A0A5K4FAT5_SCHMA Loading...

Envelope glycoprotein D

AlphaFold DB , UniProt , Accession A0A5K4FAT5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 510 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	46.1	Very low	43.1	Very low	203 Å²	203	100.5 Å²	100.5	100%	1	52%	0.515	S	S	*	.				0	-53.8	0	-98.6	-165.9	-163	0	0	112.7	C3 I4 Y5	M1-C3 PolarHBondContact O-N 3.25Å; M1-I4 PolarHBondContact O-N 2.95Å; M1-I4 VanDerWaalsContact O-N 3.15Å; M1-Y5 PolarHBondContact O-N 3.2Å
2	L	40	Very low	43.1	Very low	117 Å²	117	101.8 Å²	101.8	61%	0.613	52%	0.524	S	S	*	.	H	α-helix	trans	-58.9	-43.2	-176.7	-144.5	93.8	0	0	0	113.5	I4 Y5 I6	L2-I4 VanDerWaalsContact C-N 3.26Å; L2-I4 PolarHBondContact O-N 3.19Å; L2-Y5 WeakPolarHBondContact O-CB 3.4Å; L2-Y5 PolarHBondContact O-N 3.48Å; L2-Y5 VanDerWaalsContact O-N 3.14Å; L2-I6 HydrophobicContact CD2-CD1 4.02Å; L2-I6 HydrophobicContact CG-CD1 4.36Å; L2-I6 WeakPolarHBondContact O-CG1 3.28Å; L2-I6 PolarHBondContact O-N 2.87Å
3	C	40	Very low	43	Very low	32 Å²	32	100.7 Å²	100.7	22%	0.216	52%	0.524	C	S	.	.	H	α-helix	trans	-62.2	-27.8	177.5	-78.4	0	0	0	0	113.9	M1 S7 C461	M1-C3 PolarHBondContact O-N 3.25Å; C3-S7 WeakPolarHBondContact O-CB 3.39Å; C3-S7 PolarHBondContact O-N 2.72Å; C3-S7 PolarHBondContact O-OG 3.2Å; C3-C461 HydrophobicContact CB-CB 4.09Å; C3-C461 WeakPolarHBondContact CB-SG 3.15Å; C3-C461 WeakPolarHBondContact SG-CB 3.24Å; C3-C461 CovalentContact SG-SG 2.06Å; C3-C461 PolarHBondContact SG-SG 2.92Å
4	I	47.5	Very low	42.7	Very low	118 Å²	118	103.7 Å²	103.7	61%	0.605	53%	0.531	S	S	*	.	H	α-helix	trans	-74.6	-39.7	175.5	-60.9	174.1	0	0	0	110.3	M1 L2 S8	M1-I4 PolarHBondContact O-N 2.95Å; M1-I4 VanDerWaalsContact O-N 3.15Å; L2-I4 VanDerWaalsContact C-N 3.26Å; L2-I4 PolarHBondContact O-N 3.19Å; I4-S8 PolarHBondContact O-N 2.76Å; I4-S8 PolarHBondContact O-OG 3.39Å
5	Y	44.4	Very low	42.8	Very low	176 Å²	176	104.9 Å²	104.9	69%	0.69	53%	0.531	S	S	*	.	H	α-helix	trans	-66.1	-44.1	176.9	-118.5	-89.4	0	0	0	112.1	M1 L2 S7 S8 I9	M1-Y5 PolarHBondContact O-N 3.2Å; L2-Y5 WeakPolarHBondContact O-CB 3.4Å; L2-Y5 PolarHBondContact O-N 3.48Å; L2-Y5 VanDerWaalsContact O-N 3.14Å; Y5-S7 PolarHBondContact O-N 3.43Å; Y5-S8 PolarHBondContact O-N 2.82Å; Y5-I9 WeakPolarHBondContact O-CG1 3.35Å; Y5-I9 PolarHBondContact O-N 3.04Å
6	I	48.8	Very low	42.5	Very low	62 Å²	62	106.6 Å²	106.6	32%	0.318	54%	0.541	S	S	.	.	H	α-helix	trans	-64.9	-41.2	178.8	-65.8	168.6	0	0	0	111	L2 S8 I9 E10	L2-I6 HydrophobicContact CD2-CD1 4.02Å; L2-I6 HydrophobicContact CG-CD1 4.36Å; L2-I6 WeakPolarHBondContact O-CG1 3.28Å; L2-I6 PolarHBondContact O-N 2.87Å; I6-S8 VanDerWaalsContact C-N 3.31Å; I6-S8 PolarHBondContact O-N 3.46Å; I6-I9 PolarHBondContact O-N 2.81Å; I6-E10 PolarHBondContact O-N 3.22Å
7	S	43.4	Very low	42.2	Very low	52 Å²	52	108.2 Å²	108.2	36%	0.364	55%	0.552	S	S	.	*	H	α-helix	trans	-66.8	-31.9	178.6	-57.5	0	0	0	0	112.7	C3 Y5 I11	C3-S7 WeakPolarHBondContact O-CB 3.39Å; C3-S7 PolarHBondContact O-N 2.72Å; C3-S7 PolarHBondContact O-OG 3.2Å; Y5-S7 PolarHBondContact O-N 3.43Å; S7-I11 WeakPolarHBondContact O-CD1 3.48Å; S7-I11 WeakPolarHBondContact O-CG1 3.48Å; S7-I11 PolarHBondContact O-N 3.41Å
8	S	39.8	Very low	42.1	Very low	67 Å²	67	111.6 Å²	111.6	47%	0.469	57%	0.565	S	S	.	*	H	α-helix	trans	-71	-30.8	175.1	-66.4	0	0	0	0	113.2	I4 Y5 I6	I4-S8 PolarHBondContact O-N 2.76Å; I4-S8 PolarHBondContact O-OG 3.39Å; Y5-S8 PolarHBondContact O-N 2.82Å; I6-S8 VanDerWaalsContact C-N 3.31Å; I6-S8 PolarHBondContact O-N 3.46Å
9	I	45.5	Very low	41.9	Very low	104 Å²	104	112.3 Å²	112.3	53%	0.533	57%	0.569	S	S	.	*	H	α-helix	trans	-74.6	-39.3	178.2	-66.4	165.8	0	0	0	110.9	Y5 I6 I11 N12 V13	Y5-I9 WeakPolarHBondContact O-CG1 3.35Å; Y5-I9 PolarHBondContact O-N 3.04Å; I6-I9 PolarHBondContact O-N 2.81Å; I9-I11 PolarHBondContact O-N 3.24Å; I9-N12 PolarHBondContact O-N 2.97Å; I9-V13 PolarHBondContact O-N 3.33Å
10	E	38	Very low	41.7	Very low	78 Å²	78	113.8 Å²	113.8	36%	0.364	58%	0.579	S	S	.	*	H	α-helix	trans	-69.5	-32.4	-176.3	-150.5	-174.8	154.9	0	0	113.1	I6 N12 V13 K14 K464	I6-E10 PolarHBondContact O-N 3.22Å; E10-N12 VanDerWaalsContact C-N 3.32Å; E10-N12 PolarHBondContact O-N 3.02Å; E10-V13 PolarHBondContact O-N 2.92Å; E10-K14 PolarHBondContact O-N 3.27Å; E10-K14 IonicContact OE1-NZ 3.73Å; E10-K14 PolarHBondContact OE1-NZ 2.82Å; E10-K464 IonicContact OE2-NZ 2.74Å; E10-K464 PolarHBondContact OE2-NZ 2.99Å
11	I	40.9	Very low	41.5	Very low	97 Å²	97	115.5 Å²	115.5	50%	0.497	59%	0.59	S	S	.	*	H	α-helix	trans	-67.6	-33.9	176.1	-66.8	168.5	0	0	0	111.3	S7 I9	S7-I11 WeakPolarHBondContact O-CD1 3.48Å; S7-I11 WeakPolarHBondContact O-CG1 3.48Å; S7-I11 PolarHBondContact O-N 3.41Å; I9-I11 PolarHBondContact O-N 3.24Å
12	N	42.9	Very low	40.9	Very low	116 Å²	116	112.3 Å²	112.3	62%	0.62	58%	0.581	S	S	*	*	H	α-helix	trans	-76.2	-29.9	179.7	-81.7	-21.2	0	0	0	113.2	I9 E10	I9-N12 PolarHBondContact O-N 2.97Å; E10-N12 VanDerWaalsContact C-N 3.32Å; E10-N12 PolarHBondContact O-N 3.02Å
13	V	41.5	Very low	40.5	Very low	87 Å²	87	113.2 Å²	113.2	53%	0.527	59%	0.592	S	S	.	*	H	α-helix	trans	-79	-38.1	179.9	177.9	0	0	0	0	112.1	I9 E10 K15 L16	I9-V13 PolarHBondContact O-N 3.33Å; E10-V13 PolarHBondContact O-N 2.92Å; V13-K15 VanDerWaalsContact C-N 3.34Å; V13-K15 PolarHBondContact O-N 3.3Å; V13-L16 PolarHBondContact O-N 3.32Å
14	K	39.7	Very low	40.1	Very low	143 Å²	143	119.1 Å²	119.1	62%	0.622	62%	0.621	S	S	*	*	H	α-helix	trans	-70.1	-27.4	179.2	-84.5	176.9	175.8	162.1	0	113.9	E10	E10-K14 PolarHBondContact O-N 3.27Å; E10-K14 IonicContact OE1-NZ 3.73Å; E10-K14 PolarHBondContact OE1-NZ 2.82Å
15	K	43.3	Very low	39.5	Very low	122 Å²	122	121.7 Å²	121.7	53%	0.53	64%	0.636	S	S	.	*	H	α-helix	trans	-81.6	-22.5	177	-78	-174.9	174	-175.2	0	113.7	V13	V13-K15 VanDerWaalsContact C-N 3.34Å; V13-K15 PolarHBondContact O-N 3.3Å
16	L	38.6	Very low	39.1	Very low	132 Å²	132	121.7 Å²	121.7	69%	0.691	64%	0.642	S	S	*	*	H	α-helix	trans	-73.2	-35.7	177.5	-128.6	82.4	0	0	0	112.5	V13 Q18	V13-L16 PolarHBondContact O-N 3.32Å; L16-Q18 VanDerWaalsContact C-N 3.3Å; L16-Q18 PolarHBondContact O-N 3.01Å
17	N	36.9	Very low	38.4	Very low	134 Å²	134	124.6 Å²	124.6	72%	0.717	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-5.3	-177	-80.7	1.1	0	0	0	115.3
18	Q	40.4	Very low	38	Very low	168 Å²	168	128.8 Å²	128.8	79%	0.785	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.9	-6	178	-79.2	-173.4	-20.6	0	0	113.7	L16	L16-Q18 VanDerWaalsContact C-N 3.3Å; L16-Q18 PolarHBondContact O-N 3.01Å
19	L	38.2	Very low	37.7	Very low	125 Å²	125	132.5 Å²	132.5	65%	0.654	69%	0.691	S	S	*	*	S	Bend	trans	-90.6	-13.1	-176.4	-117.9	82	0	0	0	114.9	N21	L19-N21 PolarHBondContact O-N 3.33Å
20	D	37.9	Very low	37.3	Very low	142 Å²	142	135.1 Å²	135.1	76%	0.759	71%	0.706	S	S	*	*	S	Bend	trans	-83.1	1.9	-171	-89.3	-18.1	0	0	0	115.8
21	N	38.2	Very low	37.3	Very low	151 Å²	151	137.6 Å²	137.6	81%	0.807	72%	0.721	S	S	*	*	S	Bend	trans	-115.2	12.6	-162.1	-135.2	8.1	0	0	0	117.6	L19	L19-N21 PolarHBondContact O-N 3.33Å
22	V	33.8	Very low	37	Very low	135 Å²	135	140.3 Å²	140.3	82%	0.818	73%	0.732	S	S	*	*			trans	-145.9	89	-178.3	-168.5	0	0	0	0	112.8
23	T	31	Very low	36.9	Very low	136 Å²	136	142.4 Å²	142.4	83%	0.834	74%	0.743	S	S	*	*			trans	-147	97.4	163.9	5.7	0	0	0	0	109.9
24	N	32.2	Very low	36.7	Very low	156 Å²	156	147.3 Å²	147.3	83%	0.834	76%	0.759	S	S	*	*			trans	-170.6	99.3	159.6	-103.3	-17.8	0	0	0	109.8
25	N	34.8	Very low	36.7	Very low	172 Å²	172	145.7 Å²	145.7	92%	0.92	76%	0.757	S	S	*	*				171	146.7	129.2	-86.7	-19.8	0	0	0	112.1
26	H	35.8	Very low	36.5	Very low	176 Å²	176	145.3 Å²	145.3	82%	0.815	77%	0.768	S	S	*	*			trans	-107.3	175.3	-154.5	-135.6	10.2	0	0	0	111.9
27	N	34.4	Very low	36.8	Very low	123 Å²	123	144.2 Å²	144.2	66%	0.658	76%	0.76	S	S	*	*			trans	82.7	138.2	160.3	-64.2	8.6	0	0	0	116.7
28	D	35.1	Very low	36.9	Very low	140 Å²	140	145.7 Å²	145.7	75%	0.749	76%	0.76	S	S	*	*			cis	-159.6	170.6	15.8	-94.3	-30.4	0	0	0	111.9
29	D	33.1	Very low	37	Very low	145 Å²	145	143.3 Å²	143.3	78%	0.775	75%	0.753	S	S	*	*			trans	-38.4	153.2	-179.2	-76.6	-45.2	0	0	0	122.1
30	L	37.7	Very low	37.2	Very low	160 Å²	160	139.1 Å²	139.1	84%	0.838	74%	0.74	S	S	*	*				178.1	121.6	120.2	-93.3	150.1	0	0	0	113.9
31	D	36.9	Very low	37.6	Very low	129 Å²	129	135.8 Å²	135.8	69%	0.69	72%	0.722	S	S	*	*			trans	14.5	156.7	136.7	-81.7	-14.2	0	0	0	120.8
32	H	35.8	Very low	37.9	Very low	155 Å²	155	133.3 Å²	133.3	72%	0.718	71%	0.709	S	S	*	*			cis	-171.9	135.6	-8.8	-118.9	-45.6	0	0	0	102.5
33	D	39.4	Very low	38.6	Very low	160 Å²	160	131.6 Å²	131.6	86%	0.856	70%	0.695	S	S	*	*			trans	178.2	150.8	142.2	-97	-23.5	0	0	0	114.4
34	H	37.1	Very low	39.6	Very low	189 Å²	189	128 Å²	128	88%	0.875	67%	0.67	S	S	*	*			trans	-57	128.7	-168.3	-76.7	-36.6	0	0	0	116.6
35	D	39.5	Very low	40.3	Very low	109 Å²	109	124.6 Å²	124.6	58%	0.583	65%	0.65	S	S	*	*			trans	-127.4	118	170.9	-153.9	-14.7	0	0	0	111.8	M37 K38	D35-M37 PolarHBondContact O-N 3.1Å; D35-K38 PolarHBondContact O-N 3.43Å
36	P	39	Very low	41	Very low	115 Å²	115	122.7 Å²	122.7	75%	0.747	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-4	179.7	23.2	-33.2	0	0	0	115.4	K38	P36-K38 PolarHBondContact O-N 3.5Å
37	M	46	Very low	41.8	Very low	109 Å²	109	117.3 Å²	117.3	54%	0.537	61%	0.613	S	S	.	*	H	α-helix	trans	-65.4	-15.4	171.2	-80.8	-173.7	78.4	0	0	114.3	D35 N39 I41	D35-M37 PolarHBondContact O-N 3.1Å; M37-N39 VanDerWaalsContact C-N 3.29Å; M37-N39 PolarHBondContact O-N 3.27Å; M37-I41 PolarHBondContact O-N 3.29Å
38	K	39.5	Very low	42.3	Very low	164 Å²	164	113 Å²	113	71%	0.713	59%	0.59	S	S	*	*	H	α-helix	trans	-69.1	-23.8	-176.7	-140	175.8	-175.9	-179.4	0	113.8	D35 P36	D35-K38 PolarHBondContact O-N 3.43Å; P36-K38 PolarHBondContact O-N 3.5Å
39	N	42.3	Very low	42.6	Very low	118 Å²	118	112 Å²	112	63%	0.631	58%	0.58	S	S	*	*	H	α-helix	trans	-77.6	-43.2	177.7	-73.3	-5.7	0	0	0	112.2	M37 I41 N42 D43	M37-N39 VanDerWaalsContact C-N 3.29Å; M37-N39 PolarHBondContact O-N 3.27Å; N39-I41 VanDerWaalsContact C-N 3.29Å; N39-I41 PolarHBondContact O-N 2.84Å; N39-N42 PolarHBondContact O-N 3.1Å; N39-D43 PolarHBondContact O-N 3.28Å
40	G	41.4	Very low	43.3	Very low	38 Å²	38	109.7 Å²	109.7	39%	0.392	57%	0.567	S	S	.	*	H	α-helix	trans	-65.8	-30.6	178.6	0	0	0	0	0	113.6	D43 I44	G40-D43 PolarHBondContact O-N 2.9Å; G40-I44 WeakPolarHBondContact O-CG1 3.36Å; G40-I44 PolarHBondContact O-N 2.82Å; G40-I44 VanDerWaalsContact O-N 3.11Å
41	I	46.5	Very low	43.7	Very low	72 Å²	72	103.6 Å²	103.6	37%	0.369	54%	0.536	S	S	.	.	H	α-helix	trans	-70.2	-36.1	175.6	-67.9	168.3	0	0	0	111.3	M37 N39 M45	M37-I41 PolarHBondContact O-N 3.29Å; N39-I41 VanDerWaalsContact C-N 3.29Å; N39-I41 PolarHBondContact O-N 2.84Å; I41-M45 HydrophobicContact CG2-CG 4.39Å; I41-M45 WeakPolarHBondContact O-CB 3.34Å; I41-M45 VanDerWaalsContact O-CG 3.24Å; I41-M45 WeakPolarHBondContact O-CG 3.5Å; I41-M45 PolarHBondContact O-N 3.44Å
42	N	44.7	Very low	43.8	Very low	99 Å²	99	100.3 Å²	100.3	53%	0.529	52%	0.519	S	S	.	.	H	α-helix	trans	-67	-37.5	175.5	-94.7	-0.5	0	0	0	112.3	N39 M45 K46	N39-N42 PolarHBondContact O-N 3.1Å; N42-M45 PolarHBondContact O-N 3.03Å; N42-K46 WeakPolarHBondContact O-CG 3.41Å; N42-K46 PolarHBondContact O-N 3.29Å
43	D	49.5	Very low	43.9	Very low	98 Å²	98	99.7 Å²	99.7	52%	0.524	52%	0.516	S	S	.	.	H	α-helix	trans	-70.4	-41	178.5	-64.7	-24.3	0	0	0	111.2	N39 G40 M45 K46 V47	N39-D43 PolarHBondContact O-N 3.28Å; G40-D43 PolarHBondContact O-N 2.9Å; D43-M45 PolarHBondContact O-N 3.26Å; D43-K46 PolarHBondContact O-N 3.37Å; D43-V47 WeakPolarHBondContact O-CG2 3.46Å; D43-V47 PolarHBondContact O-N 3.01Å; D43-V47 VanDerWaalsContact O-N 3.1Å
44	I	50.6	Low	43.8	Very low	62 Å²	62	98.8 Å²	98.8	32%	0.318	51%	0.511	S	S	.	.	H	α-helix	trans	-62.7	-43.1	172.6	-68.6	167.5	0	0	0	110.8	G40 K46 V47 L48 Y274	G40-I44 WeakPolarHBondContact O-CG1 3.36Å; G40-I44 PolarHBondContact O-N 2.82Å; G40-I44 VanDerWaalsContact O-N 3.11Å; I44-K46 VanDerWaalsContact C-N 3.33Å; I44-K46 PolarHBondContact O-N 3.06Å; I44-V47 PolarHBondContact O-N 2.77Å; I44-L48 HydrophobicContact CG2-CD1 3.9Å; I44-L48 WeakPolarHBondContact O-CB 3.45Å; I44-L48 PolarHBondContact O-N 2.82Å; I44-Y274 HydrophobicContact CD1-CE2 3.75Å
45	M	46.9	Very low	43.7	Very low	84 Å²	84	91.9 Å²	91.9	41%	0.414	48%	0.484	S	S	.	.	H	α-helix	trans	-63.1	-35.4	177.1	-78.4	-65.3	-66	0	0	112.7	I41 N42 D43 L48 E49 P371	I41-M45 HydrophobicContact CG2-CG 4.39Å; I41-M45 WeakPolarHBondContact O-CB 3.34Å; I41-M45 VanDerWaalsContact O-CG 3.24Å; I41-M45 WeakPolarHBondContact O-CG 3.5Å; I41-M45 PolarHBondContact O-N 3.44Å; N42-M45 PolarHBondContact O-N 3.03Å; D43-M45 PolarHBondContact O-N 3.26Å; M45-L48 WeakPolarHBondContact O-CB 3.44Å; M45-L48 PolarHBondContact O-N 3.17Å; M45-E49 WeakPolarHBondContact O-CB 3.48Å; M45-E49 PolarHBondContact O-N 2.03Å; M45-P371 HydrophobicContact SD-CG 4.44Å
46	K	49.7	Very low	43.5	Very low	131 Å²	131	93.6 Å²	93.6	57%	0.57	49%	0.49	S	S	*	.	H	α-helix	trans	-66.9	-44.7	174.3	-81.4	178.9	178.2	174.8	0	112.6	N42 D43 I44 L48 E49 I50	N42-K46 WeakPolarHBondContact O-CG 3.41Å; N42-K46 PolarHBondContact O-N 3.29Å; D43-K46 PolarHBondContact O-N 3.37Å; I44-K46 VanDerWaalsContact C-N 3.33Å; I44-K46 PolarHBondContact O-N 3.06Å; K46-L48 PolarHBondContact O-N 2.87Å; K46-E49 PolarHBondContact O-N 3.48Å; K46-I50 VanDerWaalsContact O-CG1 3.28Å; K46-I50 WeakPolarHBondContact O-CG1 3.25Å; K46-I50 PolarHBondContact O-N 2.93Å
47	V	51.9	Low	43.4	Very low	64 Å²	64	97.4 Å²	97.4	39%	0.388	50%	0.495	S	S	.	.	H	α-helix	trans	-58	-38.9	174.4	174.1	0	0	0	0	109.9	D43 I44 V51	D43-V47 WeakPolarHBondContact O-CG2 3.46Å; D43-V47 PolarHBondContact O-N 3.01Å; D43-V47 VanDerWaalsContact O-N 3.1Å; I44-V47 PolarHBondContact O-N 2.77Å; V47-V51 VanDerWaalsContact O-CG2 3.25Å; V47-V51 WeakPolarHBondContact O-CG2 3.35Å; V47-V51 PolarHBondContact O-N 2.84Å
48	L	46.1	Very low	42.8	Very low	33 Å²	33	99.7 Å²	99.7	17%	0.173	50%	0.504	C	S	.	.	H	α-helix	trans	-70	-39.6	177.7	-110	145.1	0	0	0	115.6	I44 M45 K46 I50 V51 N52 P84	I44-L48 HydrophobicContact CG2-CD1 3.9Å; I44-L48 WeakPolarHBondContact O-CB 3.45Å; I44-L48 PolarHBondContact O-N 2.82Å; M45-L48 WeakPolarHBondContact O-CB 3.44Å; M45-L48 PolarHBondContact O-N 3.17Å; K46-L48 PolarHBondContact O-N 2.87Å; L48-I50 VanDerWaalsContact C-N 3.33Å; L48-V51 PolarHBondContact O-N 2.9Å; L48-N52 WeakPolarHBondContact O-CB 3.47Å; L48-N52 PolarHBondContact O-N 2.82Å; L48-P84 HydrophobicContact CD1-CB 3.74Å; L48-P84 HydrophobicContact CD1-CG 3.22Å; L48-P84 HydrophobicContact CD2-CB 3.13Å; L48-P84 HydrophobicContact CD2-CG 3.38Å; L48-P84 HydrophobicContact CG-CB 3.7Å; L48-P84 HydrophobicContact CG-CG 3.71Å
49	E	42	Very low	42.4	Very low	117 Å²	117	102.7 Å²	102.7	55%	0.547	51%	0.513	S	S	.	.	H	α-helix	trans	-67.3	-37.8	176.7	-166.1	168.2	-162.8	0	0	110.7	M45 K46 N52 Q53	M45-E49 WeakPolarHBondContact O-CB 3.48Å; M45-E49 PolarHBondContact O-N 2.03Å; K46-E49 PolarHBondContact O-N 3.48Å; E49-N52 PolarHBondContact O-N 3.38Å; E49-Q53 WeakPolarHBondContact O-CG 3.29Å; E49-Q53 PolarHBondContact O-N 3.29Å
50	I	47.2	Very low	41.7	Very low	97 Å²	97	103.3 Å²	103.3	50%	0.497	52%	0.521	S	S	.	.	H	α-helix	trans	-65.3	-42	173.4	-66.1	167.1	0	0	0	111	K46 L48 Q53 L54	K46-I50 VanDerWaalsContact O-CG1 3.28Å; K46-I50 WeakPolarHBondContact O-CG1 3.25Å; K46-I50 PolarHBondContact O-N 2.93Å; L48-I50 VanDerWaalsContact C-N 3.33Å; I50-Q53 PolarHBondContact O-N 3.41Å; I50-L54 HydrophobicContact CG2-CD1 4.16Å; I50-L54 WeakPolarHBondContact O-CG 3Å; I50-L54 PolarHBondContact O-N 2.84Å
51	V	46.6	Very low	41.1	Very low	32 Å²	32	106.5 Å²	106.5	19%	0.194	54%	0.537	C	S	.	.	H	α-helix	trans	-66.5	-35.9	175.6	172.8	0	0	0	0	111.7	V47 L48 S55 I87	V47-V51 VanDerWaalsContact O-CG2 3.25Å; V47-V51 WeakPolarHBondContact O-CG2 3.35Å; V47-V51 PolarHBondContact O-N 2.84Å; L48-V51 PolarHBondContact O-N 2.9Å; V51-S55 WeakPolarHBondContact O-CB 3.41Å; V51-S55 PolarHBondContact O-N 2.64Å; V51-I87 HydrophobicContact CG1-CG1 4.23Å; V51-I87 HydrophobicContact CG2-CG1 4.09Å
52	N	38.9	Very low	40.5	Very low	60 Å²	60	112 Å²	112	32%	0.321	56%	0.563	S	S	.	*	H	α-helix	trans	-71.3	-37	175.6	-101.8	-17.9	0	0	0	113.1	L48 E49 L54 S55 M56	L48-N52 WeakPolarHBondContact O-CB 3.47Å; L48-N52 PolarHBondContact O-N 2.82Å; E49-N52 PolarHBondContact O-N 3.38Å; N52-L54 VanDerWaalsContact C-N 3.3Å; N52-L54 PolarHBondContact O-N 3.44Å; N52-S55 PolarHBondContact O-N 3.42Å; N52-M56 WeakPolarHBondContact O-CG 2.99Å; N52-M56 PolarHBondContact O-N 3.5Å
53	Q	37.9	Very low	39.9	Very low	142 Å²	142	114.6 Å²	114.6	66%	0.664	58%	0.578	S	S	*	*	H	α-helix	trans	-68.8	-29.5	176.8	-74.8	-174.7	5.5	0	0	112.6	E49 I50	E49-Q53 WeakPolarHBondContact O-CG 3.29Å; E49-Q53 PolarHBondContact O-N 3.29Å; I50-Q53 PolarHBondContact O-N 3.41Å
54	L	36.9	Very low	39.1	Very low	141 Å²	141	117.4 Å²	117.4	74%	0.738	59%	0.593	S	S	*	*	H	α-helix	trans	-79.3	-19.2	174.8	-67.6	168	0	0	0	113.1	I50 N52	I50-L54 HydrophobicContact CG2-CD1 4.16Å; I50-L54 WeakPolarHBondContact O-CG 3Å; I50-L54 PolarHBondContact O-N 2.84Å; N52-L54 VanDerWaalsContact C-N 3.3Å; N52-L54 PolarHBondContact O-N 3.44Å
55	S	35.2	Very low	38.3	Very low	45 Å²	45	119.1 Å²	119.1	32%	0.315	61%	0.608	S	S	.	*	H	α-helix	trans	-92.2	-16.3	179.7	170.3	0	0	0	0	114.5	V51 N52 K57	V51-S55 WeakPolarHBondContact O-CB 3.41Å; V51-S55 PolarHBondContact O-N 2.64Å; N52-S55 PolarHBondContact O-N 3.42Å; S55-K57 PolarHBondContact O-N 3.43Å
56	M	35.7	Very low	37.8	Very low	145 Å²	145	122 Å²	122	71%	0.714	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	13.6	-177.1	-76.3	-145	-140.7	0	0	115.5	N52	N52-M56 WeakPolarHBondContact O-CG 2.99Å; N52-M56 PolarHBondContact O-N 3.5Å
57	K	35.7	Very low	37.3	Very low	195 Å²	195	123.8 Å²	123.8	85%	0.848	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.9	6.1	-178.9	-122.8	178.8	-178	-179	0	116	S55	S55-K57 PolarHBondContact O-N 3.43Å
58	E	34.3	Very low	36.7	Very low	157 Å²	157	129.8 Å²	129.8	73%	0.734	66%	0.664	S	S	*	*	S	Bend	trans	-133.2	5.5	-170.3	-122.7	171.6	-171.8	0	0	117.3
59	Y	29.6	Very low	36.3	Very low	226 Å²	226	136.5 Å²	136.5	89%	0.886	70%	0.695	S	S	*	*			trans	-143	72.4	172.6	-84.5	-86.8	0	0	0	111.8
60	T	28.9	Very low	36	Very low	132 Å²	132	138.2 Å²	138.2	81%	0.81	70%	0.703	S	S	*	*			trans	-137.4	72.8	160.3	50.4	0	0	0	0	107.9
61	S	28.3	Very low	35.5	Very low	104 Å²	104	141.8 Å²	141.8	73%	0.727	72%	0.715	S	S	*	*			trans	-174.6	108	151.9	66.3	0	0	0	0	109.5
62	M	33.2	Very low	34.9	Very low	187 Å²	187	148 Å²	148	92%	0.921	75%	0.747	S	S	*	*			trans	-167.3	89.7	141.3	-94	-60.3	171.7	0	0	103.1
63	D	32.8	Very low	34.5	Very low	155 Å²	155	148.6 Å²	148.6	83%	0.829	77%	0.767	S	S	*	*			trans	-59.4	126.4	163.9	-64.4	-57.6	0	0	0	108.1
64	D	33	Very low	34.4	Very low	157 Å²	157	149.1 Å²	149.1	84%	0.84	78%	0.775	S	S	*	*			trans	-133.6	104.6	149.2	-150	-7.8	0	0	0	107.6
65	P	33	Very low	34.1	Very low	97 Å²	97	150.1 Å²	150.1	63%	0.63	78%	0.781	S	S	*	*			trans	-94.2	103	176.2	33	-22.4	0	0	0	107.7
66	N	37.7	Very low	34.2	Very low	146 Å²	146	154 Å²	154	78%	0.781	80%	0.798	S	S	*	*			trans	172.8	109.9	152.7	-85.7	-28.5	0	0	0	107.1
67	D	38.9	Very low	34.1	Very low	168 Å²	168	153.2 Å²	153.2	90%	0.898	80%	0.801	S	S	*	*			trans	175.9	81.6	140.8	-82.7	-17.1	0	0	0	106.4
68	E	38.1	Very low	34.1	Very low	189 Å²	189	149.5 Å²	149.5	88%	0.883	80%	0.795	S	S	*	*			trans	-69.9	162.1	160.9	-67.9	-170.2	155.9	0	0	110.2
69	E	38.6	Very low	34.1	Very low	175 Å²	175	147.9 Å²	147.9	82%	0.818	79%	0.787	S	S	*	*			trans	95.9	94	173.6	-61.3	-169.8	156.1	0	0	116.1
70	Q	35.2	Very low	34.2	Very low	152 Å²	152	142.5 Å²	142.5	71%	0.71	77%	0.773	S	S	*	*				92.1	101.7	71.8	177.1	169.2	21.2	0	0	113.2
71	K	37	Very low	34.4	Very low	173 Å²	173	138.8 Å²	138.8	75%	0.752	75%	0.748	S	S	*	*				164.5	118.7	120.5	-102.9	158	-179.2	178.7	0	114
72	D	34.4	Very low	34.4	Very low	161 Å²	161	143.7 Å²	143.7	86%	0.861	75%	0.751	S	S	*	*			trans	25.4	127.3	135	-55.9	-32.5	0	0	0	120.5
73	G	30.5	Very low	34.4	Very low	73 Å²	73	138.8 Å²	138.8	75%	0.753	72%	0.723	S	S	*	*			trans	141.9	118.4	148.9	0	0	0	0	0	115.4
74	D	35.6	Very low	34.4	Very low	153 Å²	153	133.5 Å²	133.5	82%	0.818	70%	0.697	S	S	*	*			trans	75.6	93.4	166.6	-69.9	-14.6	0	0	0	119.6	N76	D74-N76 PolarHBondContact O-N 3.19Å
75	D	31.2	Very low	34.4	Very low	162 Å²	162	133.1 Å²	133.1	87%	0.866	68%	0.684	S	S	*	*			trans	-65.2	63.5	162.7	-144.6	6.1	0	0	0	110.9	T77	D75-T77 PolarHBondContact O-N 3.46Å
76	N	37.3	Very low	34.4	Very low	127 Å²	127	130.6 Å²	130.6	68%	0.679	67%	0.668	S	S	*	*			trans	-84.6	106	161.9	-87	-27.8	0	0	0	107.3	D74 V78	D74-N76 PolarHBondContact O-N 3.19Å; N76-V78 PolarHBondContact O-N 3.43Å
77	T	33.4	Very low	34.2	Very low	128 Å²	128	127.5 Å²	127.5	79%	0.785	65%	0.651	S	S	*	*			trans	-56.7	81.3	174.5	42.4	0	0	0	0	111	D75 E79	D75-T77 PolarHBondContact O-N 3.46Å; T77-E79 PolarHBondContact O-N 3.29Å
78	V	34.7	Very low	33.8	Very low	118 Å²	118	124.1 Å²	124.1	72%	0.715	64%	0.637	S	S	*	*			trans	-69.1	85.6	157.9	-179.5	0	0	0	0	104.5	N76 L80	N76-V78 PolarHBondContact O-N 3.43Å; V78-L80 PolarHBondContact O-N 3.31Å
79	E	34.2	Very low	33.5	Very low	122 Å²	122	119.4 Å²	119.4	57%	0.57	61%	0.613	S	S	*	*			trans	-59.1	97.3	166.5	-102.4	-166.3	158.9	0	0	106.9	T77 L81	T77-E79 PolarHBondContact O-N 3.29Å; E79-L81 PolarHBondContact O-N 3.22Å
80	L	32.1	Very low	33	Very low	113 Å²	113	116.7 Å²	116.7	59%	0.592	61%	0.608	S	S	*	*			trans	-62.7	86.1	165.7	-163.9	85.6	0	0	0	106.2	V78 R82	V78-L80 PolarHBondContact O-N 3.31Å; L80-R82 HydrophobicContact CD2-CG 3.88Å; L80-R82 HydrophobicContact CG-CG 4.37Å; L80-R82 PolarHBondContact O-N 3.34Å
81	L	33.9	Very low	32.7	Very low	54 Å²	54	113.5 Å²	113.5	28%	0.283	60%	0.603	S	S	.	*			trans	-61.8	85.6	167.4	-88.4	138.6	0	0	0	106.9	E79 Y83	E79-L81 PolarHBondContact O-N 3.22Å; L81-Y83 HydrophobicContact CB-CD2 4.18Å; L81-Y83 HydrophobicContact CB-CE1 4.31Å; L81-Y83 HydrophobicContact CB-CE2 3.58Å; L81-Y83 HydrophobicContact CD2-CE1 3.91Å; L81-Y83 WeakPolarHBondContact O-CD2 3.3Å; L81-Y83 PolarHBondContact O-N 3.3Å
82	R	28.4	Very low	32.3	Very low	207 Å²	207	109.7 Å²	109.7	78%	0.781	60%	0.598	S	S	*	*			trans	-67.6	92.2	165.9	-80.9	-172.5	-178.4	176.3	1.9	106.6	L80	L80-R82 HydrophobicContact CD2-CG 3.88Å; L80-R82 HydrophobicContact CG-CG 4.37Å; L80-R82 PolarHBondContact O-N 3.34Å
83	Y	33.6	Very low	32.1	Very low	84 Å²	84	106.8 Å²	106.8	33%	0.329	59%	0.59	S	S	.	*			trans	-68	152.5	171.8	-68.1	-72.1	0	0	0	110.4	L81 R85	L81-Y83 HydrophobicContact CB-CD2 4.18Å; L81-Y83 HydrophobicContact CB-CE1 4.31Å; L81-Y83 HydrophobicContact CB-CE2 3.58Å; L81-Y83 HydrophobicContact CD2-CE1 3.91Å; L81-Y83 WeakPolarHBondContact O-CD2 3.3Å; L81-Y83 PolarHBondContact O-N 3.3Å; Y83-R85 PolarHBondContact O-N 3.15Å
84	P	31.7	Very low	31.9	Very low	45 Å²	45	109.1 Å²	109.1	29%	0.292	60%	0.595	S	S	.	*			trans	-35.1	109.2	164.4	-33.6	37.8	0	0	0	112.5	L48	L48-P84 HydrophobicContact CD1-CB 3.74Å; L48-P84 HydrophobicContact CD1-CG 3.22Å; L48-P84 HydrophobicContact CD2-CB 3.13Å; L48-P84 HydrophobicContact CD2-CG 3.38Å; L48-P84 HydrophobicContact CG-CB 3.7Å; L48-P84 HydrophobicContact CG-CG 3.71Å
85	R	33.6	Very low	31.5	Very low	149 Å²	149	107 Å²	107	56%	0.562	59%	0.588	S	S	*	*			trans	-62.6	140.2	174.4	-75	-179.8	175.8	164.2	-3.3	109.1	Y83	Y83-R85 PolarHBondContact O-N 3.15Å
86	S	33.3	Very low	31.3	Very low	43 Å²	43	104.3 Å²	104.3	30%	0.301	58%	0.582	S	S	.	*			trans	-47.5	136.9	176.3	-0.4	0	0	0	0	111.5	T88 Q278	S86-T88 PolarHBondContact O-N 3.47Å; S86-T88 PolarHBondContact O-OG1 3.39Å; S86-Q278 VanDerWaalsContact CB-NE2 3.3Å; S86-Q278 VanDerWaalsContact OG-CD 3.25Å; S86-Q278 PolarHBondContact OG-OE1 2.79Å
87	I	32.6	Very low	31.2	Very low	82 Å²	82	103.8 Å²	103.8	42%	0.421	58%	0.583	S	S	.	*			trans	-57.3	108.6	166.8	-60.2	167.4	0	0	0	107.1	V51	V51-I87 HydrophobicContact CG1-CG1 4.23Å; V51-I87 HydrophobicContact CG2-CG1 4.09Å
88	T	31.5	Very low	31.4	Very low	97 Å²	97	103.1 Å²	103.1	60%	0.595	58%	0.584	S	S	*	*			trans	-89.6	121.4	171.4	-44.4	0	0	0	0	106.8	S86 T90	S86-T88 PolarHBondContact O-N 3.47Å; S86-T88 PolarHBondContact O-OG1 3.39Å; T88-T90 PolarHBondContact O-N 3.01Å
89	F	31.3	Very low	31.6	Very low	90 Å²	90	106.6 Å²	106.6	40%	0.395	59%	0.589	S	S	.	*			trans	-76.3	115.3	176.6	-75.3	-89.2	0	0	0	109.8	S91 I187	F89-S91 VanDerWaalsContact C-N 3.34Å; F89-S91 PolarHBondContact O-N 3.14Å; F89-I187 HydrophobicContact CE2-CG2 4.11Å; F89-I187 HydrophobicContact CZ-CD1 4.15Å; F89-I187 HydrophobicContact CZ-CG2 4.34Å
90	T	28.3	Very low	32	Very low	117 Å²	117	109.7 Å²	109.7	72%	0.718	60%	0.602	S	S	*	*			trans	-82.1	85.8	156.8	48.5	0	0	0	0	108.2	T88 S92	T88-T90 PolarHBondContact O-N 3.01Å; T90-S92 PolarHBondContact O-N 3.34Å
91	S	27.3	Very low	32.9	Very low	85 Å²	85	109.9 Å²	109.9	59%	0.594	60%	0.603	S	S	*	*			trans	-77.4	68.2	167	44.4	0	0	0	0	110	F89	F89-S91 VanDerWaalsContact C-N 3.34Å; F89-S91 PolarHBondContact O-N 3.14Å
92	S	28.6	Very low	34.3	Very low	94 Å²	94	112.5 Å²	112.5	66%	0.657	63%	0.626	S	S	*	*			trans	-161.8	140.7	159.5	55.4	0	0	0	0	111.1	T90	T90-S92 PolarHBondContact O-N 3.34Å
93	S	31.2	Very low	36.7	Very low	99 Å²	99	107.3 Å²	107.3	69%	0.692	61%	0.61	S	S	*	*			trans	78.8	93.7	174.1	77.3	0	0	0	0	117.2	T95	S93-T95 PolarHBondContact O-N 3.19Å
94	S	27.3	Very low	38.9	Very low	122 Å²	122	107.5 Å²	107.5	85%	0.853	61%	0.611	S	S	*	*			trans	-30.2	92.2	139.8	50.8	0	0	0	0	114.2
95	T	26.9	Very low	41.4	Very low	110 Å²	110	111 Å²	111	68%	0.675	62%	0.624	S	S	*	*			trans	-165.7	105.7	154.3	7.9	0	0	0	0	111.9	S93	S93-T95 PolarHBondContact O-N 3.19Å
96	S	27.1	Very low	43.8	Very low	105 Å²	105	108.8 Å²	108.8	73%	0.734	62%	0.623	S	S	*	*			trans	49.3	75.8	147.9	63.9	0	0	0	0	119.6
97	T	33.5	Very low	46.3	Very low	115 Å²	115	108.1 Å²	108.1	71%	0.706	62%	0.616	S	S	*	*			trans	-120.1	42.6	149.9	48.2	0	0	0	0	110.8	K99	T97-K99 VanDerWaalsContact C-N 3.25Å; T97-K99 PolarHBondContact O-N 2.9Å
98	S	38	Very low	48.9	Very low	114 Å²	114	108.6 Å²	108.6	80%	0.797	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	8.7	-177.4	60.8	0	0	0	0	115.2
99	K	38.4	Very low	51.3	Low	191 Å²	191	104.5 Å²	104.5	83%	0.83	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.9	-4.5	-175.9	-87.4	-174.4	176	-179.5	0	116.7	T97	T97-K99 VanDerWaalsContact C-N 3.25Å; T97-K99 PolarHBondContact O-N 2.9Å
100	F	42.9	Very low	53.8	Low	188 Å²	188	103.8 Å²	103.8	83%	0.825	60%	0.597	S	S	*	*	S	Bend	trans	-121.4	-3.1	-179.4	-77.8	-78.9	0	0	0	115.5
101	N	52.4	Low	56.6	Low	117 Å²	117	98.6 Å²	98.6	63%	0.626	57%	0.565	S	S	*	*			trans	-105.4	41.2	-177.3	-74.6	-7.7	0	0	0	113.7	E103	N101-E103 VanDerWaalsContact C-N 3.27Å
102	S	62.5	Low	59.4	Low	108 Å²	108	98.7 Å²	98.7	76%	0.755	56%	0.556	S	S	*	*	S	Bend	trans	-74.9	-20	173	57.4	0	0	0	0	113.1
103	E	78.8	Confident	62.3	Low	99 Å²	99	94.3 Å²	94.3	46%	0.463	53%	0.525	S	S	.	.	S	Bend	trans	-86.7	-24.5	-171.9	-67.7	-177.3	179.4	0	0	113.7	N101 H178 F179	N101-E103 VanDerWaalsContact C-N 3.27Å; E103-H178 CarbonylContact O-C 3.42Å; E103-H178 WeakPolarHBondContact O-CA 2.9Å; E103-H178 PolarHBondContact O-CD2 2.55Å; E103-H178 VanDerWaalsContact O-CD2 3.27Å; E103-F179 HydrophobicContact CB-CD1 3.8Å; E103-F179 HydrophobicContact CB-CE1 4.24Å; E103-F179 HydrophobicContact CG-CD1 3.88Å; E103-F179 HydrophobicContact CG-CE1 3.94Å; E103-F179 PolarHBondContact O-N 3.49Å
104	Y	79.9	Confident	65	Low	87 Å²	87	91.2 Å²	91.2	34%	0.341	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	127.1	-176.5	-68.9	-88.5	0	0	0	109.6	V176 H178 L183	Y104-V176 HydrophobicContact CD1-CG1 4.06Å; Y104-V176 HydrophobicContact CG-CG1 4.37Å; Y104-H178 HydrophobicContact CD1-CB 4.26Å; Y104-H178 HydrophobicContact CE1-CB 4.08Å; Y104-H178 AromaticContact CE1-CD2 3.59Å; Y104-H178 AromaticContact CE2-CD2 3.83Å; Y104-H178 AromaticContact CZ-CD2 3.49Å; Y104-H178 VanDerWaalsContact CZ-CD2 3.49Å; Y104-L183 HydrophobicContact CE1-CD2 4.37Å
105	Q	83.7	Confident	67.8	Low	119 Å²	119	85.9 Å²	85.9	56%	0.556	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.5	126.9	-177.8	-173.1	-177.2	18.3	0	0	109.9	I107 R177	Q105-I107 PolarHBondContact O-N 3.34Å; Q105-R177 PolarHBondContact N-O 3.22Å; Q105-R177 PolarHBondContact O-N 3.11Å
106	D	85.2	Confident	70.6	Confident	102 Å²	102	81.2 Å²	81.2	55%	0.545	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	131.4	168.9	-68.3	-37.3	0	0	0	110.5	Q174 V176	D106-Q174 PolarHBondContact OD1-NE2 3.05Å; D106-V176 WeakPolarHBondContact OD1-CG2 3.47Å
107	I	85.7	Confident	73.3	Confident	29 Å²	29	78.6 Å²	78.6	15%	0.149	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	154.3	175.7	63	161.8	0	0	0	110.1	Q105 C109 C175 R177 L184 I220	Q105-I107 PolarHBondContact O-N 3.34Å; I107-C109 PolarHBondContact O-N 2.98Å; I107-C175 HydrophobicContact CD1-CB 4.47Å; I107-C175 HydrophobicContact CG1-CB 3.84Å; I107-C175 WeakPolarHBondContact CG1-O 3.48Å; I107-C175 PolarHBondContact N-O 3.02Å; I107-C175 VanDerWaalsContact O-O 3.1Å; I107-R177 HydrophobicContact CD1-CB 3.98Å; I107-R177 HydrophobicContact CG1-CB 4.18Å; I107-R177 HydrophobicContact CG2-CB 4Å; I107-L184 HydrophobicContact CD1-CD1 3.86Å; I107-L184 HydrophobicContact CG1-CD1 4.42Å; I107-I220 HydrophobicContact CD1-CG2 3.91Å
108	P	86.3	Confident	75.7	Confident	93 Å²	93	78.1 Å²	78.1	60%	0.604	40%	0.402	S	S	*	.			trans	-60.4	132.1	171.9	-21.3	33	0	0	0	111.1	H110	P108-H110 VanDerWaalsContact C-N 3.28Å; P108-H110 PolarHBondContact O-CD2 2.75Å; P108-H110 VanDerWaalsContact O-CD2 3.29Å; P108-H110 PolarHBondContact O-N 2.9Å
109	C	81.5	Confident	77.9	Confident	11 Å²	11	78.1 Å²	78.1	7%	0.074	39%	0.385	C	S	.	.			trans	-70.4	-22	177.6	-76.5	0	0	0	0	113.9	I107 F111 S173 C175	I107-C109 PolarHBondContact O-N 2.98Å; C109-F111 HydrophobicContact CB-CD1 3.98Å; C109-F111 HydrophobicContact CB-CD2 4.43Å; C109-F111 HydrophobicContact CB-CE1 3.77Å; C109-F111 HydrophobicContact CB-CE2 4.25Å; C109-F111 HydrophobicContact CB-CG 4.3Å; C109-F111 HydrophobicContact CB-CZ 3.91Å; C109-F111 WeakPolarHBondContact O-CD1 3.49Å; C109-F111 VanDerWaalsContact O-CE1 3.3Å; C109-F111 WeakPolarHBondContact O-CE1 3.49Å; C109-F111 PolarHBondContact O-N 2.85Å; C109-S173 PolarHBondContact SG-O 3.41Å; C109-C175 WeakPolarHBondContact CA-SG 3.47Å; C109-C175 HydrophobicContact CB-CB 4.04Å; C109-C175 WeakPolarHBondContact CB-SG 3.4Å; C109-C175 VanDerWaalsContact SG-CA 3.59Å; C109-C175 WeakPolarHBondContact SG-CB 3.4Å; C109-C175 PolarHBondContact SG-N 3.19Å; C109-C175 CovalentContact SG-SG 2.03Å; C109-C175 PolarHBondContact SG-SG 3.32Å
110	H	84.8	Confident	80	Confident	75 Å²	75	71.4 Å²	71.4	35%	0.347	36%	0.358	S	S	.	.	S	Bend	trans	55.1	8.2	-170.5	-60.4	-81.5	0	0	0	115.1	P108 N146 S147 Y219	P108-H110 VanDerWaalsContact C-N 3.28Å; P108-H110 PolarHBondContact O-CD2 2.75Å; P108-H110 VanDerWaalsContact O-CD2 3.29Å; P108-H110 PolarHBondContact O-N 2.9Å; H110-N146 PolarHBondContact O-OD1 2.97Å; H110-S147 PolarHBondContact O-N 2.88Å; H110-Y219 HydrophobicContact CB-CD2 3.41Å; H110-Y219 VanDerWaalsContact CB-CD2 3.41Å; H110-Y219 HydrophobicContact CB-CE2 3.97Å; H110-Y219 HydrophobicContact CB-CG 3.84Å; H110-Y219 AromaticContact CG-CD2 3.91Å; H110-Y219 AromaticContact CG-CG 3.79Å
111	F	86.9	Confident	82	Confident	7 Å²	7	70.3 Å²	70.3	3%	0.031	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	160.2	166	62	-91.9	0	0	0	108.9	C109 Y145 S147 L186 I212 A215	C109-F111 HydrophobicContact CB-CD1 3.98Å; C109-F111 HydrophobicContact CB-CD2 4.43Å; C109-F111 HydrophobicContact CB-CE1 3.77Å; C109-F111 HydrophobicContact CB-CE2 4.25Å; C109-F111 HydrophobicContact CB-CG 4.3Å; C109-F111 HydrophobicContact CB-CZ 3.91Å; C109-F111 WeakPolarHBondContact O-CD1 3.49Å; C109-F111 VanDerWaalsContact O-CE1 3.3Å; C109-F111 WeakPolarHBondContact O-CE1 3.49Å; C109-F111 PolarHBondContact O-N 2.85Å; F111-Y145 CarbonylContact C-O 3.57Å; F111-Y145 WeakPolarHBondContact CA-O 3.48Å; F111-Y145 VanDerWaalsContact CB-O 3.3Å; F111-Y145 WeakPolarHBondContact CB-O 3.24Å; F111-S147 VanDerWaalsContact C-OG 3.3Å; F111-S147 WeakPolarHBondContact CA-OG 3.27Å; F111-S147 PolarHBondContact N-OG 3.41Å; F111-L186 HydrophobicContact CE2-CD1 3.81Å; F111-L186 HydrophobicContact CE2-CD2 4.07Å; F111-L186 HydrophobicContact CZ-CD1 3.45Å; F111-L186 VanDerWaalsContact CZ-CD1 3.45Å; F111-L186 HydrophobicContact CZ-CD2 3.65Å; F111-L186 HydrophobicContact CZ-CG 4.15Å; F111-I212 HydrophobicContact CD2-CG1 4.24Å; F111-I212 HydrophobicContact CE1-CG2 4.35Å; F111-I212 HydrophobicContact CE2-CG1 4.04Å; F111-I212 HydrophobicContact CZ-CG1 4.27Å; F111-I212 HydrophobicContact CZ-CG2 4.31Å; F111-A215 HydrophobicContact CB-CB 3.96Å; F111-A215 HydrophobicContact CD1-CB 3.57Å; F111-A215 HydrophobicContact CG-CB 4.2Å
112	Q	86.2	Confident	83.6	Confident	88 Å²	88	70.8 Å²	70.8	41%	0.411	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	129.6	174.5	-175.7	174	4.9	0	0	109.2	I114 C144 Y145	Q112-I114 HydrophobicContact CG-CG2 4.26Å; Q112-C144 WeakPolarHBondContact O-CA 3.32Å; Q112-Y145 PolarHBondContact N-O 2.81Å; Q112-Y145 PolarHBondContact O-N 3.4Å
113	C	89.2	Confident	84.8	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.007	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	141.4	170.3	-56	0	0	0	0	110.4	L142 D143 C144 I171 S173	C113-L142 HydrophobicContact CB-CD1 4.15Å; C113-D143 CarbonylContact C-O 3.55Å; C113-D143 VanDerWaalsContact CA-O 3.28Å; C113-D143 WeakPolarHBondContact CA-O 3.33Å; C113-C144 HydrophobicContact CB-CB 4.11Å; C113-C144 WeakPolarHBondContact CB-SG 3.36Å; C113-C144 WeakPolarHBondContact SG-CB 3.33Å; C113-C144 CovalentContact SG-SG 2.05Å; C113-C144 PolarHBondContact SG-SG 3Å; C113-I171 HydrophobicContact CB-CG2 4Å; C113-I171 WeakPolarHBondContact O-CG2 3.28Å; C113-S173 WeakPolarHBondContact CB-OG 3.29Å; C113-S173 PolarHBondContact N-OG 3.49Å; C113-S173 PolarHBondContact SG-OG 2.68Å
114	I	87.2	Confident	85	Confident	34 Å²	34	64.3 Å²	64.3	17%	0.174	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	156.6	179.2	66.2	171.7	0	0	0	110	Q112 D143 Y145 M150	Q112-I114 HydrophobicContact CG-CG2 4.26Å; I114-D143 PolarHBondContact N-O 3.45Å; I114-D143 PolarHBondContact O-N 2.76Å; I114-Y145 HydrophobicContact CD1-CD2 4.13Å; I114-Y145 HydrophobicContact CD1-CE2 3.6Å; I114-Y145 HydrophobicContact CG1-CD2 4.17Å; I114-Y145 HydrophobicContact CG1-CE2 3.72Å; I114-M150 HydrophobicContact CD1-CE 4.21Å; I114-M150 HydrophobicContact CG2-CE 4.48Å
115	L	87.1	Confident	85.2	Confident	11 Å²	11	67.9 Å²	67.9	6%	0.058	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	133.8	161.3	-66.2	180	0	0	0	109	A140 I141 L142 W167 I171 M197 I202	L115-A140 HydrophobicContact CB-CB 4.28Å; L115-A140 HydrophobicContact CD1-CB 4.28Å; L115-A140 HydrophobicContact CD2-CB 4.02Å; L115-A140 HydrophobicContact CG-CB 4.41Å; L115-I141 WeakPolarHBondContact CA-O 3.16Å; L115-L142 HydrophobicContact CD2-CB 4.12Å; L115-L142 HydrophobicContact CD2-CD1 4.16Å; L115-W167 HydrophobicContact CB-CE3 3.73Å; L115-W167 HydrophobicContact CB-CZ3 3.89Å; L115-W167 HydrophobicContact CD1-CZ3 4.44Å; L115-I171 HydrophobicContact CD1-CD1 4.02Å; L115-I171 HydrophobicContact CD1-CG1 4.26Å; L115-I171 HydrophobicContact CD2-CD1 4.34Å; L115-I171 HydrophobicContact CD2-CG1 4.45Å; L115-I171 HydrophobicContact CG-CD1 3.84Å; L115-I171 HydrophobicContact CG-CG1 3.7Å; L115-M197 HydrophobicContact CD1-CE 3.58Å; L115-M197 HydrophobicContact CD1-SD 4.12Å; L115-I202 HydrophobicContact CD1-CD1 4.15Å; L115-I202 HydrophobicContact CD2-CD1 4.2Å; L115-I202 HydrophobicContact CD2-CG1 4.26Å; L115-I202 HydrophobicContact CD2-CG2 3.75Å
116	R	85.5	Confident	85.3	Confident	11 Å²	11	62.9 Å²	62.9	4%	0.042	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	166.1	176.6	60.8	165.2	179.5	80.6	-4.8	111.4	E123 I141 D143 Y145 S205	R116-E123 IonicContact CZ-OE1 3.56Å; R116-E123 IonicContact CZ-OE2 2.83Å; R116-E123 IonicContact NH1-OE1 3.19Å; R116-E123 PolarHBondContact NH1-OE1 2.92Å; R116-E123 IonicContact NH1-OE2 3.2Å; R116-E123 PolarHBondContact NH1-OE2 2.67Å; R116-E123 IonicContact NH2-OE1 2.8Å; R116-E123 PolarHBondContact NH2-OE1 3.14Å; R116-E123 IonicContact NH2-OE2 2.61Å; R116-I141 HydrophobicContact CG-CB 4.18Å; R116-I141 PolarHBondContact N-O 3.37Å; R116-I141 PolarHBondContact O-N 2.84Å; R116-D143 HydrophobicContact CG-CB 4.3Å; R116-D143 IonicContact CZ-OD2 3.84Å; R116-D143 IonicContact NE-OD2 3.9Å; R116-D143 PolarHBondContact NE-OD2 3.36Å; R116-D143 IonicContact NH2-OD2 2.72Å; R116-D143 PolarHBondContact NH2-OD2 3.05Å; R116-Y145 WeakPolarHBondContact CD-OH 3.34Å; R116-Y145 PolarHBondContact NE-OH 3.02Å; R116-S205 PolarHBondContact NH2-OG 2.88Å; R116-S205 VanDerWaalsContact NH2-OG 3.09Å
117	S	83.2	Confident	85.2	Confident	51 Å²	51	58.4 Å²	58.4	36%	0.357	28%	0.278	S	S	.	.			trans	-66.1	156.5	167.4	56.8	0	0	0	0	111.6
118	K	84.6	Confident	85	Confident	105 Å²	105	59.3 Å²	59.3	46%	0.457	29%	0.287	S	S	.	.			trans	-59	133.4	170.5	66	-160.7	-178.3	-171.4	0	110.5	E123 I124 I127 I141	K118-E123 HydrophobicContact CB-CB 4.3Å; K118-I124 HydrophobicContact CB-CG1 4.42Å; K118-I124 HydrophobicContact CD-CG1 3.92Å; K118-I124 HydrophobicContact CG-CG1 4.07Å; K118-I127 HydrophobicContact CB-CD1 3.88Å; K118-I127 HydrophobicContact CD-CD1 3.85Å; K118-I127 HydrophobicContact CG-CD1 4.49Å; K118-I141 HydrophobicContact CB-CG1 4.21Å
119	R	83.1	Confident	84.6	Confident	113 Å²	113	61.3 Å²	61.3	43%	0.426	29%	0.286	S	S	.	.			trans	-114.4	-32.3	-176.2	-72.8	-178.6	177.6	176.1	-2	113.6	E123 Y145 L162	R119-E123 PolarHBondContact N-OE2 3.49Å; R119-Y145 PolarHBondContact NH1-OH 3Å; R119-L162 HydrophobicContact CG-CD2 4.32Å
120	N	83.3	Confident	84.2	Confident	51 Å²	51	61.8 Å²	61.8	27%	0.273	29%	0.289	S	S	.	.	S	Bend	trans	-123.8	162.4	-172	66.1	50	0	0	0	113.2	Q122 E123 I124	N120-Q122 PolarHBondContact O-N 2.91Å; N120-Q122 WeakPolarHBondContact OD1-CB 3.32Å; N120-Q122 PolarHBondContact OD1-N 2.89Å; N120-Q122 VanDerWaalsContact OD1-N 3.15Å; N120-E123 PolarHBondContact ND2-OE1 3.03Å; N120-E123 PolarHBondContact O-N 2.86Å; N120-E123 WeakPolarHBondContact OD1-CB 3.41Å; N120-E123 VanDerWaalsContact OD1-CG 3.29Å; N120-E123 WeakPolarHBondContact OD1-CG 3.35Å; N120-E123 PolarHBondContact OD1-N 3.27Å; N120-I124 WeakPolarHBondContact O-CG1 3.39Å; N120-I124 PolarHBondContact O-N 3.27Å
121	H	85	Confident	83.6	Confident	165 Å²	165	59 Å²	59	76%	0.764	28%	0.277	S	S	*	.	H	α-helix	trans	-60.4	-30.5	179.9	-77.9	-74.7	0	0	0	113.6	I124 R125	H121-I124 PolarHBondContact O-N 2.05Å; H121-R125 VanDerWaalsContact O-CB 3.28Å; H121-R125 WeakPolarHBondContact O-CB 3.41Å; H121-R125 PolarHBondContact O-N 3.3Å
122	Q	85.7	Confident	82.4	Confident	126 Å²	126	65 Å²	65	59%	0.589	31%	0.308	S	S	*	.	H	α-helix	trans	-68.4	-43.6	178.6	-66.1	176.9	-17.8	0	0	111	N120 R125 K126 N206	N120-Q122 PolarHBondContact O-N 2.91Å; N120-Q122 WeakPolarHBondContact OD1-CB 3.32Å; N120-Q122 PolarHBondContact OD1-N 2.89Å; N120-Q122 VanDerWaalsContact OD1-N 3.15Å; Q122-R125 PolarHBondContact O-N 3.03Å; Q122-K126 WeakPolarHBondContact O-CB 3.27Å; Q122-K126 PolarHBondContact O-N 3.05Å; Q122-N206 PolarHBondContact OE1-ND2 2.87Å
123	E	87.2	Confident	81.2	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-63.4	-44.2	173.8	-73.7	168	-175.1	0	0	111.2	R116 K118 R119 N120 R125 K126 I127 I141 S205	R116-E123 IonicContact CZ-OE1 3.56Å; R116-E123 IonicContact CZ-OE2 2.83Å; R116-E123 IonicContact NH1-OE1 3.19Å; R116-E123 PolarHBondContact NH1-OE1 2.92Å; R116-E123 IonicContact NH1-OE2 3.2Å; R116-E123 PolarHBondContact NH1-OE2 2.67Å; R116-E123 IonicContact NH2-OE1 2.8Å; R116-E123 PolarHBondContact NH2-OE1 3.14Å; R116-E123 IonicContact NH2-OE2 2.61Å; K118-E123 HydrophobicContact CB-CB 4.3Å; R119-E123 PolarHBondContact N-OE2 3.49Å; N120-E123 PolarHBondContact ND2-OE1 3.03Å; N120-E123 PolarHBondContact O-N 2.86Å; N120-E123 WeakPolarHBondContact OD1-CB 3.41Å; N120-E123 VanDerWaalsContact OD1-CG 3.29Å; N120-E123 WeakPolarHBondContact OD1-CG 3.35Å; N120-E123 PolarHBondContact OD1-N 3.27Å; E123-R125 VanDerWaalsContact C-N 3.29Å; E123-R125 PolarHBondContact O-N 2.93Å; E123-K126 PolarHBondContact O-N 3Å; E123-I127 VanDerWaalsContact O-CG1 3.32Å; E123-I127 WeakPolarHBondContact O-CG1 3.41Å; E123-I127 PolarHBondContact O-N 3.41Å; E123-I141 HydrophobicContact CB-CD1 4.2Å; E123-I141 HydrophobicContact CG-CD1 4.23Å; E123-I141 HydrophobicContact CG-CG1 4.4Å; E123-S205 PolarHBondContact OE1-OG 3.39Å; E123-S205 VanDerWaalsContact OE1-OG 3.12Å
124	I	83.7	Confident	80.2	Confident	72 Å²	72	71.7 Å²	71.7	37%	0.369	34%	0.341	S	S	.	.	H	α-helix	trans	-58.7	-43.9	174.7	-65.9	165.8	0	0	0	110.4	K118 N120 H121 I127 S128	K118-I124 HydrophobicContact CB-CG1 4.42Å; K118-I124 HydrophobicContact CD-CG1 3.92Å; K118-I124 HydrophobicContact CG-CG1 4.07Å; N120-I124 WeakPolarHBondContact O-CG1 3.39Å; N120-I124 PolarHBondContact O-N 3.27Å; H121-I124 PolarHBondContact O-N 2.05Å; I124-I127 PolarHBondContact O-N 2.83Å; I124-S128 WeakPolarHBondContact O-CB 3.17Å; I124-S128 PolarHBondContact O-N 2.98Å; I124-S128 PolarHBondContact O-OG 3.19Å
125	R	84.8	Confident	78.9	Confident	162 Å²	162	75.2 Å²	75.2	61%	0.611	37%	0.366	S	S	*	.	H	α-helix	trans	-67.4	-38.6	178	-169.9	178.3	-173.3	-174.3	0	112.5	H121 Q122 E123 S128 K129	H121-R125 VanDerWaalsContact O-CB 3.28Å; H121-R125 WeakPolarHBondContact O-CB 3.41Å; H121-R125 PolarHBondContact O-N 3.3Å; Q122-R125 PolarHBondContact O-N 3.03Å; E123-R125 VanDerWaalsContact C-N 3.29Å; E123-R125 PolarHBondContact O-N 2.93Å; R125-S128 WeakPolarHBondContact CA-OG 3.44Å; R125-S128 PolarHBondContact O-OG 3.01Å; R125-K129 HydrophobicContact CG-CD 4.44Å; R125-K129 WeakPolarHBondContact O-CB 3.44Å; R125-K129 VanDerWaalsContact O-CG 3.28Å; R125-K129 WeakPolarHBondContact O-CG 3.34Å; R125-K129 PolarHBondContact O-N 2.8Å; R125-K129 VanDerWaalsContact O-N 3.07Å
126	K	84.8	Confident	77.9	Confident	14 Å²	14	82.2 Å²	82.2	6%	0.061	40%	0.404	C	S	.	.	H	α-helix	trans	-61.9	-45.9	175.4	-179.8	173.3	173.8	160.2	0	110.7	Q122 E123 T130 F203 T204 D238 D241	Q122-K126 WeakPolarHBondContact O-CB 3.27Å; Q122-K126 PolarHBondContact O-N 3.05Å; E123-K126 PolarHBondContact O-N 3Å; K126-T130 PolarHBondContact O-OG1 3.29Å; K126-F203 HydrophobicContact CG-CD1 4.07Å; K126-T204 PolarHBondContact NZ-O 3.33Å; K126-T204 PolarHBondContact NZ-OG1 3.15Å; K126-D238 WeakPolarHBondContact CD-OD2 3.37Å; K126-D238 WeakPolarHBondContact CE-OD2 2.93Å; K126-D238 IonicContact NZ-OD2 2.68Å; K126-D238 PolarHBondContact NZ-OD2 3.38Å; K126-D241 IonicContact NZ-OD1 2.79Å; K126-D241 IonicContact NZ-OD2 2.74Å
127	I	84.3	Confident	77.4	Confident	8 Å²	8	86.5 Å²	86.5	4%	0.041	42%	0.423	C	S	.	.	H	α-helix	trans	-64.3	-53.5	175.5	-66.6	166.4	0	0	0	110.2	K118 E123 I124 K129 T130 T131 T139 I141 F203	K118-I127 HydrophobicContact CB-CD1 3.88Å; K118-I127 HydrophobicContact CD-CD1 3.85Å; K118-I127 HydrophobicContact CG-CD1 4.49Å; E123-I127 VanDerWaalsContact O-CG1 3.32Å; E123-I127 WeakPolarHBondContact O-CG1 3.41Å; E123-I127 PolarHBondContact O-N 3.41Å; I124-I127 PolarHBondContact O-N 2.83Å; I127-K129 VanDerWaalsContact C-N 3.31Å; I127-K129 PolarHBondContact O-N 2.92Å; I127-T130 PolarHBondContact O-N 2.85Å; I127-T131 HydrophobicContact CG2-CG2 4.22Å; I127-T131 WeakPolarHBondContact CG2-OG1 3.39Å; I127-T131 PolarHBondContact O-N 3.09Å; I127-T131 PolarHBondContact O-OG1 3.27Å; I127-T131 VanDerWaalsContact O-OG1 3.09Å; I127-T139 HydrophobicContact CG2-CG2 3.92Å; I127-I141 HydrophobicContact CD1-CD1 3.83Å; I127-I141 HydrophobicContact CG1-CD1 4.32Å; I127-F203 HydrophobicContact CG1-CD1 4.35Å; I127-F203 HydrophobicContact CG1-CD2 3.84Å; I127-F203 HydrophobicContact CG1-CE1 4.44Å; I127-F203 HydrophobicContact CG1-CE2 3.94Å; I127-F203 HydrophobicContact CG1-CG 4.09Å; I127-F203 HydrophobicContact CG1-CZ 4.26Å; I127-F203 HydrophobicContact CG2-CE2 4.5Å
128	S	80.2	Confident	77.3	Confident	47 Å²	47	88.9 Å²	88.9	33%	0.329	43%	0.427	S	S	.	.	H	α-helix	trans	-61.9	-35.3	-173.4	68.4	0	0	0	0	113.6	I124 R125 T130 L132	I124-S128 WeakPolarHBondContact O-CB 3.17Å; I124-S128 PolarHBondContact O-N 2.98Å; I124-S128 PolarHBondContact O-OG 3.19Å; R125-S128 WeakPolarHBondContact CA-OG 3.44Å; R125-S128 PolarHBondContact O-OG 3.01Å; S128-T130 PolarHBondContact O-N 3.42Å; S128-L132 WeakPolarHBondContact O-CB 3.41Å; S128-L132 WeakPolarHBondContact O-CD1 3.3Å; S128-L132 PolarHBondContact O-N 3.04Å
129	K	78.1	Confident	77.4	Confident	136 Å²	136	85.5 Å²	85.5	59%	0.591	42%	0.415	S	S	*	.	H	α-helix	trans	-63.6	-23.2	173.9	-78.5	-179	175.5	-170.5	0	113.8	R125 I127	R125-K129 HydrophobicContact CG-CD 4.44Å; R125-K129 WeakPolarHBondContact O-CB 3.44Å; R125-K129 VanDerWaalsContact O-CG 3.28Å; R125-K129 WeakPolarHBondContact O-CG 3.34Å; R125-K129 PolarHBondContact O-N 2.8Å; R125-K129 VanDerWaalsContact O-N 3.07Å; I127-K129 VanDerWaalsContact C-N 3.31Å; I127-K129 PolarHBondContact O-N 2.92Å
130	T	74.1	Confident	77.6	Confident	21 Å²	21	80.1 Å²	80.1	13%	0.129	40%	0.395	C	S	.	.	H	α-helix	trans	-108.9	-32.7	-171	-36.5	0	0	0	0	112.1	K126 I127 S128 F203 Y235 R236	K126-T130 PolarHBondContact O-OG1 3.29Å; I127-T130 PolarHBondContact O-N 2.85Å; S128-T130 PolarHBondContact O-N 3.42Å; T130-F203 HydrophobicContact CG2-CE1 4.32Å; T130-Y235 HydrophobicContact CG2-CD1 4.01Å; T130-Y235 HydrophobicContact CG2-CE1 3.61Å; T130-R236 HydrophobicContact CG2-CB 4.45Å; T130-R236 WeakPolarHBondContact OG1-CD 3.43Å; T130-R236 PolarHBondContact OG1-NH1 3.19Å
131	T	70.7	Confident	77.9	Confident	16 Å²	16	77.8 Å²	77.8	10%	0.098	38%	0.382	C	S	.	.	H	α-helix	trans	-109.4	13.8	-174.2	68.3	0	0	0	0	113.2	I127 H133 L134 T139 F201 F203 Y235	I127-T131 HydrophobicContact CG2-CG2 4.22Å; I127-T131 WeakPolarHBondContact CG2-OG1 3.39Å; I127-T131 PolarHBondContact O-N 3.09Å; I127-T131 PolarHBondContact O-OG1 3.27Å; I127-T131 VanDerWaalsContact O-OG1 3.09Å; T131-H133 PolarHBondContact O-N 3.4Å; T131-L134 CarbonylContact O-C 3.58Å; T131-L134 PolarHBondContact O-N 3.5Å; T131-T139 HydrophobicContact CG2-CG2 4.37Å; T131-F201 HydrophobicContact CG2-CD2 3.85Å; T131-F201 HydrophobicContact CG2-CE2 4.49Å; T131-F203 HydrophobicContact CG2-CE2 4.25Å; T131-F203 HydrophobicContact CG2-CZ 3.67Å; T131-Y235 HydrophobicContact CG2-CE1 4.01Å
132	L	61.7	Low	78.2	Confident	132 Å²	132	69.9 Å²	69.9	69%	0.691	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-31.9	-179.1	-151.6	83.8	0	0	0	112.4	S128	S128-L132 WeakPolarHBondContact O-CB 3.41Å; S128-L132 WeakPolarHBondContact O-CD1 3.3Å; S128-L132 PolarHBondContact O-N 3.04Å
133	H	61.1	Low	78.4	Confident	166 Å²	166	64 Å²	64	77%	0.769	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-2.7	179.5	-56.9	-63.5	0	0	0	114.4	T131	T131-H133 PolarHBondContact O-N 3.4Å
134	L	68.5	Low	78.6	Confident	64 Å²	64	64 Å²	64	34%	0.335	32%	0.318	S	S	.	.			trans	-136	61.5	-171.4	-70.9	155.5	0	0	0	111.2	T131 N136 K137 F201 Y235	T131-L134 CarbonylContact O-C 3.58Å; T131-L134 PolarHBondContact O-N 3.5Å; L134-N136 PolarHBondContact O-N 3.03Å; L134-N136 VanDerWaalsContact O-N 3.15Å; L134-K137 HydrophobicContact CB-CB 4.49Å; L134-K137 HydrophobicContact CB-CG 4.02Å; L134-K137 HydrophobicContact CD2-CG 4.24Å; L134-K137 PolarHBondContact O-N 3.05Å; L134-F201 HydrophobicContact CB-CE2 4.11Å; L134-F201 HydrophobicContact CD1-CE2 3.84Å; L134-F201 HydrophobicContact CD1-CZ 4.11Å; L134-F201 HydrophobicContact CG-CE2 4.49Å; L134-Y235 WeakPolarHBondContact CD1-OH 3.49Å
135	P	61.4	Low	78.7	Confident	109 Å²	109	62.6 Å²	62.6	71%	0.708	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-23.3	-171.2	25.5	-35	0	0	0	114.4
136	N	65.3	Low	78.6	Confident	157 Å²	157	56.8 Å²	56.8	84%	0.84	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	7.2	-173.8	-63.7	-11.3	0	0	0	114	L134	L134-N136 PolarHBondContact O-N 3.03Å; L134-N136 VanDerWaalsContact O-N 3.15Å
137	K	74.2	Confident	77.9	Confident	101 Å²	101	58.5 Å²	58.5	44%	0.439	30%	0.303	S	S	.	.	S	Bend	trans	-90.5	138.2	-176.9	-69.4	-73	-175.6	-177.8	0	111.2	L134 F201	L134-K137 HydrophobicContact CB-CB 4.49Å; L134-K137 HydrophobicContact CB-CG 4.02Å; L134-K137 HydrophobicContact CD2-CG 4.24Å; L134-K137 PolarHBondContact O-N 3.05Å; K137-F201 HydrophobicContact CB-CD2 3.62Å; K137-F201 HydrophobicContact CB-CE1 4.44Å; K137-F201 HydrophobicContact CB-CE2 3.26Å; K137-F201 HydrophobicContact CB-CG 4.37Å; K137-F201 HydrophobicContact CB-CZ 3.73Å; K137-F201 HydrophobicContact CD-CE1 4.27Å; K137-F201 HydrophobicContact CD-CE2 4.2Å; K137-F201 HydrophobicContact CD-CZ 3.75Å; K137-F201 HydrophobicContact CG-CD2 4.29Å; K137-F201 HydrophobicContact CG-CE1 4.37Å; K137-F201 HydrophobicContact CG-CE2 3.42Å; K137-F201 VanDerWaalsContact CG-CE2 3.42Å; K137-F201 HydrophobicContact CG-CZ 3.47Å; K137-F201 VanDerWaalsContact CG-CZ 3.47Å
138	K	81.7	Confident	76.9	Confident	101 Å²	101	61.6 Å²	61.6	44%	0.439	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	132.5	177.7	-64.8	177.4	-176.7	154.5	0	108.4	E199 W200 F201	K138-E199 IonicContact NZ-OE2 3.54Å; K138-E199 PolarHBondContact NZ-OE2 2.94Å; K138-W200 HydrophobicContact CB-CD2 3.67Å; K138-W200 HydrophobicContact CB-CE3 3.45Å; K138-W200 VanDerWaalsContact CB-CE3 3.45Å; K138-W200 HydrophobicContact CB-CG 4.31Å; K138-W200 HydrophobicContact CB-CH2 4.09Å; K138-W200 HydrophobicContact CB-CZ2 4.28Å; K138-W200 HydrophobicContact CB-CZ3 3.65Å; K138-W200 HydrophobicContact CD-CD2 4.28Å; K138-W200 HydrophobicContact CD-CH2 4.17Å; K138-W200 HydrophobicContact CD-CZ2 3.78Å; K138-W200 HydrophobicContact CG-CH2 4.45Å; K138-W200 HydrophobicContact CG-CZ3 4.46Å; K138-W200 WeakPolarHBondContact O-CA 3.39Å; K138-F201 PolarHBondContact O-N 2.9Å
139	T	85.7	Confident	75.8	Confident	34 Å²	34	63.4 Å²	63.4	21%	0.209	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	139.4	-177.2	54.1	0	0	0	0	110	I127 T131 F201 F203	I127-T139 HydrophobicContact CG2-CG2 3.92Å; T131-T139 HydrophobicContact CG2-CG2 4.37Å; T139-F201 WeakPolarHBondContact CA-O 3.46Å; T139-F201 HydrophobicContact CG2-CB 4.25Å; T139-F203 HydrophobicContact CG2-CE2 4.2Å
140	A	87.6	Confident	74.5	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.008	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	147.1	-179.8	0	0	0	0	0	110.6	L115 W167 W200 F201 I202 F203	L115-A140 HydrophobicContact CB-CB 4.28Å; L115-A140 HydrophobicContact CD1-CB 4.28Å; L115-A140 HydrophobicContact CD2-CB 4.02Å; L115-A140 HydrophobicContact CG-CB 4.41Å; A140-W167 HydrophobicContact CB-CH2 3.41Å; A140-W167 VanDerWaalsContact CB-CH2 3.41Å; A140-W167 HydrophobicContact CB-CZ3 3.45Å; A140-W167 VanDerWaalsContact CB-CZ3 3.45Å; A140-W200 HydrophobicContact CB-CE3 3.92Å; A140-F201 PolarHBondContact N-O 3.15Å; A140-I202 HydrophobicContact CB-CG1 4.39Å; A140-I202 WeakPolarHBondContact O-CA 3.48Å; A140-F203 PolarHBondContact O-N 3.32Å
141	I	89.7	Confident	72.9	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.005	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	119.9	169.1	-57.2	-56.2	0	0	0	108.4	L115 R116 K118 E123 I127 D143 F203	L115-I141 WeakPolarHBondContact CA-O 3.16Å; R116-I141 HydrophobicContact CG-CB 4.18Å; R116-I141 PolarHBondContact N-O 3.37Å; R116-I141 PolarHBondContact O-N 2.84Å; K118-I141 HydrophobicContact CB-CG1 4.21Å; E123-I141 HydrophobicContact CB-CD1 4.2Å; E123-I141 HydrophobicContact CG-CD1 4.23Å; E123-I141 HydrophobicContact CG-CG1 4.4Å; I127-I141 HydrophobicContact CD1-CD1 3.83Å; I127-I141 HydrophobicContact CG1-CD1 4.32Å; I141-D143 PolarHBondContact O-N 2.88Å; I141-F203 CarbonylContact C-O 3.58Å; I141-F203 VanDerWaalsContact CA-O 3.25Å; I141-F203 WeakPolarHBondContact CA-O 3.44Å; I141-F203 HydrophobicContact CD1-CB 3.8Å
142	L	91.3	Very high	71.6	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	115.2	165.7	179.9	71.7	0	0	0	108.7	C113 L115 I171 I188 I202 F203 S205 F208 F230 I232 I234	C113-L142 HydrophobicContact CB-CD1 4.15Å; L115-L142 HydrophobicContact CD2-CB 4.12Å; L115-L142 HydrophobicContact CD2-CD1 4.16Å; L142-I171 HydrophobicContact CD1-CG2 4.43Å; L142-I188 HydrophobicContact CD1-CG2 4.34Å; L142-I188 HydrophobicContact CD2-CG2 4.48Å; L142-I202 HydrophobicContact CB-CG2 3.82Å; L142-F203 PolarHBondContact N-O 3.18Å; L142-S205 WeakPolarHBondContact O-CB 3.37Å; L142-S205 PolarHBondContact O-N 3.2Å; L142-F208 HydrophobicContact CD2-CD2 4.07Å; L142-F208 HydrophobicContact CD2-CE2 3.78Å; L142-F208 HydrophobicContact CG-CD2 4.26Å; L142-F208 HydrophobicContact CG-CE2 4.32Å; L142-F230 HydrophobicContact CD2-CD1 4.43Å; L142-F230 HydrophobicContact CD2-CE1 3.94Å; L142-I232 HydrophobicContact CD1-CD1 3.91Å; L142-I232 HydrophobicContact CD2-CD1 3.86Å; L142-I232 HydrophobicContact CG-CD1 4.41Å; L142-I234 HydrophobicContact CD2-CD1 4.15Å
143	D	90.9	Very high	70.5	Confident	1 Å²	1	62 Å²	62	1%	0.005	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	147.9	178	-156.8	0.7	0	0	0	110	C113 I114 R116 I141 Y145 S205	C113-D143 CarbonylContact C-O 3.55Å; C113-D143 VanDerWaalsContact CA-O 3.28Å; C113-D143 WeakPolarHBondContact CA-O 3.33Å; I114-D143 PolarHBondContact N-O 3.45Å; I114-D143 PolarHBondContact O-N 2.76Å; R116-D143 HydrophobicContact CG-CB 4.3Å; R116-D143 IonicContact CZ-OD2 3.84Å; R116-D143 IonicContact NE-OD2 3.9Å; R116-D143 PolarHBondContact NE-OD2 3.36Å; R116-D143 IonicContact NH2-OD2 2.72Å; R116-D143 PolarHBondContact NH2-OD2 3.05Å; I141-D143 PolarHBondContact O-N 2.88Å; D143-Y145 HydrophobicContact CB-CE2 3.95Å; D143-Y145 VanDerWaalsContact CG-OH 3.28Å; D143-Y145 PolarHBondContact OD2-OH 3.27Å; D143-S205 WeakPolarHBondContact OD1-CB 3.32Å
144	C	90.5	Very high	69.5	Low	0 Å²	0	60.8 Å²	60.8	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	144.9	179.3	-52.5	0	0	0	0	109.6	Q112 C113 F208 S211 I212	Q112-C144 WeakPolarHBondContact O-CA 3.32Å; C113-C144 HydrophobicContact CB-CB 4.11Å; C113-C144 WeakPolarHBondContact CB-SG 3.36Å; C113-C144 WeakPolarHBondContact SG-CB 3.33Å; C113-C144 CovalentContact SG-SG 2.05Å; C113-C144 PolarHBondContact SG-SG 3Å; C144-F208 WeakPolarHBondContact SG-CD2 3.19Å; C144-F208 WeakPolarHBondContact SG-CE2 3.49Å; C144-S211 WeakPolarHBondContact O-CB 3.23Å; C144-S211 PolarHBondContact O-OG 2.95Å; C144-I212 HydrophobicContact CB-CG1 4.3Å
145	Y	86.6	Confident	67.9	Low	44 Å²	44	63 Å²	63	17%	0.173	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	150.4	-179	-55.4	-80.7	0	0	0	109.8	F111 Q112 I114 R116 R119 D143 S147	F111-Y145 CarbonylContact C-O 3.57Å; F111-Y145 WeakPolarHBondContact CA-O 3.48Å; F111-Y145 VanDerWaalsContact CB-O 3.3Å; F111-Y145 WeakPolarHBondContact CB-O 3.24Å; Q112-Y145 PolarHBondContact N-O 2.81Å; Q112-Y145 PolarHBondContact O-N 3.4Å; I114-Y145 HydrophobicContact CD1-CD2 4.13Å; I114-Y145 HydrophobicContact CD1-CE2 3.6Å; I114-Y145 HydrophobicContact CG1-CD2 4.17Å; I114-Y145 HydrophobicContact CG1-CE2 3.72Å; R116-Y145 WeakPolarHBondContact CD-OH 3.34Å; R116-Y145 PolarHBondContact NE-OH 3.02Å; R119-Y145 PolarHBondContact NH1-OH 3Å; D143-Y145 HydrophobicContact CB-CE2 3.95Å; D143-Y145 VanDerWaalsContact CG-OH 3.28Å; D143-Y145 PolarHBondContact OD2-OH 3.27Å; Y145-S147 PolarHBondContact O-N 2.78Å
146	N	81.7	Confident	66.7	Low	39 Å²	39	62.1 Å²	62.1	21%	0.209	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	131.2	170.9	-170.3	-17.9	0	0	0	109.4	H110 T148 T149	H110-N146 PolarHBondContact O-OD1 2.97Å; N146-T148 VanDerWaalsContact CG-OG1 3.32Å; N146-T148 PolarHBondContact O-N 3.01Å; N146-T148 PolarHBondContact OD1-N 2.91Å; N146-T148 PolarHBondContact OD1-OG1 3.41Å; N146-T148 VanDerWaalsContact OD1-OG1 3.05Å; N146-T149 PolarHBondContact O-N 3.42Å; N146-T149 VanDerWaalsContact O-N 3.09Å; N146-T149 PolarHBondContact O-OG1 3.3Å
147	S	71.3	Confident	65.1	Low	50 Å²	50	61.5 Å²	61.5	35%	0.35	36%	0.355	S	S	.	.	H	α-helix	trans	-63.2	-26.4	-174.6	-62	0	0	0	0	112.3	H110 F111 Y145 T149 M150	H110-S147 PolarHBondContact O-N 2.88Å; F111-S147 VanDerWaalsContact C-OG 3.3Å; F111-S147 WeakPolarHBondContact CA-OG 3.27Å; F111-S147 PolarHBondContact N-OG 3.41Å; Y145-S147 PolarHBondContact O-N 2.78Å; S147-T149 VanDerWaalsContact C-N 3.3Å; S147-T149 PolarHBondContact O-N 3.19Å; S147-M150 PolarHBondContact O-N 3.34Å
148	T	62.7	Low	63.1	Low	73 Å²	73	61.6 Å²	61.6	45%	0.448	36%	0.364	S	S	.	.	H	α-helix	trans	-66.9	-30.6	176.8	51.7	0	0	0	0	112.8	N146 M150 A151 T152	N146-T148 VanDerWaalsContact CG-OG1 3.32Å; N146-T148 PolarHBondContact O-N 3.01Å; N146-T148 PolarHBondContact OD1-N 2.91Å; N146-T148 PolarHBondContact OD1-OG1 3.41Å; N146-T148 VanDerWaalsContact OD1-OG1 3.05Å; T148-M150 VanDerWaalsContact C-N 3.33Å; T148-M150 PolarHBondContact O-N 2.89Å; T148-A151 PolarHBondContact O-N 2.86Å; T148-T152 PolarHBondContact O-OG1 3.31Å
149	T	56.5	Low	60.7	Low	86 Å²	86	62.9 Å²	62.9	53%	0.528	38%	0.383	S	S	.	.	H	α-helix	trans	-74.2	-24.5	-178.5	-29.3	0	0	0	0	112.7	N146 S147 S153	N146-T149 PolarHBondContact O-N 3.42Å; N146-T149 VanDerWaalsContact O-N 3.09Å; N146-T149 PolarHBondContact O-OG1 3.3Å; S147-T149 VanDerWaalsContact C-N 3.3Å; S147-T149 PolarHBondContact O-N 3.19Å; T149-S153 PolarHBondContact O-N 2.86Å; T149-S153 PolarHBondContact O-OG 2.83Å
150	M	50.5	Low	58.1	Low	40 Å²	40	65.5 Å²	65.5	20%	0.197	40%	0.403	C	S	.	.	H	α-helix	trans	-76	-33	175	-92.9	-166.9	159.6	0	0	112.8	I114 S147 T148 T152 S153 M154	I114-M150 HydrophobicContact CD1-CE 4.21Å; I114-M150 HydrophobicContact CG2-CE 4.48Å; S147-M150 PolarHBondContact O-N 3.34Å; T148-M150 VanDerWaalsContact C-N 3.33Å; T148-M150 PolarHBondContact O-N 2.89Å; M150-T152 VanDerWaalsContact C-N 3.25Å; M150-T152 PolarHBondContact O-N 2.85Å; M150-S153 WeakPolarHBondContact CA-OG 3.34Å; M150-S153 PolarHBondContact O-N 2.89Å; M150-S153 PolarHBondContact O-OG 3.4Å; M150-M154 PolarHBondContact O-N 2.92Å
151	A	42	Very low	55.7	Low	63 Å²	63	71.1 Å²	71.1	52%	0.521	44%	0.439	S	S	.	.	H	α-helix	trans	-60	-38.9	175.6	0	0	0	0	0	111.4	T148 T155	T148-A151 PolarHBondContact O-N 2.86Å; A151-T155 PolarHBondContact O-OG1 3.41Å
152	T	42.1	Very low	53.3	Low	96 Å²	96	75.8 Å²	75.8	59%	0.589	46%	0.463	S	S	*	.	H	α-helix	trans	-76.8	-26.1	-178	-30	0	0	0	0	113.6	T148 M150 T155	T148-T152 PolarHBondContact O-OG1 3.31Å; M150-T152 VanDerWaalsContact C-N 3.25Å; M150-T152 PolarHBondContact O-N 2.85Å; T152-T155 PolarHBondContact O-OG1 3.14Å
153	S	40.2	Very low	50.8	Low	77 Å²	77	81.8 Å²	81.8	54%	0.538	50%	0.495	S	S	.	.	H	α-helix	trans	-88.1	-13.4	179.6	44.7	0	0	0	0	113.7	T149 M150	T149-S153 PolarHBondContact O-N 2.86Å; T149-S153 PolarHBondContact O-OG 2.83Å; M150-S153 WeakPolarHBondContact CA-OG 3.34Å; M150-S153 PolarHBondContact O-N 2.89Å; M150-S153 PolarHBondContact O-OG 3.4Å
154	M	38.7	Very low	48.2	Very low	140 Å²	140	87.2 Å²	87.2	69%	0.69	52%	0.524	S	S	*	.	H	α-helix	trans	-92.7	-12.5	172.6	-69.9	-162	175.9	0	0	114.1	M150	M150-M154 PolarHBondContact O-N 2.92Å
155	T	36.2	Very low	46	Very low	110 Å²	110	94.5 Å²	94.5	68%	0.675	56%	0.562	S	S	*	*	S	Bend	trans	-96.4	-2.7	-179.3	46.8	0	0	0	0	115.2	A151 T152	A151-T155 PolarHBondContact O-OG1 3.41Å; T152-T155 PolarHBondContact O-OG1 3.14Å
156	T	35.3	Very low	44	Very low	90 Å²	90	100.1 Å²	100.1	55%	0.552	59%	0.589	S	S	*	*	S	Bend	trans	-100.2	121.1	171.7	47.8	0	0	0	0	110.3	T158	T156-T158 PolarHBondContact O-N 3.48Å
157	T	32.7	Very low	42.7	Very low	144 Å²	144	101.3 Å²	101.3	88%	0.883	59%	0.591	S	S	*	*	S	Bend	trans	-65.8	58.3	-174	46.4	0	0	0	0	114.9
158	T	30.9	Very low	41.6	Very low	103 Å²	103	108.2 Å²	108.2	63%	0.632	62%	0.615	S	S	*	*	S	Bend	trans	-154.5	114.9	164.1	20.7	0	0	0	0	108.2	T156 S160	T156-T158 PolarHBondContact O-N 3.48Å; T158-S160 PolarHBondContact O-N 2.88Å
159	P	30.9	Very low	41.4	Very low	128 Å²	128	106.3 Å²	106.3	83%	0.831	60%	0.601	S	S	*	*			trans	-65.9	103	176.2	27.6	-30	0	0	0	107.2
160	S	32.4	Very low	41.8	Very low	89 Å²	89	104.6 Å²	104.6	62%	0.622	59%	0.592	S	S	*	*			trans	-59	125.6	167.4	-65.1	0	0	0	0	106.8	T158 L162	T158-S160 PolarHBondContact O-N 2.88Å; S160-L162 PolarHBondContact O-N 2.91Å
161	P	36.5	Very low	43.3	Very low	119 Å²	119	103.4 Å²	103.4	77%	0.773	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	24	-171.1	29.6	-35.2	0	0	0	113.7
162	L	39.6	Very low	45.3	Very low	99 Å²	99	102.2 Å²	102.2	52%	0.518	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.7	-6.2	-177.7	-90.4	151.7	0	0	0	113.8	R119 S160	R119-L162 HydrophobicContact CG-CD2 4.32Å; S160-L162 PolarHBondContact O-N 2.91Å
163	L	38.8	Very low	47.4	Very low	126 Å²	126	99.1 Å²	99.1	66%	0.66	55%	0.553	S	S	*	*	S	Bend	trans	-98.7	76.1	158.4	-88.6	106.4	0	0	0	108.4	I165	L163-I165 PolarHBondContact O-N 2.9Å
164	N	36.3	Very low	49.6	Very low	115 Å²	115	97.7 Å²	97.7	62%	0.615	54%	0.538	S	S	*	.			trans	-68.6	127.2	168.3	-129	-1.4	0	0	0	108.4	E166	N164-E166 PolarHBondContact O-N 3.22Å
165	I	43.3	Very low	52	Low	154 Å²	154	91.1 Å²	91.1	79%	0.79	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	9.1	-162.6	-71.4	154.9	0	0	0	116	L163	L163-I165 PolarHBondContact O-N 2.9Å
166	E	45	Very low	54.4	Low	162 Å²	162	86.6 Å²	86.6	76%	0.757	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-15.5	-176.9	-82	-173.2	145.6	0	0	115.5	N164 K168	N164-E166 PolarHBondContact O-N 3.22Å; E166-K168 PolarHBondContact O-N 3.45Å
167	W	54.2	Low	56.8	Low	63 Å²	63	85.2 Å²	85.2	24%	0.239	46%	0.463	C	S	.	.			trans	-89.5	68.5	-174.8	-54.8	95.3	0	0	0	111.6	L115 A140 Q169 W200	L115-W167 HydrophobicContact CB-CE3 3.73Å; L115-W167 HydrophobicContact CB-CZ3 3.89Å; L115-W167 HydrophobicContact CD1-CZ3 4.44Å; A140-W167 HydrophobicContact CB-CH2 3.41Å; A140-W167 VanDerWaalsContact CB-CH2 3.41Å; A140-W167 HydrophobicContact CB-CZ3 3.45Å; A140-W167 VanDerWaalsContact CB-CZ3 3.45Å; W167-Q169 PolarHBondContact O-N 3.06Å; W167-W200 HydrophobicContact CE3-CH2 4.2Å; W167-W200 HydrophobicContact CE3-CZ3 4.35Å; W167-W200 AromaticContact CH2-CE3 3.61Å; W167-W200 HydrophobicContact CH2-CE3 3.61Å; W167-W200 AromaticContact CH2-CH2 3.55Å; W167-W200 HydrophobicContact CH2-CH2 3.55Å; W167-W200 HydrophobicContact CH2-CZ2 4.49Å; W167-W200 AromaticContact CH2-CZ3 3.03Å; W167-W200 HydrophobicContact CH2-CZ3 3.03Å; W167-W200 HydrophobicContact CZ2-CH2 4.14Å; W167-W200 AromaticContact CZ2-CZ3 3.9Å; W167-W200 HydrophobicContact CZ2-CZ3 3.9Å; W167-W200 HydrophobicContact CZ3-CD2 4.1Å; W167-W200 AromaticContact CZ3-CE3 3.56Å; W167-W200 HydrophobicContact CZ3-CE3 3.56Å; W167-W200 AromaticContact CZ3-CH2 3.55Å; W167-W200 HydrophobicContact CZ3-CH2 3.55Å; W167-W200 HydrophobicContact CZ3-CZ2 4.07Å; W167-W200 AromaticContact CZ3-CZ3 3.29Å; W167-W200 HydrophobicContact CZ3-CZ3 3.29Å
168	K	48.8	Very low	59.3	Low	196 Å²	196	79.7 Å²	79.7	85%	0.852	43%	0.427	S	S	*	.			trans	-76.4	-1.8	172	-80.1	-170.3	177.9	-178.6	0	114	E166 S170	E166-K168 PolarHBondContact O-N 3.45Å; K168-S170 PolarHBondContact O-N 3.42Å
169	Q	59.4	Low	61.6	Low	33 Å²	33	80.6 Å²	80.6	15%	0.154	42%	0.422	C	S	.	.			trans	-80.4	121	-177.6	-72.7	171.9	-18.1	0	0	110.8	W167 I171 M197	W167-Q169 PolarHBondContact O-N 3.06Å; Q169-I171 PolarHBondContact O-N 3.41Å; Q169-M197 HydrophobicContact CB-CE 3.56Å; Q169-M197 HydrophobicContact CG-CE 4.07Å
170	S	64.6	Low	64	Low	50 Å²	50	77.5 Å²	77.5	35%	0.35	40%	0.401	S	S	.	.			trans	-83.5	95	-178.5	51.3	0	0	0	0	110.5	K168 I172 T190 L191	K168-S170 PolarHBondContact O-N 3.42Å; S170-I172 PolarHBondContact O-N 2.91Å; S170-T190 WeakPolarHBondContact O-CA 3.31Å; S170-L191 PolarHBondContact O-N 2.81Å
171	I	81.3	Confident	66.2	Low	15 Å²	15	79.2 Å²	79.2	8%	0.077	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	131.2	160.2	-63.7	-64.3	0	0	0	108.1	C113 L115 L142 Q169 I188 G189 T190 M197 I232	C113-I171 HydrophobicContact CB-CG2 4Å; C113-I171 WeakPolarHBondContact O-CG2 3.28Å; L115-I171 HydrophobicContact CD1-CD1 4.02Å; L115-I171 HydrophobicContact CD1-CG1 4.26Å; L115-I171 HydrophobicContact CD2-CD1 4.34Å; L115-I171 HydrophobicContact CD2-CG1 4.45Å; L115-I171 HydrophobicContact CG-CD1 3.84Å; L115-I171 HydrophobicContact CG-CG1 3.7Å; L142-I171 HydrophobicContact CD1-CG2 4.43Å; Q169-I171 PolarHBondContact O-N 3.41Å; I171-I188 HydrophobicContact CG2-CG2 4.16Å; I171-G189 CarbonylContact C-O 3.48Å; I171-G189 WeakPolarHBondContact CA-O 3.27Å; I171-T190 HydrophobicContact CD1-CG2 4.24Å; I171-M197 HydrophobicContact CD1-CE 3.84Å; I171-I232 HydrophobicContact CD1-CD1 4.25Å; I171-I232 HydrophobicContact CD1-CG2 3.99Å
172	I	83.9	Confident	68.4	Low	38 Å²	38	81.4 Å²	81.4	20%	0.195	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	143.9	169.3	53.5	168.8	0	0	0	110.8	S170 I188 G189 L191	S170-I172 PolarHBondContact O-N 2.91Å; I172-I188 WeakPolarHBondContact O-CA 3Å; I172-G189 WeakPolarHBondContact CG1-O 3.37Å; I172-G189 PolarHBondContact N-O 2.99Å; I172-G189 PolarHBondContact O-N 2.92Å; I172-L191 HydrophobicContact CD1-CG 4.44Å; I172-L191 HydrophobicContact CG2-CD1 3.28Å; I172-L191 HydrophobicContact CG2-CD2 4.12Å; I172-L191 HydrophobicContact CG2-CG 3.35Å
173	S	86.4	Confident	70.6	Confident	30 Å²	30	77.8 Å²	77.8	21%	0.21	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	112.4	168.2	-54.6	0	0	0	0	106.4	C109 C113 I187	C109-S173 PolarHBondContact SG-O 3.41Å; C113-S173 WeakPolarHBondContact CB-OG 3.29Å; C113-S173 PolarHBondContact N-OG 3.49Å; C113-S173 PolarHBondContact SG-OG 2.68Å; S173-I187 WeakPolarHBondContact CA-O 3.27Å
174	Q	87.2	Confident	73.1	Confident	48 Å²	48	71.9 Å²	71.9	22%	0.224	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	133.2	177.4	-177.4	178.3	1.1	0	0	109	D106 V176 L186 I187	D106-Q174 PolarHBondContact OD1-NE2 3.05Å; Q174-V176 HydrophobicContact CG-CG2 4.01Å; Q174-L186 WeakPolarHBondContact O-CA 3.5Å; Q174-I187 HydrophobicContact CB-CB 4.36Å; Q174-I187 PolarHBondContact N-O 3.22Å; Q174-I187 PolarHBondContact O-N 3.21Å
175	C	88.4	Confident	75.6	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.007	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	113.7	179	-70.1	0	0	0	0	108.1	I107 C109 L184	I107-C175 HydrophobicContact CD1-CB 4.47Å; I107-C175 HydrophobicContact CG1-CB 3.84Å; I107-C175 WeakPolarHBondContact CG1-O 3.48Å; I107-C175 PolarHBondContact N-O 3.02Å; I107-C175 VanDerWaalsContact O-O 3.1Å; C109-C175 WeakPolarHBondContact CA-SG 3.47Å; C109-C175 HydrophobicContact CB-CB 4.04Å; C109-C175 WeakPolarHBondContact CB-SG 3.4Å; C109-C175 VanDerWaalsContact SG-CA 3.59Å; C109-C175 WeakPolarHBondContact SG-CB 3.4Å; C109-C175 PolarHBondContact SG-N 3.19Å; C109-C175 CovalentContact SG-SG 2.03Å; C109-C175 PolarHBondContact SG-SG 3.32Å; C175-L184 HydrophobicContact CB-CD1 4.11Å
176	V	87.4	Confident	77.9	Confident	15 Å²	15	60.5 Å²	60.5	9%	0.091	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	123.5	-179.8	-168.9	0	0	0	0	107.8	Y104 D106 Q174 H185 I187	Y104-V176 HydrophobicContact CD1-CG1 4.06Å; Y104-V176 HydrophobicContact CG-CG1 4.37Å; D106-V176 WeakPolarHBondContact OD1-CG2 3.47Å; Q174-V176 HydrophobicContact CG-CG2 4.01Å; V176-H185 HydrophobicContact CB-CB 4.28Å; V176-H185 PolarHBondContact N-O 3.11Å; V176-H185 PolarHBondContact O-N 2.9Å; V176-I187 HydrophobicContact CG2-CD1 4.31Å
177	R	85.7	Confident	80	Confident	62 Å²	62	53.3 Å²	53.3	23%	0.234	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	131.4	177.6	-168.4	178.6	62.5	-166.7	-7.4	109.5	Q105 I107	Q105-R177 PolarHBondContact N-O 3.22Å; Q105-R177 PolarHBondContact O-N 3.11Å; I107-R177 HydrophobicContact CD1-CB 3.98Å; I107-R177 HydrophobicContact CG1-CB 4.18Å; I107-R177 HydrophobicContact CG2-CB 4Å
178	H	84.6	Confident	81.7	Confident	28 Å²	28	50.3 Å²	50.3	13%	0.13	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	151.9	170.8	-172.4	-111.3	0	0	0	110.9	E103 Y104 T180 K181 L183	E103-H178 CarbonylContact O-C 3.42Å; E103-H178 WeakPolarHBondContact O-CA 2.9Å; E103-H178 PolarHBondContact O-CD2 2.55Å; E103-H178 VanDerWaalsContact O-CD2 3.27Å; Y104-H178 HydrophobicContact CD1-CB 4.26Å; Y104-H178 HydrophobicContact CE1-CB 4.08Å; Y104-H178 AromaticContact CE1-CD2 3.59Å; Y104-H178 AromaticContact CE2-CD2 3.83Å; Y104-H178 AromaticContact CZ-CD2 3.49Å; Y104-H178 VanDerWaalsContact CZ-CD2 3.49Å; H178-T180 VanDerWaalsContact CE1-CG2 3.5Å; H178-T180 WeakPolarHBondContact CE1-CG2 3.34Å; H178-T180 WeakPolarHBondContact ND1-CG2 3.39Å; H178-T180 PolarHBondContact ND1-N 2.83Å; H178-T180 PolarHBondContact ND1-OG1 3.47Å; H178-T180 PolarHBondContact O-N 3.27Å; H178-T180 VanDerWaalsContact O-N 3.1Å; H178-K181 WeakPolarHBondContact O-CA 3.38Å; H178-K181 PolarHBondContact O-N 3.38Å; H178-L183 HydrophobicContact CB-CB 3.92Å; H178-L183 HydrophobicContact CB-CD2 4.31Å; H178-L183 PolarHBondContact N-O 2.61Å
179	F	79.5	Confident	83.4	Confident	122 Å²	122	41 Å²	41	54%	0.535	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-28.1	-175.9	75.5	-90.9	0	0	0	112.7	E103 K181	E103-F179 HydrophobicContact CB-CD1 3.8Å; E103-F179 HydrophobicContact CB-CE1 4.24Å; E103-F179 HydrophobicContact CG-CD1 3.88Å; E103-F179 HydrophobicContact CG-CE1 3.94Å; E103-F179 PolarHBondContact O-N 3.49Å; F179-K181 PolarHBondContact O-N 3.01Å
180	T	81.3	Confident	84.1	Confident	62 Å²	62	41 Å²	41	38%	0.38	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-9.3	174.7	63.5	0	0	0	0	113.4	H178 R182	H178-T180 VanDerWaalsContact CE1-CG2 3.5Å; H178-T180 WeakPolarHBondContact CE1-CG2 3.34Å; H178-T180 WeakPolarHBondContact ND1-CG2 3.39Å; H178-T180 PolarHBondContact ND1-N 2.83Å; H178-T180 PolarHBondContact ND1-OG1 3.47Å; H178-T180 PolarHBondContact O-N 3.27Å; H178-T180 VanDerWaalsContact O-N 3.1Å; T180-R182 PolarHBondContact O-N 2.94Å
181	K	78.3	Confident	84	Confident	126 Å²	126	43.2 Å²	43.2	55%	0.548	20%	0.204	S	C	.	.	S	Bend	trans	61.4	1.7	-174.3	-54.4	-179.5	-178.9	176.7	0	115.3	H178 F179	H178-K181 WeakPolarHBondContact O-CA 3.38Å; H178-K181 PolarHBondContact O-N 3.38Å; F179-K181 PolarHBondContact O-N 3.01Å
182	R	82.3	Confident	83	Confident	164 Å²	164	44.3 Å²	44.3	62%	0.619	21%	0.213	S	C	*	.	S	Bend	trans	-83.4	-34.3	-177.4	-75	-175.3	-175.5	-173.5	0.4	112.9	T180 T224 D225	T180-R182 PolarHBondContact O-N 2.94Å; R182-T224 WeakPolarHBondContact CB-OG1 3.47Å; R182-T224 HydrophobicContact CG-CG2 4.3Å; R182-T224 PolarHBondContact O-N 2.78Å; R182-T224 PolarHBondContact O-OG1 3.17Å; R182-T224 VanDerWaalsContact O-OG1 3.05Å; R182-D225 PolarHBondContact O-N 2.73Å
183	L	86.6	Confident	81.7	Confident	24 Å²	24	50 Å²	50	13%	0.126	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	128.9	-177.7	-175.6	153.5	0	0	0	110.8	Y104 H178 H185 D225 Y227	Y104-L183 HydrophobicContact CE1-CD2 4.37Å; H178-L183 HydrophobicContact CB-CB 3.92Å; H178-L183 HydrophobicContact CB-CD2 4.31Å; H178-L183 PolarHBondContact N-O 2.61Å; L183-H185 HydrophobicContact CD2-CB 4.26Å; L183-D225 WeakPolarHBondContact CA-O 3.47Å; L183-Y227 HydrophobicContact CD1-CD1 4.01Å; L183-Y227 HydrophobicContact CD1-CD2 4.16Å; L183-Y227 HydrophobicContact CD1-CE1 3.69Å; L183-Y227 HydrophobicContact CD1-CE2 3.84Å; L183-Y227 HydrophobicContact CD1-CG 4.27Å; L183-Y227 HydrophobicContact CD2-CG 4.48Å; L183-Y227 HydrophobicContact CG-CD1 4.17Å; L183-Y227 HydrophobicContact CG-CE1 4.3Å; L183-Y227 HydrophobicContact CG-CG 4.41Å
184	L	89.7	Confident	80.1	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.005	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	125.6	169.8	179	67.4	0	0	0	109.2	I107 C175 I216 I220 T223 D225 L226 Y227	I107-L184 HydrophobicContact CD1-CD1 3.86Å; I107-L184 HydrophobicContact CG1-CD1 4.42Å; C175-L184 HydrophobicContact CB-CD1 4.11Å; L184-I216 HydrophobicContact CD2-CD1 4.12Å; L184-I216 HydrophobicContact CD2-CG1 4.03Å; L184-I220 HydrophobicContact CD1-CG2 4.26Å; L184-I220 HydrophobicContact CD2-CD1 3.99Å; L184-I220 HydrophobicContact CD2-CG2 3.98Å; L184-T223 HydrophobicContact CB-CG2 3.72Å; L184-T223 HydrophobicContact CD2-CG2 4.17Å; L184-D225 PolarHBondContact N-O 3.31Å; L184-L226 HydrophobicContact CB-CD1 4.33Å; L184-L226 HydrophobicContact CD2-CD1 3.98Å; L184-L226 HydrophobicContact CG-CD1 4.15Å; L184-L226 CarbonylContact O-C 3.52Å; L184-L226 WeakPolarHBondContact O-CA 3.35Å; L184-Y227 PolarHBondContact O-N 2.75Å
185	H	90.5	Very high	78.6	Confident	29 Å²	29	53.9 Å²	53.9	13%	0.134	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	113.2	173.1	-171.5	179.7	0	0	0	109.7	V176 L183 Y227 T229	V176-H185 HydrophobicContact CB-CB 4.28Å; V176-H185 PolarHBondContact N-O 3.11Å; V176-H185 PolarHBondContact O-N 2.9Å; L183-H185 HydrophobicContact CD2-CB 4.26Å; H185-Y227 CarbonylContact C-O 3.57Å; H185-Y227 WeakPolarHBondContact CA-O 3.49Å; H185-Y227 PolarHBondContact CD2-O 2.84Å; H185-T229 PolarHBondContact NE2-OG1 2.86Å
186	L	91.1	Very high	77.3	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.01	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	121.2	172.2	174.3	53.7	0	0	0	110.1	F111 Q174 I188 I212 L226 Y227 I228 T229	F111-L186 HydrophobicContact CE2-CD1 3.81Å; F111-L186 HydrophobicContact CE2-CD2 4.07Å; F111-L186 HydrophobicContact CZ-CD1 3.45Å; F111-L186 VanDerWaalsContact CZ-CD1 3.45Å; F111-L186 HydrophobicContact CZ-CD2 3.65Å; F111-L186 HydrophobicContact CZ-CG 4.15Å; Q174-L186 WeakPolarHBondContact O-CA 3.5Å; L186-I188 HydrophobicContact CD1-CG1 4.05Å; L186-I188 HydrophobicContact CD2-CD1 4.13Å; L186-I188 HydrophobicContact CD2-CG1 4.38Å; L186-I188 HydrophobicContact CG-CD1 4.33Å; L186-I188 HydrophobicContact CG-CG1 4.04Å; L186-I212 HydrophobicContact CD2-CD1 3.82Å; L186-I212 HydrophobicContact CD2-CG1 4.36Å; L186-I212 HydrophobicContact CD2-CG2 3.98Å; L186-L226 HydrophobicContact CB-CD1 4.36Å; L186-Y227 PolarHBondContact N-O 2.96Å; L186-I228 HydrophobicContact CB-CG1 4.46Å; L186-I228 CarbonylContact O-C 3.46Å; L186-I228 WeakPolarHBondContact O-CA 3.37Å; L186-T229 PolarHBondContact O-N 3.21Å
187	I	89.6	Confident	76.2	Confident	11 Å²	11	57.6 Å²	57.6	6%	0.056	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	122.1	173.7	-55.1	170	0	0	0	107.9	F89 S173 Q174 V176 T231	F89-I187 HydrophobicContact CE2-CG2 4.11Å; F89-I187 HydrophobicContact CZ-CD1 4.15Å; F89-I187 HydrophobicContact CZ-CG2 4.34Å; S173-I187 WeakPolarHBondContact CA-O 3.27Å; Q174-I187 HydrophobicContact CB-CB 4.36Å; Q174-I187 PolarHBondContact N-O 3.22Å; Q174-I187 PolarHBondContact O-N 3.21Å; V176-I187 HydrophobicContact CG2-CD1 4.31Å; I187-T231 HydrophobicContact CG2-CG2 4.49Å
188	I	88.6	Confident	75.2	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	119.5	174	-59	175.4	0	0	0	107.6	L142 I171 I172 L186 F208 I212 T229 F230 T231 I232	L142-I188 HydrophobicContact CD1-CG2 4.34Å; L142-I188 HydrophobicContact CD2-CG2 4.48Å; I171-I188 HydrophobicContact CG2-CG2 4.16Å; I172-I188 WeakPolarHBondContact O-CA 3Å; L186-I188 HydrophobicContact CD1-CG1 4.05Å; L186-I188 HydrophobicContact CD2-CD1 4.13Å; L186-I188 HydrophobicContact CD2-CG1 4.38Å; L186-I188 HydrophobicContact CG-CD1 4.33Å; L186-I188 HydrophobicContact CG-CG1 4.04Å; I188-F208 HydrophobicContact CD1-CE2 3.63Å; I188-F208 HydrophobicContact CD1-CZ 3.65Å; I188-I212 HydrophobicContact CD1-CD1 4.43Å; I188-T229 PolarHBondContact N-O 2.79Å; I188-F230 HydrophobicContact CB-CD1 4.14Å; I188-F230 HydrophobicContact CB-CE1 4.38Å; I188-F230 HydrophobicContact CD1-CD1 4.43Å; I188-F230 HydrophobicContact CD1-CE1 3.82Å; I188-F230 HydrophobicContact CD1-CZ 4.38Å; I188-F230 HydrophobicContact CG2-CD1 4.41Å; I188-T231 PolarHBondContact O-N 2.74Å; I188-T231 PolarHBondContact O-OG1 3.34Å; I188-I232 HydrophobicContact CG2-CD1 4.04Å
189	G	84.4	Confident	74.6	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	-169.5	-169.5	0	0	0	0	0	114.4	I171 I172 T231	I171-G189 CarbonylContact C-O 3.48Å; I171-G189 WeakPolarHBondContact CA-O 3.27Å; I172-G189 WeakPolarHBondContact CG1-O 3.37Å; I172-G189 PolarHBondContact N-O 2.99Å; I172-G189 PolarHBondContact O-N 2.92Å; G189-T231 WeakPolarHBondContact CA-OG1 3.25Å
190	T	75.7	Confident	74.6	Confident	32 Å²	32	55.8 Å²	55.8	20%	0.196	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	148.9	170.2	58	0	0	0	0	109.9	S170 I171 S192 M197 I232	S170-T190 WeakPolarHBondContact O-CA 3.31Å; I171-T190 HydrophobicContact CD1-CG2 4.24Å; T190-S192 VanDerWaalsContact C-N 3.33Å; T190-S192 WeakPolarHBondContact CB-O 3.37Å; T190-S192 PolarHBondContact OG1-O 3.38Å; T190-M197 HydrophobicContact CG2-CE 3.31Å; T190-M197 HydrophobicContact CG2-CG 4Å; T190-M197 HydrophobicContact CG2-SD 3.74Å; T190-I232 HydrophobicContact CG2-CG2 3.74Å
191	L	62.4	Low	74.7	Confident	98 Å²	98	53.7 Å²	53.7	51%	0.513	28%	0.281	S	S	.	.	S	Bend	trans	-75.2	-25	174.7	-83.8	148	0	0	0	113.2	S170 I172	S170-L191 PolarHBondContact O-N 2.81Å; I172-L191 HydrophobicContact CD1-CG 4.44Å; I172-L191 HydrophobicContact CG2-CD1 3.28Å; I172-L191 HydrophobicContact CG2-CD2 4.12Å; I172-L191 HydrophobicContact CG2-CG 3.35Å
192	S	59	Low	75.2	Confident	37 Å²	37	47.7 Å²	47.7	26%	0.259	26%	0.255	S	S	.	.	S	Bend	trans	-113.1	141.9	-178.8	43	0	0	0	0	109.7	T190 D194	T190-S192 VanDerWaalsContact C-N 3.33Å; T190-S192 WeakPolarHBondContact CB-O 3.37Å; T190-S192 PolarHBondContact OG1-O 3.38Å; S192-D194 WeakPolarHBondContact CB-OD2 3.3Å; S192-D194 PolarHBondContact O-N 3.16Å; S192-D194 PolarHBondContact OG-OD2 2.93Å
193	N	56.4	Low	75.6	Confident	159 Å²	159	39.9 Å²	39.9	85%	0.85	23%	0.225	S	C	*	.			trans	-69.6	52.5	156	-80.8	-8.8	0	0	0	109.2	S195	N193-S195 PolarHBondContact O-N 3.27Å
194	D	53.8	Low	75.8	Confident	63 Å²	63	38.7 Å²	38.7	34%	0.337	22%	0.219	S	C	.	.			trans	-66.1	103.6	176.2	-93.3	-34.7	0	0	0	107.1	S192 N196 M197	S192-D194 WeakPolarHBondContact CB-OD2 3.3Å; S192-D194 PolarHBondContact O-N 3.16Å; S192-D194 PolarHBondContact OG-OD2 2.93Å; D194-N196 HydrophobicContact CB-CB 4.42Å; D194-N196 PolarHBondContact O-N 3.28Å; D194-M197 WeakPolarHBondContact O-CB 3.42Å; D194-M197 PolarHBondContact O-N 3.01Å
195	S	55.7	Low	75.8	Confident	96 Å²	96	38.8 Å²	38.8	67%	0.671	22%	0.22	S	C	*	.	G	3₁₀ helix	trans	-48.4	-27.5	169.5	53.7	0	0	0	0	111.8	N193 M197 A198	N193-S195 PolarHBondContact O-N 3.27Å; S195-M197 PolarHBondContact O-N 2.92Å; S195-A198 WeakPolarHBondContact O-CB 3.41Å; S195-A198 PolarHBondContact O-N 2.85Å
196	N	60.4	Low	75.6	Confident	84 Å²	84	40.8 Å²	40.8	45%	0.449	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-57.7	-30.8	173.5	-66.6	-26.9	0	0	0	113.7	D194 A198 E199	D194-N196 HydrophobicContact CB-CB 4.42Å; D194-N196 PolarHBondContact O-N 3.28Å; N196-A198 PolarHBondContact O-N 2.85Å; N196-E199 PolarHBondContact O-N 3.3Å
197	M	64.4	Low	75.3	Confident	9 Å²	9	45.7 Å²	45.7	4%	0.044	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-62.8	-27.2	175.3	-85	-95.1	179.6	0	0	112.3	L115 Q169 I171 T190 D194 S195 E199 W200 I202	L115-M197 HydrophobicContact CD1-CE 3.58Å; L115-M197 HydrophobicContact CD1-SD 4.12Å; Q169-M197 HydrophobicContact CB-CE 3.56Å; Q169-M197 HydrophobicContact CG-CE 4.07Å; I171-M197 HydrophobicContact CD1-CE 3.84Å; T190-M197 HydrophobicContact CG2-CE 3.31Å; T190-M197 HydrophobicContact CG2-CG 4Å; T190-M197 HydrophobicContact CG2-SD 3.74Å; D194-M197 WeakPolarHBondContact O-CB 3.42Å; D194-M197 PolarHBondContact O-N 3.01Å; S195-M197 PolarHBondContact O-N 2.92Å; M197-E199 PolarHBondContact O-N 3.2Å; M197-W200 PolarHBondContact O-N 3.3Å; M197-W200 VanDerWaalsContact O-N 3.11Å; M197-I202 HydrophobicContact SD-CD1 4.01Å
198	A	64.8	Low	75.4	Confident	58 Å²	58	45.1 Å²	45.1	48%	0.479	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-68.5	-13.8	178.1	0	0	0	0	0	114.1	S195 N196	S195-A198 WeakPolarHBondContact O-CB 3.41Å; S195-A198 PolarHBondContact O-N 2.85Å; N196-A198 PolarHBondContact O-N 2.85Å
199	E	73	Confident	75.6	Confident	88 Å²	88	45.5 Å²	45.5	41%	0.411	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-85.2	-17.2	173.8	-59.4	-168.7	156.2	0	0	113.6	K138 N196 M197	K138-E199 IonicContact NZ-OE2 3.54Å; K138-E199 PolarHBondContact NZ-OE2 2.94Å; N196-E199 PolarHBondContact O-N 3.3Å; M197-E199 PolarHBondContact O-N 3.2Å
200	W	77.9	Confident	75.8	Confident	29 Å²	29	47.6 Å²	47.6	11%	0.11	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	127.6	-173	-69.6	90.1	0	0	0	111.7	K138 A140 W167 M197 I202	K138-W200 HydrophobicContact CB-CD2 3.67Å; K138-W200 HydrophobicContact CB-CE3 3.45Å; K138-W200 VanDerWaalsContact CB-CE3 3.45Å; K138-W200 HydrophobicContact CB-CG 4.31Å; K138-W200 HydrophobicContact CB-CH2 4.09Å; K138-W200 HydrophobicContact CB-CZ2 4.28Å; K138-W200 HydrophobicContact CB-CZ3 3.65Å; K138-W200 HydrophobicContact CD-CD2 4.28Å; K138-W200 HydrophobicContact CD-CH2 4.17Å; K138-W200 HydrophobicContact CD-CZ2 3.78Å; K138-W200 HydrophobicContact CG-CH2 4.45Å; K138-W200 HydrophobicContact CG-CZ3 4.46Å; K138-W200 WeakPolarHBondContact O-CA 3.39Å; A140-W200 HydrophobicContact CB-CE3 3.92Å; W167-W200 HydrophobicContact CE3-CH2 4.2Å; W167-W200 HydrophobicContact CE3-CZ3 4.35Å; W167-W200 AromaticContact CH2-CE3 3.61Å; W167-W200 HydrophobicContact CH2-CE3 3.61Å; W167-W200 AromaticContact CH2-CH2 3.55Å; W167-W200 HydrophobicContact CH2-CH2 3.55Å; W167-W200 HydrophobicContact CH2-CZ2 4.49Å; W167-W200 AromaticContact CH2-CZ3 3.03Å; W167-W200 HydrophobicContact CH2-CZ3 3.03Å; W167-W200 HydrophobicContact CZ2-CH2 4.14Å; W167-W200 AromaticContact CZ2-CZ3 3.9Å; W167-W200 HydrophobicContact CZ2-CZ3 3.9Å; W167-W200 HydrophobicContact CZ3-CD2 4.1Å; W167-W200 AromaticContact CZ3-CE3 3.56Å; W167-W200 HydrophobicContact CZ3-CE3 3.56Å; W167-W200 AromaticContact CZ3-CH2 3.55Å; W167-W200 HydrophobicContact CZ3-CH2 3.55Å; W167-W200 HydrophobicContact CZ3-CZ2 4.07Å; W167-W200 AromaticContact CZ3-CZ3 3.29Å; W167-W200 HydrophobicContact CZ3-CZ3 3.29Å; M197-W200 PolarHBondContact O-N 3.3Å; M197-W200 VanDerWaalsContact O-N 3.11Å; W200-I202 HydrophobicContact CB-CG1 4.31Å; W200-I202 PolarHBondContact O-N 2.98Å
201	F	84.5	Confident	76.4	Confident	17 Å²	17	46.9 Å²	46.9	8%	0.075	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	103.9	169.3	-62.9	-12.4	0	0	0	109	T131 L134 K137 K138 T139 A140 F203 Y235	T131-F201 HydrophobicContact CG2-CD2 3.85Å; T131-F201 HydrophobicContact CG2-CE2 4.49Å; L134-F201 HydrophobicContact CB-CE2 4.11Å; L134-F201 HydrophobicContact CD1-CE2 3.84Å; L134-F201 HydrophobicContact CD1-CZ 4.11Å; L134-F201 HydrophobicContact CG-CE2 4.49Å; K137-F201 HydrophobicContact CB-CD2 3.62Å; K137-F201 HydrophobicContact CB-CE1 4.44Å; K137-F201 HydrophobicContact CB-CE2 3.26Å; K137-F201 HydrophobicContact CB-CG 4.37Å; K137-F201 HydrophobicContact CB-CZ 3.73Å; K137-F201 HydrophobicContact CD-CE1 4.27Å; K137-F201 HydrophobicContact CD-CE2 4.2Å; K137-F201 HydrophobicContact CD-CZ 3.75Å; K137-F201 HydrophobicContact CG-CD2 4.29Å; K137-F201 HydrophobicContact CG-CE1 4.37Å; K137-F201 HydrophobicContact CG-CE2 3.42Å; K137-F201 VanDerWaalsContact CG-CE2 3.42Å; K137-F201 HydrophobicContact CG-CZ 3.47Å; K137-F201 VanDerWaalsContact CG-CZ 3.47Å; K138-F201 PolarHBondContact O-N 2.9Å; T139-F201 WeakPolarHBondContact CA-O 3.46Å; T139-F201 HydrophobicContact CG2-CB 4.25Å; A140-F201 PolarHBondContact N-O 3.15Å; F201-F203 HydrophobicContact CB-CE2 3.79Å; F201-F203 HydrophobicContact CB-CZ 4.41Å; F201-F203 VanDerWaalsContact O-CD2 3.27Å; F201-F203 WeakPolarHBondContact O-CD2 3.1Å; F201-F203 WeakPolarHBondContact O-CE2 3Å; F201-Y235 HydrophobicContact CB-CD1 4.12Å; F201-Y235 HydrophobicContact CB-CD2 3.87Å; F201-Y235 HydrophobicContact CB-CE2 4.31Å; F201-Y235 HydrophobicContact CB-CG 3.74Å; F201-Y235 AromaticContact CD1-CD2 3.37Å; F201-Y235 HydrophobicContact CD1-CD2 3.37Å; F201-Y235 AromaticContact CD1-CE2 3.42Å; F201-Y235 HydrophobicContact CD1-CE2 3.42Å; F201-Y235 VanDerWaalsContact CD1-CE2 3.42Å; F201-Y235 HydrophobicContact CD1-CG 4.17Å; F201-Y235 HydrophobicContact CD2-CD1 4.46Å; F201-Y235 HydrophobicContact CD2-CD2 4.1Å; F201-Y235 HydrophobicContact CD2-CE1 4.09Å; F201-Y235 AromaticContact CD2-CE2 3.67Å; F201-Y235 HydrophobicContact CD2-CE2 3.67Å; F201-Y235 HydrophobicContact CD2-CG 4.46Å; F201-Y235 AromaticContact CD2-CZ 3.68Å; F201-Y235 AromaticContact CE1-CD2 3.86Å; F201-Y235 HydrophobicContact CE1-CD2 3.86Å; F201-Y235 AromaticContact CE1-CE2 3.45Å; F201-Y235 HydrophobicContact CE1-CE2 3.45Å; F201-Y235 VanDerWaalsContact CE1-CE2 3.45Å; F201-Y235 HydrophobicContact CE2-CD2 4.48Å; F201-Y235 HydrophobicContact CE2-CE1 4.48Å; F201-Y235 AromaticContact CE2-CE2 3.67Å; F201-Y235 HydrophobicContact CE2-CE2 3.67Å; F201-Y235 AromaticContact CE2-CZ 3.68Å; F201-Y235 HydrophobicContact CG-CD1 4.29Å; F201-Y235 AromaticContact CG-CD2 3.51Å; F201-Y235 HydrophobicContact CG-CD2 3.51Å; F201-Y235 HydrophobicContact CG-CE1 4.33Å; F201-Y235 AromaticContact CG-CE2 3.54Å; F201-Y235 HydrophobicContact CG-CE2 3.54Å; F201-Y235 AromaticContact CG-CG 3.9Å; F201-Y235 HydrophobicContact CG-CG 3.9Å; F201-Y235 AromaticContact CG-CZ 3.98Å; F201-Y235 HydrophobicContact CZ-CD2 4.38Å; F201-Y235 AromaticContact CZ-CE2 3.56Å; F201-Y235 HydrophobicContact CZ-CE2 3.56Å
202	I	87.7	Confident	77.8	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	126.9	-176.4	-55.5	175.6	0	0	0	110	L115 A140 L142 M197 W200 I232 P233 I234 Y235	L115-I202 HydrophobicContact CD1-CD1 4.15Å; L115-I202 HydrophobicContact CD2-CD1 4.2Å; L115-I202 HydrophobicContact CD2-CG1 4.26Å; L115-I202 HydrophobicContact CD2-CG2 3.75Å; A140-I202 HydrophobicContact CB-CG1 4.39Å; A140-I202 WeakPolarHBondContact O-CA 3.48Å; L142-I202 HydrophobicContact CB-CG2 3.82Å; M197-I202 HydrophobicContact SD-CD1 4.01Å; W200-I202 HydrophobicContact CB-CG1 4.31Å; W200-I202 PolarHBondContact O-N 2.98Å; I202-I232 HydrophobicContact CD1-CB 4.32Å; I202-I232 HydrophobicContact CD1-CD1 4.37Å; I202-I232 HydrophobicContact CG2-CD1 4.44Å; I202-P233 WeakPolarHBondContact CB-O 3.45Å; I202-P233 HydrophobicContact CD1-CG 4.4Å; I202-I234 HydrophobicContact CB-CD1 4.47Å; I202-I234 HydrophobicContact CG2-CD1 3.92Å; I202-Y235 WeakPolarHBondContact O-CB 3.33Å; I202-Y235 PolarHBondContact O-N 3.15Å
203	F	90.4	Very high	79.3	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	138.3	175.7	-61.5	-100.2	0	0	0	109.4	K126 I127 T130 T131 T139 A140 I141 L142 F201 Y235 R236	K126-F203 HydrophobicContact CG-CD1 4.07Å; I127-F203 HydrophobicContact CG1-CD1 4.35Å; I127-F203 HydrophobicContact CG1-CD2 3.84Å; I127-F203 HydrophobicContact CG1-CE1 4.44Å; I127-F203 HydrophobicContact CG1-CE2 3.94Å; I127-F203 HydrophobicContact CG1-CG 4.09Å; I127-F203 HydrophobicContact CG1-CZ 4.26Å; I127-F203 HydrophobicContact CG2-CE2 4.5Å; T130-F203 HydrophobicContact CG2-CE1 4.32Å; T131-F203 HydrophobicContact CG2-CE2 4.25Å; T131-F203 HydrophobicContact CG2-CZ 3.67Å; T139-F203 HydrophobicContact CG2-CE2 4.2Å; A140-F203 PolarHBondContact O-N 3.32Å; I141-F203 CarbonylContact C-O 3.58Å; I141-F203 VanDerWaalsContact CA-O 3.25Å; I141-F203 WeakPolarHBondContact CA-O 3.44Å; I141-F203 HydrophobicContact CD1-CB 3.8Å; L142-F203 PolarHBondContact N-O 3.18Å; F201-F203 HydrophobicContact CB-CE2 3.79Å; F201-F203 HydrophobicContact CB-CZ 4.41Å; F201-F203 VanDerWaalsContact O-CD2 3.27Å; F201-F203 WeakPolarHBondContact O-CD2 3.1Å; F201-F203 WeakPolarHBondContact O-CE2 3Å; F203-Y235 AromaticContact CE1-CD1 3.97Å; F203-Y235 HydrophobicContact CE1-CD1 3.97Å; F203-Y235 HydrophobicContact CE2-CD1 4.21Å; F203-Y235 AromaticContact CZ-CD1 3.51Å; F203-Y235 HydrophobicContact CZ-CD1 3.51Å; F203-Y235 HydrophobicContact CZ-CE1 4.1Å; F203-Y235 HydrophobicContact CZ-CG 4.38Å; F203-R236 HydrophobicContact CD1-CB 3.6Å; F203-R236 HydrophobicContact CD1-CG 4.12Å; F203-R236 HydrophobicContact CE1-CB 3.63Å; F203-R236 HydrophobicContact CE1-CG 4.31Å
204	T	91.5	Very high	80.9	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	138.6	170.4	45.8	0	0	0	0	111.4	K126 F208 L237 D241	K126-T204 PolarHBondContact NZ-O 3.33Å; K126-T204 PolarHBondContact NZ-OG1 3.15Å; T204-F208 HydrophobicContact CG2-CD1 4.49Å; T204-L237 HydrophobicContact CG2-CD2 4.21Å; T204-D241 PolarHBondContact OG1-OD1 2.62Å; T204-D241 PolarHBondContact OG1-OD2 3.01Å
205	S	90.8	Very high	82.5	Confident	3 Å²	3	35.4 Å²	35.4	2%	0.021	20%	0.199	C	C	.	.			trans	-73.3	154.7	168.9	-170.7	0	0	0	0	111.3	R116 E123 L142 D143 Q207 F208	R116-S205 PolarHBondContact NH2-OG 2.88Å; R116-S205 VanDerWaalsContact NH2-OG 3.09Å; E123-S205 PolarHBondContact OE1-OG 3.39Å; E123-S205 VanDerWaalsContact OE1-OG 3.12Å; L142-S205 WeakPolarHBondContact O-CB 3.37Å; L142-S205 PolarHBondContact O-N 3.2Å; D143-S205 WeakPolarHBondContact OD1-CB 3.32Å; S205-Q207 PolarHBondContact O-N 2.84Å; S205-Q207 VanDerWaalsContact O-N 3.16Å; S205-Q207 PolarHBondContact OG-N 2.75Å; S205-F208 WeakPolarHBondContact O-CB 3.39Å; S205-F208 PolarHBondContact O-N 3.5Å; S205-F208 VanDerWaalsContact O-N 3.09Å
206	N	85.6	Confident	84	Confident	71 Å²	71	30.9 Å²	30.9	38%	0.38	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-17.8	172.8	-63.2	-14.6	0	0	0	113.1	Q122	Q122-N206 PolarHBondContact OE1-ND2 2.87Å
207	Q	85.3	Confident	85.3	Confident	104 Å²	104	30.5 Å²	30.5	49%	0.486	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-6.6	177.4	-62.8	-176.3	33.2	0	0	113.3	S205 S209 S210 S211	S205-Q207 PolarHBondContact O-N 2.84Å; S205-Q207 VanDerWaalsContact O-N 3.16Å; S205-Q207 PolarHBondContact OG-N 2.75Å; Q207-S209 PolarHBondContact O-N 3.12Å; Q207-S210 PolarHBondContact O-N 3.09Å; Q207-S210 VanDerWaalsContact O-N 3.15Å; Q207-S211 PolarHBondContact O-N 2.83Å; Q207-S211 PolarHBondContact O-OG 3.09Å
208	F	90.9	Very high	86.2	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-50.4	-56.3	-173.3	170.3	-100.2	0	0	0	112.7	L142 C144 I188 T204 S205 I212 F230 F242	L142-F208 HydrophobicContact CD2-CD2 4.07Å; L142-F208 HydrophobicContact CD2-CE2 3.78Å; L142-F208 HydrophobicContact CG-CD2 4.26Å; L142-F208 HydrophobicContact CG-CE2 4.32Å; C144-F208 WeakPolarHBondContact SG-CD2 3.19Å; C144-F208 WeakPolarHBondContact SG-CE2 3.49Å; I188-F208 HydrophobicContact CD1-CE2 3.63Å; I188-F208 HydrophobicContact CD1-CZ 3.65Å; T204-F208 HydrophobicContact CG2-CD1 4.49Å; S205-F208 WeakPolarHBondContact O-CB 3.39Å; S205-F208 PolarHBondContact O-N 3.5Å; S205-F208 VanDerWaalsContact O-N 3.09Å; F208-I212 HydrophobicContact CD1-CD1 4.45Å; F208-I212 HydrophobicContact CD2-CD1 4.2Å; F208-I212 HydrophobicContact CE1-CD1 3.89Å; F208-I212 HydrophobicContact CE2-CD1 3.61Å; F208-I212 HydrophobicContact CZ-CD1 3.4Å; F208-I212 VanDerWaalsContact CZ-CD1 3.4Å; F208-I212 WeakPolarHBondContact O-CG1 3.36Å; F208-I212 PolarHBondContact O-N 3.16Å; F208-F230 HydrophobicContact CE1-CE1 4.36Å; F208-F230 AromaticContact CE1-CZ 3.8Å; F208-F230 HydrophobicContact CE1-CZ 3.8Å; F208-F230 HydrophobicContact CE2-CE1 4.17Å; F208-F230 HydrophobicContact CE2-CZ 4.39Å; F208-F230 AromaticContact CZ-CE1 3.64Å; F208-F230 HydrophobicContact CZ-CE1 3.64Å; F208-F230 AromaticContact CZ-CZ 3.44Å; F208-F230 HydrophobicContact CZ-CZ 3.44Å; F208-F230 VanDerWaalsContact CZ-CZ 3.44Å; F208-F242 HydrophobicContact CE1-CE1 4.2Å
209	S	91.9	Very high	86.9	Confident	8 Å²	8	35 Å²	35	6%	0.056	18%	0.181	C	C	.	.	H	α-helix	trans	-72.1	-33.4	-179	52.6	0	0	0	0	113.3	Q207 Y213 D241	Q207-S209 PolarHBondContact O-N 3.12Å; S209-Y213 WeakPolarHBondContact O-CB 3.47Å; S209-Y213 PolarHBondContact O-N 2.82Å; S209-D241 VanDerWaalsContact CB-O 3.24Å; S209-D241 WeakPolarHBondContact CB-O 3.4Å
210	S	90.6	Very high	86.9	Confident	43 Å²	43	31.3 Å²	31.3	30%	0.301	17%	0.165	S	C	.	.	H	α-helix	trans	-63.7	-46.5	177.6	-59.4	0	0	0	0	111.7	Q207 I212 Y213 D214	Q207-S210 PolarHBondContact O-N 3.09Å; Q207-S210 VanDerWaalsContact O-N 3.15Å; S210-I212 VanDerWaalsContact C-N 3.35Å; S210-I212 PolarHBondContact O-N 2.92Å; S210-Y213 WeakPolarHBondContact O-CB 3.45Å; S210-Y213 PolarHBondContact O-N 2.71Å; S210-D214 WeakPolarHBondContact O-CB 3.48Å; S210-D214 PolarHBondContact O-N 2.68Å
211	S	87.9	Confident	86.4	Confident	18 Å²	18	35.9 Å²	35.9	13%	0.126	19%	0.187	C	C	.	.	H	α-helix	trans	-63.5	-40.1	179.7	-62.7	0	0	0	0	112.7	C144 Q207 A215	C144-S211 WeakPolarHBondContact O-CB 3.23Å; C144-S211 PolarHBondContact O-OG 2.95Å; Q207-S211 PolarHBondContact O-N 2.83Å; Q207-S211 PolarHBondContact O-OG 3.09Å; S211-A215 WeakPolarHBondContact O-CB 3.12Å; S211-A215 PolarHBondContact O-N 3.22Å; S211-A215 VanDerWaalsContact O-N 3.14Å
212	I	90.6	Very high	85.3	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-67.3	-44.1	175.5	-65.3	167.1	0	0	0	110.1	F111 C144 L186 I188 F208 S210 D214 A215 I216 L245	F111-I212 HydrophobicContact CD2-CG1 4.24Å; F111-I212 HydrophobicContact CE1-CG2 4.35Å; F111-I212 HydrophobicContact CE2-CG1 4.04Å; F111-I212 HydrophobicContact CZ-CG1 4.27Å; F111-I212 HydrophobicContact CZ-CG2 4.31Å; C144-I212 HydrophobicContact CB-CG1 4.3Å; L186-I212 HydrophobicContact CD2-CD1 3.82Å; L186-I212 HydrophobicContact CD2-CG1 4.36Å; L186-I212 HydrophobicContact CD2-CG2 3.98Å; I188-I212 HydrophobicContact CD1-CD1 4.43Å; F208-I212 HydrophobicContact CD1-CD1 4.45Å; F208-I212 HydrophobicContact CD2-CD1 4.2Å; F208-I212 HydrophobicContact CE1-CD1 3.89Å; F208-I212 HydrophobicContact CE2-CD1 3.61Å; F208-I212 HydrophobicContact CZ-CD1 3.4Å; F208-I212 VanDerWaalsContact CZ-CD1 3.4Å; F208-I212 WeakPolarHBondContact O-CG1 3.36Å; F208-I212 PolarHBondContact O-N 3.16Å; S210-I212 VanDerWaalsContact C-N 3.35Å; S210-I212 PolarHBondContact O-N 2.92Å; I212-D214 PolarHBondContact O-N 3.32Å; I212-A215 PolarHBondContact O-N 2.84Å; I212-I216 HydrophobicContact CG2-CD1 3.76Å; I212-I216 HydrophobicContact CG2-CG1 4.37Å; I212-I216 WeakPolarHBondContact O-CG1 3.24Å; I212-I216 PolarHBondContact O-N 3.47Å; I212-L245 HydrophobicContact CB-CD1 4.49Å; I212-L245 HydrophobicContact CB-CD2 4.2Å; I212-L245 HydrophobicContact CG2-CD1 4.24Å; I212-L245 HydrophobicContact CG2-CD2 3.87Å
213	Y	91.9	Very high	84.4	Confident	33 Å²	33	40.5 Å²	40.5	13%	0.129	22%	0.219	C	C	.	.	H	α-helix	trans	-57.6	-50	178.2	178	-89.9	0	0	0	111.6	S209 S210 A215 I216 Q217 R244 W248	S209-Y213 WeakPolarHBondContact O-CB 3.47Å; S209-Y213 PolarHBondContact O-N 2.82Å; S210-Y213 WeakPolarHBondContact O-CB 3.45Å; S210-Y213 PolarHBondContact O-N 2.71Å; Y213-A215 VanDerWaalsContact C-N 3.3Å; Y213-A215 PolarHBondContact O-N 3.2Å; Y213-I216 PolarHBondContact O-N 3Å; Y213-Q217 HydrophobicContact CD1-CG 4.17Å; Y213-Q217 HydrophobicContact CE1-CG 3.87Å; Y213-Q217 WeakPolarHBondContact O-CG 3.31Å; Y213-Q217 PolarHBondContact O-N 2.82Å; Y213-Q217 PolarHBondContact OH-NE2 2.66Å; Y213-R244 HydrophobicContact CD1-CG 4.13Å; Y213-R244 HydrophobicContact CD2-CG 3.84Å; Y213-R244 WeakPolarHBondContact CD2-O 3.42Å; Y213-R244 HydrophobicContact CE2-CG 4.43Å; Y213-R244 VanDerWaalsContact CE2-O 3.31Å; Y213-R244 WeakPolarHBondContact CE2-O 2.89Å; Y213-R244 HydrophobicContact CG-CG 3.64Å; Y213-W248 HydrophobicContact CD2-CE3 4.4Å; Y213-W248 AromaticContact CD2-CH2 3.82Å; Y213-W248 HydrophobicContact CD2-CH2 3.82Å; Y213-W248 AromaticContact CD2-CZ3 3.42Å; Y213-W248 HydrophobicContact CD2-CZ3 3.42Å; Y213-W248 VanDerWaalsContact CD2-CZ3 3.42Å; Y213-W248 AromaticContact CE2-CH2 3.59Å; Y213-W248 HydrophobicContact CE2-CH2 3.59Å; Y213-W248 AromaticContact CE2-CZ3 3.64Å; Y213-W248 HydrophobicContact CE2-CZ3 3.64Å; Y213-W248 HydrophobicContact CG-CZ3 4.27Å
214	D	89.2	Confident	83.7	Confident	82 Å²	82	43.3 Å²	43.3	44%	0.439	24%	0.236	S	C	.	.	H	α-helix	trans	-63.6	-38.5	-178.8	-65.8	-19.7	0	0	0	111	S210 I212 Q217 A218	S210-D214 WeakPolarHBondContact O-CB 3.48Å; S210-D214 PolarHBondContact O-N 2.68Å; I212-D214 PolarHBondContact O-N 3.32Å; D214-Q217 PolarHBondContact O-N 2.87Å; D214-A218 VanDerWaalsContact O-CB 3.27Å; D214-A218 WeakPolarHBondContact O-CB 3.03Å; D214-A218 PolarHBondContact O-N 2.91Å
215	A	87	Confident	83.6	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.008	25%	0.248	C	C	.	.	H	α-helix	trans	-67.2	-42.1	176.1	0	0	0	0	0	112.8	F111 S211 I212 Y213 A218 Y219	F111-A215 HydrophobicContact CB-CB 3.96Å; F111-A215 HydrophobicContact CD1-CB 3.57Å; F111-A215 HydrophobicContact CG-CB 4.2Å; S211-A215 WeakPolarHBondContact O-CB 3.12Å; S211-A215 PolarHBondContact O-N 3.22Å; S211-A215 VanDerWaalsContact O-N 3.14Å; I212-A215 PolarHBondContact O-N 2.84Å; Y213-A215 VanDerWaalsContact C-N 3.3Å; Y213-A215 PolarHBondContact O-N 3.2Å; A215-A218 PolarHBondContact O-N 2.77Å; A215-Y219 WeakPolarHBondContact O-CD2 3.47Å; A215-Y219 PolarHBondContact O-N 3.05Å
216	I	87	Confident	83.7	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.005	25%	0.247	C	C	.	.	I	π-helix	trans	-61.9	-46.1	174.6	-69.3	169.4	0	0	0	110.1	L184 I212 Y213 A218 I220 Q221 T223 L226 W248	L184-I216 HydrophobicContact CD2-CD1 4.12Å; L184-I216 HydrophobicContact CD2-CG1 4.03Å; I212-I216 HydrophobicContact CG2-CD1 3.76Å; I212-I216 HydrophobicContact CG2-CG1 4.37Å; I212-I216 WeakPolarHBondContact O-CG1 3.24Å; I212-I216 PolarHBondContact O-N 3.47Å; Y213-I216 PolarHBondContact O-N 3Å; I216-A218 VanDerWaalsContact C-N 3.35Å; I216-A218 PolarHBondContact O-N 3.21Å; I216-I220 HydrophobicContact CG1-CD1 4.2Å; I216-I220 HydrophobicContact CG2-CB 4.49Å; I216-I220 PolarHBondContact O-N 2.72Å; I216-Q221 PolarHBondContact O-N 2.64Å; I216-T223 WeakPolarHBondContact CG2-OG1 3.42Å; I216-L226 HydrophobicContact CD1-CD1 4.09Å; I216-L226 HydrophobicContact CD1-CD2 3.88Å; I216-W248 HydrophobicContact CB-CZ3 4.25Å; I216-W248 HydrophobicContact CG2-CE3 4.04Å; I216-W248 HydrophobicContact CG2-CH2 4.18Å; I216-W248 HydrophobicContact CG2-CZ3 3.83Å
217	Q	87.4	Confident	84	Confident	75 Å²	75	43.9 Å²	43.9	35%	0.35	24%	0.236	S	C	.	.	I	π-helix	trans	-61.8	-41.3	178.7	-76.1	-152.9	-27.4	0	0	112.8	Y213 D214 Q221 W248	Y213-Q217 HydrophobicContact CD1-CG 4.17Å; Y213-Q217 HydrophobicContact CE1-CG 3.87Å; Y213-Q217 WeakPolarHBondContact O-CG 3.31Å; Y213-Q217 PolarHBondContact O-N 2.82Å; Y213-Q217 PolarHBondContact OH-NE2 2.66Å; D214-Q217 PolarHBondContact O-N 2.87Å; Q217-Q221 WeakPolarHBondContact O-CG 3.17Å; Q217-Q221 PolarHBondContact O-NE2 2.88Å; Q217-W248 HydrophobicContact CG-CH2 3.58Å; Q217-W248 HydrophobicContact CG-CZ2 4.35Å; Q217-W248 HydrophobicContact CG-CZ3 4.5Å
218	A	84.1	Confident	84.4	Confident	64 Å²	64	39 Å²	39	53%	0.529	21%	0.213	S	C	.	.	I	π-helix	trans	-76	-36.5	-176.4	0	0	0	0	0	112.8	D214 A215 I216	D214-A218 VanDerWaalsContact O-CB 3.27Å; D214-A218 WeakPolarHBondContact O-CB 3.03Å; D214-A218 PolarHBondContact O-N 2.91Å; A215-A218 PolarHBondContact O-N 2.77Å; I216-A218 VanDerWaalsContact C-N 3.35Å; I216-A218 PolarHBondContact O-N 3.21Å
219	Y	79.7	Confident	84.4	Confident	97 Å²	97	39.7 Å²	39.7	38%	0.38	22%	0.218	S	C	.	.	I	π-helix	trans	-126.7	-20.7	-162.8	-54.3	-66.7	0	0	0	115.8	H110 A215	H110-Y219 HydrophobicContact CB-CD2 3.41Å; H110-Y219 VanDerWaalsContact CB-CD2 3.41Å; H110-Y219 HydrophobicContact CB-CE2 3.97Å; H110-Y219 HydrophobicContact CB-CG 3.84Å; H110-Y219 AromaticContact CG-CD2 3.91Å; H110-Y219 AromaticContact CG-CG 3.79Å; A215-Y219 WeakPolarHBondContact O-CD2 3.47Å; A215-Y219 PolarHBondContact O-N 3.05Å
220	I	72.3	Confident	84.3	Confident	12 Å²	12	39.3 Å²	39.3	6%	0.062	22%	0.215	C	C	.	.	I	π-helix	trans	-113.4	-2.2	-166.9	-42.6	-178.3	0	0	0	112.5	I107 L184 I216 T223	I107-I220 HydrophobicContact CD1-CG2 3.91Å; L184-I220 HydrophobicContact CD1-CG2 4.26Å; L184-I220 HydrophobicContact CD2-CD1 3.99Å; L184-I220 HydrophobicContact CD2-CG2 3.98Å; I216-I220 HydrophobicContact CG1-CD1 4.2Å; I216-I220 HydrophobicContact CG2-CB 4.49Å; I216-I220 PolarHBondContact O-N 2.72Å; I220-T223 HydrophobicContact CB-CG2 4.47Å; I220-T223 HydrophobicContact CG2-CG2 3.73Å
221	Q	67.5	Low	83.9	Confident	124 Å²	124	39.2 Å²	39.2	58%	0.579	21%	0.213	S	C	*	.			trans	-59.7	144.5	-178.7	-68.3	-165.2	32.2	0	0	114.1	I216 Q217	I216-Q221 PolarHBondContact O-N 2.64Å; Q217-Q221 WeakPolarHBondContact O-CG 3.17Å; Q217-Q221 PolarHBondContact O-NE2 2.88Å
222	P	62.4	Low	83.6	Confident	107 Å²	107	38.4 Å²	38.4	70%	0.695	21%	0.207	S	C	*	.			cis	-94.9	114.3	-4.8	33	-28.4	0	0	0	112.2
223	T	67.7	Low	83.1	Confident	7 Å²	7	38.9 Å²	38.9	4%	0.043	21%	0.21	C	C	.	.			trans	-92.2	129.4	163.8	49.7	0	0	0	0	109.3	L184 I216 I220 W248	L184-T223 HydrophobicContact CB-CG2 3.72Å; L184-T223 HydrophobicContact CD2-CG2 4.17Å; I216-T223 WeakPolarHBondContact CG2-OG1 3.42Å; I220-T223 HydrophobicContact CB-CG2 4.47Å; I220-T223 HydrophobicContact CG2-CG2 3.73Å; T223-W248 PolarHBondContact O-NE1 3.35Å
224	T	77.3	Confident	82.9	Confident	60 Å²	60	37.3 Å²	37.3	37%	0.368	20%	0.204	S	C	.	.	S	Bend	trans	-88.8	-38.2	173.6	57.9	0	0	0	0	111.1	R182	R182-T224 WeakPolarHBondContact CB-OG1 3.47Å; R182-T224 HydrophobicContact CG-CG2 4.3Å; R182-T224 PolarHBondContact O-N 2.78Å; R182-T224 PolarHBondContact O-OG1 3.17Å; R182-T224 VanDerWaalsContact O-OG1 3.05Å
225	D	89	Confident	82.8	Confident	46 Å²	46	33.9 Å²	33.9	25%	0.246	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	131.8	-172.2	-54.1	-56.1	0	0	0	110.9	R182 L183 L184 Y227 W248 R250	R182-D225 PolarHBondContact O-N 2.73Å; L183-D225 WeakPolarHBondContact CA-O 3.47Å; L184-D225 PolarHBondContact N-O 3.31Å; D225-Y227 HydrophobicContact CB-CE1 4.33Å; D225-W248 CarbonylContact C-O 3.58Å; D225-W248 WeakPolarHBondContact CA-O 3.41Å; D225-R250 HydrophobicContact CB-CG 3.87Å; D225-R250 VanDerWaalsContact OD1-CG 3.29Å; D225-R250 WeakPolarHBondContact OD1-CG 3.17Å; D225-R250 IonicContact OD1-NE 2.84Å; D225-R250 PolarHBondContact OD1-NE 3.33Å
226	L	91.7	Very high	82.9	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	125.9	179	175.6	66	0	0	0	109.5	L184 L186 I216 I228 L245 W248 L249 R250 Y251	L184-L226 HydrophobicContact CB-CD1 4.33Å; L184-L226 HydrophobicContact CD2-CD1 3.98Å; L184-L226 HydrophobicContact CG-CD1 4.15Å; L184-L226 CarbonylContact O-C 3.52Å; L184-L226 WeakPolarHBondContact O-CA 3.35Å; L186-L226 HydrophobicContact CB-CD1 4.36Å; I216-L226 HydrophobicContact CD1-CD1 4.09Å; I216-L226 HydrophobicContact CD1-CD2 3.88Å; L226-I228 HydrophobicContact CD1-CG1 4.33Å; L226-I228 HydrophobicContact CD2-CD1 3.96Å; L226-I228 HydrophobicContact CD2-CG1 4.18Å; L226-I228 HydrophobicContact CG-CD1 4.3Å; L226-I228 HydrophobicContact CG-CG1 3.96Å; L226-L245 HydrophobicContact CD2-CB 4.1Å; L226-L245 HydrophobicContact CD2-CD1 4.2Å; L226-L245 HydrophobicContact CD2-CD2 4.11Å; L226-L245 HydrophobicContact CD2-CG 4.36Å; L226-W248 HydrophobicContact CB-CB 3.82Å; L226-W248 PolarHBondContact N-O 2.8Å; L226-L249 HydrophobicContact CD2-CD1 4.35Å; L226-L249 HydrophobicContact CG-CD1 4.25Å; L226-R250 PolarHBondContact O-N 2.98Å; L226-Y251 PolarHBondContact O-N 3.24Å
227	Y	93.3	Very high	83.1	Confident	40 Å²	40	34.9 Å²	34.9	16%	0.157	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	128	177	-76.2	30.9	0	0	0	107.2	L183 L184 H185 L186 D225 R250 Y251	L183-Y227 HydrophobicContact CD1-CD1 4.01Å; L183-Y227 HydrophobicContact CD1-CD2 4.16Å; L183-Y227 HydrophobicContact CD1-CE1 3.69Å; L183-Y227 HydrophobicContact CD1-CE2 3.84Å; L183-Y227 HydrophobicContact CD1-CG 4.27Å; L183-Y227 HydrophobicContact CD2-CG 4.48Å; L183-Y227 HydrophobicContact CG-CD1 4.17Å; L183-Y227 HydrophobicContact CG-CE1 4.3Å; L183-Y227 HydrophobicContact CG-CG 4.41Å; L184-Y227 PolarHBondContact O-N 2.75Å; H185-Y227 CarbonylContact C-O 3.57Å; H185-Y227 WeakPolarHBondContact CA-O 3.49Å; H185-Y227 PolarHBondContact CD2-O 2.84Å; L186-Y227 PolarHBondContact N-O 2.96Å; D225-Y227 HydrophobicContact CB-CE1 4.33Å; Y227-R250 HydrophobicContact CD1-CB 4.31Å; Y227-R250 HydrophobicContact CE1-CB 3.81Å; Y227-Y251 HydrophobicContact CD2-CD1 4.14Å; Y227-Y251 HydrophobicContact CD2-CD2 4.22Å; Y227-Y251 AromaticContact CD2-CG 3.74Å; Y227-Y251 HydrophobicContact CD2-CG 3.74Å; Y227-Y251 HydrophobicContact CE2-CD2 4.24Å; Y227-Y251 HydrophobicContact CE2-CG 4.13Å; Y227-Y251 HydrophobicContact CG-CD1 4.28Å; Y227-Y251 AromaticContact CG-CG 3.99Å; Y227-Y251 HydrophobicContact CG-CG 3.99Å
228	I	92.4	Very high	83.2	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	133.9	179.8	-56.3	178.6	0	0	0	109.3	L186 L226 F230 F242 L245 L249 Y251 I252 S253	L186-I228 HydrophobicContact CB-CG1 4.46Å; L186-I228 CarbonylContact O-C 3.46Å; L186-I228 WeakPolarHBondContact O-CA 3.37Å; L226-I228 HydrophobicContact CD1-CG1 4.33Å; L226-I228 HydrophobicContact CD2-CD1 3.96Å; L226-I228 HydrophobicContact CD2-CG1 4.18Å; L226-I228 HydrophobicContact CG-CD1 4.3Å; L226-I228 HydrophobicContact CG-CG1 3.96Å; I228-F230 HydrophobicContact CG2-CD2 4.01Å; I228-F230 HydrophobicContact CG2-CE2 3.45Å; I228-F230 VanDerWaalsContact CG2-CE2 3.45Å; I228-F230 HydrophobicContact CG2-CZ 3.89Å; I228-F242 HydrophobicContact CD1-CD1 4.43Å; I228-L245 HydrophobicContact CD1-CD1 3.56Å; I228-L249 HydrophobicContact CB-CD1 4.37Å; I228-L249 HydrophobicContact CD1-CD1 3.59Å; I228-L249 HydrophobicContact CD1-CD2 4.48Å; I228-L249 HydrophobicContact CG1-CD1 3.7Å; I228-Y251 PolarHBondContact N-O 3.35Å; I228-I252 CarbonylContact O-C 3.49Å; I228-I252 WeakPolarHBondContact O-CA 3.47Å; I228-S253 PolarHBondContact O-N 3.13Å
229	T	91.2	Very high	83.3	Confident	16 Å²	16	31.6 Å²	31.6	10%	0.098	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	121.4	173.7	-59.6	0	0	0	0	110.3	H185 L186 I188 T231 S253	H185-T229 PolarHBondContact NE2-OG1 2.86Å; L186-T229 PolarHBondContact O-N 3.21Å; I188-T229 PolarHBondContact N-O 2.79Å; T229-T231 HydrophobicContact CG2-CG2 4.12Å; T229-S253 CarbonylContact C-O 3.52Å; T229-S253 WeakPolarHBondContact CA-O 3.24Å
230	F	89.4	Confident	83.6	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	115.8	168.8	-63.6	-87.8	0	0	0	108.7	L142 I188 F208 I228 I232 I234 F242 S253 I254 D255	L142-F230 HydrophobicContact CD2-CD1 4.43Å; L142-F230 HydrophobicContact CD2-CE1 3.94Å; I188-F230 HydrophobicContact CB-CD1 4.14Å; I188-F230 HydrophobicContact CB-CE1 4.38Å; I188-F230 HydrophobicContact CD1-CD1 4.43Å; I188-F230 HydrophobicContact CD1-CE1 3.82Å; I188-F230 HydrophobicContact CD1-CZ 4.38Å; I188-F230 HydrophobicContact CG2-CD1 4.41Å; F208-F230 HydrophobicContact CE1-CE1 4.36Å; F208-F230 AromaticContact CE1-CZ 3.8Å; F208-F230 HydrophobicContact CE1-CZ 3.8Å; F208-F230 HydrophobicContact CE2-CE1 4.17Å; F208-F230 HydrophobicContact CE2-CZ 4.39Å; F208-F230 AromaticContact CZ-CE1 3.64Å; F208-F230 HydrophobicContact CZ-CE1 3.64Å; F208-F230 AromaticContact CZ-CZ 3.44Å; F208-F230 HydrophobicContact CZ-CZ 3.44Å; F208-F230 VanDerWaalsContact CZ-CZ 3.44Å; I228-F230 HydrophobicContact CG2-CD2 4.01Å; I228-F230 HydrophobicContact CG2-CE2 3.45Å; I228-F230 VanDerWaalsContact CG2-CE2 3.45Å; I228-F230 HydrophobicContact CG2-CZ 3.89Å; F230-I232 HydrophobicContact CD1-CG1 4.39Å; F230-I234 HydrophobicContact CB-CG1 4.32Å; F230-I234 HydrophobicContact CD1-CD1 4.17Å; F230-I234 HydrophobicContact CD1-CG1 4.17Å; F230-I234 HydrophobicContact CG-CG1 4.3Å; F230-F242 HydrophobicContact CD2-CZ 4.5Å; F230-F242 AromaticContact CE2-CE1 3.53Å; F230-F242 HydrophobicContact CE2-CE1 3.53Å; F230-F242 AromaticContact CE2-CZ 3.53Å; F230-F242 HydrophobicContact CE2-CZ 3.53Å; F230-F242 AromaticContact CZ-CE1 3.76Å; F230-F242 HydrophobicContact CZ-CE1 3.76Å; F230-F242 HydrophobicContact CZ-CZ 4Å; F230-S253 PolarHBondContact N-O 3.01Å; F230-I254 HydrophobicContact CB-CG2 4.41Å; F230-I254 HydrophobicContact CD2-CG1 4.21Å; F230-D255 PolarHBondContact O-N 3.46Å
231	T	82.7	Confident	84.5	Confident	41 Å²	41	32 Å²	32	25%	0.252	17%	0.169	S	C	.	.			trans	-98.1	-5	169.4	56.7	0	0	0	0	111.7	I187 I188 G189 T229	I187-T231 HydrophobicContact CG2-CG2 4.49Å; I188-T231 PolarHBondContact O-N 2.74Å; I188-T231 PolarHBondContact O-OG1 3.34Å; G189-T231 WeakPolarHBondContact CA-OG1 3.25Å; T229-T231 HydrophobicContact CG2-CG2 4.12Å
232	I	82.2	Confident	85.7	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.142	C	C	.	.	S	Bend	trans	-86.1	145.9	171.5	65.1	177.6	0	0	0	110.6	L142 I171 I188 T190 I202 F230 I234	L142-I232 HydrophobicContact CD1-CD1 3.91Å; L142-I232 HydrophobicContact CD2-CD1 3.86Å; L142-I232 HydrophobicContact CG-CD1 4.41Å; I171-I232 HydrophobicContact CD1-CD1 4.25Å; I171-I232 HydrophobicContact CD1-CG2 3.99Å; I188-I232 HydrophobicContact CG2-CD1 4.04Å; T190-I232 HydrophobicContact CG2-CG2 3.74Å; I202-I232 HydrophobicContact CD1-CB 4.32Å; I202-I232 HydrophobicContact CD1-CD1 4.37Å; I202-I232 HydrophobicContact CG2-CD1 4.44Å; F230-I232 HydrophobicContact CD1-CG1 4.39Å; I232-I234 HydrophobicContact CD1-CD1 3.75Å; I232-I234 HydrophobicContact CG1-CD1 3.69Å; I232-I234 HydrophobicContact CG1-CG1 4.3Å; I232-I234 PolarHBondContact O-N 3.19Å
233	P	80	Confident	86.9	Confident	11 Å²	11	22.8 Å²	22.8	7%	0.071	12%	0.118	C	C	.	.			trans	-71.1	104.2	177.8	27.3	-32.9	0	0	0	110.7	I202 Q258	I202-P233 WeakPolarHBondContact CB-O 3.45Å; I202-P233 HydrophobicContact CD1-CG 4.4Å; P233-Q258 HydrophobicContact CB-CB 3.71Å; P233-Q258 HydrophobicContact CB-CG 3.78Å; P233-Q258 VanDerWaalsContact CB-NE2 3.34Å
234	I	87.6	Confident	88	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	125.2	174.5	-56.2	-63.2	0	0	0	109.5	L142 I202 F230 I232 R236 L237	L142-I234 HydrophobicContact CD2-CD1 4.15Å; I202-I234 HydrophobicContact CB-CD1 4.47Å; I202-I234 HydrophobicContact CG2-CD1 3.92Å; F230-I234 HydrophobicContact CB-CG1 4.32Å; F230-I234 HydrophobicContact CD1-CD1 4.17Å; F230-I234 HydrophobicContact CD1-CG1 4.17Å; F230-I234 HydrophobicContact CG-CG1 4.3Å; I232-I234 HydrophobicContact CD1-CD1 3.75Å; I232-I234 HydrophobicContact CG1-CD1 3.69Å; I232-I234 HydrophobicContact CG1-CG1 4.3Å; I232-I234 PolarHBondContact O-N 3.19Å; I234-R236 WeakPolarHBondContact CG2-O 3.47Å; I234-L237 HydrophobicContact CG2-CD1 4.42Å; I234-L237 HydrophobicContact CG2-CD2 3.73Å; I234-L237 HydrophobicContact CG2-CG 3.72Å
235	Y	87.4	Confident	88.6	Confident	9 Å²	9	25.7 Å²	25.7	4%	0.035	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	-36.8	-177.1	-167.7	-98.8	0	0	0	112.6	T130 T131 L134 F201 I202 F203 R260 Y261	T130-Y235 HydrophobicContact CG2-CD1 4.01Å; T130-Y235 HydrophobicContact CG2-CE1 3.61Å; T131-Y235 HydrophobicContact CG2-CE1 4.01Å; L134-Y235 WeakPolarHBondContact CD1-OH 3.49Å; F201-Y235 HydrophobicContact CB-CD1 4.12Å; F201-Y235 HydrophobicContact CB-CD2 3.87Å; F201-Y235 HydrophobicContact CB-CE2 4.31Å; F201-Y235 HydrophobicContact CB-CG 3.74Å; F201-Y235 AromaticContact CD1-CD2 3.37Å; F201-Y235 HydrophobicContact CD1-CD2 3.37Å; F201-Y235 AromaticContact CD1-CE2 3.42Å; F201-Y235 HydrophobicContact CD1-CE2 3.42Å; F201-Y235 VanDerWaalsContact CD1-CE2 3.42Å; F201-Y235 HydrophobicContact CD1-CG 4.17Å; F201-Y235 HydrophobicContact CD2-CD1 4.46Å; F201-Y235 HydrophobicContact CD2-CD2 4.1Å; F201-Y235 HydrophobicContact CD2-CE1 4.09Å; F201-Y235 AromaticContact CD2-CE2 3.67Å; F201-Y235 HydrophobicContact CD2-CE2 3.67Å; F201-Y235 HydrophobicContact CD2-CG 4.46Å; F201-Y235 AromaticContact CD2-CZ 3.68Å; F201-Y235 AromaticContact CE1-CD2 3.86Å; F201-Y235 HydrophobicContact CE1-CD2 3.86Å; F201-Y235 AromaticContact CE1-CE2 3.45Å; F201-Y235 HydrophobicContact CE1-CE2 3.45Å; F201-Y235 VanDerWaalsContact CE1-CE2 3.45Å; F201-Y235 HydrophobicContact CE2-CD2 4.48Å; F201-Y235 HydrophobicContact CE2-CE1 4.48Å; F201-Y235 AromaticContact CE2-CE2 3.67Å; F201-Y235 HydrophobicContact CE2-CE2 3.67Å; F201-Y235 AromaticContact CE2-CZ 3.68Å; F201-Y235 HydrophobicContact CG-CD1 4.29Å; F201-Y235 AromaticContact CG-CD2 3.51Å; F201-Y235 HydrophobicContact CG-CD2 3.51Å; F201-Y235 HydrophobicContact CG-CE1 4.33Å; F201-Y235 AromaticContact CG-CE2 3.54Å; F201-Y235 HydrophobicContact CG-CE2 3.54Å; F201-Y235 AromaticContact CG-CG 3.9Å; F201-Y235 HydrophobicContact CG-CG 3.9Å; F201-Y235 AromaticContact CG-CZ 3.98Å; F201-Y235 HydrophobicContact CZ-CD2 4.38Å; F201-Y235 AromaticContact CZ-CE2 3.56Å; F201-Y235 HydrophobicContact CZ-CE2 3.56Å; I202-Y235 WeakPolarHBondContact O-CB 3.33Å; I202-Y235 PolarHBondContact O-N 3.15Å; F203-Y235 AromaticContact CE1-CD1 3.97Å; F203-Y235 HydrophobicContact CE1-CD1 3.97Å; F203-Y235 HydrophobicContact CE2-CD1 4.21Å; F203-Y235 AromaticContact CZ-CD1 3.51Å; F203-Y235 HydrophobicContact CZ-CD1 3.51Å; F203-Y235 HydrophobicContact CZ-CE1 4.1Å; F203-Y235 HydrophobicContact CZ-CG 4.38Å; Y235-R260 HydrophobicContact CD1-CB 4.34Å; Y235-R260 HydrophobicContact CD2-CB 4.21Å; Y235-R260 HydrophobicContact CD2-CG 3.83Å; Y235-R260 HydrophobicContact CE1-CB 3.91Å; Y235-R260 HydrophobicContact CE1-CG 4.25Å; Y235-R260 HydrophobicContact CE2-CB 3.79Å; Y235-R260 HydrophobicContact CE2-CG 3.21Å; Y235-R260 HydrophobicContact CG-CB 4.48Å; Y235-R260 VanDerWaalsContact CZ-CG 3.45Å; Y235-R260 PolarHBondContact O-N 2.83Å; Y235-Y261 PolarHBondContact O-N 2.97Å; Y235-Y261 VanDerWaalsContact O-N 3.16Å
236	R	88.9	Confident	88.7	Confident	23 Å²	23	25.5 Å²	25.5	9%	0.087	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	131.1	-178	166.6	163.3	-178.1	141.2	14.3	112.1	T130 F203 I234 D238 Y261	T130-R236 HydrophobicContact CG2-CB 4.45Å; T130-R236 WeakPolarHBondContact OG1-CD 3.43Å; T130-R236 PolarHBondContact OG1-NH1 3.19Å; F203-R236 HydrophobicContact CD1-CB 3.6Å; F203-R236 HydrophobicContact CD1-CG 4.12Å; F203-R236 HydrophobicContact CE1-CB 3.63Å; F203-R236 HydrophobicContact CE1-CG 4.31Å; I234-R236 WeakPolarHBondContact CG2-O 3.47Å; R236-D238 IonicContact CZ-OD1 3.49Å; R236-D238 IonicContact NE-OD1 3.48Å; R236-D238 PolarHBondContact NE-OD1 3.13Å; R236-D238 IonicContact NE-OD2 3.32Å; R236-D238 PolarHBondContact NE-OD2 2.03Å; R236-D238 IonicContact NH2-OD1 2.73Å; R236-D238 PolarHBondContact NH2-OD1 2.66Å; R236-Y261 VanDerWaalsContact CA-O 3.3Å; R236-Y261 WeakPolarHBondContact CA-O 3.32Å; R236-Y261 HydrophobicContact CG-CD1 3.78Å; R236-Y261 HydrophobicContact CG-CG 4.4Å
237	L	90.5	Very high	88.6	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	131	171.2	-68.9	162.8	0	0	0	110.8	T204 I234 D241 F242 I254 L259 Y261 I262 D263 L266	T204-L237 HydrophobicContact CG2-CD2 4.21Å; I234-L237 HydrophobicContact CG2-CD1 4.42Å; I234-L237 HydrophobicContact CG2-CD2 3.73Å; I234-L237 HydrophobicContact CG2-CG 3.72Å; L237-D241 VanDerWaalsContact CA-OD2 3.32Å; L237-D241 WeakPolarHBondContact CA-OD2 3.37Å; L237-F242 HydrophobicContact CD2-CE2 4.12Å; L237-F242 HydrophobicContact CD2-CZ 4.07Å; L237-I254 HydrophobicContact CD1-CD1 3.25Å; L237-I254 HydrophobicContact CD1-CG2 4.14Å; L237-L259 HydrophobicContact CD1-CD1 4.11Å; L237-L259 HydrophobicContact CG-CD1 4.48Å; L237-Y261 PolarHBondContact N-O 2.71Å; L237-Y261 VanDerWaalsContact N-O 3.09Å; L237-I262 HydrophobicContact CB-CG1 4.4Å; L237-D263 PolarHBondContact O-N 3.31Å; L237-L266 HydrophobicContact CB-CD1 3.95Å; L237-L266 HydrophobicContact CB-CD2 4.13Å; L237-L266 HydrophobicContact CD1-CD2 4.13Å
238	D	89	Confident	88.5	Confident	23 Å²	23	28.7 Å²	28.7	12%	0.123	15%	0.145	C	C	.	.			trans	-109.2	158.6	179.5	-66.4	-45.1	0	0	0	111.8	K126 R236 N240 D241 L266	K126-D238 WeakPolarHBondContact CD-OD2 3.37Å; K126-D238 WeakPolarHBondContact CE-OD2 2.93Å; K126-D238 IonicContact NZ-OD2 2.68Å; K126-D238 PolarHBondContact NZ-OD2 3.38Å; R236-D238 IonicContact CZ-OD1 3.49Å; R236-D238 IonicContact NE-OD1 3.48Å; R236-D238 PolarHBondContact NE-OD1 3.13Å; R236-D238 IonicContact NE-OD2 3.32Å; R236-D238 PolarHBondContact NE-OD2 2.03Å; R236-D238 IonicContact NH2-OD1 2.73Å; R236-D238 PolarHBondContact NH2-OD1 2.66Å; D238-N240 PolarHBondContact O-N 3.24Å; D238-D241 PolarHBondContact N-OD2 3.02Å; D238-D241 WeakPolarHBondContact O-CB 3.27Å; D238-D241 PolarHBondContact O-N 2.84Å; D238-L266 WeakPolarHBondContact O-CD1 3.4Å
239	R	86	Confident	88.6	Confident	47 Å²	47	28.7 Å²	28.7	18%	0.177	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.4	-35.9	178.1	-175.4	-179.7	-175	176.6	5.2	114.4	N243 D263 M265 N269 E301	R239-N243 PolarHBondContact O-ND2 3Å; R239-N243 PolarHBondContact O-OD1 3.5Å; R239-D263 PolarHBondContact N-OD2 3.09Å; R239-M265 HydrophobicContact CB-CB 4.32Å; R239-M265 HydrophobicContact CG-CB 3.85Å; R239-N269 PolarHBondContact NH2-ND2 3.33Å; R239-N269 VanDerWaalsContact NH2-ND2 3.13Å; R239-E301 PolarHBondContact NH2-O 2.79Å; R239-E301 VanDerWaalsContact NH2-O 3.12Å
240	N	87.4	Confident	88.6	Confident	113 Å²	113	30.2 Å²	30.2	60%	0.604	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-6.4	-172.2	-66.4	-32.4	0	0	0	114.6	D238 F242 N243	D238-N240 PolarHBondContact O-N 3.24Å; N240-F242 PolarHBondContact O-N 2.82Å; N240-F242 VanDerWaalsContact O-N 3.13Å; N240-N243 PolarHBondContact OD1-ND2 2.82Å
241	D	90.9	Very high	88.7	Confident	4 Å²	4	32.1 Å²	32.1	2%	0.021	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-23.2	-172.9	-70.3	-11	0	0	0	113	K126 T204 S209 L237 D238	K126-D241 IonicContact NZ-OD1 2.79Å; K126-D241 IonicContact NZ-OD2 2.74Å; T204-D241 PolarHBondContact OG1-OD1 2.62Å; T204-D241 PolarHBondContact OG1-OD2 3.01Å; S209-D241 VanDerWaalsContact CB-O 3.24Å; S209-D241 WeakPolarHBondContact CB-O 3.4Å; L237-D241 VanDerWaalsContact CA-OD2 3.32Å; L237-D241 WeakPolarHBondContact CA-OD2 3.37Å; D238-D241 PolarHBondContact N-OD2 3.02Å; D238-D241 WeakPolarHBondContact O-CB 3.27Å; D238-D241 PolarHBondContact O-N 2.84Å
242	F	91.9	Very high	89.2	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.9	-9.7	-179.1	-59	-58.6	0	0	0	114.5	F208 I228 F230 L237 N240 R244 L245 S246 L249 I252 I254 L266 L270	F208-F242 HydrophobicContact CE1-CE1 4.2Å; I228-F242 HydrophobicContact CD1-CD1 4.43Å; F230-F242 HydrophobicContact CD2-CZ 4.5Å; F230-F242 AromaticContact CE2-CE1 3.53Å; F230-F242 HydrophobicContact CE2-CE1 3.53Å; F230-F242 AromaticContact CE2-CZ 3.53Å; F230-F242 HydrophobicContact CE2-CZ 3.53Å; F230-F242 AromaticContact CZ-CE1 3.76Å; F230-F242 HydrophobicContact CZ-CE1 3.76Å; F230-F242 HydrophobicContact CZ-CZ 4Å; L237-F242 HydrophobicContact CD2-CE2 4.12Å; L237-F242 HydrophobicContact CD2-CZ 4.07Å; N240-F242 PolarHBondContact O-N 2.82Å; N240-F242 VanDerWaalsContact O-N 3.13Å; F242-R244 VanDerWaalsContact C-N 3.27Å; F242-R244 PolarHBondContact O-N 2.9Å; F242-R244 VanDerWaalsContact O-N 3.15Å; F242-L245 WeakPolarHBondContact O-CA 3.07Å; F242-L245 WeakPolarHBondContact O-CB 3.41Å; F242-L245 PolarHBondContact O-N 3.03Å; F242-S246 PolarHBondContact O-N 3.25Å; F242-L249 HydrophobicContact CB-CD2 3.7Å; F242-L249 HydrophobicContact CD1-CD2 4.26Å; F242-L249 HydrophobicContact CG-CD2 4.15Å; F242-I252 HydrophobicContact CD2-CD1 4.05Å; F242-I252 HydrophobicContact CE2-CD1 4.41Å; F242-I252 HydrophobicContact CG-CD1 4.2Å; F242-I252 HydrophobicContact CZ-CG2 4.4Å; F242-I254 HydrophobicContact CE2-CD1 4.37Å; F242-I254 HydrophobicContact CZ-CD1 4.38Å; F242-L266 HydrophobicContact CD2-CD1 3.8Å; F242-L266 HydrophobicContact CD2-CG 4.28Å; F242-L266 HydrophobicContact CE2-CD1 3.92Å; F242-L266 HydrophobicContact CE2-CD2 4.31Å; F242-L266 HydrophobicContact CE2-CG 4.39Å; F242-L270 HydrophobicContact CB-CD1 4.03Å
243	N	87.6	Confident	89.6	Confident	38 Å²	38	30.2 Å²	30.2	20%	0.203	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-56.2	-38.6	-171.5	-79.7	-15.5	0	0	0	113.4	R239 N240 L245 S246	R239-N243 PolarHBondContact O-ND2 3Å; R239-N243 PolarHBondContact O-OD1 3.5Å; N240-N243 PolarHBondContact OD1-ND2 2.82Å; N243-L245 PolarHBondContact O-N 2.8Å; N243-S246 WeakPolarHBondContact O-CB 3.43Å; N243-S246 PolarHBondContact O-N 3.4Å; N243-S246 PolarHBondContact O-OG 3.26Å
244	R	90.5	Very high	90	Very high	128 Å²	128	29.7 Å²	29.7	48%	0.483	14%	0.141	S	C	.	.	G	3₁₀ helix	trans	-66.1	-28.4	178.8	-166.9	61.8	171.7	-169.7	-2.9	112.6	Y213 F242 S246 P247	Y213-R244 HydrophobicContact CD1-CG 4.13Å; Y213-R244 HydrophobicContact CD2-CG 3.84Å; Y213-R244 WeakPolarHBondContact CD2-O 3.42Å; Y213-R244 HydrophobicContact CE2-CG 4.43Å; Y213-R244 VanDerWaalsContact CE2-O 3.31Å; Y213-R244 WeakPolarHBondContact CE2-O 2.89Å; Y213-R244 HydrophobicContact CG-CG 3.64Å; F242-R244 VanDerWaalsContact C-N 3.27Å; F242-R244 PolarHBondContact O-N 2.9Å; F242-R244 VanDerWaalsContact O-N 3.15Å; R244-S246 VanDerWaalsContact C-N 3.35Å; R244-P247 WeakPolarHBondContact O-CD 3.4Å
245	L	91.9	Very high	89.8	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-87.1	-5.5	179.3	-58.2	174.3	0	0	0	112.9	I212 L226 I228 F242 N243 P247 W248 L249	I212-L245 HydrophobicContact CB-CD1 4.49Å; I212-L245 HydrophobicContact CB-CD2 4.2Å; I212-L245 HydrophobicContact CG2-CD1 4.24Å; I212-L245 HydrophobicContact CG2-CD2 3.87Å; L226-L245 HydrophobicContact CD2-CB 4.1Å; L226-L245 HydrophobicContact CD2-CD1 4.2Å; L226-L245 HydrophobicContact CD2-CD2 4.11Å; L226-L245 HydrophobicContact CD2-CG 4.36Å; I228-L245 HydrophobicContact CD1-CD1 3.56Å; F242-L245 WeakPolarHBondContact O-CA 3.07Å; F242-L245 WeakPolarHBondContact O-CB 3.41Å; F242-L245 PolarHBondContact O-N 3.03Å; N243-L245 PolarHBondContact O-N 2.8Å; L245-P247 VanDerWaalsContact C-N 3.28Å; L245-P247 WeakPolarHBondContact O-CD 3.46Å; L245-P247 VanDerWaalsContact O-N 3.08Å; L245-W248 PolarHBondContact O-N 2.79Å; L245-W248 VanDerWaalsContact O-N 3.16Å; L245-L249 HydrophobicContact CB-CB 4.34Å; L245-L249 HydrophobicContact CB-CD2 4.29Å; L245-L249 VanDerWaalsContact O-CB 3.23Å; L245-L249 WeakPolarHBondContact O-CB 3.38Å; L245-L249 PolarHBondContact O-N 3.15Å
246	S	90.5	Very high	89.4	Confident	43 Å²	43	30.6 Å²	30.6	30%	0.301	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.9	-32.8	-177.9	63.5	0	0	0	0	116.3	F242 N243 R244 W248	F242-S246 PolarHBondContact O-N 3.25Å; N243-S246 WeakPolarHBondContact O-CB 3.43Å; N243-S246 PolarHBondContact O-N 3.4Å; N243-S246 PolarHBondContact O-OG 3.26Å; R244-S246 VanDerWaalsContact C-N 3.35Å; S246-W248 VanDerWaalsContact C-N 3.27Å; S246-W248 PolarHBondContact O-N 2.92Å
247	P	89.3	Confident	88.8	Confident	66 Å²	66	34.5 Å²	34.5	43%	0.429	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-36.7	-179.7	-26.4	37.5	0	0	0	113.4	R244 L245 R250	R244-P247 WeakPolarHBondContact O-CD 3.4Å; L245-P247 VanDerWaalsContact C-N 3.28Å; L245-P247 WeakPolarHBondContact O-CD 3.46Å; L245-P247 VanDerWaalsContact O-N 3.08Å; P247-R250 PolarHBondContact O-NH1 3.1Å; P247-R250 PolarHBondContact O-NH2 3.24Å
248	W	91.2	Very high	88	Confident	40 Å²	40	36.5 Å²	36.5	15%	0.152	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-22.5	-177.4	-49.8	-61.1	0	0	0	113.2	Y213 I216 Q217 T223 D225 L226 L245 S246 R250	Y213-W248 HydrophobicContact CD2-CE3 4.4Å; Y213-W248 AromaticContact CD2-CH2 3.82Å; Y213-W248 HydrophobicContact CD2-CH2 3.82Å; Y213-W248 AromaticContact CD2-CZ3 3.42Å; Y213-W248 HydrophobicContact CD2-CZ3 3.42Å; Y213-W248 VanDerWaalsContact CD2-CZ3 3.42Å; Y213-W248 AromaticContact CE2-CH2 3.59Å; Y213-W248 HydrophobicContact CE2-CH2 3.59Å; Y213-W248 AromaticContact CE2-CZ3 3.64Å; Y213-W248 HydrophobicContact CE2-CZ3 3.64Å; Y213-W248 HydrophobicContact CG-CZ3 4.27Å; I216-W248 HydrophobicContact CB-CZ3 4.25Å; I216-W248 HydrophobicContact CG2-CE3 4.04Å; I216-W248 HydrophobicContact CG2-CH2 4.18Å; I216-W248 HydrophobicContact CG2-CZ3 3.83Å; Q217-W248 HydrophobicContact CG-CH2 3.58Å; Q217-W248 HydrophobicContact CG-CZ2 4.35Å; Q217-W248 HydrophobicContact CG-CZ3 4.5Å; T223-W248 PolarHBondContact O-NE1 3.35Å; D225-W248 CarbonylContact C-O 3.58Å; D225-W248 WeakPolarHBondContact CA-O 3.41Å; L226-W248 HydrophobicContact CB-CB 3.82Å; L226-W248 PolarHBondContact N-O 2.8Å; L245-W248 PolarHBondContact O-N 2.79Å; L245-W248 VanDerWaalsContact O-N 3.16Å; S246-W248 VanDerWaalsContact C-N 3.27Å; S246-W248 PolarHBondContact O-N 2.92Å; W248-R250 WeakPolarHBondContact O-CG 3.04Å; W248-R250 PolarHBondContact O-N 3.15Å
249	L	93.6	Very high	87.6	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	119.9	-172	-170.5	57.5	0	0	0	111.4	L226 I228 F242 L245 Y251 I252 L270 L272	L226-L249 HydrophobicContact CD2-CD1 4.35Å; L226-L249 HydrophobicContact CG-CD1 4.25Å; I228-L249 HydrophobicContact CB-CD1 4.37Å; I228-L249 HydrophobicContact CD1-CD1 3.59Å; I228-L249 HydrophobicContact CD1-CD2 4.48Å; I228-L249 HydrophobicContact CG1-CD1 3.7Å; F242-L249 HydrophobicContact CB-CD2 3.7Å; F242-L249 HydrophobicContact CD1-CD2 4.26Å; F242-L249 HydrophobicContact CG-CD2 4.15Å; L245-L249 HydrophobicContact CB-CB 4.34Å; L245-L249 HydrophobicContact CB-CD2 4.29Å; L245-L249 VanDerWaalsContact O-CB 3.23Å; L245-L249 WeakPolarHBondContact O-CB 3.38Å; L245-L249 PolarHBondContact O-N 3.15Å; L249-Y251 WeakPolarHBondContact CD1-O 3.43Å; L249-I252 HydrophobicContact CD1-CG1 3.9Å; L249-I252 HydrophobicContact CD2-CD1 3.7Å; L249-I252 HydrophobicContact CD2-CG1 3.9Å; L249-I252 HydrophobicContact CG-CD1 4.21Å; L249-I252 HydrophobicContact CG-CG1 3.99Å; L249-L270 HydrophobicContact CD2-CD1 4.13Å; L249-L272 HydrophobicContact CG-CD2 3.99Å
250	R	92.5	Very high	87.3	Confident	49 Å²	49	38.5 Å²	38.5	19%	0.185	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	-26	177.9	-60.2	-55.8	168.7	-112.4	-5.5	113.5	D225 L226 Y227 P247 W248 L272 D273 Y274	D225-R250 HydrophobicContact CB-CG 3.87Å; D225-R250 VanDerWaalsContact OD1-CG 3.29Å; D225-R250 WeakPolarHBondContact OD1-CG 3.17Å; D225-R250 IonicContact OD1-NE 2.84Å; D225-R250 PolarHBondContact OD1-NE 3.33Å; L226-R250 PolarHBondContact O-N 2.98Å; Y227-R250 HydrophobicContact CD1-CB 4.31Å; Y227-R250 HydrophobicContact CE1-CB 3.81Å; P247-R250 PolarHBondContact O-NH1 3.1Å; P247-R250 PolarHBondContact O-NH2 3.24Å; W248-R250 WeakPolarHBondContact O-CG 3.04Å; W248-R250 PolarHBondContact O-N 3.15Å; R250-L272 CarbonylContact O-C 3.59Å; R250-L272 WeakPolarHBondContact O-CA 3.41Å; R250-D273 HydrophobicContact CB-CB 4.45Å; R250-D273 PolarHBondContact O-N 3.02Å; R250-Y274 PolarHBondContact O-N 2.79Å
251	Y	92	Very high	87.1	Confident	39 Å²	39	37 Å²	37	15%	0.153	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	133.2	-177.2	176.7	-80.9	0	0	0	110.3	L226 Y227 I228 L249 S253 Y274 I276	L226-Y251 PolarHBondContact O-N 3.24Å; Y227-Y251 HydrophobicContact CD2-CD1 4.14Å; Y227-Y251 HydrophobicContact CD2-CD2 4.22Å; Y227-Y251 AromaticContact CD2-CG 3.74Å; Y227-Y251 HydrophobicContact CD2-CG 3.74Å; Y227-Y251 HydrophobicContact CE2-CD2 4.24Å; Y227-Y251 HydrophobicContact CE2-CG 4.13Å; Y227-Y251 HydrophobicContact CG-CD1 4.28Å; Y227-Y251 AromaticContact CG-CG 3.99Å; Y227-Y251 HydrophobicContact CG-CG 3.99Å; I228-Y251 PolarHBondContact N-O 3.35Å; L249-Y251 WeakPolarHBondContact CD1-O 3.43Å; Y251-S253 VanDerWaalsContact CE1-CB 3.43Å; Y251-S253 WeakPolarHBondContact OH-CB 3.11Å; Y251-Y274 WeakPolarHBondContact CA-O 3.24Å; Y251-Y274 HydrophobicContact CD2-CD2 4.21Å; Y251-Y274 HydrophobicContact CD2-CG 4.28Å; Y251-I276 HydrophobicContact CE2-CD1 3.88Å; Y251-I276 HydrophobicContact CE2-CG1 4.38Å; Y251-I276 WeakPolarHBondContact OH-CD1 2.99Å
252	I	91.9	Very high	87	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	127.9	171	-57.1	166.5	0	0	0	107.9	I228 F242 L249 I254 L270 L272 Y274 F275 I276	I228-I252 CarbonylContact O-C 3.49Å; I228-I252 WeakPolarHBondContact O-CA 3.47Å; F242-I252 HydrophobicContact CD2-CD1 4.05Å; F242-I252 HydrophobicContact CE2-CD1 4.41Å; F242-I252 HydrophobicContact CG-CD1 4.2Å; F242-I252 HydrophobicContact CZ-CG2 4.4Å; L249-I252 HydrophobicContact CD1-CG1 3.9Å; L249-I252 HydrophobicContact CD2-CD1 3.7Å; L249-I252 HydrophobicContact CD2-CG1 3.9Å; L249-I252 HydrophobicContact CG-CD1 4.21Å; L249-I252 HydrophobicContact CG-CG1 3.99Å; I252-I254 HydrophobicContact CG2-CD1 3.71Å; I252-I254 HydrophobicContact CG2-CG1 3.63Å; I252-L270 HydrophobicContact CD1-CD1 3.81Å; I252-L272 HydrophobicContact CD1-CD1 3.92Å; I252-L272 HydrophobicContact CD1-CD2 4.03Å; I252-L272 HydrophobicContact CG1-CD2 4.2Å; I252-Y274 PolarHBondContact N-O 3.2Å; I252-F275 HydrophobicContact CB-CD2 4.06Å; I252-F275 HydrophobicContact CG2-CD2 4.28Å; I252-F275 HydrophobicContact CG2-CE2 4.3Å; I252-F275 WeakPolarHBondContact O-CA 3.34Å; I252-I276 PolarHBondContact O-N 2.89Å
253	S	91.1	Very high	86.8	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.007	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	131.5	169.2	177.8	0	0	0	0	110.1	I228 T229 F230 Y251 I276 Q278	I228-S253 PolarHBondContact O-N 3.13Å; T229-S253 CarbonylContact C-O 3.52Å; T229-S253 WeakPolarHBondContact CA-O 3.24Å; F230-S253 PolarHBondContact N-O 3.01Å; Y251-S253 VanDerWaalsContact CE1-CB 3.43Å; Y251-S253 WeakPolarHBondContact OH-CB 3.11Å; S253-I276 CarbonylContact C-O 3.56Å; S253-I276 WeakPolarHBondContact CA-O 3.19Å; S253-Q278 PolarHBondContact OG-NE2 2.91Å
254	I	88.8	Confident	86.8	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	136.4	-176.2	-43.1	-172.7	0	0	0	108.6	F230 L237 F242 I252 G256 F275 I276 L277 Q278	F230-I254 HydrophobicContact CB-CG2 4.41Å; F230-I254 HydrophobicContact CD2-CG1 4.21Å; L237-I254 HydrophobicContact CD1-CD1 3.25Å; L237-I254 HydrophobicContact CD1-CG2 4.14Å; F242-I254 HydrophobicContact CE2-CD1 4.37Å; F242-I254 HydrophobicContact CZ-CD1 4.38Å; I252-I254 HydrophobicContact CG2-CD1 3.71Å; I252-I254 HydrophobicContact CG2-CG1 3.63Å; I254-G256 PolarHBondContact O-N 2.98Å; I254-F275 HydrophobicContact CD1-CE2 4.39Å; I254-I276 PolarHBondContact N-O 3.46Å; I254-L277 HydrophobicContact CB-CD2 3.99Å; I254-L277 HydrophobicContact CD1-CD2 4.35Å; I254-L277 HydrophobicContact CG1-CD2 4.37Å; I254-Q278 PolarHBondContact O-N 2.8Å
255	D	83.4	Confident	86.7	Confident	27 Å²	27	32.7 Å²	32.7	14%	0.144	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	114.3	166.3	-175.8	-7.4	0	0	0	110.4	F230 K257	F230-D255 PolarHBondContact O-N 3.46Å; D255-K257 VanDerWaalsContact OD1-CB 3.31Å; D255-K257 WeakPolarHBondContact OD1-CB 3.19Å; D255-K257 VanDerWaalsContact OD1-CG 3.3Å; D255-K257 WeakPolarHBondContact OD1-CG 3.48Å; D255-K257 PolarHBondContact OD1-N 3.38Å
256	G	78	Confident	86.6	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.01	15%	0.153	C	C	.	.			trans	-86.7	-4.9	-179.4	0	0	0	0	0	114.8	I254 Q258 L259 Q278	I254-G256 PolarHBondContact O-N 2.98Å; G256-Q258 VanDerWaalsContact C-N 3.25Å; G256-Q258 PolarHBondContact O-N 3.47Å; G256-L259 PolarHBondContact O-N 3.2Å; G256-Q278 WeakPolarHBondContact CA-O 3.33Å; G256-Q278 PolarHBondContact N-O 2.99Å
257	K	76.8	Confident	86.7	Confident	106 Å²	106	30.7 Å²	30.7	46%	0.461	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-33.9	-174.9	-72.3	179.9	-175.8	179.5	0	114.1	D255 D279 N319	D255-K257 VanDerWaalsContact OD1-CB 3.31Å; D255-K257 WeakPolarHBondContact OD1-CB 3.19Å; D255-K257 VanDerWaalsContact OD1-CG 3.3Å; D255-K257 WeakPolarHBondContact OD1-CG 3.48Å; D255-K257 PolarHBondContact OD1-N 3.38Å; K257-D279 VanDerWaalsContact CE-OD1 3.27Å; K257-D279 WeakPolarHBondContact CE-OD1 3.48Å; K257-D279 WeakPolarHBondContact CE-OD2 3.3Å; K257-D279 HydrophobicContact CG-CB 3.82Å; K257-D279 VanDerWaalsContact CG-CG 3.49Å; K257-D279 VanDerWaalsContact CG-OD2 3.27Å; K257-D279 WeakPolarHBondContact CG-OD2 3.44Å; K257-N319 PolarHBondContact O-ND2 2.83Å
258	Q	74.3	Confident	86.6	Confident	41 Å²	41	27.5 Å²	27.5	19%	0.192	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.1	4.6	-176.8	-65.6	-169.7	36.4	0	0	114.1	P233 G256 R260	P233-Q258 HydrophobicContact CB-CB 3.71Å; P233-Q258 HydrophobicContact CB-CG 3.78Å; P233-Q258 VanDerWaalsContact CB-NE2 3.34Å; G256-Q258 VanDerWaalsContact C-N 3.25Å; G256-Q258 PolarHBondContact O-N 3.47Å; Q258-R260 PolarHBondContact O-N 3.48Å
259	L	80.3	Confident	86.3	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.005	12%	0.12	C	C	.	.			trans	-65	121.4	178.6	-171.8	67.4	0	0	0	109.6	L237 G256 Y261 I262 L277 F323	L237-L259 HydrophobicContact CD1-CD1 4.11Å; L237-L259 HydrophobicContact CG-CD1 4.48Å; G256-L259 PolarHBondContact O-N 3.2Å; L259-Y261 WeakPolarHBondContact CD1-O 3.39Å; L259-I262 HydrophobicContact CD1-CB 4.4Å; L259-I262 HydrophobicContact CD2-CB 4.11Å; L259-I262 HydrophobicContact CD2-CD1 4.01Å; L259-I262 HydrophobicContact CD2-CG2 4.39Å; L259-I262 HydrophobicContact CG-CB 4.46Å; L259-L277 HydrophobicContact CD2-CD2 4.33Å; L259-F323 HydrophobicContact CD2-CZ 4.41Å
260	R	78.8	Confident	86.2	Confident	112 Å²	112	27.3 Å²	27.3	42%	0.423	12%	0.12	S	C	.	.			trans	-118.9	-12.5	177.3	-65.7	-61.1	-169.5	157.3	5.1	113.5	Y235 Q258 N319 Y320	Y235-R260 HydrophobicContact CD1-CB 4.34Å; Y235-R260 HydrophobicContact CD2-CB 4.21Å; Y235-R260 HydrophobicContact CD2-CG 3.83Å; Y235-R260 HydrophobicContact CE1-CB 3.91Å; Y235-R260 HydrophobicContact CE1-CG 4.25Å; Y235-R260 HydrophobicContact CE2-CB 3.79Å; Y235-R260 HydrophobicContact CE2-CG 3.21Å; Y235-R260 HydrophobicContact CG-CB 4.48Å; Y235-R260 VanDerWaalsContact CZ-CG 3.45Å; Y235-R260 PolarHBondContact O-N 2.83Å; Q258-R260 PolarHBondContact O-N 3.48Å; R260-N319 VanDerWaalsContact CZ-O 3.32Å; R260-N319 PolarHBondContact NH1-O 3.2Å; R260-Y320 VanDerWaalsContact C-CZ 3.49Å; R260-Y320 WeakPolarHBondContact O-CE2 3.46Å; R260-Y320 PolarHBondContact O-OH 3.27Å
261	Y	85	Confident	86.1	Confident	82 Å²	82	27.2 Å²	27.2	32%	0.322	13%	0.126	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	131.8	172.1	-176	-86.8	0	0	0	109.8	Y235 R236 L237 L259 D263	Y235-Y261 PolarHBondContact O-N 2.97Å; Y235-Y261 VanDerWaalsContact O-N 3.16Å; R236-Y261 VanDerWaalsContact CA-O 3.3Å; R236-Y261 WeakPolarHBondContact CA-O 3.32Å; R236-Y261 HydrophobicContact CG-CD1 3.78Å; R236-Y261 HydrophobicContact CG-CG 4.4Å; L237-Y261 PolarHBondContact N-O 2.71Å; L237-Y261 VanDerWaalsContact N-O 3.09Å; L259-Y261 WeakPolarHBondContact CD1-O 3.39Å; Y261-D263 HydrophobicContact CE1-CB 4.26Å
262	I	88.1	Confident	86	Confident	10 Å²	10	25.4 Å²	25.4	5%	0.051	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	125.8	171.7	-169.2	169.9	0	0	0	107.5	L237 L259 V264 L266 F275 L277 F323 L325	L237-I262 HydrophobicContact CB-CG1 4.4Å; L259-I262 HydrophobicContact CD1-CB 4.4Å; L259-I262 HydrophobicContact CD2-CB 4.11Å; L259-I262 HydrophobicContact CD2-CD1 4.01Å; L259-I262 HydrophobicContact CD2-CG2 4.39Å; L259-I262 HydrophobicContact CG-CB 4.46Å; I262-V264 PolarHBondContact O-N 3.04Å; I262-L266 HydrophobicContact CD1-CD2 3.58Å; I262-L266 HydrophobicContact CG1-CB 4.29Å; I262-L266 HydrophobicContact CG1-CD2 3.69Å; I262-F275 HydrophobicContact CD1-CZ 4.33Å; I262-L277 HydrophobicContact CD1-CD1 4.2Å; I262-L277 HydrophobicContact CD1-CD2 4.41Å; I262-F323 HydrophobicContact CD1-CE2 4.34Å; I262-F323 HydrophobicContact CG2-CD1 4.45Å; I262-F323 HydrophobicContact CG2-CD2 3.26Å; I262-F323 HydrophobicContact CG2-CE1 4.46Å; I262-F323 HydrophobicContact CG2-CE2 3.31Å; I262-F323 HydrophobicContact CG2-CG 3.87Å; I262-F323 HydrophobicContact CG2-CZ 3.93Å; I262-L325 HydrophobicContact CD1-CD1 3.9Å; I262-L325 HydrophobicContact CD1-CD2 3.87Å; I262-L325 HydrophobicContact CD1-CG 4.43Å; I262-L325 HydrophobicContact CG1-CD2 3.88Å; I262-L325 HydrophobicContact CG2-CD2 4.16Å
263	D	88.3	Confident	85.8	Confident	30 Å²	30	28 Å²	28	16%	0.16	13%	0.132	C	C	.	.			trans	-63.5	131.3	177	-170.2	-51.3	0	0	0	109.8	L237 R239 Y261 M265 L266 L325	L237-D263 PolarHBondContact O-N 3.31Å; R239-D263 PolarHBondContact N-OD2 3.09Å; Y261-D263 HydrophobicContact CE1-CB 4.26Å; D263-M265 PolarHBondContact O-N 3.22Å; D263-M265 VanDerWaalsContact O-N 3.08Å; D263-M265 WeakPolarHBondContact OD1-CB 3.38Å; D263-M265 PolarHBondContact OD1-N 3.09Å; D263-L266 VanDerWaalsContact O-CB 3.24Å; D263-L266 WeakPolarHBondContact O-CB 3.18Å; D263-L266 PolarHBondContact O-N 3.28Å; D263-L325 WeakPolarHBondContact O-CD2 3.28Å
264	V	87.1	Confident	85.6	Confident	31 Å²	31	32.1 Å²	32.1	19%	0.188	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-27.3	-179.1	69.5	0	0	0	0	112.2	I262 I324 I326	I262-V264 PolarHBondContact O-N 3.04Å; V264-I324 HydrophobicContact CG2-CB 4.49Å; V264-I324 HydrophobicContact CG2-CG2 4.16Å; V264-I326 HydrophobicContact CG2-CD1 4.45Å; V264-I326 HydrophobicContact CG2-CG1 4.19Å; V264-I326 PolarHBondContact O-N 2.87Å
265	M	87.8	Confident	85.7	Confident	8 Å²	8	33.3 Å²	33.3	4%	0.039	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	6.7	180	-61.3	-65.2	-83.1	0	0	113.5	R239 D263 I267 A268 I300 E301 L302 I326	R239-M265 HydrophobicContact CB-CB 4.32Å; R239-M265 HydrophobicContact CG-CB 3.85Å; D263-M265 PolarHBondContact O-N 3.22Å; D263-M265 VanDerWaalsContact O-N 3.08Å; D263-M265 WeakPolarHBondContact OD1-CB 3.38Å; D263-M265 PolarHBondContact OD1-N 3.09Å; M265-I267 PolarHBondContact O-N 3.08Å; M265-I267 VanDerWaalsContact O-N 3.08Å; M265-A268 HydrophobicContact CB-CB 4.42Å; M265-A268 HydrophobicContact CE-CB 4.11Å; M265-A268 PolarHBondContact O-N 2.89Å; M265-A268 HydrophobicContact SD-CB 4.02Å; M265-I300 HydrophobicContact CE-CG2 4.42Å; M265-I300 HydrophobicContact SD-CG1 4.3Å; M265-I300 HydrophobicContact SD-CG2 4.14Å; M265-E301 WeakPolarHBondContact CE-O 2.82Å; M265-L302 HydrophobicContact CE-CG 4.32Å; M265-I326 HydrophobicContact SD-CD1 3.31Å; M265-I326 WeakPolarHBondContact SD-CD1 3.4Å; M265-I326 HydrophobicContact SD-CG1 4.38Å
266	L	90.7	Very high	85.8	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.7	-46.4	-172.6	180	69.2	0	0	0	113.1	L237 D238 F242 I262 D263 F275	L237-L266 HydrophobicContact CB-CD1 3.95Å; L237-L266 HydrophobicContact CB-CD2 4.13Å; L237-L266 HydrophobicContact CD1-CD2 4.13Å; D238-L266 WeakPolarHBondContact O-CD1 3.4Å; F242-L266 HydrophobicContact CD2-CD1 3.8Å; F242-L266 HydrophobicContact CD2-CG 4.28Å; F242-L266 HydrophobicContact CE2-CD1 3.92Å; F242-L266 HydrophobicContact CE2-CD2 4.31Å; F242-L266 HydrophobicContact CE2-CG 4.39Å; I262-L266 HydrophobicContact CD1-CD2 3.58Å; I262-L266 HydrophobicContact CG1-CB 4.29Å; I262-L266 HydrophobicContact CG1-CD2 3.69Å; D263-L266 VanDerWaalsContact O-CB 3.24Å; D263-L266 WeakPolarHBondContact O-CB 3.18Å; D263-L266 PolarHBondContact O-N 3.28Å; L266-F275 HydrophobicContact CD2-CE2 4.38Å; L266-F275 HydrophobicContact CD2-CZ 4.38Å
267	I	91.5	Very high	86.3	Confident	0 Å²	0	33 Å²	33	0%	0	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-3.5	-174.5	66.2	175.4	0	0	0	113.5	M265 N269 L270 L272 F275 W313 I326 D328	M265-I267 PolarHBondContact O-N 3.08Å; M265-I267 VanDerWaalsContact O-N 3.08Å; I267-N269 PolarHBondContact O-N 2.86Å; I267-N269 VanDerWaalsContact O-N 3.16Å; I267-L270 HydrophobicContact CB-CD1 4.32Å; I267-L270 HydrophobicContact CG2-CD1 4.26Å; I267-L270 WeakPolarHBondContact O-CB 3.45Å; I267-L270 PolarHBondContact O-N 3Å; I267-L272 HydrophobicContact CB-CD1 4.07Å; I267-L272 HydrophobicContact CG2-CD1 3.99Å; I267-F275 HydrophobicContact CD1-CD1 3.84Å; I267-F275 HydrophobicContact CD1-CE1 4.16Å; I267-F275 HydrophobicContact CD1-CG 4.07Å; I267-F275 HydrophobicContact CG2-CD2 3.84Å; I267-F275 HydrophobicContact CG2-CE2 3.78Å; I267-F275 HydrophobicContact CG2-CG 4.32Å; I267-F275 HydrophobicContact CG2-CZ 4.19Å; I267-W313 HydrophobicContact CD1-CE3 3.9Å; I267-W313 HydrophobicContact CD1-CH2 4.35Å; I267-W313 HydrophobicContact CD1-CZ3 3.39Å; I267-I326 VanDerWaalsContact CG1-O 3.24Å; I267-I326 WeakPolarHBondContact CG1-O 3.32Å; I267-D328 WeakPolarHBondContact O-CA 3.41Å
268	A	87.1	Confident	86.6	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-36.6	-169.9	0	0	0	0	0	113.1	M265 I326 L329	M265-A268 HydrophobicContact CB-CB 4.42Å; M265-A268 HydrophobicContact CE-CB 4.11Å; M265-A268 PolarHBondContact O-N 2.89Å; M265-A268 HydrophobicContact SD-CB 4.02Å; A268-I326 HydrophobicContact CB-CB 3.93Å; A268-I326 HydrophobicContact CB-CG2 3.62Å; A268-L329 WeakPolarHBondContact O-CD2 3.29Å; A268-L329 WeakPolarHBondContact O-CG 3.42Å
269	N	85.8	Confident	87	Confident	35 Å²	35	30.5 Å²	30.5	19%	0.187	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	2.4	-179.3	-72	-8.5	0	0	0	113.6	R239 I267	R239-N269 PolarHBondContact NH2-ND2 3.33Å; R239-N269 VanDerWaalsContact NH2-ND2 3.13Å; I267-N269 PolarHBondContact O-N 2.86Å; I267-N269 VanDerWaalsContact O-N 3.16Å
270	L	90.3	Very high	87.2	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.145	C	C	.	.			trans	-92.7	159.6	-179	-54.9	-179.5	0	0	0	110.4	F242 L249 I252 I267 L272 D328 L329	F242-L270 HydrophobicContact CB-CD1 4.03Å; L249-L270 HydrophobicContact CD2-CD1 4.13Å; I252-L270 HydrophobicContact CD1-CD1 3.81Å; I267-L270 HydrophobicContact CB-CD1 4.32Å; I267-L270 HydrophobicContact CG2-CD1 4.26Å; I267-L270 WeakPolarHBondContact O-CB 3.45Å; I267-L270 PolarHBondContact O-N 3Å; L270-L272 HydrophobicContact CB-CD1 4.27Å; L270-L272 HydrophobicContact CB-CD2 4.15Å; L270-L272 HydrophobicContact CB-CG 3.87Å; L270-L272 HydrophobicContact CD1-CD1 4.22Å; L270-L272 HydrophobicContact CD1-CD2 4.33Å; L270-L272 HydrophobicContact CD1-CG 4.47Å; L270-D328 WeakPolarHBondContact O-CB 3.28Å; L270-L329 WeakPolarHBondContact O-CB 3.37Å; L270-L329 PolarHBondContact O-N 2.83Å
271	T	90.6	Very high	87.5	Confident	48 Å²	48	29.6 Å²	29.6	29%	0.294	15%	0.147	S	C	.	.			trans	-117	87.8	171.9	-55.7	0	0	0	0	107.5	K330	T271-K330 HydrophobicContact CG2-CB 4Å; T271-K330 HydrophobicContact CG2-CG 4.5Å
272	L	90.6	Very high	87.5	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.005	14%	0.136	C	C	.	.			trans	-99.4	145.5	-171.6	-60.6	175.2	0	0	0	111.1	L249 R250 I252 I267 L270 F275 D328 K330	L249-L272 HydrophobicContact CG-CD2 3.99Å; R250-L272 CarbonylContact O-C 3.59Å; R250-L272 WeakPolarHBondContact O-CA 3.41Å; I252-L272 HydrophobicContact CD1-CD1 3.92Å; I252-L272 HydrophobicContact CD1-CD2 4.03Å; I252-L272 HydrophobicContact CG1-CD2 4.2Å; I267-L272 HydrophobicContact CB-CD1 4.07Å; I267-L272 HydrophobicContact CG2-CD1 3.99Å; L270-L272 HydrophobicContact CB-CD1 4.27Å; L270-L272 HydrophobicContact CB-CD2 4.15Å; L270-L272 HydrophobicContact CB-CG 3.87Å; L270-L272 HydrophobicContact CD1-CD1 4.22Å; L270-L272 HydrophobicContact CD1-CD2 4.33Å; L270-L272 HydrophobicContact CD1-CG 4.47Å; L272-F275 HydrophobicContact CD1-CB 4.02Å; L272-F275 HydrophobicContact CD1-CD2 4.4Å; L272-D328 HydrophobicContact CB-CB 4.39Å; L272-D328 HydrophobicContact CG-CB 4.45Å; L272-D328 PolarHBondContact N-OD1 3.38Å; L272-K330 WeakPolarHBondContact O-CD 3.3Å
273	D	88	Confident	87.3	Confident	54 Å²	54	31.9 Å²	31.9	29%	0.289	16%	0.158	S	C	.	.	S	Bend	trans	-81.7	-41.3	164.2	-67.7	-33.2	0	0	0	110.4	R250 K330	R250-D273 HydrophobicContact CB-CB 4.45Å; R250-D273 PolarHBondContact O-N 3.02Å; D273-K330 IonicContact OD1-NZ 3.3Å; D273-K330 PolarHBondContact OD1-NZ 2.91Å
274	Y	87.4	Confident	86.8	Confident	87 Å²	87	32.9 Å²	32.9	34%	0.341	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	141.6	178.6	-54.6	-86.7	0	0	0	111.9	I44 R250 Y251 I252	I44-Y274 HydrophobicContact CD1-CE2 3.75Å; R250-Y274 PolarHBondContact O-N 2.79Å; Y251-Y274 WeakPolarHBondContact CA-O 3.24Å; Y251-Y274 HydrophobicContact CD2-CD2 4.21Å; Y251-Y274 HydrophobicContact CD2-CG 4.28Å; I252-Y274 PolarHBondContact N-O 3.2Å
275	F	89.1	Confident	86.6	Confident	25 Å²	25	31.4 Å²	31.4	11%	0.11	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	119.1	170.2	174.5	-111	0	0	0	107.8	I252 I254 I262 L266 I267 L272 L277 W313 L325	I252-F275 HydrophobicContact CB-CD2 4.06Å; I252-F275 HydrophobicContact CG2-CD2 4.28Å; I252-F275 HydrophobicContact CG2-CE2 4.3Å; I252-F275 WeakPolarHBondContact O-CA 3.34Å; I254-F275 HydrophobicContact CD1-CE2 4.39Å; I262-F275 HydrophobicContact CD1-CZ 4.33Å; L266-F275 HydrophobicContact CD2-CE2 4.38Å; L266-F275 HydrophobicContact CD2-CZ 4.38Å; I267-F275 HydrophobicContact CD1-CD1 3.84Å; I267-F275 HydrophobicContact CD1-CE1 4.16Å; I267-F275 HydrophobicContact CD1-CG 4.07Å; I267-F275 HydrophobicContact CG2-CD2 3.84Å; I267-F275 HydrophobicContact CG2-CE2 3.78Å; I267-F275 HydrophobicContact CG2-CG 4.32Å; I267-F275 HydrophobicContact CG2-CZ 4.19Å; L272-F275 HydrophobicContact CD1-CB 4.02Å; L272-F275 HydrophobicContact CD1-CD2 4.4Å; F275-L277 HydrophobicContact CD1-CG 4.49Å; F275-L277 HydrophobicContact CE1-CD1 3.67Å; F275-L277 HydrophobicContact CE1-CD2 4.18Å; F275-L277 HydrophobicContact CE1-CG 3.57Å; F275-L277 HydrophobicContact CE2-CD2 4.21Å; F275-L277 HydrophobicContact CE2-CG 4.41Å; F275-L277 HydrophobicContact CZ-CD1 3.81Å; F275-L277 HydrophobicContact CZ-CD2 3.59Å; F275-L277 HydrophobicContact CZ-CG 3.53Å; F275-W313 HydrophobicContact CD1-CZ3 4.21Å; F275-L325 HydrophobicContact CE1-CD1 3.5Å; F275-L325 HydrophobicContact CZ-CD1 3.93Å
276	I	86.7	Confident	86.2	Confident	15 Å²	15	32.5 Å²	32.5	8%	0.077	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	119.4	-175.7	-54.9	-173.3	0	0	0	109.2	Y251 I252 S253 I254 Q278	Y251-I276 HydrophobicContact CE2-CD1 3.88Å; Y251-I276 HydrophobicContact CE2-CG1 4.38Å; Y251-I276 WeakPolarHBondContact OH-CD1 2.99Å; I252-I276 PolarHBondContact O-N 2.89Å; S253-I276 CarbonylContact C-O 3.56Å; S253-I276 WeakPolarHBondContact CA-O 3.19Å; I254-I276 PolarHBondContact N-O 3.46Å; I276-Q278 HydrophobicContact CG2-CG 4.11Å
277	L	87.2	Confident	85.7	Confident	6 Å²	6	32.8 Å²	32.8	3%	0.031	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	101.9	164.9	-67.6	178.2	0	0	0	107.6	I254 L259 I262 F275 C280 Y315 F323 L325	I254-L277 HydrophobicContact CB-CD2 3.99Å; I254-L277 HydrophobicContact CD1-CD2 4.35Å; I254-L277 HydrophobicContact CG1-CD2 4.37Å; L259-L277 HydrophobicContact CD2-CD2 4.33Å; I262-L277 HydrophobicContact CD1-CD1 4.2Å; I262-L277 HydrophobicContact CD1-CD2 4.41Å; F275-L277 HydrophobicContact CD1-CG 4.49Å; F275-L277 HydrophobicContact CE1-CD1 3.67Å; F275-L277 HydrophobicContact CE1-CD2 4.18Å; F275-L277 HydrophobicContact CE1-CG 3.57Å; F275-L277 HydrophobicContact CE2-CD2 4.21Å; F275-L277 HydrophobicContact CE2-CG 4.41Å; F275-L277 HydrophobicContact CZ-CD1 3.81Å; F275-L277 HydrophobicContact CZ-CD2 3.59Å; F275-L277 HydrophobicContact CZ-CG 3.53Å; L277-C280 HydrophobicContact CB-CB 3.79Å; L277-C280 PolarHBondContact O-N 3.01Å; L277-Y315 HydrophobicContact CD1-CD1 4.16Å; L277-Y315 HydrophobicContact CD1-CE1 4.3Å; L277-Y315 HydrophobicContact CD1-CG 4.33Å; L277-F323 HydrophobicContact CD1-CE2 4.16Å; L277-F323 HydrophobicContact CD1-CZ 3.8Å; L277-L325 HydrophobicContact CD1-CD1 4.11Å
278	Q	84.4	Confident	84.8	Confident	19 Å²	19	35.3 Å²	35.3	9%	0.089	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	146.3	179.1	-59.9	175.2	-0.5	0	0	109.6	S86 S253 I254 G256 I276 C280	S86-Q278 VanDerWaalsContact CB-NE2 3.3Å; S86-Q278 VanDerWaalsContact OG-CD 3.25Å; S86-Q278 PolarHBondContact OG-OE1 2.79Å; S253-Q278 PolarHBondContact OG-NE2 2.91Å; I254-Q278 PolarHBondContact O-N 2.8Å; G256-Q278 WeakPolarHBondContact CA-O 3.33Å; G256-Q278 PolarHBondContact N-O 2.99Å; I276-Q278 HydrophobicContact CG2-CG 4.11Å; Q278-C280 PolarHBondContact O-N 2.88Å
279	D	82.4	Confident	83.9	Confident	76 Å²	76	37.7 Å²	37.7	41%	0.406	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.6	2.1	-175.4	-56	-82	0	0	0	115.5	K257 P318	K257-D279 VanDerWaalsContact CE-OD1 3.27Å; K257-D279 WeakPolarHBondContact CE-OD1 3.48Å; K257-D279 WeakPolarHBondContact CE-OD2 3.3Å; K257-D279 HydrophobicContact CG-CB 3.82Å; K257-D279 VanDerWaalsContact CG-CG 3.49Å; K257-D279 VanDerWaalsContact CG-OD2 3.27Å; K257-D279 WeakPolarHBondContact CG-OD2 3.44Å; D279-P318 WeakPolarHBondContact O-CD 3.14Å
280	C	85	Confident	82.9	Confident	6 Å²	6	38.3 Å²	38.3	4%	0.041	19%	0.192	C	C	.	.			trans	-104.2	144.1	172.8	-58.1	0	0	0	0	110.9	L277 Q278 Y315 S316 C317	L277-C280 HydrophobicContact CB-CB 3.79Å; L277-C280 PolarHBondContact O-N 3.01Å; Q278-C280 PolarHBondContact O-N 2.88Å; C280-Y315 HydrophobicContact CB-CD1 4.28Å; C280-S316 CarbonylContact C-O 3.54Å; C280-S316 WeakPolarHBondContact CA-O 3.38Å; C280-C317 HydrophobicContact CB-CB 4.07Å; C280-C317 WeakPolarHBondContact CB-SG 3.27Å; C280-C317 WeakPolarHBondContact SG-CB 2.81Å; C280-C317 CovalentContact SG-SG 2.03Å; C280-C317 PolarHBondContact SG-SG 3.47Å
281	I	84.5	Confident	81.4	Confident	88 Å²	88	45.1 Å²	45.1	45%	0.451	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	128	177.8	-58.2	173.5	0	0	0	108.6	K283 Y315 S316	I281-K283 PolarHBondContact O-N 2.93Å; I281-Y315 CarbonylContact O-C 3.6Å; I281-Y315 WeakPolarHBondContact O-CA 3.23Å; I281-S316 PolarHBondContact N-O 3.25Å; I281-S316 PolarHBondContact O-N 3.03Å
282	R	85.3	Confident	79.6	Confident	23 Å²	23	46.1 Å²	46.1	9%	0.087	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	98.7	169.5	-171.3	174.9	68.9	150.9	10.3	109.3	E285 W313 I314 Y315 R366	R282-E285 IonicContact CZ-OE2 2.71Å; R282-E285 IonicContact NH1-OE2 3.43Å; R282-E285 PolarHBondContact NH1-OE2 2.9Å; R282-E285 IonicContact NH2-OE2 2.82Å; R282-W313 HydrophobicContact CG-CB 4.38Å; R282-W313 VanDerWaalsContact NH1-NE1 3.19Å; R282-I314 CarbonylContact C-O 3.57Å; R282-I314 WeakPolarHBondContact CA-O 3.46Å; R282-Y315 HydrophobicContact CB-CD1 4.14Å; R282-Y315 HydrophobicContact CB-CE1 3.79Å; R282-Y315 HydrophobicContact CG-CE1 4.28Å; R282-R366 PolarHBondContact O-NH2 2.84Å
283	K	83.7	Confident	77.6	Confident	118 Å²	118	52.9 Å²	52.9	51%	0.513	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	-53.3	-179.2	-74.7	-174.5	164	166.4	0	111	I281 I314 S316	I281-K283 PolarHBondContact O-N 2.93Å; K283-I314 HydrophobicContact CB-CG2 4.42Å; K283-I314 PolarHBondContact N-O 3.16Å; K283-S316 VanDerWaalsContact CE-OG 3.31Å; K283-S316 WeakPolarHBondContact CE-OG 3.48Å; K283-S316 PolarHBondContact NZ-OG 3.21Å
284	D	78.6	Confident	75.8	Confident	50 Å²	50	53.4 Å²	53.4	27%	0.267	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	161.4	-170.6	-154.9	1	0	0	0	112.5	I314 Q359	D284-I314 HydrophobicContact CB-CB 4.17Å; D284-I314 HydrophobicContact CB-CD1 4.16Å; D284-I314 HydrophobicContact CB-CG1 4.32Å; D284-I314 PolarHBondContact N-O 3.08Å; D284-I314 PolarHBondContact O-N 3.27Å; D284-Q359 PolarHBondContact OD1-NE2 3.41Å
285	E	81.3	Confident	74.2	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	121.8	173.6	180	171.1	107.3	0	0	108.3	R282 V311 Y312 W313 Y335 Q359 V362	R282-E285 IonicContact CZ-OE2 2.71Å; R282-E285 IonicContact NH1-OE2 3.43Å; R282-E285 PolarHBondContact NH1-OE2 2.9Å; R282-E285 IonicContact NH2-OE2 2.82Å; E285-V311 HydrophobicContact CG-CG1 3.73Å; E285-Y312 CarbonylContact C-O 3.56Å; E285-Y312 VanDerWaalsContact CA-O 3.27Å; E285-Y312 WeakPolarHBondContact CA-O 3.37Å; E285-W313 PolarHBondContact OE2-NE1 3.13Å; E285-Y335 WeakPolarHBondContact OE1-CE1 3.41Å; E285-Y335 PolarHBondContact OE1-OH 3.24Å; E285-Q359 PolarHBondContact O-NE2 3.04Å; E285-V362 HydrophobicContact CB-CG1 4.15Å; E285-V362 HydrophobicContact CG-CG1 4.06Å; E285-V362 WeakPolarHBondContact OE1-CG1 3.25Å
286	I	80.4	Confident	72.3	Confident	31 Å²	31	54.8 Å²	54.8	16%	0.159	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	130.8	-176.6	-49.4	176.2	0	0	0	109	M288 V311 Y312 I314	I286-M288 HydrophobicContact CG2-CE 3.58Å; I286-M288 HydrophobicContact CG2-CG 3.75Å; I286-M288 HydrophobicContact CG2-SD 4.41Å; I286-V311 CarbonylContact O-C 3.6Å; I286-V311 WeakPolarHBondContact O-CA 3.36Å; I286-Y312 PolarHBondContact N-O 3.35Å; I286-Y312 PolarHBondContact O-N 3.44Å; I286-I314 HydrophobicContact CD1-CD1 3.69Å; I286-I314 HydrophobicContact CD1-CG1 4.47Å; I286-I314 HydrophobicContact CG1-CD1 4.41Å
287	I	78.9	Confident	70.6	Confident	5 Å²	5	58.1 Å²	58.1	3%	0.026	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	124.3	171.4	-52.6	-173.7	0	0	0	108.3	C309 L310 V311 Y335 F339 I358 V362	I287-C309 HydrophobicContact CG2-CB 4.11Å; I287-C309 VanDerWaalsContact CG2-SG 3.58Å; I287-L310 CarbonylContact C-O 3.45Å; I287-L310 WeakPolarHBondContact CA-O 3.27Å; I287-V311 HydrophobicContact CG1-CG2 4.19Å; I287-Y335 HydrophobicContact CD1-CD1 3.64Å; I287-Y335 HydrophobicContact CD1-CG 4.13Å; I287-F339 HydrophobicContact CG2-CD2 3.82Å; I287-F339 HydrophobicContact CG2-CE2 4.1Å; I287-I358 HydrophobicContact CB-CG2 3.94Å; I287-I358 HydrophobicContact CD1-CG2 3.86Å; I287-I358 HydrophobicContact CG1-CG2 4.25Å; I287-I358 HydrophobicContact CG2-CG2 4.43Å; I287-V362 HydrophobicContact CD1-CG2 3.3Å; I287-V362 HydrophobicContact CG1-CG2 3.73Å
288	M	74.3	Confident	68.4	Low	53 Å²	53	64.1 Å²	64.1	26%	0.261	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	149.4	179.2	-60.4	-168.4	167.7	0	0	110.7	I286 C309 L310 Y312	I286-M288 HydrophobicContact CG2-CE 3.58Å; I286-M288 HydrophobicContact CG2-CG 3.75Å; I286-M288 HydrophobicContact CG2-SD 4.41Å; M288-C309 CarbonylContact O-C 3.48Å; M288-C309 WeakPolarHBondContact O-CA 3.21Å; M288-L310 PolarHBondContact N-O 3.09Å; M288-L310 PolarHBondContact O-N 3.36Å; M288-Y312 HydrophobicContact CB-CE2 4.26Å; M288-Y312 HydrophobicContact CG-CD2 4.38Å; M288-Y312 HydrophobicContact CG-CE2 4.33Å; M288-Y312 HydrophobicContact SD-CD2 4.46Å; M288-Y312 HydrophobicContact SD-CE2 4.24Å
289	N	68	Low	66.7	Low	51 Å²	51	66.7 Å²	66.7	27%	0.273	38%	0.381	S	S	.	.			trans	-73.9	127.6	167.2	-176.1	-32.3	0	0	0	109.1	L291 V292	N289-L291 PolarHBondContact O-N 3.08Å; N289-L291 VanDerWaalsContact O-N 3.09Å; N289-L291 VanDerWaalsContact OD1-CB 3.31Å; N289-L291 WeakPolarHBondContact OD1-CB 3.37Å; N289-L291 PolarHBondContact OD1-N 2.87Å; N289-V292 HydrophobicContact CB-CG2 4.18Å; N289-V292 WeakPolarHBondContact O-CB 3.34Å; N289-V292 PolarHBondContact O-N 2.94Å
290	P	64.4	Low	65.4	Low	48 Å²	48	64.5 Å²	64.5	31%	0.312	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-21.9	179.7	21.6	-32.3	0	0	0	114.1	V292 D308 L310	P290-V292 PolarHBondContact O-N 2.98Å; P290-D308 WeakPolarHBondContact CD-O 3.5Å; P290-L310 HydrophobicContact CB-CD1 3.64Å; P290-L310 HydrophobicContact CB-CG 3.92Å; P290-L310 HydrophobicContact CG-CG 4.32Å
291	L	58.3	Low	63.9	Low	143 Å²	143	70.1 Å²	70.1	75%	0.749	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-10.4	177.5	-66.6	160.5	0	0	0	113	N289 T293	N289-L291 PolarHBondContact O-N 3.08Å; N289-L291 VanDerWaalsContact O-N 3.09Å; N289-L291 VanDerWaalsContact OD1-CB 3.31Å; N289-L291 WeakPolarHBondContact OD1-CB 3.37Å; N289-L291 PolarHBondContact OD1-N 2.87Å; L291-T293 PolarHBondContact O-N 2.97Å
292	V	54.1	Low	62.7	Low	68 Å²	68	67.6 Å²	67.6	41%	0.412	38%	0.382	S	S	.	.	S	Bend	trans	-81.7	110.6	174.1	-175.2	0	0	0	0	108.4	N289 P290 T294 L295	N289-V292 HydrophobicContact CB-CG2 4.18Å; N289-V292 WeakPolarHBondContact O-CB 3.34Å; N289-V292 PolarHBondContact O-N 2.94Å; P290-V292 PolarHBondContact O-N 2.98Å; V292-T294 HydrophobicContact CG1-CG2 4.23Å; V292-T294 PolarHBondContact O-N 2.95Å; V292-L295 WeakPolarHBondContact O-CD1 3.41Å
293	T	47.8	Very low	61.3	Low	144 Å²	144	74 Å²	74	88%	0.883	41%	0.407	S	S	*	.	S	Bend	trans	-63.1	21.8	-173	38.7	0	0	0	0	116.5	L291	L291-T293 PolarHBondContact O-N 2.97Å
294	T	50	Low	60.1	Low	65 Å²	65	71.5 Å²	71.5	40%	0.399	40%	0.397	S	S	.	.			trans	-101.2	12.1	-176.5	58.2	0	0	0	0	114	V292	V292-T294 HydrophobicContact CG1-CG2 4.23Å; V292-T294 PolarHBondContact O-N 2.95Å
295	L	53.6	Low	59	Low	38 Å²	38	78.8 Å²	78.8	20%	0.199	43%	0.426	C	S	.	.			trans	-65.1	130.9	176.6	-76	78.6	0	0	0	109.3	V292 D297 I300 L310 Y312	V292-L295 WeakPolarHBondContact O-CD1 3.41Å; L295-D297 PolarHBondContact O-N 3.33Å; L295-I300 HydrophobicContact CB-CD1 4.15Å; L295-I300 HydrophobicContact CD2-CB 3.82Å; L295-I300 HydrophobicContact CD2-CD1 3.47Å; L295-I300 VanDerWaalsContact CD2-CD1 3.47Å; L295-I300 HydrophobicContact CD2-CG1 4.19Å; L295-I300 HydrophobicContact CD2-CG2 3.82Å; L295-I300 HydrophobicContact CG-CD1 4.26Å; L295-L310 HydrophobicContact CD2-CD1 4.04Å; L295-Y312 WeakPolarHBondContact CD2-OH 3.5Å; L295-Y312 WeakPolarHBondContact CG-OH 3.31Å
296	P	50.5	Low	58	Low	103 Å²	103	85.5 Å²	85.5	67%	0.669	46%	0.462	S	S	*	.	S	Bend	trans	-68.7	3.2	-179.5	25	-31.7	0	0	0	114.2	I324	P296-I324 HydrophobicContact CG-CD1 4.24Å
297	D	51	Low	57.2	Low	84 Å²	84	85.3 Å²	85.3	45%	0.449	46%	0.461	S	S	.	.			trans	-147.8	118.6	172.8	-132.6	-35.1	0	0	0	109.3	L295 S299 I300	L295-D297 PolarHBondContact O-N 3.33Å; D297-S299 PolarHBondContact O-N 3.02Å; D297-S299 PolarHBondContact OD1-OG 3Å; D297-I300 HydrophobicContact CB-CD1 4.4Å
298	S	41.2	Very low	56.8	Low	133 Å²	133	89 Å²	89	93%	0.93	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	8.9	-178.3	52.6	0	0	0	0	114
299	S	47.8	Very low	57	Low	72 Å²	72	86.5 Å²	86.5	50%	0.503	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	12.7	-174.3	61.1	0	0	0	0	114	D297 E301	D297-S299 PolarHBondContact O-N 3.02Å; D297-S299 PolarHBondContact OD1-OG 3Å; S299-E301 VanDerWaalsContact C-N 3.27Å; S299-E301 PolarHBondContact O-N 2.74Å
300	I	56	Low	57.7	Low	30 Å²	30	84.2 Å²	84.2	15%	0.154	46%	0.456	C	S	.	.			trans	-75.9	80.6	-177.9	-68.8	169.2	0	0	0	109.7	M265 L295 D297 L302 L310 I326	M265-I300 HydrophobicContact CE-CG2 4.42Å; M265-I300 HydrophobicContact SD-CG1 4.3Å; M265-I300 HydrophobicContact SD-CG2 4.14Å; L295-I300 HydrophobicContact CB-CD1 4.15Å; L295-I300 HydrophobicContact CD2-CB 3.82Å; L295-I300 HydrophobicContact CD2-CD1 3.47Å; L295-I300 VanDerWaalsContact CD2-CD1 3.47Å; L295-I300 HydrophobicContact CD2-CG1 4.19Å; L295-I300 HydrophobicContact CD2-CG2 3.82Å; L295-I300 HydrophobicContact CG-CD1 4.26Å; D297-I300 HydrophobicContact CB-CD1 4.4Å; I300-L302 HydrophobicContact CG2-CD1 3.44Å; I300-L302 VanDerWaalsContact CG2-CD1 3.44Å; I300-L302 HydrophobicContact CG2-CG 4.29Å; I300-L302 PolarHBondContact O-N 3.16Å; I300-L310 HydrophobicContact CG2-CD1 4.43Å; I300-I326 HydrophobicContact CD1-CD1 3.9Å; I300-I326 HydrophobicContact CG1-CD1 4.14Å; I300-I326 HydrophobicContact CG2-CD1 3.6Å
301	E	53	Low	58.7	Low	125 Å²	125	81.9 Å²	81.9	58%	0.584	44%	0.442	S	S	*	.			trans	-84.1	92.9	167.8	-68.4	-179.3	-175	0	0	109	R239 M265 S299	R239-E301 PolarHBondContact NH2-O 2.79Å; R239-E301 VanDerWaalsContact NH2-O 3.12Å; M265-E301 WeakPolarHBondContact CE-O 2.82Å; S299-E301 VanDerWaalsContact C-N 3.27Å; S299-E301 PolarHBondContact O-N 2.74Å
302	L	59.7	Low	60	Low	35 Å²	35	75.7 Å²	75.7	18%	0.183	41%	0.408	C	S	.	.			trans	-78.5	127	160	-63.6	109.4	0	0	0	108.2	M265 I300 H304 L310 I326	M265-L302 HydrophobicContact CE-CG 4.32Å; I300-L302 HydrophobicContact CG2-CD1 3.44Å; I300-L302 VanDerWaalsContact CG2-CD1 3.44Å; I300-L302 HydrophobicContact CG2-CG 4.29Å; I300-L302 PolarHBondContact O-N 3.16Å; L302-H304 PolarHBondContact O-N 2.86Å; L302-H304 VanDerWaalsContact O-N 3.13Å; L302-L310 HydrophobicContact CD1-CD1 3.61Å; L302-L310 HydrophobicContact CD1-CD2 3.24Å; L302-L310 HydrophobicContact CD1-CG 4.03Å; L302-L310 HydrophobicContact CD2-CD2 3.49Å; L302-L310 VanDerWaalsContact CD2-CD2 3.49Å; L302-L310 HydrophobicContact CG-CD2 3.94Å; L302-I326 HydrophobicContact CD2-CG2 4.23Å
303	Y	54.1	Low	61.7	Low	157 Å²	157	73 Å²	73	62%	0.616	39%	0.391	S	S	*	.	S	Bend	trans	-72.3	-2.4	-179.2	-79.8	-83.8	0	0	0	113.8
304	H	58.6	Low	63.6	Low	66 Å²	66	68 Å²	68	31%	0.306	36%	0.358	S	S	.	.			trans	-103.5	98.8	-176.5	-66	-65.1	0	0	0	110.1	L302 D306 L307 L329	L302-H304 PolarHBondContact O-N 2.86Å; L302-H304 VanDerWaalsContact O-N 3.13Å; H304-D306 PolarHBondContact O-N 3.49Å; H304-D306 VanDerWaalsContact O-N 3.13Å; H304-L307 HydrophobicContact CB-CD1 3.92Å; H304-L307 HydrophobicContact CB-CG 4.2Å; H304-L329 WeakPolarHBondContact CD2-CD2 3.47Å; H304-L329 WeakPolarHBondContact NE2-CD1 3.34Å; H304-L329 WeakPolarHBondContact NE2-CD2 3.49Å
305	K	56.1	Low	65.3	Low	203 Å²	203	65.5 Å²	65.5	88%	0.883	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-10.8	176.2	-68.9	-174.4	176.4	-176.8	0	114
306	D	61.2	Low	66.8	Low	141 Å²	141	64.8 Å²	64.8	75%	0.754	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	8.7	-172.4	-48.2	-35.4	0	0	0	113.4	H304	H304-D306 PolarHBondContact O-N 3.49Å; H304-D306 VanDerWaalsContact O-N 3.13Å
307	L	63.7	Low	68.4	Low	27 Å²	27	60.2 Å²	60.2	14%	0.141	31%	0.31	C	S	.	.			trans	-105.4	106.1	178.9	-67.4	173.3	0	0	0	110.3	H304 C309 Q332 R333 C336	H304-L307 HydrophobicContact CB-CD1 3.92Å; H304-L307 HydrophobicContact CB-CG 4.2Å; L307-C309 PolarHBondContact O-N 2.8Å; L307-Q332 HydrophobicContact CD1-CB 3.98Å; L307-R333 HydrophobicContact CD2-CG 4.4Å; L307-C336 HydrophobicContact CD2-CB 4.22Å
308	D	70.3	Confident	69.5	Low	83 Å²	83	60.9 Å²	60.9	44%	0.444	32%	0.319	S	S	.	.	S	Bend	trans	-78.3	4.4	174.8	-55.2	-47.4	0	0	0	113.2	P290 N340	P290-D308 WeakPolarHBondContact CD-O 3.5Å; D308-N340 PolarHBondContact OD2-ND2 2.02Å
309	C	77.9	Confident	71	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.298	C	S	.	.			trans	-144.6	155.8	-175.9	115.9	0	0	0	0	111.3	I287 M288 L307 C336 F339	I287-C309 HydrophobicContact CG2-CB 4.11Å; I287-C309 VanDerWaalsContact CG2-SG 3.58Å; M288-C309 CarbonylContact O-C 3.48Å; M288-C309 WeakPolarHBondContact O-CA 3.21Å; L307-C309 PolarHBondContact O-N 2.8Å; C309-C336 HydrophobicContact CB-CB 3.74Å; C309-C336 WeakPolarHBondContact CB-SG 3.37Å; C309-C336 PolarHBondContact O-SG 3.46Å; C309-C336 WeakPolarHBondContact SG-CA 3.19Å; C309-C336 WeakPolarHBondContact SG-CB 3.38Å; C309-C336 CovalentContact SG-SG 2.02Å; C309-C336 PolarHBondContact SG-SG 3.06Å; C309-F339 HydrophobicContact CB-CD1 4.4Å; C309-F339 HydrophobicContact CB-CG 4.37Å
310	L	82.7	Confident	72.2	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.016	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	126.3	174.7	-67.6	-179.5	0	0	0	110.8	I287 M288 P290 L295 I300 L302 Y312	I287-L310 CarbonylContact C-O 3.45Å; I287-L310 WeakPolarHBondContact CA-O 3.27Å; M288-L310 PolarHBondContact N-O 3.09Å; M288-L310 PolarHBondContact O-N 3.36Å; P290-L310 HydrophobicContact CB-CD1 3.64Å; P290-L310 HydrophobicContact CB-CG 3.92Å; P290-L310 HydrophobicContact CG-CG 4.32Å; L295-L310 HydrophobicContact CD2-CD1 4.04Å; I300-L310 HydrophobicContact CG2-CD1 4.43Å; L302-L310 HydrophobicContact CD1-CD1 3.61Å; L302-L310 HydrophobicContact CD1-CD2 3.24Å; L302-L310 HydrophobicContact CD1-CG 4.03Å; L302-L310 HydrophobicContact CD2-CD2 3.49Å; L302-L310 VanDerWaalsContact CD2-CD2 3.49Å; L302-L310 HydrophobicContact CG-CD2 3.94Å; L310-Y312 HydrophobicContact CB-CE2 4.02Å; L310-Y312 WeakPolarHBondContact CD1-OH 3.14Å
311	V	85.3	Confident	73.3	Confident	0 Å²	0	61 Å²	61	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	123.4	173.8	-172.1	0	0	0	0	109.6	E285 I286 I287 A327 T331 Q332 Y335	E285-V311 HydrophobicContact CG-CG1 3.73Å; I286-V311 CarbonylContact O-C 3.6Å; I286-V311 WeakPolarHBondContact O-CA 3.36Å; I287-V311 HydrophobicContact CG1-CG2 4.19Å; V311-A327 HydrophobicContact CB-CB 3.85Å; V311-A327 HydrophobicContact CG1-CB 3.96Å; V311-A327 PolarHBondContact O-N 3.22Å; V311-T331 HydrophobicContact CG1-CG2 4.4Å; V311-Q332 PolarHBondContact O-NE2 3.08Å; V311-Y335 HydrophobicContact CG2-CD2 4.43Å; V311-Y335 HydrophobicContact CG2-CG 4.13Å
312	Y	86.3	Confident	74.8	Confident	12 Å²	12	58.7 Å²	58.7	5%	0.047	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	144	172.1	-64.2	-75.2	0	0	0	110.6	E285 I286 M288 L295 L310 I324 L325 I326	E285-Y312 CarbonylContact C-O 3.56Å; E285-Y312 VanDerWaalsContact CA-O 3.27Å; E285-Y312 WeakPolarHBondContact CA-O 3.37Å; I286-Y312 PolarHBondContact N-O 3.35Å; I286-Y312 PolarHBondContact O-N 3.44Å; M288-Y312 HydrophobicContact CB-CE2 4.26Å; M288-Y312 HydrophobicContact CG-CD2 4.38Å; M288-Y312 HydrophobicContact CG-CE2 4.33Å; M288-Y312 HydrophobicContact SD-CD2 4.46Å; M288-Y312 HydrophobicContact SD-CE2 4.24Å; L295-Y312 WeakPolarHBondContact CD2-OH 3.5Å; L295-Y312 WeakPolarHBondContact CG-OH 3.31Å; L310-Y312 HydrophobicContact CB-CE2 4.02Å; L310-Y312 WeakPolarHBondContact CD1-OH 3.14Å; Y312-I324 HydrophobicContact CD1-CG2 3.39Å; Y312-I324 HydrophobicContact CE1-CG2 4.26Å; Y312-I324 HydrophobicContact CG-CG2 4Å; Y312-L325 CarbonylContact C-O 3.57Å; Y312-L325 WeakPolarHBondContact CA-O 3.45Å; Y312-I326 HydrophobicContact CD1-CG1 3.69Å; Y312-I326 HydrophobicContact CE1-CD1 3.84Å; Y312-I326 HydrophobicContact CE1-CG1 3.37Å
313	W	89	Confident	76.1	Confident	13 Å²	13	57.9 Å²	57.9	5%	0.049	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	127.5	169	-64.2	-26.5	0	0	0	109.6	I267 F275 R282 E285 Y315 I324 L325 A327 T331	I267-W313 HydrophobicContact CD1-CE3 3.9Å; I267-W313 HydrophobicContact CD1-CH2 4.35Å; I267-W313 HydrophobicContact CD1-CZ3 3.39Å; F275-W313 HydrophobicContact CD1-CZ3 4.21Å; R282-W313 HydrophobicContact CG-CB 4.38Å; R282-W313 VanDerWaalsContact NH1-NE1 3.19Å; E285-W313 PolarHBondContact OE2-NE1 3.13Å; W313-Y315 HydrophobicContact CB-CD2 3.99Å; W313-Y315 HydrophobicContact CB-CE2 3.41Å; W313-Y315 VanDerWaalsContact CB-CE2 3.41Å; W313-Y315 HydrophobicContact CD2-CE2 4.38Å; W313-Y315 AromaticContact CE3-CE2 3.97Å; W313-Y315 HydrophobicContact CE3-CE2 3.97Å; W313-Y315 HydrophobicContact CG-CE2 4.23Å; W313-I324 CarbonylContact O-C 3.56Å; W313-I324 WeakPolarHBondContact O-CA 3.37Å; W313-L325 PolarHBondContact N-O 2.87Å; W313-L325 PolarHBondContact O-N 3.15Å; W313-A327 HydrophobicContact CD2-CB 4.09Å; W313-A327 HydrophobicContact CE3-CB 4.49Å; W313-A327 HydrophobicContact CH2-CB 4.16Å; W313-A327 HydrophobicContact CZ2-CB 3.73Å; W313-T331 HydrophobicContact CZ2-CG2 3.73Å
314	I	86.8	Confident	77.7	Confident	38 Å²	38	53.3 Å²	53.3	20%	0.195	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	117.6	174.1	-56.1	-174.1	0	0	0	108.3	R282 K283 D284 I286 F323 I324	R282-I314 CarbonylContact C-O 3.57Å; R282-I314 WeakPolarHBondContact CA-O 3.46Å; K283-I314 HydrophobicContact CB-CG2 4.42Å; K283-I314 PolarHBondContact N-O 3.16Å; D284-I314 HydrophobicContact CB-CB 4.17Å; D284-I314 HydrophobicContact CB-CD1 4.16Å; D284-I314 HydrophobicContact CB-CG1 4.32Å; D284-I314 PolarHBondContact N-O 3.08Å; D284-I314 PolarHBondContact O-N 3.27Å; I286-I314 HydrophobicContact CD1-CD1 3.69Å; I286-I314 HydrophobicContact CD1-CG1 4.47Å; I286-I314 HydrophobicContact CG1-CD1 4.41Å; I314-F323 WeakPolarHBondContact CA-O 3.43Å; I314-I324 HydrophobicContact CG1-CG1 4.29Å
315	Y	87.4	Confident	79.1	Confident	12 Å²	12	50.2 Å²	50.2	5%	0.047	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	151.1	177.5	-75.2	-90.5	0	0	0	111.2	L277 C280 I281 R282 W313 P322 F323 L325	L277-Y315 HydrophobicContact CD1-CD1 4.16Å; L277-Y315 HydrophobicContact CD1-CE1 4.3Å; L277-Y315 HydrophobicContact CD1-CG 4.33Å; C280-Y315 HydrophobicContact CB-CD1 4.28Å; I281-Y315 CarbonylContact O-C 3.6Å; I281-Y315 WeakPolarHBondContact O-CA 3.23Å; R282-Y315 HydrophobicContact CB-CD1 4.14Å; R282-Y315 HydrophobicContact CB-CE1 3.79Å; R282-Y315 HydrophobicContact CG-CE1 4.28Å; W313-Y315 HydrophobicContact CB-CD2 3.99Å; W313-Y315 HydrophobicContact CB-CE2 3.41Å; W313-Y315 VanDerWaalsContact CB-CE2 3.41Å; W313-Y315 HydrophobicContact CD2-CE2 4.38Å; W313-Y315 AromaticContact CE3-CE2 3.97Å; W313-Y315 HydrophobicContact CE3-CE2 3.97Å; W313-Y315 HydrophobicContact CG-CE2 4.23Å; Y315-P322 CarbonylContact O-C 3.56Å; Y315-P322 WeakPolarHBondContact O-CA 3.39Å; Y315-F323 HydrophobicContact CD2-CE2 4.06Å; Y315-F323 HydrophobicContact CD2-CZ 4.46Å; Y315-F323 HydrophobicContact CG-CE2 4.07Å; Y315-F323 HydrophobicContact CG-CZ 4.01Å; Y315-F323 PolarHBondContact N-O 3.27Å; Y315-F323 PolarHBondContact O-N 2.91Å; Y315-L325 HydrophobicContact CD2-CD1 3.96Å; Y315-L325 HydrophobicContact CD2-CG 4.31Å; Y315-L325 HydrophobicContact CE2-CB 4.37Å; Y315-L325 HydrophobicContact CE2-CD1 3.81Å; Y315-L325 HydrophobicContact CE2-CG 4.43Å
316	S	84.9	Confident	80.7	Confident	24 Å²	24	40.5 Å²	40.5	17%	0.168	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	125.6	172.4	-165.5	0	0	0	0	108.6	C280 I281 K283	C280-S316 CarbonylContact C-O 3.54Å; C280-S316 WeakPolarHBondContact CA-O 3.38Å; I281-S316 PolarHBondContact N-O 3.25Å; I281-S316 PolarHBondContact O-N 3.03Å; K283-S316 VanDerWaalsContact CE-OG 3.31Å; K283-S316 WeakPolarHBondContact CE-OG 3.48Å; K283-S316 PolarHBondContact NZ-OG 3.21Å
317	C	83	Confident	82	Confident	7 Å²	7	33.8 Å²	33.8	5%	0.047	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	155.2	176.3	-43.6	0	0	0	0	109.6	C280 N319 Y320 F323	C280-C317 HydrophobicContact CB-CB 4.07Å; C280-C317 WeakPolarHBondContact CB-SG 3.27Å; C280-C317 WeakPolarHBondContact SG-CB 2.81Å; C280-C317 CovalentContact SG-SG 2.03Å; C280-C317 PolarHBondContact SG-SG 3.47Å; C317-N319 VanDerWaalsContact C-N 3.26Å; C317-N319 PolarHBondContact O-N 3.07Å; C317-N319 VanDerWaalsContact O-N 3.15Å; C317-Y320 PolarHBondContact O-N 2.85Å; C317-F323 VanDerWaalsContact SG-CE1 3.56Å
318	P	74.6	Confident	83.3	Confident	98 Å²	98	32.7 Å²	32.7	64%	0.636	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-39.6	-176.1	-30.1	31.1	0	0	0	114.5	D279	D279-P318 WeakPolarHBondContact O-CD 3.14Å
319	N	72.1	Confident	84.1	Confident	89 Å²	89	29.2 Å²	29.2	48%	0.476	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.5	15.4	-174.5	-64.3	-41.7	0	0	0	113	K257 R260 C317	K257-N319 PolarHBondContact O-ND2 2.83Å; R260-N319 VanDerWaalsContact CZ-O 3.32Å; R260-N319 PolarHBondContact NH1-O 3.2Å; C317-N319 VanDerWaalsContact C-N 3.26Å; C317-N319 PolarHBondContact O-N 3.07Å; C317-N319 VanDerWaalsContact O-N 3.15Å
320	Y	72.8	Confident	84.5	Confident	47 Å²	47	33 Å²	33	18%	0.184	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	137.6	-173.8	-165.5	-134.5	0	0	0	112	R260 C317 F323	R260-Y320 VanDerWaalsContact C-CZ 3.49Å; R260-Y320 WeakPolarHBondContact O-CE2 3.46Å; R260-Y320 PolarHBondContact O-OH 3.27Å; C317-Y320 PolarHBondContact O-N 2.85Å; Y320-F323 AromaticContact CD1-CD1 3.26Å; Y320-F323 HydrophobicContact CD1-CD1 3.26Å; Y320-F323 AromaticContact CD1-CE1 3.58Å; Y320-F323 HydrophobicContact CD1-CE1 3.58Å; Y320-F323 HydrophobicContact CD1-CG 4.19Å; Y320-F323 HydrophobicContact CE1-CB 3.95Å; Y320-F323 AromaticContact CE1-CD1 3.31Å; Y320-F323 HydrophobicContact CE1-CD1 3.31Å; Y320-F323 AromaticContact CE1-CE1 3.92Å; Y320-F323 HydrophobicContact CE1-CE1 3.92Å; Y320-F323 AromaticContact CE1-CG 3.77Å; Y320-F323 HydrophobicContact CE1-CG 3.77Å
321	T	80.2	Confident	84.7	Confident	100 Å²	100	32.9 Å²	32.9	61%	0.613	18%	0.18	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-57.6	145.5	174.2	49.2	0	0	0	0	109.1	F323	T321-F323 PolarHBondContact O-N 2.89Å
322	P	84.4	Confident	84.7	Confident	78 Å²	78	32.9 Å²	32.9	51%	0.506	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.1	137.8	175.9	-26.4	34.3	0	0	0	111.4	Y315	Y315-P322 CarbonylContact O-C 3.56Å; Y315-P322 WeakPolarHBondContact O-CA 3.39Å
323	F	85.9	Confident	84.7	Confident	18 Å²	18	38.6 Å²	38.6	8%	0.079	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	162.3	-178.5	63.8	-87.4	0	0	0	110.3	L259 I262 L277 I314 Y315 C317 Y320 T321 L325	L259-F323 HydrophobicContact CD2-CZ 4.41Å; I262-F323 HydrophobicContact CD1-CE2 4.34Å; I262-F323 HydrophobicContact CG2-CD1 4.45Å; I262-F323 HydrophobicContact CG2-CD2 3.26Å; I262-F323 HydrophobicContact CG2-CE1 4.46Å; I262-F323 HydrophobicContact CG2-CE2 3.31Å; I262-F323 HydrophobicContact CG2-CG 3.87Å; I262-F323 HydrophobicContact CG2-CZ 3.93Å; L277-F323 HydrophobicContact CD1-CE2 4.16Å; L277-F323 HydrophobicContact CD1-CZ 3.8Å; I314-F323 WeakPolarHBondContact CA-O 3.43Å; Y315-F323 HydrophobicContact CD2-CE2 4.06Å; Y315-F323 HydrophobicContact CD2-CZ 4.46Å; Y315-F323 HydrophobicContact CG-CE2 4.07Å; Y315-F323 HydrophobicContact CG-CZ 4.01Å; Y315-F323 PolarHBondContact N-O 3.27Å; Y315-F323 PolarHBondContact O-N 2.91Å; C317-F323 VanDerWaalsContact SG-CE1 3.56Å; Y320-F323 AromaticContact CD1-CD1 3.26Å; Y320-F323 HydrophobicContact CD1-CD1 3.26Å; Y320-F323 AromaticContact CD1-CE1 3.58Å; Y320-F323 HydrophobicContact CD1-CE1 3.58Å; Y320-F323 HydrophobicContact CD1-CG 4.19Å; Y320-F323 HydrophobicContact CE1-CB 3.95Å; Y320-F323 AromaticContact CE1-CD1 3.31Å; Y320-F323 HydrophobicContact CE1-CD1 3.31Å; Y320-F323 AromaticContact CE1-CE1 3.92Å; Y320-F323 HydrophobicContact CE1-CE1 3.92Å; Y320-F323 AromaticContact CE1-CG 3.77Å; Y320-F323 HydrophobicContact CE1-CG 3.77Å; T321-F323 PolarHBondContact O-N 2.89Å; F323-L325 HydrophobicContact CD2-CD2 4.47Å; F323-L325 HydrophobicContact CD2-CG 4.07Å; F323-L325 HydrophobicContact CE2-CD1 3.9Å; F323-L325 HydrophobicContact CE2-CD2 4.38Å; F323-L325 HydrophobicContact CE2-CG 3.81Å
324	I	87.5	Confident	84.4	Confident	61 Å²	61	42.3 Å²	42.3	31%	0.313	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	141.1	-177.7	-63.7	167	0	0	0	108.8	V264 P296 Y312 W313 I314	V264-I324 HydrophobicContact CG2-CB 4.49Å; V264-I324 HydrophobicContact CG2-CG2 4.16Å; P296-I324 HydrophobicContact CG-CD1 4.24Å; Y312-I324 HydrophobicContact CD1-CG2 3.39Å; Y312-I324 HydrophobicContact CE1-CG2 4.26Å; Y312-I324 HydrophobicContact CG-CG2 4Å; W313-I324 CarbonylContact O-C 3.56Å; W313-I324 WeakPolarHBondContact O-CA 3.37Å; I314-I324 HydrophobicContact CG1-CG1 4.29Å
325	L	89.5	Confident	84.1	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	138.3	164.9	-70.5	177.4	0	0	0	109.7	I262 D263 F275 L277 Y312 W313 Y315 F323	I262-L325 HydrophobicContact CD1-CD1 3.9Å; I262-L325 HydrophobicContact CD1-CD2 3.87Å; I262-L325 HydrophobicContact CD1-CG 4.43Å; I262-L325 HydrophobicContact CG1-CD2 3.88Å; I262-L325 HydrophobicContact CG2-CD2 4.16Å; D263-L325 WeakPolarHBondContact O-CD2 3.28Å; F275-L325 HydrophobicContact CE1-CD1 3.5Å; F275-L325 HydrophobicContact CZ-CD1 3.93Å; L277-L325 HydrophobicContact CD1-CD1 4.11Å; Y312-L325 CarbonylContact C-O 3.57Å; Y312-L325 WeakPolarHBondContact CA-O 3.45Å; W313-L325 PolarHBondContact N-O 2.87Å; W313-L325 PolarHBondContact O-N 3.15Å; Y315-L325 HydrophobicContact CD2-CD1 3.96Å; Y315-L325 HydrophobicContact CD2-CG 4.31Å; Y315-L325 HydrophobicContact CE2-CB 4.37Å; Y315-L325 HydrophobicContact CE2-CD1 3.81Å; Y315-L325 HydrophobicContact CE2-CG 4.43Å; F323-L325 HydrophobicContact CD2-CD2 4.47Å; F323-L325 HydrophobicContact CD2-CG 4.07Å; F323-L325 HydrophobicContact CE2-CD1 3.9Å; F323-L325 HydrophobicContact CE2-CD2 4.38Å; F323-L325 HydrophobicContact CE2-CG 3.81Å
326	I	88.2	Confident	83.8	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	129.7	166.9	-71	172.6	0	0	0	108.2	V264 M265 I267 A268 I300 L302 Y312 Q332	V264-I326 HydrophobicContact CG2-CD1 4.45Å; V264-I326 HydrophobicContact CG2-CG1 4.19Å; V264-I326 PolarHBondContact O-N 2.87Å; M265-I326 HydrophobicContact SD-CD1 3.31Å; M265-I326 WeakPolarHBondContact SD-CD1 3.4Å; M265-I326 HydrophobicContact SD-CG1 4.38Å; I267-I326 VanDerWaalsContact CG1-O 3.24Å; I267-I326 WeakPolarHBondContact CG1-O 3.32Å; A268-I326 HydrophobicContact CB-CB 3.93Å; A268-I326 HydrophobicContact CB-CG2 3.62Å; I300-I326 HydrophobicContact CD1-CD1 3.9Å; I300-I326 HydrophobicContact CG1-CD1 4.14Å; I300-I326 HydrophobicContact CG2-CD1 3.6Å; L302-I326 HydrophobicContact CD2-CG2 4.23Å; Y312-I326 HydrophobicContact CD1-CG1 3.69Å; Y312-I326 HydrophobicContact CE1-CD1 3.84Å; Y312-I326 HydrophobicContact CE1-CG1 3.37Å; I326-Q332 VanDerWaalsContact CG2-NE2 3.32Å
327	A	89.1	Confident	83.4	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-63.8	154.8	179.7	0	0	0	0	0	111.8	V311 W313 T331 Q332	V311-A327 HydrophobicContact CB-CB 3.85Å; V311-A327 HydrophobicContact CG1-CB 3.96Å; V311-A327 PolarHBondContact O-N 3.22Å; W313-A327 HydrophobicContact CD2-CB 4.09Å; W313-A327 HydrophobicContact CE3-CB 4.49Å; W313-A327 HydrophobicContact CH2-CB 4.16Å; W313-A327 HydrophobicContact CZ2-CB 3.73Å; A327-T331 HydrophobicContact CB-CG2 3.62Å; A327-Q332 WeakPolarHBondContact O-CG 3.38Å; A327-Q332 PolarHBondContact O-NE2 2.97Å
328	D	90.4	Very high	82.7	Confident	4 Å²	4	49.6 Å²	49.6	2%	0.021	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-65.9	161.6	179.2	79.5	93.1	0	0	0	112.6	I267 L270 L272 K330 T331 Q332	I267-D328 WeakPolarHBondContact O-CA 3.41Å; L270-D328 WeakPolarHBondContact O-CB 3.28Å; L272-D328 HydrophobicContact CB-CB 4.39Å; L272-D328 HydrophobicContact CG-CB 4.45Å; L272-D328 PolarHBondContact N-OD1 3.38Å; D328-K330 VanDerWaalsContact C-N 3.26Å; D328-K330 PolarHBondContact O-N 2.9Å; D328-K330 VanDerWaalsContact O-N 3.17Å; D328-K330 WeakPolarHBondContact OD1-CA 3.31Å; D328-K330 WeakPolarHBondContact OD1-CB 3.45Å; D328-K330 PolarHBondContact OD1-N 3.34Å; D328-T331 CarbonylContact O-C 3.57Å; D328-T331 WeakPolarHBondContact O-CA 3.46Å; D328-T331 WeakPolarHBondContact O-CB 3.36Å; D328-T331 PolarHBondContact O-N 3.47Å; D328-T331 PolarHBondContact OD1-N 3.45Å; D328-T331 VanDerWaalsContact OD2-CB 3.23Å; D328-T331 WeakPolarHBondContact OD2-CB 3.31Å; D328-T331 PolarHBondContact OD2-OG1 3.01Å; D328-Q332 WeakPolarHBondContact O-CG 3.42Å; D328-Q332 PolarHBondContact O-N 3.15Å
329	L	87.2	Confident	82.1	Confident	10 Å²	10	45.7 Å²	45.7	5%	0.052	21%	0.213	C	C	.	.	H	α-helix	trans	-56.6	-35.6	-175.8	-64.8	178.2	0	0	0	113.9	A268 L270 H304 T331 R333	A268-L329 WeakPolarHBondContact O-CD2 3.29Å; A268-L329 WeakPolarHBondContact O-CG 3.42Å; L270-L329 WeakPolarHBondContact O-CB 3.37Å; L270-L329 PolarHBondContact O-N 2.83Å; H304-L329 WeakPolarHBondContact CD2-CD2 3.47Å; H304-L329 WeakPolarHBondContact NE2-CD1 3.34Å; H304-L329 WeakPolarHBondContact NE2-CD2 3.49Å; L329-T331 VanDerWaalsContact C-N 3.35Å; L329-R333 WeakPolarHBondContact O-CB 3.44Å; L329-R333 VanDerWaalsContact O-CG 3.27Å; L329-R333 WeakPolarHBondContact O-CG 3.45Å; L329-R333 PolarHBondContact O-N 3.44Å
330	K	87.6	Confident	81.5	Confident	78 Å²	78	44.3 Å²	44.3	34%	0.339	21%	0.206	S	C	.	.	H	α-helix	trans	-66.7	-43.2	178.9	-163.8	-176.5	-175.5	-178.8	0	109.9	T271 L272 D273 D328 R334	T271-K330 HydrophobicContact CG2-CB 4Å; T271-K330 HydrophobicContact CG2-CG 4.5Å; L272-K330 WeakPolarHBondContact O-CD 3.3Å; D273-K330 IonicContact OD1-NZ 3.3Å; D273-K330 PolarHBondContact OD1-NZ 2.91Å; D328-K330 VanDerWaalsContact C-N 3.26Å; D328-K330 PolarHBondContact O-N 2.9Å; D328-K330 VanDerWaalsContact O-N 3.17Å; D328-K330 WeakPolarHBondContact OD1-CA 3.31Å; D328-K330 WeakPolarHBondContact OD1-CB 3.45Å; D328-K330 PolarHBondContact OD1-N 3.34Å; K330-R334 WeakPolarHBondContact O-CB 3.12Å; K330-R334 PolarHBondContact O-N 3.36Å
331	T	87.3	Confident	80.7	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.006	22%	0.224	C	C	.	.	H	α-helix	trans	-65.9	-50.4	174.8	-63.2	0	0	0	0	110.7	V311 W313 A327 D328 L329 R333 R334 Y335	V311-T331 HydrophobicContact CG1-CG2 4.4Å; W313-T331 HydrophobicContact CZ2-CG2 3.73Å; A327-T331 HydrophobicContact CB-CG2 3.62Å; D328-T331 CarbonylContact O-C 3.57Å; D328-T331 WeakPolarHBondContact O-CA 3.46Å; D328-T331 WeakPolarHBondContact O-CB 3.36Å; D328-T331 PolarHBondContact O-N 3.47Å; D328-T331 PolarHBondContact OD1-N 3.45Å; D328-T331 VanDerWaalsContact OD2-CB 3.23Å; D328-T331 WeakPolarHBondContact OD2-CB 3.31Å; D328-T331 PolarHBondContact OD2-OG1 3.01Å; L329-T331 VanDerWaalsContact C-N 3.35Å; T331-R333 PolarHBondContact O-N 3.47Å; T331-R334 PolarHBondContact O-N 3.21Å; T331-R334 VanDerWaalsContact O-N 3.09Å; T331-Y335 HydrophobicContact CG2-CD2 3.5Å; T331-Y335 HydrophobicContact CG2-CE2 3.62Å; T331-Y335 WeakPolarHBondContact O-CD2 3.44Å; T331-Y335 PolarHBondContact O-N 2.91Å
332	Q	85.4	Confident	79.3	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-51.2	-53.5	178	-64.7	-63.7	-10.5	0	0	111.2	L307 V311 I326 A327 D328 R334 Y335 C336	L307-Q332 HydrophobicContact CD1-CB 3.98Å; V311-Q332 PolarHBondContact O-NE2 3.08Å; I326-Q332 VanDerWaalsContact CG2-NE2 3.32Å; A327-Q332 WeakPolarHBondContact O-CG 3.38Å; A327-Q332 PolarHBondContact O-NE2 2.97Å; D328-Q332 WeakPolarHBondContact O-CG 3.42Å; D328-Q332 PolarHBondContact O-N 3.15Å; Q332-R334 VanDerWaalsContact C-N 3.31Å; Q332-R334 PolarHBondContact O-N 2.67Å; Q332-Y335 PolarHBondContact O-N 3.27Å; Q332-C336 VanDerWaalsContact O-CB 3.24Å; Q332-C336 WeakPolarHBondContact O-CB 3.24Å; Q332-C336 PolarHBondContact O-N 3.5Å; Q332-C336 PolarHBondContact O-SG 3.38Å
333	R	84.6	Confident	77.4	Confident	132 Å²	132	47.7 Å²	47.7	50%	0.498	22%	0.222	S	C	.	.	H	α-helix	trans	-58.6	-39.7	179.6	-72.2	174.3	-172.5	156.4	5.3	113.2	L307 L329 T331 R337	L307-R333 HydrophobicContact CD2-CG 4.4Å; L329-R333 WeakPolarHBondContact O-CB 3.44Å; L329-R333 VanDerWaalsContact O-CG 3.27Å; L329-R333 WeakPolarHBondContact O-CG 3.45Å; L329-R333 PolarHBondContact O-N 3.44Å; T331-R333 PolarHBondContact O-N 3.47Å; R333-R337 WeakPolarHBondContact O-CB 3.38Å; R333-R337 PolarHBondContact O-N 3.13Å; R333-R337 VanDerWaalsContact O-N 3.08Å
334	R	83.3	Confident	75	Confident	92 Å²	92	52.2 Å²	52.2	35%	0.347	25%	0.254	S	S	.	.	H	α-helix	trans	-65.1	-49.2	-179.7	-179.7	178.4	176.9	170.4	-2.2	111.3	K330 T331 Q332 T338	K330-R334 WeakPolarHBondContact O-CB 3.12Å; K330-R334 PolarHBondContact O-N 3.36Å; T331-R334 PolarHBondContact O-N 3.21Å; T331-R334 VanDerWaalsContact O-N 3.09Å; Q332-R334 VanDerWaalsContact C-N 3.31Å; Q332-R334 PolarHBondContact O-N 2.67Å; R334-T338 PolarHBondContact O-N 3.3Å; R334-T338 PolarHBondContact O-OG1 3.31Å
335	Y	80.4	Confident	72.6	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.008	28%	0.277	C	S	.	.	H	α-helix	trans	-76.4	-43.7	-175.9	-79.1	-85.4	0	0	0	111.9	E285 I287 V311 T331 Q332 R337 T338 F339 V362 L365	E285-Y335 WeakPolarHBondContact OE1-CE1 3.41Å; E285-Y335 PolarHBondContact OE1-OH 3.24Å; I287-Y335 HydrophobicContact CD1-CD1 3.64Å; I287-Y335 HydrophobicContact CD1-CG 4.13Å; V311-Y335 HydrophobicContact CG2-CD2 4.43Å; V311-Y335 HydrophobicContact CG2-CG 4.13Å; T331-Y335 HydrophobicContact CG2-CD2 3.5Å; T331-Y335 HydrophobicContact CG2-CE2 3.62Å; T331-Y335 WeakPolarHBondContact O-CD2 3.44Å; T331-Y335 PolarHBondContact O-N 2.91Å; Q332-Y335 PolarHBondContact O-N 3.27Å; Y335-R337 VanDerWaalsContact C-N 3.33Å; Y335-R337 PolarHBondContact O-N 3.25Å; Y335-T338 WeakPolarHBondContact O-CB 3.09Å; Y335-T338 PolarHBondContact O-N 3.04Å; Y335-F339 PolarHBondContact O-N 2.79Å; Y335-V362 HydrophobicContact CE1-CG1 4.41Å; Y335-V362 HydrophobicContact CE1-CG2 4.47Å; Y335-L365 HydrophobicContact CD1-CB 4.46Å; Y335-L365 HydrophobicContact CD1-CD1 3.46Å; Y335-L365 VanDerWaalsContact CD1-CD1 3.46Å; Y335-L365 HydrophobicContact CE1-CB 3.64Å; Y335-L365 HydrophobicContact CE1-CD1 3.5Å; Y335-L365 HydrophobicContact CE1-CG 4.22Å; Y335-L365 HydrophobicContact CG-CD1 4.36Å
336	C	82.1	Confident	70	Confident	4 Å²	4	63.3 Å²	63.3	3%	0.027	32%	0.319	C	S	.	.	H	α-helix	trans	-65.5	-33.8	177.6	-57.6	0	0	0	0	113.1	L307 C309 Q332 T338 F339 N340	L307-C336 HydrophobicContact CD2-CB 4.22Å; C309-C336 HydrophobicContact CB-CB 3.74Å; C309-C336 WeakPolarHBondContact CB-SG 3.37Å; C309-C336 PolarHBondContact O-SG 3.46Å; C309-C336 WeakPolarHBondContact SG-CA 3.19Å; C309-C336 WeakPolarHBondContact SG-CB 3.38Å; C309-C336 CovalentContact SG-SG 2.02Å; C309-C336 PolarHBondContact SG-SG 3.06Å; Q332-C336 VanDerWaalsContact O-CB 3.24Å; Q332-C336 WeakPolarHBondContact O-CB 3.24Å; Q332-C336 PolarHBondContact O-N 3.5Å; Q332-C336 PolarHBondContact O-SG 3.38Å; C336-T338 VanDerWaalsContact C-N 3.25Å; C336-T338 PolarHBondContact O-N 2.82Å; C336-F339 WeakPolarHBondContact O-CB 2.99Å; C336-F339 PolarHBondContact O-N 2.92Å; C336-N340 PolarHBondContact O-N 2.83Å; C336-N340 PolarHBondContact O-OD1 3.05Å
337	R	75.8	Confident	67.1	Low	193 Å²	193	67.2 Å²	67.2	73%	0.728	36%	0.359	S	S	*	.	H	α-helix	trans	-62.1	-37.9	172.3	-174.7	176.4	-175.9	175.3	1.6	111.7	R333 Y335 T341	R333-R337 WeakPolarHBondContact O-CB 3.38Å; R333-R337 PolarHBondContact O-N 3.13Å; R333-R337 VanDerWaalsContact O-N 3.08Å; Y335-R337 VanDerWaalsContact C-N 3.33Å; Y335-R337 PolarHBondContact O-N 3.25Å; R337-T341 PolarHBondContact O-N 3.17Å; R337-T341 PolarHBondContact O-OG1 3.15Å
338	T	67.4	Low	64.1	Low	34 Å²	34	70.3 Å²	70.3	21%	0.209	39%	0.391	C	S	.	.	H	α-helix	trans	-70.8	-39	178.1	-40.1	0	0	0	0	110.4	R334 Y335 C336 N340 T341 V342 L361 L365	R334-T338 PolarHBondContact O-N 3.3Å; R334-T338 PolarHBondContact O-OG1 3.31Å; Y335-T338 WeakPolarHBondContact O-CB 3.09Å; Y335-T338 PolarHBondContact O-N 3.04Å; C336-T338 VanDerWaalsContact C-N 3.25Å; C336-T338 PolarHBondContact O-N 2.82Å; T338-N340 PolarHBondContact O-N 3.4Å; T338-T341 WeakPolarHBondContact CA-OG1 3.31Å; T338-T341 PolarHBondContact O-N 3.36Å; T338-T341 PolarHBondContact O-OG1 3.02Å; T338-V342 WeakPolarHBondContact O-CG2 3.42Å; T338-V342 PolarHBondContact O-N 3.27Å; T338-L361 HydrophobicContact CG2-CD1 4Å; T338-L361 HydrophobicContact CG2-CD2 3.51Å; T338-L361 HydrophobicContact CG2-CG 3.9Å; T338-L365 HydrophobicContact CG2-CD1 4.37Å
339	F	62	Low	61.2	Low	17 Å²	17	75.1 Å²	75.1	8%	0.075	43%	0.425	C	S	.	.	H	α-helix	trans	-56.9	-49.4	172.9	-167.2	-88.1	0	0	0	111.7	I287 C309 Y335 C336 T341 V342 I353 I358	I287-F339 HydrophobicContact CG2-CD2 3.82Å; I287-F339 HydrophobicContact CG2-CE2 4.1Å; C309-F339 HydrophobicContact CB-CD1 4.4Å; C309-F339 HydrophobicContact CB-CG 4.37Å; Y335-F339 PolarHBondContact O-N 2.79Å; C336-F339 WeakPolarHBondContact O-CB 2.99Å; C336-F339 PolarHBondContact O-N 2.92Å; F339-T341 VanDerWaalsContact C-N 3.28Å; F339-T341 PolarHBondContact O-N 3.13Å; F339-V342 PolarHBondContact O-N 3.13Å; F339-I353 HydrophobicContact CD1-CD1 4.42Å; F339-I353 HydrophobicContact CE1-CD1 3.58Å; F339-I353 HydrophobicContact CE2-CD1 4.41Å; F339-I353 HydrophobicContact CZ-CB 4.38Å; F339-I353 HydrophobicContact CZ-CD1 3.59Å; F339-I353 HydrophobicContact CZ-CG1 4.46Å; F339-I358 HydrophobicContact CD2-CD1 4.08Å; F339-I358 HydrophobicContact CD2-CG1 3.88Å; F339-I358 HydrophobicContact CD2-CG2 4.06Å; F339-I358 HydrophobicContact CE2-CD1 3.29Å; F339-I358 HydrophobicContact CE2-CG1 3.61Å; F339-I358 HydrophobicContact CE2-CG2 4.36Å; F339-I358 HydrophobicContact CZ-CD1 4.08Å
340	N	59.5	Low	58.4	Low	60 Å²	60	81 Å²	81	32%	0.321	47%	0.468	S	S	.	.	H	α-helix	trans	-74.4	-10.3	-179.6	-67.4	14.3	0	0	0	114.1	D308 C336 T338	D308-N340 PolarHBondContact OD2-ND2 2.02Å; C336-N340 PolarHBondContact O-N 2.83Å; C336-N340 PolarHBondContact O-OD1 3.05Å; T338-N340 PolarHBondContact O-N 3.4Å
341	T	56.1	Low	55.8	Low	93 Å²	93	81.3 Å²	81.3	57%	0.571	48%	0.479	S	S	*	.	H	α-helix	trans	-98.7	-16.1	176.8	30.6	0	0	0	0	113.5	R337 T338 F339	R337-T341 PolarHBondContact O-N 3.17Å; R337-T341 PolarHBondContact O-OG1 3.15Å; T338-T341 WeakPolarHBondContact CA-OG1 3.31Å; T338-T341 PolarHBondContact O-N 3.36Å; T338-T341 PolarHBondContact O-OG1 3.02Å; F339-T341 VanDerWaalsContact C-N 3.28Å; F339-T341 PolarHBondContact O-N 3.13Å
342	V	52.3	Low	53.4	Low	97 Å²	97	88 Å²	88	59%	0.588	52%	0.521	S	S	*	.	H	α-helix	trans	-76.7	-18.3	168.8	179.8	0	0	0	0	110.8	T338 F339 L361	T338-V342 WeakPolarHBondContact O-CG2 3.42Å; T338-V342 PolarHBondContact O-N 3.27Å; F339-V342 PolarHBondContact O-N 3.13Å; V342-L361 HydrophobicContact CG2-CD2 3.93Å
343	E	43.9	Very low	51.4	Low	105 Å²	105	90.9 Å²	90.9	49%	0.491	54%	0.535	S	S	.	.			trans	-97.1	91.9	162.1	-67.4	-168.4	140.7	0	0	109.6	I353	E343-I353 VanDerWaalsContact CD-CD1 3.47Å; E343-I353 HydrophobicContact CG-CD1 3.93Å; E343-I353 WeakPolarHBondContact OE1-CD1 3.46Å
344	P	35.2	Very low	49.2	Very low	114 Å²	114	89.5 Å²	89.5	74%	0.74	54%	0.538	S	S	*	.				-159	97.5	99.9	35.1	-12.2	0	0	0	113.1
345	S	38	Very low	47.3	Very low	114 Å²	114	87.7 Å²	87.7	80%	0.797	54%	0.537	S	S	*	.	S	Bend	trans	-145.7	6.1	162.6	73.5	0	0	0	0	115.3
346	M	33.5	Very low	45.7	Very low	179 Å²	179	91 Å²	91	88%	0.882	56%	0.56	S	S	*	*	S	Bend	trans	-127.1	107.5	171	-77	-78.1	-161.4	0	0	107.8
347	G	27.5	Very low	44	Very low	82 Å²	82	95.3 Å²	95.3	85%	0.845	59%	0.586	S	S	*	*			trans	-62.5	140.1	176.8	0	0	0	0	0	111.6
348	G	26.6	Very low	43	Very low	65 Å²	65	86.8 Å²	86.8	67%	0.67	56%	0.555	S	S	*	*	S	Bend	trans	87.3	135.9	158.3	0	0	0	0	0	115.4
349	S	29	Very low	42.4	Very low	105 Å²	105	86.9 Å²	86.9	73%	0.734	55%	0.553	S	S	*	*			trans	75.4	100.6	172.9	67	0	0	0	0	116.8	S351	S349-S351 VanDerWaalsContact C-N 3.34Å; S349-S351 PolarHBondContact O-N 3.12Å; S349-S351 PolarHBondContact O-OG 2.93Å
350	S	28.3	Very low	42	Very low	135 Å²	135	89.6 Å²	89.6	94%	0.944	57%	0.573	S	S	*	*			trans	-14	90.2	140.4	154.2	0	0	0	0	111.8
351	S	34	Very low	41.8	Very low	84 Å²	84	89.2 Å²	89.2	59%	0.587	57%	0.57	S	S	*	*			trans	-126.7	123.1	172.1	48.4	0	0	0	0	106.7	S349 I353	S349-S351 VanDerWaalsContact C-N 3.34Å; S349-S351 PolarHBondContact O-N 3.12Å; S349-S351 PolarHBondContact O-OG 2.93Å; S351-I353 PolarHBondContact O-N 3.25Å
352	T	36.7	Very low	41.7	Very low	142 Å²	142	84.9 Å²	84.9	87%	0.871	54%	0.544	S	S	*	.			trans	-46.9	108	171	42	0	0	0	0	109.3	D354	T352-D354 PolarHBondContact O-N 3.36Å; T352-D354 VanDerWaalsContact O-N 3.1Å
353	I	43	Very low	41.9	Very low	59 Å²	59	84.2 Å²	84.2	30%	0.303	54%	0.537	S	S	.	.			trans	-61.9	115.5	172.2	-51.3	-179.5	0	0	0	107	F339 E343 S351 V355 I358	F339-I353 HydrophobicContact CD1-CD1 4.42Å; F339-I353 HydrophobicContact CE1-CD1 3.58Å; F339-I353 HydrophobicContact CE2-CD1 4.41Å; F339-I353 HydrophobicContact CZ-CB 4.38Å; F339-I353 HydrophobicContact CZ-CD1 3.59Å; F339-I353 HydrophobicContact CZ-CG1 4.46Å; E343-I353 VanDerWaalsContact CD-CD1 3.47Å; E343-I353 HydrophobicContact CG-CD1 3.93Å; E343-I353 WeakPolarHBondContact OE1-CD1 3.46Å; S351-I353 PolarHBondContact O-N 3.25Å; I353-V355 PolarHBondContact O-N 2.82Å; I353-I358 HydrophobicContact CB-CD1 4.27Å; I353-I358 HydrophobicContact CG2-CD1 3.53Å; I353-I358 HydrophobicContact CG2-CG1 3.96Å
354	D	38.2	Very low	42.3	Very low	103 Å²	103	84.7 Å²	84.7	55%	0.551	54%	0.543	S	S	*	.			trans	-67.7	132.5	177.6	-171	12.8	0	0	0	109.1	T352 S356 T357	T352-D354 PolarHBondContact O-N 3.36Å; T352-D354 VanDerWaalsContact O-N 3.1Å; D354-S356 PolarHBondContact O-N 3.29Å; D354-S356 PolarHBondContact OD2-OG 2.95Å; D354-T357 WeakPolarHBondContact O-CB 3.23Å; D354-T357 PolarHBondContact O-N 3.45Å; D354-T357 PolarHBondContact O-OG1 3.26Å
355	V	43.6	Very low	43.1	Very low	55 Å²	55	80.3 Å²	80.3	33%	0.333	51%	0.513	S	S	.	.	H	α-helix	trans	-54.6	-27.3	-175.5	177	0	0	0	0	111.1	I353 T357 I358 Q359	I353-V355 PolarHBondContact O-N 2.82Å; V355-T357 VanDerWaalsContact C-N 3.26Å; V355-T357 PolarHBondContact O-N 3Å; V355-I358 PolarHBondContact O-N 2.87Å; V355-Q359 PolarHBondContact O-N 3.25Å
356	S	45.9	Very low	43.6	Very low	72 Å²	72	77 Å²	77	50%	0.503	48%	0.483	S	S	.	.	H	α-helix	trans	-57.7	-31.2	173.7	61.5	0	0	0	0	114.1	D354 P360	D354-S356 PolarHBondContact O-N 3.29Å; D354-S356 PolarHBondContact OD2-OG 2.95Å; S356-P360 WeakPolarHBondContact O-CD 3.3Å
357	T	47.7	Very low	43.9	Very low	93 Å²	93	71 Å²	71	57%	0.571	46%	0.462	S	S	*	.	H	α-helix	trans	-77.8	-25.6	-177.5	-29.4	0	0	0	0	112.5	D354 V355	D354-T357 WeakPolarHBondContact O-CB 3.23Å; D354-T357 PolarHBondContact O-N 3.45Å; D354-T357 PolarHBondContact O-OG1 3.26Å; V355-T357 VanDerWaalsContact C-N 3.26Å; V355-T357 PolarHBondContact O-N 3Å
358	I	53.7	Low	44.9	Very low	14 Å²	14	75 Å²	75	7%	0.072	46%	0.456	C	S	.	.	H	α-helix	trans	-94.8	-29	-172.4	-59.4	133.3	0	0	0	111.5	I287 F339 I353 V355 P360 L361 V362	I287-I358 HydrophobicContact CB-CG2 3.94Å; I287-I358 HydrophobicContact CD1-CG2 3.86Å; I287-I358 HydrophobicContact CG1-CG2 4.25Å; I287-I358 HydrophobicContact CG2-CG2 4.43Å; F339-I358 HydrophobicContact CD2-CD1 4.08Å; F339-I358 HydrophobicContact CD2-CG1 3.88Å; F339-I358 HydrophobicContact CD2-CG2 4.06Å; F339-I358 HydrophobicContact CE2-CD1 3.29Å; F339-I358 HydrophobicContact CE2-CG1 3.61Å; F339-I358 HydrophobicContact CE2-CG2 4.36Å; F339-I358 HydrophobicContact CZ-CD1 4.08Å; I353-I358 HydrophobicContact CB-CD1 4.27Å; I353-I358 HydrophobicContact CG2-CD1 3.53Å; I353-I358 HydrophobicContact CG2-CG1 3.96Å; V355-I358 PolarHBondContact O-N 2.87Å; I358-P360 VanDerWaalsContact C-CD 3.44Å; I358-L361 VanDerWaalsContact O-CB 3.31Å; I358-L361 WeakPolarHBondContact O-CB 3.3Å; I358-L361 PolarHBondContact O-N 3.3Å; I358-L361 VanDerWaalsContact O-N 3.13Å; I358-V362 HydrophobicContact CG2-CG2 4.02Å; I358-V362 WeakPolarHBondContact O-CG2 3.5Å; I358-V362 PolarHBondContact O-N 3.38Å
359	Q	54.7	Low	45.6	Very low	36 Å²	36	76.6 Å²	76.6	17%	0.168	44%	0.442	C	S	.	.	H	α-helix	trans	-57.9	-38.8	-176.8	-148.1	67.5	1.5	0	0	115	D284 E285 V355 L361 V362 N363	D284-Q359 PolarHBondContact OD1-NE2 3.41Å; E285-Q359 PolarHBondContact O-NE2 3.04Å; V355-Q359 PolarHBondContact O-N 3.25Å; Q359-L361 VanDerWaalsContact C-N 3.33Å; Q359-L361 PolarHBondContact O-N 2.93Å; Q359-V362 WeakPolarHBondContact O-CB 3.44Å; Q359-V362 PolarHBondContact O-N 3.36Å; Q359-N363 PolarHBondContact O-N 3.29Å
360	P	53.9	Low	45.9	Very low	74 Å²	74	72.8 Å²	72.8	48%	0.481	42%	0.415	S	S	.	.	H	α-helix	trans	-64.8	-37.5	176.3	-18.6	30.5	0	0	0	112.4	S356 I358 N363 N364	S356-P360 WeakPolarHBondContact O-CD 3.3Å; I358-P360 VanDerWaalsContact C-CD 3.44Å; P360-N363 PolarHBondContact O-N 3.45Å; P360-N364 PolarHBondContact O-N 3.31Å
361	L	56.8	Low	46.2	Very low	53 Å²	53	70.9 Å²	70.9	28%	0.277	40%	0.4	S	S	.	.	H	α-helix	trans	-66.4	-41	177.1	-167.2	75	0	0	0	110.7	T338 V342 I358 Q359 N364 L365	T338-L361 HydrophobicContact CG2-CD1 4Å; T338-L361 HydrophobicContact CG2-CD2 3.51Å; T338-L361 HydrophobicContact CG2-CG 3.9Å; V342-L361 HydrophobicContact CG2-CD2 3.93Å; I358-L361 VanDerWaalsContact O-CB 3.31Å; I358-L361 WeakPolarHBondContact O-CB 3.3Å; I358-L361 PolarHBondContact O-N 3.3Å; I358-L361 VanDerWaalsContact O-N 3.13Å; Q359-L361 VanDerWaalsContact C-N 3.33Å; Q359-L361 PolarHBondContact O-N 2.93Å; L361-N364 PolarHBondContact O-N 2.88Å; L361-L365 VanDerWaalsContact O-CG 3.3Å; L361-L365 WeakPolarHBondContact O-CG 3.48Å; L361-L365 PolarHBondContact O-N 2.94Å
362	V	53.2	Low	46.4	Very low	1 Å²	1	75.7 Å²	75.7	1%	0.006	41%	0.41	C	S	.	.	H	α-helix	trans	-59.9	-46.7	173.5	172.1	0	0	0	0	111.2	E285 I287 Y335 I358 Q359 N364 L365 R366	E285-V362 HydrophobicContact CB-CG1 4.15Å; E285-V362 HydrophobicContact CG-CG1 4.06Å; E285-V362 WeakPolarHBondContact OE1-CG1 3.25Å; I287-V362 HydrophobicContact CD1-CG2 3.3Å; I287-V362 HydrophobicContact CG1-CG2 3.73Å; Y335-V362 HydrophobicContact CE1-CG1 4.41Å; Y335-V362 HydrophobicContact CE1-CG2 4.47Å; I358-V362 HydrophobicContact CG2-CG2 4.02Å; I358-V362 WeakPolarHBondContact O-CG2 3.5Å; I358-V362 PolarHBondContact O-N 3.38Å; Q359-V362 WeakPolarHBondContact O-CB 3.44Å; Q359-V362 PolarHBondContact O-N 3.36Å; V362-N364 PolarHBondContact O-N 3.01Å; V362-L365 PolarHBondContact O-N 2.7Å; V362-R366 WeakPolarHBondContact O-CB 3.41Å; V362-R366 PolarHBondContact O-N 3.13Å
363	N	57.4	Low	46.2	Very low	84 Å²	84	80 Å²	80	45%	0.449	41%	0.41	S	S	.	.	H	α-helix	trans	-62.6	-41.6	178.2	-71.7	-17.8	0	0	0	112.2	Q359 P360 L365 R366 A367	Q359-N363 PolarHBondContact O-N 3.29Å; P360-N363 PolarHBondContact O-N 3.45Å; N363-L365 VanDerWaalsContact C-N 3.35Å; N363-L365 PolarHBondContact O-N 3.28Å; N363-R366 WeakPolarHBondContact O-CB 3.38Å; N363-R366 PolarHBondContact O-N 3.31Å; N363-A367 PolarHBondContact O-N 3.35Å
364	N	51.5	Low	45.7	Very low	115 Å²	115	84.2 Å²	84.2	62%	0.615	43%	0.433	S	S	*	.	H	α-helix	trans	-64.2	-37.4	174.4	-85.7	-26.5	0	0	0	112.8	P360 L361 V362	P360-N364 PolarHBondContact O-N 3.31Å; L361-N364 PolarHBondContact O-N 2.88Å; V362-N364 PolarHBondContact O-N 3.01Å
365	L	52.5	Low	45.6	Very low	21 Å²	21	88.4 Å²	88.4	11%	0.11	45%	0.447	C	S	.	.	H	α-helix	trans	-69.7	-33.6	174.4	-70.9	171.4	0	0	0	112	Y335 T338 L361 V362 N363 K368	Y335-L365 HydrophobicContact CD1-CB 4.46Å; Y335-L365 HydrophobicContact CD1-CD1 3.46Å; Y335-L365 VanDerWaalsContact CD1-CD1 3.46Å; Y335-L365 HydrophobicContact CE1-CB 3.64Å; Y335-L365 HydrophobicContact CE1-CD1 3.5Å; Y335-L365 HydrophobicContact CE1-CG 4.22Å; Y335-L365 HydrophobicContact CG-CD1 4.36Å; T338-L365 HydrophobicContact CG2-CD1 4.37Å; L361-L365 VanDerWaalsContact O-CG 3.3Å; L361-L365 WeakPolarHBondContact O-CG 3.48Å; L361-L365 PolarHBondContact O-N 2.94Å; V362-L365 PolarHBondContact O-N 2.7Å; N363-L365 VanDerWaalsContact C-N 3.35Å; N363-L365 PolarHBondContact O-N 3.28Å; L365-K368 PolarHBondContact O-N 3.02Å
366	R	47.4	Very low	45	Very low	44 Å²	44	90.3 Å²	90.3	17%	0.166	46%	0.46	C	S	.	.	H	α-helix	trans	-66	-46.3	175.9	-169.3	176.1	-172.6	162.6	4.2	111.8	R282 V362 N363 K368 R369 S370	R282-R366 PolarHBondContact O-NH2 2.84Å; V362-R366 WeakPolarHBondContact O-CB 3.41Å; V362-R366 PolarHBondContact O-N 3.13Å; N363-R366 WeakPolarHBondContact O-CB 3.38Å; N363-R366 PolarHBondContact O-N 3.31Å; R366-K368 PolarHBondContact O-N 2.84Å; R366-R369 PolarHBondContact O-N 2.96Å; R366-S370 PolarHBondContact O-N 3.19Å
367	A	40	Very low	44.2	Very low	53 Å²	53	96.4 Å²	96.4	44%	0.438	48%	0.478	S	S	.	.	H	α-helix	trans	-61.9	-25.8	178.5	0	0	0	0	0	113.5	N363 R369	N363-A367 PolarHBondContact O-N 3.35Å; A367-R369 VanDerWaalsContact C-N 3.29Å; A367-R369 PolarHBondContact O-N 3.38Å
368	K	49.1	Very low	43.4	Very low	168 Å²	168	103.1 Å²	103.1	73%	0.73	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-17	173.7	-71.1	-176.4	179.1	-177.1	0	113.6	L365 R366	L365-K368 PolarHBondContact O-N 3.02Å; R366-K368 PolarHBondContact O-N 2.84Å
369	R	41.5	Very low	42.4	Very low	97 Å²	97	107 Å²	107	37%	0.366	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-21.4	176.5	-83	-178.2	157.1	172.2	-5.6	113.1	R366 A367	R366-R369 PolarHBondContact O-N 2.96Å; A367-R369 VanDerWaalsContact C-N 3.29Å; A367-R369 PolarHBondContact O-N 3.38Å
370	S	34.6	Very low	41.3	Very low	25 Å²	25	112 Å²	112	18%	0.175	55%	0.547	C	S	.	.	S	Bend	trans	-76.7	132	173.2	-51	0	0	0	0	109.7	R366 K372	R366-S370 PolarHBondContact O-N 3.19Å; S370-K372 PolarHBondContact O-N 3.45Å
371	P	34.7	Very low	40	Very low	95 Å²	95	115.9 Å²	115.9	62%	0.617	56%	0.563	S	S	*	*			trans	-57.9	113	170.5	-19.3	30.1	0	0	0	109.3	M45 R373	M45-P371 HydrophobicContact SD-CG 4.44Å; P371-R373 PolarHBondContact O-N 3.23Å
372	K	37.5	Very low	38.9	Very low	185 Å²	185	121.8 Å²	121.8	80%	0.804	59%	0.589	S	S	*	*			trans	-57.7	114.5	171.2	-79.5	-171.4	176.2	-174.7	0	107.8	S370 N374	S370-K372 PolarHBondContact O-N 3.45Å; K372-N374 PolarHBondContact O-N 2.94Å
373	R	32.4	Very low	37.6	Very low	234 Å²	234	129.6 Å²	129.6	88%	0.883	63%	0.625	S	S	*	*			trans	-64.5	99.6	175.6	-163.2	177.7	-176.1	-177.9	0.4	108.1	P371 K375	P371-R373 PolarHBondContact O-N 3.23Å; R373-K375 PolarHBondContact O-N 3.21Å
374	N	32.8	Very low	36.6	Very low	147 Å²	147	131.5 Å²	131.5	79%	0.786	64%	0.642	S	S	*	*			trans	-62.3	107.5	163.9	-79.2	-14.5	0	0	0	106.7	K372 P376	K372-N374 PolarHBondContact O-N 2.94Å; N374-P376 VanDerWaalsContact O-CD 3.27Å; N374-P376 WeakPolarHBondContact O-CD 3.44Å; N374-P376 VanDerWaalsContact O-N 3.17Å
375	K	36	Very low	35.7	Very low	190 Å²	190	133.1 Å²	133.1	83%	0.826	65%	0.651	S	S	*	*			trans	-59.3	116.6	169.1	-70.2	-174.3	178.9	-179.5	0	106.8	R373 K377	R373-K375 PolarHBondContact O-N 3.21Å; K375-K377 PolarHBondContact O-N 3.41Å; K375-K377 VanDerWaalsContact O-N 3.14Å
376	P	31.3	Very low	34.9	Very low	96 Å²	96	141.5 Å²	141.5	62%	0.623	69%	0.689	S	S	*	*			trans	-71.6	116.2	177	31.9	-33.7	0	0	0	107.4	N374 W378	N374-P376 VanDerWaalsContact O-CD 3.27Å; N374-P376 WeakPolarHBondContact O-CD 3.44Å; N374-P376 VanDerWaalsContact O-N 3.17Å; P376-W378 VanDerWaalsContact C-N 3.27Å; P376-W378 PolarHBondContact O-N 3.42Å
377	K	30.6	Very low	34.4	Very low	199 Å²	199	147.9 Å²	147.9	87%	0.865	72%	0.721	S	S	*	*			trans	-76.1	82.3	175.1	-149.5	177.5	-171.3	-179	0	107.3	K375 S379	K375-K377 PolarHBondContact O-N 3.41Å; K375-K377 VanDerWaalsContact O-N 3.14Å; K377-S379 PolarHBondContact O-N 3.08Å
378	W	29.1	Very low	34.3	Very low	235 Å²	235	151.4 Å²	151.4	89%	0.89	74%	0.737	S	S	*	*			trans	-81.2	89.1	168.6	-73	65.4	0	0	0	107.7	P376	P376-W378 VanDerWaalsContact C-N 3.27Å; P376-W378 PolarHBondContact O-N 3.42Å
379	S	33	Very low	33.8	Very low	95 Å²	95	148.6 Å²	148.6	66%	0.664	74%	0.739	S	S	*	*			trans	-101.5	96.9	163.8	52.2	0	0	0	0	109	K377	K377-S379 PolarHBondContact O-N 3.08Å
380	I	31.9	Very low	33.7	Very low	141 Å²	141	149.9 Å²	149.9	72%	0.723	76%	0.76	S	S	*	*			trans	50.2	105.8	133.6	-54.5	170.3	0	0	0	116.6
381	L	26.5	Very low	34.8	Very low	156 Å²	156	154.6 Å²	154.6	82%	0.817	79%	0.79	S	S	*	*			trans	-55.8	123.8	158.2	-149.6	86	0	0	0	110.7
382	H	33.1	Very low	35.6	Very low	177 Å²	177	155.8 Å²	155.8	82%	0.819	80%	0.798	S	S	*	*			trans	-144.6	112.4	155.1	-93.5	-63.1	0	0	0	109.4
383	H	27	Very low	36	Very low	164 Å²	164	152.8 Å²	152.8	76%	0.759	80%	0.797	S	S	*	*			trans	-69.6	151.8	161.5	-81.6	-40.5	0	0	0	109.8
384	P	35.4	Very low	37.2	Very low	124 Å²	124	147.3 Å²	147.3	81%	0.805	79%	0.792	S	S	*	*				-145.3	164.5	84.2	33.2	-12.3	0	0	0	116.5
385	N	33.8	Very low	37.7	Very low	149 Å²	149	146.9 Å²	146.9	80%	0.797	79%	0.794	S	S	*	*			trans	-43.8	144.2	178.6	-54.6	-32.4	0	0	0	117
386	E	35.6	Very low	37.6	Very low	197 Å²	197	141.6 Å²	141.6	92%	0.921	79%	0.786	S	S	*	*				-165	144.9	124.3	-116.8	173.6	178.6	0	0	111.5
387	E	35.8	Very low	38.2	Very low	179 Å²	179	144 Å²	144	84%	0.836	80%	0.8	S	S	*	*			trans	-67.6	153.9	-172.8	-65.6	167.1	131.6	0	0	113.3
388	T	39.5	Very low	38.5	Very low	127 Å²	127	139.9 Å²	139.9	78%	0.779	79%	0.791	S	S	*	*				153.1	104.9	129.9	-59.4	0	0	0	0	111.8
389	S	37.9	Very low	38.9	Very low	109 Å²	109	134.5 Å²	134.5	76%	0.762	78%	0.784	S	S	*	*			trans	52.5	133.5	140.4	-44	0	0	0	0	123
390	P	39.9	Very low	39.1	Very low	124 Å²	124	141.2 Å²	141.2	81%	0.805	80%	0.795	S	S	*	*			trans	-100.7	160.6	179.4	39.1	-32.4	0	0	0	114.5
391	P	56.7	Low	39.2	Very low	123 Å²	123	143.4 Å²	143.4	80%	0.799	81%	0.805	S	S	*	*			trans	-121	164.6	157.7	28.4	-10.3	0	0	0	114.8
392	P	52.9	Low	39.7	Very low	121 Å²	121	141.7 Å²	141.7	79%	0.786	81%	0.806	S	S	*	*			trans	-102.9	177.8	-147.6	40.8	-35.5	0	0	0	115.6
393	P	44.1	Very low	39.7	Very low	121 Å²	121	139.1 Å²	139.1	79%	0.786	80%	0.802	S	S	*	*			trans	-98.6	158.3	-176.9	38.3	-31.5	0	0	0	113.8
394	P	57.7	Low	40.2	Very low	119 Å²	119	138.2 Å²	138.2	77%	0.773	80%	0.803	S	S	*	*			trans	-120.3	168.8	159.2	38.2	-25.9	0	0	0	111.3
395	T	43	Very low	40.3	Very low	138 Å²	138	141.4 Å²	141.4	85%	0.847	80%	0.804	S	S	*	*			cis	-170.3	150.8	-29.4	-75.6	0	0	0	0	104.4
396	A	35.6	Very low	40.3	Very low	79 Å²	79	146 Å²	146	65%	0.653	81%	0.81	S	S	*	*			trans	-71.5	167.9	-169.2	0	0	0	0	0	117.8
397	T	42.7	Very low	40.4	Very low	148 Å²	148	141.7 Å²	141.7	91%	0.908	80%	0.801	S	S	*	*			trans	-145	137.2	145.6	-43.2	0	0	0	0	110.7
398	T	36.6	Very low	40.5	Very low	112 Å²	112	137.9 Å²	137.9	69%	0.687	80%	0.795	S	S	*	*			trans	-125.1	170	-165.8	-58	0	0	0	0	111.4
399	T	38.2	Very low	40.5	Very low	122 Å²	122	141.1 Å²	141.1	75%	0.748	80%	0.803	S	S	*	*			trans	92.4	137	154	-0.8	0	0	0	0	115.8
400	R	37.6	Very low	40.6	Very low	236 Å²	236	144.8 Å²	144.8	89%	0.891	81%	0.808	S	S	*	*			cis	-168.3	148.5	31.1	-162.8	171.6	-169.9	175.6	2.5	111.5
401	M	32.9	Very low	40.6	Very low	187 Å²	187	143.9 Å²	143.9	92%	0.921	80%	0.803	S	S	*	*			trans	-89.5	152.7	168.6	-79.9	-165.8	-99.1	0	0	112.3
402	S	37.7	Very low	39.6	Very low	120 Å²	120	143.4 Å²	143.4	84%	0.839	80%	0.802	S	S	*	*			trans	-160.3	131.7	143.4	62	0	0	0	0	113.7
403	T	33.7	Very low	38.9	Very low	122 Å²	122	144.1 Å²	144.1	75%	0.748	80%	0.804	S	S	*	*			trans	-71.1	155.3	174.6	37.5	0	0	0	0	116.1
404	L	37	Very low	38.5	Very low	146 Å²	146	143.4 Å²	143.4	76%	0.764	80%	0.802	S	S	*	*				156.6	144.5	114.6	-100.5	118	0	0	0	116.2
405	K	37.3	Very low	37.5	Very low	190 Å²	190	149.1 Å²	149.1	83%	0.826	81%	0.808	S	S	*	*			trans	70.2	120	156.5	-80	171.4	173.9	-179	0	118.5
406	R	34.7	Very low	37.1	Very low	247 Å²	247	147.5 Å²	147.5	93%	0.932	80%	0.802	S	S	*	*			cis	81.7	123.3	42.4	-162.5	179.3	-161.8	176.7	6.5	115.1
407	S	36.7	Very low	37.2	Very low	105 Å²	105	149 Å²	149	73%	0.734	81%	0.805	S	S	*	*			trans	129.1	96.3	151.3	-171.4	0	0	0	0	112.8
408	S	37.8	Very low	36.8	Very low	100 Å²	100	146.7 Å²	146.7	70%	0.699	80%	0.795	S	S	*	*				68.3	115.9	94.2	96.1	0	0	0	0	116.7
409	M	40	Very low	36.9	Very low	195 Å²	195	149.9 Å²	149.9	96%	0.961	80%	0.802	S	S	*	*				174.3	156.5	116.9	-104.7	176.3	145	0	0	111.1
410	E	39	Very low	36.8	Very low	186 Å²	186	148.8 Å²	148.8	87%	0.869	80%	0.8	S	S	*	*			trans	-103.7	-166	-154.1	-133.5	-168.7	166.4	0	0	112
411	P	39.9	Very low	36.8	Very low	105 Å²	105	143.6 Å²	143.6	68%	0.682	80%	0.8	S	S	*	*				-118.2	176.1	-129.5	36.1	-14.7	0	0	0	115.3
412	S	37.4	Very low	37	Very low	112 Å²	112	143.8 Å²	143.8	78%	0.783	80%	0.798	S	S	*	*			trans	-173.1	115.9	155.8	18	0	0	0	0	109.5
413	V	38.1	Very low	36.9	Very low	137 Å²	137	143.2 Å²	143.2	83%	0.83	79%	0.794	S	S	*	*				77	121	91.2	172.9	0	0	0	0	114.8
414	S	35.1	Very low	37	Very low	106 Å²	106	147 Å²	147	74%	0.741	80%	0.8	S	S	*	*			trans	116.1	132.3	140	70.6	0	0	0	0	120.5
415	R	36.5	Very low	36.8	Very low	238 Å²	238	147.8 Å²	147.8	90%	0.898	80%	0.802	S	S	*	*			trans	87.6	98	146.9	-86.3	176.3	174	165.3	-1.8	121.1
416	S	34.3	Very low	36.6	Very low	105 Å²	105	144.4 Å²	144.4	73%	0.734	80%	0.797	S	S	*	*				-66.8	160.9	129.4	52.1	0	0	0	0	110.3
417	P	37.9	Very low	36.6	Very low	110 Å²	110	139.1 Å²	139.1	71%	0.714	79%	0.787	S	S	*	*				-156.2	178	61.2	38.8	-15	0	0	0	118.6
418	S	34.3	Very low	36.6	Very low	99 Å²	99	142.6 Å²	142.6	69%	0.692	79%	0.792	S	S	*	*			trans	66.1	126.8	141.1	58.1	0	0	0	0	122.5
419	E	39.1	Very low	36.4	Very low	179 Å²	179	142.5 Å²	142.5	84%	0.836	79%	0.791	S	S	*	*				163.8	103	126.7	-90.3	174.7	-174.2	0	0	109.1
420	S	35	Very low	36.3	Very low	100 Å²	100	141.2 Å²	141.2	70%	0.699	79%	0.788	S	S	*	*				74.9	115.8	87.4	71.1	0	0	0	0	115.2
421	S	39.2	Very low	35.8	Very low	127 Å²	127	137 Å²	137	89%	0.888	79%	0.785	S	S	*	*			trans	-165.8	98.4	146.4	-79.4	0	0	0	0	110.2
422	E	35.5	Very low	35.6	Very low	190 Å²	190	137.3 Å²	137.3	89%	0.888	79%	0.79	S	S	*	*			trans	-70.5	150.7	160.6	-73.1	174.9	127.2	0	0	111
423	S	37.3	Very low	35.3	Very low	109 Å²	109	138.7 Å²	138.7	76%	0.762	79%	0.794	S	S	*	*				160.2	118.4	119.8	60.4	0	0	0	0	112.2
424	K	34.6	Very low	35	Very low	201 Å²	201	140.5 Å²	140.5	87%	0.874	80%	0.795	S	S	*	*				168.5	111.4	107.6	-102.1	-179.9	174.5	175.5	0	111.2
425	M	32.2	Very low	34.9	Very low	163 Å²	163	142.7 Å²	142.7	80%	0.803	80%	0.798	S	S	*	*			trans	-59.2	142	157.9	-71.5	164.1	69.7	0	0	111
426	V	35.1	Very low	34.6	Very low	119 Å²	119	138.6 Å²	138.6	72%	0.721	80%	0.795	S	S	*	*			trans	-139.8	98.7	138.5	-178.2	0	0	0	0	108.1	H428	V426-H428 WeakPolarHBondContact CG1-CD2 3.43Å
427	N	33.8	Very low	34.7	Very low	135 Å²	135	142.6 Å²	142.6	72%	0.722	80%	0.802	S	S	*	*			trans	-89.1	126.6	160.3	-105.5	-11.4	0	0	0	107.3
428	H	37.1	Very low	34.6	Very low	178 Å²	178	141.8 Å²	141.8	82%	0.824	80%	0.804	S	S	*	*			trans	-130.2	87.6	163.2	-80.1	-55.4	0	0	0	109.6	V426	V426-H428 WeakPolarHBondContact CG1-CD2 3.43Å
429	S	32.3	Very low	34.6	Very low	98 Å²	98	144.1 Å²	144.1	69%	0.685	81%	0.808	S	S	*	*			trans	-92	121.6	145	24.4	0	0	0	0	106.9
430	N	37.7	Very low	34.4	Very low	168 Å²	168	142.1 Å²	142.1	90%	0.898	80%	0.803	S	S	*	*			trans	-174.5	137.9	142.8	-91.8	-17	0	0	0	111.4
431	A	29.4	Very low	34.6	Very low	98 Å²	98	141.3 Å²	141.3	81%	0.81	80%	0.797	S	S	*	*			trans	-60.5	142.6	-177.5	0	0	0	0	0	113.5
432	S	36.1	Very low	34.7	Very low	111 Å²	111	138.5 Å²	138.5	78%	0.776	78%	0.776	S	S	*	*			trans	-146	117	147.1	56	0	0	0	0	110.4	M434	S432-M434 PolarHBondContact O-N 2.95Å
433	T	30.1	Very low	35	Very low	142 Å²	142	134.9 Å²	134.9	87%	0.871	76%	0.761	S	S	*	*			trans	-52.4	113.5	172	-34	0	0	0	0	110.8
434	M	32.7	Very low	35.1	Very low	175 Å²	175	137.5 Å²	137.5	86%	0.862	76%	0.759	S	S	*	*			trans	-141.3	109.6	160.3	-77.5	-156	88.8	0	0	111.7	S432	S432-M434 PolarHBondContact O-N 2.95Å
435	N	33.6	Very low	35.6	Very low	151 Å²	151	133.1 Å²	133.1	81%	0.807	75%	0.745	S	S	*	*			trans	50.2	90.9	150.1	-97	-1.7	0	0	0	119.9	Q437	N435-Q437 PolarHBondContact O-N 3.42Å
436	N	30.2	Very low	35.9	Very low	153 Å²	153	129.5 Å²	129.5	82%	0.818	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.2	117.3	140.4	-67.8	-33	0	0	0	110.5
437	Q	35.7	Very low	36.6	Very low	189 Å²	189	127.4 Å²	127.4	88%	0.883	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	169	-6.5	135.9	-94.6	174.4	-3.3	0	0	115.3	N435	N435-Q437 PolarHBondContact O-N 3.42Å
438	A	36.3	Very low	37.3	Very low	93 Å²	93	123.9 Å²	123.9	77%	0.769	71%	0.708	S	S	*	*	S	Bend	trans	-106.9	0.9	-173.2	0	0	0	0	0	116.7
439	L	34.6	Very low	38	Very low	148 Å²	148	120.7 Å²	120.7	78%	0.775	70%	0.696	S	S	*	*			trans	-107	14.5	-169.4	-115.3	145	0	0	0	115	P442	L439-P442 WeakPolarHBondContact O-CD 3.32Å
440	L	34.7	Very low	39	Very low	137 Å²	137	121 Å²	121	72%	0.717	69%	0.687	S	S	*	*			trans	-95.2	3.8	-180	-86.9	156.2	0	0	0	114.4
441	S	39	Very low	40	Very low	83 Å²	83	117.8 Å²	117.8	58%	0.58	67%	0.67	S	S	*	*	S	Bend	trans	-80.1	-35.6	177.9	49.9	0	0	0	0	115.8	I443 K444	S441-I443 VanDerWaalsContact C-N 3.33Å; S441-I443 PolarHBondContact O-N 2.89Å; S441-K444 PolarHBondContact O-N 2.93Å
442	P	40.6	Very low	41.2	Very low	68 Å²	68	117.8 Å²	117.8	44%	0.442	66%	0.656	S	S	.	*	H	α-helix	trans	-80.3	-12.5	-175.5	24.6	-20.6	0	0	0	114	L439	L439-P442 WeakPolarHBondContact O-CD 3.32Å
443	I	42.2	Very low	42	Very low	114 Å²	114	117.6 Å²	117.6	59%	0.585	65%	0.646	S	S	*	*	H	α-helix	trans	-81.5	-22.3	177.8	-58.7	173.8	0	0	0	111.2	S441 T447	S441-I443 VanDerWaalsContact C-N 3.33Å; S441-I443 PolarHBondContact O-N 2.89Å; I443-T447 PolarHBondContact O-OG1 2.93Å
444	K	39.8	Very low	43.5	Very low	164 Å²	164	116.7 Å²	116.7	71%	0.713	63%	0.629	S	S	*	*	H	α-helix	trans	-76.4	-29.2	173.6	-104.9	179.6	174.7	-179.4	0	112.8	S441 T447 S448	S441-K444 PolarHBondContact O-N 2.93Å; K444-T447 PolarHBondContact O-OG1 2.77Å; K444-T447 VanDerWaalsContact O-OG1 3.07Å; K444-S448 PolarHBondContact O-N 3.1Å
445	D	43.4	Very low	44.8	Very low	108 Å²	108	117 Å²	117	58%	0.578	62%	0.621	S	S	*	*	H	α-helix	trans	-75.8	-35	177.6	-69.4	-22.8	0	0	0	112.4	T447 S448 I449	D445-T447 VanDerWaalsContact C-N 3.33Å; D445-T447 PolarHBondContact O-N 3.49Å; D445-S448 PolarHBondContact O-N 3Å; D445-I449 WeakPolarHBondContact O-CG1 3.4Å; D445-I449 PolarHBondContact O-N 2.77Å; D445-I449 VanDerWaalsContact O-N 3.13Å
446	C	40.5	Very low	45.8	Very low	88 Å²	88	116.9 Å²	116.9	60%	0.595	61%	0.611	S	S	*	*	H	α-helix	trans	-65.2	-33.3	175	-81.2	0	0	0	0	113.5	E450	C446-E450 PolarHBondContact O-N 3.09Å
447	T	49.1	Very low	46.9	Very low	75 Å²	75	114.4 Å²	114.4	46%	0.46	60%	0.597	S	S	.	*	H	α-helix	trans	-77.2	-25.7	177.5	49.3	0	0	0	0	112.6	I443 K444 D445 N451	I443-T447 PolarHBondContact O-OG1 2.93Å; K444-T447 PolarHBondContact O-OG1 2.77Å; K444-T447 VanDerWaalsContact O-OG1 3.07Å; D445-T447 VanDerWaalsContact C-N 3.33Å; D445-T447 PolarHBondContact O-N 3.49Å; T447-N451 PolarHBondContact O-N 3.33Å; T447-N451 PolarHBondContact O-ND2 3.5Å
448	S	48.4	Very low	48.3	Very low	61 Å²	61	110.4 Å²	110.4	43%	0.427	58%	0.581	S	S	.	*	H	α-helix	trans	-70.6	-43.9	171.4	-161.6	0	0	0	0	111.9	K444 D445 E450 N451 D452	K444-S448 PolarHBondContact O-N 3.1Å; D445-S448 PolarHBondContact O-N 3Å; S448-E450 PolarHBondContact O-N 2.95Å; S448-N451 PolarHBondContact O-N 3.42Å; S448-D452 PolarHBondContact O-N 3.44Å
449	I	51.4	Low	49.5	Very low	111 Å²	111	110.8 Å²	110.8	57%	0.569	57%	0.571	S	S	*	*	H	α-helix	trans	-64.7	-39	178.4	-65.4	167.1	0	0	0	111.2	D445 N451 D452 L453	D445-I449 WeakPolarHBondContact O-CG1 3.4Å; D445-I449 PolarHBondContact O-N 2.77Å; D445-I449 VanDerWaalsContact O-N 3.13Å; I449-N451 VanDerWaalsContact C-N 3.34Å; I449-N451 PolarHBondContact O-N 3.37Å; I449-D452 PolarHBondContact O-N 3.01Å; I449-L453 VanDerWaalsContact O-CB 3.25Å; I449-L453 WeakPolarHBondContact O-CB 2.96Å; I449-L453 PolarHBondContact O-N 3.32Å
450	E	53.2	Low	50.9	Low	104 Å²	104	107.6 Å²	107.6	49%	0.486	55%	0.551	S	S	.	*	H	α-helix	trans	-64.8	-39	176.6	-163.8	-169.7	150.7	0	0	112	C446 S448 K454	C446-E450 PolarHBondContact O-N 3.09Å; S448-E450 PolarHBondContact O-N 2.95Å; E450-K454 WeakPolarHBondContact O-CB 3.2Å; E450-K454 PolarHBondContact O-N 3.5Å; E450-K454 IonicContact OE1-NZ 3.71Å; E450-K454 PolarHBondContact OE1-NZ 2.98Å
451	N	58	Low	52.3	Low	101 Å²	101	103.2 Å²	103.2	54%	0.54	53%	0.532	S	S	.	.	H	α-helix	trans	-70.4	-40	177.5	-75.1	-26	0	0	0	112.2	T447 S448 I449 K454 R455	T447-N451 PolarHBondContact O-N 3.33Å; T447-N451 PolarHBondContact O-ND2 3.5Å; S448-N451 PolarHBondContact O-N 3.42Å; I449-N451 VanDerWaalsContact C-N 3.34Å; I449-N451 PolarHBondContact O-N 3.37Å; N451-K454 PolarHBondContact O-N 3.29Å; N451-R455 WeakPolarHBondContact O-CB 3.33Å; N451-R455 PolarHBondContact O-N 3.19Å
452	D	55.7	Low	53.9	Low	97 Å²	97	104.9 Å²	104.9	52%	0.519	53%	0.53	S	S	.	.	H	α-helix	trans	-68.8	-38.1	175.7	-73.9	-26.3	0	0	0	111.8	S448 I449 R455 Y456	S448-D452 PolarHBondContact O-N 3.44Å; I449-D452 PolarHBondContact O-N 3.01Å; D452-R455 PolarHBondContact O-N 3.46Å; D452-Y456 VanDerWaalsContact O-CB 3.28Å; D452-Y456 WeakPolarHBondContact O-CB 3.25Å; D452-Y456 PolarHBondContact O-N 3.25Å
453	L	52.8	Low	55.4	Low	107 Å²	107	107.9 Å²	107.9	56%	0.56	54%	0.539	S	S	*	.	H	α-helix	trans	-67	-41.1	174.9	-156	90.3	0	0	0	111.5	I449 L457	I449-L453 VanDerWaalsContact O-CB 3.25Å; I449-L453 WeakPolarHBondContact O-CB 2.96Å; I449-L453 PolarHBondContact O-N 3.32Å; L453-L457 HydrophobicContact CD2-CD1 4.19Å; L453-L457 HydrophobicContact CG-CD1 4.2Å; L453-L457 VanDerWaalsContact O-CB 3.29Å; L453-L457 WeakPolarHBondContact O-CB 3.42Å; L453-L457 WeakPolarHBondContact O-CD1 3.44Å; L453-L457 WeakPolarHBondContact O-CG 3.49Å; L453-L457 PolarHBondContact O-N 3.25Å
454	K	60.6	Low	56.7	Low	123 Å²	123	105.9 Å²	105.9	54%	0.535	53%	0.526	S	S	.	.	H	α-helix	trans	-62.2	-43	173.4	-93	170.9	174.2	154	0	111.5	E450 N451 N458	E450-K454 WeakPolarHBondContact O-CB 3.2Å; E450-K454 PolarHBondContact O-N 3.5Å; E450-K454 IonicContact OE1-NZ 3.71Å; E450-K454 PolarHBondContact OE1-NZ 2.98Å; N451-K454 PolarHBondContact O-N 3.29Å; K454-N458 WeakPolarHBondContact O-CB 3.42Å; K454-N458 PolarHBondContact O-N 3.19Å
455	R	60.7	Low	58.3	Low	181 Å²	181	102.8 Å²	102.8	68%	0.683	52%	0.516	S	S	*	.	H	α-helix	trans	-67.8	-43	179.6	-155.7	174.6	-170.2	175	2.5	111.7	N451 D452 N458 D459	N451-R455 WeakPolarHBondContact O-CB 3.33Å; N451-R455 PolarHBondContact O-N 3.19Å; D452-R455 PolarHBondContact O-N 3.46Å; R455-N458 PolarHBondContact O-N 3.5Å; R455-D459 PolarHBondContact O-N 2.92Å
456	Y	54.8	Low	60	Low	150 Å²	150	102.2 Å²	102.2	59%	0.588	51%	0.512	S	S	*	.	H	α-helix	trans	-64.2	-43	175.8	-169.3	-96	0	0	0	112.3	D452 N458 H460	D452-Y456 VanDerWaalsContact O-CB 3.28Å; D452-Y456 WeakPolarHBondContact O-CB 3.25Å; D452-Y456 PolarHBondContact O-N 3.25Å; Y456-N458 VanDerWaalsContact C-N 3.33Å; Y456-N458 PolarHBondContact O-N 3.5Å; Y456-H460 WeakPolarHBondContact O-CB 3.49Å; Y456-H460 PolarHBondContact O-N 2.92Å; Y456-H460 VanDerWaalsContact O-N 3.14Å
457	L	54.1	Low	61.7	Low	101 Å²	101	106.4 Å²	106.4	53%	0.529	52%	0.516	S	S	.	.	H	α-helix	trans	-64.5	-35.6	175.7	-84.3	160.4	0	0	0	112.6	L453 C461	L453-L457 HydrophobicContact CD2-CD1 4.19Å; L453-L457 HydrophobicContact CG-CD1 4.2Å; L453-L457 VanDerWaalsContact O-CB 3.29Å; L453-L457 WeakPolarHBondContact O-CB 3.42Å; L453-L457 WeakPolarHBondContact O-CD1 3.44Å; L453-L457 WeakPolarHBondContact O-CG 3.49Å; L453-L457 PolarHBondContact O-N 3.25Å; L457-C461 WeakPolarHBondContact O-CB 3.33Å; L457-C461 PolarHBondContact O-N 3.23Å; L457-C461 VanDerWaalsContact O-N 3.12Å
458	N	63.9	Low	63.1	Low	105 Å²	105	105.9 Å²	105.9	56%	0.561	51%	0.51	S	S	*	.	H	α-helix	trans	-71.9	-48.8	179.6	-128.4	32.9	0	0	0	111.6	K454 R455 Y456 H460 C461 E462	K454-N458 WeakPolarHBondContact O-CB 3.42Å; K454-N458 PolarHBondContact O-N 3.19Å; R455-N458 PolarHBondContact O-N 3.5Å; Y456-N458 VanDerWaalsContact C-N 3.33Å; Y456-N458 PolarHBondContact O-N 3.5Å; N458-H460 PolarHBondContact O-N 3.36Å; N458-C461 PolarHBondContact O-N 3.45Å; N458-E462 PolarHBondContact O-N 3.45Å
459	D	62.6	Low	64.6	Low	101 Å²	101	106.5 Å²	106.5	54%	0.54	51%	0.511	S	S	.	.	H	α-helix	trans	-65.9	-40.8	-177.9	-82.7	-0.7	0	0	0	112.1	R455 Q463	R455-D459 PolarHBondContact O-N 2.92Å; D459-Q463 PolarHBondContact O-N 3.34Å; D459-Q463 VanDerWaalsContact O-N 3.15Å
460	H	63.4	Low	66.2	Low	81 Å²	81	105.3 Å²	105.3	38%	0.375	51%	0.506	S	S	.	.	H	α-helix	trans	-72.8	-33.1	177.1	-103.6	33	0	0	0	113.2	Y456 N458 K464	Y456-H460 WeakPolarHBondContact O-CB 3.49Å; Y456-H460 PolarHBondContact O-N 2.92Å; Y456-H460 VanDerWaalsContact O-N 3.14Å; N458-H460 PolarHBondContact O-N 3.36Å; H460-K464 WeakPolarHBondContact O-CB 3.31Å; H460-K464 WeakPolarHBondContact O-CG 3.19Å; H460-K464 PolarHBondContact O-N 3.44Å
461	C	63.8	Low	67.7	Low	45 Å²	45	103 Å²	103	30%	0.304	50%	0.496	S	S	.	.	H	α-helix	trans	-72.7	-37.2	177.5	-172.4	0	0	0	0	110.9	C3 L457 N458 L465	C3-C461 HydrophobicContact CB-CB 4.09Å; C3-C461 WeakPolarHBondContact CB-SG 3.15Å; C3-C461 WeakPolarHBondContact SG-CB 3.24Å; C3-C461 CovalentContact SG-SG 2.06Å; C3-C461 PolarHBondContact SG-SG 2.92Å; L457-C461 WeakPolarHBondContact O-CB 3.33Å; L457-C461 PolarHBondContact O-N 3.23Å; L457-C461 VanDerWaalsContact O-N 3.12Å; N458-C461 PolarHBondContact O-N 3.45Å; C461-L465 VanDerWaalsContact O-CB 3.23Å; C461-L465 WeakPolarHBondContact O-CB 3.42Å; C461-L465 PolarHBondContact O-N 2.89Å
462	E	72.1	Confident	68.9	Low	117 Å²	117	102.2 Å²	102.2	55%	0.547	49%	0.491	S	S	.	.	H	α-helix	trans	-64.9	-46.2	173.4	-76.3	-163.2	170.6	0	0	112.2	N458 K464 L465 I466	N458-E462 PolarHBondContact O-N 3.45Å; E462-K464 PolarHBondContact O-N 2.91Å; E462-L465 PolarHBondContact O-N 3.05Å; E462-I466 VanDerWaalsContact O-CG1 3.26Å; E462-I466 WeakPolarHBondContact O-CG1 3.48Å; E462-I466 PolarHBondContact O-N 2.85Å
463	Q	73.1	Confident	70.4	Confident	132 Å²	132	100.8 Å²	100.8	62%	0.617	49%	0.486	S	S	*	.	H	α-helix	trans	-61.4	-43.5	176.3	-81.6	-173.2	-16.5	0	0	112.5	D459 I466 W467	D459-Q463 PolarHBondContact O-N 3.34Å; D459-Q463 VanDerWaalsContact O-N 3.15Å; Q463-I466 PolarHBondContact O-N 3.48Å; Q463-W467 WeakPolarHBondContact O-CB 3.32Å; Q463-W467 PolarHBondContact O-N 2.91Å
464	K	70.2	Confident	72.1	Confident	72 Å²	72	100.2 Å²	100.2	31%	0.313	48%	0.482	S	S	.	.	H	α-helix	trans	-68.3	-34.6	177.2	-75.2	-166.1	178.8	-167.8	0	112.2	E10 H460 E462 W467 L468	E10-K464 IonicContact OE2-NZ 2.74Å; E10-K464 PolarHBondContact OE2-NZ 2.99Å; H460-K464 WeakPolarHBondContact O-CB 3.31Å; H460-K464 WeakPolarHBondContact O-CG 3.19Å; H460-K464 PolarHBondContact O-N 3.44Å; E462-K464 PolarHBondContact O-N 2.91Å; K464-W467 PolarHBondContact O-N 3.47Å; K464-L468 WeakPolarHBondContact O-CB 3.35Å; K464-L468 PolarHBondContact O-N 3.31Å
465	L	73.5	Confident	73.3	Confident	99 Å²	99	99.5 Å²	99.5	52%	0.518	48%	0.484	S	S	.	.	H	α-helix	trans	-65	-46.2	175.2	-164.3	80.1	0	0	0	110.5	C461 E462 W467 L468 T469	C461-L465 VanDerWaalsContact O-CB 3.23Å; C461-L465 WeakPolarHBondContact O-CB 3.42Å; C461-L465 PolarHBondContact O-N 2.89Å; E462-L465 PolarHBondContact O-N 3.05Å; L465-W467 VanDerWaalsContact C-N 3.31Å; L465-W467 PolarHBondContact O-N 3.33Å; L465-L468 PolarHBondContact O-N 3.47Å; L465-T469 PolarHBondContact O-N 2.93Å; L465-T469 PolarHBondContact O-OG1 3.22Å
466	I	77.5	Confident	74.7	Confident	96 Å²	96	95.4 Å²	95.4	49%	0.492	48%	0.475	S	S	.	.	H	α-helix	trans	-60.1	-41.6	175.7	-67.2	164.8	0	0	0	111	E462 Q463 T469 N470	E462-I466 VanDerWaalsContact O-CG1 3.26Å; E462-I466 WeakPolarHBondContact O-CG1 3.48Å; E462-I466 PolarHBondContact O-N 2.85Å; Q463-I466 PolarHBondContact O-N 3.48Å; I466-T469 WeakPolarHBondContact CA-OG1 3.42Å; I466-T469 PolarHBondContact O-OG1 3.4Å; I466-T469 VanDerWaalsContact O-OG1 3.13Å; I466-N470 WeakPolarHBondContact O-CB 3.33Å; I466-N470 VanDerWaalsContact O-CG 3.27Å; I466-N470 PolarHBondContact O-N 3.32Å
467	W	77.6	Confident	76.4	Confident	175 Å²	175	93.2 Å²	93.2	66%	0.663	47%	0.472	S	S	*	.	H	α-helix	trans	-66.1	-42.4	177.1	-167.1	83	0	0	0	112.1	Q463 K464 L465 N470 I471	Q463-W467 WeakPolarHBondContact O-CB 3.32Å; Q463-W467 PolarHBondContact O-N 2.91Å; K464-W467 PolarHBondContact O-N 3.47Å; L465-W467 VanDerWaalsContact C-N 3.31Å; L465-W467 PolarHBondContact O-N 3.33Å; W467-N470 PolarHBondContact O-N 2.96Å; W467-I471 HydrophobicContact CD2-CD1 3.85Å; W467-I471 HydrophobicContact CD2-CG1 4.44Å; W467-I471 HydrophobicContact CE3-CD1 3.55Å; W467-I471 HydrophobicContact CE3-CG1 4.43Å; W467-I471 HydrophobicContact CH2-CD1 3.18Å; W467-I471 HydrophobicContact CZ2-CD1 3.47Å; W467-I471 VanDerWaalsContact CZ2-CD1 3.47Å; W467-I471 HydrophobicContact CZ3-CD1 3.22Å; W467-I471 HydrophobicContact CZ3-CG1 4.48Å; W467-I471 PolarHBondContact O-N 2.73Å
468	L	78	Confident	78.1	Confident	64 Å²	64	92.9 Å²	92.9	34%	0.335	47%	0.47	S	S	.	.	H	α-helix	trans	-64.1	-45	176.6	-167	84.6	0	0	0	111.5	K464 L465 N470 I471 I472	K464-L468 WeakPolarHBondContact O-CB 3.35Å; K464-L468 PolarHBondContact O-N 3.31Å; L465-L468 PolarHBondContact O-N 3.47Å; L468-N470 VanDerWaalsContact C-N 3.31Å; L468-N470 PolarHBondContact O-N 3.22Å; L468-I471 PolarHBondContact O-N 3.17Å; L468-I472 HydrophobicContact CD2-CD1 4.27Å; L468-I472 HydrophobicContact CG-CD1 4.08Å; L468-I472 VanDerWaalsContact O-CG1 3.3Å; L468-I472 WeakPolarHBondContact O-CG1 3.46Å; L468-I472 PolarHBondContact O-N 3.22Å
469	T	80.7	Confident	79.4	Confident	74 Å²	74	92.6 Å²	92.6	45%	0.454	47%	0.468	S	S	.	.	H	α-helix	trans	-63.1	-38.4	175.4	29.2	0	0	0	0	111.6	L465 I466 I472 T473	L465-T469 PolarHBondContact O-N 2.93Å; L465-T469 PolarHBondContact O-OG1 3.22Å; I466-T469 WeakPolarHBondContact CA-OG1 3.42Å; I466-T469 PolarHBondContact O-OG1 3.4Å; I466-T469 VanDerWaalsContact O-OG1 3.13Å; T469-I472 PolarHBondContact O-N 2.98Å; T469-T473 WeakPolarHBondContact O-CG2 3.24Å; T469-T473 PolarHBondContact O-N 3.14Å; T469-T473 PolarHBondContact O-OG1 3.29Å
470	N	83.9	Confident	80.9	Confident	87 Å²	87	92.9 Å²	92.9	47%	0.465	47%	0.469	S	S	.	.	H	α-helix	trans	-64	-38.8	174.6	-78.4	-13.1	0	0	0	112.9	I466 W467 L468 T473 I474	I466-N470 WeakPolarHBondContact O-CB 3.33Å; I466-N470 VanDerWaalsContact O-CG 3.27Å; I466-N470 PolarHBondContact O-N 3.32Å; W467-N470 PolarHBondContact O-N 2.96Å; L468-N470 VanDerWaalsContact C-N 3.31Å; L468-N470 PolarHBondContact O-N 3.22Å; N470-T473 VanDerWaalsContact CA-OG1 3.31Å; N470-T473 WeakPolarHBondContact CA-OG1 3.38Å; N470-T473 PolarHBondContact O-OG1 3.39Å; N470-I474 WeakPolarHBondContact O-CB 3.32Å; N470-I474 WeakPolarHBondContact O-CD1 3.39Å; N470-I474 WeakPolarHBondContact O-CG1 3.49Å; N470-I474 PolarHBondContact O-N 3.49Å
471	I	84.4	Confident	82.3	Confident	56 Å²	56	92.5 Å²	92.5	29%	0.287	47%	0.472	S	S	.	.	H	α-helix	trans	-66.9	-43.2	174.5	-75.6	-176.7	0	0	0	111.4	W467 L468 T473 I474 L475	W467-I471 HydrophobicContact CD2-CD1 3.85Å; W467-I471 HydrophobicContact CD2-CG1 4.44Å; W467-I471 HydrophobicContact CE3-CD1 3.55Å; W467-I471 HydrophobicContact CE3-CG1 4.43Å; W467-I471 HydrophobicContact CH2-CD1 3.18Å; W467-I471 HydrophobicContact CZ2-CD1 3.47Å; W467-I471 VanDerWaalsContact CZ2-CD1 3.47Å; W467-I471 HydrophobicContact CZ3-CD1 3.22Å; W467-I471 HydrophobicContact CZ3-CG1 4.48Å; W467-I471 PolarHBondContact O-N 2.73Å; L468-I471 PolarHBondContact O-N 3.17Å; I471-T473 VanDerWaalsContact C-N 3.33Å; I471-T473 PolarHBondContact O-N 3.32Å; I471-I474 PolarHBondContact O-N 3.42Å; I471-L475 HydrophobicContact CG2-CD1 3.92Å; I471-L475 WeakPolarHBondContact O-CB 3.26Å; I471-L475 PolarHBondContact O-N 2.84Å
472	I	84.9	Confident	83.7	Confident	84 Å²	84	93.7 Å²	93.7	43%	0.431	48%	0.478	S	S	.	.	H	α-helix	trans	-63.1	-41.3	178.5	-69.2	167.9	0	0	0	110.6	L468 T469 L475 L476	L468-I472 HydrophobicContact CD2-CD1 4.27Å; L468-I472 HydrophobicContact CG-CD1 4.08Å; L468-I472 VanDerWaalsContact O-CG1 3.3Å; L468-I472 WeakPolarHBondContact O-CG1 3.46Å; L468-I472 PolarHBondContact O-N 3.22Å; T469-I472 PolarHBondContact O-N 2.98Å; I472-L475 PolarHBondContact O-N 3.28Å; I472-L476 HydrophobicContact CG2-CD1 4.17Å; I472-L476 WeakPolarHBondContact O-CG 3.26Å; I472-L476 PolarHBondContact O-N 3.32Å
473	T	85.6	Confident	84.6	Confident	67 Å²	67	91.3 Å²	91.3	41%	0.411	47%	0.469	S	S	.	.	H	α-helix	trans	-67.1	-40.4	176	47.5	0	0	0	0	112.1	T469 N470 I471 L475 L476 I477	T469-T473 WeakPolarHBondContact O-CG2 3.24Å; T469-T473 PolarHBondContact O-N 3.14Å; T469-T473 PolarHBondContact O-OG1 3.29Å; N470-T473 VanDerWaalsContact CA-OG1 3.31Å; N470-T473 WeakPolarHBondContact CA-OG1 3.38Å; N470-T473 PolarHBondContact O-OG1 3.39Å; I471-T473 VanDerWaalsContact C-N 3.33Å; I471-T473 PolarHBondContact O-N 3.32Å; T473-L475 PolarHBondContact O-N 3.15Å; T473-L476 PolarHBondContact O-N 2.89Å; T473-I477 VanDerWaalsContact O-CG1 3.27Å; T473-I477 WeakPolarHBondContact O-CG1 3.45Å; T473-I477 PolarHBondContact O-N 2.96Å
474	I	88.3	Confident	85.6	Confident	94 Å²	94	90.7 Å²	90.7	48%	0.482	47%	0.468	S	S	.	.	H	α-helix	trans	-60.8	-45.4	173.7	-69.6	164.8	0	0	0	110.8	N470 I471 L476 I477 I478	N470-I474 WeakPolarHBondContact O-CB 3.32Å; N470-I474 WeakPolarHBondContact O-CD1 3.39Å; N470-I474 WeakPolarHBondContact O-CG1 3.49Å; N470-I474 PolarHBondContact O-N 3.49Å; I471-I474 PolarHBondContact O-N 3.42Å; I474-L476 VanDerWaalsContact C-N 3.34Å; I474-L476 PolarHBondContact O-N 3.48Å; I474-I477 PolarHBondContact O-N 3.34Å; I474-I478 HydrophobicContact CG2-CD1 3.83Å; I474-I478 HydrophobicContact CG2-CG1 4.41Å; I474-I478 WeakPolarHBondContact O-CG1 3.42Å; I474-I478 PolarHBondContact O-N 3.21Å
475	L	87.5	Confident	86.7	Confident	108 Å²	108	91.9 Å²	91.9	57%	0.565	48%	0.477	S	S	*	.	H	α-helix	trans	-59.8	-42.3	176	-94.5	156.4	0	0	0	112.2	I471 I472 T473 I478 L479	I471-L475 HydrophobicContact CG2-CD1 3.92Å; I471-L475 WeakPolarHBondContact O-CB 3.26Å; I471-L475 PolarHBondContact O-N 2.84Å; I472-L475 PolarHBondContact O-N 3.28Å; T473-L475 PolarHBondContact O-N 3.15Å; L475-I478 PolarHBondContact O-N 3.41Å; L475-L479 WeakPolarHBondContact O-CB 3.34Å; L475-L479 PolarHBondContact O-N 2.92Å
476	L	88.7	Confident	87.7	Confident	95 Å²	95	91.9 Å²	91.9	50%	0.497	48%	0.477	S	S	.	.	H	α-helix	trans	-64.6	-39.3	175.4	-80.1	167.6	0	0	0	112.4	I472 T473 I474 L479 L480	I472-L476 HydrophobicContact CG2-CD1 4.17Å; I472-L476 WeakPolarHBondContact O-CG 3.26Å; I472-L476 PolarHBondContact O-N 3.32Å; T473-L476 PolarHBondContact O-N 2.89Å; I474-L476 VanDerWaalsContact C-N 3.34Å; I474-L476 PolarHBondContact O-N 3.48Å; L476-L479 PolarHBondContact O-N 2.93Å; L476-L480 WeakPolarHBondContact O-CG 3.44Å; L476-L480 PolarHBondContact O-N 3.44Å
477	I	90.5	Very high	88.4	Confident	104 Å²	104	93.1 Å²	93.1	53%	0.533	48%	0.479	S	S	.	.	H	α-helix	trans	-65.4	-45.6	175.6	-68.2	164.3	0	0	0	110.4	T473 I474 L479 L480 V481	T473-I477 VanDerWaalsContact O-CG1 3.27Å; T473-I477 WeakPolarHBondContact O-CG1 3.45Å; T473-I477 PolarHBondContact O-N 2.96Å; I474-I477 PolarHBondContact O-N 3.34Å; I477-L479 VanDerWaalsContact C-N 3.33Å; I477-L479 PolarHBondContact O-N 3.21Å; I477-L480 PolarHBondContact O-N 3.39Å; I477-V481 WeakPolarHBondContact O-CG2 3.35Å; I477-V481 PolarHBondContact O-N 3.43Å
478	I	91	Very high	89.1	Confident	95 Å²	95	86.2 Å²	86.2	49%	0.487	46%	0.463	S	S	.	.	H	α-helix	trans	-59.8	-45.3	176.4	-68	168.6	0	0	0	110.3	I474 L475 L480 V481 V482	I474-I478 HydrophobicContact CG2-CD1 3.83Å; I474-I478 HydrophobicContact CG2-CG1 4.41Å; I474-I478 WeakPolarHBondContact O-CG1 3.42Å; I474-I478 PolarHBondContact O-N 3.21Å; L475-I478 PolarHBondContact O-N 3.41Å; I478-L480 VanDerWaalsContact C-N 3.34Å; I478-L480 PolarHBondContact O-N 2.89Å; I478-V481 PolarHBondContact O-N 3.23Å; I478-V482 HydrophobicContact CG2-CG2 4.43Å; I478-V482 WeakPolarHBondContact O-CG2 3.28Å; I478-V482 PolarHBondContact O-N 3.5Å
479	L	91.2	Very high	89.9	Confident	98 Å²	98	87.1 Å²	87.1	51%	0.513	47%	0.467	S	S	.	.	H	α-helix	trans	-59.3	-44	176.9	-174.9	69.2	0	0	0	111.6	L475 L476 I477 V482 I483	L475-L479 WeakPolarHBondContact O-CB 3.34Å; L475-L479 PolarHBondContact O-N 2.92Å; L476-L479 PolarHBondContact O-N 2.93Å; I477-L479 VanDerWaalsContact C-N 3.33Å; I477-L479 PolarHBondContact O-N 3.21Å; L479-V482 PolarHBondContact O-N 2.95Å; L479-I483 HydrophobicContact CG-CD1 4.1Å; L479-I483 VanDerWaalsContact O-CG1 3.26Å; L479-I483 WeakPolarHBondContact O-CG1 3.44Å; L479-I483 PolarHBondContact O-N 2.96Å
480	L	92.7	Very high	90.5	Very high	107 Å²	107	88.9 Å²	88.9	56%	0.56	47%	0.473	S	S	*	.	H	α-helix	trans	-62.2	-42.2	175.6	-80.5	170.3	0	0	0	112.3	L476 I477 I478 I483 I484	L476-L480 WeakPolarHBondContact O-CG 3.44Å; L476-L480 PolarHBondContact O-N 3.44Å; I477-L480 PolarHBondContact O-N 3.39Å; I478-L480 VanDerWaalsContact C-N 3.34Å; I478-L480 PolarHBondContact O-N 2.89Å; L480-I483 PolarHBondContact O-N 2.92Å; L480-I484 VanDerWaalsContact O-CG1 3.28Å; L480-I484 WeakPolarHBondContact O-CG1 3.37Å; L480-I484 PolarHBondContact O-N 2.99Å
481	V	93	Very high	90.9	Very high	73 Å²	73	92 Å²	92	44%	0.442	48%	0.483	S	S	.	.	H	α-helix	trans	-63	-44.2	176.5	171.8	0	0	0	0	110.9	I477 I478 I483 I484 I485	I477-V481 WeakPolarHBondContact O-CG2 3.35Å; I477-V481 PolarHBondContact O-N 3.43Å; I478-V481 PolarHBondContact O-N 3.23Å; V481-I483 VanDerWaalsContact C-N 3.33Å; V481-I483 PolarHBondContact O-N 2.95Å; V481-I484 PolarHBondContact O-N 3.29Å; V481-I485 HydrophobicContact CG1-CD1 3.82Å; V481-I485 HydrophobicContact CG1-CG1 4.42Å; V481-I485 VanDerWaalsContact O-CG1 3.32Å; V481-I485 WeakPolarHBondContact O-CG1 3.36Å; V481-I485 PolarHBondContact O-N 3.41Å
482	V	93.2	Very high	91.3	Very high	71 Å²	71	93.6 Å²	93.6	43%	0.43	49%	0.491	S	S	.	.	H	α-helix	trans	-60.5	-43.6	176.2	171.8	0	0	0	0	110.9	I478 L479 I484 I485 L486	I478-V482 HydrophobicContact CG2-CG2 4.43Å; I478-V482 WeakPolarHBondContact O-CG2 3.28Å; I478-V482 PolarHBondContact O-N 3.5Å; L479-V482 PolarHBondContact O-N 2.95Å; V482-I484 PolarHBondContact O-N 2.83Å; V482-I485 PolarHBondContact O-N 3.48Å; V482-L486 HydrophobicContact CG1-CD1 3.95Å; V482-L486 HydrophobicContact CG1-CG 4.42Å; V482-L486 WeakPolarHBondContact O-CB 3.45Å; V482-L486 WeakPolarHBondContact O-CG 3.41Å; V482-L486 PolarHBondContact O-N 3.27Å
483	I	92.2	Very high	91.7	Very high	67 Å²	67	95.8 Å²	95.8	34%	0.344	50%	0.498	S	S	.	.	H	α-helix	trans	-60.6	-45.8	176	-70.4	167.1	0	0	0	110.7	L479 L480 V481 I485 L486 F487	L479-I483 HydrophobicContact CG-CD1 4.1Å; L479-I483 VanDerWaalsContact O-CG1 3.26Å; L479-I483 WeakPolarHBondContact O-CG1 3.44Å; L479-I483 PolarHBondContact O-N 2.96Å; L480-I483 PolarHBondContact O-N 2.92Å; V481-I483 VanDerWaalsContact C-N 3.33Å; V481-I483 PolarHBondContact O-N 2.95Å; I483-I485 PolarHBondContact O-N 3.46Å; I483-L486 PolarHBondContact O-N 3.31Å; I483-F487 HydrophobicContact CG2-CD2 3.58Å; I483-F487 HydrophobicContact CG2-CE2 3.61Å; I483-F487 VanDerWaalsContact O-CD2 3.26Å; I483-F487 WeakPolarHBondContact O-CD2 3.46Å; I483-F487 PolarHBondContact O-N 2.89Å
484	I	93.5	Very high	92	Very high	118 Å²	118	96.2 Å²	96.2	61%	0.605	50%	0.504	S	S	*	.	H	α-helix	trans	-62.1	-42.8	178.2	-68.9	165.2	0	0	0	111.3	L480 V481 V482 F487 G488	L480-I484 VanDerWaalsContact O-CG1 3.28Å; L480-I484 WeakPolarHBondContact O-CG1 3.37Å; L480-I484 PolarHBondContact O-N 2.99Å; V481-I484 PolarHBondContact O-N 3.29Å; V482-I484 PolarHBondContact O-N 2.83Å; I484-F487 PolarHBondContact O-N 3.25Å; I484-G488 PolarHBondContact O-N 3.44Å
485	I	93.2	Very high	92.3	Very high	97 Å²	97	98.4 Å²	98.4	50%	0.497	51%	0.507	S	S	.	.	H	α-helix	trans	-63.2	-45.7	177	-68.1	168.1	0	0	0	110.5	V481 V482 I483 F487 G488 L489	V481-I485 HydrophobicContact CG1-CD1 3.82Å; V481-I485 HydrophobicContact CG1-CG1 4.42Å; V481-I485 VanDerWaalsContact O-CG1 3.32Å; V481-I485 WeakPolarHBondContact O-CG1 3.36Å; V481-I485 PolarHBondContact O-N 3.41Å; V482-I485 PolarHBondContact O-N 3.48Å; I483-I485 PolarHBondContact O-N 3.46Å; I485-F487 PolarHBondContact O-N 2.89Å; I485-G488 PolarHBondContact O-N 2.8Å; I485-L489 HydrophobicContact CG2-CD1 4.16Å; I485-L489 HydrophobicContact CG2-CG 4.49Å; I485-L489 WeakPolarHBondContact O-CG 3.18Å; I485-L489 PolarHBondContact O-N 2.85Å
486	L	93.4	Very high	92.5	Very high	99 Å²	99	99.5 Å²	99.5	52%	0.518	51%	0.507	S	S	.	.	H	α-helix	trans	-60.6	-44.5	177.2	-74.9	170.5	0	0	0	111.6	V482 I483 L489 L490	V482-L486 HydrophobicContact CG1-CD1 3.95Å; V482-L486 HydrophobicContact CG1-CG 4.42Å; V482-L486 WeakPolarHBondContact O-CB 3.45Å; V482-L486 WeakPolarHBondContact O-CG 3.41Å; V482-L486 PolarHBondContact O-N 3.27Å; I483-L486 PolarHBondContact O-N 3.31Å; L486-L489 PolarHBondContact O-N 2.97Å; L486-L490 WeakPolarHBondContact O-CB 3.48Å; L486-L490 WeakPolarHBondContact O-CG 3.47Å; L486-L490 PolarHBondContact O-N 3.01Å
487	F	93.3	Very high	92.7	Very high	122 Å²	122	99.8 Å²	99.8	54%	0.535	51%	0.508	S	S	.	.	H	α-helix	trans	-63.1	-42.6	174.2	-86.7	-69.6	0	0	0	112.1	I483 I484 I485 L489 L490 F491	I483-F487 HydrophobicContact CG2-CD2 3.58Å; I483-F487 HydrophobicContact CG2-CE2 3.61Å; I483-F487 VanDerWaalsContact O-CD2 3.26Å; I483-F487 WeakPolarHBondContact O-CD2 3.46Å; I483-F487 PolarHBondContact O-N 2.89Å; I484-F487 PolarHBondContact O-N 3.25Å; I485-F487 PolarHBondContact O-N 2.89Å; F487-L489 PolarHBondContact O-N 2.06Å; F487-L490 PolarHBondContact O-N 3.45Å; F487-F491 VanDerWaalsContact O-CD2 3.24Å; F487-F491 WeakPolarHBondContact O-CD2 3.36Å; F487-F491 PolarHBondContact O-N 3.15Å
488	G	93.2	Very high	92.7	Very high	31 Å²	31	101.5 Å²	101.5	32%	0.32	51%	0.512	S	S	.	.	H	α-helix	trans	-59.1	-45.1	176	0	0	0	0	0	112.5	I484 I485 F491 I492	I484-G488 PolarHBondContact O-N 3.44Å; I485-G488 PolarHBondContact O-N 2.8Å; G488-F491 PolarHBondContact O-N 3.42Å; G488-I492 WeakPolarHBondContact O-CG1 3.3Å; G488-I492 PolarHBondContact O-N 3.25Å
489	L	93.5	Very high	92.8	Very high	82 Å²	82	100.7 Å²	100.7	43%	0.429	51%	0.506	S	S	.	.	H	α-helix	trans	-62.9	-43.4	174.5	-71.4	174.1	0	0	0	111.6	I485 L486 F487 F491 I492 F493	I485-L489 HydrophobicContact CG2-CD1 4.16Å; I485-L489 HydrophobicContact CG2-CG 4.49Å; I485-L489 WeakPolarHBondContact O-CG 3.18Å; I485-L489 PolarHBondContact O-N 2.85Å; L486-L489 PolarHBondContact O-N 2.97Å; F487-L489 PolarHBondContact O-N 2.06Å; L489-F491 VanDerWaalsContact C-N 3.32Å; L489-F491 PolarHBondContact O-N 2.98Å; L489-I492 PolarHBondContact O-N 2.89Å; L489-F493 HydrophobicContact CB-CD2 4.5Å; L489-F493 WeakPolarHBondContact O-CB 3.34Å; L489-F493 VanDerWaalsContact O-CD2 3.23Å; L489-F493 WeakPolarHBondContact O-CD2 3.23Å; L489-F493 PolarHBondContact O-N 3.48Å
490	L	93.4	Very high	92.8	Very high	111 Å²	111	103 Å²	103	58%	0.581	51%	0.509	S	S	*	.	H	α-helix	trans	-60.1	-40.5	176.1	-76.2	170.5	0	0	0	112.3	L486 F487 S494	L486-L490 WeakPolarHBondContact O-CB 3.48Å; L486-L490 WeakPolarHBondContact O-CG 3.47Å; L486-L490 PolarHBondContact O-N 3.01Å; F487-L490 PolarHBondContact O-N 3.45Å; L490-S494 VanDerWaalsContact O-CB 3.24Å; L490-S494 WeakPolarHBondContact O-CB 3.18Å; L490-S494 PolarHBondContact O-N 3.02Å
491	F	93	Very high	92.6	Very high	154 Å²	154	102.6 Å²	102.6	68%	0.675	51%	0.507	S	S	*	.	H	α-helix	trans	-64	-42.8	174.7	-88	-71.6	0	0	0	112.2	F487 G488 L489 S494 Y495	F487-F491 VanDerWaalsContact O-CD2 3.24Å; F487-F491 WeakPolarHBondContact O-CD2 3.36Å; F487-F491 PolarHBondContact O-N 3.15Å; G488-F491 PolarHBondContact O-N 3.42Å; L489-F491 VanDerWaalsContact C-N 3.32Å; L489-F491 PolarHBondContact O-N 2.98Å; F491-S494 PolarHBondContact O-N 2.92Å; F491-Y495 WeakPolarHBondContact O-CB 3.27Å; F491-Y495 PolarHBondContact O-N 2.93Å
492	I	93	Very high	92.5	Very high	89 Å²	89	103 Å²	103	46%	0.456	51%	0.506	S	S	.	.	H	α-helix	trans	-64.3	-47.3	177	-68.2	167.2	0	0	0	110.7	G488 L489 S494 Y495 F496	G488-I492 WeakPolarHBondContact O-CG1 3.3Å; G488-I492 PolarHBondContact O-N 3.25Å; L489-I492 PolarHBondContact O-N 2.89Å; I492-S494 VanDerWaalsContact C-N 3.35Å; I492-S494 PolarHBondContact O-N 3.12Å; I492-Y495 WeakPolarHBondContact O-CB 3.31Å; I492-Y495 PolarHBondContact O-N 3.34Å; I492-F496 HydrophobicContact CG2-CD2 3.63Å; I492-F496 HydrophobicContact CG2-CE2 3.48Å; I492-F496 VanDerWaalsContact CG2-CE2 3.48Å; I492-F496 VanDerWaalsContact O-CD2 3.25Å; I492-F496 WeakPolarHBondContact O-CD2 3.47Å; I492-F496 PolarHBondContact O-N 3.14Å
493	F	92.1	Very high	92.2	Very high	130 Å²	130	104.4 Å²	104.4	57%	0.57	51%	0.511	S	S	*	.	H	α-helix	trans	-60.7	-43.3	176.1	-86.3	-68.6	0	0	0	111.8	L489 Y495 F496 I497	L489-F493 HydrophobicContact CB-CD2 4.5Å; L489-F493 WeakPolarHBondContact O-CB 3.34Å; L489-F493 VanDerWaalsContact O-CD2 3.23Å; L489-F493 WeakPolarHBondContact O-CD2 3.23Å; L489-F493 PolarHBondContact O-N 3.48Å; F493-Y495 VanDerWaalsContact C-N 3.31Å; F493-Y495 PolarHBondContact O-N 3.47Å; F493-F496 PolarHBondContact O-N 3.31Å; F493-I497 WeakPolarHBondContact O-CB 3.28Å; F493-I497 VanDerWaalsContact O-CG1 3.25Å; F493-I497 WeakPolarHBondContact O-CG1 3.07Å; F493-I497 PolarHBondContact O-N 2.95Å
494	S	92.8	Very high	92	Very high	76 Å²	76	106.1 Å²	106.1	53%	0.531	52%	0.517	S	S	.	.	H	α-helix	trans	-60.3	-40.4	175.5	-174.2	0	0	0	0	112	L490 F491 I492 K498	L490-S494 VanDerWaalsContact O-CB 3.24Å; L490-S494 WeakPolarHBondContact O-CB 3.18Å; L490-S494 PolarHBondContact O-N 3.02Å; F491-S494 PolarHBondContact O-N 2.92Å; I492-S494 VanDerWaalsContact C-N 3.35Å; I492-S494 PolarHBondContact O-N 3.12Å; S494-K498 WeakPolarHBondContact O-CB 3.21Å; S494-K498 PolarHBondContact O-N 3.13Å
495	Y	93.5	Very high	91.7	Very high	139 Å²	139	109.1 Å²	109.1	55%	0.545	52%	0.521	S	S	.	.	H	α-helix	trans	-62.6	-47.4	174.1	-179.6	-93.1	0	0	0	112.2	F491 I492 F493 K498 Q499	F491-Y495 WeakPolarHBondContact O-CB 3.27Å; F491-Y495 PolarHBondContact O-N 2.93Å; I492-Y495 WeakPolarHBondContact O-CB 3.31Å; I492-Y495 PolarHBondContact O-N 3.34Å; F493-Y495 VanDerWaalsContact C-N 3.31Å; F493-Y495 PolarHBondContact O-N 3.47Å; Y495-K498 PolarHBondContact O-N 3.43Å; Y495-Q499 HydrophobicContact CD1-CG 4.17Å; Y495-Q499 HydrophobicContact CE1-CG 3.73Å; Y495-Q499 HydrophobicContact CE2-CG 4.49Å; Y495-Q499 WeakPolarHBondContact O-CG 3.42Å; Y495-Q499 PolarHBondContact O-N 2.93Å; Y495-Q499 PolarHBondContact OH-NE2 3.39Å; Y495-Q499 VanDerWaalsContact OH-NE2 3.08Å
496	F	92.5	Very high	91.3	Very high	131 Å²	131	110.8 Å²	110.8	58%	0.575	53%	0.527	S	S	*	.	H	α-helix	trans	-64.6	-40.9	178	-81.4	-67	0	0	0	112.8	I492 F493 K498 Q499 Y500	I492-F496 HydrophobicContact CG2-CD2 3.63Å; I492-F496 HydrophobicContact CG2-CE2 3.48Å; I492-F496 VanDerWaalsContact CG2-CE2 3.48Å; I492-F496 VanDerWaalsContact O-CD2 3.25Å; I492-F496 WeakPolarHBondContact O-CD2 3.47Å; I492-F496 PolarHBondContact O-N 3.14Å; F493-F496 PolarHBondContact O-N 3.31Å; F496-K498 VanDerWaalsContact C-N 3.31Å; F496-K498 PolarHBondContact O-N 3.45Å; F496-Q499 PolarHBondContact O-N 2.99Å; F496-Y500 VanDerWaalsContact O-CB 3.3Å; F496-Y500 WeakPolarHBondContact O-CB 3.29Å; F496-Y500 PolarHBondContact O-N 2.88Å
497	I	91.9	Very high	90.7	Very high	101 Å²	101	111 Å²	111	52%	0.518	53%	0.528	S	S	.	.	H	α-helix	trans	-60.7	-43.4	174.8	-69.1	165.7	0	0	0	110	F493 Y500 L501	F493-I497 WeakPolarHBondContact O-CB 3.28Å; F493-I497 VanDerWaalsContact O-CG1 3.25Å; F493-I497 WeakPolarHBondContact O-CG1 3.07Å; F493-I497 PolarHBondContact O-N 2.95Å; I497-Y500 PolarHBondContact O-N 3.46Å; I497-L501 HydrophobicContact CG2-CD1 3.97Å; I497-L501 HydrophobicContact CG2-CG 4.41Å; I497-L501 WeakPolarHBondContact O-CB 3.25Å; I497-L501 VanDerWaalsContact O-CG 3.3Å; I497-L501 WeakPolarHBondContact O-CG 3.46Å; I497-L501 PolarHBondContact O-N 3.25Å
498	K	92.1	Very high	90.2	Very high	140 Å²	140	114 Å²	114	61%	0.609	54%	0.541	S	S	*	.	H	α-helix	trans	-62.9	-43.5	177.1	-170.6	178.1	179.6	-179.1	0	112.1	S494 Y495 F496 L501 L502	S494-K498 WeakPolarHBondContact O-CB 3.21Å; S494-K498 PolarHBondContact O-N 3.13Å; Y495-K498 PolarHBondContact O-N 3.43Å; F496-K498 VanDerWaalsContact C-N 3.31Å; F496-K498 PolarHBondContact O-N 3.45Å; K498-L501 PolarHBondContact O-N 3.46Å; K498-L502 WeakPolarHBondContact O-CG 3.44Å; K498-L502 PolarHBondContact O-N 3.13Å
499	Q	91.9	Very high	89.4	Confident	79 Å²	79	119 Å²	119	37%	0.369	56%	0.559	S	S	.	*	H	α-helix	trans	-64.8	-42.8	175.9	-71.3	-66	-1.9	0	0	111.9	Y495 F496 L501 L502 L503	Y495-Q499 HydrophobicContact CD1-CG 4.17Å; Y495-Q499 HydrophobicContact CE1-CG 3.73Å; Y495-Q499 HydrophobicContact CE2-CG 4.49Å; Y495-Q499 WeakPolarHBondContact O-CG 3.42Å; Y495-Q499 PolarHBondContact O-N 2.93Å; Y495-Q499 PolarHBondContact OH-NE2 3.39Å; Y495-Q499 VanDerWaalsContact OH-NE2 3.08Å; F496-Q499 PolarHBondContact O-N 2.99Å; Q499-L501 PolarHBondContact O-N 3.2Å; Q499-L502 PolarHBondContact O-N 2.74Å; Q499-L503 PolarHBondContact O-N 3.29Å
500	Y	90.8	Very high	88.1	Confident	145 Å²	145	127.5 Å²	127.5	57%	0.569	59%	0.585	S	S	*	*	H	α-helix	trans	-61.6	-42.6	176.7	-179.2	-98.2	0	0	0	112.2	F496 I497 L503 Q504	F496-Y500 VanDerWaalsContact O-CB 3.3Å; F496-Y500 WeakPolarHBondContact O-CB 3.29Å; F496-Y500 PolarHBondContact O-N 2.88Å; I497-Y500 PolarHBondContact O-N 3.46Å; Y500-L503 PolarHBondContact O-N 3.49Å; Y500-Q504 HydrophobicContact CD1-CG 4.5Å; Y500-Q504 HydrophobicContact CE1-CG 4Å; Y500-Q504 PolarHBondContact O-N 3.05Å; Y500-Q504 PolarHBondContact OH-NE2 2.92Å; Y500-Q504 VanDerWaalsContact OH-NE2 3.15Å
501	L	90.3	Very high	87.8	Confident	99 Å²	99	128.4 Å²	128.4	52%	0.518	59%	0.586	S	S	.	*	H	α-helix	trans	-65.8	-37.1	175.7	-72.9	172.3	0	0	0	112.7	I497 K498 Q499 R505	I497-L501 HydrophobicContact CG2-CD1 3.97Å; I497-L501 HydrophobicContact CG2-CG 4.41Å; I497-L501 WeakPolarHBondContact O-CB 3.25Å; I497-L501 VanDerWaalsContact O-CG 3.3Å; I497-L501 WeakPolarHBondContact O-CG 3.46Å; I497-L501 PolarHBondContact O-N 3.25Å; K498-L501 PolarHBondContact O-N 3.46Å; Q499-L501 PolarHBondContact O-N 3.2Å; L501-R505 WeakPolarHBondContact O-CB 3.35Å; L501-R505 PolarHBondContact O-N 2.86Å; L501-R505 VanDerWaalsContact O-N 3.08Å
502	L	89.2	Confident	87.6	Confident	83 Å²	83	127 Å²	127	44%	0.435	58%	0.581	S	S	.	*	H	α-helix	trans	-64.5	-44.6	173.2	-75.1	169.7	0	0	0	111.2	K498 Q499 R505 E506	K498-L502 WeakPolarHBondContact O-CG 3.44Å; K498-L502 PolarHBondContact O-N 3.13Å; Q499-L502 PolarHBondContact O-N 2.74Å; L502-R505 WeakPolarHBondContact O-CB 3.26Å; L502-R505 PolarHBondContact O-N 3.37Å; L502-R505 VanDerWaalsContact O-N 3.15Å; L502-E506 PolarHBondContact O-N 2.92Å
503	L	88.5	Confident	87.3	Confident	100 Å²	100	129.1 Å²	129.1	52%	0.524	59%	0.588	S	S	.	*	H	α-helix	trans	-65.6	-40.3	179	-142	107.6	0	0	0	112.3	Q499 Y500 R505 E506 N507	Q499-L503 PolarHBondContact O-N 3.29Å; Y500-L503 PolarHBondContact O-N 3.49Å; L503-R505 VanDerWaalsContact C-N 3.29Å; L503-R505 PolarHBondContact O-N 3.39Å; L503-E506 PolarHBondContact O-N 3.41Å; L503-N507 WeakPolarHBondContact O-CB 3.45Å; L503-N507 PolarHBondContact O-N 3.43Å
504	Q	87.6	Confident	87	Confident	103 Å²	103	129.1 Å²	129.1	48%	0.481	59%	0.589	S	S	.	*	H	α-helix	trans	-62.6	-36.3	172.5	-88.2	-158.7	-21	0	0	112.2	Y500 K508	Y500-Q504 HydrophobicContact CD1-CG 4.5Å; Y500-Q504 HydrophobicContact CE1-CG 4Å; Y500-Q504 PolarHBondContact O-N 3.05Å; Y500-Q504 PolarHBondContact OH-NE2 2.92Å; Y500-Q504 VanDerWaalsContact OH-NE2 3.15Å; Q504-K508 WeakPolarHBondContact O-CB 3.34Å; Q504-K508 PolarHBondContact O-N 3.28Å; Q504-K508 VanDerWaalsContact O-N 3.13Å
505	R	85.9	Confident	86.6	Confident	180 Å²	180	132.4 Å²	132.4	68%	0.679	59%	0.592	S	S	*	*	H	α-helix	trans	-68.4	-41.4	177.4	-168.5	178.8	-177.6	179.7	0.8	111.5	L501 L502 L503 K508 I509	L501-R505 WeakPolarHBondContact O-CB 3.35Å; L501-R505 PolarHBondContact O-N 2.86Å; L501-R505 VanDerWaalsContact O-N 3.08Å; L502-R505 WeakPolarHBondContact O-CB 3.26Å; L502-R505 PolarHBondContact O-N 3.37Å; L502-R505 VanDerWaalsContact O-N 3.15Å; L503-R505 VanDerWaalsContact C-N 3.29Å; L503-R505 PolarHBondContact O-N 3.39Å; R505-K508 PolarHBondContact O-N 3.2Å; R505-I509 HydrophobicContact CG-CD1 4.26Å; R505-I509 WeakPolarHBondContact O-CD1 3.49Å; R505-I509 VanDerWaalsContact O-CG1 3.31Å; R505-I509 WeakPolarHBondContact O-CG1 3.36Å; R505-I509 PolarHBondContact O-N 3.38Å
506	E	85.8	Confident	86.2	Confident	133 Å²	133	131.9 Å²	131.9	62%	0.621	60%	0.596	S	S	*	*	H	α-helix	trans	-65.4	-44.3	175.4	-72.9	-175.1	169.9	0	0	112.1	L502 L503 K508 I509 R510	L502-E506 PolarHBondContact O-N 2.92Å; L503-E506 PolarHBondContact O-N 3.41Å; E506-K508 PolarHBondContact O-N 3.46Å; E506-I509 PolarHBondContact O-N 3.36Å; E506-I509 VanDerWaalsContact O-N 3.1Å; E506-R510 PolarHBondContact O-N 3.07Å
507	N	81.6	Confident	85.7	Confident	104 Å²	104	132 Å²	132	56%	0.556	60%	0.597	S	S	*	*	H	α-helix	trans	-67.3	-16.3	176.5	-81.5	-11.7	0	0	0	114.2	L503 R510	L503-N507 WeakPolarHBondContact O-CB 3.45Å; L503-N507 PolarHBondContact O-N 3.43Å; N507-R510 VanDerWaalsContact O-OXT 3.1Å
508	K	81.3	Confident	85.2	Confident	184 Å²	184	134.4 Å²	134.4	80%	0.8	60%	0.603	S	S	*	*	H	α-helix	trans	-89.3	-21.4	173.2	-168.3	174.1	-178.9	178.2	0	112.5	Q504 R505 E506	Q504-K508 WeakPolarHBondContact O-CB 3.34Å; Q504-K508 PolarHBondContact O-N 3.28Å; Q504-K508 VanDerWaalsContact O-N 3.13Å; R505-K508 PolarHBondContact O-N 3.2Å; E506-K508 PolarHBondContact O-N 3.46Å
509	I	77.5	Confident	84.7	Confident	135 Å²	135	133.9 Å²	133.9	69%	0.692	60%	0.603	S	S	*	*	H	α-helix	trans	-84.9	-37	176.2	-68.1	165.7	0	0	0	110.7	R505 E506	R505-I509 HydrophobicContact CG-CD1 4.26Å; R505-I509 WeakPolarHBondContact O-CD1 3.49Å; R505-I509 VanDerWaalsContact O-CG1 3.31Å; R505-I509 WeakPolarHBondContact O-CG1 3.36Å; R505-I509 PolarHBondContact O-N 3.38Å; E506-I509 PolarHBondContact O-N 3.36Å; E506-I509 VanDerWaalsContact O-N 3.1Å
510	R	65.7	Low	84	Confident	262 Å²	262	138.9 Å²	138.9	99%	0.989	62%	0.624	S	S	*	*			trans	-75.2	0	169.8	-174.7	-177.5	-97.7	175.7	-6.5	110.3	E506 N507	E506-R510 PolarHBondContact O-N 3.07Å; N507-R510 VanDerWaalsContact O-OXT 3.1Å

Retrieved 510 of 510 residues in 307.8 ms (Link to these results)

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