²	122.8	81%	0.807	67%	0.672	S	S	*	*			trans	155	5.3	144.9	-80.8	-13.2	0	0	0	116.3	Q43	D41-Q43 PolarHBondContact O-N 3.36Å
42	D	48.1	Very low	52.4	Low	144 Å²	144	120 Å²	120	77%	0.77	65%	0.65	S	S	*	*	H	α-helix	trans	-73.3	-22.9	-175.4	-161.3	33.3	0	0	0	115.4
43	Q	43.4	Very low	55	Low	185 Å²	185	114.8 Å²	114.8	86%	0.864	61%	0.614	S	S	*	*	H	α-helix	trans	-80.3	-26.3	-176	-75.3	-172.5	7.3	0	0	114.6	D41	D41-Q43 PolarHBondContact O-N 3.36Å
44	G	51.7	Low	57.6	Low	58 Å²	58	111.7 Å²	111.7	60%	0.598	59%	0.589	S	S	*	*	H	α-helix	trans	-73.5	-34.7	-178.2	0	0	0	0	0	112.8	Q48	G44-Q48 PolarHBondContact O-N 3.24Å
45	D	69.1	Low	60.4	Low	79 Å²	79	104 Å²	104	42%	0.422	57%	0.571	S	S	.	*	H	α-helix	trans	-72.7	-42	-177.2	-177.8	40.8	0	0	0	112	G47 Q48 K49	D45-G47 PolarHBondContact O-N 3.45Å; D45-Q48 PolarHBondContact O-N 2.79Å; D45-K49 VanDerWaalsContact O-CG 3.32Å; D45-K49 WeakPolarHBondContact O-CG 3.33Å; D45-K49 PolarHBondContact O-N 3.09Å; D45-K49 WeakPolarHBondContact OD1-CE 3.4Å; D45-K49 IonicContact OD1-NZ 3.84Å; D45-K49 WeakPolarHBondContact OD2-CE 3.44Å; D45-K49 IonicContact OD2-NZ 3.72Å; D45-K49 PolarHBondContact OD2-NZ 3.11Å
46	L	70.3	Confident	63	Low	89 Å²	89	98.1 Å²	98.1	47%	0.466	54%	0.536	S	S	.	.	H	α-helix	trans	-63.2	-41.4	179.2	-161.1	76.3	0	0	0	112.3	Q48 K49 E50	L46-Q48 VanDerWaalsContact C-N 3.34Å; L46-Q48 PolarHBondContact O-N 3.4Å; L46-K49 PolarHBondContact O-N 3.35Å; L46-E50 PolarHBondContact O-N 2.93Å
47	G	81.6	Confident	65.5	Low	31 Å²	31	88.8 Å²	88.8	32%	0.32	50%	0.496	S	S	.	.	H	α-helix	trans	-63.9	-38.1	178.2	0	0	0	0	0	112.8	D45 E50 I51	D45-G47 PolarHBondContact O-N 3.45Å; G47-E50 PolarHBondContact O-N 3.17Å; G47-I51 WeakPolarHBondContact O-CG1 3.47Å; G47-I51 PolarHBondContact O-N 3.41Å
48	Q	82	Confident	68.2	Low	94 Å²	94	82.4 Å²	82.4	44%	0.439	47%	0.469	S	S	.	.	H	α-helix	trans	-66.8	-43	175.4	-176.7	57.3	39.9	0	0	111.4	G44 D45 L46 E50 I51 E52	G44-Q48 PolarHBondContact O-N 3.24Å; D45-Q48 PolarHBondContact O-N 2.79Å; L46-Q48 VanDerWaalsContact C-N 3.34Å; L46-Q48 PolarHBondContact O-N 3.4Å; Q48-E50 VanDerWaalsContact C-N 3.35Å; Q48-E50 PolarHBondContact O-N 2.77Å; Q48-I51 WeakPolarHBondContact O-CB 3.46Å; Q48-I51 PolarHBondContact O-N 3.35Å; Q48-E52 PolarHBondContact NE2-OE1 3.32Å; Q48-E52 PolarHBondContact O-N 3.41Å
49	K	78.5	Confident	70.6	Confident	36 Å²	36	82.6 Å²	82.6	16%	0.157	45%	0.447	C	S	.	.	H	α-helix	trans	-59.3	-43.6	175.5	-71.1	170.1	172.6	169	0	112.2	D45 L46 I51 E52 I53 P140	D45-K49 VanDerWaalsContact O-CG 3.32Å; D45-K49 WeakPolarHBondContact O-CG 3.33Å; D45-K49 PolarHBondContact O-N 3.09Å; D45-K49 WeakPolarHBondContact OD1-CE 3.4Å; D45-K49 IonicContact OD1-NZ 3.84Å; D45-K49 WeakPolarHBondContact OD2-CE 3.44Å; D45-K49 IonicContact OD2-NZ 3.72Å; D45-K49 PolarHBondContact OD2-NZ 3.11Å; L46-K49 PolarHBondContact O-N 3.35Å; K49-I51 VanDerWaalsContact C-N 3.32Å; K49-I51 PolarHBondContact O-N 3.21Å; K49-E52 PolarHBondContact O-N 2.65Å; K49-I53 VanDerWaalsContact O-CG1 3.3Å; K49-I53 WeakPolarHBondContact O-CG1 3.47Å; K49-I53 PolarHBondContact O-N 3.11Å; K49-P140 HydrophobicContact CB-CG 4.38Å; K49-P140 HydrophobicContact CD-CG 3.92Å; K49-P140 HydrophobicContact CG-CG 3.93Å
50	E	86.7	Confident	72.9	Confident	81 Å²	81	75.4 Å²	75.4	38%	0.379	42%	0.416	S	S	.	.	H	α-helix	trans	-60.9	-39.6	176.2	-77.9	-178.2	-172.8	0	0	112.5	L46 G47 Q48 K54 F92 L96	L46-E50 PolarHBondContact O-N 2.93Å; G47-E50 PolarHBondContact O-N 3.17Å; Q48-E50 VanDerWaalsContact C-N 3.35Å; Q48-E50 PolarHBondContact O-N 2.77Å; E50-K54 VanDerWaalsContact O-CB 3.29Å; E50-K54 WeakPolarHBondContact O-CB 3.33Å; E50-K54 PolarHBondContact O-N 3.26Å; E50-F92 HydrophobicContact CB-CZ 4.14Å; E50-F92 WeakPolarHBondContact O-CE2 3.27Å; E50-F92 WeakPolarHBondContact O-CZ 3.44Å; E50-L96 HydrophobicContact CG-CD1 4.44Å
51	I	88.1	Confident	75.2	Confident	105 Å²	105	69.7 Å²	69.7	54%	0.538	38%	0.377	S	S	.	.	H	α-helix	trans	-63.8	-43.2	175.8	-67.9	165.3	0	0	0	110.9	G47 Q48 K49 K54 S55	G47-I51 WeakPolarHBondContact O-CG1 3.47Å; G47-I51 PolarHBondContact O-N 3.41Å; Q48-I51 WeakPolarHBondContact O-CB 3.46Å; Q48-I51 PolarHBondContact O-N 3.35Å; K49-I51 VanDerWaalsContact C-N 3.32Å; K49-I51 PolarHBondContact O-N 3.21Å; I51-K54 PolarHBondContact O-N 3.44Å; I51-S55 WeakPolarHBondContact O-CB 3.37Å; I51-S55 PolarHBondContact O-N 3.2Å
52	E	84.9	Confident	77.2	Confident	63 Å²	63	67.4 Å²	67.4	29%	0.294	36%	0.36	S	S	.	.	H	α-helix	trans	-65.6	-45.1	178.9	-71.2	175	-161.5	0	0	111.8	Q48 K49 K54 S55 A56 I142 Q362	Q48-E52 PolarHBondContact NE2-OE1 3.32Å; Q48-E52 PolarHBondContact O-N 3.41Å; K49-E52 PolarHBondContact O-N 2.65Å; E52-K54 PolarHBondContact O-N 3.01Å; E52-S55 PolarHBondContact O-N 3.02Å; E52-A56 PolarHBondContact O-N 3.28Å; E52-I142 HydrophobicContact CB-CD1 3.61Å; E52-Q362 PolarHBondContact OE2-NE2 3.28Å
53	I	84	Confident	78.7	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.005	35%	0.35	C	S	.	.	H	α-helix	trans	-58.4	-49.5	173.4	-67.1	166.4	0	0	0	109.7	K49 S55 A56 L57 F92 Y95 L96 Y100 I142	K49-I53 VanDerWaalsContact O-CG1 3.3Å; K49-I53 WeakPolarHBondContact O-CG1 3.47Å; K49-I53 PolarHBondContact O-N 3.11Å; I53-S55 VanDerWaalsContact C-N 3.32Å; I53-S55 PolarHBondContact O-N 3.16Å; I53-A56 PolarHBondContact O-N 2.97Å; I53-L57 HydrophobicContact CG2-CD1 4.2Å; I53-L57 HydrophobicContact CG2-CG 4.32Å; I53-L57 WeakPolarHBondContact O-CG 3.38Å; I53-L57 PolarHBondContact O-N 3.28Å; I53-F92 HydrophobicContact CB-CE2 4.2Å; I53-F92 HydrophobicContact CG2-CD2 4.27Å; I53-F92 HydrophobicContact CG2-CE2 3.87Å; I53-Y95 HydrophobicContact CG2-CD1 3.64Å; I53-Y95 HydrophobicContact CG2-CE1 3.48Å; I53-Y95 VanDerWaalsContact CG2-CE1 3.48Å; I53-L96 HydrophobicContact CD1-CD2 4.24Å; I53-L96 HydrophobicContact CG2-CD2 4.39Å; I53-Y100 HydrophobicContact CD1-CD2 3.84Å; I53-Y100 HydrophobicContact CD1-CE2 3.59Å; I53-Y100 HydrophobicContact CD1-CG 4.48Å; I53-I142 HydrophobicContact CG1-CD1 4.14Å; I53-I142 HydrophobicContact CG1-CG1 4.05Å
54	K	89.5	Confident	80.5	Confident	74 Å²	74	60.2 Å²	60.2	32%	0.322	33%	0.327	S	S	.	.	H	α-helix	trans	-58.3	-45.7	179.8	-169.8	169.1	-175.5	168.5	0	111.4	E50 I51 E52 A56 L57 V58 D89 F92	E50-K54 VanDerWaalsContact O-CB 3.29Å; E50-K54 WeakPolarHBondContact O-CB 3.33Å; E50-K54 PolarHBondContact O-N 3.26Å; I51-K54 PolarHBondContact O-N 3.44Å; E52-K54 PolarHBondContact O-N 3.01Å; K54-A56 PolarHBondContact O-N 3.45Å; K54-L57 PolarHBondContact O-N 3.44Å; K54-V58 HydrophobicContact CG-CG2 4.39Å; K54-V58 WeakPolarHBondContact O-CB 3.4Å; K54-V58 WeakPolarHBondContact O-CG2 3.46Å; K54-V58 PolarHBondContact O-N 3.3Å; K54-D89 WeakPolarHBondContact CE-OD1 3.36Å; K54-D89 IonicContact NZ-OD1 3.28Å; K54-D89 PolarHBondContact NZ-OD1 3.05Å; K54-F92 HydrophobicContact CB-CD2 3.76Å; K54-F92 HydrophobicContact CB-CE2 3.54Å; K54-F92 HydrophobicContact CB-CG 4.34Å; K54-F92 HydrophobicContact CB-CZ 3.93Å; K54-F92 HydrophobicContact CD-CD1 4.23Å; K54-F92 HydrophobicContact CD-CE1 4.29Å; K54-F92 HydrophobicContact CD-CG 4.37Å; K54-F92 HydrophobicContact CD-CZ 4.5Å; K54-F92 HydrophobicContact CG-CD1 4.48Å; K54-F92 HydrophobicContact CG-CD2 4.02Å; K54-F92 HydrophobicContact CG-CE2 4.23Å; K54-F92 HydrophobicContact CG-CG 4.14Å
55	S	87.4	Confident	82.2	Confident	71 Å²	71	58 Å²	58	50%	0.497	30%	0.301	S	S	.	.	H	α-helix	trans	-60.2	-45.2	178.3	-173	0	0	0	0	112.1	I51 E52 I53 V58 Q59	I51-S55 WeakPolarHBondContact O-CB 3.37Å; I51-S55 PolarHBondContact O-N 3.2Å; E52-S55 PolarHBondContact O-N 3.02Å; I53-S55 VanDerWaalsContact C-N 3.32Å; I53-S55 PolarHBondContact O-N 3.16Å; S55-V58 PolarHBondContact O-N 2.92Å; S55-Q59 PolarHBondContact O-N 2.89Å
56	A	82.9	Confident	83.2	Confident	10 Å²	10	57.4 Å²	57.4	8%	0.083	30%	0.296	C	S	.	.	H	α-helix	trans	-61.8	-47.4	177.4	0	0	0	0	0	112	E52 I53 K54 V58 Q59 Q60 I142	E52-A56 PolarHBondContact O-N 3.28Å; I53-A56 PolarHBondContact O-N 2.97Å; K54-A56 PolarHBondContact O-N 3.45Å; A56-V58 VanDerWaalsContact C-N 3.34Å; A56-V58 PolarHBondContact O-N 3.47Å; A56-Q59 PolarHBondContact O-N 3.47Å; A56-Q60 WeakPolarHBondContact O-CB 3.37Å; A56-Q60 PolarHBondContact O-N 3.38Å; A56-I142 HydrophobicContact CB-CG2 3.56Å
57	L	84.1	Confident	83.9	Confident	4 Å²	4	58 Å²	58	2%	0.021	30%	0.296	C	S	.	.	H	α-helix	trans	-63.6	-38.8	177.6	-64.4	-173.8	0	0	0	112.4	I53 K54 Q59 Q60 T61 Y91 F92 Y95 P143	I53-L57 HydrophobicContact CG2-CD1 4.2Å; I53-L57 HydrophobicContact CG2-CG 4.32Å; I53-L57 WeakPolarHBondContact O-CG 3.38Å; I53-L57 PolarHBondContact O-N 3.28Å; K54-L57 PolarHBondContact O-N 3.44Å; L57-Q59 VanDerWaalsContact C-N 3.35Å; L57-Q60 PolarHBondContact O-N 2.99Å; L57-T61 WeakPolarHBondContact O-CB 3.39Å; L57-T61 WeakPolarHBondContact O-CG2 3.43Å; L57-T61 PolarHBondContact O-N 2.88Å; L57-T61 PolarHBondContact O-OG1 2.8Å; L57-Y91 HydrophobicContact CB-CD1 4.01Å; L57-Y91 HydrophobicContact CB-CE1 3.89Å; L57-Y91 HydrophobicContact CD1-CD1 4.08Å; L57-Y91 HydrophobicContact CD1-CE1 4.05Å; L57-Y91 HydrophobicContact CD2-CE1 3.7Å; L57-Y91 HydrophobicContact CG-CD1 4.43Å; L57-Y91 HydrophobicContact CG-CE1 4.08Å; L57-F92 HydrophobicContact CD1-CB 4.41Å; L57-F92 HydrophobicContact CD1-CD2 3.94Å; L57-Y95 HydrophobicContact CD1-CD1 3.85Å; L57-Y95 HydrophobicContact CD1-CD2 4.13Å; L57-Y95 HydrophobicContact CD1-CG 3.56Å; L57-Y95 HydrophobicContact CD2-CD2 3.87Å; L57-Y95 HydrophobicContact CD2-CE2 4.1Å; L57-Y95 HydrophobicContact CD2-CG 4.15Å; L57-Y95 HydrophobicContact CG-CG 4.43Å; L57-P143 HydrophobicContact CD2-CB 4.38Å; L57-P143 HydrophobicContact CD2-CG 3.84Å
58	V	87.2	Confident	84.1	Confident	48 Å²	48	60.3 Å²	60.3	29%	0.291	30%	0.296	S	S	.	.	H	α-helix	trans	-60.8	-46.1	175.3	160.4	0	0	0	0	110.3	K54 S55 A56 T61 K62 Q88	K54-V58 HydrophobicContact CG-CG2 4.39Å; K54-V58 WeakPolarHBondContact O-CB 3.4Å; K54-V58 WeakPolarHBondContact O-CG2 3.46Å; K54-V58 PolarHBondContact O-N 3.3Å; S55-V58 PolarHBondContact O-N 2.92Å; A56-V58 VanDerWaalsContact C-N 3.34Å; A56-V58 PolarHBondContact O-N 3.47Å; V58-T61 PolarHBondContact O-N 3.08Å; V58-T61 PolarHBondContact O-OG1 3.44Å; V58-K62 PolarHBondContact O-N 3.11Å; V58-K62 VanDerWaalsContact O-N 3.1Å; V58-Q88 HydrophobicContact CG2-CB 4.28Å; V58-Q88 HydrophobicContact CG2-CG 4.22Å
59	Q	82.2	Confident	84.5	Confident	91 Å²	91	55.8 Å²	55.8	43%	0.425	28%	0.275	S	S	.	.	H	α-helix	trans	-68.6	-38.7	-179.4	-168.4	171.4	3	0	0	111.9	S55 A56 L57 T61 T145	S55-Q59 PolarHBondContact O-N 2.89Å; A56-Q59 PolarHBondContact O-N 3.47Å; L57-Q59 VanDerWaalsContact C-N 3.35Å; Q59-T61 VanDerWaalsContact C-N 3.34Å; Q59-T61 PolarHBondContact O-N 3.36Å; Q59-T145 HydrophobicContact CB-CG2 3.61Å; Q59-T145 VanDerWaalsContact CD-CG2 3.47Å; Q59-T145 HydrophobicContact CG-CG2 3.39Å
60	Q	76.8	Confident	85.2	Confident	48 Å²	48	60.3 Å²	60.3	22%	0.224	29%	0.291	C	S	.	.	H	α-helix	trans	-64	-37.2	177.2	-170.9	-171.1	-5.2	0	0	112.6	A56 L57 L309	A56-Q60 WeakPolarHBondContact O-CB 3.37Å; A56-Q60 PolarHBondContact O-N 3.38Å; L57-Q60 PolarHBondContact O-N 2.99Å; Q60-L309 PolarHBondContact NE2-O 2.91Å
61	T	79.6	Confident	85.4	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-94.4	-7.2	-174.5	57.2	0	0	0	0	114.2	L57 V58 Q59 D63 L64 Y65 Y91 L309	L57-T61 WeakPolarHBondContact O-CB 3.39Å; L57-T61 WeakPolarHBondContact O-CG2 3.43Å; L57-T61 PolarHBondContact O-N 2.88Å; L57-T61 PolarHBondContact O-OG1 2.8Å; V58-T61 PolarHBondContact O-N 3.08Å; V58-T61 PolarHBondContact O-OG1 3.44Å; Q59-T61 VanDerWaalsContact C-N 3.34Å; Q59-T61 PolarHBondContact O-N 3.36Å; T61-D63 PolarHBondContact O-N 3.03Å; T61-L64 PolarHBondContact O-N 3.36Å; T61-Y65 VanDerWaalsContact CB-CE2 3.44Å; T61-Y65 HydrophobicContact CG2-CE1 4.34Å; T61-Y65 HydrophobicContact CG2-CE2 3.95Å; T61-Y65 WeakPolarHBondContact O-CB 3.43Å; T61-Y65 PolarHBondContact O-N 2.85Å; T61-Y65 WeakPolarHBondContact OG1-CE2 3.49Å; T61-Y91 HydrophobicContact CG2-CD1 3.74Å; T61-Y91 HydrophobicContact CG2-CE1 3.55Å; T61-L309 HydrophobicContact CG2-CD1 3.91Å; T61-L309 HydrophobicContact CG2-CD2 4.33Å
62	K	83.4	Confident	85.5	Confident	103 Å²	103	61.6 Å²	61.6	45%	0.448	29%	0.294	S	S	.	.	H	α-helix	trans	-49.3	-60.3	-171.2	-176.2	-175.6	174.8	-172.1	0	113.6	V58 L64 Y65 E66	V58-K62 PolarHBondContact O-N 3.11Å; V58-K62 VanDerWaalsContact O-N 3.1Å; K62-L64 PolarHBondContact O-N 3.32Å; K62-Y65 PolarHBondContact O-N 3.41Å; K62-E66 WeakPolarHBondContact CE-OE1 3.29Å; K62-E66 HydrophobicContact CG-CG 4.43Å; K62-E66 WeakPolarHBondContact CG-OE1 3.46Å; K62-E66 VanDerWaalsContact O-CB 3.31Å; K62-E66 WeakPolarHBondContact O-CB 3.48Å; K62-E66 VanDerWaalsContact O-CG 3.29Å; K62-E66 WeakPolarHBondContact O-CG 3.37Å; K62-E66 PolarHBondContact O-N 3.15Å
63	D	78.3	Confident	85.9	Confident	103 Å²	103	62 Å²	62	55%	0.551	30%	0.295	S	S	*	.	H	α-helix	trans	-65.5	-40.3	-171.4	-67.3	-26	0	0	0	111.8	T61 Q67	T61-D63 PolarHBondContact O-N 3.03Å; D63-Q67 WeakPolarHBondContact O-CB 3.44Å; D63-Q67 PolarHBondContact O-N 3.35Å
64	L	82.2	Confident	86.4	Confident	75 Å²	75	66.2 Å²	66.2	39%	0.393	32%	0.323	S	S	.	.	H	α-helix	trans	-64.4	-47.9	177.9	177.6	64.5	0	0	0	111.3	T61 K62 Q67 Y68 L309	T61-L64 PolarHBondContact O-N 3.36Å; K62-L64 PolarHBondContact O-N 3.32Å; L64-Q67 PolarHBondContact O-N 2.98Å; L64-Y68 WeakPolarHBondContact O-CB 3.37Å; L64-Y68 PolarHBondContact O-N 3.34Å; L64-L309 HydrophobicContact CD2-CD1 3.47Å; L64-L309 VanDerWaalsContact CD2-CD1 3.47Å; L64-L309 HydrophobicContact CD2-CD2 3.66Å; L64-L309 HydrophobicContact CD2-CG 3.81Å
65	Y	88	Confident	86.5	Confident	13 Å²	13	72.5 Å²	72.5	5%	0.051	35%	0.35	C	S	.	.	H	α-helix	trans	-69.5	-37	-178.3	-72.6	1.1	0	0	0	111.7	T61 K62 A69 M87 Q88 L309	T61-Y65 VanDerWaalsContact CB-CE2 3.44Å; T61-Y65 HydrophobicContact CG2-CE1 4.34Å; T61-Y65 HydrophobicContact CG2-CE2 3.95Å; T61-Y65 WeakPolarHBondContact O-CB 3.43Å; T61-Y65 PolarHBondContact O-N 2.85Å; T61-Y65 WeakPolarHBondContact OG1-CE2 3.49Å; K62-Y65 PolarHBondContact O-N 3.41Å; Y65-A69 WeakPolarHBondContact O-CB 3.44Å; Y65-A69 PolarHBondContact O-N 3.13Å; Y65-M87 HydrophobicContact CD1-CE 4.01Å; Y65-M87 HydrophobicContact CD1-SD 4.45Å; Y65-M87 HydrophobicContact CD2-CB 3.94Å; Y65-M87 HydrophobicContact CD2-CE 4.18Å; Y65-M87 HydrophobicContact CE2-CB 3.78Å; Y65-M87 HydrophobicContact CG-CB 4.41Å; Y65-M87 HydrophobicContact CG-CE 3.68Å; Y65-Q88 HydrophobicContact CD2-CG 3.63Å; Y65-Q88 HydrophobicContact CE2-CG 3.77Å; Y65-L309 HydrophobicContact CE1-CD1 3.5Å; Y65-L309 VanDerWaalsContact CE1-CD1 3.5Å
66	E	89.3	Confident	86.9	Confident	65 Å²	65	71.8 Å²	71.8	30%	0.304	34%	0.341	S	S	.	.	H	α-helix	trans	-62.9	-42.7	172	-77.4	-176.4	-169.2	0	0	112	K62 R70 I84	K62-E66 WeakPolarHBondContact CE-OE1 3.29Å; K62-E66 HydrophobicContact CG-CG 4.43Å; K62-E66 WeakPolarHBondContact CG-OE1 3.46Å; K62-E66 VanDerWaalsContact O-CB 3.31Å; K62-E66 WeakPolarHBondContact O-CB 3.48Å; K62-E66 VanDerWaalsContact O-CG 3.29Å; K62-E66 WeakPolarHBondContact O-CG 3.37Å; K62-E66 PolarHBondContact O-N 3.15Å; E66-R70 VanDerWaalsContact O-CB 3.31Å; E66-R70 WeakPolarHBondContact O-CB 3.39Å; E66-R70 PolarHBondContact O-N 2.93Å; E66-I84 HydrophobicContact CG-CD1 3.88Å
67	Q	85.4	Confident	87.5	Confident	103 Å²	103	76.8 Å²	76.8	48%	0.481	37%	0.366	S	S	.	.	H	α-helix	trans	-62.8	-51.5	175.9	-179.9	177.1	-12.5	0	0	111.3	D63 L64 A69 R70 E71	D63-Q67 WeakPolarHBondContact O-CB 3.44Å; D63-Q67 PolarHBondContact O-N 3.35Å; L64-Q67 PolarHBondContact O-N 2.98Å; Q67-A69 VanDerWaalsContact C-N 3.33Å; Q67-A69 PolarHBondContact O-N 3.15Å; Q67-R70 WeakPolarHBondContact O-CB 3.45Å; Q67-R70 PolarHBondContact O-N 3.28Å; Q67-R70 VanDerWaalsContact O-N 3.16Å; Q67-E71 PolarHBondContact NE2-OE1 3.49Å; Q67-E71 PolarHBondContact O-N 3.01Å
68	Y	85.4	Confident	88.1	Confident	78 Å²	78	82.7 Å²	82.7	31%	0.306	39%	0.393	S	S	.	.	H	α-helix	trans	-59.2	-45.2	179.7	-179.6	-99.1	0	0	0	111.6	L64 R70 E71 Q72 L83 M87 L304	L64-Y68 WeakPolarHBondContact O-CB 3.37Å; L64-Y68 PolarHBondContact O-N 3.34Å; Y68-R70 VanDerWaalsContact C-N 3.31Å; Y68-R70 PolarHBondContact O-N 3.47Å; Y68-E71 PolarHBondContact O-N 3.05Å; Y68-E71 VanDerWaalsContact O-N 3.15Å; Y68-Q72 HydrophobicContact CD1-CG 4.09Å; Y68-Q72 HydrophobicContact CE1-CG 3.59Å; Y68-Q72 HydrophobicContact CE2-CG 4.16Å; Y68-Q72 WeakPolarHBondContact O-CG 3.31Å; Y68-Q72 PolarHBondContact O-N 3.45Å; Y68-L83 HydrophobicContact CD1-CD2 4.05Å; Y68-L83 HydrophobicContact CE1-CD2 3.95Å; Y68-M87 HydrophobicContact CD1-CE 4.02Å; Y68-M87 HydrophobicContact CD1-SD 3.62Å; Y68-M87 HydrophobicContact CE1-SD 3.96Å; Y68-L304 HydrophobicContact CD1-CD2 4.03Å; Y68-L304 HydrophobicContact CD2-CD2 4.39Å; Y68-L304 HydrophobicContact CE1-CD2 3.44Å; Y68-L304 VanDerWaalsContact CE1-CD2 3.44Å; Y68-L304 HydrophobicContact CE2-CD2 3.84Å; Y68-L304 HydrophobicContact CG-CD2 4.47Å; Y68-L304 WeakPolarHBondContact OH-CD2 3.36Å
69	A	90.7	Very high	88.4	Confident	0 Å²	0	85.4 Å²	85.4	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-61.3	-40.1	177.6	0	0	0	0	0	112.2	Y65 Q67 E71 Q72 F73 Q80 L83 I84	Y65-A69 WeakPolarHBondContact O-CB 3.44Å; Y65-A69 PolarHBondContact O-N 3.13Å; Q67-A69 VanDerWaalsContact C-N 3.33Å; Q67-A69 PolarHBondContact O-N 3.15Å; A69-E71 VanDerWaalsContact C-N 3.32Å; A69-E71 PolarHBondContact O-N 3.38Å; A69-Q72 PolarHBondContact O-N 3.28Å; A69-F73 PolarHBondContact O-N 3.01Å; A69-Q80 HydrophobicContact CB-CB 4Å; A69-Q80 HydrophobicContact CB-CG 4.15Å; A69-Q80 WeakPolarHBondContact O-CG 3.49Å; A69-L83 HydrophobicContact CB-CD2 4.15Å; A69-I84 HydrophobicContact CB-CD1 3.98Å; A69-I84 HydrophobicContact CB-CG1 3.71Å
70	R	92.6	Very high	89	Confident	130 Å²	130	82.1 Å²	82.1	49%	0.491	39%	0.385	S	S	.	.	H	α-helix	trans	-64.1	-34.9	175.7	-168	-177.7	-58.4	120.2	4.7	112.4	E66 Q67 Y68 P74	E66-R70 VanDerWaalsContact O-CB 3.31Å; E66-R70 WeakPolarHBondContact O-CB 3.39Å; E66-R70 PolarHBondContact O-N 2.93Å; Q67-R70 WeakPolarHBondContact O-CB 3.45Å; Q67-R70 PolarHBondContact O-N 3.28Å; Q67-R70 VanDerWaalsContact O-N 3.16Å; Y68-R70 VanDerWaalsContact C-N 3.31Å; Y68-R70 PolarHBondContact O-N 3.47Å; R70-P74 WeakPolarHBondContact O-CA 3.34Å; R70-P74 WeakPolarHBondContact O-CD 3.15Å; R70-P74 VanDerWaalsContact O-CG 3.31Å; R70-P74 WeakPolarHBondContact O-CG 3.29Å
71	E	91.5	Very high	89.9	Confident	119 Å²	119	85.5 Å²	85.5	56%	0.556	40%	0.399	S	S	*	.	H	α-helix	trans	-70.6	-42.7	175.6	-70.6	174.4	-168.6	0	0	112.2	Q67 Y68 A69	Q67-E71 PolarHBondContact NE2-OE1 3.49Å; Q67-E71 PolarHBondContact O-N 3.01Å; Y68-E71 PolarHBondContact O-N 3.05Å; Y68-E71 VanDerWaalsContact O-N 3.15Å; A69-E71 VanDerWaalsContact C-N 3.32Å; A69-E71 PolarHBondContact O-N 3.38Å
72	Q	91	Very high	90.6	Very high	94 Å²	94	88.4 Å²	88.4	44%	0.439	42%	0.424	S	S	.	.	H	α-helix	trans	-70.2	-39	178.7	-63	-53.1	-44.6	0	0	112.6	Y68 A69 L83	Y68-Q72 HydrophobicContact CD1-CG 4.09Å; Y68-Q72 HydrophobicContact CE1-CG 3.59Å; Y68-Q72 HydrophobicContact CE2-CG 4.16Å; Y68-Q72 WeakPolarHBondContact O-CG 3.31Å; Y68-Q72 PolarHBondContact O-N 3.45Å; A69-Q72 PolarHBondContact O-N 3.28Å; Q72-L83 HydrophobicContact CB-CD2 4.07Å; Q72-L83 HydrophobicContact CG-CD2 4.11Å
73	F	93.3	Very high	91	Very high	72 Å²	72	84.8 Å²	84.8	32%	0.316	41%	0.409	S	S	.	.			trans	-132.3	64.8	-174.6	-58.9	-64.5	0	0	0	113.1	A69 K75 D76 K79 Q80 L83	A69-F73 PolarHBondContact O-N 3.01Å; F73-K75 PolarHBondContact O-N 3.26Å; F73-D76 HydrophobicContact CB-CB 4.36Å; F73-D76 PolarHBondContact O-N 2.74Å; F73-K79 HydrophobicContact CB-CB 4.08Å; F73-K79 HydrophobicContact CD1-CB 4Å; F73-K79 HydrophobicContact CD1-CD 3.67Å; F73-K79 HydrophobicContact CD2-CB 3.78Å; F73-K79 HydrophobicContact CE1-CB 4.39Å; F73-K79 HydrophobicContact CE1-CD 3.71Å; F73-K79 HydrophobicContact CE2-CB 4.17Å; F73-K79 HydrophobicContact CG-CB 3.68Å; F73-K79 HydrophobicContact CG-CD 4.24Å; F73-K79 HydrophobicContact CZ-CB 4.46Å; F73-K79 HydrophobicContact CZ-CD 4.28Å; F73-Q80 HydrophobicContact CB-CG 4.02Å; F73-Q80 PolarHBondContact O-NE2 3.5Å; F73-L83 HydrophobicContact CD2-CD2 3.95Å; F73-L83 HydrophobicContact CE2-CB 4.29Å; F73-L83 HydrophobicContact CE2-CD2 3.75Å
74	P	93.4	Very high	91.7	Very high	89 Å²	89	81.1 Å²	81.1	58%	0.578	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-21.9	-167.9	-25.3	32.4	0	0	0	117.2	R70	R70-P74 WeakPolarHBondContact O-CA 3.34Å; R70-P74 WeakPolarHBondContact O-CD 3.15Å; R70-P74 VanDerWaalsContact O-CG 3.31Å; R70-P74 WeakPolarHBondContact O-CG 3.29Å
75	K	92.6	Very high	92.2	Very high	206 Å²	206	80.9 Å²	80.9	90%	0.896	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.8	-3.2	-174.4	-62.2	-176.5	179.4	-179.4	0	114	F73	F73-K75 PolarHBondContact O-N 3.26Å
76	D	95.1	Very high	92.4	Very high	56 Å²	56	85.4 Å²	85.4	30%	0.299	41%	0.413	S	S	.	.			trans	-119.5	88.9	-169	-168	-24.1	0	0	0	109.9	F73 E78 K79 Q80	F73-D76 HydrophobicContact CB-CB 4.36Å; F73-D76 PolarHBondContact O-N 2.74Å; D76-E78 VanDerWaalsContact C-N 3.26Å; D76-E78 PolarHBondContact O-N 3.46Å; D76-E78 PolarHBondContact OD1-N 3.42Å; D76-K79 HydrophobicContact CB-CB 4.16Å; D76-K79 HydrophobicContact CB-CD 4.32Å; D76-K79 HydrophobicContact CB-CG 4.4Å; D76-K79 PolarHBondContact O-N 2.86Å; D76-K79 PolarHBondContact OD1-N 2.64Å; D76-K79 VanDerWaalsContact OD1-N 3.16Å; D76-K79 WeakPolarHBondContact OD2-CD 3.28Å; D76-K79 WeakPolarHBondContact OD2-CE 3.25Å; D76-K79 WeakPolarHBondContact OD2-CG 3.38Å; D76-K79 IonicContact OD2-NZ 3.76Å; D76-K79 PolarHBondContact OD2-NZ 2.86Å; D76-Q80 WeakPolarHBondContact O-CG 3.06Å; D76-Q80 PolarHBondContact O-N 3.05Å
77	L	95.2	Very high	92.5	Very high	116 Å²	116	82.5 Å²	82.5	61%	0.607	40%	0.399	S	S	*	.	H	α-helix	trans	-62.6	-31.8	-176.2	-68.4	175.2	0	0	0	112.9	Q80 K81	L77-Q80 PolarHBondContact O-N 3.09Å; L77-K81 WeakPolarHBondContact O-CG 3.04Å; L77-K81 PolarHBondContact O-N 2.76Å
78	E	96	Very high	92.7	Very high	127 Å²	127	79 Å²	79	59%	0.593	38%	0.382	S	S	*	.	H	α-helix	trans	-72.4	-39.3	179.4	-70	-60.5	117.9	0	0	110.9	D76 Q80 K81 A82	D76-E78 VanDerWaalsContact C-N 3.26Å; D76-E78 PolarHBondContact O-N 3.46Å; D76-E78 PolarHBondContact OD1-N 3.42Å; E78-Q80 VanDerWaalsContact C-N 3.35Å; E78-K81 PolarHBondContact O-N 2.99Å; E78-K81 IonicContact OE1-NZ 3.99Å; E78-K81 PolarHBondContact OE1-NZ 2.96Å; E78-A82 WeakPolarHBondContact O-CB 3.42Å; E78-A82 PolarHBondContact O-N 3.28Å
79	K	94.6	Very high	92.9	Very high	105 Å²	105	78 Å²	78	46%	0.457	38%	0.382	S	S	.	.	H	α-helix	trans	-66.9	-35.7	170.6	-72.4	-175.5	-169.1	145.7	0	113	F73 D76 L83	F73-K79 HydrophobicContact CB-CB 4.08Å; F73-K79 HydrophobicContact CD1-CB 4Å; F73-K79 HydrophobicContact CD1-CD 3.67Å; F73-K79 HydrophobicContact CD2-CB 3.78Å; F73-K79 HydrophobicContact CE1-CB 4.39Å; F73-K79 HydrophobicContact CE1-CD 3.71Å; F73-K79 HydrophobicContact CE2-CB 4.17Å; F73-K79 HydrophobicContact CG-CB 3.68Å; F73-K79 HydrophobicContact CG-CD 4.24Å; F73-K79 HydrophobicContact CZ-CB 4.46Å; F73-K79 HydrophobicContact CZ-CD 4.28Å; D76-K79 HydrophobicContact CB-CB 4.16Å; D76-K79 HydrophobicContact CB-CD 4.32Å; D76-K79 HydrophobicContact CB-CG 4.4Å; D76-K79 PolarHBondContact O-N 2.86Å; D76-K79 PolarHBondContact OD1-N 2.64Å; D76-K79 VanDerWaalsContact OD1-N 3.16Å; D76-K79 WeakPolarHBondContact OD2-CD 3.28Å; D76-K79 WeakPolarHBondContact OD2-CE 3.25Å; D76-K79 WeakPolarHBondContact OD2-CG 3.38Å; D76-K79 IonicContact OD2-NZ 3.76Å; D76-K79 PolarHBondContact OD2-NZ 2.86Å; K79-L83 VanDerWaalsContact O-CB 3.24Å; K79-L83 WeakPolarHBondContact O-CB 3.37Å; K79-L83 PolarHBondContact O-N 3.34Å
80	Q	94.2	Very high	92.8	Very high	22 Å²	22	81.8 Å²	81.8	10%	0.103	40%	0.4	C	S	.	.	H	α-helix	trans	-59.8	-51.1	173.7	-71.3	177.9	27.1	0	0	110.8	A69 F73 D76 L77 E78 A82 L83 I84	A69-Q80 HydrophobicContact CB-CB 4Å; A69-Q80 HydrophobicContact CB-CG 4.15Å; A69-Q80 WeakPolarHBondContact O-CG 3.49Å; F73-Q80 HydrophobicContact CB-CG 4.02Å; F73-Q80 PolarHBondContact O-NE2 3.5Å; D76-Q80 WeakPolarHBondContact O-CG 3.06Å; D76-Q80 PolarHBondContact O-N 3.05Å; L77-Q80 PolarHBondContact O-N 3.09Å; E78-Q80 VanDerWaalsContact C-N 3.35Å; Q80-A82 PolarHBondContact O-N 2.99Å; Q80-L83 PolarHBondContact O-N 3.42Å; Q80-I84 WeakPolarHBondContact O-CD1 3.46Å; Q80-I84 VanDerWaalsContact O-CG1 3.22Å; Q80-I84 WeakPolarHBondContact O-CG1 3.46Å; Q80-I84 PolarHBondContact O-N 3.25Å
81	K	95.4	Very high	92.4	Very high	119 Å²	119	75.6 Å²	75.6	52%	0.517	38%	0.377	S	S	.	.	H	α-helix	trans	-59.8	-47.6	178	-71.7	174.1	-169.9	166.4	0	112.3	L77 E78 L83 I84 T85	L77-K81 WeakPolarHBondContact O-CG 3.04Å; L77-K81 PolarHBondContact O-N 2.76Å; E78-K81 PolarHBondContact O-N 2.99Å; E78-K81 IonicContact OE1-NZ 3.99Å; E78-K81 PolarHBondContact OE1-NZ 2.96Å; K81-L83 VanDerWaalsContact C-N 3.31Å; K81-L83 PolarHBondContact O-N 3.46Å; K81-I84 PolarHBondContact O-N 3.42Å; K81-T85 PolarHBondContact O-N 3.16Å; K81-T85 PolarHBondContact O-OG1 3.03Å
82	A	95.2	Very high	92.3	Very high	62 Å²	62	71.1 Å²	71.1	51%	0.512	36%	0.356	S	S	.	.	H	α-helix	trans	-59.9	-43.1	179.3	0	0	0	0	0	111.7	E78 Q80 T85 E86	E78-A82 WeakPolarHBondContact O-CB 3.42Å; E78-A82 PolarHBondContact O-N 3.28Å; Q80-A82 PolarHBondContact O-N 2.99Å; A82-T85 PolarHBondContact O-N 2.85Å; A82-E86 WeakPolarHBondContact O-CB 3.48Å; A82-E86 PolarHBondContact O-N 3.21Å
83	L	92.5	Very high	92.1	Very high	27 Å²	27	73.2 Å²	73.2	14%	0.141	37%	0.365	C	S	.	.	H	α-helix	trans	-64.7	-43.1	176.2	178.9	60.9	0	0	0	111.8	Y68 A69 Q72 F73 K79 Q80 K81 E86 M87	Y68-L83 HydrophobicContact CD1-CD2 4.05Å; Y68-L83 HydrophobicContact CE1-CD2 3.95Å; A69-L83 HydrophobicContact CB-CD2 4.15Å; Q72-L83 HydrophobicContact CB-CD2 4.07Å; Q72-L83 HydrophobicContact CG-CD2 4.11Å; F73-L83 HydrophobicContact CD2-CD2 3.95Å; F73-L83 HydrophobicContact CE2-CB 4.29Å; F73-L83 HydrophobicContact CE2-CD2 3.75Å; K79-L83 VanDerWaalsContact O-CB 3.24Å; K79-L83 WeakPolarHBondContact O-CB 3.37Å; K79-L83 PolarHBondContact O-N 3.34Å; Q80-L83 PolarHBondContact O-N 3.42Å; K81-L83 VanDerWaalsContact C-N 3.31Å; K81-L83 PolarHBondContact O-N 3.46Å; L83-E86 PolarHBondContact O-N 2.62Å; L83-M87 HydrophobicContact CD1-CG 4.13Å; L83-M87 HydrophobicContact CD1-SD 4.19Å; L83-M87 HydrophobicContact CG-CE 4.04Å; L83-M87 HydrophobicContact CG-CG 4.49Å; L83-M87 HydrophobicContact CG-SD 4.19Å; L83-M87 WeakPolarHBondContact O-CB 3.19Å; L83-M87 VanDerWaalsContact O-CG 3.24Å; L83-M87 WeakPolarHBondContact O-CG 3.33Å; L83-M87 PolarHBondContact O-N 3.38Å
84	I	91.3	Very high	91.6	Very high	25 Å²	25	72 Å²	72	13%	0.128	36%	0.361	C	S	.	.	H	α-helix	trans	-60.7	-48.3	176.9	-67.6	161.8	0	0	0	110.4	E66 A69 Q80 K81 E86 M87 Q88	E66-I84 HydrophobicContact CG-CD1 3.88Å; A69-I84 HydrophobicContact CB-CD1 3.98Å; A69-I84 HydrophobicContact CB-CG1 3.71Å; Q80-I84 WeakPolarHBondContact O-CD1 3.46Å; Q80-I84 VanDerWaalsContact O-CG1 3.22Å; Q80-I84 WeakPolarHBondContact O-CG1 3.46Å; Q80-I84 PolarHBondContact O-N 3.25Å; K81-I84 PolarHBondContact O-N 3.42Å; I84-E86 PolarHBondContact O-N 2.94Å; I84-M87 HydrophobicContact CG1-CE 4.41Å; I84-M87 PolarHBondContact O-N 3.36Å; I84-Q88 HydrophobicContact CG2-CG 4.3Å; I84-Q88 WeakPolarHBondContact O-CB 3.45Å; I84-Q88 VanDerWaalsContact O-CG 3.25Å; I84-Q88 WeakPolarHBondContact O-CG 3.47Å; I84-Q88 PolarHBondContact O-N 3.41Å
85	T	93.9	Very high	91.1	Very high	71 Å²	71	67.9 Å²	67.9	44%	0.436	33%	0.334	S	S	.	.	H	α-helix	trans	-60.6	-45.1	178	-60.5	0	0	0	0	111.6	K81 A82 M87 Q88 D89	K81-T85 PolarHBondContact O-N 3.16Å; K81-T85 PolarHBondContact O-OG1 3.03Å; A82-T85 PolarHBondContact O-N 2.85Å; T85-M87 PolarHBondContact O-N 2.95Å; T85-Q88 PolarHBondContact O-N 3.08Å; T85-D89 WeakPolarHBondContact O-CB 3.37Å; T85-D89 PolarHBondContact O-N 3.32Å
86	E	92.5	Very high	90.7	Very high	108 Å²	108	59.8 Å²	59.8	51%	0.505	30%	0.3	S	S	.	.	H	α-helix	trans	-58.9	-46.8	176.2	-177.6	-178.6	175.6	0	0	111.9	A82 L83 I84 Q88 D89 Q90	A82-E86 WeakPolarHBondContact O-CB 3.48Å; A82-E86 PolarHBondContact O-N 3.21Å; L83-E86 PolarHBondContact O-N 2.62Å; I84-E86 PolarHBondContact O-N 2.94Å; E86-Q88 VanDerWaalsContact C-N 3.34Å; E86-Q88 PolarHBondContact O-N 3.4Å; E86-D89 PolarHBondContact O-N 3.06Å; E86-Q90 WeakPolarHBondContact O-CB 3.46Å; E86-Q90 WeakPolarHBondContact O-CG 3.13Å; E86-Q90 PolarHBondContact O-N 2.93Å; E86-Q90 PolarHBondContact OE1-NE2 3.02Å
87	M	90.2	Very high	89.9	Confident	4 Å²	4	60.5 Å²	60.5	2%	0.02	31%	0.309	C	S	.	.	H	α-helix	trans	-64.5	-38.3	178.1	-69	-174.4	-53.5	0	0	112	Y65 Y68 L83 I84 T85 Y91 L304	Y65-M87 HydrophobicContact CD1-CE 4.01Å; Y65-M87 HydrophobicContact CD1-SD 4.45Å; Y65-M87 HydrophobicContact CD2-CB 3.94Å; Y65-M87 HydrophobicContact CD2-CE 4.18Å; Y65-M87 HydrophobicContact CE2-CB 3.78Å; Y65-M87 HydrophobicContact CG-CB 4.41Å; Y65-M87 HydrophobicContact CG-CE 3.68Å; Y68-M87 HydrophobicContact CD1-CE 4.02Å; Y68-M87 HydrophobicContact CD1-SD 3.62Å; Y68-M87 HydrophobicContact CE1-SD 3.96Å; L83-M87 HydrophobicContact CD1-CG 4.13Å; L83-M87 HydrophobicContact CD1-SD 4.19Å; L83-M87 HydrophobicContact CG-CE 4.04Å; L83-M87 HydrophobicContact CG-CG 4.49Å; L83-M87 HydrophobicContact CG-SD 4.19Å; L83-M87 WeakPolarHBondContact O-CB 3.19Å; L83-M87 VanDerWaalsContact O-CG 3.24Å; L83-M87 WeakPolarHBondContact O-CG 3.33Å; L83-M87 PolarHBondContact O-N 3.38Å; I84-M87 HydrophobicContact CG1-CE 4.41Å; I84-M87 PolarHBondContact O-N 3.36Å; T85-M87 PolarHBondContact O-N 2.95Å; M87-Y91 WeakPolarHBondContact O-CB 3.31Å; M87-Y91 PolarHBondContact O-N 3.37Å; M87-L304 HydrophobicContact CG-CD1 3.58Å; M87-L304 HydrophobicContact SD-CD1 3.58Å; M87-L304 VanDerWaalsContact SD-CD1 3.58Å; M87-L304 HydrophobicContact SD-CD2 4.14Å
88	Q	89.9	Confident	89	Confident	28 Å²	28	60.9 Å²	60.9	13%	0.131	31%	0.308	C	S	.	.	H	α-helix	trans	-68.3	-41.3	177.6	-73.6	174.9	-25.3	0	0	112.2	V58 Y65 I84 T85 E86 Y91 F92	V58-Q88 HydrophobicContact CG2-CB 4.28Å; V58-Q88 HydrophobicContact CG2-CG 4.22Å; Y65-Q88 HydrophobicContact CD2-CG 3.63Å; Y65-Q88 HydrophobicContact CE2-CG 3.77Å; I84-Q88 HydrophobicContact CG2-CG 4.3Å; I84-Q88 WeakPolarHBondContact O-CB 3.45Å; I84-Q88 VanDerWaalsContact O-CG 3.25Å; I84-Q88 WeakPolarHBondContact O-CG 3.47Å; I84-Q88 PolarHBondContact O-N 3.41Å; T85-Q88 PolarHBondContact O-N 3.08Å; E86-Q88 VanDerWaalsContact C-N 3.34Å; E86-Q88 PolarHBondContact O-N 3.4Å; Q88-Y91 PolarHBondContact O-N 2.94Å; Q88-F92 VanDerWaalsContact O-CB 3.29Å; Q88-F92 WeakPolarHBondContact O-CB 3.44Å; Q88-F92 PolarHBondContact O-N 2.95Å
89	D	90.3	Very high	88	Confident	57 Å²	57	55.5 Å²	55.5	31%	0.305	28%	0.284	S	S	.	.	H	α-helix	trans	-67	-45.4	177.4	-72.8	-22	0	0	0	111	K54 T85 E86 Y91 F92 E93	K54-D89 WeakPolarHBondContact CE-OD1 3.36Å; K54-D89 IonicContact NZ-OD1 3.28Å; K54-D89 PolarHBondContact NZ-OD1 3.05Å; T85-D89 WeakPolarHBondContact O-CB 3.37Å; T85-D89 PolarHBondContact O-N 3.32Å; E86-D89 PolarHBondContact O-N 3.06Å; D89-Y91 VanDerWaalsContact C-N 3.33Å; D89-Y91 PolarHBondContact O-N 3.21Å; D89-F92 PolarHBondContact O-N 2.97Å; D89-E93 WeakPolarHBondContact O-CG 3.07Å; D89-E93 PolarHBondContact O-N 2.83Å
90	Q	88.8	Confident	87.2	Confident	80 Å²	80	51.9 Å²	51.9	37%	0.374	27%	0.267	S	S	.	.	H	α-helix	trans	-59.6	-43.6	174.5	-74.8	176.5	2.3	0	0	112	E86 E93 H94	E86-Q90 WeakPolarHBondContact O-CB 3.46Å; E86-Q90 WeakPolarHBondContact O-CG 3.13Å; E86-Q90 PolarHBondContact O-N 2.93Å; E86-Q90 PolarHBondContact OE1-NE2 3.02Å; Q90-E93 PolarHBondContact O-N 2.8Å; Q90-H94 WeakPolarHBondContact O-CB 3.47Å; Q90-H94 PolarHBondContact O-N 3.36Å
91	Y	84.1	Confident	86.4	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-64.2	-41.5	178	-176.8	-123.3	0	0	0	112	L57 T61 M87 Q88 D89 H94 Y95 I306 L309 I310	L57-Y91 HydrophobicContact CB-CD1 4.01Å; L57-Y91 HydrophobicContact CB-CE1 3.89Å; L57-Y91 HydrophobicContact CD1-CD1 4.08Å; L57-Y91 HydrophobicContact CD1-CE1 4.05Å; L57-Y91 HydrophobicContact CD2-CE1 3.7Å; L57-Y91 HydrophobicContact CG-CD1 4.43Å; L57-Y91 HydrophobicContact CG-CE1 4.08Å; T61-Y91 HydrophobicContact CG2-CD1 3.74Å; T61-Y91 HydrophobicContact CG2-CE1 3.55Å; M87-Y91 WeakPolarHBondContact O-CB 3.31Å; M87-Y91 PolarHBondContact O-N 3.37Å; Q88-Y91 PolarHBondContact O-N 2.94Å; D89-Y91 VanDerWaalsContact C-N 3.33Å; D89-Y91 PolarHBondContact O-N 3.21Å; Y91-H94 PolarHBondContact O-N 3.22Å; Y91-Y95 VanDerWaalsContact O-CB 3.26Å; Y91-Y95 WeakPolarHBondContact O-CB 3.48Å; Y91-Y95 PolarHBondContact O-N 3.21Å; Y91-I306 HydrophobicContact CD2-CG2 4.26Å; Y91-L309 HydrophobicContact CE2-CB 3.99Å; Y91-L309 PolarHBondContact OH-O 2.88Å; Y91-I310 HydrophobicContact CD2-CG1 4.5Å; Y91-I310 HydrophobicContact CE2-CD1 4.03Å; Y91-I310 HydrophobicContact CE2-CG1 3.45Å; Y91-I310 VanDerWaalsContact CE2-CG1 3.45Å
92	F	88.4	Confident	85.4	Confident	26 Å²	26	58 Å²	58	11%	0.114	29%	0.289	C	S	.	.	H	α-helix	trans	-64.4	-45	177.2	178.6	-111.9	0	0	0	112.3	E50 I53 K54 L57 Q88 D89 H94 Y95 L96	E50-F92 HydrophobicContact CB-CZ 4.14Å; E50-F92 WeakPolarHBondContact O-CE2 3.27Å; E50-F92 WeakPolarHBondContact O-CZ 3.44Å; I53-F92 HydrophobicContact CB-CE2 4.2Å; I53-F92 HydrophobicContact CG2-CD2 4.27Å; I53-F92 HydrophobicContact CG2-CE2 3.87Å; K54-F92 HydrophobicContact CB-CD2 3.76Å; K54-F92 HydrophobicContact CB-CE2 3.54Å; K54-F92 HydrophobicContact CB-CG 4.34Å; K54-F92 HydrophobicContact CB-CZ 3.93Å; K54-F92 HydrophobicContact CD-CD1 4.23Å; K54-F92 HydrophobicContact CD-CE1 4.29Å; K54-F92 HydrophobicContact CD-CG 4.37Å; K54-F92 HydrophobicContact CD-CZ 4.5Å; K54-F92 HydrophobicContact CG-CD1 4.48Å; K54-F92 HydrophobicContact CG-CD2 4.02Å; K54-F92 HydrophobicContact CG-CE2 4.23Å; K54-F92 HydrophobicContact CG-CG 4.14Å; L57-F92 HydrophobicContact CD1-CB 4.41Å; L57-F92 HydrophobicContact CD1-CD2 3.94Å; Q88-F92 VanDerWaalsContact O-CB 3.29Å; Q88-F92 WeakPolarHBondContact O-CB 3.44Å; Q88-F92 PolarHBondContact O-N 2.95Å; D89-F92 PolarHBondContact O-N 2.97Å; F92-H94 VanDerWaalsContact C-N 3.33Å; F92-H94 PolarHBondContact O-N 2.83Å; F92-Y95 PolarHBondContact O-N 2.73Å; F92-L96 HydrophobicContact CD1-CD1 4.13Å; F92-L96 HydrophobicContact CD2-CD1 4.45Å; F92-L96 HydrophobicContact CD2-CG 4.31Å; F92-L96 HydrophobicContact CE1-CD1 3.5Å; F92-L96 HydrophobicContact CE1-CG 4.35Å; F92-L96 HydrophobicContact CE2-CD1 3.87Å; F92-L96 HydrophobicContact CE2-CD2 4.22Å; F92-L96 HydrophobicContact CE2-CG 3.94Å; F92-L96 HydrophobicContact CZ-CD1 3.37Å; F92-L96 HydrophobicContact CZ-CD2 4.41Å; F92-L96 HydrophobicContact CZ-CG 3.99Å; F92-L96 WeakPolarHBondContact O-CG 2.86Å; F92-L96 PolarHBondContact O-N 2.95Å
93	E	88	Confident	84.4	Confident	137 Å²	137	55.2 Å²	55.2	64%	0.64	27%	0.265	S	S	*	.	H	α-helix	trans	-60.9	-42.7	175.5	-72.7	-177.4	175.1	0	0	111.9	D89 Q90 S97	D89-E93 WeakPolarHBondContact O-CG 3.07Å; D89-E93 PolarHBondContact O-N 2.83Å; Q90-E93 PolarHBondContact O-N 2.8Å; E93-S97 WeakPolarHBondContact O-CB 3.14Å; E93-S97 PolarHBondContact O-N 2.97Å; E93-S97 PolarHBondContact O-OG 2.97Å
94	H	82.2	Confident	83.6	Confident	48 Å²	48	57.2 Å²	57.2	22%	0.222	28%	0.276	C	S	.	.	H	α-helix	trans	-63.4	-47.4	176.2	-170.3	-85.6	0	0	0	111.6	Q90 Y91 F92 L96 S97 E98 I310	Q90-H94 WeakPolarHBondContact O-CB 3.47Å; Q90-H94 PolarHBondContact O-N 3.36Å; Y91-H94 PolarHBondContact O-N 3.22Å; F92-H94 VanDerWaalsContact C-N 3.33Å; F92-H94 PolarHBondContact O-N 2.83Å; H94-L96 PolarHBondContact O-N 2.83Å; H94-S97 PolarHBondContact O-N 3.37Å; H94-S97 PolarHBondContact O-OG 2.79Å; H94-E98 IonicContact CE1-OE2 2.71Å; H94-E98 PolarHBondContact CE1-OE2 3.09Å; H94-E98 IonicContact ND1-OE2 2.83Å; H94-E98 IonicContact NE2-OE2 3.5Å; H94-E98 PolarHBondContact NE2-OE2 2.72Å; H94-E98 PolarHBondContact O-N 3.28Å; H94-I310 WeakPolarHBondContact ND1-CD1 3.21Å
95	Y	82.3	Confident	83.1	Confident	1 Å²	1	60 Å²	60	0%	0.004	29%	0.294	C	S	.	.	I	π-helix	trans	-58.1	-48.6	177.9	179.8	-88	0	0	0	111.9	I53 L57 Y91 F92 S97 V99 Y100 Q103 L141 P143	I53-Y95 HydrophobicContact CG2-CD1 3.64Å; I53-Y95 HydrophobicContact CG2-CE1 3.48Å; I53-Y95 VanDerWaalsContact CG2-CE1 3.48Å; L57-Y95 HydrophobicContact CD1-CD1 3.85Å; L57-Y95 HydrophobicContact CD1-CD2 4.13Å; L57-Y95 HydrophobicContact CD1-CG 3.56Å; L57-Y95 HydrophobicContact CD2-CD2 3.87Å; L57-Y95 HydrophobicContact CD2-CE2 4.1Å; L57-Y95 HydrophobicContact CD2-CG 4.15Å; L57-Y95 HydrophobicContact CG-CG 4.43Å; Y91-Y95 VanDerWaalsContact O-CB 3.26Å; Y91-Y95 WeakPolarHBondContact O-CB 3.48Å; Y91-Y95 PolarHBondContact O-N 3.21Å; F92-Y95 PolarHBondContact O-N 2.73Å; Y95-S97 VanDerWaalsContact C-N 3.33Å; Y95-S97 PolarHBondContact O-N 3.08Å; Y95-V99 HydrophobicContact CD2-CB 3.82Å; Y95-V99 HydrophobicContact CD2-CG1 4.03Å; Y95-V99 HydrophobicContact CD2-CG2 4.02Å; Y95-V99 HydrophobicContact CE2-CB 3.85Å; Y95-V99 HydrophobicContact CE2-CG1 3.58Å; Y95-V99 HydrophobicContact CE2-CG2 4.42Å; Y95-V99 HydrophobicContact CG-CB 4.32Å; Y95-V99 WeakPolarHBondContact O-CA 3.33Å; Y95-V99 WeakPolarHBondContact O-CB 3.42Å; Y95-V99 PolarHBondContact O-N 3.19Å; Y95-Y100 HydrophobicContact CE1-CD2 4.44Å; Y95-Y100 PolarHBondContact O-N 2.97Å; Y95-Q103 VanDerWaalsContact OH-CD 3.28Å; Y95-Q103 PolarHBondContact OH-NE2 3.41Å; Y95-Q103 PolarHBondContact OH-OE1 3.02Å; Y95-L141 PolarHBondContact OH-O 3Å; Y95-P143 HydrophobicContact CD2-CG 4.45Å; Y95-P143 HydrophobicContact CE1-CG 4.42Å; Y95-P143 HydrophobicContact CE2-CG 3.41Å; Y95-P143 VanDerWaalsContact CE2-CG 3.41Å; Y95-P143 VanDerWaalsContact CZ-CG 3.4Å; Y95-P143 WeakPolarHBondContact OH-CD 3.32Å; Y95-P143 WeakPolarHBondContact OH-CG 3.29Å
96	L	84.7	Confident	82.3	Confident	36 Å²	36	58.6 Å²	58.6	19%	0.188	28%	0.282	C	S	.	.	I	π-helix	trans	-64.4	-36.8	179.6	-74.3	-175.2	0	0	0	112.7	E50 I53 F92 H94 Y100	E50-L96 HydrophobicContact CG-CD1 4.44Å; I53-L96 HydrophobicContact CD1-CD2 4.24Å; I53-L96 HydrophobicContact CG2-CD2 4.39Å; F92-L96 HydrophobicContact CD1-CD1 4.13Å; F92-L96 HydrophobicContact CD2-CD1 4.45Å; F92-L96 HydrophobicContact CD2-CG 4.31Å; F92-L96 HydrophobicContact CE1-CD1 3.5Å; F92-L96 HydrophobicContact CE1-CG 4.35Å; F92-L96 HydrophobicContact CE2-CD1 3.87Å; F92-L96 HydrophobicContact CE2-CD2 4.22Å; F92-L96 HydrophobicContact CE2-CG 3.94Å; F92-L96 HydrophobicContact CZ-CD1 3.37Å; F92-L96 HydrophobicContact CZ-CD2 4.41Å; F92-L96 HydrophobicContact CZ-CG 3.99Å; F92-L96 WeakPolarHBondContact O-CG 2.86Å; F92-L96 PolarHBondContact O-N 2.95Å; H94-L96 PolarHBondContact O-N 2.83Å; L96-Y100 HydrophobicContact CD2-CD1 4.08Å; L96-Y100 HydrophobicContact CD2-CG 4.15Å
97	S	79	Confident	81.6	Confident	71 Å²	71	53.6 Å²	53.6	50%	0.497	26%	0.259	S	S	.	.	I	π-helix	trans	-76.9	-41.6	-176	58.8	0	0	0	0	113.5	E93 H94 Y95 R101	E93-S97 WeakPolarHBondContact O-CB 3.14Å; E93-S97 PolarHBondContact O-N 2.97Å; E93-S97 PolarHBondContact O-OG 2.97Å; H94-S97 PolarHBondContact O-N 3.37Å; H94-S97 PolarHBondContact O-OG 2.79Å; Y95-S97 VanDerWaalsContact C-N 3.33Å; Y95-S97 PolarHBondContact O-N 3.08Å; S97-R101 WeakPolarHBondContact O-CD 3.34Å
98	E	75.1	Confident	81	Confident	124 Å²	124	61.3 Å²	61.3	58%	0.579	29%	0.288	S	S	*	.	I	π-helix	trans	-103.5	-42.4	-173.5	-62.2	-156	131.3	0	0	113.8	H94	H94-E98 IonicContact CE1-OE2 2.71Å; H94-E98 PolarHBondContact CE1-OE2 3.09Å; H94-E98 IonicContact ND1-OE2 2.83Å; H94-E98 IonicContact NE2-OE2 3.5Å; H94-E98 PolarHBondContact NE2-OE2 2.72Å; H94-E98 PolarHBondContact O-N 3.28Å
99	V	74.3	Confident	80.7	Confident	15 Å²	15	63.5 Å²	63.5	9%	0.091	30%	0.298	C	S	.	.	I	π-helix	trans	-89.6	-52.4	-168.8	-172.2	0	0	0	0	110.8	Y95 R101 F102 Q103 I310 Y313	Y95-V99 HydrophobicContact CD2-CB 3.82Å; Y95-V99 HydrophobicContact CD2-CG1 4.03Å; Y95-V99 HydrophobicContact CD2-CG2 4.02Å; Y95-V99 HydrophobicContact CE2-CB 3.85Å; Y95-V99 HydrophobicContact CE2-CG1 3.58Å; Y95-V99 HydrophobicContact CE2-CG2 4.42Å; Y95-V99 HydrophobicContact CG-CB 4.32Å; Y95-V99 WeakPolarHBondContact O-CA 3.33Å; Y95-V99 WeakPolarHBondContact O-CB 3.42Å; Y95-V99 PolarHBondContact O-N 3.19Å; V99-R101 VanDerWaalsContact C-N 3.32Å; V99-R101 PolarHBondContact O-N 2.94Å; V99-F102 PolarHBondContact O-N 2.84Å; V99-F102 VanDerWaalsContact O-N 3.08Å; V99-Q103 HydrophobicContact CG1-CG 4.32Å; V99-Q103 WeakPolarHBondContact O-CG 3.18Å; V99-Q103 PolarHBondContact O-N 3.43Å; V99-I310 HydrophobicContact CG1-CG2 4.27Å; V99-I310 HydrophobicContact CG2-CD1 3.96Å; V99-I310 HydrophobicContact CG2-CG2 3.43Å; V99-I310 VanDerWaalsContact CG2-CG2 3.43Å; V99-Y313 HydrophobicContact CG1-CD2 4.11Å; V99-Y313 HydrophobicContact CG1-CE2 4.19Å
100	Y	78.5	Confident	80.2	Confident	28 Å²	28	61 Å²	61	11%	0.11	29%	0.285	C	S	.	.	I	π-helix	trans	-61	-41.2	-173.5	-176.4	-117.4	0	0	0	112.5	I53 Y95 L96 F102 Q103 L104 P140	I53-Y100 HydrophobicContact CD1-CD2 3.84Å; I53-Y100 HydrophobicContact CD1-CE2 3.59Å; I53-Y100 HydrophobicContact CD1-CG 4.48Å; Y95-Y100 HydrophobicContact CE1-CD2 4.44Å; Y95-Y100 PolarHBondContact O-N 2.97Å; L96-Y100 HydrophobicContact CD2-CD1 4.08Å; L96-Y100 HydrophobicContact CD2-CG 4.15Å; Y100-F102 VanDerWaalsContact C-N 3.32Å; Y100-F102 PolarHBondContact O-N 3.33Å; Y100-Q103 PolarHBondContact O-N 3.06Å; Y100-L104 HydrophobicContact CD1-CD1 4.04Å; Y100-L104 HydrophobicContact CE1-CD1 3.61Å; Y100-L104 HydrophobicContact CE1-CG 4.35Å; Y100-L104 HydrophobicContact CE2-CD1 4.45Å; Y100-L104 HydrophobicContact CE2-CD2 4.46Å; Y100-L104 HydrophobicContact CE2-CG 4.32Å; Y100-L104 WeakPolarHBondContact O-CG 3.44Å; Y100-L104 PolarHBondContact O-N 2.83Å; Y100-P140 HydrophobicContact CE2-CB 3.61Å
101	R	76.9	Confident	79.7	Confident	180 Å²	180	58 Å²	58	68%	0.679	27%	0.271	S	S	*	.	H	α-helix	trans	-62.1	-40	176.4	-65.2	-172.1	70	153.2	2.6	112.4	S97 V99 V105	S97-R101 WeakPolarHBondContact O-CD 3.34Å; V99-R101 VanDerWaalsContact C-N 3.32Å; V99-R101 PolarHBondContact O-N 2.94Å; R101-V105 WeakPolarHBondContact O-CG2 3.46Å; R101-V105 PolarHBondContact O-N 2.63Å
102	F	75.8	Confident	79.6	Confident	89 Å²	89	62.3 Å²	62.3	39%	0.39	29%	0.291	S	S	.	.	H	α-helix	trans	-69.4	-43.3	178.6	-176.5	-95.7	0	0	0	111.3	V99 Y100 L104 V105 H106	V99-F102 PolarHBondContact O-N 2.84Å; V99-F102 VanDerWaalsContact O-N 3.08Å; Y100-F102 VanDerWaalsContact C-N 3.32Å; Y100-F102 PolarHBondContact O-N 3.33Å; F102-L104 PolarHBondContact O-N 3.03Å; F102-V105 PolarHBondContact O-N 3.28Å; F102-H106 WeakPolarHBondContact O-CB 3.45Å; F102-H106 PolarHBondContact O-N 3.45Å
103	Q	73.9	Confident	79.3	Confident	4 Å²	4	65.5 Å²	65.5	2%	0.019	31%	0.306	C	S	.	.	H	α-helix	trans	-56.6	-46.2	175.6	-73.7	173.9	-32.1	0	0	112.2	Y95 V99 Y100 V105 H106 Q107 L141 Y313	Y95-Q103 VanDerWaalsContact OH-CD 3.28Å; Y95-Q103 PolarHBondContact OH-NE2 3.41Å; Y95-Q103 PolarHBondContact OH-OE1 3.02Å; V99-Q103 HydrophobicContact CG1-CG 4.32Å; V99-Q103 WeakPolarHBondContact O-CG 3.18Å; V99-Q103 PolarHBondContact O-N 3.43Å; Y100-Q103 PolarHBondContact O-N 3.06Å; Q103-V105 VanDerWaalsContact C-N 3.33Å; Q103-V105 PolarHBondContact O-N 2.92Å; Q103-H106 PolarHBondContact O-N 2.99Å; Q103-Q107 VanDerWaalsContact O-CB 3.29Å; Q103-Q107 WeakPolarHBondContact O-CB 3.44Å; Q103-Q107 PolarHBondContact O-N 2.92Å; Q103-L141 HydrophobicContact CB-CB 4.48Å; Q103-L141 HydrophobicContact CG-CD2 4.46Å; Q103-L141 PolarHBondContact NE2-O 2.91Å; Q103-L141 VanDerWaalsContact NE2-O 3.08Å; Q103-L141 PolarHBondContact OE1-O 2.78Å; Q103-Y313 HydrophobicContact CG-CD2 3.93Å; Q103-Y313 HydrophobicContact CG-CE2 3.76Å; Q103-Y313 PolarHBondContact NE2-OH 3.32Å
104	L	76.2	Confident	78.9	Confident	70 Å²	70	59.2 Å²	59.2	37%	0.366	28%	0.277	S	S	.	.	H	α-helix	trans	-60.1	-41.7	179.2	-74.2	171.6	0	0	0	112.5	Y100 F102 R108	Y100-L104 HydrophobicContact CD1-CD1 4.04Å; Y100-L104 HydrophobicContact CE1-CD1 3.61Å; Y100-L104 HydrophobicContact CE1-CG 4.35Å; Y100-L104 HydrophobicContact CE2-CD1 4.45Å; Y100-L104 HydrophobicContact CE2-CD2 4.46Å; Y100-L104 HydrophobicContact CE2-CG 4.32Å; Y100-L104 WeakPolarHBondContact O-CG 3.44Å; Y100-L104 PolarHBondContact O-N 2.83Å; F102-L104 PolarHBondContact O-N 3.03Å; L104-R108 WeakPolarHBondContact O-CB 3.49Å; L104-R108 PolarHBondContact O-N 3.36Å; L104-R108 VanDerWaalsContact O-N 3.16Å
105	V	79	Confident	78.9	Confident	82 Å²	82	61 Å²	61	50%	0.497	28%	0.282	S	S	.	.	H	α-helix	trans	-67.2	-43.4	177	174.6	0	0	0	0	110.7	R101 F102 Q103 R108 Q109	R101-V105 WeakPolarHBondContact O-CG2 3.46Å; R101-V105 PolarHBondContact O-N 2.63Å; F102-V105 PolarHBondContact O-N 3.28Å; Q103-V105 VanDerWaalsContact C-N 3.33Å; Q103-V105 PolarHBondContact O-N 2.92Å; V105-R108 PolarHBondContact O-N 2.85Å; V105-Q109 WeakPolarHBondContact O-CG 3.41Å; V105-Q109 PolarHBondContact O-N 2.68Å; V105-Q109 VanDerWaalsContact O-N 3.13Å
106	H	78.7	Confident	78.8	Confident	42 Å²	42	63.5 Å²	63.5	19%	0.194	30%	0.303	C	S	.	.	H	α-helix	trans	-61.7	-49.6	179.1	-173.2	-109.8	0	0	0	112	F102 Q103 R108 Q109 Q110 D342	F102-H106 WeakPolarHBondContact O-CB 3.45Å; F102-H106 PolarHBondContact O-N 3.45Å; Q103-H106 PolarHBondContact O-N 2.99Å; H106-R108 VanDerWaalsContact C-N 3.3Å; H106-R108 PolarHBondContact O-N 3.24Å; H106-Q109 WeakPolarHBondContact O-CB 3.48Å; H106-Q109 PolarHBondContact O-N 3.41Å; H106-Q110 PolarHBondContact CE1-NE2 2.88Å; H106-Q110 WeakPolarHBondContact O-CG 3.26Å; H106-Q110 PolarHBondContact O-N 2.82Å; H106-D342 IonicContact CE1-OD1 3.36Å; H106-D342 PolarHBondContact CE1-OD1 3.2Å; H106-D342 IonicContact ND1-OD1 2.8Å; H106-D342 PolarHBondContact ND1-OD1 3.43Å
107	Q	76.3	Confident	78.5	Confident	3 Å²	3	63.2 Å²	63.2	1%	0.014	30%	0.302	C	S	.	.	H	α-helix	trans	-60.3	-40.4	179.8	-174.2	177.2	48.8	0	0	112.1	Q103 Q109 Q110 L111 P138 L139 W208	Q103-Q107 VanDerWaalsContact O-CB 3.29Å; Q103-Q107 WeakPolarHBondContact O-CB 3.44Å; Q103-Q107 PolarHBondContact O-N 2.92Å; Q107-Q109 VanDerWaalsContact C-N 3.35Å; Q107-Q109 PolarHBondContact O-N 3.49Å; Q107-Q110 PolarHBondContact O-N 2.91Å; Q107-L111 PolarHBondContact O-N 2.9Å; Q107-P138 VanDerWaalsContact CD-CB 3.45Å; Q107-P138 HydrophobicContact CG-CB 3.75Å; Q107-P138 VanDerWaalsContact OE1-CB 3.31Å; Q107-L139 VanDerWaalsContact CD-O 3.31Å; Q107-L139 PolarHBondContact NE2-O 3.42Å; Q107-L139 PolarHBondContact OE1-O 2.58Å; Q107-L139 VanDerWaalsContact OE1-O 3.09Å; Q107-W208 HydrophobicContact CG-CH2 3.88Å; Q107-W208 HydrophobicContact CG-CZ2 3.76Å
108	R	79.1	Confident	78.4	Confident	166 Å²	166	63 Å²	63	63%	0.626	29%	0.292	S	S	*	.	H	α-helix	trans	-61.4	-42.5	174	-176.8	176.3	174.6	159.3	4.4	112.1	L104 V105 H106 Q110 L111 E112	L104-R108 WeakPolarHBondContact O-CB 3.49Å; L104-R108 PolarHBondContact O-N 3.36Å; L104-R108 VanDerWaalsContact O-N 3.16Å; V105-R108 PolarHBondContact O-N 2.85Å; H106-R108 VanDerWaalsContact C-N 3.3Å; H106-R108 PolarHBondContact O-N 3.24Å; R108-Q110 VanDerWaalsContact C-N 3.33Å; R108-Q110 PolarHBondContact O-N 3.16Å; R108-L111 PolarHBondContact O-N 2.79Å; R108-E112 IonicContact NE-OE1 3.89Å; R108-E112 PolarHBondContact NE-OE1 3.2Å; R108-E112 WeakPolarHBondContact O-CG 3.43Å; R108-E112 PolarHBondContact O-N 3.03Å
109	Q	83	Confident	78.5	Confident	74 Å²	74	60.6 Å²	60.6	35%	0.346	29%	0.289	S	S	.	.	H	α-helix	trans	-62.3	-40.8	176.4	-70.5	172.7	1.2	0	0	111.6	V105 H106 Q107 E112 Q113	V105-Q109 WeakPolarHBondContact O-CG 3.41Å; V105-Q109 PolarHBondContact O-N 2.68Å; V105-Q109 VanDerWaalsContact O-N 3.13Å; H106-Q109 WeakPolarHBondContact O-CB 3.48Å; H106-Q109 PolarHBondContact O-N 3.41Å; Q107-Q109 VanDerWaalsContact C-N 3.35Å; Q107-Q109 PolarHBondContact O-N 3.49Å; Q109-E112 PolarHBondContact O-N 3.01Å; Q109-Q113 WeakPolarHBondContact O-CG 3.3Å; Q109-Q113 PolarHBondContact O-N 2.94Å
110	Q	79.8	Confident	78.5	Confident	6 Å²	6	63.3 Å²	63.3	3%	0.028	31%	0.313	C	S	.	.	H	α-helix	trans	-65.4	-42.3	177.3	-67.1	174.1	-43.8	0	0	112.1	H106 Q107 R108 E112 Q113 L114 P340 I341 D342	H106-Q110 PolarHBondContact CE1-NE2 2.88Å; H106-Q110 WeakPolarHBondContact O-CG 3.26Å; H106-Q110 PolarHBondContact O-N 2.82Å; Q107-Q110 PolarHBondContact O-N 2.91Å; R108-Q110 VanDerWaalsContact C-N 3.33Å; R108-Q110 PolarHBondContact O-N 3.16Å; Q110-E112 VanDerWaalsContact C-N 3.3Å; Q110-E112 PolarHBondContact O-N 2.92Å; Q110-Q113 WeakPolarHBondContact O-CB 3.32Å; Q110-Q113 PolarHBondContact O-N 2.8Å; Q110-Q113 VanDerWaalsContact O-N 3.15Å; Q110-L114 WeakPolarHBondContact O-CG 3.17Å; Q110-L114 PolarHBondContact O-N 3.49Å; Q110-P340 HydrophobicContact CB-CB 3.79Å; Q110-P340 HydrophobicContact CB-CG 4.27Å; Q110-P340 HydrophobicContact CG-CB 3.77Å; Q110-I341 PolarHBondContact NE2-O 2.85Å; Q110-D342 VanDerWaalsContact NE2-CG 3.25Å; Q110-D342 PolarHBondContact NE2-OD1 2.94Å; Q110-D342 PolarHBondContact NE2-OD2 2.85Å; Q110-D342 PolarHBondContact OE1-OD1 3.19Å; Q110-D342 PolarHBondContact OE1-OD2 2.89Å
111	L	78.4	Confident	78.1	Confident	16 Å²	16	67.9 Å²	67.9	8%	0.084	34%	0.344	C	S	.	.	H	α-helix	trans	-63.6	-37.6	175.9	-167.3	68.6	0	0	0	111.8	Q107 R108 L114 R115 F135 P138	Q107-L111 PolarHBondContact O-N 2.9Å; R108-L111 PolarHBondContact O-N 2.79Å; L111-L114 HydrophobicContact CD1-CD1 4.2Å; L111-L114 PolarHBondContact O-N 3.04Å; L111-R115 PolarHBondContact O-N 3.46Å; L111-F135 HydrophobicContact CD1-CD1 3.88Å; L111-F135 HydrophobicContact CG-CD1 4.18Å; L111-P138 HydrophobicContact CD2-CG 4.42Å
112	E	81.7	Confident	77.6	Confident	91 Å²	91	63.8 Å²	63.8	43%	0.425	33%	0.331	S	S	.	.	H	α-helix	trans	-64.5	-40.4	172.7	-73.9	171.9	-171.4	0	0	111.7	R108 Q109 Q110 R115 A116	R108-E112 IonicContact NE-OE1 3.89Å; R108-E112 PolarHBondContact NE-OE1 3.2Å; R108-E112 WeakPolarHBondContact O-CG 3.43Å; R108-E112 PolarHBondContact O-N 3.03Å; Q109-E112 PolarHBondContact O-N 3.01Å; Q110-E112 VanDerWaalsContact C-N 3.3Å; Q110-E112 PolarHBondContact O-N 2.92Å; E112-R115 PolarHBondContact O-N 3.23Å; E112-A116 PolarHBondContact O-N 3.41Å
113	Q	82.2	Confident	76.9	Confident	93 Å²	93	64.6 Å²	64.6	44%	0.435	34%	0.34	S	S	.	.	H	α-helix	trans	-62.6	-45.5	173	-71.1	173.5	16.5	0	0	111.7	Q109 Q110 R115 A116 V117 P340	Q109-Q113 WeakPolarHBondContact O-CG 3.3Å; Q109-Q113 PolarHBondContact O-N 2.94Å; Q110-Q113 WeakPolarHBondContact O-CB 3.32Å; Q110-Q113 PolarHBondContact O-N 2.8Å; Q110-Q113 VanDerWaalsContact O-N 3.15Å; Q113-R115 VanDerWaalsContact C-N 3.29Å; Q113-R115 PolarHBondContact O-N 2.88Å; Q113-A116 WeakPolarHBondContact O-CB 3.1Å; Q113-A116 PolarHBondContact O-N 3.37Å; Q113-A116 VanDerWaalsContact O-N 3.11Å; Q113-V117 WeakPolarHBondContact O-CG2 3.3Å; Q113-V117 PolarHBondContact O-N 3.45Å; Q113-P340 HydrophobicContact CB-CG 3.93Å
114	L	79.8	Confident	76.2	Confident	5 Å²	5	70.5 Å²	70.5	3%	0.026	38%	0.378	C	S	.	.	H	α-helix	trans	-57.4	-42.7	174.7	-73.2	174.2	0	0	0	112	Q110 L111 A116 V117 K118 W208 L210 L339 P340	Q110-L114 WeakPolarHBondContact O-CG 3.17Å; Q110-L114 PolarHBondContact O-N 3.49Å; L111-L114 HydrophobicContact CD1-CD1 4.2Å; L111-L114 PolarHBondContact O-N 3.04Å; L114-A116 VanDerWaalsContact C-N 3.3Å; L114-A116 PolarHBondContact O-N 3.02Å; L114-V117 PolarHBondContact O-N 3.44Å; L114-K118 WeakPolarHBondContact O-CB 3.17Å; L114-K118 PolarHBondContact O-N 2.98Å; L114-W208 HydrophobicContact CD1-CB 3.57Å; L114-W208 HydrophobicContact CD1-CD2 4.49Å; L114-W208 HydrophobicContact CD1-CE3 4.21Å; L114-W208 HydrophobicContact CD1-CG 4.29Å; L114-W208 HydrophobicContact CD2-CB 4.03Å; L114-W208 WeakPolarHBondContact CD2-O 3.36Å; L114-W208 HydrophobicContact CG-CB 4.09Å; L114-L210 HydrophobicContact CB-CD1 4.4Å; L114-L210 HydrophobicContact CD1-CD2 4.35Å; L114-L210 HydrophobicContact CD1-CG 4.33Å; L114-L339 HydrophobicContact CD2-CD2 3.87Å; L114-P340 HydrophobicContact CD2-CG 4.17Å; L114-P340 HydrophobicContact CG-CG 4.14Å
115	R	81.2	Confident	75.4	Confident	86 Å²	86	75 Å²	75	33%	0.325	40%	0.397	S	S	.	.	H	α-helix	trans	-61.9	-40.1	176.9	-169.6	179.2	-65.8	128.6	-2.4	111.7	L111 E112 Q113 S119 D132 F135	L111-R115 PolarHBondContact O-N 3.46Å; E112-R115 PolarHBondContact O-N 3.23Å; Q113-R115 VanDerWaalsContact C-N 3.29Å; Q113-R115 PolarHBondContact O-N 2.88Å; R115-S119 WeakPolarHBondContact O-CB 3.17Å; R115-S119 PolarHBondContact O-N 3.24Å; R115-S119 PolarHBondContact O-OG 3.43Å; R115-D132 IonicContact NE-OD1 3.67Å; R115-F135 HydrophobicContact CB-CD1 4.39Å; R115-F135 HydrophobicContact CB-CE1 3.58Å; R115-F135 HydrophobicContact CB-CE2 4.34Å; R115-F135 HydrophobicContact CB-CZ 3.6Å; R115-F135 HydrophobicContact CG-CE1 4.04Å; R115-F135 HydrophobicContact CG-CE2 3.87Å; R115-F135 HydrophobicContact CG-CZ 3.58Å
116	A	81.6	Confident	74.5	Confident	53 Å²	53	75.5 Å²	75.5	44%	0.438	40%	0.397	S	S	.	.	H	α-helix	trans	-67.2	-41	175.7	0	0	0	0	0	112.7	E112 Q113 L114 S119 A120	E112-A116 PolarHBondContact O-N 3.41Å; Q113-A116 WeakPolarHBondContact O-CB 3.1Å; Q113-A116 PolarHBondContact O-N 3.37Å; Q113-A116 VanDerWaalsContact O-N 3.11Å; L114-A116 VanDerWaalsContact C-N 3.3Å; L114-A116 PolarHBondContact O-N 3.02Å; A116-S119 PolarHBondContact O-N 3.43Å; A116-S119 PolarHBondContact O-OG 2.79Å; A116-A120 WeakPolarHBondContact O-CB 3.26Å; A116-A120 PolarHBondContact O-N 3.41Å
117	V	78.3	Confident	73.4	Confident	29 Å²	29	82.7 Å²	82.7	18%	0.176	43%	0.431	C	S	.	.	H	α-helix	trans	-62.7	-46.2	175.5	175.8	0	0	0	0	110.2	Q113 L114 S119 A120 V121 Q337	Q113-V117 WeakPolarHBondContact O-CG2 3.3Å; Q113-V117 PolarHBondContact O-N 3.45Å; L114-V117 PolarHBondContact O-N 3.44Å; V117-S119 PolarHBondContact O-N 3.5Å; V117-A120 PolarHBondContact O-N 3.29Å; V117-V121 WeakPolarHBondContact O-CG2 3.44Å; V117-V121 PolarHBondContact O-N 3.03Å; V117-Q337 HydrophobicContact CG1-CB 4.42Å; V117-Q337 HydrophobicContact CG2-CB 3.86Å
118	K	76.3	Confident	72.3	Confident	67 Å²	67	89.5 Å²	89.5	29%	0.291	47%	0.467	S	S	.	.	H	α-helix	trans	-64.1	-38.2	178.7	-169.5	165	-170.2	157.9	0	112.2	L114 K122 F135 L210 E211	L114-K118 WeakPolarHBondContact O-CB 3.17Å; L114-K118 PolarHBondContact O-N 2.98Å; K118-K122 WeakPolarHBondContact O-CG 3.35Å; K118-K122 PolarHBondContact O-N 3.29Å; K118-F135 HydrophobicContact CD-CZ 4.34Å; K118-L210 HydrophobicContact CD-CD1 4.11Å; K118-E211 WeakPolarHBondContact CE-OE1 3.32Å; K118-E211 IonicContact NZ-OE1 3.08Å; K118-E211 PolarHBondContact NZ-OE1 2.93Å
119	S	76.6	Confident	70.9	Confident	74 Å²	74	84 Å²	84	52%	0.517	46%	0.457	S	S	.	.	H	α-helix	trans	-73.2	-29.8	178.2	68.6	0	0	0	0	113.3	R115 A116 V117 V121 K122	R115-S119 WeakPolarHBondContact O-CB 3.17Å; R115-S119 PolarHBondContact O-N 3.24Å; R115-S119 PolarHBondContact O-OG 3.43Å; A116-S119 PolarHBondContact O-N 3.43Å; A116-S119 PolarHBondContact O-OG 2.79Å; V117-S119 PolarHBondContact O-N 3.5Å; S119-V121 VanDerWaalsContact C-N 3.31Å; S119-V121 PolarHBondContact O-N 3.45Å; S119-K122 PolarHBondContact O-N 3.41Å
120	A	75.2	Confident	69.5	Low	72 Å²	72	87.8 Å²	87.8	60%	0.595	48%	0.475	S	S	*	.	H	α-helix	trans	-70.2	-25.6	176.4	0	0	0	0	0	113.6	A116 V117	A116-A120 WeakPolarHBondContact O-CB 3.26Å; A116-A120 PolarHBondContact O-N 3.41Å; V117-A120 PolarHBondContact O-N 3.29Å
121	V	70.1	Confident	68.2	Low	124 Å²	124	90.8 Å²	90.8	75%	0.752	50%	0.496	S	S	*	.	H	α-helix	trans	-87.9	-20.5	178.8	-179.8	0	0	0	0	112.2	V117 S119	V117-V121 WeakPolarHBondContact O-CG2 3.44Å; V117-V121 PolarHBondContact O-N 3.03Å; S119-V121 VanDerWaalsContact C-N 3.31Å; S119-V121 PolarHBondContact O-N 3.45Å
122	K	65.5	Low	67	Low	94 Å²	94	95.8 Å²	95.8	41%	0.409	52%	0.523	S	S	.	.	S	Bend	trans	-69.3	131	178.9	-78.9	-178.8	176.7	-172.1	0	111.3	K118 S119 A129	K118-K122 WeakPolarHBondContact O-CG 3.35Å; K118-K122 PolarHBondContact O-N 3.29Å; S119-K122 PolarHBondContact O-N 3.41Å; K122-A129 HydrophobicContact CD-CB 4.48Å
123	D	61.1	Low	65.7	Low	106 Å²	106	100.1 Å²	100.1	57%	0.567	54%	0.541	S	S	*	.			trans	-64.8	127	172.8	-169.3	-32.5	0	0	0	109.2	H125 D126	D123-H125 PolarHBondContact O-N 3.41Å; D123-H125 IonicContact OD1-CD2 3.89Å; D123-H125 PolarHBondContact OD1-N 2.96Å; D123-H125 VanDerWaalsContact OD1-N 3.11Å; D123-D126 PolarHBondContact O-N 3.48Å; D123-D126 VanDerWaalsContact O-N 3.11Å
124	P	60.9	Low	64.4	Low	127 Å²	127	100.9 Å²	100.9	83%	0.825	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-8.2	179.8	21.6	-32.8	0	0	0	114.9
125	H	58.9	Low	63.5	Low	164 Å²	164	102.5 Å²	102.5	76%	0.759	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	1.5	176.2	-75	-65.2	0	0	0	115.8	D123 E127	D123-H125 PolarHBondContact O-N 3.41Å; D123-H125 IonicContact OD1-CD2 3.89Å; D123-H125 PolarHBondContact OD1-N 2.96Å; D123-H125 VanDerWaalsContact OD1-N 3.11Å; H125-E127 PolarHBondContact O-N 3.46Å; H125-E127 VanDerWaalsContact O-N 3.17Å
126	D	59.6	Low	62.6	Low	94 Å²	94	100.6 Å²	100.6	50%	0.503	55%	0.553	S	S	.	*			trans	-85	86.7	176.5	-165.4	4.2	0	0	0	112	D123 N128 A129	D123-D126 PolarHBondContact O-N 3.48Å; D123-D126 VanDerWaalsContact O-N 3.11Å; D126-N128 PolarHBondContact O-N 3.26Å; D126-N128 PolarHBondContact OD1-N 3.42Å; D126-A129 PolarHBondContact O-N 2.91Å
127	E	54.9	Low	61.7	Low	193 Å²	193	106 Å²	106	90%	0.902	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-3.4	177.1	-64.8	-170.6	169.1	0	0	113.8	H125	H125-E127 PolarHBondContact O-N 3.46Å; H125-E127 VanDerWaalsContact O-N 3.17Å
128	N	54	Low	60.9	Low	145 Å²	145	106.6 Å²	106.6	78%	0.775	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.3	12.3	177.7	-84.1	-26.8	0	0	0	113.8	D126 E130	D126-N128 PolarHBondContact O-N 3.26Å; D126-N128 PolarHBondContact OD1-N 3.42Å; N128-E130 PolarHBondContact O-N 2.95Å
129	A	50.7	Low	60.5	Low	51 Å²	51	107.2 Å²	107.2	42%	0.421	58%	0.58	S	S	.	*			trans	-57.4	104.3	-179.4	0	0	0	0	0	111.7	K122 D126 S131	K122-A129 HydrophobicContact CD-CB 4.48Å; D126-A129 PolarHBondContact O-N 2.91Å; A129-S131 PolarHBondContact O-N 2.97Å
130	E	51.6	Low	60	Low	154 Å²	154	103.9 Å²	103.9	72%	0.72	56%	0.557	S	S	*	*			trans	-47.8	130.4	174.9	-86.2	169.4	149.9	0	0	110.6	N128	N128-E130 PolarHBondContact O-N 2.95Å
131	S	52.6	Low	60	Low	69 Å²	69	100.6 Å²	100.6	48%	0.483	53%	0.529	S	S	.	.			trans	-51.5	158	-172.5	59.1	0	0	0	0	113.2	A129 K133	A129-S131 PolarHBondContact O-N 2.97Å; S131-K133 PolarHBondContact O-N 3.34Å; S131-K133 WeakPolarHBondContact OG-CG 3.44Å
132	D	54.3	Low	60.4	Low	121 Å²	121	95.1 Å²	95.1	65%	0.647	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-44.2	-2.7	170.9	-80.2	-42.7	0	0	0	117.1	R115 D134	R115-D132 IonicContact NE-OD1 3.67Å; D132-D134 VanDerWaalsContact C-N 3.32Å; D132-D134 PolarHBondContact O-N 2.74Å
133	K	53.4	Low	61.2	Low	182 Å²	182	90.9 Å²	90.9	79%	0.791	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-69.8	-18.2	178.9	-64.7	-172.4	178.6	-175.6	0	115.1	S131	S131-K133 PolarHBondContact O-N 3.34Å; S131-K133 WeakPolarHBondContact OG-CG 3.44Å
134	D	56.8	Low	62.5	Low	109 Å²	109	86.2 Å²	86.2	58%	0.583	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-88.1	1.5	-179.6	-73.3	-26.3	0	0	0	114.2	D132 P136	D132-D134 VanDerWaalsContact C-N 3.32Å; D132-D134 PolarHBondContact O-N 2.74Å; D134-P136 VanDerWaalsContact O-CD 3.28Å; D134-P136 WeakPolarHBondContact O-CD 3.45Å
135	F	60.3	Low	63.7	Low	38 Å²	38	80.5 Å²	80.5	17%	0.167	42%	0.416	C	S	.	.	S	Bend	trans	-78.6	115	171.7	-81.6	-96.3	0	0	0	109.2	L111 R115 K118 E137 L210	L111-F135 HydrophobicContact CD1-CD1 3.88Å; L111-F135 HydrophobicContact CG-CD1 4.18Å; R115-F135 HydrophobicContact CB-CD1 4.39Å; R115-F135 HydrophobicContact CB-CE1 3.58Å; R115-F135 HydrophobicContact CB-CE2 4.34Å; R115-F135 HydrophobicContact CB-CZ 3.6Å; R115-F135 HydrophobicContact CG-CE1 4.04Å; R115-F135 HydrophobicContact CG-CE2 3.87Å; R115-F135 HydrophobicContact CG-CZ 3.58Å; K118-F135 HydrophobicContact CD-CZ 4.34Å; F135-E137 PolarHBondContact O-N 3Å; F135-L210 HydrophobicContact CD1-CD1 3.95Å; F135-L210 HydrophobicContact CE1-CD1 3.31Å; F135-L210 HydrophobicContact CZ-CD1 3.67Å
136	P	61.4	Low	65.1	Low	46 Å²	46	74.8 Å²	74.8	30%	0.299	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-60.1	138	178.3	24.6	-31.9	0	0	0	109.4	D134 L210 V366	D134-P136 VanDerWaalsContact O-CD 3.28Å; D134-P136 WeakPolarHBondContact O-CD 3.45Å; P136-L210 HydrophobicContact CG-CD2 4.26Å; P136-V366 HydrophobicContact CG-CG2 4.35Å
137	E	63.5	Low	66.5	Low	167 Å²	167	74.2 Å²	74.2	78%	0.78	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-62.6	131.7	173.4	-167.1	169.6	-167.6	0	0	108.6	F135 L139	F135-E137 PolarHBondContact O-N 3Å; E137-L139 PolarHBondContact O-N 3.39Å
138	P	60.7	Low	68.4	Low	42 Å²	42	67.2 Å²	67.2	27%	0.273	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-61.5	122.2	-177.9	20.2	-28.9	0	0	0	110.5	Q107 L111	Q107-P138 VanDerWaalsContact CD-CB 3.45Å; Q107-P138 HydrophobicContact CG-CB 3.75Å; Q107-P138 VanDerWaalsContact OE1-CB 3.31Å; L111-P138 HydrophobicContact CD2-CG 4.42Å
139	L	67.7	Low	70.3	Confident	79 Å²	79	63 Å²	63	41%	0.414	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-80.7	144.5	172.2	-64.2	174.6	0	0	0	109	Q107 E137 L141 Y363 P364	Q107-L139 VanDerWaalsContact CD-O 3.31Å; Q107-L139 PolarHBondContact NE2-O 3.42Å; Q107-L139 PolarHBondContact OE1-O 2.58Å; Q107-L139 VanDerWaalsContact OE1-O 3.09Å; E137-L139 PolarHBondContact O-N 3.39Å; L139-L141 PolarHBondContact O-N 3.29Å; L139-Y363 VanDerWaalsContact CD1-O 3.3Å; L139-Y363 WeakPolarHBondContact CD1-O 3.13Å; L139-P364 WeakPolarHBondContact CB-O 3.24Å; L139-P364 PolarHBondContact N-O 3.32Å
140	P	67.4	Low	72.4	Confident	5 Å²	5	68.9 Å²	68.9	3%	0.032	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-52.9	132.7	178.3	24.1	-35.1	0	0	0	111.2	K49 Y100 I142	K49-P140 HydrophobicContact CB-CG 4.38Å; K49-P140 HydrophobicContact CD-CG 3.92Å; K49-P140 HydrophobicContact CG-CG 3.93Å; Y100-P140 HydrophobicContact CE2-CB 3.61Å; P140-I142 VanDerWaalsContact C-N 3.27Å; P140-I142 HydrophobicContact CG-CG1 4.45Å; P140-I142 PolarHBondContact O-N 2.77Å
141	L	75.3	Confident	74.5	Confident	3 Å²	3	64.4 Å²	64.4	2%	0.016	33%	0.325	C	S	.	.			trans	-74.8	82.7	176	-169.6	65.6	0	0	0	109.5	Y95 Q103 L139 Y313 L344 P364	Y95-L141 PolarHBondContact OH-O 3Å; Q103-L141 HydrophobicContact CB-CB 4.48Å; Q103-L141 HydrophobicContact CG-CD2 4.46Å; Q103-L141 PolarHBondContact NE2-O 2.91Å; Q103-L141 VanDerWaalsContact NE2-O 3.08Å; Q103-L141 PolarHBondContact OE1-O 2.78Å; L139-L141 PolarHBondContact O-N 3.29Å; L141-Y313 HydrophobicContact CD2-CE1 3.53Å; L141-Y313 WeakPolarHBondContact CD2-OH 3.2Å; L141-L344 HydrophobicContact CD1-CD2 3.76Å; L141-L344 HydrophobicContact CD2-CD2 4.35Å; L141-L344 HydrophobicContact CG-CD2 4.41Å; L141-P364 HydrophobicContact CD1-CB 3.51Å; L141-P364 HydrophobicContact CD1-CG 3.85Å
142	I	78.2	Confident	76.6	Confident	8 Å²	8	62.4 Å²	62.4	4%	0.041	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-68.1	131.5	177.6	-57.1	-161.1	0	0	0	108.9	E52 I53 A56 P140 H361	E52-I142 HydrophobicContact CB-CD1 3.61Å; I53-I142 HydrophobicContact CG1-CD1 4.14Å; I53-I142 HydrophobicContact CG1-CG1 4.05Å; A56-I142 HydrophobicContact CB-CG2 3.56Å; P140-I142 VanDerWaalsContact C-N 3.27Å; P140-I142 HydrophobicContact CG-CG1 4.45Å; P140-I142 PolarHBondContact O-N 2.77Å; I142-H361 PolarHBondContact O-CD2 2.88Å; I142-H361 PolarHBondContact O-NE2 3.14Å
143	P	81.5	Confident	78.7	Confident	6 Å²	6	60.4 Å²	60.4	4%	0.039	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-55.8	146	179.2	-27.6	38.7	0	0	0	112.3	L57 Y95 T145	L57-P143 HydrophobicContact CD2-CB 4.38Å; L57-P143 HydrophobicContact CD2-CG 3.84Å; Y95-P143 HydrophobicContact CD2-CG 4.45Å; Y95-P143 HydrophobicContact CE1-CG 4.42Å; Y95-P143 HydrophobicContact CE2-CG 3.41Å; Y95-P143 VanDerWaalsContact CE2-CG 3.41Å; Y95-P143 VanDerWaalsContact CZ-CG 3.4Å; Y95-P143 WeakPolarHBondContact OH-CD 3.32Å; Y95-P143 WeakPolarHBondContact OH-CG 3.29Å; P143-T145 PolarHBondContact O-N 3.05Å
144	A	87.9	Confident	80.8	Confident	7 Å²	7	56.5 Å²	56.5	6%	0.058	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-67.8	132.3	174.9	0	0	0	0	0	110.4	W191 I345 H361	A144-W191 HydrophobicContact CB-CH2 4.04Å; A144-I345 HydrophobicContact CB-CD1 3.77Å; A144-I345 HydrophobicContact CB-CG1 3.79Å; A144-H361 HydrophobicContact CB-CB 4.19Å
145	T	87.1	Confident	82.7	Confident	7 Å²	7	51.3 Å²	51.3	4%	0.043	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	132	174.7	-51.9	0	0	0	0	109.3	Q59 P143 W147 G359 T360	Q59-T145 HydrophobicContact CB-CG2 3.61Å; Q59-T145 VanDerWaalsContact CD-CG2 3.47Å; Q59-T145 HydrophobicContact CG-CG2 3.39Å; P143-T145 PolarHBondContact O-N 3.05Å; T145-W147 HydrophobicContact CG2-CE3 3.87Å; T145-W147 HydrophobicContact CG2-CZ3 3.85Å; T145-G359 CarbonylContact O-C 3.54Å; T145-G359 WeakPolarHBondContact O-CA 3.35Å; T145-T360 PolarHBondContact N-O 3.43Å; T145-T360 PolarHBondContact O-N 2.95Å
146	V	89.1	Confident	84.5	Confident	45 Å²	45	51 Å²	51	27%	0.273	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	138.8	-178.9	-177.1	0	0	0	0	109.6	W191 I345 C358	V146-W191 HydrophobicContact CG2-CZ2 4.25Å; V146-I345 HydrophobicContact CG2-CD1 3.79Å; V146-C358 WeakPolarHBondContact CA-O 3.28Å
147	W	89.2	Confident	86.3	Confident	81 Å²	81	55.8 Å²	55.8	31%	0.307	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	174.1	175.3	61.9	95	0	0	0	110.8	T145 C358 T360	T145-W147 HydrophobicContact CG2-CE3 3.87Å; T145-W147 HydrophobicContact CG2-CZ3 3.85Å; W147-C358 HydrophobicContact CD2-CB 4Å; W147-C358 VanDerWaalsContact CE2-CB 3.45Å; W147-C358 HydrophobicContact CG-CB 4.13Å; W147-C358 HydrophobicContact CZ2-CB 3.91Å; W147-C358 PolarHBondContact N-O 3.3Å; W147-C358 PolarHBondContact O-N 3.4Å; W147-C358 VanDerWaalsContact O-O 3.09Å; W147-T360 HydrophobicContact CH2-CG2 3.97Å; W147-T360 HydrophobicContact CZ3-CG2 3.93Å
148	T	93.2	Very high	87.8	Confident	47 Å²	47	51.4 Å²	51.4	29%	0.288	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	159.3	176.5	65.7	0	0	0	0	112.9	E355 V356 Y357	T148-E355 WeakPolarHBondContact CB-OE2 3.25Å; T148-E355 HydrophobicContact CG2-CB 4.47Å; T148-E355 PolarHBondContact OG1-OE2 2.88Å; T148-V356 CarbonylContact C-O 3.54Å; T148-V356 WeakPolarHBondContact CA-O 3.24Å; T148-Y357 HydrophobicContact CG2-CD1 4.16Å; T148-Y357 HydrophobicContact CG2-CD2 4.13Å; T148-Y357 HydrophobicContact CG2-CE1 4.04Å; T148-Y357 HydrophobicContact CG2-CE2 4.01Å; T148-Y357 HydrophobicContact CG2-CG 4.21Å
149	R	94.4	Very high	89.6	Confident	56 Å²	56	49.5 Å²	49.5	21%	0.211	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	142.8	172.9	-59.3	-173.4	-66	106.5	-5.2	111.3	N151 E192 V356 C358	R149-N151 WeakPolarHBondContact CB-OD1 3.35Å; R149-N151 PolarHBondContact NH1-ND2 3.33Å; R149-N151 VanDerWaalsContact NH1-ND2 3.13Å; R149-N151 PolarHBondContact NH1-OD1 2.78Å; R149-E192 IonicContact CZ-OE1 2.69Å; R149-E192 VanDerWaalsContact CZ-OE1 3.28Å; R149-E192 IonicContact NE-OE1 2.75Å; R149-E192 PolarHBondContact NE-OE1 3.11Å; R149-E192 IonicContact NH2-OE1 2.97Å; R149-E192 PolarHBondContact NH2-OE1 2.87Å; R149-V356 HydrophobicContact CB-CB 4.32Å; R149-V356 PolarHBondContact N-O 3.18Å; R149-V356 PolarHBondContact O-N 2.9Å; R149-C358 PolarHBondContact NE-SG 3.35Å; R149-C358 VanDerWaalsContact NE-SG 3.38Å
150	K	95.3	Very high	91	Very high	174 Å²	174	49.3 Å²	49.3	76%	0.757	24%	0.242	S	C	*	.	S	Bend	trans	-82.8	-16.3	-173.4	-64	-173.9	177.2	-175.5	0	115.3	I152 E355	K150-I152 PolarHBondContact O-N 2.84Å; K150-E355 WeakPolarHBondContact CE-OE1 3.22Å; K150-E355 WeakPolarHBondContact CG-OE1 3.15Å
151	N	95.4	Very high	92.3	Very high	60 Å²	60	55 Å²	55	32%	0.321	27%	0.272	S	S	.	.			trans	-82.7	52.9	-176.3	58.7	-36.5	0	0	0	112.9	R149 A153 E154 F155	R149-N151 WeakPolarHBondContact CB-OD1 3.35Å; R149-N151 PolarHBondContact NH1-ND2 3.33Å; R149-N151 VanDerWaalsContact NH1-ND2 3.13Å; R149-N151 PolarHBondContact NH1-OD1 2.78Å; N151-A153 PolarHBondContact O-N 2.92Å; N151-E154 HydrophobicContact CB-CB 4.3Å; N151-E154 PolarHBondContact ND2-OE2 3.03Å; N151-E154 PolarHBondContact O-N 2.9Å; N151-F155 PolarHBondContact O-N 2.88Å; N151-F155 VanDerWaalsContact O-N 3.13Å
152	I	97.3	Very high	93.2	Very high	28 Å²	28	59.8 Å²	59.8	14%	0.144	30%	0.301	C	S	.	.	H	α-helix	trans	-61.1	-40.5	-178	-171.4	173.2	0	0	0	113.4	K150 E154 F155 K156 A194 H353 V356	K150-I152 PolarHBondContact O-N 2.84Å; I152-E154 PolarHBondContact O-N 2.79Å; I152-F155 PolarHBondContact O-N 2.83Å; I152-K156 HydrophobicContact CG1-CD 4.28Å; I152-K156 HydrophobicContact CG1-CG 4.46Å; I152-K156 WeakPolarHBondContact O-CG 3.09Å; I152-K156 PolarHBondContact O-N 2.83Å; I152-A194 HydrophobicContact CD1-CB 4.04Å; I152-A194 HydrophobicContact CG1-CB 3.93Å; I152-H353 VanDerWaalsContact CD1-O 3.26Å; I152-H353 WeakPolarHBondContact CD1-O 3.41Å; I152-V356 HydrophobicContact CB-CG2 4.09Å; I152-V356 HydrophobicContact CG1-CG2 4.31Å
153	A	97.4	Very high	93.8	Very high	78 Å²	78	62.3 Å²	62.3	65%	0.645	31%	0.313	S	S	*	.	H	α-helix	trans	-66	-38.3	-179.3	0	0	0	0	0	112.4	N151 R157	N151-A153 PolarHBondContact O-N 2.92Å; A153-R157 WeakPolarHBondContact O-CB 3.3Å; A153-R157 PolarHBondContact O-N 3.11Å
154	E	97.5	Very high	94.4	Very high	100 Å²	100	69.3 Å²	69.3	47%	0.467	34%	0.343	S	S	.	.	H	α-helix	trans	-67.3	-46.5	176.3	-179.5	178.7	-149.4	0	0	111.1	N151 I152 K156 R157 E158	N151-E154 HydrophobicContact CB-CB 4.3Å; N151-E154 PolarHBondContact ND2-OE2 3.03Å; N151-E154 PolarHBondContact O-N 2.9Å; I152-E154 PolarHBondContact O-N 2.79Å; E154-K156 PolarHBondContact O-N 3.4Å; E154-R157 PolarHBondContact O-N 3.45Å; E154-E158 PolarHBondContact O-N 3.08Å
155	F	97.8	Very high	94.6	Very high	1 Å²	1	75.5 Å²	75.5	0%	0.004	37%	0.371	C	S	.	.	H	α-helix	trans	-57.3	-50.2	177.1	171.6	-107.3	0	0	0	112	N151 I152 R157 E158 I159 E192 A194 V356 R388	N151-F155 PolarHBondContact O-N 2.88Å; N151-F155 VanDerWaalsContact O-N 3.13Å; I152-F155 PolarHBondContact O-N 2.83Å; F155-R157 VanDerWaalsContact C-N 3.31Å; F155-R157 PolarHBondContact O-N 2.89Å; F155-E158 PolarHBondContact O-N 2.85Å; F155-I159 HydrophobicContact CD2-CG1 4.29Å; F155-I159 HydrophobicContact CE1-CG1 4.25Å; F155-I159 HydrophobicContact CE2-CD1 3.93Å; F155-I159 HydrophobicContact CE2-CG1 3.87Å; F155-I159 HydrophobicContact CZ-CD1 4.16Å; F155-I159 HydrophobicContact CZ-CG1 3.86Å; F155-I159 WeakPolarHBondContact O-CG1 3.44Å; F155-I159 PolarHBondContact O-N 2.81Å; F155-E192 HydrophobicContact CE2-CB 3.76Å; F155-E192 HydrophobicContact CZ-CB 3.98Å; F155-A194 HydrophobicContact CD1-CB 3.77Å; F155-A194 HydrophobicContact CE1-CB 3.75Å; F155-V356 HydrophobicContact CB-CG2 3.69Å; F155-V356 HydrophobicContact CD1-CG1 3.89Å; F155-V356 HydrophobicContact CD1-CG2 3.85Å; F155-V356 HydrophobicContact CD2-CG1 4.24Å; F155-V356 HydrophobicContact CE1-CG1 4.04Å; F155-V356 HydrophobicContact CE2-CG1 4.37Å; F155-V356 HydrophobicContact CG-CG1 3.99Å; F155-V356 HydrophobicContact CG-CG2 3.86Å; F155-V356 HydrophobicContact CZ-CG1 4.28Å; F155-R388 HydrophobicContact CE2-CB 4.45Å
156	K	97.8	Very high	95.1	Very high	30 Å²	30	76 Å²	76	13%	0.13	38%	0.375	C	S	.	.	H	α-helix	trans	-59.2	-42.3	178.5	-70.7	178.4	178.8	-179.2	0	112.4	I152 E154 I159 L160 T195 D196 Y386	I152-K156 HydrophobicContact CG1-CD 4.28Å; I152-K156 HydrophobicContact CG1-CG 4.46Å; I152-K156 WeakPolarHBondContact O-CG 3.09Å; I152-K156 PolarHBondContact O-N 2.83Å; E154-K156 PolarHBondContact O-N 3.4Å; K156-I159 PolarHBondContact O-N 2.62Å; K156-L160 VanDerWaalsContact O-CG 3.27Å; K156-L160 WeakPolarHBondContact O-CG 2.99Å; K156-L160 PolarHBondContact O-N 3.12Å; K156-T195 WeakPolarHBondContact CE-O 3.35Å; K156-T195 PolarHBondContact NZ-O 2.86Å; K156-D196 VanDerWaalsContact NZ-CA 3.31Å; K156-D196 IonicContact NZ-OD1 2.86Å; K156-D196 PolarHBondContact NZ-OD1 3.26Å; K156-Y386 HydrophobicContact CB-CD1 4.06Å; K156-Y386 HydrophobicContact CB-CE1 4.08Å; K156-Y386 HydrophobicContact CB-CG 4.38Å; K156-Y386 HydrophobicContact CD-CD2 4.18Å; K156-Y386 HydrophobicContact CD-CE2 4Å; K156-Y386 HydrophobicContact CG-CD1 4.04Å; K156-Y386 HydrophobicContact CG-CD2 3.86Å; K156-Y386 HydrophobicContact CG-CE1 4.23Å; K156-Y386 HydrophobicContact CG-CE2 4.08Å; K156-Y386 HydrophobicContact CG-CG 3.86Å
157	R	97.6	Very high	95.4	Very high	147 Å²	147	74.9 Å²	74.9	56%	0.555	37%	0.368	S	S	*	.	H	α-helix	trans	-62.5	-45.6	176.7	-178.8	-177.7	61.5	-179	-1.5	111.2	A153 E154 F155 I159 L160 D161	A153-R157 WeakPolarHBondContact O-CB 3.3Å; A153-R157 PolarHBondContact O-N 3.11Å; E154-R157 PolarHBondContact O-N 3.45Å; F155-R157 VanDerWaalsContact C-N 3.31Å; F155-R157 PolarHBondContact O-N 2.89Å; R157-I159 PolarHBondContact O-N 2.94Å; R157-L160 PolarHBondContact O-N 3.2Å; R157-D161 WeakPolarHBondContact CG-OD2 3.22Å; R157-D161 WeakPolarHBondContact O-CB 3.22Å; R157-D161 VanDerWaalsContact O-CG 3.24Å; R157-D161 PolarHBondContact O-N 2.95Å
158	E	96.8	Very high	95.8	Very high	76 Å²	76	72 Å²	72	36%	0.355	36%	0.359	S	S	.	.	H	α-helix	trans	-59.1	-45.3	177.7	-172	-173.3	175.5	0	0	112	E154 F155 L160 D161 V162 R388	E154-E158 PolarHBondContact O-N 3.08Å; F155-E158 PolarHBondContact O-N 2.85Å; E158-L160 PolarHBondContact O-N 2.86Å; E158-D161 PolarHBondContact O-N 3.29Å; E158-V162 HydrophobicContact CG-CG2 4.34Å; E158-V162 WeakPolarHBondContact O-CB 3.31Å; E158-V162 WeakPolarHBondContact O-CG2 3.4Å; E158-V162 PolarHBondContact O-N 2.83Å; E158-R388 VanDerWaalsContact CD-NH1 3.26Å; E158-R388 IonicContact OE1-CZ 3.59Å; E158-R388 IonicContact OE1-NH1 3.07Å; E158-R388 PolarHBondContact OE1-NH1 3.01Å; E158-R388 IonicContact OE2-NH1 3.41Å; E158-R388 PolarHBondContact OE2-NH1 3.47Å; E158-R388 IonicContact OE2-NH2 3.57Å
159	I	97.4	Very high	95.9	Very high	1 Å²	1	74.7 Å²	74.7	1%	0.005	37%	0.366	C	S	.	.	H	α-helix	trans	-60.2	-45.9	175.5	-63.6	-55.5	0	0	0	110.9	F155 K156 R157 D161 Q163 K164 C166 C167 Y386 Y387 R388	F155-I159 HydrophobicContact CD2-CG1 4.29Å; F155-I159 HydrophobicContact CE1-CG1 4.25Å; F155-I159 HydrophobicContact CE2-CD1 3.93Å; F155-I159 HydrophobicContact CE2-CG1 3.87Å; F155-I159 HydrophobicContact CZ-CD1 4.16Å; F155-I159 HydrophobicContact CZ-CG1 3.86Å; F155-I159 WeakPolarHBondContact O-CG1 3.44Å; F155-I159 PolarHBondContact O-N 2.81Å; K156-I159 PolarHBondContact O-N 2.62Å; R157-I159 PolarHBondContact O-N 2.94Å; I159-D161 VanDerWaalsContact C-N 3.33Å; I159-D161 PolarHBondContact O-N 3.18Å; I159-Q163 CarbonylContact O-C 2.94Å; I159-Q163 WeakPolarHBondContact O-CA 3.41Å; I159-Q163 PolarHBondContact O-N 2.9Å; I159-Q163 VanDerWaalsContact O-O 3.11Å; I159-K164 PolarHBondContact O-N 3.29Å; I159-C166 HydrophobicContact CG2-CB 4.19Å; I159-C167 HydrophobicContact CG2-CB 4.27Å; I159-Y386 HydrophobicContact CB-CD1 4.23Å; I159-Y386 HydrophobicContact CG2-CD1 4.12Å; I159-Y387 WeakPolarHBondContact CD1-O 3.43Å; I159-R388 HydrophobicContact CD1-CB 3.92Å
160	L	96.8	Very high	96	Very high	75 Å²	75	72 Å²	72	39%	0.393	36%	0.356	S	S	.	.	H	α-helix	trans	-66.4	-33.9	-179.9	-69.9	172.7	0	0	0	113.5	K156 R157 E158 C167 Y386	K156-L160 VanDerWaalsContact O-CG 3.27Å; K156-L160 WeakPolarHBondContact O-CG 2.99Å; K156-L160 PolarHBondContact O-N 3.12Å; R157-L160 PolarHBondContact O-N 3.2Å; E158-L160 PolarHBondContact O-N 2.86Å; L160-C167 HydrophobicContact CD2-CB 4.22Å; L160-Y386 HydrophobicContact CD1-CE1 3.9Å; L160-Y386 HydrophobicContact CD2-CE1 3.84Å; L160-Y386 HydrophobicContact CG-CD1 4.36Å; L160-Y386 HydrophobicContact CG-CE1 3.73Å
161	D	96.2	Very high	96	Very high	124 Å²	124	65 Å²	65	66%	0.663	33%	0.329	S	S	*	.	H	α-helix	trans	-82.2	-37.5	-177.1	-71.3	-15.6	0	0	0	112.4	R157 E158 I159	R157-D161 WeakPolarHBondContact CG-OD2 3.22Å; R157-D161 WeakPolarHBondContact O-CB 3.22Å; R157-D161 VanDerWaalsContact O-CG 3.24Å; R157-D161 PolarHBondContact O-N 2.95Å; E158-D161 PolarHBondContact O-N 3.29Å; I159-D161 VanDerWaalsContact C-N 3.33Å; I159-D161 PolarHBondContact O-N 3.18Å
162	V	93.6	Very high	95.9	Very high	104 Å²	104	64.2 Å²	64.2	63%	0.63	33%	0.328	S	S	*	.	H	α-helix	trans	-107.8	-36.4	-169.8	-171.7	0	0	0	0	113.1	E158	E158-V162 HydrophobicContact CG-CG2 4.34Å; E158-V162 WeakPolarHBondContact O-CB 3.31Å; E158-V162 WeakPolarHBondContact O-CG2 3.4Å; E158-V162 PolarHBondContact O-N 2.83Å
163	Q	90.8	Very high	95.6	Very high	62 Å²	62	64.9 Å²	64.9	29%	0.29	33%	0.332	S	S	.	.			trans	-140.7	59.1	-168.4	-61.9	-175.9	-35	0	0	111	I159 E165 C166	I159-Q163 CarbonylContact O-C 2.94Å; I159-Q163 WeakPolarHBondContact O-CA 3.41Å; I159-Q163 PolarHBondContact O-N 2.9Å; I159-Q163 VanDerWaalsContact O-O 3.11Å; Q163-E165 PolarHBondContact O-N 2.82Å; Q163-E165 VanDerWaalsContact O-N 3.14Å; Q163-C166 HydrophobicContact CB-CB 4.3Å; Q163-C166 WeakPolarHBondContact O-CB 3.42Å; Q163-C166 PolarHBondContact O-N 2.93Å
164	K	93.3	Very high	95.2	Very high	152 Å²	152	61.2 Å²	61.2	66%	0.661	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-59.3	-29.5	-172.4	-173.6	179.1	178.3	-177.1	0	112.8	I159 C166 C167	I159-K164 PolarHBondContact O-N 3.29Å; K164-C166 PolarHBondContact O-N 2.88Å; K164-C167 WeakPolarHBondContact O-CB 3.31Å; K164-C167 PolarHBondContact O-N 3.46Å
165	E	93.5	Very high	94.9	Very high	138 Å²	138	57.6 Å²	57.6	65%	0.645	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-61.2	-22.3	173.6	65.8	-84.2	-161.9	0	0	113.5	Q163 C167	Q163-E165 PolarHBondContact O-N 2.82Å; Q163-E165 VanDerWaalsContact O-N 3.14Å; E165-C167 PolarHBondContact O-N 3.44Å
166	C	95.7	Very high	94.8	Very high	18 Å²	18	57.5 Å²	57.5	12%	0.122	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-87.5	14.3	174.6	-53.5	0	0	0	0	113	I159 Q163 K164 Y387	I159-C166 HydrophobicContact CG2-CB 4.19Å; Q163-C166 HydrophobicContact CB-CB 4.3Å; Q163-C166 WeakPolarHBondContact O-CB 3.42Å; Q163-C166 PolarHBondContact O-N 2.93Å; K164-C166 PolarHBondContact O-N 2.88Å; C166-Y387 HydrophobicContact CB-CD1 4.26Å; C166-Y387 HydrophobicContact CB-CE1 4.11Å; C166-Y387 HydrophobicContact CB-CE2 4.47Å; C166-Y387 WeakPolarHBondContact CB-O 3.42Å; C166-Y387 WeakPolarHBondContact O-CD1 3.44Å; C166-Y387 PolarHBondContact O-N 3.24Å
167	C	97.2	Very high	94.7	Very high	20 Å²	20	57.3 Å²	57.3	14%	0.135	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	108.1	167.5	-176.3	0	0	0	0	109.4	I159 L160 K164 E165 L385 Y386	I159-C167 HydrophobicContact CG2-CB 4.27Å; L160-C167 HydrophobicContact CD2-CB 4.22Å; K164-C167 WeakPolarHBondContact O-CB 3.31Å; K164-C167 PolarHBondContact O-N 3.46Å; E165-C167 PolarHBondContact O-N 3.44Å; C167-L385 CarbonylContact C-O 3.58Å; C167-L385 VanDerWaalsContact CA-O 3.28Å; C167-L385 WeakPolarHBondContact CA-O 3.36Å; C167-Y386 HydrophobicContact CB-CD1 4.27Å; C167-Y386 HydrophobicContact CB-CE1 4.44Å; C167-Y386 VanDerWaalsContact SG-CE1 3.59Å
168	I	95.8	Very high	94.6	Very high	22 Å²	22	50.3 Å²	50.3	11%	0.113	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	145.7	-176.2	65.8	173.8	0	0	0	111.6	A176 V218 L385 Y387	I168-A176 HydrophobicContact CD1-CB 3.79Å; I168-V218 HydrophobicContact CD1-CG1 4.12Å; I168-L385 HydrophobicContact CD1-CD2 4Å; I168-L385 HydrophobicContact CG1-CB 3.99Å; I168-L385 HydrophobicContact CG1-CD2 3.97Å; I168-L385 HydrophobicContact CG1-CG 4.37Å; I168-L385 PolarHBondContact N-O 3.45Å; I168-L385 PolarHBondContact O-N 2.92Å; I168-Y387 HydrophobicContact CD1-CE1 4.28Å; I168-Y387 HydrophobicContact CG1-CE1 4.34Å; I168-Y387 HydrophobicContact CG2-CE1 4.26Å
169	K	96.9	Very high	94.6	Very high	102 Å²	102	49.5 Å²	49.5	44%	0.443	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	124.3	172.5	-173.6	-177.3	177.5	-172.6	0	109.3	S382 W384	K169-S382 WeakPolarHBondContact CE-OG 3.42Å; K169-W384 HydrophobicContact CB-CD2 4.15Å; K169-W384 HydrophobicContact CB-CE3 4.02Å; K169-W384 HydrophobicContact CB-CH2 4.08Å; K169-W384 HydrophobicContact CB-CZ2 4.2Å; K169-W384 HydrophobicContact CB-CZ3 3.99Å; K169-W384 HydrophobicContact CD-CZ2 4.28Å
170	I	95.7	Very high	94.6	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	111.8	171.4	-48.8	-179.7	0	0	0	107.4	A174 A176 L200 F373 N375 S382 K383 L385	I170-A174 HydrophobicContact CG2-CB 4.11Å; I170-A176 HydrophobicContact CD1-CB 3.7Å; I170-A176 HydrophobicContact CG1-CB 3.87Å; I170-L200 HydrophobicContact CD1-CD1 4.2Å; I170-L200 HydrophobicContact CD1-CD2 4.06Å; I170-F373 HydrophobicContact CD1-CB 3.55Å; I170-N375 HydrophobicContact CB-CB 4.36Å; I170-N375 HydrophobicContact CG2-CB 3.59Å; I170-N375 PolarHBondContact O-ND2 2.98Å; I170-S382 CarbonylContact O-C 3.26Å; I170-S382 WeakPolarHBondContact O-CA 3.12Å; I170-S382 WeakPolarHBondContact O-CB 3.38Å; I170-K383 PolarHBondContact N-O 3.4Å; I170-K383 PolarHBondContact O-N 3.5Å; I170-L385 HydrophobicContact CD1-CB 4.13Å; I170-L385 HydrophobicContact CD1-CD2 4.09Å; I170-L385 HydrophobicContact CG1-CB 4.45Å
171	S	95.2	Very high	94.6	Very high	28 Å²	28	47.3 Å²	47.3	20%	0.196	25%	0.245	C	C	.	.			trans	-57.6	163.7	177.9	-58.2	0	0	0	0	111.8	A174 E222 N375	S171-A174 WeakPolarHBondContact O-CB 3.39Å; S171-A174 PolarHBondContact O-N 3.49Å; S171-E222 WeakPolarHBondContact CB-OE1 3.37Å; S171-E222 PolarHBondContact OG-OE1 2.92Å; S171-N375 PolarHBondContact O-ND2 3.23Å
172	S	92.6	Very high	94.5	Very high	43 Å²	43	42.1 Å²	42.1	30%	0.301	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	147.7	165.8	36.5	0	0	0	0	109.6	A174 S378 L379	S172-A174 PolarHBondContact O-N 3.03Å; S172-S378 CarbonylContact C-O 3.52Å; S172-S378 VanDerWaalsContact CA-O 3.31Å; S172-S378 WeakPolarHBondContact CA-O 3.2Å; S172-S378 WeakPolarHBondContact CB-O 3.41Å; S172-L379 VanDerWaalsContact CB-O 3.3Å; S172-L379 WeakPolarHBondContact CB-O 3.39Å
173	L	91	Very high	94.5	Very high	42 Å²	42	40.4 Å²	40.4	22%	0.22	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	17.5	-179.7	-53.7	179.4	0	0	0	115.2	S223 N375 S376 S378 L379	L173-S223 VanDerWaalsContact CB-OG 3.31Å; L173-S223 WeakPolarHBondContact CB-OG 3.43Å; L173-S223 PolarHBondContact O-N 2.77Å; L173-S223 PolarHBondContact O-OG 2.73Å; L173-N375 PolarHBondContact N-O 2.97Å; L173-S376 WeakPolarHBondContact CD2-O 3.38Å; L173-S378 PolarHBondContact N-O 3.32Å; L173-L379 HydrophobicContact CD2-CD2 4.11Å
174	A	90.2	Very high	94.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	160	-176.9	0	0	0	0	0	112.5	I170 S171 S172 I220 S221 E222 N375 S376	I170-A174 HydrophobicContact CG2-CB 4.11Å; S171-A174 WeakPolarHBondContact O-CB 3.39Å; S171-A174 PolarHBondContact O-N 3.49Å; S172-A174 PolarHBondContact O-N 3.03Å; A174-I220 HydrophobicContact CB-CG2 4.36Å; A174-S221 CarbonylContact C-O 3.22Å; A174-S221 VanDerWaalsContact CA-O 3.27Å; A174-S221 WeakPolarHBondContact CA-O 3.32Å; A174-S221 WeakPolarHBondContact CB-O 3.4Å; A174-E222 HydrophobicContact CB-CB 4.5Å; A174-E222 HydrophobicContact CB-CG 4.02Å; A174-N375 CarbonylContact O-C 3.53Å; A174-N375 VanDerWaalsContact O-C 3.26Å; A174-N375 WeakPolarHBondContact O-CA 3.31Å; A174-N375 VanDerWaalsContact O-CB 3.22Å; A174-N375 WeakPolarHBondContact O-CB 3.09Å; A174-N375 PolarHBondContact O-N 2.61Å; A174-S376 PolarHBondContact O-N 2.68Å
175	T	91.9	Very high	94.4	Very high	24 Å²	24	41.1 Å²	41.1	15%	0.147	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	129.5	173.8	-62.5	0	0	0	0	109	S221 F373 D374	T175-S221 PolarHBondContact N-O 3.34Å; T175-S221 PolarHBondContact O-N 2.89Å; T175-S221 PolarHBondContact O-OG 3.1Å; T175-F373 WeakPolarHBondContact CA-O 3.31Å; T175-D374 HydrophobicContact CG2-CB 4.47Å; T175-D374 PolarHBondContact OG1-OD1 2.76Å
176	A	94.9	Very high	94.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	132.8	168.6	0	0	0	0	0	109.9	I168 I170 N219 I220 F373	I168-A176 HydrophobicContact CD1-CB 3.79Å; I170-A176 HydrophobicContact CD1-CB 3.7Å; I170-A176 HydrophobicContact CG1-CB 3.87Å; A176-N219 CarbonylContact C-O 3.59Å; A176-N219 WeakPolarHBondContact CA-O 3.46Å; A176-I220 HydrophobicContact CB-CG1 4.13Å; A176-F373 HydrophobicContact CB-CB 4.23Å; A176-F373 PolarHBondContact N-O 2.71Å; A176-F373 PolarHBondContact O-N 3.43Å
177	T	95.8	Very high	94	Very high	25 Å²	25	42.2 Å²	42.2	15%	0.153	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	118.3	177.2	-57.4	0	0	0	0	108.9	R179 V218 N219 V370 F371	T177-R179 HydrophobicContact CG2-CG 4.12Å; T177-V218 WeakPolarHBondContact O-CA 3.42Å; T177-N219 PolarHBondContact N-O 2.97Å; T177-N219 PolarHBondContact O-N 2.93Å; T177-V370 HydrophobicContact CG2-CG1 3.48Å; T177-V370 VanDerWaalsContact CG2-CG1 3.48Å; T177-F371 CarbonylContact C-O 3.44Å; T177-F371 VanDerWaalsContact CA-O 3.31Å; T177-F371 WeakPolarHBondContact CA-O 3.48Å
178	V	96.3	Very high	93.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	119.8	172.7	-173.5	0	0	0	0	108.1	V180 I216 S217 V218 F371 F373 Y387 I389	V178-V180 HydrophobicContact CG1-CG2 3.89Å; V178-I216 HydrophobicContact CG1-CG2 4.01Å; V178-S217 CarbonylContact C-O 3.51Å; V178-S217 WeakPolarHBondContact CA-O 3.34Å; V178-V218 HydrophobicContact CG1-CG2 4.16Å; V178-V218 HydrophobicContact CG2-CG1 4.28Å; V178-V218 HydrophobicContact CG2-CG2 4.17Å; V178-F371 HydrophobicContact CB-CB 4.15Å; V178-F371 PolarHBondContact N-O 2.91Å; V178-F371 PolarHBondContact O-N 3Å; V178-F373 HydrophobicContact CG2-CD2 4.25Å; V178-F373 HydrophobicContact CG2-CE2 3.94Å; V178-Y387 HydrophobicContact CG1-CE2 4.32Å; V178-Y387 HydrophobicContact CG2-CE2 4.29Å; V178-I389 HydrophobicContact CB-CD1 4.38Å; V178-I389 HydrophobicContact CG1-CD1 3.94Å
179	R	96.9	Very high	93.9	Very high	59 Å²	59	40.8 Å²	40.8	22%	0.223	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	120.4	179	-65.1	176.1	60.6	89.3	-3.3	109.3	T177 E207 I216 S217 V368 Y369 V370	T177-R179 HydrophobicContact CG2-CG 4.12Å; R179-E207 IonicContact CZ-OE1 3.28Å; R179-E207 IonicContact CZ-OE2 2.74Å; R179-E207 IonicContact NH1-OE1 3.69Å; R179-E207 IonicContact NH1-OE2 3.15Å; R179-E207 PolarHBondContact NH1-OE2 3.37Å; R179-E207 VanDerWaalsContact NH2-CD 3.34Å; R179-E207 IonicContact NH2-OE1 2.99Å; R179-E207 PolarHBondContact NH2-OE1 2.88Å; R179-E207 IonicContact NH2-OE2 3.03Å; R179-E207 PolarHBondContact NH2-OE2 3.38Å; R179-I216 WeakPolarHBondContact O-CA 3.47Å; R179-S217 WeakPolarHBondContact CB-OG 3.38Å; R179-S217 PolarHBondContact N-O 2.79Å; R179-S217 PolarHBondContact O-N 3Å; R179-S217 VanDerWaalsContact O-N 3.11Å; R179-V368 HydrophobicContact CB-CG1 3.81Å; R179-V368 HydrophobicContact CG-CG1 4.47Å; R179-Y369 CarbonylContact C-O 3.58Å; R179-Y369 VanDerWaalsContact CA-O 3.3Å; R179-Y369 WeakPolarHBondContact CA-O 3.24Å; R179-V370 HydrophobicContact CG-CG1 4.45Å; R179-V370 HydrophobicContact CG-CG2 4.41Å
180	V	97	Very high	93.9	Very high	13 Å²	13	36.7 Å²	36.7	8%	0.079	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	104.8	-174	-173.4	0	0	0	0	109.5	V178 I189 I216 Y369 F371 I389	V178-V180 HydrophobicContact CG1-CG2 3.89Å; V180-I189 HydrophobicContact CB-CD1 4.03Å; V180-I189 HydrophobicContact CG1-CD1 3.84Å; V180-I216 HydrophobicContact CG1-CD1 4.28Å; V180-I216 HydrophobicContact CG1-CG1 4.25Å; V180-I216 HydrophobicContact CG2-CG1 4.5Å; V180-I216 HydrophobicContact CG2-CG2 4.23Å; V180-Y369 PolarHBondContact N-O 3.44Å; V180-Y369 PolarHBondContact O-N 2.88Å; V180-F371 HydrophobicContact CB-CE2 4.13Å; V180-F371 HydrophobicContact CG2-CD2 3.99Å; V180-F371 HydrophobicContact CG2-CE2 3.82Å; V180-I389 HydrophobicContact CG1-CG2 4.24Å; V180-I389 HydrophobicContact CG2-CD1 4.05Å; V180-I389 HydrophobicContact CG2-CG2 4.08Å
181	P	96.6	Very high	94	Very high	18 Å²	18	36.9 Å²	36.9	12%	0.117	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	145.9	173.5	-25	35.4	0	0	0	112.5	H183 P212 P213	P181-H183 PolarHBondContact O-N 3.06Å; P181-P212 HydrophobicContact CB-CB 4.2Å; P181-P213 WeakPolarHBondContact CB-O 3.49Å; P181-P213 HydrophobicContact CG-CG 4.13Å; P181-P213 WeakPolarHBondContact CG-O 3.24Å
182	T	94.5	Very high	94.1	Very high	14 Å²	14	36.6 Å²	36.6	9%	0.086	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-66.4	126.7	169.1	51.8	0	0	0	0	110.2	F206 Y363 G365 V366 G367 Y369	T182-F206 HydrophobicContact CG2-CE2 3.73Å; T182-F206 HydrophobicContact CG2-CZ 4.08Å; T182-Y363 HydrophobicContact CG2-CD1 4.41Å; T182-Y363 HydrophobicContact CG2-CD2 4.06Å; T182-Y363 HydrophobicContact CG2-CE1 4.44Å; T182-Y363 HydrophobicContact CG2-CE2 4.13Å; T182-Y363 HydrophobicContact CG2-CG 4.2Å; T182-G365 WeakPolarHBondContact CG2-O 3.36Å; T182-V366 WeakPolarHBondContact OG1-CA 3.21Å; T182-G367 PolarHBondContact N-O 3.2Å; T182-G367 PolarHBondContact OG1-N 3.4Å; T182-G367 PolarHBondContact OG1-O 2.94Å; T182-Y369 HydrophobicContact CG2-CD2 4.32Å; T182-Y369 HydrophobicContact CG2-CE2 4.03Å
183	H	93.3	Very high	94.4	Very high	68 Å²	68	34.6 Å²	34.6	32%	0.315	18%	0.18	S	C	.	.	P	Polyproline II helix	trans	-79.7	135.9	176.3	-171.3	-94.4	0	0	0	111.1	P181 N185 G186 Y391	P181-H183 PolarHBondContact O-N 3.06Å; H183-N185 PolarHBondContact ND1-N 2.89Å; H183-N185 PolarHBondContact O-N 3.19Å; H183-N185 VanDerWaalsContact O-N 3.12Å; H183-G186 PolarHBondContact O-N 3.21Å; H183-Y391 HydrophobicContact CB-CD1 3.79Å; H183-Y391 HydrophobicContact CB-CD2 4.37Å; H183-Y391 HydrophobicContact CB-CE1 3.91Å; H183-Y391 HydrophobicContact CB-CE2 4.49Å; H183-Y391 HydrophobicContact CB-CG 4.04Å; H183-Y391 AromaticContact CD2-CE1 3.94Å; H183-Y391 AromaticContact CE1-CZ 3.92Å; H183-Y391 AromaticContact CG-CE1 3.69Å; H183-Y391 AromaticContact CG-CZ 3.75Å; H183-Y391 AromaticContact ND1-CE2 3.79Å; H183-Y391 AromaticContact ND1-CZ 3.62Å
184	P	90.7	Very high	94.8	Very high	120 Å²	120	32.6 Å²	32.6	78%	0.779	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-31.3	-177.1	-27.8	34.9	0	0	0	115
185	N	90.5	Very high	95.2	Very high	109 Å²	109	32.7 Å²	32.7	58%	0.583	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.2	0.3	177.2	-58.6	-23.7	0	0	0	113.1	H183 H393	H183-N185 PolarHBondContact ND1-N 2.89Å; H183-N185 PolarHBondContact O-N 3.19Å; H183-N185 VanDerWaalsContact O-N 3.12Å; N185-H393 PolarHBondContact O-CE1 3.47Å; N185-H393 PolarHBondContact O-ND1 2.96Å
186	G	91.4	Very high	95.4	Very high	12 Å²	12	33.7 Å²	33.7	12%	0.124	18%	0.175	C	C	.	.			trans	-88.5	152.9	-179.1	0	0	0	0	0	112.1	H183 Y363 T392	H183-G186 PolarHBondContact O-N 3.21Å; G186-Y363 VanDerWaalsContact C-CE2 3.46Å; G186-Y363 VanDerWaalsContact O-CD2 3.32Å; G186-Y363 WeakPolarHBondContact O-CD2 3.44Å; G186-Y363 WeakPolarHBondContact O-CE2 3.41Å; G186-T392 CarbonylContact C-O 3.54Å; G186-T392 WeakPolarHBondContact CA-O 3.45Å
187	R	90.7	Very high	95.5	Very high	167 Å²	167	39.2 Å²	39.2	63%	0.63	20%	0.204	S	C	*	.	S	Bend	trans	-119.9	-25.9	175.6	-68.6	-165	179.4	141.4	-16	113.8	Q362 Y363 T392 H393	R187-Q362 WeakPolarHBondContact O-CG 3.3Å; R187-Y363 PolarHBondContact O-N 3.06Å; R187-T392 PolarHBondContact N-O 3.41Å; R187-H393 WeakPolarHBondContact CD-OXT 3.37Å; R187-H393 WeakPolarHBondContact CG-OXT 3.38Å; R187-H393 VanDerWaalsContact CZ-OXT 3.23Å; R187-H393 PolarHBondContact NE-OXT 3.13Å; R187-H393 PolarHBondContact NH1-OXT 2.88Å
188	A	93.1	Very high	95.5	Very high	11 Å²	11	42.2 Å²	42.2	9%	0.091	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	155.7	176.9	0	0	0	0	0	110.5	H361 Y391 T392	A188-H361 CarbonylContact C-O 3.56Å; A188-H361 VanDerWaalsContact CA-O 3.24Å; A188-H361 WeakPolarHBondContact CA-O 3.24Å; A188-H361 WeakPolarHBondContact CB-O 3.22Å; A188-Y391 CarbonylContact O-C 3.59Å; A188-Y391 WeakPolarHBondContact O-CA 3.36Å; A188-Y391 WeakPolarHBondContact O-CB 3.45Å; A188-T392 PolarHBondContact O-N 3.26Å
189	I	95.9	Very high	95.5	Very high	1 Å²	1	43 Å²	43	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	140.9	169.5	-163.3	157.5	0	0	0	108.6	V180 W191 T360 H361 Y363 Y369 F371 I389	V180-I189 HydrophobicContact CB-CD1 4.03Å; V180-I189 HydrophobicContact CG1-CD1 3.84Å; I189-W191 HydrophobicContact CG2-CE3 4.15Å; I189-W191 HydrophobicContact CG2-CZ3 3.96Å; I189-T360 CarbonylContact O-C 3.45Å; I189-T360 WeakPolarHBondContact O-CA 3.45Å; I189-T360 PolarHBondContact O-OG1 3.31Å; I189-T360 VanDerWaalsContact O-OG1 3.1Å; I189-H361 HydrophobicContact CG2-CB 4.09Å; I189-H361 PolarHBondContact N-O 2.97Å; I189-H361 PolarHBondContact O-N 2.97Å; I189-Y363 HydrophobicContact CB-CE1 3.94Å; I189-Y369 HydrophobicContact CB-CD2 4.32Å; I189-Y369 HydrophobicContact CB-CE2 4.1Å; I189-Y369 HydrophobicContact CD1-CD1 4.39Å; I189-Y369 HydrophobicContact CD1-CD2 3.66Å; I189-Y369 HydrophobicContact CD1-CE2 4.29Å; I189-Y369 HydrophobicContact CD1-CG 3.71Å; I189-Y369 HydrophobicContact CG2-CD1 3.87Å; I189-Y369 HydrophobicContact CG2-CD2 4.18Å; I189-Y369 HydrophobicContact CG2-CE1 3.5Å; I189-Y369 HydrophobicContact CG2-CE2 3.87Å; I189-Y369 HydrophobicContact CG2-CG 4.17Å; I189-F371 HydrophobicContact CD1-CE2 3.56Å; I189-F371 HydrophobicContact CD1-CZ 3.53Å; I189-F371 HydrophobicContact CG1-CZ 4.01Å; I189-I389 HydrophobicContact CD1-CG2 3.71Å; I189-I389 HydrophobicContact CG1-CG2 3.73Å
190	C	97.2	Very high	95.5	Very high	16 Å²	16	40.2 Å²	40.2	11%	0.108	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	145.8	171.6	-62	0	0	0	0	109.3	G359 T360 I389 F390	C190-G359 VanDerWaalsContact CA-O 3.28Å; C190-G359 WeakPolarHBondContact CA-O 3.05Å; C190-T360 PolarHBondContact SG-OG1 3.46Å; C190-T360 VanDerWaalsContact SG-OG1 3.34Å; C190-I389 WeakPolarHBondContact O-CA 3.27Å; C190-F390 HydrophobicContact CB-CD1 4.34Å; C190-F390 HydrophobicContact CB-CD2 3.84Å; C190-F390 HydrophobicContact CB-CE1 3.92Å; C190-F390 HydrophobicContact CB-CE2 3.37Å; C190-F390 HydrophobicContact CB-CG 4.31Å; C190-F390 HydrophobicContact CB-CZ 3.42Å; C190-F390 VanDerWaalsContact CB-CZ 3.42Å; C190-F390 PolarHBondContact N-O 3.43Å; C190-F390 PolarHBondContact O-N 2.94Å
191	W	98.2	Very high	95.4	Very high	5 Å²	5	39.7 Å²	39.7	2%	0.019	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	153.3	178.5	63.6	90	0	0	0	111.8	A144 V146 I189 F202 L204 I345 C358 G359 T360 H361 F371 R388 I389	A144-W191 HydrophobicContact CB-CH2 4.04Å; V146-W191 HydrophobicContact CG2-CZ2 4.25Å; I189-W191 HydrophobicContact CG2-CE3 4.15Å; I189-W191 HydrophobicContact CG2-CZ3 3.96Å; W191-F202 AromaticContact CD1-CZ 3.91Å; W191-F202 AromaticContact NE1-CE1 3.8Å; W191-F202 AromaticContact NE1-CZ 3.6Å; W191-L204 HydrophobicContact CE3-CD2 4.4Å; W191-L204 HydrophobicContact CH2-CD2 3.7Å; W191-L204 HydrophobicContact CZ2-CD2 4.22Å; W191-L204 HydrophobicContact CZ3-CD2 3.79Å; W191-I345 HydrophobicContact CH2-CD1 4.06Å; W191-I345 HydrophobicContact CZ2-CD1 3.56Å; W191-C358 CarbonylContact O-C 3.49Å; W191-C358 VanDerWaalsContact O-CA 3.24Å; W191-C358 WeakPolarHBondContact O-CA 3.13Å; W191-G359 VanDerWaalsContact CE2-CA 3.43Å; W191-G359 VanDerWaalsContact CZ2-CA 3.47Å; W191-G359 PolarHBondContact N-O 2.69Å; W191-G359 PolarHBondContact O-N 3.5Å; W191-T360 VanDerWaalsContact CZ3-C 3.46Å; W191-H361 HydrophobicContact CH2-CB 4.22Å; W191-H361 HydrophobicContact CZ3-CB 3.99Å; W191-F371 HydrophobicContact CB-CD1 4.48Å; W191-F371 HydrophobicContact CB-CE1 3.65Å; W191-F371 HydrophobicContact CB-CZ 4.3Å; W191-F371 AromaticContact CD2-CE1 3.85Å; W191-F371 HydrophobicContact CD2-CE1 3.85Å; W191-F371 AromaticContact CE3-CE1 3.94Å; W191-F371 HydrophobicContact CE3-CE1 3.94Å; W191-F371 HydrophobicContact CE3-CZ 4.26Å; W191-F371 AromaticContact CG-CE1 3.74Å; W191-F371 HydrophobicContact CG-CE1 3.74Å; W191-R388 CarbonylContact C-O 3.55Å; W191-R388 VanDerWaalsContact CA-O 3.29Å; W191-R388 WeakPolarHBondContact CA-O 3.49Å; W191-I389 HydrophobicContact CB-CG1 4.04Å
192	E	98.1	Very high	95.4	Very high	21 Å²	21	39 Å²	39	10%	0.098	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	138.2	173.6	-57.4	178.2	105.9	0	0	108.4	R149 F155 V356 Y357 C358 Y387 R388	R149-E192 IonicContact CZ-OE1 2.69Å; R149-E192 VanDerWaalsContact CZ-OE1 3.28Å; R149-E192 IonicContact NE-OE1 2.75Å; R149-E192 PolarHBondContact NE-OE1 3.11Å; R149-E192 IonicContact NH2-OE1 2.97Å; R149-E192 PolarHBondContact NH2-OE1 2.87Å; F155-E192 HydrophobicContact CE2-CB 3.76Å; F155-E192 HydrophobicContact CZ-CB 3.98Å; E192-V356 HydrophobicContact CB-CG1 4.2Å; E192-Y357 CarbonylContact C-O 3.53Å; E192-Y357 VanDerWaalsContact CA-O 3.24Å; E192-Y357 WeakPolarHBondContact CA-O 3.24Å; E192-C358 HydrophobicContact CG-CB 4.39Å; E192-Y387 CarbonylContact O-C 3.54Å; E192-Y387 VanDerWaalsContact O-CA 3.22Å; E192-Y387 WeakPolarHBondContact O-CA 3.46Å; E192-R388 PolarHBondContact N-O 3.46Å; E192-R388 PolarHBondContact O-N 3.28Å; E192-R388 IonicContact OE1-NH2 2.68Å; E192-R388 IonicContact OE2-CZ 2.79Å; E192-R388 IonicContact OE2-NE 2.62Å; E192-R388 PolarHBondContact OE2-NE 3.49Å; E192-R388 IonicContact OE2-NH2 3.59Å; E192-R388 PolarHBondContact OE2-NH2 3.37Å
193	F	98.5	Very high	95.3	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.009	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	154	173.9	68.3	-85.8	0	0	0	114	F202 R350 C352 Y357 F373 L385 Y386	F193-F202 HydrophobicContact CD1-CD2 4.34Å; F193-F202 HydrophobicContact CD1-CE2 4.3Å; F193-F202 HydrophobicContact CE1-CB 4.39Å; F193-F202 AromaticContact CE1-CD1 3.88Å; F193-F202 HydrophobicContact CE1-CD1 3.88Å; F193-F202 AromaticContact CE1-CD2 3.7Å; F193-F202 HydrophobicContact CE1-CD2 3.7Å; F193-F202 HydrophobicContact CE1-CE1 4.03Å; F193-F202 AromaticContact CE1-CE2 3.85Å; F193-F202 HydrophobicContact CE1-CE2 3.85Å; F193-F202 AromaticContact CE1-CG 3.7Å; F193-F202 HydrophobicContact CE1-CG 3.7Å; F193-F202 HydrophobicContact CE1-CZ 4.02Å; F193-F202 HydrophobicContact CE2-CB 4.19Å; F193-F202 HydrophobicContact CE2-CD2 4.5Å; F193-F202 HydrophobicContact CE2-CG 4.34Å; F193-F202 HydrophobicContact CZ-CB 3.66Å; F193-F202 AromaticContact CZ-CD1 3.86Å; F193-F202 HydrophobicContact CZ-CD1 3.86Å; F193-F202 AromaticContact CZ-CD2 3.8Å; F193-F202 HydrophobicContact CZ-CD2 3.8Å; F193-F202 HydrophobicContact CZ-CE1 4.48Å; F193-F202 HydrophobicContact CZ-CE2 4.41Å; F193-F202 AromaticContact CZ-CG 3.47Å; F193-F202 HydrophobicContact CZ-CG 3.47Å; F193-F202 VanDerWaalsContact CZ-CG 3.47Å; F193-R350 HydrophobicContact CE2-CB 4.44Å; F193-R350 HydrophobicContact CZ-CG 4.28Å; F193-C352 HydrophobicContact CD2-CB 3.85Å; F193-C352 HydrophobicContact CE2-CB 3.64Å; F193-Y357 VanDerWaalsContact CE1-CB 3.47Å; F193-Y357 HydrophobicContact CE1-CG 4.44Å; F193-Y357 HydrophobicContact CE2-CG 4.25Å; F193-Y357 HydrophobicContact CZ-CD1 4.27Å; F193-Y357 AromaticContact CZ-CG 3.92Å; F193-Y357 HydrophobicContact CZ-CG 3.92Å; F193-Y357 PolarHBondContact N-O 2.98Å; F193-Y357 PolarHBondContact O-N 2.89Å; F193-F373 HydrophobicContact CB-CE1 4.04Å; F193-F373 HydrophobicContact CB-CZ 4.49Å; F193-F373 HydrophobicContact CD1-CE1 4.09Å; F193-F373 HydrophobicContact CD2-CE1 4.08Å; F193-F373 AromaticContact CG-CE1 3.81Å; F193-F373 HydrophobicContact CG-CE1 3.81Å; F193-L385 HydrophobicContact CB-CD1 3.88Å; F193-L385 HydrophobicContact CD2-CD1 4.25Å; F193-L385 HydrophobicContact CG-CD1 4.45Å; F193-Y386 CarbonylContact C-O 3.53Å; F193-Y386 WeakPolarHBondContact CA-O 3.42Å; F193-Y386 WeakPolarHBondContact CB-O 3.26Å
194	A	98.6	Very high	95.4	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	161.6	175.1	0	0	0	0	0	110.9	I152 F155 C352 Y386	I152-A194 HydrophobicContact CD1-CB 4.04Å; I152-A194 HydrophobicContact CG1-CB 3.93Å; F155-A194 HydrophobicContact CD1-CB 3.77Å; F155-A194 HydrophobicContact CE1-CB 3.75Å; A194-C352 CarbonylContact C-O 3.46Å; A194-C352 VanDerWaalsContact CA-O 3.24Å; A194-C352 WeakPolarHBondContact CA-O 3.17Å; A194-C352 WeakPolarHBondContact CB-O 3.31Å; A194-Y386 PolarHBondContact N-O 3.42Å; A194-Y386 PolarHBondContact O-N 2.94Å
195	T	98.5	Very high	95.5	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.006	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	168.6	173.9	51.4	0	0	0	0	111.3	K156 Y198 L200 C352 H353 W384	K156-T195 WeakPolarHBondContact CE-O 3.35Å; K156-T195 PolarHBondContact NZ-O 2.86Å; T195-Y198 WeakPolarHBondContact CB-O 3.32Å; T195-Y198 PolarHBondContact OG1-O 3.19Å; T195-L200 HydrophobicContact CG2-CB 4.04Å; T195-L200 HydrophobicContact CG2-CD2 3.86Å; T195-C352 VanDerWaalsContact CG2-SG 3.57Å; T195-C352 PolarHBondContact N-O 3.39Å; T195-C352 PolarHBondContact OG1-SG 3.34Å; T195-H353 WeakPolarHBondContact O-CA 3.24Å; T195-H353 PolarHBondContact OG1-N 2.8Å; T195-W384 VanDerWaalsContact CA-O 3.24Å; T195-W384 WeakPolarHBondContact CA-O 3.07Å
196	D	97.3	Very high	95.6	Very high	46 Å²	46	25.7 Å²	25.7	25%	0.246	12%	0.121	C	C	.	.	S	Bend	trans	-71.8	-65.7	179	-77.6	-28.8	0	0	0	115.2	K156 Y386	K156-D196 VanDerWaalsContact NZ-CA 3.31Å; K156-D196 IonicContact NZ-OD1 2.86Å; K156-D196 PolarHBondContact NZ-OD1 3.26Å; D196-Y386 VanDerWaalsContact OD1-CE2 3.3Å; D196-Y386 WeakPolarHBondContact OD1-CE2 3.42Å; D196-Y386 PolarHBondContact OD1-OH 3.19Å; D196-Y386 PolarHBondContact OD2-OH 2.66Å
197	N	95.8	Very high	95.5	Very high	115 Å²	115	26.5 Å²	26.5	62%	0.615	12%	0.122	S	C	*	.	S	Bend	trans	-126.9	-13.2	-161.2	-59	-52.5	0	0	0	113.7
198	Y	96.7	Very high	95.4	Very high	88 Å²	88	18.9 Å²	18.9	35%	0.345	9%	0.093	S	C	.	.	S	Bend	trans	-140.1	154	-170	-55.4	-73.1	0	0	0	110.6	T195 R381	T195-Y198 WeakPolarHBondContact CB-O 3.32Å; T195-Y198 PolarHBondContact OG1-O 3.19Å; Y198-R381 HydrophobicContact CD2-CB 4.18Å; Y198-R381 HydrophobicContact CD2-CG 4.49Å; Y198-R381 HydrophobicContact CE1-CG 4.42Å; Y198-R381 HydrophobicContact CE2-CB 4.09Å; Y198-R381 HydrophobicContact CE2-CG 4.03Å; Y198-R381 PolarHBondContact OH-NE 2.91Å
199	D	96.9	Very high	95.2	Very high	18 Å²	18	19.8 Å²	19.8	10%	0.096	10%	0.096	C	C	.	.			trans	-63.4	163.8	172.1	72.3	-55	0	0	0	111.8	R349 R350 H353 K383	D199-R349 IonicContact OD1-CZ 2.61Å; D199-R349 IonicContact OD1-NH2 3.9Å; D199-R349 PolarHBondContact OD1-NH2 2.86Å; D199-R349 WeakPolarHBondContact OD2-CB 3.36Å; D199-R349 IonicContact OD2-CZ 3.05Å; D199-R349 IonicContact OD2-NE 2.93Å; D199-R349 PolarHBondContact OD2-NE 2.62Å; D199-R349 IonicContact OD2-NH2 2.63Å; D199-R349 PolarHBondContact OD2-NH2 3.38Å; D199-R350 CarbonylContact C-O 3.51Å; D199-R350 WeakPolarHBondContact CA-O 3.44Å; D199-R350 VanDerWaalsContact CB-O 3.22Å; D199-R350 WeakPolarHBondContact CB-O 3.43Å; D199-H353 PolarHBondContact N-ND1 2.94Å; D199-K383 WeakPolarHBondContact O-CD 3.3Å; D199-K383 WeakPolarHBondContact O-CE 3.39Å
200	L	95.3	Very high	94.7	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	144.3	-179.8	-174.4	68.4	0	0	0	109.7	I170 T195 R350 F373 D374 N375 K383 L385	I170-L200 HydrophobicContact CD1-CD1 4.2Å; I170-L200 HydrophobicContact CD1-CD2 4.06Å; T195-L200 HydrophobicContact CG2-CB 4.04Å; T195-L200 HydrophobicContact CG2-CD2 3.86Å; L200-R350 PolarHBondContact N-O 2.97Å; L200-R350 PolarHBondContact O-N 2.82Å; L200-F373 HydrophobicContact CD2-CB 4.03Å; L200-F373 HydrophobicContact CD2-CD1 3.97Å; L200-F373 HydrophobicContact CD2-CG 4.44Å; L200-D374 WeakPolarHBondContact CD1-O 3.4Å; L200-N375 HydrophobicContact CD1-CB 3.95Å; L200-K383 HydrophobicContact CB-CD 4.28Å; L200-K383 HydrophobicContact CD1-CB 4.43Å; L200-K383 HydrophobicContact CD1-CD 3.51Å; L200-K383 HydrophobicContact CG-CD 4.46Å; L200-L385 HydrophobicContact CD2-CD1 3.91Å
201	G	95.3	Very high	94.2	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.01	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	132.9	171.9	0	0	0	0	0	110.1	Y348 F373 D374	G201-Y348 WeakPolarHBondContact CA-O 3.4Å; G201-F373 CarbonylContact O-C 3.53Å; G201-F373 WeakPolarHBondContact O-CA 3.38Å; G201-D374 WeakPolarHBondContact CA-O 2.95Å; G201-D374 PolarHBondContact N-O 2.83Å; G201-D374 PolarHBondContact O-N 2.83Å
202	F	96.5	Very high	93.8	Very high	3 Å²	3	28.6 Å²	28.6	1%	0.013	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	128.3	177	175.1	-103	0	0	0	111.1	W191 F193 L204 I345 I347 Y348 R350 F371 K372 F373	W191-F202 AromaticContact CD1-CZ 3.91Å; W191-F202 AromaticContact NE1-CE1 3.8Å; W191-F202 AromaticContact NE1-CZ 3.6Å; F193-F202 HydrophobicContact CD1-CD2 4.34Å; F193-F202 HydrophobicContact CD1-CE2 4.3Å; F193-F202 HydrophobicContact CE1-CB 4.39Å; F193-F202 AromaticContact CE1-CD1 3.88Å; F193-F202 HydrophobicContact CE1-CD1 3.88Å; F193-F202 AromaticContact CE1-CD2 3.7Å; F193-F202 HydrophobicContact CE1-CD2 3.7Å; F193-F202 HydrophobicContact CE1-CE1 4.03Å; F193-F202 AromaticContact CE1-CE2 3.85Å; F193-F202 HydrophobicContact CE1-CE2 3.85Å; F193-F202 AromaticContact CE1-CG 3.7Å; F193-F202 HydrophobicContact CE1-CG 3.7Å; F193-F202 HydrophobicContact CE1-CZ 4.02Å; F193-F202 HydrophobicContact CE2-CB 4.19Å; F193-F202 HydrophobicContact CE2-CD2 4.5Å; F193-F202 HydrophobicContact CE2-CG 4.34Å; F193-F202 HydrophobicContact CZ-CB 3.66Å; F193-F202 AromaticContact CZ-CD1 3.86Å; F193-F202 HydrophobicContact CZ-CD1 3.86Å; F193-F202 AromaticContact CZ-CD2 3.8Å; F193-F202 HydrophobicContact CZ-CD2 3.8Å; F193-F202 HydrophobicContact CZ-CE1 4.48Å; F193-F202 HydrophobicContact CZ-CE2 4.41Å; F193-F202 AromaticContact CZ-CG 3.47Å; F193-F202 HydrophobicContact CZ-CG 3.47Å; F193-F202 VanDerWaalsContact CZ-CG 3.47Å; F202-L204 HydrophobicContact CZ-CB 4.48Å; F202-I345 HydrophobicContact CE1-CD1 4.02Å; F202-I347 WeakPolarHBondContact O-CA 3.39Å; F202-Y348 PolarHBondContact N-O 2.82Å; F202-Y348 PolarHBondContact O-N 3.44Å; F202-R350 HydrophobicContact CB-CG 3.85Å; F202-F371 AromaticContact CE2-CD1 3.97Å; F202-F371 HydrophobicContact CE2-CD1 3.97Å; F202-F371 HydrophobicContact CZ-CD1 4.13Å; F202-K372 WeakPolarHBondContact CA-O 3.43Å; F202-F373 AromaticContact CD2-CD1 3.91Å; F202-F373 HydrophobicContact CD2-CD1 3.91Å; F202-F373 AromaticContact CD2-CE1 3.61Å; F202-F373 HydrophobicContact CD2-CE1 3.61Å; F202-F373 HydrophobicContact CD2-CZ 4.28Å; F202-F373 AromaticContact CE2-CE1 3.89Å; F202-F373 HydrophobicContact CE2-CE1 3.89Å; F202-F373 HydrophobicContact CE2-CZ 4.13Å
203	G	93.6	Very high	93.4	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	161.2	169.7	0	0	0	0	0	112.1	I345 K372	G203-I345 CarbonylContact C-O 3.58Å; G203-I345 WeakPolarHBondContact CA-O 3.28Å; G203-K372 PolarHBondContact N-O 3.5Å; G203-K372 PolarHBondContact O-N 2.68Å
204	L	95.2	Very high	92.9	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	130.9	-177.6	-175.2	63.3	0	0	0	109.8	W191 F202 L344 I345 Y369 F371	W191-L204 HydrophobicContact CE3-CD2 4.4Å; W191-L204 HydrophobicContact CH2-CD2 3.7Å; W191-L204 HydrophobicContact CZ2-CD2 4.22Å; W191-L204 HydrophobicContact CZ3-CD2 3.79Å; F202-L204 HydrophobicContact CZ-CB 4.48Å; L204-L344 HydrophobicContact CB-CB 4.35Å; L204-L344 HydrophobicContact CD2-CB 4.29Å; L204-L344 HydrophobicContact CD2-CD1 3.99Å; L204-L344 HydrophobicContact CG-CB 4.21Å; L204-L344 HydrophobicContact CG-CD1 4.05Å; L204-L344 WeakPolarHBondContact O-CA 3.36Å; L204-L344 WeakPolarHBondContact O-CB 3.46Å; L204-L344 PolarHBondContact O-N 2.75Å; L204-I345 HydrophobicContact CB-CB 3.87Å; L204-I345 HydrophobicContact CB-CD1 3.98Å; L204-I345 HydrophobicContact CB-CG1 4Å; L204-I345 HydrophobicContact CD2-CD1 4.1Å; L204-I345 PolarHBondContact N-O 3Å; L204-I345 PolarHBondContact O-N 3.09Å; L204-Y369 HydrophobicContact CD1-CD1 3.95Å; L204-Y369 HydrophobicContact CD2-CD1 4.23Å; L204-Y369 HydrophobicContact CD2-CE1 4.43Å; L204-Y369 HydrophobicContact CG-CD1 4.25Å; L204-F371 HydrophobicContact CD1-CD1 3.64Å; L204-F371 HydrophobicContact CD1-CD2 4.02Å; L204-F371 HydrophobicContact CD1-CE1 3.6Å; L204-F371 HydrophobicContact CD1-CE2 3.99Å; L204-F371 HydrophobicContact CD1-CG 3.85Å; L204-F371 HydrophobicContact CD1-CZ 3.78Å
205	Y	92.9	Very high	92.5	Very high	33 Å²	33	45.5 Å²	45.5	13%	0.129	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	159.2	176.2	-53.9	-99.9	0	0	0	110.1	I341 D342 E343 I347 Y369 V370 K372	Y205-I341 HydrophobicContact CD1-CG2 4.11Å; Y205-I341 HydrophobicContact CG-CG2 4.4Å; Y205-D342 CarbonylContact C-O 3.46Å; Y205-D342 WeakPolarHBondContact CA-O 3.37Å; Y205-D342 WeakPolarHBondContact CB-O 3.29Å; Y205-E343 HydrophobicContact CD1-CB 3.84Å; Y205-E343 HydrophobicContact CD1-CG 4.03Å; Y205-E343 HydrophobicContact CE1-CB 3.78Å; Y205-E343 HydrophobicContact CE1-CG 3.59Å; Y205-I347 HydrophobicContact CE2-CG1 4.45Å; Y205-Y369 CarbonylContact O-C 3.54Å; Y205-Y369 WeakPolarHBondContact O-CA 3.35Å; Y205-V370 PolarHBondContact N-O 3.36Å; Y205-V370 PolarHBondContact O-N 3.2Å; Y205-K372 HydrophobicContact CD2-CD 4.21Å; Y205-K372 HydrophobicContact CD2-CG 4.2Å; Y205-K372 HydrophobicContact CE2-CB 4.46Å; Y205-K372 HydrophobicContact CE2-CD 3.73Å; Y205-K372 HydrophobicContact CE2-CG 4.04Å
206	F	91.9	Very high	92.2	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	113.7	171.3	-170.4	-100.9	0	0	0	109.2	T182 W208 I341 D342 L344 P364 Y369	T182-F206 HydrophobicContact CG2-CE2 3.73Å; T182-F206 HydrophobicContact CG2-CZ 4.08Å; F206-W208 AromaticContact CD1-CD2 3.99Å; F206-W208 HydrophobicContact CD1-CD2 3.99Å; F206-W208 AromaticContact CD1-CE2 3.8Å; F206-W208 HydrophobicContact CD1-CG 4.21Å; F206-W208 HydrophobicContact CD1-CZ2 4.19Å; F206-W208 AromaticContact CD1-NE1 3.92Å; F206-W208 AromaticContact CE1-CD2 3.72Å; F206-W208 HydrophobicContact CE1-CD2 3.72Å; F206-W208 AromaticContact CE1-CE2 3.88Å; F206-W208 AromaticContact CE1-CE3 3.83Å; F206-W208 HydrophobicContact CE1-CE3 3.83Å; F206-W208 HydrophobicContact CE1-CG 4.21Å; F206-W208 HydrophobicContact CE1-CH2 4.22Å; F206-W208 HydrophobicContact CE1-CZ2 4.13Å; F206-W208 HydrophobicContact CE1-CZ3 4.09Å; F206-I341 CarbonylContact O-C 3.51Å; F206-I341 VanDerWaalsContact O-CA 3.31Å; F206-I341 WeakPolarHBondContact O-CA 3.22Å; F206-D342 HydrophobicContact CB-CB 4.42Å; F206-D342 PolarHBondContact N-O 2.87Å; F206-D342 PolarHBondContact O-N 2.87Å; F206-L344 HydrophobicContact CB-CD1 3.93Å; F206-L344 HydrophobicContact CB-CD2 4.26Å; F206-L344 HydrophobicContact CB-CG 4.14Å; F206-P364 HydrophobicContact CD1-CG 3.72Å; F206-P364 HydrophobicContact CD2-CG 4.11Å; F206-P364 HydrophobicContact CE1-CG 3.67Å; F206-P364 HydrophobicContact CE2-CG 4.06Å; F206-P364 HydrophobicContact CG-CG 3.94Å; F206-P364 HydrophobicContact CZ-CG 3.84Å; F206-Y369 HydrophobicContact CD2-CD1 4.11Å; F206-Y369 AromaticContact CD2-CD2 3.96Å; F206-Y369 HydrophobicContact CD2-CD2 3.96Å; F206-Y369 AromaticContact CD2-CE1 3.99Å; F206-Y369 HydrophobicContact CD2-CE1 3.99Å; F206-Y369 AromaticContact CD2-CE2 3.81Å; F206-Y369 HydrophobicContact CD2-CE2 3.81Å; F206-Y369 HydrophobicContact CD2-CG 4.11Å; F206-Y369 AromaticContact CD2-CZ 3.83Å; F206-Y369 HydrophobicContact CE2-CD2 4.01Å; F206-Y369 AromaticContact CE2-CE2 3.71Å; F206-Y369 HydrophobicContact CE2-CE2 3.71Å
207	E	89.7	Confident	91.9	Very high	29 Å²	29	50.1 Å²	50.1	14%	0.136	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	118	173.3	-174.6	179.3	111.2	0	0	108.5	R179 D209 L339 I341 G367 V368 V370	R179-E207 IonicContact CZ-OE1 3.28Å; R179-E207 IonicContact CZ-OE2 2.74Å; R179-E207 IonicContact NH1-OE1 3.69Å; R179-E207 IonicContact NH1-OE2 3.15Å; R179-E207 PolarHBondContact NH1-OE2 3.37Å; R179-E207 VanDerWaalsContact NH2-CD 3.34Å; R179-E207 IonicContact NH2-OE1 2.99Å; R179-E207 PolarHBondContact NH2-OE1 2.88Å; R179-E207 IonicContact NH2-OE2 3.03Å; R179-E207 PolarHBondContact NH2-OE2 3.38Å; E207-D209 PolarHBondContact O-N 3.47Å; E207-L339 HydrophobicContact CG-CB 3.85Å; E207-L339 HydrophobicContact CG-CD1 4.28Å; E207-I341 HydrophobicContact CB-CG1 4.09Å; E207-I341 HydrophobicContact CG-CD1 4.48Å; E207-I341 HydrophobicContact CG-CG1 3.96Å; E207-G367 CarbonylContact O-C 3.54Å; E207-G367 VanDerWaalsContact O-CA 3.29Å; E207-G367 WeakPolarHBondContact O-CA 3.19Å; E207-V368 HydrophobicContact CB-CB 4.38Å; E207-V368 PolarHBondContact N-O 3Å; E207-V368 PolarHBondContact O-N 2.78Å; E207-V370 HydrophobicContact CB-CG2 4.2Å
208	W	88.6	Confident	91.7	Very high	6 Å²	6	47.6 Å²	47.6	2%	0.023	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	120.8	179.7	-72.2	91.8	0	0	0	109.9	Q107 L114 F206 L339 P340 D342 P364	Q107-W208 HydrophobicContact CG-CH2 3.88Å; Q107-W208 HydrophobicContact CG-CZ2 3.76Å; L114-W208 HydrophobicContact CD1-CB 3.57Å; L114-W208 HydrophobicContact CD1-CD2 4.49Å; L114-W208 HydrophobicContact CD1-CE3 4.21Å; L114-W208 HydrophobicContact CD1-CG 4.29Å; L114-W208 HydrophobicContact CD2-CB 4.03Å; L114-W208 WeakPolarHBondContact CD2-O 3.36Å; L114-W208 HydrophobicContact CG-CB 4.09Å; F206-W208 AromaticContact CD1-CD2 3.99Å; F206-W208 HydrophobicContact CD1-CD2 3.99Å; F206-W208 AromaticContact CD1-CE2 3.8Å; F206-W208 HydrophobicContact CD1-CG 4.21Å; F206-W208 HydrophobicContact CD1-CZ2 4.19Å; F206-W208 AromaticContact CD1-NE1 3.92Å; F206-W208 AromaticContact CE1-CD2 3.72Å; F206-W208 HydrophobicContact CE1-CD2 3.72Å; F206-W208 AromaticContact CE1-CE2 3.88Å; F206-W208 AromaticContact CE1-CE3 3.83Å; F206-W208 HydrophobicContact CE1-CE3 3.83Å; F206-W208 HydrophobicContact CE1-CG 4.21Å; F206-W208 HydrophobicContact CE1-CH2 4.22Å; F206-W208 HydrophobicContact CE1-CZ2 4.13Å; F206-W208 HydrophobicContact CE1-CZ3 4.09Å; W208-L339 WeakPolarHBondContact O-CB 3.14Å; W208-P340 HydrophobicContact CB-CB 4.35Å; W208-P340 PolarHBondContact N-O 3.21Å; W208-D342 PolarHBondContact NE1-OD2 2.83Å; W208-P364 HydrophobicContact CH2-CB 4.01Å; W208-P364 HydrophobicContact CH2-CG 4.34Å; W208-P364 WeakPolarHBondContact CH2-O 3.29Å; W208-P364 HydrophobicContact CZ2-CB 4.17Å; W208-P364 HydrophobicContact CZ2-CG 4.34Å
209	D	87.8	Confident	91.4	Very high	30 Å²	30	47.9 Å²	47.9	16%	0.16	25%	0.251	C	S	.	.			trans	-147.2	123.9	179.6	-166.5	-11.6	0	0	0	108.7	E207 E211 P212 L339 V366 G367 V368	E207-D209 PolarHBondContact O-N 3.47Å; D209-E211 VanDerWaalsContact C-N 3.29Å; D209-E211 PolarHBondContact OD1-N 2.82Å; D209-P212 HydrophobicContact CB-CB 4.25Å; D209-P212 WeakPolarHBondContact OD2-CA 3.45Å; D209-L339 HydrophobicContact CB-CD1 3.82Å; D209-V366 CarbonylContact O-C 3.52Å; D209-V366 WeakPolarHBondContact O-CG1 3.35Å; D209-V366 VanDerWaalsContact O-O 3.1Å; D209-G367 WeakPolarHBondContact O-CA 3.48Å; D209-G367 PolarHBondContact O-N 3.49Å; D209-V368 HydrophobicContact CB-CG2 4.4Å
210	L	85.9	Confident	90.9	Very high	38 Å²	38	50.7 Å²	50.7	20%	0.199	27%	0.265	C	S	.	.	S	Bend	trans	-80.6	-17.3	179.1	-61.5	173.7	0	0	0	112.1	L114 K118 F135 P136 P212	L114-L210 HydrophobicContact CB-CD1 4.4Å; L114-L210 HydrophobicContact CD1-CD2 4.35Å; L114-L210 HydrophobicContact CD1-CG 4.33Å; K118-L210 HydrophobicContact CD-CD1 4.11Å; F135-L210 HydrophobicContact CD1-CD1 3.95Å; F135-L210 HydrophobicContact CE1-CD1 3.31Å; F135-L210 HydrophobicContact CZ-CD1 3.67Å; P136-L210 HydrophobicContact CG-CD2 4.26Å; L210-P212 VanDerWaalsContact C-CD 3.43Å
211	E	87.4	Confident	90.3	Very high	140 Å²	140	53.9 Å²	53.9	65%	0.654	29%	0.287	S	S	*	.	S	Bend	trans	-131.5	57.7	-178.9	-68.1	171	-164	0	0	108.9	K118 D209	K118-E211 WeakPolarHBondContact CE-OE1 3.32Å; K118-E211 IonicContact NZ-OE1 3.08Å; K118-E211 PolarHBondContact NZ-OE1 2.93Å; D209-E211 VanDerWaalsContact C-N 3.29Å; D209-E211 PolarHBondContact OD1-N 2.82Å
212	P	89	Confident	89.1	Confident	30 Å²	30	59.5 Å²	59.5	20%	0.195	31%	0.313	C	S	.	.			trans	-63.1	150.9	-174.9	30.6	-36.4	0	0	0	110.3	P181 D209 L210 V366 V368	P181-P212 HydrophobicContact CB-CB 4.2Å; D209-P212 HydrophobicContact CB-CB 4.25Å; D209-P212 WeakPolarHBondContact OD2-CA 3.45Å; L210-P212 VanDerWaalsContact C-CD 3.43Å; P212-V366 HydrophobicContact CG-CG1 3.79Å; P212-V368 HydrophobicContact CB-CG2 3.71Å
213	P	90.6	Very high	87.2	Confident	61 Å²	61	62.6 Å²	62.6	40%	0.396	34%	0.336	S	S	.	.			trans	-59.6	152.2	177.2	24.9	-32.2	0	0	0	110.6	P181 N215	P181-P213 WeakPolarHBondContact CB-O 3.49Å; P181-P213 HydrophobicContact CG-CG 4.13Å; P181-P213 WeakPolarHBondContact CG-O 3.24Å; P213-N215 VanDerWaalsContact C-N 3.32Å; P213-N215 PolarHBondContact O-N 2.97Å
214	E	88	Confident	84.9	Confident	190 Å²	190	68.2 Å²	68.2	89%	0.888	38%	0.375	S	S	*	.	S	Bend	trans	-75.2	-24.1	179.1	-64.7	-177.3	169.4	0	0	112.9
215	N	88.9	Confident	82.7	Confident	126 Å²	126	75.6 Å²	75.6	67%	0.674	41%	0.414	S	S	*	.	S	Bend	trans	-103.4	142.4	-170.8	-63.9	-46.1	0	0	0	112.3	P213	P213-N215 VanDerWaalsContact C-N 3.32Å; P213-N215 PolarHBondContact O-N 2.97Å
216	I	92.5	Very high	80.4	Confident	103 Å²	103	81.4 Å²	81.4	53%	0.528	44%	0.443	S	S	.	.			trans	-67	137.3	165.2	-62.1	173.5	0	0	0	108.5	V178 R179 V180	V178-I216 HydrophobicContact CG1-CG2 4.01Å; R179-I216 WeakPolarHBondContact O-CA 3.47Å; V180-I216 HydrophobicContact CG1-CD1 4.28Å; V180-I216 HydrophobicContact CG1-CG1 4.25Å; V180-I216 HydrophobicContact CG2-CG1 4.5Å; V180-I216 HydrophobicContact CG2-CG2 4.23Å
217	S	90.9	Very high	78.2	Confident	41 Å²	41	91.4 Å²	91.4	29%	0.287	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	145.4	174	52.1	0	0	0	0	111.5	V178 R179	V178-S217 CarbonylContact C-O 3.51Å; V178-S217 WeakPolarHBondContact CA-O 3.34Å; R179-S217 WeakPolarHBondContact CB-OG 3.38Å; R179-S217 PolarHBondContact N-O 2.79Å; R179-S217 PolarHBondContact O-N 3Å; R179-S217 VanDerWaalsContact O-N 3.11Å
218	V	91.9	Very high	75.9	Confident	62 Å²	62	93.6 Å²	93.6	38%	0.376	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	121.1	177.1	-176.6	0	0	0	0	107.9	I168 T177 V178	I168-V218 HydrophobicContact CD1-CG1 4.12Å; T177-V218 WeakPolarHBondContact O-CA 3.42Å; V178-V218 HydrophobicContact CG1-CG2 4.16Å; V178-V218 HydrophobicContact CG2-CG1 4.28Å; V178-V218 HydrophobicContact CG2-CG2 4.17Å
219	N	89.9	Confident	73.8	Confident	95 Å²	95	97.1 Å²	97.1	51%	0.508	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.1	126.6	-178.8	-66.6	49.1	0	0	0	108.8	A176 T177	A176-N219 CarbonylContact C-O 3.59Å; A176-N219 WeakPolarHBondContact CA-O 3.46Å; T177-N219 PolarHBondContact N-O 2.97Å; T177-N219 PolarHBondContact O-N 2.93Å
220	I	87.2	Confident	71.5	Confident	76 Å²	76	104.1 Å²	104.1	39%	0.39	59%	0.59	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.6	113.1	172.6	-57.1	177.1	0	0	0	106.9	A174 A176 E222	A174-I220 HydrophobicContact CB-CG2 4.36Å; A176-I220 HydrophobicContact CB-CG1 4.13Å; I220-E222 HydrophobicContact CG2-CG 4.39Å
221	S	82.9	Confident	69.6	Low	67 Å²	67	108.6 Å²	108.6	47%	0.469	61%	0.614	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.6	116.4	172.6	56.7	0	0	0	0	108.6	A174 T175	A174-S221 CarbonylContact C-O 3.22Å; A174-S221 VanDerWaalsContact CA-O 3.27Å; A174-S221 WeakPolarHBondContact CA-O 3.32Å; A174-S221 WeakPolarHBondContact CB-O 3.4Å; T175-S221 PolarHBondContact N-O 3.34Å; T175-S221 PolarHBondContact O-N 2.89Å; T175-S221 PolarHBondContact O-OG 3.1Å
222	E	70.2	Confident	67.4	Low	119 Å²	119	110.1 Å²	110.1	56%	0.556	62%	0.621	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-92	134.1	168.7	-57.2	-173.2	149.2	0	0	107.5	S171 A174 I220 S224	S171-E222 WeakPolarHBondContact CB-OE1 3.37Å; S171-E222 PolarHBondContact OG-OE1 2.92Å; A174-E222 HydrophobicContact CB-CB 4.5Å; A174-E222 HydrophobicContact CB-CG 4.02Å; I220-E222 HydrophobicContact CG2-CG 4.39Å; E222-S224 PolarHBondContact O-N 3.47Å
223	S	55.5	Low	65.2	Low	69 Å²	69	116.8 Å²	116.8	48%	0.483	66%	0.655	S	S	.	*			trans	-64	108.5	169.7	59.6	0	0	0	0	107.8	L173 D225	L173-S223 VanDerWaalsContact CB-OG 3.31Å; L173-S223 WeakPolarHBondContact CB-OG 3.43Å; L173-S223 PolarHBondContact O-N 2.77Å; L173-S223 PolarHBondContact O-OG 2.73Å; S223-D225 PolarHBondContact O-N 2.78Å
224	S	46	Very low	62.9	Low	118 Å²	118	123 Å²	123	83%	0.825	68%	0.679	S	S	*	*	S	Bend	trans	-73	61.3	-172.2	173.5	0	0	0	0	112.8	E222	E222-S224 PolarHBondContact O-N 3.47Å
225	D	49.7	Very low	60.7	Low	155 Å²	155	123.3 Å²	123.3	83%	0.829	68%	0.68	S	S	*	*			trans	-139.4	15.4	-179	-109.4	-6.5	0	0	0	116.5	S223	S223-D225 PolarHBondContact O-N 2.78Å
226	E	43.3	Very low	58.1	Low	155 Å²	155	120.5 Å²	120.5	72%	0.724	68%	0.681	S	S	*	*			trans	-126.2	81.3	168.8	-65.3	-157.7	-172.9	0	0	112.4
227	E	45.5	Very low	55.4	Low	209 Å²	209	121.8 Å²	121.8	98%	0.977	70%	0.696	S	S	*	*			trans	-82.2	106.6	147.3	-78.2	-143.9	-177.2	0	0	108.4
228	G	43.3	Very low	52.8	Low	75 Å²	75	127.7 Å²	127.7	77%	0.773	73%	0.725	S	S	*	*			trans	142.1	85.2	163.6	0	0	0	0	0	115.2
229	G	44	Very low	50.1	Low	81 Å²	81	130.3 Å²	130.3	84%	0.835	75%	0.746	S	S	*	*			trans	-178.7	84.9	168.6	0	0	0	0	0	111.8
230	E	40.1	Very low	47.6	Very low	176 Å²	176	129.4 Å²	129.4	82%	0.822	76%	0.759	S	S	*	*			trans	-65.7	163.3	167.5	-61.8	173.6	152.8	0	0	110.7
231	D	45	Very low	44.9	Very low	132 Å²	132	133.9 Å²	133.9	71%	0.706	78%	0.784	S	S	*	*			trans	92	96.6	162.4	-46.3	-27.6	0	0	0	116.3
232	E	40.8	Very low	43	Very low	172 Å²	172	136.6 Å²	136.6	80%	0.804	80%	0.803	S	S	*	*				79.7	116.8	88.2	-77.5	-174	-172.9	0	0	112.4
233	D	42.2	Very low	41.9	Very low	170 Å²	170	136.3 Å²	136.3	91%	0.909	81%	0.809	S	S	*	*			trans	-174.5	89.2	143	-86.7	-24.8	0	0	0	109.1
234	E	42.6	Very low	41.3	Very low	192 Å²	192	141.5 Å²	141.5	90%	0.897	83%	0.825	S	S	*	*			trans	-80	122.3	153.6	-80.5	-151.3	167.1	0	0	108.7
235	E	42.1	Very low	41	Very low	196 Å²	196	143.7 Å²	143.7	92%	0.916	82%	0.823	S	S	*	*			trans	-139.8	106	149.5	-78.9	-152.8	164.1	0	0	111.2
236	G	34.7	Very low	40.4	Very low	67 Å²	67	143.2 Å²	143.2	69%	0.691	83%	0.825	S	S	*	*			trans	-81	167.7	157.3	0	0	0	0	0	112
237	P	36.5	Very low	40	Very low	131 Å²	131	141.3 Å²	141.3	85%	0.851	83%	0.829	S	S	*	*			trans	-92	148.1	-141	34.9	-34.6	0	0	0	113.8
238	N	36.5	Very low	40	Very low	165 Å²	165	136.7 Å²	136.7	88%	0.882	82%	0.818	S	S	*	*			trans	-118.4	112.3	171.3	-138.4	0.9	0	0	0	112.1
239	S	34.5	Very low	39.8	Very low	117 Å²	117	142.2 Å²	142.2	82%	0.818	82%	0.82	S	S	*	*			trans	-74.6	131.2	166	58	0	0	0	0	110.3
240	G	36.5	Very low	39.5	Very low	76 Å²	76	144.8 Å²	144.8	78%	0.784	82%	0.815	S	S	*	*			trans	-161.2	92.6	173.2	0	0	0	0	0	112.2
241	N	30.7	Very low	39.4	Very low	170 Å²	170	144.4 Å²	144.4	91%	0.909	81%	0.813	S	S	*	*			trans	-61.1	139.8	167.6	-75.6	-27.4	0	0	0	111.1
242	S	42.9	Very low	39	Very low	124 Å²	124	145.4 Å²	145.4	87%	0.867	82%	0.818	S	S	*	*			trans	-160	149.1	133.6	-143	0	0	0	0	113
243	V	47.2	Very low	38.8	Very low	113 Å²	113	146.1 Å²	146.1	69%	0.685	82%	0.819	S	S	*	*			trans	-97.3	151	-163.4	167.6	0	0	0	0	110.7
244	E	42.9	Very low	38.4	Very low	177 Å²	177	147 Å²	147	83%	0.827	82%	0.817	S	S	*	*			trans	165.2	105.4	133.5	-91.7	-177.6	161.2	0	0	110.4
245	Q	39.5	Very low	37.7	Very low	165 Å²	165	142.8 Å²	142.8	77%	0.771	81%	0.809	S	S	*	*				62.9	110.4	96.1	-76.4	-168.2	32.7	0	0	115.9
246	T	37.3	Very low	37.3	Very low	144 Å²	144	141.8 Å²	141.8	88%	0.883	80%	0.804	S	S	*	*				-177.3	132.8	116.8	36.7	0	0	0	0	111.4
247	S	36.1	Very low	37.1	Very low	116 Å²	116	145.3 Å²	145.3	81%	0.811	81%	0.807	S	S	*	*			trans	-121.7	-169.7	177.6	-57.2	0	0	0	0	108.2
248	P	45	Very low	36.9	Very low	112 Å²	112	147.3 Å²	147.3	73%	0.727	81%	0.81	S	S	*	*				-130.3	-176.9	-59.8	33.7	-16.1	0	0	0	111.2
249	K	38.9	Very low	36.6	Very low	191 Å²	191	148.5 Å²	148.5	83%	0.83	81%	0.81	S	S	*	*			trans	171.1	150.7	134.4	-97.9	169.5	-177.4	-177.7	0	117.1
250	N	37.4	Very low	36.4	Very low	134 Å²	134	151.4 Å²	151.4	72%	0.717	82%	0.816	S	S	*	*			trans	80.5	104.2	160.2	-68.2	3.7	0	0	0	118
251	E	37.4	Very low	36.1	Very low	168 Å²	168	151 Å²	151	79%	0.785	81%	0.811	S	S	*	*				66	102.3	65.5	-66.5	-169.6	175.2	0	0	114.9
252	N	37	Very low	36	Very low	153 Å²	153	152.8 Å²	152.8	82%	0.818	81%	0.811	S	S	*	*				-178.4	150.6	111.2	-95.1	-35.6	0	0	0	114.4
253	K	37	Very low	35.5	Very low	188 Å²	188	156.8 Å²	156.8	82%	0.817	81%	0.812	S	S	*	*			trans	-45.2	157.2	174.4	-66.9	159.8	171.4	172.1	0	113
254	E	33.8	Very low	34.6	Very low	188 Å²	188	156.7 Å²	156.7	88%	0.879	82%	0.817	S	S	*	*				-178.6	149	65.2	-159.7	165.4	-155.6	0	0	110.3
255	S	27.7	Very low	34	Very low	103 Å²	103	156.3 Å²	156.3	72%	0.72	82%	0.82	S	S	*	*			trans	-84.5	136.5	178.5	48.8	0	0	0	0	112.9
256	H	34.5	Very low	33.5	Very low	176 Å²	176	157.3 Å²	157.3	82%	0.815	82%	0.824	S	S	*	*			trans	-167.3	144.4	140.5	-130.9	-81.9	0	0	0	113
257	D	29.4	Very low	33.2	Very low	141 Å²	141	159.6 Å²	159.6	75%	0.754	83%	0.825	S	S	*	*			trans	-54.2	148.4	-178.7	-56	-63	0	0	0	115.9
258	L	33.1	Very low	32.9	Very low	173 Å²	173	163 Å²	163	91%	0.906	82%	0.82	S	S	*	*			trans	-140.3	116.3	159.3	-95.5	156.5	0	0	0	110.9
259	E	29.3	Very low	32.4	Very low	189 Å²	189	165.1 Å²	165.1	88%	0.883	83%	0.825	S	S	*	*			trans	-50.2	135.2	171.5	-73.9	171.6	115.6	0	0	113.5
260	L	32	Very low	32.4	Very low	179 Å²	179	162 Å²	162	94%	0.937	82%	0.823	S	S	*	*			trans	-104.4	105.7	161.7	-102.6	156.2	0	0	0	110.1
261	G	29.4	Very low	32.1	Very low	67 Å²	67	162.3 Å²	162.3	69%	0.691	82%	0.824	S	S	*	*			trans	-72.3	155.9	174.8	0	0	0	0	0	114.4
262	K	28.6	Very low	31.8	Very low	208 Å²	208	161.3 Å²	161.3	90%	0.904	82%	0.824	S	S	*	*			trans	-51.3	127.9	174.1	-57.6	164.7	179	176.2	0	112.9
263	K	32.7	Very low	31.5	Very low	207 Å²	207	163.2 Å²	163.2	90%	0.9	83%	0.828	S	S	*	*			trans	-148.5	125.6	144.3	-73.2	-165.3	180	172.5	0	111.3
264	S	27.8	Very low	31.3	Very low	111 Å²	111	161.3 Å²	161.3	78%	0.776	83%	0.826	S	S	*	*			trans	-64.3	136.9	166.5	54	0	0	0	0	111.8
265	L	30.6	Very low	31.3	Very low	170 Å²	170	158.8 Å²	158.8	89%	0.89	82%	0.817	S	S	*	*			trans	-164.2	126.5	147.2	-113.8	144.9	0	0	0	110.9
266	Q	28.4	Very low	31.5	Very low	186 Å²	186	157.6 Å²	157.6	87%	0.869	81%	0.807	S	S	*	*			trans	-63.7	130	174.4	-68.1	159.3	-21.7	0	0	110.3
267	Q	31.2	Very low	31.3	Very low	192 Å²	192	156.5 Å²	156.5	90%	0.897	81%	0.805	S	S	*	*			trans	-150.8	109	157.8	-108.3	168.4	-0.2	0	0	107.8
268	R	30.9	Very low	31.2	Very low	186 Å²	186	155.3 Å²	155.3	70%	0.702	79%	0.791	S	S	*	*			trans	-79.7	139.2	167.3	-72.5	-176.5	-165	-165.9	-0.2	108
269	L	33.7	Very low	31.2	Very low	158 Å²	158	157.8 Å²	157.8	83%	0.827	79%	0.789	S	S	*	*			trans	-110	153.2	163.5	-72.2	170.2	0	0	0	109.7
270	P	38.7	Very low	31.3	Very low	124 Å²	124	159.3 Å²	159.3	81%	0.805	79%	0.786	S	S	*	*			trans	-70.2	136.6	-161.7	-15	31.2	0	0	0	112.6
271	I	31.7	Very low	31.4	Very low	141 Å²	141	157.1 Å²	157.1	72%	0.723	78%	0.775	S	S	*	*			trans	-80.7	109.8	165.6	-67.3	160.5	0	0	0	104.9
272	D	29.7	Very low	31.3	Very low	148 Å²	148	158.8 Å²	158.8	79%	0.791	78%	0.775	S	S	*	*			trans	166.3	78.1	158	-82.4	-21.3	0	0	0	107.9
273	E	31.6	Very low	31.2	Very low	192 Å²	192	156.7 Å²	156.7	90%	0.897	77%	0.769	S	S	*	*			trans	178.4	83.8	165.5	-105.7	166.6	-150	0	0	110.7
274	L	32.2	Very low	31.1	Very low	149 Å²	149	153 Å²	153	78%	0.78	76%	0.763	S	S	*	*			trans	-164.9	70	157	-101.5	144.8	0	0	0	108.2
275	I	33.4	Very low	31.3	Very low	134 Å²	134	156.2 Å²	156.2	69%	0.687	77%	0.766	S	S	*	*			trans	-91.1	127.7	168.5	-64.1	173.8	0	0	0	107.2	I277	I275-I277 PolarHBondContact O-N 3.18Å
276	P	32.1	Very low	31.4	Very low	78 Å²	78	154.4 Å²	154.4	51%	0.506	76%	0.762	S	S	.	*			trans	-59.5	122.7	172.2	-20.7	31.9	0	0	0	110.5	Y278 Y348	P276-Y278 PolarHBondContact O-N 3.42Å; P276-Y348 HydrophobicContact CB-CD1 4.15Å; P276-Y348 HydrophobicContact CB-CE1 3.29Å; P276-Y348 HydrophobicContact CG-CE1 4.35Å
277	I	30.2	Very low	31.4	Very low	153 Å²	153	155.1 Å²	155.1	79%	0.785	76%	0.758	S	S	*	*			trans	-64.4	92.3	-177.2	-59.6	164	0	0	0	109.2	I275	I275-I277 PolarHBondContact O-N 3.18Å
278	Y	27.9	Very low	31.4	Very low	116 Å²	116	152.1 Å²	152.1	46%	0.455	76%	0.756	S	S	.	*	S	Bend	trans	-96.1	118.4	145.8	-94.2	-88.5	0	0	0	107.2	P276 R280 P346 I347 Y348	P276-Y278 PolarHBondContact O-N 3.42Å; Y278-R280 VanDerWaalsContact C-N 3.34Å; Y278-R280 PolarHBondContact O-N 3.38Å; Y278-P346 HydrophobicContact CE2-CB 4.41Å; Y278-I347 WeakPolarHBondContact CE2-O 3.46Å; Y278-I347 WeakPolarHBondContact OH-CA 2.97Å; Y278-I347 WeakPolarHBondContact OH-CB 3.21Å; Y278-I347 PolarHBondContact OH-N 2.9Å; Y278-I347 PolarHBondContact OH-O 2.73Å; Y278-Y348 AromaticContact CD2-CE1 4Å; Y278-Y348 HydrophobicContact CD2-CE1 4Å; Y278-Y348 HydrophobicContact CE2-CD1 4.35Å; Y278-Y348 AromaticContact CE2-CE1 3.82Å; Y278-Y348 HydrophobicContact CE2-CE1 3.82Å
279	R	33.2	Very low	31.2	Very low	226 Å²	226	150.6 Å²	150.6	85%	0.853	76%	0.758	S	S	*	*			trans	43.8	52.7	149.7	-149.1	-172.7	-137.9	156.5	3.3	114.5
280	R	31.7	Very low	31.3	Very low	220 Å²	220	148.1 Å²	148.1	83%	0.83	75%	0.753	S	S	*	*			trans	-93.9	101.8	155.9	-128.9	-176.9	-170.5	126.5	-2.2	105.7	Y278 C282	Y278-R280 VanDerWaalsContact C-N 3.34Å; Y278-R280 PolarHBondContact O-N 3.38Å; R280-C282 PolarHBondContact O-N 3.4Å
281	D	33.4	Very low	31.1	Very low	133 Å²	133	149.9 Å²	149.9	71%	0.711	75%	0.75	S	S	*	*			trans	-38.3	122.5	171.5	-60.5	-53.5	0	0	0	110.5	H283	D281-H283 PolarHBondContact O-N 3.48Å
282	C	27.7	Very low	31.1	Very low	102 Å²	102	149.3 Å²	149.3	69%	0.689	75%	0.749	S	S	*	*	S	Bend		12.7	98.4	119.2	-164.8	0	0	0	0	113.8	R280	R280-C282 PolarHBondContact O-N 3.4Å
283	H	27.5	Very low	31.5	Very low	165 Å²	165	150.3 Å²	150.3	76%	0.764	75%	0.753	S	S	*	*			trans	77.7	143.8	164.2	-54.3	-64.7	0	0	0	119.2	D281	D281-H283 PolarHBondContact O-N 3.48Å
284	T	29	Very low	31.5	Very low	128 Å²	128	148.9 Å²	148.9	79%	0.785	75%	0.746	S	S	*	*			trans	90.4	107	178.1	-26	0	0	0	0	111.3
285	E	33.6	Very low	31.6	Very low	179 Å²	179	149.7 Å²	149.7	84%	0.836	75%	0.751	S	S	*	*				-158	116	63	-71.9	167.1	167	0	0	107.9
286	V	32.4	Very low	31.6	Very low	132 Å²	132	146.3 Å²	146.3	80%	0.8	75%	0.749	S	S	*	*				40.6	99.2	88.1	-167	0	0	0	0	114.8
287	Y	27	Very low	31.6	Very low	202 Å²	202	150.1 Å²	150.1	79%	0.792	76%	0.757	S	S	*	*			trans	-0.9	127.4	147.9	-103.6	-99.7	0	0	0	117.4	E289	Y287-E289 HydrophobicContact CE1-CG 4.49Å
288	C	31.9	Very low	31.7	Very low	128 Å²	128	153 Å²	153	87%	0.865	76%	0.764	S	S	*	*			trans	-151.6	114.2	136.9	-151.6	0	0	0	0	111.5
289	E	27.6	Very low	32.2	Very low	155 Å²	155	152.4 Å²	152.4	72%	0.724	78%	0.778	S	S	*	*			trans	-65.9	141.2	165.5	-66.4	171.7	147.5	0	0	110.3	Y287	Y287-E289 HydrophobicContact CE1-CG 4.49Å
290	S	36	Very low	32.4	Very low	105 Å²	105	146.8 Å²	146.8	73%	0.734	76%	0.764	S	S	*	*				158.4	130.9	124.5	49.9	0	0	0	0	115.1
291	H	34.3	Very low	32.6	Very low	162 Å²	162	144.9 Å²	144.9	75%	0.75	76%	0.764	S	S	*	*			trans	75.9	111	146.1	-85.1	-86.7	0	0	0	123.2
292	D	32	Very low	32.8	Very low	128 Å²	128	147.5 Å²	147.5	68%	0.684	77%	0.772	S	S	*	*			trans	54.2	111.1	133.3	-65.6	-30.5	0	0	0	121.4
293	L	36.7	Very low	33.4	Very low	169 Å²	169	152.8 Å²	152.8	89%	0.885	78%	0.778	S	S	*	*			trans	-159.7	82.6	139.4	-102.4	139.4	0	0	0	111.1	L295	L293-L295 PolarHBondContact O-N 3.46Å
294	E	31.3	Very low	34.3	Very low	162 Å²	162	147.2 Å²	147.2	76%	0.757	75%	0.753	S	S	*	*			trans	-70.4	96.7	157.3	-76.5	-166.8	130.6	0	0	109.3
295	L	34.7	Very low	35.2	Very low	167 Å²	167	144 Å²	144	87%	0.874	74%	0.735	S	S	*	*			trans	-177.3	94.5	159.7	-97.1	152.5	0	0	0	108.5	L293	L293-L295 PolarHBondContact O-N 3.46Å
296	G	34.8	Very low	35.7	Very low	63 Å²	63	137.2 Å²	137.2	65%	0.649	70%	0.704	S	S	*	*			trans	170.7	-9.1	178.7	0	0	0	0	0	115.3	K298	G296-K298 PolarHBondContact O-N 3.05Å
297	K	31.8	Very low	36.2	Very low	157 Å²	157	136.5 Å²	136.5	68%	0.683	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	80	-178	-62.9	174.7	-177.8	168.4	0	111.5
298	K	32.3	Very low	37.1	Very low	213 Å²	213	133.2 Å²	133.2	93%	0.926	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-158.4	4.1	163.1	-109.4	161.4	-165.6	-172	0	118.9	G296	G296-K298 PolarHBondContact O-N 3.05Å
299	S	37.7	Very low	37.9	Very low	105 Å²	105	128.5 Å²	128.5	73%	0.734	65%	0.653	S	S	*	*	S	Bend	trans	-137.3	22.9	-177.9	77.4	0	0	0	0	117.6
300	L	38.3	Very low	38.8	Very low	107 Å²	107	121.8 Å²	121.8	56%	0.56	62%	0.622	S	S	*	*			trans	-114.4	71.7	-174.5	-80.7	158.8	0	0	0	111.9
301	Q	34.2	Very low	39.1	Very low	180 Å²	180	118.4 Å²	118.4	84%	0.841	60%	0.598	S	S	*	*	S	Bend	trans	-134.6	15.1	177.1	-107.8	176.1	-7.9	0	0	114.3
302	Q	37.7	Very low	39.5	Very low	189 Å²	189	115.5 Å²	115.5	88%	0.883	59%	0.587	S	S	*	*			trans	-147.4	35.4	-171.7	-81.6	-176.2	-25.1	0	0	115.6
303	R	41.9	Very low	39.9	Very low	212 Å²	212	111.3 Å²	111.3	80%	0.8	56%	0.561	S	S	*	*			trans	-124.5	105.9	172.7	-87.7	-173.9	-95.4	-159.3	-3.7	111.6
304	L	44.9	Very low	40	Very low	49 Å²	49	111.8 Å²	111.8	26%	0.257	55%	0.552	S	S	.	*			trans	-68.8	156.5	160	-73.2	165.4	0	0	0	109.3	Y68 M87 I306	Y68-L304 HydrophobicContact CD1-CD2 4.03Å; Y68-L304 HydrophobicContact CD2-CD2 4.39Å; Y68-L304 HydrophobicContact CE1-CD2 3.44Å; Y68-L304 VanDerWaalsContact CE1-CD2 3.44Å; Y68-L304 HydrophobicContact CE2-CD2 3.84Å; Y68-L304 HydrophobicContact CG-CD2 4.47Å; Y68-L304 WeakPolarHBondContact OH-CD2 3.36Å; M87-L304 HydrophobicContact CG-CD1 3.58Å; M87-L304 HydrophobicContact SD-CD1 3.58Å; M87-L304 VanDerWaalsContact SD-CD1 3.58Å; M87-L304 HydrophobicContact SD-CD2 4.14Å; L304-I306 HydrophobicContact CB-CG1 4.35Å; L304-I306 PolarHBondContact O-N 3.44Å
305	P	48.4	Very low	39.9	Very low	60 Å²	60	109.6 Å²	109.6	39%	0.39	54%	0.536	S	S	.	.	S	Bend	trans	-74.9	62.6	178	33	-34.3	0	0	0	110.6	D307 E308	P305-D307 PolarHBondContact O-N 3Å; P305-E308 HydrophobicContact CB-CB 4.22Å; P305-E308 HydrophobicContact CB-CG 4.11Å; P305-E308 PolarHBondContact O-N 3.36Å
306	I	44.1	Very low	40	Very low	36 Å²	36	107.2 Å²	107.2	19%	0.185	53%	0.525	C	S	.	.	H	α-helix	trans	-65.7	-28.9	172.6	-69	171.6	0	0	0	109.8	Y91 L304 E308 I310	Y91-I306 HydrophobicContact CD2-CG2 4.26Å; L304-I306 HydrophobicContact CB-CG1 4.35Å; L304-I306 PolarHBondContact O-N 3.44Å; I306-E308 VanDerWaalsContact C-N 3.31Å; I306-E308 PolarHBondContact O-N 2.91Å; I306-I310 HydrophobicContact CG2-CD1 4.5Å
307	D	43.2	Very low	39.7	Very low	118 Å²	118	109.3 Å²	109.3	63%	0.631	53%	0.528	S	S	*	.	H	α-helix	trans	-73.7	-14.3	179.6	-63.2	-29.6	0	0	0	114.2	P305	P305-D307 PolarHBondContact O-N 3Å
308	E	45.8	Very low	39.6	Very low	133 Å²	133	110.1 Å²	110.1	62%	0.621	53%	0.534	S	S	*	.	H	α-helix	trans	-93.1	-18.6	-179.6	-68.5	-176.4	175	0	0	113.7	P305 I306	P305-E308 HydrophobicContact CB-CB 4.22Å; P305-E308 HydrophobicContact CB-CG 4.11Å; P305-E308 PolarHBondContact O-N 3.36Å; I306-E308 VanDerWaalsContact C-N 3.31Å; I306-E308 PolarHBondContact O-N 2.91Å
309	L	48.2	Very low	39.6	Very low	28 Å²	28	104.8 Å²	104.8	15%	0.147	52%	0.519	C	S	.	.	H	α-helix	trans	-95.1	-19	-175	-77.5	164.9	0	0	0	114.3	Q60 T61 L64 Y65 Y91 P311	Q60-L309 PolarHBondContact NE2-O 2.91Å; T61-L309 HydrophobicContact CG2-CD1 3.91Å; T61-L309 HydrophobicContact CG2-CD2 4.33Å; L64-L309 HydrophobicContact CD2-CD1 3.47Å; L64-L309 VanDerWaalsContact CD2-CD1 3.47Å; L64-L309 HydrophobicContact CD2-CD2 3.66Å; L64-L309 HydrophobicContact CD2-CG 3.81Å; Y65-L309 HydrophobicContact CE1-CD1 3.5Å; Y65-L309 VanDerWaalsContact CE1-CD1 3.5Å; Y91-L309 HydrophobicContact CE2-CB 3.99Å; Y91-L309 PolarHBondContact OH-O 2.88Å; L309-P311 WeakPolarHBondContact O-CD 3.42Å
310	I	46	Very low	39.2	Very low	15 Å²	15	105.2 Å²	105.2	8%	0.077	51%	0.51	C	S	.	.	S	Bend	trans	-84.1	117.7	174.9	-56.4	-178.7	0	0	0	106.5	Y91 H94 V99 I306 I312	Y91-I310 HydrophobicContact CD2-CG1 4.5Å; Y91-I310 HydrophobicContact CE2-CD1 4.03Å; Y91-I310 HydrophobicContact CE2-CG1 3.45Å; Y91-I310 VanDerWaalsContact CE2-CG1 3.45Å; H94-I310 WeakPolarHBondContact ND1-CD1 3.21Å; V99-I310 HydrophobicContact CG1-CG2 4.27Å; V99-I310 HydrophobicContact CG2-CD1 3.96Å; V99-I310 HydrophobicContact CG2-CG2 3.43Å; V99-I310 VanDerWaalsContact CG2-CG2 3.43Å; I306-I310 HydrophobicContact CG2-CD1 4.5Å; I310-I312 HydrophobicContact CG2-CG1 4.4Å; I310-I312 PolarHBondContact O-N 3.37Å
311	P	43.8	Very low	38.7	Very low	33 Å²	33	105.6 Å²	105.6	21%	0.214	52%	0.516	C	S	.	.			trans	-61.1	93.4	155	-6.3	22.9	0	0	0	104.5	L309 Y313	L309-P311 WeakPolarHBondContact O-CD 3.42Å; P311-Y313 WeakPolarHBondContact O-CD2 3.31Å; P311-Y313 PolarHBondContact O-N 2.95Å
312	I	42.3	Very low	38.5	Very low	102 Å²	102	106.1 Å²	106.1	52%	0.523	51%	0.512	S	S	.	.			trans	-57.4	115.5	166.1	-59.2	175.5	0	0	0	101.9	I310 R314	I310-I312 HydrophobicContact CG2-CG1 4.4Å; I310-I312 PolarHBondContact O-N 3.37Å; I312-R314 HydrophobicContact CB-CB 4.33Å; I312-R314 HydrophobicContact CG2-CB 3.91Å; I312-R314 HydrophobicContact CG2-CG 4.4Å; I312-R314 PolarHBondContact O-N 3.1Å
313	Y	39.5	Very low	38	Very low	39 Å²	39	101 Å²	101	15%	0.153	50%	0.496	C	S	.	.			trans	-62.9	71.4	166	-71.2	-93	0	0	0	106.2	V99 Q103 L141 P311 R315 E343	V99-Y313 HydrophobicContact CG1-CD2 4.11Å; V99-Y313 HydrophobicContact CG1-CE2 4.19Å; Q103-Y313 HydrophobicContact CG-CD2 3.93Å; Q103-Y313 HydrophobicContact CG-CE2 3.76Å; Q103-Y313 PolarHBondContact NE2-OH 3.32Å; L141-Y313 HydrophobicContact CD2-CE1 3.53Å; L141-Y313 WeakPolarHBondContact CD2-OH 3.2Å; P311-Y313 WeakPolarHBondContact O-CD2 3.31Å; P311-Y313 PolarHBondContact O-N 2.95Å; Y313-R315 PolarHBondContact O-N 3.02Å; Y313-E343 WeakPolarHBondContact CE1-O 3.46Å
314	R	38.4	Very low	37.4	Very low	180 Å²	180	98.4 Å²	98.4	68%	0.679	49%	0.493	S	S	*	.			trans	-83.2	98.3	-170.3	-165.2	178.6	-162.4	142	11	104.6	I312 D316	I312-R314 HydrophobicContact CB-CB 4.33Å; I312-R314 HydrophobicContact CG2-CB 3.91Å; I312-R314 HydrophobicContact CG2-CG 4.4Å; I312-R314 PolarHBondContact O-N 3.1Å; R314-D316 HydrophobicContact CG-CB 4.33Å; R314-D316 WeakPolarHBondContact CG-OD2 3.17Å; R314-D316 IonicContact NE-OD2 3.73Å; R314-D316 PolarHBondContact NE-OD2 3.15Å; R314-D316 VanDerWaalsContact NE-OD2 3.15Å; R314-D316 PolarHBondContact O-N 3.38Å
315	R	30.7	Very low	37	Very low	116 Å²	116	101.4 Å²	101.4	44%	0.438	52%	0.518	S	S	.	.			trans	-58.7	88	162.6	-166.7	-174.6	-152.7	125.3	6.6	107.5	Y313 E320	Y313-R315 PolarHBondContact O-N 3.02Å; R315-E320 IonicContact CZ-OE1 3.79Å; R315-E320 IonicContact CZ-OE2 3.53Å; R315-E320 IonicContact NE-OE1 2.68Å; R315-E320 IonicContact NE-OE2 2.97Å; R315-E320 PolarHBondContact NE-OE2 2.88Å; R315-E320 VanDerWaalsContact NE-OE2 3.08Å; R315-E320 IonicContact NH2-OE1 3.16Å; R315-E320 PolarHBondContact NH2-OE1 3.38Å; R315-E320 IonicContact NH2-OE2 2.91Å; R315-E320 PolarHBondContact NH2-OE2 3.46Å
316	D	35.6	Very low	36.4	Very low	117 Å²	117	106.1 Å²	106.1	63%	0.626	54%	0.535	S	S	*	.			trans	-149.3	106	168.3	-82.6	-42.1	0	0	0	110.9	R314	R314-D316 HydrophobicContact CG-CB 4.33Å; R314-D316 WeakPolarHBondContact CG-OD2 3.17Å; R314-D316 IonicContact NE-OD2 3.73Å; R314-D316 PolarHBondContact NE-OD2 3.15Å; R314-D316 VanDerWaalsContact NE-OD2 3.15Å; R314-D316 PolarHBondContact O-N 3.38Å
317	C	29.5	Very low	36.3	Very low	106 Å²	106	109.2 Å²	109.2	72%	0.716	55%	0.552	S	S	*	*	S	Bend	trans	61.5	87	143.7	-162.5	0	0	0	0	116.5
318	H	29.6	Very low	36.5	Very low	174 Å²	174	111.8 Å²	111.8	81%	0.806	57%	0.565	S	S	*	*	S	Bend		-160.1	11	106.1	-106.3	-74.3	0	0	0	116.7
319	T	31.7	Very low	36.6	Very low	102 Å²	102	113.9 Å²	113.9	63%	0.626	57%	0.574	S	S	*	*	S	Bend	trans	-131.3	-2.2	-176.5	-41.5	0	0	0	0	116.4	V321	T319-V321 PolarHBondContact O-N 2.92Å
320	E	28.8	Very low	36.3	Very low	113 Å²	113	116.8 Å²	116.8	53%	0.528	59%	0.589	S	S	.	*			trans	-94.8	66.4	166.8	-74.5	-173.9	156.2	0	0	110.3	R315 Y322	R315-E320 IonicContact CZ-OE1 3.79Å; R315-E320 IonicContact CZ-OE2 3.53Å; R315-E320 IonicContact NE-OE1 2.68Å; R315-E320 IonicContact NE-OE2 2.97Å; R315-E320 PolarHBondContact NE-OE2 2.88Å; R315-E320 VanDerWaalsContact NE-OE2 3.08Å; R315-E320 IonicContact NH2-OE1 3.16Å; R315-E320 PolarHBondContact NH2-OE1 3.38Å; R315-E320 IonicContact NH2-OE2 2.91Å; R315-E320 PolarHBondContact NH2-OE2 3.46Å; E320-Y322 PolarHBondContact O-N 3.48Å
321	V	28	Very low	35.5	Very low	116 Å²	116	118.6 Å²	118.6	70%	0.703	61%	0.612	S	S	*	*			trans	-78.3	106.4	145	178.5	0	0	0	0	103.9	T319 C323	T319-V321 PolarHBondContact O-N 2.92Å; V321-C323 PolarHBondContact O-N 3.23Å
322	Y	29.9	Very low	35.2	Very low	190 Å²	190	127 Å²	127	75%	0.745	65%	0.645	S	S	*	*			trans	-48.1	99.6	154.5	-85	-101.2	0	0	0	106	E320 E324	E320-Y322 PolarHBondContact O-N 3.48Å; Y322-E324 PolarHBondContact O-N 2.92Å
323	C	28.5	Very low	35	Very low	83 Å²	83	131.9 Å²	131.9	56%	0.561	66%	0.663	S	S	*	*			trans	-68	81.3	157.9	-80.1	0	0	0	0	104.8	V321 S325	V321-C323 PolarHBondContact O-N 3.23Å; C323-S325 PolarHBondContact O-N 3.39Å
324	E	28.3	Very low	35	Very low	157 Å²	157	133.3 Å²	133.3	73%	0.734	68%	0.678	S	S	*	*			trans	-47.1	135.9	151.9	-77.8	-174.5	153.8	0	0	106.7	Y322 H326	Y322-E324 PolarHBondContact O-N 2.92Å; E324-H326 PolarHBondContact O-N 3.42Å
325	S	36.7	Very low	34.9	Very low	112 Å²	112	131.9 Å²	131.9	78%	0.783	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	29.6	-168.5	42	0	0	0	0	116	C323	C323-S325 PolarHBondContact O-N 3.39Å
326	H	36.8	Very low	35.6	Very low	159 Å²	159	134.6 Å²	134.6	74%	0.736	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.9	6.2	-173.4	-63.7	92	0	0	0	115	E324 L328	E324-H326 PolarHBondContact O-N 3.42Å; H326-L328 PolarHBondContact O-N 3.33Å
327	D	41.1	Very low	36.5	Very low	101 Å²	101	134.1 Å²	134.1	54%	0.54	70%	0.695	S	S	.	*			trans	-78.6	106.3	171.5	-158.5	-9.7	0	0	0	111.2	E329	D327-E329 VanDerWaalsContact C-N 3.28Å; D327-E329 PolarHBondContact O-N 2.96Å; D327-E329 PolarHBondContact OD1-N 3.16Å
328	L	46.7	Very low	38.5	Very low	172 Å²	172	138.3 Å²	138.3	90%	0.901	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-7.5	-175.8	-79.2	156.4	0	0	0	113.3	H326	H326-L328 PolarHBondContact O-N 3.33Å
329	E	47.6	Very low	41	Very low	177 Å²	177	132.1 Å²	132.1	83%	0.827	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-4.9	-174.5	-69.7	-84.2	142.9	0	0	114	D327 G331	D327-E329 VanDerWaalsContact C-N 3.28Å; D327-E329 PolarHBondContact O-N 2.96Å; D327-E329 PolarHBondContact OD1-N 3.16Å; E329-G331 PolarHBondContact O-N 3.34Å; E329-G331 VanDerWaalsContact O-N 3.09Å
330	L	42.2	Very low	43.6	Very low	88 Å²	88	127.8 Å²	127.8	46%	0.461	64%	0.642	S	S	.	*	S	Bend	trans	-79	95.6	172.3	-80.3	150.8	0	0	0	110.1	K332 S334	L330-K332 PolarHBondContact O-N 3.41Å; L330-S334 WeakPolarHBondContact CD2-OG 2.7Å
331	G	29.2	Very low	46.3	Very low	54 Å²	54	125.8 Å²	125.8	56%	0.557	63%	0.634	S	S	*	*			trans	-45.5	134.6	170.9	0	0	0	0	0	111	E329 K333 S334	E329-G331 PolarHBondContact O-N 3.34Å; E329-G331 VanDerWaalsContact O-N 3.09Å; G331-K333 PolarHBondContact O-N 2.8Å; G331-S334 PolarHBondContact O-N 2.9Å
332	K	37.6	Very low	49	Very low	208 Å²	208	120.4 Å²	120.4	90%	0.904	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.4	13.2	-171.6	-65.5	-180	176.5	-179.5	0	116.9	L330	L330-K332 PolarHBondContact O-N 3.41Å
333	K	38.9	Very low	51.5	Low	205 Å²	205	115.2 Å²	115.2	89%	0.891	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.2	-7.5	179.9	-67.3	-172.9	176.1	-177.3	0	114.5	G331	G331-K333 PolarHBondContact O-N 2.8Å
334	S	38.6	Very low	54.3	Low	69 Å²	69	111.4 Å²	111.4	48%	0.483	56%	0.558	S	S	.	*			trans	-103.4	13.4	179.7	70.3	0	0	0	0	114.9	L330 G331 Q336	L330-S334 WeakPolarHBondContact CD2-OG 2.7Å; G331-S334 PolarHBondContact O-N 2.9Å; S334-Q336 PolarHBondContact O-N 2.93Å; S334-Q336 VanDerWaalsContact O-N 3.16Å
335	L	38	Very low	57.2	Low	150 Å²	150	104.5 Å²	104.5	79%	0.785	53%	0.526	S	S	*	.			trans	-78.6	24.7	172.2	-97.2	165	0	0	0	113.4	Q337	L335-Q337 PolarHBondContact O-N 2.87Å
336	Q	43.9	Very low	59.6	Low	173 Å²	173	100.3 Å²	100.3	81%	0.808	50%	0.496	S	S	*	.	S	Bend	trans	-68.4	94.2	150.6	-86.2	177.1	-14.5	0	0	105.3	S334 R338	S334-Q336 PolarHBondContact O-N 2.93Å; S334-Q336 VanDerWaalsContact O-N 3.16Å; Q336-R338 PolarHBondContact O-N 3.19Å
337	Q	54.8	Low	62.1	Low	107 Å²	107	94 Å²	94	50%	0.5	47%	0.467	S	S	.	.			trans	-47	112.3	167.9	-85.6	173.2	-35.8	0	0	106.9	V117 L335 L339	V117-Q337 HydrophobicContact CG1-CB 4.42Å; V117-Q337 HydrophobicContact CG2-CB 3.86Å; L335-Q337 PolarHBondContact O-N 2.87Å; Q337-L339 PolarHBondContact O-N 2.61Å
338	R	71.2	Confident	64.3	Low	194 Å²	194	92.8 Å²	92.8	73%	0.732	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-58.3	130.9	-177.7	-68.9	178.4	81	155.8	3.5	107.4	Q336	Q336-R338 PolarHBondContact O-N 3.19Å
339	L	82.8	Confident	66.6	Low	45 Å²	45	92 Å²	92	24%	0.236	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-58.7	145.6	176.4	-68.3	175.1	0	0	0	110	L114 E207 W208 D209 Q337	L114-L339 HydrophobicContact CD2-CD2 3.87Å; E207-L339 HydrophobicContact CG-CB 3.85Å; E207-L339 HydrophobicContact CG-CD1 4.28Å; W208-L339 WeakPolarHBondContact O-CB 3.14Å; D209-L339 HydrophobicContact CB-CD1 3.82Å; Q337-L339 PolarHBondContact O-N 2.61Å
340	P	85.4	Confident	68.8	Low	10 Å²	10	86.1 Å²	86.1	7%	0.065	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-60	141.9	175.7	-20.5	32.5	0	0	0	111.5	Q110 Q113 L114 W208	Q110-P340 HydrophobicContact CB-CB 3.79Å; Q110-P340 HydrophobicContact CB-CG 4.27Å; Q110-P340 HydrophobicContact CG-CB 3.77Å; Q113-P340 HydrophobicContact CB-CG 3.93Å; L114-P340 HydrophobicContact CD2-CG 4.17Å; L114-P340 HydrophobicContact CG-CG 4.14Å; W208-P340 HydrophobicContact CB-CB 4.35Å; W208-P340 PolarHBondContact N-O 3.21Å
341	I	85.2	Confident	71.3	Confident	72 Å²	72	86 Å²	86	37%	0.369	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	133.7	-178.4	-61.7	172.3	0	0	0	109.6	Q110 Y205 F206 E207	Q110-I341 PolarHBondContact NE2-O 2.85Å; Y205-I341 HydrophobicContact CD1-CG2 4.11Å; Y205-I341 HydrophobicContact CG-CG2 4.4Å; F206-I341 CarbonylContact O-C 3.51Å; F206-I341 VanDerWaalsContact O-CA 3.31Å; F206-I341 WeakPolarHBondContact O-CA 3.22Å; E207-I341 HydrophobicContact CB-CG1 4.09Å; E207-I341 HydrophobicContact CG-CD1 4.48Å; E207-I341 HydrophobicContact CG-CG1 3.96Å
342	D	84.7	Confident	74.5	Confident	2 Å²	2	83.4 Å²	83.4	1%	0.011	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	139.1	165.8	-75.1	-42.4	0	0	0	111.4	H106 Q110 Y205 F206 W208 L344	H106-D342 IonicContact CE1-OD1 3.36Å; H106-D342 PolarHBondContact CE1-OD1 3.2Å; H106-D342 IonicContact ND1-OD1 2.8Å; H106-D342 PolarHBondContact ND1-OD1 3.43Å; Q110-D342 VanDerWaalsContact NE2-CG 3.25Å; Q110-D342 PolarHBondContact NE2-OD1 2.94Å; Q110-D342 PolarHBondContact NE2-OD2 2.85Å; Q110-D342 PolarHBondContact OE1-OD1 3.19Å; Q110-D342 PolarHBondContact OE1-OD2 2.89Å; Y205-D342 CarbonylContact C-O 3.46Å; Y205-D342 WeakPolarHBondContact CA-O 3.37Å; Y205-D342 WeakPolarHBondContact CB-O 3.29Å; F206-D342 HydrophobicContact CB-CB 4.42Å; F206-D342 PolarHBondContact N-O 2.87Å; F206-D342 PolarHBondContact O-N 2.87Å; W208-D342 PolarHBondContact NE1-OD2 2.83Å; D342-L344 HydrophobicContact CB-CD2 4.17Å
343	E	84.2	Confident	77.3	Confident	81 Å²	81	76.2 Å²	76.2	38%	0.379	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	111.2	167.2	-176.5	169.9	157.2	0	0	109.1	Y205 Y313 P346	Y205-E343 HydrophobicContact CD1-CB 3.84Å; Y205-E343 HydrophobicContact CD1-CG 4.03Å; Y205-E343 HydrophobicContact CE1-CB 3.78Å; Y205-E343 HydrophobicContact CE1-CG 3.59Å; Y313-E343 WeakPolarHBondContact CE1-O 3.46Å; E343-P346 WeakPolarHBondContact OE1-CA 3.19Å; E343-P346 WeakPolarHBondContact OE1-CB 2.98Å; E343-P346 VanDerWaalsContact OE1-CG 3.25Å; E343-P346 WeakPolarHBondContact OE1-CG 3.39Å
344	L	87.1	Confident	80.1	Confident	4 Å²	4	70 Å²	70	2%	0.021	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-41.5	-179.6	-55	-176.1	0	0	0	111.4	L141 L204 F206 D342 H361 Y369	L141-L344 HydrophobicContact CD1-CD2 3.76Å; L141-L344 HydrophobicContact CD2-CD2 4.35Å; L141-L344 HydrophobicContact CG-CD2 4.41Å; L204-L344 HydrophobicContact CB-CB 4.35Å; L204-L344 HydrophobicContact CD2-CB 4.29Å; L204-L344 HydrophobicContact CD2-CD1 3.99Å; L204-L344 HydrophobicContact CG-CB 4.21Å; L204-L344 HydrophobicContact CG-CD1 4.05Å; L204-L344 WeakPolarHBondContact O-CA 3.36Å; L204-L344 WeakPolarHBondContact O-CB 3.46Å; L204-L344 PolarHBondContact O-N 2.75Å; F206-L344 HydrophobicContact CB-CD1 3.93Å; F206-L344 HydrophobicContact CB-CD2 4.26Å; F206-L344 HydrophobicContact CB-CG 4.14Å; D342-L344 HydrophobicContact CB-CD2 4.17Å; L344-H361 VanDerWaalsContact CD1-CE1 3.41Å; L344-H361 WeakPolarHBondContact CD1-CE1 3.18Å; L344-Y369 HydrophobicContact CD1-CD1 3.97Å; L344-Y369 HydrophobicContact CD1-CE1 3.53Å
345	I	88.6	Confident	82.9	Confident	12 Å²	12	69.2 Å²	69.2	6%	0.062	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	116.3	177.2	-57	174.1	0	0	0	107.7	A144 V146 W191 F202 G203 L204	A144-I345 HydrophobicContact CB-CD1 3.77Å; A144-I345 HydrophobicContact CB-CG1 3.79Å; V146-I345 HydrophobicContact CG2-CD1 3.79Å; W191-I345 HydrophobicContact CH2-CD1 4.06Å; W191-I345 HydrophobicContact CZ2-CD1 3.56Å; F202-I345 HydrophobicContact CE1-CD1 4.02Å; G203-I345 CarbonylContact C-O 3.58Å; G203-I345 WeakPolarHBondContact CA-O 3.28Å; L204-I345 HydrophobicContact CB-CB 3.87Å; L204-I345 HydrophobicContact CB-CD1 3.98Å; L204-I345 HydrophobicContact CB-CG1 4Å; L204-I345 HydrophobicContact CD2-CD1 4.1Å; L204-I345 PolarHBondContact N-O 3Å; L204-I345 PolarHBondContact O-N 3.09Å
346	P	87.8	Confident	85.7	Confident	23 Å²	23	62 Å²	62	15%	0.149	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	147.8	172.7	-20.8	30.3	0	0	0	112.3	Y278 E343 Y348	Y278-P346 HydrophobicContact CE2-CB 4.41Å; E343-P346 WeakPolarHBondContact OE1-CA 3.19Å; E343-P346 WeakPolarHBondContact OE1-CB 2.98Å; E343-P346 VanDerWaalsContact OE1-CG 3.25Å; E343-P346 WeakPolarHBondContact OE1-CG 3.39Å; P346-Y348 HydrophobicContact CB-CD2 4.17Å; P346-Y348 HydrophobicContact CB-CE2 3.69Å; P346-Y348 HydrophobicContact CG-CE2 4.11Å; P346-Y348 PolarHBondContact O-N 2.91Å; P346-Y348 VanDerWaalsContact O-N 3.08Å
347	I	87.9	Confident	88.3	Confident	26 Å²	26	55.6 Å²	55.6	13%	0.133	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	112.4	173.9	-61.4	174.6	0	0	0	109.6	F202 Y205 Y278 K372 D374	F202-I347 WeakPolarHBondContact O-CA 3.39Å; Y205-I347 HydrophobicContact CE2-CG1 4.45Å; Y278-I347 WeakPolarHBondContact CE2-O 3.46Å; Y278-I347 WeakPolarHBondContact OH-CA 2.97Å; Y278-I347 WeakPolarHBondContact OH-CB 3.21Å; Y278-I347 PolarHBondContact OH-N 2.9Å; Y278-I347 PolarHBondContact OH-O 2.73Å; I347-K372 HydrophobicContact CD1-CB 4.2Å; I347-K372 HydrophobicContact CD1-CD 4.11Å; I347-D374 HydrophobicContact CG2-CB 4.03Å
348	Y	88.9	Confident	90.2	Very high	76 Å²	76	50.6 Å²	50.6	30%	0.298	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	149.8	168.8	-68.7	-58	0	0	0	110.4	G201 F202 P276 Y278 P346 R350	G201-Y348 WeakPolarHBondContact CA-O 3.4Å; F202-Y348 PolarHBondContact N-O 2.82Å; F202-Y348 PolarHBondContact O-N 3.44Å; P276-Y348 HydrophobicContact CB-CD1 4.15Å; P276-Y348 HydrophobicContact CB-CE1 3.29Å; P276-Y348 HydrophobicContact CG-CE1 4.35Å; Y278-Y348 AromaticContact CD2-CE1 4Å; Y278-Y348 HydrophobicContact CD2-CE1 4Å; Y278-Y348 HydrophobicContact CE2-CD1 4.35Å; Y278-Y348 AromaticContact CE2-CE1 3.82Å; Y278-Y348 HydrophobicContact CE2-CE1 3.82Å; P346-Y348 HydrophobicContact CB-CD2 4.17Å; P346-Y348 HydrophobicContact CB-CE2 3.69Å; P346-Y348 HydrophobicContact CG-CE2 4.11Å; P346-Y348 PolarHBondContact O-N 2.91Å; P346-Y348 VanDerWaalsContact O-N 3.08Å; Y348-R350 PolarHBondContact O-N 2.87Å
349	R	94.7	Very high	91.3	Very high	157 Å²	157	41.4 Å²	41.4	59%	0.592	20%	0.195	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-66	128.1	173.5	-66.5	177.7	68.7	-174	-3.6	109.3	D199 F377	D199-R349 IonicContact OD1-CZ 2.61Å; D199-R349 IonicContact OD1-NH2 3.9Å; D199-R349 PolarHBondContact OD1-NH2 2.86Å; D199-R349 WeakPolarHBondContact OD2-CB 3.36Å; D199-R349 IonicContact OD2-CZ 3.05Å; D199-R349 IonicContact OD2-NE 2.93Å; D199-R349 PolarHBondContact OD2-NE 2.62Å; D199-R349 IonicContact OD2-NH2 2.63Å; D199-R349 PolarHBondContact OD2-NH2 3.38Å; R349-F377 HydrophobicContact CG-CE1 4.06Å; R349-F377 HydrophobicContact CG-CZ 4.13Å
350	R	93.2	Very high	91.9	Very high	53 Å²	53	40.8 Å²	40.8	20%	0.2	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	131.7	-179.2	-53.9	-54.2	-178.9	169.3	0.9	109.3	F193 D199 L200 F202 Y348 C352 Y357	F193-R350 HydrophobicContact CE2-CB 4.44Å; F193-R350 HydrophobicContact CZ-CG 4.28Å; D199-R350 CarbonylContact C-O 3.51Å; D199-R350 WeakPolarHBondContact CA-O 3.44Å; D199-R350 VanDerWaalsContact CB-O 3.22Å; D199-R350 WeakPolarHBondContact CB-O 3.43Å; L200-R350 PolarHBondContact N-O 2.97Å; L200-R350 PolarHBondContact O-N 2.82Å; F202-R350 HydrophobicContact CB-CG 3.85Å; Y348-R350 PolarHBondContact O-N 2.87Å; R350-C352 HydrophobicContact CB-CB 4.44Å; R350-C352 PolarHBondContact O-N 3.22Å; R350-C352 PolarHBondContact O-SG 3.03Å; R350-Y357 HydrophobicContact CB-CD1 4.08Å; R350-Y357 HydrophobicContact CB-CD2 4.37Å; R350-Y357 HydrophobicContact CB-CE1 3.77Å; R350-Y357 HydrophobicContact CB-CE2 4.08Å; R350-Y357 HydrophobicContact CB-CG 4.36Å; R350-Y357 HydrophobicContact CG-CD1 4.13Å; R350-Y357 HydrophobicContact CG-CE1 3.95Å
351	D	95.5	Very high	92.2	Very high	84 Å²	84	40.5 Å²	40.5	45%	0.449	19%	0.191	S	C	.	.			trans	-74.1	47.9	174.5	-66.9	-44.1	0	0	0	112.1	H353 T354 Y357	D351-H353 PolarHBondContact O-N 3.01Å; D351-H353 IonicContact OD1-CE1 3.29Å; D351-T354 HydrophobicContact CB-CG2 4.25Å; D351-T354 PolarHBondContact O-N 3.4Å; D351-T354 PolarHBondContact O-OG1 2.94Å; D351-Y357 PolarHBondContact N-OH 3.16Å
352	C	95.8	Very high	92.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	4	-175.6	59.5	0	0	0	0	114.2	F193 A194 T195 R350 E355 Y357	F193-C352 HydrophobicContact CD2-CB 3.85Å; F193-C352 HydrophobicContact CE2-CB 3.64Å; A194-C352 CarbonylContact C-O 3.46Å; A194-C352 VanDerWaalsContact CA-O 3.24Å; A194-C352 WeakPolarHBondContact CA-O 3.17Å; A194-C352 WeakPolarHBondContact CB-O 3.31Å; T195-C352 VanDerWaalsContact CG2-SG 3.57Å; T195-C352 PolarHBondContact N-O 3.39Å; T195-C352 PolarHBondContact OG1-SG 3.34Å; R350-C352 HydrophobicContact CB-CB 4.44Å; R350-C352 PolarHBondContact O-N 3.22Å; R350-C352 PolarHBondContact O-SG 3.03Å; C352-E355 CarbonylContact C-O 3.46Å; C352-E355 WeakPolarHBondContact CA-O 3.29Å; C352-Y357 HydrophobicContact CB-CD2 3.6Å; C352-Y357 HydrophobicContact CB-CE2 4.1Å; C352-Y357 HydrophobicContact CB-CG 4.34Å
353	H	97	Very high	92.7	Very high	57 Å²	57	40.4 Å²	40.4	26%	0.264	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-14.5	165.8	63.5	-76.6	0	0	0	112.7	I152 T195 D199 D351	I152-H353 VanDerWaalsContact CD1-O 3.26Å; I152-H353 WeakPolarHBondContact CD1-O 3.41Å; T195-H353 WeakPolarHBondContact O-CA 3.24Å; T195-H353 PolarHBondContact OG1-N 2.8Å; D199-H353 PolarHBondContact N-ND1 2.94Å; D351-H353 PolarHBondContact O-N 3.01Å; D351-H353 IonicContact OD1-CE1 3.29Å
354	T	97	Very high	92.8	Very high	75 Å²	75	36.6 Å²	36.6	46%	0.46	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-37.5	-179.3	68.4	0	0	0	0	112.4	D351	D351-T354 HydrophobicContact CB-CG2 4.25Å; D351-T354 PolarHBondContact O-N 3.4Å; D351-T354 PolarHBondContact O-OG1 2.94Å
355	E	96.6	Very high	92.9	Very high	52 Å²	52	37 Å²	37	24%	0.243	18%	0.176	C	C	.	.	S	Bend	trans	-141.5	156.5	-178.5	-62.3	-171.1	142.1	0	0	110.2	T148 K150 C352 Y357	T148-E355 WeakPolarHBondContact CB-OE2 3.25Å; T148-E355 HydrophobicContact CG2-CB 4.47Å; T148-E355 PolarHBondContact OG1-OE2 2.88Å; K150-E355 WeakPolarHBondContact CE-OE1 3.22Å; K150-E355 WeakPolarHBondContact CG-OE1 3.15Å; C352-E355 CarbonylContact C-O 3.46Å; C352-E355 WeakPolarHBondContact CA-O 3.29Å; E355-Y357 PolarHBondContact O-N 3.46Å
356	V	97.6	Very high	92.9	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	119.3	172.1	-172.5	0	0	0	0	108.3	T148 R149 I152 F155 E192	T148-V356 CarbonylContact C-O 3.54Å; T148-V356 WeakPolarHBondContact CA-O 3.24Å; R149-V356 HydrophobicContact CB-CB 4.32Å; R149-V356 PolarHBondContact N-O 3.18Å; R149-V356 PolarHBondContact O-N 2.9Å; I152-V356 HydrophobicContact CB-CG2 4.09Å; I152-V356 HydrophobicContact CG1-CG2 4.31Å; F155-V356 HydrophobicContact CB-CG2 3.69Å; F155-V356 HydrophobicContact CD1-CG1 3.89Å; F155-V356 HydrophobicContact CD1-CG2 3.85Å; F155-V356 HydrophobicContact CD2-CG1 4.24Å; F155-V356 HydrophobicContact CE1-CG1 4.04Å; F155-V356 HydrophobicContact CE2-CG1 4.37Å; F155-V356 HydrophobicContact CG-CG1 3.99Å; F155-V356 HydrophobicContact CG-CG2 3.86Å; F155-V356 HydrophobicContact CZ-CG1 4.28Å; E192-V356 HydrophobicContact CB-CG1 4.2Å
357	Y	97.2	Very high	93.1	Very high	38 Å²	38	37.8 Å²	37.8	15%	0.149	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	130.1	173.5	-85.4	-108.3	0	0	0	109.4	T148 E192 F193 R350 D351 C352 E355	T148-Y357 HydrophobicContact CG2-CD1 4.16Å; T148-Y357 HydrophobicContact CG2-CD2 4.13Å; T148-Y357 HydrophobicContact CG2-CE1 4.04Å; T148-Y357 HydrophobicContact CG2-CE2 4.01Å; T148-Y357 HydrophobicContact CG2-CG 4.21Å; E192-Y357 CarbonylContact C-O 3.53Å; E192-Y357 VanDerWaalsContact CA-O 3.24Å; E192-Y357 WeakPolarHBondContact CA-O 3.24Å; F193-Y357 VanDerWaalsContact CE1-CB 3.47Å; F193-Y357 HydrophobicContact CE1-CG 4.44Å; F193-Y357 HydrophobicContact CE2-CG 4.25Å; F193-Y357 HydrophobicContact CZ-CD1 4.27Å; F193-Y357 AromaticContact CZ-CG 3.92Å; F193-Y357 HydrophobicContact CZ-CG 3.92Å; F193-Y357 PolarHBondContact N-O 2.98Å; F193-Y357 PolarHBondContact O-N 2.89Å; R350-Y357 HydrophobicContact CB-CD1 4.08Å; R350-Y357 HydrophobicContact CB-CD2 4.37Å; R350-Y357 HydrophobicContact CB-CE1 3.77Å; R350-Y357 HydrophobicContact CB-CE2 4.08Å; R350-Y357 HydrophobicContact CB-CG 4.36Å; R350-Y357 HydrophobicContact CG-CD1 4.13Å; R350-Y357 HydrophobicContact CG-CE1 3.95Å; D351-Y357 PolarHBondContact N-OH 3.16Å; C352-Y357 HydrophobicContact CB-CD2 3.6Å; C352-Y357 HydrophobicContact CB-CE2 4.1Å; C352-Y357 HydrophobicContact CB-CG 4.34Å; E355-Y357 PolarHBondContact O-N 3.46Å
358	C	96.4	Very high	93.4	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.007	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	157	-176.5	-54.8	0	0	0	0	109.9	V146 W147 R149 W191 E192	V146-C358 WeakPolarHBondContact CA-O 3.28Å; W147-C358 HydrophobicContact CD2-CB 4Å; W147-C358 VanDerWaalsContact CE2-CB 3.45Å; W147-C358 HydrophobicContact CG-CB 4.13Å; W147-C358 HydrophobicContact CZ2-CB 3.91Å; W147-C358 PolarHBondContact N-O 3.3Å; W147-C358 PolarHBondContact O-N 3.4Å; W147-C358 VanDerWaalsContact O-O 3.09Å; R149-C358 PolarHBondContact NE-SG 3.35Å; R149-C358 VanDerWaalsContact NE-SG 3.38Å; W191-C358 CarbonylContact O-C 3.49Å; W191-C358 VanDerWaalsContact O-CA 3.24Å; W191-C358 WeakPolarHBondContact O-CA 3.13Å; E192-C358 HydrophobicContact CG-CB 4.39Å
359	G	94.4	Very high	93.8	Very high	1 Å²	1	33 Å²	33	1%	0.01	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.2	171.7	168.4	0	0	0	0	0	114.3	T145 C190 W191	T145-G359 CarbonylContact O-C 3.54Å; T145-G359 WeakPolarHBondContact O-CA 3.35Å; C190-G359 VanDerWaalsContact CA-O 3.28Å; C190-G359 WeakPolarHBondContact CA-O 3.05Å; W191-G359 VanDerWaalsContact CE2-CA 3.43Å; W191-G359 VanDerWaalsContact CZ2-CA 3.47Å; W191-G359 PolarHBondContact N-O 2.69Å; W191-G359 PolarHBondContact O-N 3.5Å
360	T	93.9	Very high	93.9	Very high	33 Å²	33	26 Å²	26	20%	0.202	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	152	173.9	-171.5	0	0	0	0	111.4	T145 W147 I189 C190 W191	T145-T360 PolarHBondContact N-O 3.43Å; T145-T360 PolarHBondContact O-N 2.95Å; W147-T360 HydrophobicContact CH2-CG2 3.97Å; W147-T360 HydrophobicContact CZ3-CG2 3.93Å; I189-T360 CarbonylContact O-C 3.45Å; I189-T360 WeakPolarHBondContact O-CA 3.45Å; I189-T360 PolarHBondContact O-OG1 3.31Å; I189-T360 VanDerWaalsContact O-OG1 3.1Å; C190-T360 PolarHBondContact SG-OG1 3.46Å; C190-T360 VanDerWaalsContact SG-OG1 3.34Å; W191-T360 VanDerWaalsContact CZ3-C 3.46Å
361	H	92.2	Very high	94.1	Very high	3 Å²	3	23.4 Å²	23.4	1%	0.014	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	128.2	173.5	-176.2	-102.4	0	0	0	109.8	I142 A144 A188 I189 W191 L344 Y369	I142-H361 PolarHBondContact O-CD2 2.88Å; I142-H361 PolarHBondContact O-NE2 3.14Å; A144-H361 HydrophobicContact CB-CB 4.19Å; A188-H361 CarbonylContact C-O 3.56Å; A188-H361 VanDerWaalsContact CA-O 3.24Å; A188-H361 WeakPolarHBondContact CA-O 3.24Å; A188-H361 WeakPolarHBondContact CB-O 3.22Å; I189-H361 HydrophobicContact CG2-CB 4.09Å; I189-H361 PolarHBondContact N-O 2.97Å; I189-H361 PolarHBondContact O-N 2.97Å; W191-H361 HydrophobicContact CH2-CB 4.22Å; W191-H361 HydrophobicContact CZ3-CB 3.99Å; L344-H361 VanDerWaalsContact CD1-CE1 3.41Å; L344-H361 WeakPolarHBondContact CD1-CE1 3.18Å; H361-Y369 HydrophobicContact CB-CE1 4.27Å; H361-Y369 AromaticContact ND1-CE1 3.43Å; H361-Y369 WeakPolarHBondContact ND1-CE1 3.49Å; H361-Y369 AromaticContact ND1-CZ 3.55Å; H361-Y369 PolarHBondContact ND1-OH 3.16Å
362	Q	90.3	Very high	94.2	Very high	57 Å²	57	22.8 Å²	22.8	27%	0.266	12%	0.119	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	142.6	175.3	-166.5	-179.4	46.3	0	0	109.5	E52 R187 P364 Y369	E52-Q362 PolarHBondContact OE2-NE2 3.28Å; R187-Q362 WeakPolarHBondContact O-CG 3.3Å; Q362-P364 VanDerWaalsContact O-CD 3.26Å; Q362-P364 WeakPolarHBondContact O-CD 3.17Å; Q362-Y369 PolarHBondContact O-OH 2.74Å
363	Y	90.9	Very high	94.2	Very high	15 Å²	15	22.9 Å²	22.9	6%	0.059	12%	0.119	C	C	.	.			trans	-63.2	120.4	178.5	-71.3	2.2	0	0	0	109.8	L139 T182 G186 R187 I189 G365 Y369 Y391	L139-Y363 VanDerWaalsContact CD1-O 3.3Å; L139-Y363 WeakPolarHBondContact CD1-O 3.13Å; T182-Y363 HydrophobicContact CG2-CD1 4.41Å; T182-Y363 HydrophobicContact CG2-CD2 4.06Å; T182-Y363 HydrophobicContact CG2-CE1 4.44Å; T182-Y363 HydrophobicContact CG2-CE2 4.13Å; T182-Y363 HydrophobicContact CG2-CG 4.2Å; G186-Y363 VanDerWaalsContact C-CE2 3.46Å; G186-Y363 VanDerWaalsContact O-CD2 3.32Å; G186-Y363 WeakPolarHBondContact O-CD2 3.44Å; G186-Y363 WeakPolarHBondContact O-CE2 3.41Å; R187-Y363 PolarHBondContact O-N 3.06Å; I189-Y363 HydrophobicContact CB-CE1 3.94Å; Y363-G365 PolarHBondContact O-N 2.91Å; Y363-Y369 AromaticContact CD1-CE2 3.71Å; Y363-Y369 HydrophobicContact CD1-CE2 3.71Å; Y363-Y369 AromaticContact CE1-CE2 3.74Å; Y363-Y369 HydrophobicContact CE1-CE2 3.74Å; Y363-Y391 WeakPolarHBondContact OH-CB 3.5Å
364	P	86.4	Confident	94.1	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.006	11%	0.113	C	C	.	.			trans	-77.7	-14.7	173.9	32.6	-34.2	0	0	0	111.9	L139 L141 F206 W208 Q362	L139-P364 WeakPolarHBondContact CB-O 3.24Å; L139-P364 PolarHBondContact N-O 3.32Å; L141-P364 HydrophobicContact CD1-CB 3.51Å; L141-P364 HydrophobicContact CD1-CG 3.85Å; F206-P364 HydrophobicContact CD1-CG 3.72Å; F206-P364 HydrophobicContact CD2-CG 4.11Å; F206-P364 HydrophobicContact CE1-CG 3.67Å; F206-P364 HydrophobicContact CE2-CG 4.06Å; F206-P364 HydrophobicContact CG-CG 3.94Å; F206-P364 HydrophobicContact CZ-CG 3.84Å; W208-P364 HydrophobicContact CH2-CB 4.01Å; W208-P364 HydrophobicContact CH2-CG 4.34Å; W208-P364 WeakPolarHBondContact CH2-O 3.29Å; W208-P364 HydrophobicContact CZ2-CB 4.17Å; W208-P364 HydrophobicContact CZ2-CG 4.34Å; Q362-P364 VanDerWaalsContact O-CD 3.26Å; Q362-P364 WeakPolarHBondContact O-CD 3.17Å
365	G	87.9	Confident	93.9	Very high	12 Å²	12	17.9 Å²	17.9	12%	0.124	9%	0.091	C	C	.	.	S	Bend	trans	168.5	-160.9	-179.4	0	0	0	0	0	111	T182 Y363	T182-G365 WeakPolarHBondContact CG2-O 3.36Å; Y363-G365 PolarHBondContact O-N 2.91Å
366	V	89.7	Confident	93.5	Very high	53 Å²	53	18.1 Å²	18.1	32%	0.321	10%	0.099	S	C	.	.	S	Bend	trans	-83.7	134.1	173.4	-172.2	0	0	0	0	109.2	P136 T182 D209 P212	P136-V366 HydrophobicContact CG-CG2 4.35Å; T182-V366 WeakPolarHBondContact OG1-CA 3.21Å; D209-V366 CarbonylContact O-C 3.52Å; D209-V366 WeakPolarHBondContact O-CG1 3.35Å; D209-V366 VanDerWaalsContact O-O 3.1Å; P212-V366 HydrophobicContact CG-CG1 3.79Å
367	G	92.2	Very high	93.1	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.2	-154.5	179.8	0	0	0	0	0	113.3	T182 E207 D209	T182-G367 PolarHBondContact N-O 3.2Å; T182-G367 PolarHBondContact OG1-N 3.4Å; T182-G367 PolarHBondContact OG1-O 2.94Å; E207-G367 CarbonylContact O-C 3.54Å; E207-G367 VanDerWaalsContact O-CA 3.29Å; E207-G367 WeakPolarHBondContact O-CA 3.19Å; D209-G367 WeakPolarHBondContact O-CA 3.48Å; D209-G367 PolarHBondContact O-N 3.49Å
368	V	94.7	Very high	92.6	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	118.8	-176.6	-175.8	0	0	0	0	109.6	R179 E207 D209 P212	R179-V368 HydrophobicContact CB-CG1 3.81Å; R179-V368 HydrophobicContact CG-CG1 4.47Å; E207-V368 HydrophobicContact CB-CB 4.38Å; E207-V368 PolarHBondContact N-O 3Å; E207-V368 PolarHBondContact O-N 2.78Å; D209-V368 HydrophobicContact CB-CG2 4.4Å; P212-V368 HydrophobicContact CB-CG2 3.71Å
369	Y	96.5	Very high	92.3	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	133.9	166.8	-76.3	-90.2	0	0	0	110.1	R179 V180 T182 I189 L204 Y205 F206 L344 H361 Q362 Y363 F371	R179-Y369 CarbonylContact C-O 3.58Å; R179-Y369 VanDerWaalsContact CA-O 3.3Å; R179-Y369 WeakPolarHBondContact CA-O 3.24Å; V180-Y369 PolarHBondContact N-O 3.44Å; V180-Y369 PolarHBondContact O-N 2.88Å; T182-Y369 HydrophobicContact CG2-CD2 4.32Å; T182-Y369 HydrophobicContact CG2-CE2 4.03Å; I189-Y369 HydrophobicContact CB-CD2 4.32Å; I189-Y369 HydrophobicContact CB-CE2 4.1Å; I189-Y369 HydrophobicContact CD1-CD1 4.39Å; I189-Y369 HydrophobicContact CD1-CD2 3.66Å; I189-Y369 HydrophobicContact CD1-CE2 4.29Å; I189-Y369 HydrophobicContact CD1-CG 3.71Å; I189-Y369 HydrophobicContact CG2-CD1 3.87Å; I189-Y369 HydrophobicContact CG2-CD2 4.18Å; I189-Y369 HydrophobicContact CG2-CE1 3.5Å; I189-Y369 HydrophobicContact CG2-CE2 3.87Å; I189-Y369 HydrophobicContact CG2-CG 4.17Å; L204-Y369 HydrophobicContact CD1-CD1 3.95Å; L204-Y369 HydrophobicContact CD2-CD1 4.23Å; L204-Y369 HydrophobicContact CD2-CE1 4.43Å; L204-Y369 HydrophobicContact CG-CD1 4.25Å; Y205-Y369 CarbonylContact O-C 3.54Å; Y205-Y369 WeakPolarHBondContact O-CA 3.35Å; F206-Y369 HydrophobicContact CD2-CD1 4.11Å; F206-Y369 AromaticContact CD2-CD2 3.96Å; F206-Y369 HydrophobicContact CD2-CD2 3.96Å; F206-Y369 AromaticContact CD2-CE1 3.99Å; F206-Y369 HydrophobicContact CD2-CE1 3.99Å; F206-Y369 AromaticContact CD2-CE2 3.81Å; F206-Y369 HydrophobicContact CD2-CE2 3.81Å; F206-Y369 HydrophobicContact CD2-CG 4.11Å; F206-Y369 AromaticContact CD2-CZ 3.83Å; F206-Y369 HydrophobicContact CE2-CD2 4.01Å; F206-Y369 AromaticContact CE2-CE2 3.71Å; F206-Y369 HydrophobicContact CE2-CE2 3.71Å; L344-Y369 HydrophobicContact CD1-CD1 3.97Å; L344-Y369 HydrophobicContact CD1-CE1 3.53Å; H361-Y369 HydrophobicContact CB-CE1 4.27Å; H361-Y369 AromaticContact ND1-CE1 3.43Å; H361-Y369 WeakPolarHBondContact ND1-CE1 3.49Å; H361-Y369 AromaticContact ND1-CZ 3.55Å; H361-Y369 PolarHBondContact ND1-OH 3.16Å; Q362-Y369 PolarHBondContact O-OH 2.74Å; Y363-Y369 AromaticContact CD1-CE2 3.71Å; Y363-Y369 HydrophobicContact CD1-CE2 3.71Å; Y363-Y369 AromaticContact CE1-CE2 3.74Å; Y363-Y369 HydrophobicContact CE1-CE2 3.74Å; Y369-F371 HydrophobicContact CG-CE2 4.49Å
370	V	96.3	Very high	92.2	Very high	10 Å²	10	35.2 Å²	35.2	6%	0.061	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	98.9	178.6	-173.6	0	0	0	0	108.5	T177 R179 Y205 E207 K372	T177-V370 HydrophobicContact CG2-CG1 3.48Å; T177-V370 VanDerWaalsContact CG2-CG1 3.48Å; R179-V370 HydrophobicContact CG-CG1 4.45Å; R179-V370 HydrophobicContact CG-CG2 4.41Å; Y205-V370 PolarHBondContact N-O 3.36Å; Y205-V370 PolarHBondContact O-N 3.2Å; E207-V370 HydrophobicContact CB-CG2 4.2Å; V370-K372 HydrophobicContact CG1-CG 4.36Å
371	F	97.8	Very high	92.1	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	123.2	174.3	-63.4	-100.4	0	0	0	108.8	T177 V178 V180 I189 W191 F202 L204 Y369 F373 I389	T177-F371 CarbonylContact C-O 3.44Å; T177-F371 VanDerWaalsContact CA-O 3.31Å; T177-F371 WeakPolarHBondContact CA-O 3.48Å; V178-F371 HydrophobicContact CB-CB 4.15Å; V178-F371 PolarHBondContact N-O 2.91Å; V178-F371 PolarHBondContact O-N 3Å; V180-F371 HydrophobicContact CB-CE2 4.13Å; V180-F371 HydrophobicContact CG2-CD2 3.99Å; V180-F371 HydrophobicContact CG2-CE2 3.82Å; I189-F371 HydrophobicContact CD1-CE2 3.56Å; I189-F371 HydrophobicContact CD1-CZ 3.53Å; I189-F371 HydrophobicContact CG1-CZ 4.01Å; W191-F371 HydrophobicContact CB-CD1 4.48Å; W191-F371 HydrophobicContact CB-CE1 3.65Å; W191-F371 HydrophobicContact CB-CZ 4.3Å; W191-F371 AromaticContact CD2-CE1 3.85Å; W191-F371 HydrophobicContact CD2-CE1 3.85Å; W191-F371 AromaticContact CE3-CE1 3.94Å; W191-F371 HydrophobicContact CE3-CE1 3.94Å; W191-F371 HydrophobicContact CE3-CZ 4.26Å; W191-F371 AromaticContact CG-CE1 3.74Å; W191-F371 HydrophobicContact CG-CE1 3.74Å; F202-F371 AromaticContact CE2-CD1 3.97Å; F202-F371 HydrophobicContact CE2-CD1 3.97Å; F202-F371 HydrophobicContact CZ-CD1 4.13Å; L204-F371 HydrophobicContact CD1-CD1 3.64Å; L204-F371 HydrophobicContact CD1-CD2 4.02Å; L204-F371 HydrophobicContact CD1-CE1 3.6Å; L204-F371 HydrophobicContact CD1-CE2 3.99Å; L204-F371 HydrophobicContact CD1-CG 3.85Å; L204-F371 HydrophobicContact CD1-CZ 3.78Å; Y369-F371 HydrophobicContact CG-CE2 4.49Å; F371-F373 HydrophobicContact CB-CE2 3.92Å; F371-F373 HydrophobicContact CB-CZ 4.42Å; F371-I389 HydrophobicContact CD1-CD1 4.06Å; F371-I389 HydrophobicContact CD2-CD1 3.74Å; F371-I389 HydrophobicContact CE1-CD1 4.14Å; F371-I389 HydrophobicContact CE1-CG1 4.27Å; F371-I389 HydrophobicContact CE2-CD1 3.81Å; F371-I389 HydrophobicContact CE2-CG1 4.41Å; F371-I389 HydrophobicContact CE2-CG2 4.06Å; F371-I389 HydrophobicContact CG-CD1 3.88Å; F371-I389 HydrophobicContact CZ-CD1 4.01Å; F371-I389 HydrophobicContact CZ-CG1 4.17Å; F371-I389 HydrophobicContact CZ-CG2 3.92Å
372	K	96.5	Very high	92.3	Very high	70 Å²	70	42.1 Å²	42.1	30%	0.304	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	118.7	176.5	-68.9	-160.9	177.2	-175.9	0	110.4	F202 G203 Y205 I347 V370	F202-K372 WeakPolarHBondContact CA-O 3.43Å; G203-K372 PolarHBondContact N-O 3.5Å; G203-K372 PolarHBondContact O-N 2.68Å; Y205-K372 HydrophobicContact CD2-CD 4.21Å; Y205-K372 HydrophobicContact CD2-CG 4.2Å; Y205-K372 HydrophobicContact CE2-CB 4.46Å; Y205-K372 HydrophobicContact CE2-CD 3.73Å; Y205-K372 HydrophobicContact CE2-CG 4.04Å; I347-K372 HydrophobicContact CD1-CB 4.2Å; I347-K372 HydrophobicContact CD1-CD 4.11Å; V370-K372 HydrophobicContact CG1-CG 4.36Å
373	F	96.5	Very high	92.6	Very high	3 Å²	3	39.7 Å²	39.7	1%	0.013	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	99	173.8	-63.3	-76.1	0	0	0	108.6	I170 T175 A176 V178 F193 L200 G201 F202 F371 L385	I170-F373 HydrophobicContact CD1-CB 3.55Å; T175-F373 WeakPolarHBondContact CA-O 3.31Å; A176-F373 HydrophobicContact CB-CB 4.23Å; A176-F373 PolarHBondContact N-O 2.71Å; A176-F373 PolarHBondContact O-N 3.43Å; V178-F373 HydrophobicContact CG2-CD2 4.25Å; V178-F373 HydrophobicContact CG2-CE2 3.94Å; F193-F373 HydrophobicContact CB-CE1 4.04Å; F193-F373 HydrophobicContact CB-CZ 4.49Å; F193-F373 HydrophobicContact CD1-CE1 4.09Å; F193-F373 HydrophobicContact CD2-CE1 4.08Å; F193-F373 AromaticContact CG-CE1 3.81Å; F193-F373 HydrophobicContact CG-CE1 3.81Å; L200-F373 HydrophobicContact CD2-CB 4.03Å; L200-F373 HydrophobicContact CD2-CD1 3.97Å; L200-F373 HydrophobicContact CD2-CG 4.44Å; G201-F373 CarbonylContact O-C 3.53Å; G201-F373 WeakPolarHBondContact O-CA 3.38Å; F202-F373 AromaticContact CD2-CD1 3.91Å; F202-F373 HydrophobicContact CD2-CD1 3.91Å; F202-F373 AromaticContact CD2-CE1 3.61Å; F202-F373 HydrophobicContact CD2-CE1 3.61Å; F202-F373 HydrophobicContact CD2-CZ 4.28Å; F202-F373 AromaticContact CE2-CE1 3.89Å; F202-F373 HydrophobicContact CE2-CE1 3.89Å; F202-F373 HydrophobicContact CE2-CZ 4.13Å; F371-F373 HydrophobicContact CB-CE2 3.92Å; F371-F373 HydrophobicContact CB-CZ 4.42Å; F373-L385 HydrophobicContact CB-CD2 3.99Å; F373-L385 HydrophobicContact CD1-CD1 3.79Å; F373-L385 HydrophobicContact CD1-CD2 3.62Å; F373-L385 HydrophobicContact CD1-CG 4.38Å; F373-L385 HydrophobicContact CD2-CD2 3.48Å; F373-L385 VanDerWaalsContact CD2-CD2 3.48Å; F373-L385 HydrophobicContact CE1-CD1 3.8Å; F373-L385 HydrophobicContact CE1-CD2 3.87Å; F373-L385 HydrophobicContact CE1-CG 4.48Å; F373-L385 HydrophobicContact CE2-CD2 3.74Å; F373-L385 HydrophobicContact CG-CD1 4.42Å; F373-L385 HydrophobicContact CG-CD2 3.41Å; F373-L385 VanDerWaalsContact CG-CD2 3.41Å; F373-L385 HydrophobicContact CZ-CD1 4.44Å; F373-L385 HydrophobicContact CZ-CD2 3.92Å
374	D	94.1	Very high	93	Very high	26 Å²	26	44.8 Å²	44.8	14%	0.139	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	116.4	-166.4	-172.9	-8.4	0	0	0	110.9	T175 L200 G201 I347 S376 F377	T175-D374 HydrophobicContact CG2-CB 4.47Å; T175-D374 PolarHBondContact OG1-OD1 2.76Å; L200-D374 WeakPolarHBondContact CD1-O 3.4Å; G201-D374 WeakPolarHBondContact CA-O 2.95Å; G201-D374 PolarHBondContact N-O 2.83Å; G201-D374 PolarHBondContact O-N 2.83Å; I347-D374 HydrophobicContact CG2-CB 4.03Å; D374-S376 WeakPolarHBondContact OD1-CA 3.47Å; D374-S376 WeakPolarHBondContact OD1-CB 3.46Å; D374-S376 PolarHBondContact OD1-N 3.13Å; D374-S376 PolarHBondContact OD1-OG 3.29Å; D374-S376 PolarHBondContact OD2-OG 2.74Å; D374-F377 WeakPolarHBondContact O-CE1 3.36Å
375	N	94.6	Very high	93.5	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.211	C	C	.	.			trans	-115.3	16.9	171.3	-164.3	30.2	0	0	0	112.1	I170 S171 L173 A174 L200 F377 S378 R381 K383	I170-N375 HydrophobicContact CB-CB 4.36Å; I170-N375 HydrophobicContact CG2-CB 3.59Å; I170-N375 PolarHBondContact O-ND2 2.98Å; S171-N375 PolarHBondContact O-ND2 3.23Å; L173-N375 PolarHBondContact N-O 2.97Å; A174-N375 CarbonylContact O-C 3.53Å; A174-N375 VanDerWaalsContact O-C 3.26Å; A174-N375 WeakPolarHBondContact O-CA 3.31Å; A174-N375 VanDerWaalsContact O-CB 3.22Å; A174-N375 WeakPolarHBondContact O-CB 3.09Å; A174-N375 PolarHBondContact O-N 2.61Å; L200-N375 HydrophobicContact CD1-CB 3.95Å; N375-F377 PolarHBondContact O-N 3.48Å; N375-F377 VanDerWaalsContact O-N 3.11Å; N375-S378 PolarHBondContact O-N 2.86Å; N375-S378 WeakPolarHBondContact OD1-CB 3.34Å; N375-R381 PolarHBondContact ND2-O 3.04Å; N375-K383 HydrophobicContact CB-CD 4.48Å; N375-K383 VanDerWaalsContact OD1-CD 3.31Å; N375-K383 WeakPolarHBondContact OD1-CD 3.4Å; N375-K383 WeakPolarHBondContact OD1-CE 3.48Å; N375-K383 PolarHBondContact OD1-NZ 3.34Å
376	S	88.3	Confident	94	Very high	57 Å²	57	45.1 Å²	45.1	40%	0.399	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-20.6	-178.2	66.4	0	0	0	0	113.6	L173 A174 D374	L173-S376 WeakPolarHBondContact CD2-O 3.38Å; A174-S376 PolarHBondContact O-N 2.68Å; D374-S376 WeakPolarHBondContact OD1-CA 3.47Å; D374-S376 WeakPolarHBondContact OD1-CB 3.46Å; D374-S376 PolarHBondContact OD1-N 3.13Å; D374-S376 PolarHBondContact OD1-OG 3.29Å; D374-S376 PolarHBondContact OD2-OG 2.74Å
377	F	88.9	Confident	94.4	Very high	74 Å²	74	43.5 Å²	43.5	33%	0.325	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-10.8	178	61.8	-95.2	0	0	0	114	R349 D374 N375	R349-F377 HydrophobicContact CG-CE1 4.06Å; R349-F377 HydrophobicContact CG-CZ 4.13Å; D374-F377 WeakPolarHBondContact O-CE1 3.36Å; N375-F377 PolarHBondContact O-N 3.48Å; N375-F377 VanDerWaalsContact O-N 3.11Å
378	S	86.6	Confident	94.7	Very high	15 Å²	15	45.8 Å²	45.8	11%	0.105	21%	0.206	C	C	.	.			trans	-96.9	111.2	-177	-159.6	0	0	0	0	111.3	S172 L173 N375 R381 K383	S172-S378 CarbonylContact C-O 3.52Å; S172-S378 VanDerWaalsContact CA-O 3.31Å; S172-S378 WeakPolarHBondContact CA-O 3.2Å; S172-S378 WeakPolarHBondContact CB-O 3.41Å; L173-S378 PolarHBondContact N-O 3.32Å; N375-S378 PolarHBondContact O-N 2.86Å; N375-S378 WeakPolarHBondContact OD1-CB 3.34Å; S378-R381 WeakPolarHBondContact OG-CB 3.08Å; S378-R381 PolarHBondContact OG-N 3.21Å; S378-R381 PolarHBondContact OG-O 3.48Å; S378-K383 VanDerWaalsContact CB-NZ 3.32Å; S378-K383 PolarHBondContact OG-NZ 2.89Å
379	L	89.8	Confident	94.8	Very high	103 Å²	103	47.2 Å²	47.2	54%	0.539	21%	0.213	S	C	.	.	S	Bend	trans	-69	-39.2	178.1	-65	168	0	0	0	112.6	S172 L173	S172-L379 VanDerWaalsContact CB-O 3.3Å; S172-L379 WeakPolarHBondContact CB-O 3.39Å; L173-L379 HydrophobicContact CD2-CD2 4.11Å
380	W	91.6	Very high	94.8	Very high	207 Å²	207	51.5 Å²	51.5	78%	0.784	23%	0.232	S	C	*	.	S	Bend	trans	-123.9	-8.6	-165.9	-43.1	108.3	0	0	0	114.9
381	R	93.3	Very high	94.7	Very high	136 Å²	136	55.5 Å²	55.5	51%	0.513	25%	0.247	S	C	.	.			trans	-119.5	108.1	-170.3	-56.4	-60.8	-172.5	-167.3	0.9	110.8	Y198 N375 S378 K383	Y198-R381 HydrophobicContact CD2-CB 4.18Å; Y198-R381 HydrophobicContact CD2-CG 4.49Å; Y198-R381 HydrophobicContact CE1-CG 4.42Å; Y198-R381 HydrophobicContact CE2-CB 4.09Å; Y198-R381 HydrophobicContact CE2-CG 4.03Å; Y198-R381 PolarHBondContact OH-NE 2.91Å; N375-R381 PolarHBondContact ND2-O 3.04Å; S378-R381 WeakPolarHBondContact OG-CB 3.08Å; S378-R381 PolarHBondContact OG-N 3.21Å; S378-R381 PolarHBondContact OG-O 3.48Å; R381-K383 PolarHBondContact O-NZ 3.18Å
382	S	96.2	Very high	94.5	Very high	45 Å²	45	58 Å²	58	32%	0.315	26%	0.262	S	S	.	.			trans	-65.6	155.2	159.9	-42.7	0	0	0	0	110.6	K169 I170	K169-S382 WeakPolarHBondContact CE-OG 3.42Å; I170-S382 CarbonylContact O-C 3.26Å; I170-S382 WeakPolarHBondContact O-CA 3.12Å; I170-S382 WeakPolarHBondContact O-CB 3.38Å
383	K	96.7	Very high	94.1	Very high	7 Å²	7	61.4 Å²	61.4	3%	0.03	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	130.7	-179.3	-66.3	171.3	178.5	54	0	109.6	I170 D199 L200 N375 S378 R381	I170-K383 PolarHBondContact N-O 3.4Å; I170-K383 PolarHBondContact O-N 3.5Å; D199-K383 WeakPolarHBondContact O-CD 3.3Å; D199-K383 WeakPolarHBondContact O-CE 3.39Å; L200-K383 HydrophobicContact CB-CD 4.28Å; L200-K383 HydrophobicContact CD1-CB 4.43Å; L200-K383 HydrophobicContact CD1-CD 3.51Å; L200-K383 HydrophobicContact CG-CD 4.46Å; N375-K383 HydrophobicContact CB-CD 4.48Å; N375-K383 VanDerWaalsContact OD1-CD 3.31Å; N375-K383 WeakPolarHBondContact OD1-CD 3.4Å; N375-K383 WeakPolarHBondContact OD1-CE 3.48Å; N375-K383 PolarHBondContact OD1-NZ 3.34Å; S378-K383 VanDerWaalsContact CB-NZ 3.32Å; S378-K383 PolarHBondContact OG-NZ 2.89Å; R381-K383 PolarHBondContact O-NZ 3.18Å
384	W	97.8	Very high	93.9	Very high	122 Å²	122	64.4 Å²	64.4	46%	0.462	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	119.4	165.7	-75.6	103	0	0	0	108.4	K169 T195 Y386	K169-W384 HydrophobicContact CB-CD2 4.15Å; K169-W384 HydrophobicContact CB-CE3 4.02Å; K169-W384 HydrophobicContact CB-CH2 4.08Å; K169-W384 HydrophobicContact CB-CZ2 4.2Å; K169-W384 HydrophobicContact CB-CZ3 3.99Å; K169-W384 HydrophobicContact CD-CZ2 4.28Å; T195-W384 VanDerWaalsContact CA-O 3.24Å; T195-W384 WeakPolarHBondContact CA-O 3.07Å; W384-Y386 HydrophobicContact CB-CE2 4.13Å
385	L	98.1	Very high	93.9	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	122.3	175.3	172.6	69.2	0	0	0	108.7	C167 I168 I170 F193 L200 F373 Y387	C167-L385 CarbonylContact C-O 3.58Å; C167-L385 VanDerWaalsContact CA-O 3.28Å; C167-L385 WeakPolarHBondContact CA-O 3.36Å; I168-L385 HydrophobicContact CD1-CD2 4Å; I168-L385 HydrophobicContact CG1-CB 3.99Å; I168-L385 HydrophobicContact CG1-CD2 3.97Å; I168-L385 HydrophobicContact CG1-CG 4.37Å; I168-L385 PolarHBondContact N-O 3.45Å; I168-L385 PolarHBondContact O-N 2.92Å; I170-L385 HydrophobicContact CD1-CB 4.13Å; I170-L385 HydrophobicContact CD1-CD2 4.09Å; I170-L385 HydrophobicContact CG1-CB 4.45Å; F193-L385 HydrophobicContact CB-CD1 3.88Å; F193-L385 HydrophobicContact CD2-CD1 4.25Å; F193-L385 HydrophobicContact CG-CD1 4.45Å; L200-L385 HydrophobicContact CD2-CD1 3.91Å; F373-L385 HydrophobicContact CB-CD2 3.99Å; F373-L385 HydrophobicContact CD1-CD1 3.79Å; F373-L385 HydrophobicContact CD1-CD2 3.62Å; F373-L385 HydrophobicContact CD1-CG 4.38Å; F373-L385 HydrophobicContact CD2-CD2 3.48Å; F373-L385 VanDerWaalsContact CD2-CD2 3.48Å; F373-L385 HydrophobicContact CE1-CD1 3.8Å; F373-L385 HydrophobicContact CE1-CD2 3.87Å; F373-L385 HydrophobicContact CE1-CG 4.48Å; F373-L385 HydrophobicContact CE2-CD2 3.74Å; F373-L385 HydrophobicContact CG-CD1 4.42Å; F373-L385 HydrophobicContact CG-CD2 3.41Å; F373-L385 VanDerWaalsContact CG-CD2 3.41Å; F373-L385 HydrophobicContact CZ-CD1 4.44Å; F373-L385 HydrophobicContact CZ-CD2 3.92Å; L385-Y387 HydrophobicContact CD2-CD1 4.04Å; L385-Y387 HydrophobicContact CD2-CG 4.49Å; L385-Y387 HydrophobicContact CG-CD1 4.21Å
386	Y	98.5	Very high	93.9	Very high	20 Å²	20	70.1 Å²	70.1	8%	0.078	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	120.7	166.7	-56.6	-100	0	0	0	106.5	K156 I159 L160 C167 F193 A194 D196 W384	K156-Y386 HydrophobicContact CB-CD1 4.06Å; K156-Y386 HydrophobicContact CB-CE1 4.08Å; K156-Y386 HydrophobicContact CB-CG 4.38Å; K156-Y386 HydrophobicContact CD-CD2 4.18Å; K156-Y386 HydrophobicContact CD-CE2 4Å; K156-Y386 HydrophobicContact CG-CD1 4.04Å; K156-Y386 HydrophobicContact CG-CD2 3.86Å; K156-Y386 HydrophobicContact CG-CE1 4.23Å; K156-Y386 HydrophobicContact CG-CE2 4.08Å; K156-Y386 HydrophobicContact CG-CG 3.86Å; I159-Y386 HydrophobicContact CB-CD1 4.23Å; I159-Y386 HydrophobicContact CG2-CD1 4.12Å; L160-Y386 HydrophobicContact CD1-CE1 3.9Å; L160-Y386 HydrophobicContact CD2-CE1 3.84Å; L160-Y386 HydrophobicContact CG-CD1 4.36Å; L160-Y386 HydrophobicContact CG-CE1 3.73Å; C167-Y386 HydrophobicContact CB-CD1 4.27Å; C167-Y386 HydrophobicContact CB-CE1 4.44Å; C167-Y386 VanDerWaalsContact SG-CE1 3.59Å; F193-Y386 CarbonylContact C-O 3.53Å; F193-Y386 WeakPolarHBondContact CA-O 3.42Å; F193-Y386 WeakPolarHBondContact CB-O 3.26Å; A194-Y386 PolarHBondContact N-O 3.42Å; A194-Y386 PolarHBondContact O-N 2.94Å; D196-Y386 VanDerWaalsContact OD1-CE2 3.3Å; D196-Y386 WeakPolarHBondContact OD1-CE2 3.42Å; D196-Y386 PolarHBondContact OD1-OH 3.19Å; D196-Y386 PolarHBondContact OD2-OH 2.66Å; W384-Y386 HydrophobicContact CB-CE2 4.13Å
387	Y	98.3	Very high	94.2	Very high	19 Å²	19	70.8 Å²	70.8	8%	0.075	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	161.4	179.7	75.6	-82.9	0	0	0	112	I159 C166 I168 V178 E192 L385 I389	I159-Y387 WeakPolarHBondContact CD1-O 3.43Å; C166-Y387 HydrophobicContact CB-CD1 4.26Å; C166-Y387 HydrophobicContact CB-CE1 4.11Å; C166-Y387 HydrophobicContact CB-CE2 4.47Å; C166-Y387 WeakPolarHBondContact CB-O 3.42Å; C166-Y387 WeakPolarHBondContact O-CD1 3.44Å; C166-Y387 PolarHBondContact O-N 3.24Å; I168-Y387 HydrophobicContact CD1-CE1 4.28Å; I168-Y387 HydrophobicContact CG1-CE1 4.34Å; I168-Y387 HydrophobicContact CG2-CE1 4.26Å; V178-Y387 HydrophobicContact CG1-CE2 4.32Å; V178-Y387 HydrophobicContact CG2-CE2 4.29Å; E192-Y387 CarbonylContact O-C 3.54Å; E192-Y387 VanDerWaalsContact O-CA 3.22Å; E192-Y387 WeakPolarHBondContact O-CA 3.46Å; L385-Y387 HydrophobicContact CD2-CD1 4.04Å; L385-Y387 HydrophobicContact CD2-CG 4.49Å; L385-Y387 HydrophobicContact CG-CD1 4.21Å; Y387-I389 HydrophobicContact CD2-CD1 3.89Å; Y387-I389 HydrophobicContact CD2-CG1 4.1Å; Y387-I389 HydrophobicContact CE2-CD1 4.09Å
388	R	97.4	Very high	94.5	Very high	47 Å²	47	70.6 Å²	70.6	18%	0.177	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	132	169	176.6	165.9	64.4	-168.4	-1.2	108.1	F155 E158 I159 W191 E192 F390	F155-R388 HydrophobicContact CE2-CB 4.45Å; E158-R388 VanDerWaalsContact CD-NH1 3.26Å; E158-R388 IonicContact OE1-CZ 3.59Å; E158-R388 IonicContact OE1-NH1 3.07Å; E158-R388 PolarHBondContact OE1-NH1 3.01Å; E158-R388 IonicContact OE2-NH1 3.41Å; E158-R388 PolarHBondContact OE2-NH1 3.47Å; E158-R388 IonicContact OE2-NH2 3.57Å; I159-R388 HydrophobicContact CD1-CB 3.92Å; W191-R388 CarbonylContact C-O 3.55Å; W191-R388 VanDerWaalsContact CA-O 3.29Å; W191-R388 WeakPolarHBondContact CA-O 3.49Å; E192-R388 PolarHBondContact N-O 3.46Å; E192-R388 PolarHBondContact O-N 3.28Å; E192-R388 IonicContact OE1-NH2 2.68Å; E192-R388 IonicContact OE2-CZ 2.79Å; E192-R388 IonicContact OE2-NE 2.62Å; E192-R388 PolarHBondContact OE2-NE 3.49Å; E192-R388 IonicContact OE2-NH2 3.59Å; E192-R388 PolarHBondContact OE2-NH2 3.37Å; R388-F390 HydrophobicContact CG-CD1 4Å; R388-F390 HydrophobicContact CG-CE1 4.39Å
389	I	97.3	Very high	95.1	Very high	31 Å²	31	74.3 Å²	74.3	16%	0.159	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	133.5	178.2	-60.3	161.6	0	0	0	108	V178 V180 I189 C190 W191 F371 Y387	V178-I389 HydrophobicContact CB-CD1 4.38Å; V178-I389 HydrophobicContact CG1-CD1 3.94Å; V180-I389 HydrophobicContact CG1-CG2 4.24Å; V180-I389 HydrophobicContact CG2-CD1 4.05Å; V180-I389 HydrophobicContact CG2-CG2 4.08Å; I189-I389 HydrophobicContact CD1-CG2 3.71Å; I189-I389 HydrophobicContact CG1-CG2 3.73Å; C190-I389 WeakPolarHBondContact O-CA 3.27Å; W191-I389 HydrophobicContact CB-CG1 4.04Å; F371-I389 HydrophobicContact CD1-CD1 4.06Å; F371-I389 HydrophobicContact CD2-CD1 3.74Å; F371-I389 HydrophobicContact CE1-CD1 4.14Å; F371-I389 HydrophobicContact CE1-CG1 4.27Å; F371-I389 HydrophobicContact CE2-CD1 3.81Å; F371-I389 HydrophobicContact CE2-CG1 4.41Å; F371-I389 HydrophobicContact CE2-CG2 4.06Å; F371-I389 HydrophobicContact CG-CD1 3.88Å; F371-I389 HydrophobicContact CZ-CD1 4.01Å; F371-I389 HydrophobicContact CZ-CG1 4.17Å; F371-I389 HydrophobicContact CZ-CG2 3.92Å; Y387-I389 HydrophobicContact CD2-CD1 3.89Å; Y387-I389 HydrophobicContact CD2-CG1 4.1Å; Y387-I389 HydrophobicContact CE2-CD1 4.09Å
390	F	95.7	Very high	95.5	Very high	89 Å²	89	72.3 Å²	72.3	39%	0.39	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	161.6	-178.7	54.9	-83	0	0	0	110	C190 R388 T392	C190-F390 HydrophobicContact CB-CD1 4.34Å; C190-F390 HydrophobicContact CB-CD2 3.84Å; C190-F390 HydrophobicContact CB-CE1 3.92Å; C190-F390 HydrophobicContact CB-CE2 3.37Å; C190-F390 HydrophobicContact CB-CG 4.31Å; C190-F390 HydrophobicContact CB-CZ 3.42Å; C190-F390 VanDerWaalsContact CB-CZ 3.42Å; C190-F390 PolarHBondContact N-O 3.43Å; C190-F390 PolarHBondContact O-N 2.94Å; R388-F390 HydrophobicContact CG-CD1 4Å; R388-F390 HydrophobicContact CG-CE1 4.39Å; F390-T392 HydrophobicContact CD2-CG2 4.47Å; F390-T392 HydrophobicContact CE2-CG2 4.39Å
391	Y	95.1	Very high	95.7	Very high	95 Å²	95	61.9 Å²	61.9	37%	0.373	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	156.5	173.7	65.8	-95.9	0	0	0	111	H183 A188 Y363 H393	H183-Y391 HydrophobicContact CB-CD1 3.79Å; H183-Y391 HydrophobicContact CB-CD2 4.37Å; H183-Y391 HydrophobicContact CB-CE1 3.91Å; H183-Y391 HydrophobicContact CB-CE2 4.49Å; H183-Y391 HydrophobicContact CB-CG 4.04Å; H183-Y391 AromaticContact CD2-CE1 3.94Å; H183-Y391 AromaticContact CE1-CZ 3.92Å; H183-Y391 AromaticContact CG-CE1 3.69Å; H183-Y391 AromaticContact CG-CZ 3.75Å; H183-Y391 AromaticContact ND1-CE2 3.79Å; H183-Y391 AromaticContact ND1-CZ 3.62Å; A188-Y391 CarbonylContact O-C 3.59Å; A188-Y391 WeakPolarHBondContact O-CA 3.36Å; A188-Y391 WeakPolarHBondContact O-CB 3.45Å; Y363-Y391 WeakPolarHBondContact OH-CB 3.5Å; Y391-H393 AromaticContact CE2-CE1 3.6Å; Y391-H393 AromaticContact CE2-NE2 3.66Å
392	T	92.4	Very high	96	Very high	53 Å²	53	55.8 Å²	55.8	33%	0.325	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	158.9	172.4	64.9	0	0	0	0	110.9	G186 R187 A188 F390	G186-T392 CarbonylContact C-O 3.54Å; G186-T392 WeakPolarHBondContact CA-O 3.45Å; R187-T392 PolarHBondContact N-O 3.41Å; A188-T392 PolarHBondContact O-N 3.26Å; F390-T392 HydrophobicContact CD2-CG2 4.47Å; F390-T392 HydrophobicContact CE2-CG2 4.39Å
393	H	87.9	Confident	95.9	Very high	141 Å²	141	56.7 Å²	56.7	65%	0.653	25%	0.248	S	C	*	.			trans	-97.9	0	-178.3	-68.6	-72.6	0	0	0	113.3	N185 R187 Y391	N185-H393 PolarHBondContact O-CE1 3.47Å; N185-H393 PolarHBondContact O-ND1 2.96Å; R187-H393 WeakPolarHBondContact CD-OXT 3.37Å; R187-H393 WeakPolarHBondContact CG-OXT 3.38Å; R187-H393 VanDerWaalsContact CZ-OXT 3.23Å; R187-H393 PolarHBondContact NE-OXT 3.13Å; R187-H393 PolarHBondContact NH1-OXT 2.88Å; Y391-H393 AromaticContact CE2-CE1 3.6Å; Y391-H393 AromaticContact CE2-NE2 3.66Å

Retrieved 393 of 393 residues in 112.3 ms (Link to these results)

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