A0A5K4F641_SCHMA Loading...

DUF1619 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F641, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 559 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	38.1	Very low	28.8	Very low	234 Å²	234	166.6 Å²	166.6	100%	1.153	85%	0.849	S	S	*	*				0	152.5	0	-76.5	164.8	149.1	0	0	108.6	F3	M1-F3 PolarHBondContact O-N 2.59Å
2	M	33.8	Very low	28.3	Very low	185 Å²	185	160.1 Å²	160.1	91%	0.911	83%	0.83	S	S	*	*			trans	-69	122.3	179.3	-83.1	-179.7	157.1	0	0	111.5	K4	M2-K4 PolarHBondContact O-N 2.96Å
3	F	30.8	Very low	27.9	Very low	214 Å²	214	157 Å²	157	94%	0.939	82%	0.823	S	S	*	*			trans	-71.4	103.8	160.8	-83.4	-99.9	0	0	0	108.4	M1 L5	M1-F3 PolarHBondContact O-N 2.59Å; F3-L5 PolarHBondContact O-N 3.37Å
4	K	30.3	Very low	27.5	Very low	181 Å²	181	156.4 Å²	156.4	79%	0.787	82%	0.819	S	S	*	*			trans	-73.1	109.5	166.7	-89.5	-167.7	172.1	-175.9	0	108.7	M2 L6	M2-K4 PolarHBondContact O-N 2.96Å; K4-L6 HydrophobicContact CB-CD1 4.41Å; K4-L6 PolarHBondContact O-N 2.82Å
5	L	27.1	Very low	27.3	Very low	162 Å²	162	155.6 Å²	155.6	85%	0.848	82%	0.815	S	S	*	*			trans	-65.3	94.3	169.7	-170.7	75.7	0	0	0	108.8	F3 T7	F3-L5 PolarHBondContact O-N 3.37Å; L5-T7 PolarHBondContact O-N 3.2Å
6	L	28.8	Very low	27.2	Very low	145 Å²	145	153.3 Å²	153.3	76%	0.759	80%	0.804	S	S	*	*			trans	-70.6	102.2	169.5	-90.7	85.5	0	0	0	108.5	K4 F8	K4-L6 HydrophobicContact CB-CD1 4.41Å; K4-L6 PolarHBondContact O-N 2.82Å; L6-F8 PolarHBondContact O-N 2.94Å
7	T	29.1	Very low	27.2	Very low	106 Å²	106	150.1 Å²	150.1	65%	0.65	80%	0.798	S	S	*	*			trans	-56.4	122.5	163.7	48.1	0	0	0	0	108.9	L5 L9	L5-T7 PolarHBondContact O-N 3.2Å; T7-L9 PolarHBondContact O-N 3.12Å
8	F	25.6	Very low	27.5	Very low	211 Å²	211	148.5 Å²	148.5	93%	0.925	79%	0.785	S	S	*	*			trans	-65.6	86.4	169.1	-76.6	-95.6	0	0	0	109.2	L6 S10	L6-F8 PolarHBondContact O-N 2.94Å; F8-S10 PolarHBondContact O-N 2.88Å
9	L	26.4	Very low	28.2	Very low	150 Å²	150	149.1 Å²	149.1	79%	0.785	79%	0.788	S	S	*	*			trans	-59.3	124.1	161.1	-80.2	166.7	0	0	0	106.9	T7 V11	T7-L9 PolarHBondContact O-N 3.12Å; L9-V11 PolarHBondContact O-N 3.12Å
10	S	23.4	Very low	29	Very low	109 Å²	109	146.5 Å²	146.5	76%	0.762	78%	0.783	S	S	*	*			trans	-58.8	108.1	179.1	51.6	0	0	0	0	109.5	F8 S12	F8-S10 PolarHBondContact O-N 2.88Å; S10-S12 PolarHBondContact O-N 2.93Å
11	V	23	Very low	30.1	Very low	136 Å²	136	142.4 Å²	142.4	82%	0.824	76%	0.764	S	S	*	*			trans	-65.6	94.8	163.1	179.4	0	0	0	0	105.9	L9 T13	L9-V11 PolarHBondContact O-N 3.12Å; V11-T13 PolarHBondContact O-N 3.33Å
12	S	22.9	Very low	30.9	Very low	88 Å²	88	132.8 Å²	132.8	62%	0.615	72%	0.72	S	S	*	*			trans	-52.5	132	171.4	45.3	0	0	0	0	108.4	S10 L14	S10-S12 PolarHBondContact O-N 2.93Å; S12-L14 VanDerWaalsContact C-N 3.33Å; S12-L14 PolarHBondContact O-N 3.46Å
13	T	23	Very low	32.7	Very low	120 Å²	120	129.4 Å²	129.4	74%	0.736	71%	0.706	S	S	*	*			trans	-65.8	87.7	-170.3	47.8	0	0	0	0	111.8	V11 L15	V11-T13 PolarHBondContact O-N 3.33Å; T13-L15 HydrophobicContact CG2-CD1 4.46Å; T13-L15 PolarHBondContact O-N 2.84Å
14	L	23.5	Very low	34.6	Very low	148 Å²	148	119.5 Å²	119.5	78%	0.775	66%	0.663	S	S	*	*			trans	-72.6	55.7	161.1	-70.1	168.9	0	0	0	109.6	S12	S12-L14 VanDerWaalsContact C-N 3.33Å; S12-L14 PolarHBondContact O-N 3.46Å
15	L	24.4	Very low	36.4	Very low	145 Å²	145	113.2 Å²	113.2	76%	0.759	64%	0.638	S	S	*	*			trans	-90.5	13.4	164.7	-71.8	172.1	0	0	0	111.3	T13 S17	T13-L15 HydrophobicContact CG2-CD1 4.46Å; T13-L15 PolarHBondContact O-N 2.84Å; L15-S17 PolarHBondContact O-N 3.36Å
16	N	24.4	Very low	38.4	Very low	119 Å²	119	111.5 Å²	111.5	64%	0.636	63%	0.628	S	S	*	*			trans	-83.1	68.1	144.2	-82.6	44.8	0	0	0	108.3	E18	N16-E18 HydrophobicContact CB-CG 4.28Å; N16-E18 PolarHBondContact ND2-OE1 2.92Å; N16-E18 PolarHBondContact O-N 3.02Å
17	S	28.6	Very low	39.6	Very low	99 Å²	99	107.6 Å²	107.6	69%	0.692	61%	0.607	S	S	*	*			trans	-72.4	79.2	145.8	56.8	0	0	0	0	106.1	L15 D19	L15-S17 PolarHBondContact O-N 3.36Å; S17-D19 PolarHBondContact O-N 3.41Å; S17-D19 VanDerWaalsContact O-N 3.15Å
18	E	31.6	Very low	40.8	Very low	121 Å²	121	110.5 Å²	110.5	57%	0.565	61%	0.611	S	S	*	*			trans	-58.8	116.7	167.2	-76.1	164.7	-165	0	0	106.8	N16 S20	N16-E18 HydrophobicContact CB-CG 4.28Å; N16-E18 PolarHBondContact ND2-OE1 2.92Å; N16-E18 PolarHBondContact O-N 3.02Å; E18-S20 WeakPolarHBondContact O-CA 3.18Å; E18-S20 PolarHBondContact O-N 2.91Å
19	D	41.5	Very low	41.9	Very low	160 Å²	160	103.5 Å²	103.5	86%	0.856	58%	0.583	S	S	*	*	S	Bend	trans	-48.9	112.8	166.8	-78.4	-62.8	0	0	0	106.8	S17 P21	S17-D19 PolarHBondContact O-N 3.41Å; S17-D19 VanDerWaalsContact O-N 3.15Å; D19-P21 WeakPolarHBondContact O-CA 3.39Å
20	S	44.4	Very low	43	Very low	96 Å²	96	100.1 Å²	100.1	67%	0.671	56%	0.56	S	S	*	*	S	Bend	trans	-38.1	109	-152.8	53.7	0	0	0	0	111.7	E18 C22	E18-S20 WeakPolarHBondContact O-CA 3.18Å; E18-S20 PolarHBondContact O-N 2.91Å; S20-C22 PolarHBondContact O-N 2.81Å; S20-C22 VanDerWaalsContact O-N 3.11Å
21	P	50.9	Low	44.8	Very low	62 Å²	62	95.4 Å²	95.4	40%	0.403	53%	0.528	S	S	.	.			trans	-59.6	119.8	-152.7	18.1	-31.8	0	0	0	110.4	D19 N23	D19-P21 WeakPolarHBondContact O-CA 3.39Å; P21-N23 VanDerWaalsContact C-N 3.26Å; P21-N23 VanDerWaalsContact O-CG 3.22Å; P21-N23 PolarHBondContact O-N 2.99Å; P21-N23 PolarHBondContact O-ND2 3.39Å; P21-N23 PolarHBondContact O-OD1 2.87Å
22	C	55.3	Low	46.9	Very low	32 Å²	32	89.7 Å²	89.7	22%	0.216	49%	0.492	C	S	.	.			trans	-75.1	81.1	-179.7	-176.5	0	0	0	0	108.8	S20 C24 N25 C35 C37	S20-C22 PolarHBondContact O-N 2.81Å; S20-C22 VanDerWaalsContact O-N 3.11Å; C22-C24 PolarHBondContact O-N 2.84Å; C22-N25 PolarHBondContact O-N 3.05Å; C22-C35 PolarHBondContact SG-SG 3.33Å; C22-C37 WeakPolarHBondContact CA-SG 3.33Å; C22-C37 HydrophobicContact CB-CB 3.84Å; C22-C37 WeakPolarHBondContact CB-SG 3.44Å; C22-C37 WeakPolarHBondContact SG-CB 3.33Å; C22-C37 CovalentContact SG-SG 2.04Å; C22-C37 PolarHBondContact SG-SG 3.09Å
23	N	71.4	Confident	49.2	Very low	114 Å²	114	89.1 Å²	89.1	61%	0.61	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-8.4	-168.1	-47.7	-78.2	0	0	0	113.6	P21 E54	P21-N23 VanDerWaalsContact C-N 3.26Å; P21-N23 VanDerWaalsContact O-CG 3.22Å; P21-N23 PolarHBondContact O-N 2.99Å; P21-N23 PolarHBondContact O-ND2 3.39Å; P21-N23 PolarHBondContact O-OD1 2.87Å; N23-E54 WeakPolarHBondContact CB-OE1 3.38Å; N23-E54 PolarHBondContact N-OE1 2.84Å; N23-E54 PolarHBondContact ND2-OE1 3.09Å
24	C	70.5	Confident	51.4	Low	6 Å²	6	86 Å²	86	4%	0.041	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-7.9	173.6	59.3	0	0	0	0	114.9	C22 I26 E32 C35 K53	C22-C24 PolarHBondContact O-N 2.84Å; C24-I26 PolarHBondContact O-N 3.44Å; C24-E32 WeakPolarHBondContact O-CB 3.36Å; C24-E32 WeakPolarHBondContact O-CG 3.49Å; C24-C35 VanDerWaalsContact CA-SG 3.53Å; C24-C35 HydrophobicContact CB-CB 3.66Å; C24-C35 WeakPolarHBondContact CB-SG 3.22Å; C24-C35 PolarHBondContact O-SG 3.4Å; C24-C35 WeakPolarHBondContact SG-CA 3.5Å; C24-C35 WeakPolarHBondContact SG-CB 3.43Å; C24-C35 CovalentContact SG-SG 2.04Å; C24-C35 PolarHBondContact SG-SG 3.14Å; C24-K53 HydrophobicContact CB-CB 4.22Å; C24-K53 HydrophobicContact CB-CD 3.81Å
25	N	69	Low	53.7	Low	49 Å²	49	79 Å²	79	26%	0.262	43%	0.428	S	S	.	.			trans	-81.1	104.9	161.2	179.5	-63.4	0	0	0	106.2	C22 C35 D38 D40	C22-N25 PolarHBondContact O-N 3.05Å; N25-C35 PolarHBondContact N-SG 2.82Å; N25-D38 PolarHBondContact ND2-OD1 2.02Å; N25-D40 PolarHBondContact ND2-OD2 3.38Å
26	I	68.9	Low	55.7	Low	125 Å²	125	73.2 Å²	73.2	64%	0.641	40%	0.4	S	S	*	.			trans	-106.3	-33.9	-175.9	-58.6	167.7	0	0	0	108.9	C24 E32	C24-I26 PolarHBondContact O-N 3.44Å; I26-E32 WeakPolarHBondContact CA-OE2 3.48Å; I26-E32 PolarHBondContact N-OE2 3.37Å
27	I	54	Low	57.7	Low	64 Å²	64	69.9 Å²	69.9	33%	0.328	39%	0.385	S	S	.	.	S	Bend	trans	-119.2	96.1	-177.3	-52.3	178.2	0	0	0	109	N29 Y30 E32 F164	I27-N29 PolarHBondContact O-N 3.37Å; I27-Y30 HydrophobicContact CB-CD1 4.1Å; I27-Y30 HydrophobicContact CB-CG 4.39Å; I27-Y30 HydrophobicContact CD1-CD1 4.32Å; I27-Y30 HydrophobicContact CG2-CG 4.33Å; I27-Y30 WeakPolarHBondContact O-CB 3.46Å; I27-Y30 PolarHBondContact O-N 2.98Å; I27-Y30 VanDerWaalsContact O-O 3.13Å; I27-E32 WeakPolarHBondContact CG1-OE1 3.41Å; I27-E32 PolarHBondContact N-OE2 2.94Å; I27-F164 HydrophobicContact CD1-CE1 3.88Å; I27-F164 HydrophobicContact CD1-CZ 3.86Å; I27-F164 HydrophobicContact CG2-CE1 4.29Å
28	K	55.5	Low	59.3	Low	167 Å²	167	65.3 Å²	65.3	73%	0.726	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.7	132.3	174.8	175.2	163.8	-174.9	159.5	0	112.5	Y30	K28-Y30 VanDerWaalsContact C-N 3.28Å
29	N	47.3	Very low	60.8	Low	64 Å²	64	64.8 Å²	64.8	34%	0.342	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	22.7	-177.5	-53.1	1.4	0	0	0	113.6	I27 D40 K132 E137	I27-N29 PolarHBondContact O-N 3.37Å; N29-D40 VanDerWaalsContact CA-CG 3.45Å; N29-D40 VanDerWaalsContact CA-OD2 3.29Å; N29-D40 WeakPolarHBondContact CA-OD2 3.3Å; N29-D40 PolarHBondContact N-OD2 3.22Å; N29-K132 PolarHBondContact ND2-NZ 2.69Å; N29-E137 PolarHBondContact ND2-OE1 3.36Å; N29-E137 PolarHBondContact ND2-OE2 2.87Å
30	Y	50.5	Low	61.3	Low	78 Å²	78	59.5 Å²	59.5	31%	0.306	33%	0.334	S	S	.	.	S	Bend	trans	-134.6	128.6	172	169	-84.8	0	0	0	109.5	I27 K28 E32 F164	I27-Y30 HydrophobicContact CB-CD1 4.1Å; I27-Y30 HydrophobicContact CB-CG 4.39Å; I27-Y30 HydrophobicContact CD1-CD1 4.32Å; I27-Y30 HydrophobicContact CG2-CG 4.33Å; I27-Y30 WeakPolarHBondContact O-CB 3.46Å; I27-Y30 PolarHBondContact O-N 2.98Å; I27-Y30 VanDerWaalsContact O-O 3.13Å; K28-Y30 VanDerWaalsContact C-N 3.28Å; Y30-E32 VanDerWaalsContact CD1-OE1 3.27Å; Y30-E32 WeakPolarHBondContact CD1-OE1 2.99Å; Y30-E32 WeakPolarHBondContact CE1-OE1 3.03Å; Y30-E32 PolarHBondContact O-N 3.07Å; Y30-F164 AromaticContact CD2-CE1 3.98Å; Y30-F164 HydrophobicContact CD2-CE1 3.98Å; Y30-F164 HydrophobicContact CE2-CE1 4.17Å; Y30-F164 HydrophobicContact CG-CE1 4.32Å
31	C	61	Low	61.7	Low	11 Å²	11	55.5 Å²	55.5	7%	0.074	31%	0.306	C	S	.	.			trans	-72.4	108.6	-178.3	173	0	0	0	0	112.2	D38 C41 Q45 F49	C31-D38 VanDerWaalsContact CA-OD2 3.3Å; C31-D38 WeakPolarHBondContact CA-OD2 3.28Å; C31-C41 WeakPolarHBondContact CA-SG 3.39Å; C31-C41 HydrophobicContact CB-CB 3.92Å; C31-C41 WeakPolarHBondContact CB-SG 3.21Å; C31-C41 WeakPolarHBondContact SG-CA 3.34Å; C31-C41 WeakPolarHBondContact SG-CB 3.37Å; C31-C41 CovalentContact SG-SG 2.03Å; C31-C41 PolarHBondContact SG-SG 3.1Å; C31-Q45 WeakPolarHBondContact SG-CB 3.44Å; C31-F49 VanDerWaalsContact SG-CZ 3.59Å
32	E	66	Low	61.3	Low	15 Å²	15	54.4 Å²	54.4	7%	0.07	30%	0.3	C	S	.	.			trans	-75.3	130.7	-178.6	-120.8	84.2	-127.7	0	0	112.5	C24 I26 I27 Y30 E34 C35 D38 F49	C24-E32 WeakPolarHBondContact O-CB 3.36Å; C24-E32 WeakPolarHBondContact O-CG 3.49Å; I26-E32 WeakPolarHBondContact CA-OE2 3.48Å; I26-E32 PolarHBondContact N-OE2 3.37Å; I27-E32 WeakPolarHBondContact CG1-OE1 3.41Å; I27-E32 PolarHBondContact N-OE2 2.94Å; Y30-E32 VanDerWaalsContact CD1-OE1 3.27Å; Y30-E32 WeakPolarHBondContact CD1-OE1 2.99Å; Y30-E32 WeakPolarHBondContact CE1-OE1 3.03Å; Y30-E32 PolarHBondContact O-N 3.07Å; E32-E34 PolarHBondContact O-N 3.34Å; E32-C35 HydrophobicContact CB-CB 3.7Å; E32-C35 VanDerWaalsContact O-CB 3.3Å; E32-C35 WeakPolarHBondContact O-CB 3.43Å; E32-C35 PolarHBondContact O-N 3.26Å; E32-D38 PolarHBondContact N-OD2 2.92Å; E32-F49 WeakPolarHBondContact O-CZ 3.32Å
33	S	71.2	Confident	60.7	Low	77 Å²	77	61.4 Å²	61.4	54%	0.538	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	129.5	179.4	56.8	0	0	0	0	112.5	C35 K53	S33-C35 PolarHBondContact O-N 3.5Å; S33-K53 PolarHBondContact O-NZ 2.86Å
34	E	69.7	Low	59.3	Low	54 Å²	54	60.7 Å²	60.7	25%	0.252	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.2	15.9	-175.6	-53.3	-163.7	141.1	0	0	114.5	E32 C36 F49 K50 N51 C52 K53	E32-E34 PolarHBondContact O-N 3.34Å; E34-C36 PolarHBondContact O-N 2.94Å; E34-F49 HydrophobicContact CG-CB 4.37Å; E34-K50 WeakPolarHBondContact OE1-CB 3.43Å; E34-K50 PolarHBondContact OE1-N 3.35Å; E34-N51 VanDerWaalsContact CB-O 3.27Å; E34-N51 WeakPolarHBondContact CB-O 3.38Å; E34-N51 WeakPolarHBondContact CG-O 3.4Å; E34-N51 PolarHBondContact OE1-N 2.97Å; E34-N51 PolarHBondContact OE1-ND2 3.23Å; E34-C52 CarbonylContact O-C 3.59Å; E34-C52 WeakPolarHBondContact O-CA 3.4Å; E34-K53 HydrophobicContact CB-CG 4.29Å; E34-K53 PolarHBondContact O-N 3.15Å
35	C	71.3	Confident	58.1	Low	0 Å²	0	62.6 Å²	62.6	0%	0	32%	0.324	C	S	.	.			trans	-92	87.1	174.6	-165.7	0	0	0	0	112.6	C22 C24 N25 E32 S33 C37 D38	C22-C35 PolarHBondContact SG-SG 3.33Å; C24-C35 VanDerWaalsContact CA-SG 3.53Å; C24-C35 HydrophobicContact CB-CB 3.66Å; C24-C35 WeakPolarHBondContact CB-SG 3.22Å; C24-C35 PolarHBondContact O-SG 3.4Å; C24-C35 WeakPolarHBondContact SG-CA 3.5Å; C24-C35 WeakPolarHBondContact SG-CB 3.43Å; C24-C35 CovalentContact SG-SG 2.04Å; C24-C35 PolarHBondContact SG-SG 3.14Å; N25-C35 PolarHBondContact N-SG 2.82Å; E32-C35 HydrophobicContact CB-CB 3.7Å; E32-C35 VanDerWaalsContact O-CB 3.3Å; E32-C35 WeakPolarHBondContact O-CB 3.43Å; E32-C35 PolarHBondContact O-N 3.26Å; S33-C35 PolarHBondContact O-N 3.5Å; C35-C37 PolarHBondContact O-N 2.92Å; C35-C37 VanDerWaalsContact SG-SG 3.7Å; C35-D38 HydrophobicContact CB-CB 3.98Å; C35-D38 WeakPolarHBondContact O-CB 3.44Å; C35-D38 PolarHBondContact O-N 3.35Å
36	C	66.9	Low	57.1	Low	25 Å²	25	63.8 Å²	63.8	17%	0.169	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-0.2	-174	-61.7	0	0	0	0	115.6	E34 C52	E34-C36 PolarHBondContact O-N 2.94Å; C36-C52 HydrophobicContact CB-CB 3.66Å; C36-C52 WeakPolarHBondContact CB-SG 3.22Å; C36-C52 VanDerWaalsContact SG-CA 3.55Å; C36-C52 WeakPolarHBondContact SG-CB 3.36Å; C36-C52 CovalentContact SG-SG 2.03Å; C36-C52 PolarHBondContact SG-SG 2.88Å
37	C	67	Low	56	Low	49 Å²	49	61 Å²	61	33%	0.331	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-2.4	171.2	53.3	0	0	0	0	113.4	C22 C35 S39	C22-C37 WeakPolarHBondContact CA-SG 3.33Å; C22-C37 HydrophobicContact CB-CB 3.84Å; C22-C37 WeakPolarHBondContact CB-SG 3.44Å; C22-C37 WeakPolarHBondContact SG-CB 3.33Å; C22-C37 CovalentContact SG-SG 2.04Å; C22-C37 PolarHBondContact SG-SG 3.09Å; C35-C37 PolarHBondContact O-N 2.92Å; C35-C37 VanDerWaalsContact SG-SG 3.7Å; C37-S39 PolarHBondContact O-N 3Å
38	D	61.5	Low	55.7	Low	3 Å²	3	64.2 Å²	64.2	2%	0.016	35%	0.347	C	S	.	.			trans	-74.3	120.7	-170.9	-171.6	-5.4	0	0	0	112.5	N25 C31 E32 C35 D40 C41 F46	N25-D38 PolarHBondContact ND2-OD1 2.02Å; C31-D38 VanDerWaalsContact CA-OD2 3.3Å; C31-D38 WeakPolarHBondContact CA-OD2 3.28Å; E32-D38 PolarHBondContact N-OD2 2.92Å; C35-D38 HydrophobicContact CB-CB 3.98Å; C35-D38 WeakPolarHBondContact O-CB 3.44Å; C35-D38 PolarHBondContact O-N 3.35Å; D38-D40 PolarHBondContact O-N 2.8Å; D38-D40 WeakPolarHBondContact OD1-CB 3.46Å; D38-D40 PolarHBondContact OD1-N 3.01Å; D38-C41 HydrophobicContact CB-CB 4.48Å; D38-F46 VanDerWaalsContact O-CZ 3.31Å; D38-F46 WeakPolarHBondContact O-CZ 3.32Å
39	S	63.2	Low	55.6	Low	109 Å²	109	57.6 Å²	57.6	76%	0.762	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-18.7	176.4	52.9	0	0	0	0	113.8	C37 C41	C37-S39 PolarHBondContact O-N 3Å; S39-C41 PolarHBondContact O-N 3.21Å
40	D	52.9	Low	55.9	Low	49 Å²	49	63.6 Å²	63.6	26%	0.262	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-4.3	-175.6	-56.3	-37.1	0	0	0	111.8	N25 N29 D38	N25-D40 PolarHBondContact ND2-OD2 3.38Å; N29-D40 VanDerWaalsContact CA-CG 3.45Å; N29-D40 VanDerWaalsContact CA-OD2 3.29Å; N29-D40 WeakPolarHBondContact CA-OD2 3.3Å; N29-D40 PolarHBondContact N-OD2 3.22Å; D38-D40 PolarHBondContact O-N 2.8Å; D38-D40 WeakPolarHBondContact OD1-CB 3.46Å; D38-D40 PolarHBondContact OD1-N 3.01Å
41	C	51.4	Low	56.3	Low	12 Å²	12	65 Å²	65	8%	0.081	35%	0.354	C	S	.	.			trans	-88.2	121.2	177.2	-70.7	0	0	0	0	113.7	C31 D38 S39 F46 F49	C31-C41 WeakPolarHBondContact CA-SG 3.39Å; C31-C41 HydrophobicContact CB-CB 3.92Å; C31-C41 WeakPolarHBondContact CB-SG 3.21Å; C31-C41 WeakPolarHBondContact SG-CA 3.34Å; C31-C41 WeakPolarHBondContact SG-CB 3.37Å; C31-C41 CovalentContact SG-SG 2.03Å; C31-C41 PolarHBondContact SG-SG 3.1Å; D38-C41 HydrophobicContact CB-CB 4.48Å; S39-C41 PolarHBondContact O-N 3.21Å; C41-F46 HydrophobicContact CB-CD1 3.98Å; C41-F46 HydrophobicContact CB-CD2 4.13Å; C41-F46 HydrophobicContact CB-CE1 3.54Å; C41-F46 HydrophobicContact CB-CE2 3.72Å; C41-F46 HydrophobicContact CB-CG 4.26Å; C41-F46 HydrophobicContact CB-CZ 3.42Å; C41-F46 VanDerWaalsContact CB-CZ 3.42Å; C41-F46 WeakPolarHBondContact O-CE2 3.15Å; C41-F49 VanDerWaalsContact SG-CZ 3.6Å
42	S	42.5	Very low	56.1	Low	40 Å²	40	66.2 Å²	66.2	28%	0.28	36%	0.362	S	S	.	.			trans	-73.1	158.7	165.1	70.7	0	0	0	0	111.8	R44 Q45 F46	S42-R44 PolarHBondContact O-N 2.82Å; S42-R44 VanDerWaalsContact O-N 3.12Å; S42-Q45 WeakPolarHBondContact O-CA 3.26Å; S42-Q45 WeakPolarHBondContact O-CB 3.24Å; S42-Q45 PolarHBondContact O-N 3.29Å; S42-Q45 PolarHBondContact OG-OE1 3.02Å; S42-F46 PolarHBondContact O-N 3.43Å; S42-F46 VanDerWaalsContact O-N 3.14Å
43	F	43	Very low	56	Low	179 Å²	179	71.1 Å²	71.1	79%	0.785	38%	0.383	S	S	*	.	H	α-helix	trans	-49.8	-38.9	176	-176.9	-98	0	0	0	113.5	Q45 F46 G47	F43-Q45 VanDerWaalsContact C-N 3.28Å; F43-Q45 PolarHBondContact O-N 3.44Å; F43-F46 PolarHBondContact O-N 3.34Å; F43-G47 PolarHBondContact O-N 3.04Å; F43-G47 VanDerWaalsContact O-N 3.15Å
44	R	41.5	Very low	55.2	Low	98 Å²	98	69.7 Å²	69.7	37%	0.37	37%	0.368	S	S	.	.	H	α-helix	trans	-60.5	-35.4	175.1	-67.6	-173.3	-177.4	-80.3	6	113	S42 D176	S42-R44 PolarHBondContact O-N 2.82Å; S42-R44 VanDerWaalsContact O-N 3.12Å; R44-D176 IonicContact CZ-OD1 3.37Å; R44-D176 IonicContact CZ-OD2 3.75Å; R44-D176 IonicContact NE-OD1 3.22Å; R44-D176 PolarHBondContact NE-OD1 2.82Å; R44-D176 IonicContact NE-OD2 2.82Å; R44-D176 PolarHBondContact NE-OD2 3.37Å; R44-D176 IonicContact NH2-OD1 2.69Å; R44-D176 PolarHBondContact NH2-OD1 2.85Å; R44-D176 IonicContact NH2-OD2 3.8Å
45	Q	45.4	Very low	53.8	Low	46 Å²	46	73.5 Å²	73.5	22%	0.215	40%	0.395	C	S	.	.	H	α-helix	trans	-80.9	-39.2	-177.7	-68.4	157.1	-77.1	0	0	111.7	C31 S42 F43 G47 L48 F49	C31-Q45 WeakPolarHBondContact SG-CB 3.44Å; S42-Q45 WeakPolarHBondContact O-CA 3.26Å; S42-Q45 WeakPolarHBondContact O-CB 3.24Å; S42-Q45 PolarHBondContact O-N 3.29Å; S42-Q45 PolarHBondContact OG-OE1 3.02Å; F43-Q45 VanDerWaalsContact C-N 3.28Å; F43-Q45 PolarHBondContact O-N 3.44Å; Q45-G47 PolarHBondContact O-N 3.05Å; Q45-L48 WeakPolarHBondContact O-CB 3.33Å; Q45-L48 PolarHBondContact O-N 3.17Å; Q45-F49 WeakPolarHBondContact O-CD1 3.38Å; Q45-F49 VanDerWaalsContact O-CE1 3.3Å; Q45-F49 WeakPolarHBondContact O-CE1 3.44Å
46	F	49.5	Very low	52.2	Low	74 Å²	74	80.7 Å²	80.7	33%	0.325	43%	0.427	S	S	.	.	H	α-helix	trans	-56.3	-35.1	168.6	-69.9	-56.8	0	0	0	112	D38 C41 S42 F43 L48 F49	D38-F46 VanDerWaalsContact O-CZ 3.31Å; D38-F46 WeakPolarHBondContact O-CZ 3.32Å; C41-F46 HydrophobicContact CB-CD1 3.98Å; C41-F46 HydrophobicContact CB-CD2 4.13Å; C41-F46 HydrophobicContact CB-CE1 3.54Å; C41-F46 HydrophobicContact CB-CE2 3.72Å; C41-F46 HydrophobicContact CB-CG 4.26Å; C41-F46 HydrophobicContact CB-CZ 3.42Å; C41-F46 VanDerWaalsContact CB-CZ 3.42Å; C41-F46 WeakPolarHBondContact O-CE2 3.15Å; S42-F46 PolarHBondContact O-N 3.43Å; S42-F46 VanDerWaalsContact O-N 3.14Å; F43-F46 PolarHBondContact O-N 3.34Å; F46-L48 PolarHBondContact O-N 3.18Å; F46-F49 AromaticContact CD1-CD2 3.96Å; F46-F49 HydrophobicContact CD1-CD2 3.96Å; F46-F49 AromaticContact CD1-CE2 3.65Å; F46-F49 HydrophobicContact CD1-CE2 3.65Å; F46-F49 HydrophobicContact CE1-CE2 4.15Å; F46-F49 WeakPolarHBondContact O-CB 3.13Å; F46-F49 PolarHBondContact O-N 3.09Å
47	G	44.2	Very low	50.6	Low	67 Å²	67	87 Å²	87	69%	0.691	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-10.2	173.1	0	0	0	0	0	115.8	F43 Q45	F43-G47 PolarHBondContact O-N 3.04Å; F43-G47 VanDerWaalsContact O-N 3.15Å; Q45-G47 PolarHBondContact O-N 3.05Å
48	L	47.5	Very low	49	Very low	131 Å²	131	95.8 Å²	95.8	69%	0.686	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-9	174.1	-61.1	175.5	0	0	0	113.1	Q45 F46	Q45-L48 WeakPolarHBondContact O-CB 3.33Å; Q45-L48 PolarHBondContact O-N 3.17Å; F46-L48 PolarHBondContact O-N 3.18Å
49	F	55.1	Low	47.4	Very low	29 Å²	29	101.7 Å²	101.7	13%	0.127	51%	0.505	C	S	.	.			trans	-83.6	123.7	-173.8	-63.2	-3.9	0	0	0	110.5	C31 E32 E34 C41 Q45 F46	C31-F49 VanDerWaalsContact SG-CZ 3.59Å; E32-F49 WeakPolarHBondContact O-CZ 3.32Å; E34-F49 HydrophobicContact CG-CB 4.37Å; C41-F49 VanDerWaalsContact SG-CZ 3.6Å; Q45-F49 WeakPolarHBondContact O-CD1 3.38Å; Q45-F49 VanDerWaalsContact O-CE1 3.3Å; Q45-F49 WeakPolarHBondContact O-CE1 3.44Å; F46-F49 AromaticContact CD1-CD2 3.96Å; F46-F49 HydrophobicContact CD1-CD2 3.96Å; F46-F49 AromaticContact CD1-CE2 3.65Å; F46-F49 HydrophobicContact CD1-CE2 3.65Å; F46-F49 HydrophobicContact CE1-CE2 4.15Å; F46-F49 WeakPolarHBondContact O-CB 3.13Å; F46-F49 PolarHBondContact O-N 3.09Å
50	K	51.7	Low	45.8	Very low	190 Å²	190	100.7 Å²	100.7	83%	0.826	50%	0.498	S	S	*	.	S	Bend	trans	-78	-42.8	178.6	-67.3	-178.3	176.7	179.5	0	111	E34	E34-K50 WeakPolarHBondContact OE1-CB 3.43Å; E34-K50 PolarHBondContact OE1-N 3.35Å
51	N	59.3	Low	44.6	Very low	107 Å²	107	103.9 Å²	103.9	57%	0.572	51%	0.514	S	S	*	.	S	Bend	trans	-122.8	178.9	173.5	-53.9	-73.3	0	0	0	110.8	E34	E34-N51 VanDerWaalsContact CB-O 3.27Å; E34-N51 WeakPolarHBondContact CB-O 3.38Å; E34-N51 WeakPolarHBondContact CG-O 3.4Å; E34-N51 PolarHBondContact OE1-N 2.97Å; E34-N51 PolarHBondContact OE1-ND2 3.23Å
52	C	58.4	Low	43.7	Very low	36 Å²	36	107.2 Å²	107.2	24%	0.243	53%	0.529	C	S	.	.			trans	-113.7	135.3	162.1	-60.7	0	0	0	0	108.1	E34 C36 E54	E34-C52 CarbonylContact O-C 3.59Å; E34-C52 WeakPolarHBondContact O-CA 3.4Å; C36-C52 HydrophobicContact CB-CB 3.66Å; C36-C52 WeakPolarHBondContact CB-SG 3.22Å; C36-C52 VanDerWaalsContact SG-CA 3.55Å; C36-C52 WeakPolarHBondContact SG-CB 3.36Å; C36-C52 CovalentContact SG-SG 2.03Å; C36-C52 PolarHBondContact SG-SG 2.88Å; C52-E54 VanDerWaalsContact CB-O 3.26Å; C52-E54 WeakPolarHBondContact CB-O 3.48Å; C52-E54 PolarHBondContact O-N 3.12Å
53	K	63.6	Low	43.1	Very low	118 Å²	118	110.4 Å²	110.4	51%	0.513	54%	0.542	S	S	.	.	S	Bend	trans	-64.6	-28.4	173.8	-77.5	174.9	179.5	160.6	0	112.8	C24 S33 E34	C24-K53 HydrophobicContact CB-CB 4.22Å; C24-K53 HydrophobicContact CB-CD 3.81Å; S33-K53 PolarHBondContact O-NZ 2.86Å; E34-K53 HydrophobicContact CB-CG 4.29Å; E34-K53 PolarHBondContact O-N 3.15Å
54	E	52.8	Low	42.5	Very low	47 Å²	47	105.8 Å²	105.8	22%	0.22	53%	0.531	C	S	.	.	S	Bend	trans	-121	150.2	176.2	-64.1	-166.8	-173.5	0	0	111.6	N23 C52 F56	N23-E54 WeakPolarHBondContact CB-OE1 3.38Å; N23-E54 PolarHBondContact N-OE1 2.84Å; N23-E54 PolarHBondContact ND2-OE1 3.09Å; C52-E54 VanDerWaalsContact CB-O 3.26Å; C52-E54 WeakPolarHBondContact CB-O 3.48Å; C52-E54 PolarHBondContact O-N 3.12Å; E54-F56 VanDerWaalsContact C-N 3.34Å
55	T	40.5	Very low	42	Very low	135 Å²	135	106.5 Å²	106.5	83%	0.828	54%	0.537	S	S	*	.	S	Bend	trans	-82	-5.4	-177.6	34.1	0	0	0	0	114.4	R57	T55-R57 VanDerWaalsContact C-N 3.29Å; T55-R57 PolarHBondContact O-N 2.86Å
56	F	37.5	Very low	41.4	Very low	151 Å²	151	113.1 Å²	113.1	66%	0.662	56%	0.561	S	S	*	*			trans	-79	69.8	-179.7	-65.3	-72.6	0	0	0	112.4	E54	E54-F56 VanDerWaalsContact C-N 3.34Å
57	R	33.8	Very low	40.5	Very low	156 Å²	156	114.6 Å²	114.6	59%	0.589	57%	0.572	S	S	*	*			trans	-89.4	126.6	177.9	-144.3	179.5	-153.7	-170	6.9	110.7	T55	T55-R57 VanDerWaalsContact C-N 3.29Å; T55-R57 PolarHBondContact O-N 2.86Å
58	R	33.4	Very low	39.6	Very low	235 Å²	235	115.6 Å²	115.6	89%	0.887	56%	0.56	S	S	*	*			trans	-63.4	137.7	170.2	-79.2	-175.2	174.5	174.3	0.4	110.4	S60	R58-S60 PolarHBondContact O-N 3.38Å
59	D	29.3	Very low	38.9	Very low	126 Å²	126	112.7 Å²	112.7	67%	0.674	55%	0.551	S	S	*	*	S	Bend	trans	-88.8	70.9	-163.1	-158.4	-0.9	0	0	0	113.7	L61	D59-L61 VanDerWaalsContact C-N 3.28Å
60	S	27.9	Very low	37.8	Very low	89 Å²	89	117.2 Å²	117.2	62%	0.622	58%	0.576	S	S	*	*			trans	-86.5	4	169.8	55.6	0	0	0	0	113.3	R58 Q62 L63	R58-S60 PolarHBondContact O-N 3.38Å; S60-Q62 VanDerWaalsContact C-N 3.27Å; S60-Q62 PolarHBondContact O-N 3.28Å; S60-Q62 VanDerWaalsContact O-N 3.13Å; S60-L63 PolarHBondContact O-N 3.2Å
61	L	29.4	Very low	37	Very low	115 Å²	115	109.6 Å²	109.6	60%	0.602	55%	0.545	S	S	*	.	H	α-helix	trans	-72.3	-13.8	-160.3	-149.6	75.4	0	0	0	114.5	D59	D59-L61 VanDerWaalsContact C-N 3.28Å
62	Q	31.4	Very low	35.7	Very low	82 Å²	82	107.8 Å²	107.8	38%	0.383	54%	0.54	S	S	.	.	H	α-helix	trans	-73.6	-27.9	174.5	-93.5	-166.2	-6.7	0	0	113.8	S60 C64 K65 L89 A92	S60-Q62 VanDerWaalsContact C-N 3.27Å; S60-Q62 PolarHBondContact O-N 3.28Å; S60-Q62 VanDerWaalsContact O-N 3.13Å; Q62-C64 PolarHBondContact O-N 3.36Å; Q62-K65 PolarHBondContact O-N 2.9Å; Q62-L89 PolarHBondContact NE2-O 2.86Å; Q62-A92 VanDerWaalsContact CD-CB 3.43Å; Q62-A92 HydrophobicContact CG-CB 4.21Å
63	L	30.8	Very low	34.7	Very low	107 Å²	107	109 Å²	109	56%	0.56	55%	0.545	S	S	*	.	H	α-helix	trans	-66.7	-42.2	-171.3	-154.5	74.5	0	0	0	112	S60 K65 Y66	S60-L63 PolarHBondContact O-N 3.2Å; L63-K65 VanDerWaalsContact C-N 3.29Å; L63-K65 PolarHBondContact O-N 3.2Å; L63-Y66 PolarHBondContact O-N 2.87Å
64	C	30.3	Very low	34	Very low	82 Å²	82	110.6 Å²	110.6	55%	0.554	55%	0.554	S	S	*	*	H	α-helix	trans	-65.8	-28.3	178.5	-61.8	0	0	0	0	113.2	Q62 Y66 L67 I68	Q62-C64 PolarHBondContact O-N 3.36Å; C64-Y66 PolarHBondContact O-N 2.84Å; C64-L67 PolarHBondContact O-N 3.44Å; C64-I68 WeakPolarHBondContact O-CD1 3.38Å; C64-I68 VanDerWaalsContact O-CG1 3.31Å; C64-I68 WeakPolarHBondContact O-CG1 3.27Å; C64-I68 PolarHBondContact O-N 3.01Å
65	K	31	Very low	32.8	Very low	113 Å²	113	112.3 Å²	112.3	49%	0.491	57%	0.569	S	S	.	*	H	α-helix	trans	-66.7	-20.4	-179.9	-103.1	-175.8	179.2	-177	0	113.8	Q62 L63 Y87	Q62-K65 PolarHBondContact O-N 2.9Å; L63-K65 VanDerWaalsContact C-N 3.29Å; L63-K65 PolarHBondContact O-N 3.2Å; K65-Y87 HydrophobicContact CD-CD2 4.05Å; K65-Y87 HydrophobicContact CD-CG 4.08Å; K65-Y87 VanDerWaalsContact CE-CD2 3.48Å
66	Y	32	Very low	32.4	Very low	186 Å²	186	112.1 Å²	112.1	73%	0.729	56%	0.562	S	S	*	*	H	α-helix	trans	-94.5	-20.6	173.9	-116.3	-76.3	0	0	0	113.7	L63 C64 I68	L63-Y66 PolarHBondContact O-N 2.87Å; C64-Y66 PolarHBondContact O-N 2.84Å; Y66-I68 VanDerWaalsContact C-N 3.27Å
67	L	30	Very low	32.4	Very low	104 Å²	104	105.7 Å²	105.7	55%	0.545	54%	0.536	S	S	.	.	H	α-helix	trans	-87.9	3.3	175.9	-64.5	174.2	0	0	0	112.9	C64 S69 C77	C64-L67 PolarHBondContact O-N 3.44Å; L67-S69 VanDerWaalsContact C-N 3.3Å; L67-C77 PolarHBondContact O-SG 3.4Å
68	I	26.3	Very low	32.3	Very low	88 Å²	88	103 Å²	103	45%	0.451	53%	0.532	S	S	.	.	S	Bend	trans	-97.6	35.1	170.6	-64.6	161.5	0	0	0	109.5	C64 Y66 S80	C64-I68 WeakPolarHBondContact O-CD1 3.38Å; C64-I68 VanDerWaalsContact O-CG1 3.31Å; C64-I68 WeakPolarHBondContact O-CG1 3.27Å; C64-I68 PolarHBondContact O-N 3.01Å; Y66-I68 VanDerWaalsContact C-N 3.27Å; I68-S80 WeakPolarHBondContact CG2-OG 3.39Å
69	S	33	Very low	32.1	Very low	70 Å²	70	102.1 Å²	102.1	49%	0.49	53%	0.53	S	S	.	.	S	Bend	trans	-141.9	5.6	174.2	97.1	0	0	0	0	119.9	L67 I81	L67-S69 VanDerWaalsContact C-N 3.3Å; S69-I81 VanDerWaalsContact C-CG1 3.49Å; S69-I81 VanDerWaalsContact N-CG1 3.27Å
70	D	31.5	Very low	32.2	Very low	124 Å²	124	98.6 Å²	98.6	66%	0.663	52%	0.515	S	S	*	.	S	Bend	trans	-133.6	138.6	144.5	-140	-28.3	0	0	0	115.5	S72 C77 I81	D70-S72 PolarHBondContact O-N 3.32Å; D70-S72 PolarHBondContact O-OG 3.39Å; D70-C77 WeakPolarHBondContact O-CB 3.4Å; D70-I81 WeakPolarHBondContact O-CD1 3.46Å
71	D	34	Very low	32.4	Very low	31 Å²	31	95 Å²	95	17%	0.166	49%	0.489	C	S	.	.			trans	-72.9	87	-164.5	-105.1	-33.2	0	0	0	109.5	C77 I78 Y79 S80 I81 N82	D71-C77 WeakPolarHBondContact CA-O 3.37Å; D71-I78 VanDerWaalsContact C-CA 3.47Å; D71-I78 HydrophobicContact CB-CG2 3.88Å; D71-I78 WeakPolarHBondContact O-CD1 3.38Å; D71-I78 VanDerWaalsContact OD1-CA 3.31Å; D71-I78 WeakPolarHBondContact OD1-CA 3.38Å; D71-Y79 PolarHBondContact OD1-N 3.46Å; D71-S80 PolarHBondContact OD1-N 2.92Å; D71-I81 HydrophobicContact CB-CB 3.91Å; D71-I81 HydrophobicContact CB-CG2 4Å; D71-I81 WeakPolarHBondContact OD1-CB 3.35Å; D71-I81 PolarHBondContact OD1-N 3.21Å; D71-N82 WeakPolarHBondContact OD2-CB 3.41Å; D71-N82 PolarHBondContact OD2-N 2.64Å; D71-N82 PolarHBondContact OD2-ND2 3.03Å
72	S	32.9	Very low	32.2	Very low	68 Å²	68	96.4 Å²	96.4	48%	0.476	50%	0.497	S	S	.	.			trans	-141	87.4	-175.6	48.7	0	0	0	0	112.9	D70 H74 C77 I78	D70-S72 PolarHBondContact O-N 3.32Å; D70-S72 PolarHBondContact O-OG 3.39Å; S72-H74 PolarHBondContact O-N 3.1Å; S72-C77 VanDerWaalsContact N-C 3.26Å; S72-C77 WeakPolarHBondContact O-CA 3.45Å; S72-C77 WeakPolarHBondContact O-CB 3.15Å; S72-C77 PolarHBondContact O-N 2.93Å; S72-C77 PolarHBondContact O-SG 3.01Å; S72-I78 VanDerWaalsContact N-N 3.15Å
73	D	36.7	Very low	32.1	Very low	63 Å²	63	101.3 Å²	101.3	34%	0.337	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	97.3	-169.4	-139.2	51.8	0	0	0	108.9	P75 L76 C77 I78	D73-P75 VanDerWaalsContact C-N 3.3Å; D73-P75 WeakPolarHBondContact O-CA 3.44Å; D73-P75 WeakPolarHBondContact OD2-CA 3.35Å; D73-P75 VanDerWaalsContact OD2-CB 3.31Å; D73-P75 WeakPolarHBondContact OD2-CB 3.46Å; D73-L76 WeakPolarHBondContact OD1-CA 3.44Å; D73-L76 PolarHBondContact OD1-N 2.81Å; D73-L76 PolarHBondContact OD2-N 3.19Å; D73-C77 VanDerWaalsContact CA-N 3.33Å; D73-C77 PolarHBondContact OD1-N 3.18Å; D73-I78 HydrophobicContact CB-CB 3.81Å; D73-I78 HydrophobicContact CB-CG1 3.49Å; D73-I78 VanDerWaalsContact CB-CG1 3.49Å; D73-I78 PolarHBondContact OD1-N 2.94Å
74	H	49.5	Very low	32	Very low	151 Å²	151	103.1 Å²	103.1	70%	0.699	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	-39.1	-178.7	128.4	-110.8	0	0	0	114.1	S72	S72-H74 PolarHBondContact O-N 3.1Å
75	P	28.5	Very low	31.9	Very low	82 Å²	82	105.2 Å²	105.2	53%	0.532	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	cis	-68.8	134.8	14.7	26.7	-36.3	0	0	0	116.1	D73	D73-P75 VanDerWaalsContact C-N 3.3Å; D73-P75 WeakPolarHBondContact O-CA 3.44Å; D73-P75 WeakPolarHBondContact OD2-CA 3.35Å; D73-P75 VanDerWaalsContact OD2-CB 3.31Å; D73-P75 WeakPolarHBondContact OD2-CB 3.46Å
76	L	32.3	Very low	31.7	Very low	132 Å²	132	107.4 Å²	107.4	69%	0.691	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	166.3	-65.6	-152.9	-58.1	76.8	0	0	0	113.4	D73	D73-L76 WeakPolarHBondContact OD1-CA 3.44Å; D73-L76 PolarHBondContact OD1-N 2.81Å; D73-L76 PolarHBondContact OD2-N 3.19Å
77	C	37.6	Very low	31.5	Very low	16 Å²	16	106.7 Å²	106.7	11%	0.108	55%	0.552	C	S	.	*	S	Bend	trans	-116.3	-27.4	-165.9	-30.2	0	0	0	0	121	L67 D70 D71 S72 D73 Y79 S80 I81	L67-C77 PolarHBondContact O-SG 3.4Å; D70-C77 WeakPolarHBondContact O-CB 3.4Å; D71-C77 WeakPolarHBondContact CA-O 3.37Å; S72-C77 VanDerWaalsContact N-C 3.26Å; S72-C77 WeakPolarHBondContact O-CA 3.45Å; S72-C77 WeakPolarHBondContact O-CB 3.15Å; S72-C77 PolarHBondContact O-N 2.93Å; S72-C77 PolarHBondContact O-SG 3.01Å; D73-C77 VanDerWaalsContact CA-N 3.33Å; D73-C77 PolarHBondContact OD1-N 3.18Å; C77-Y79 PolarHBondContact O-N 3.17Å; C77-S80 PolarHBondContact O-N 2.8Å; C77-I81 HydrophobicContact CB-CD1 3.54Å; C77-I81 WeakPolarHBondContact O-CD1 3.35Å
78	I	29.9	Very low	31.4	Very low	99 Å²	99	108.3 Å²	108.3	51%	0.508	57%	0.566	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65	5.1	-178	-20.5	-87.6	0	0	0	111.4	D71 S72 D73	D71-I78 VanDerWaalsContact C-CA 3.47Å; D71-I78 HydrophobicContact CB-CG2 3.88Å; D71-I78 WeakPolarHBondContact O-CD1 3.38Å; D71-I78 VanDerWaalsContact OD1-CA 3.31Å; D71-I78 WeakPolarHBondContact OD1-CA 3.38Å; S72-I78 VanDerWaalsContact N-N 3.15Å; D73-I78 HydrophobicContact CB-CB 3.81Å; D73-I78 HydrophobicContact CB-CG1 3.49Å; D73-I78 VanDerWaalsContact CB-CG1 3.49Å; D73-I78 PolarHBondContact OD1-N 2.94Å
79	Y	29.2	Very low	31.4	Very low	216 Å²	216	109.9 Å²	109.9	85%	0.847	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.6	-1.8	179.8	-101.8	-84.4	0	0	0	114.8	D71 C77	D71-Y79 PolarHBondContact OD1-N 3.46Å; C77-Y79 PolarHBondContact O-N 3.17Å
80	S	32.4	Very low	31	Very low	53 Å²	53	116 Å²	116	37%	0.371	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	-117.3	-5	-172.2	-163.6	0	0	0	0	115	I68 D71 C77	I68-S80 WeakPolarHBondContact CG2-OG 3.39Å; D71-S80 PolarHBondContact OD1-N 2.92Å; C77-S80 PolarHBondContact O-N 2.8Å
81	I	31.6	Very low	30.8	Very low	13 Å²	13	117.9 Å²	117.9	7%	0.067	60%	0.602	C	S	.	*			trans	-110.3	-31.1	-159.7	-83.4	95.9	0	0	0	117.9	S69 D70 D71 C77 K83	S69-I81 VanDerWaalsContact C-CG1 3.49Å; S69-I81 VanDerWaalsContact N-CG1 3.27Å; D70-I81 WeakPolarHBondContact O-CD1 3.46Å; D71-I81 HydrophobicContact CB-CB 3.91Å; D71-I81 HydrophobicContact CB-CG2 4Å; D71-I81 WeakPolarHBondContact OD1-CB 3.35Å; D71-I81 PolarHBondContact OD1-N 3.21Å; C77-I81 HydrophobicContact CB-CD1 3.54Å; C77-I81 WeakPolarHBondContact O-CD1 3.35Å; I81-K83 PolarHBondContact O-N 2.93Å
82	N	26.5	Very low	30.3	Very low	144 Å²	144	118.3 Å²	118.3	77%	0.77	61%	0.61	S	S	*	*	S	Bend	trans	-61.9	17.9	179.8	-102.4	-79.6	0	0	0	114.4	D71	D71-N82 WeakPolarHBondContact OD2-CB 3.41Å; D71-N82 PolarHBondContact OD2-N 2.64Å; D71-N82 PolarHBondContact OD2-ND2 3.03Å
83	K	29.5	Very low	29.8	Very low	185 Å²	185	123 Å²	123	80%	0.804	63%	0.628	S	S	*	*	S	Bend	trans	-142.9	63.1	-179.6	-60.9	-171.4	179.2	176.7	0	113.1	I81	I81-K83 PolarHBondContact O-N 2.93Å
84	N	26.8	Very low	29.2	Very low	146 Å²	146	123.4 Å²	123.4	78%	0.781	65%	0.648	S	S	*	*			trans	-33.3	123.4	173	-64.7	-72.5	0	0	0	117
85	V	29.5	Very low	28.1	Very low	126 Å²	126	121.6 Å²	121.6	76%	0.764	65%	0.647	S	S	*	*			trans	-146.8	136.8	164	-174.8	0	0	0	0	111.7
86	N	27	Very low	27.9	Very low	158 Å²	158	125.7 Å²	125.7	85%	0.845	66%	0.659	S	S	*	*			trans	-93.6	157.1	-174.3	-85.9	-39.7	0	0	0	115.5
87	Y	27.9	Very low	27.6	Very low	171 Å²	171	126.6 Å²	126.6	67%	0.671	67%	0.665	S	S	*	*			trans	-145.6	164.6	168.1	-81.1	-80.5	0	0	0	112.7	K65	K65-Y87 HydrophobicContact CD-CD2 4.05Å; K65-Y87 HydrophobicContact CD-CG 4.08Å; K65-Y87 VanDerWaalsContact CE-CD2 3.48Å
88	T	27.9	Very low	27.1	Very low	138 Å²	138	130.7 Å²	130.7	85%	0.847	69%	0.689	S	S	*	*			trans	-115.2	155.2	-173.5	50.5	0	0	0	0	113.9
89	L	26.4	Very low	27	Very low	121 Å²	121	131.4 Å²	131.4	63%	0.634	70%	0.7	S	S	*	*			trans	-96.6	-9.5	-158.7	-152	77.3	0	0	0	116.5	Q62 N91	Q62-L89 PolarHBondContact NE2-O 2.86Å; L89-N91 VanDerWaalsContact C-N 3.31Å; L89-N91 PolarHBondContact O-N 2.91Å
90	K	24.5	Very low	27	Very low	199 Å²	199	126.9 Å²	126.9	87%	0.865	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	4.4	-151.7	-138	-177.4	-176.9	-176.5	0	117.9
91	N	25.5	Very low	27.1	Very low	163 Å²	163	129.9 Å²	129.9	87%	0.872	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.8	5.7	-171.9	-74.2	30.7	0	0	0	115.2	L89	L89-N91 VanDerWaalsContact C-N 3.31Å; L89-N91 PolarHBondContact O-N 2.91Å
92	A	23.7	Very low	27.4	Very low	40 Å²	40	132.4 Å²	132.4	33%	0.331	72%	0.723	S	S	.	*			trans	-100.7	8.3	-171.7	0	0	0	0	0	115.8	Q62	Q62-A92 VanDerWaalsContact CD-CB 3.43Å; Q62-A92 HydrophobicContact CG-CB 4.21Å
93	I	23.3	Very low	28.2	Very low	167 Å²	167	130.6 Å²	130.6	86%	0.856	71%	0.713	S	S	*	*			trans	-105.5	86.5	177.8	-54.8	178.4	0	0	0	108.5
94	G	24.4	Very low	29	Very low	72 Å²	72	127.6 Å²	127.6	74%	0.742	71%	0.706	S	S	*	*			trans	-123.8	37.9	179.2	0	0	0	0	0	113	E96	G94-E96 PolarHBondContact O-N 3.04Å; G94-E96 VanDerWaalsContact O-N 3.16Å
95	V	25.3	Very low	30.2	Very low	113 Å²	113	124.1 Å²	124.1	69%	0.685	69%	0.693	S	S	*	*			trans	-86.2	81.5	-178.1	-172.6	0	0	0	0	110.1	T98	V95-T98 HydrophobicContact CG1-CG2 4.46Å
96	E	25.2	Very low	31.5	Very low	167 Å²	167	120.6 Å²	120.6	78%	0.78	67%	0.672	S	S	*	*			trans	-99.5	136.4	161.8	-66.3	-168.2	165.9	0	0	110	G94	G94-E96 PolarHBondContact O-N 3.04Å; G94-E96 VanDerWaalsContact O-N 3.16Å
97	N	26	Very low	33.3	Very low	152 Å²	152	116.5 Å²	116.5	81%	0.813	65%	0.649	S	S	*	*			trans	69.4	29.1	162.3	-48.4	-42.8	0	0	0	119.1
98	T	27.6	Very low	35.1	Very low	101 Å²	101	108.7 Å²	108.7	62%	0.62	62%	0.619	S	S	*	*			trans	-68.7	132.4	153.4	48.8	0	0	0	0	109.8	V95 S100	V95-T98 HydrophobicContact CG1-CG2 4.46Å; T98-S100 PolarHBondContact O-N 3.13Å
99	P	26.1	Very low	36.4	Very low	115 Å²	115	105.7 Å²	105.7	75%	0.747	60%	0.604	S	S	*	*			trans	-62.4	134.4	-178.4	25.5	-34	0	0	0	111.1	Y101	P99-Y101 PolarHBondContact O-N 3.38Å
100	S	30.2	Very low	37.7	Very low	120 Å²	120	105 Å²	105	84%	0.839	60%	0.6	S	S	*	*			trans	-71.3	89.6	-177.8	57.5	0	0	0	0	111.4	T98 S102	T98-S100 PolarHBondContact O-N 3.13Å; S100-S102 PolarHBondContact O-N 3.49Å
101	Y	33.7	Very low	39	Very low	117 Å²	117	96.9 Å²	96.9	46%	0.459	57%	0.573	S	S	.	*			trans	-55	124.9	153.5	-111.8	-96.3	0	0	0	108	P99 V106 M190	P99-Y101 PolarHBondContact O-N 3.38Å; Y101-V106 HydrophobicContact CE1-CG2 4.48Å; Y101-M190 HydrophobicContact CE1-CE 4.33Å; Y101-M190 WeakPolarHBondContact OH-CE 3.43Å
102	S	38.1	Very low	40.9	Very low	66 Å²	66	91 Å²	91	46%	0.462	54%	0.542	S	S	.	.			trans	-56.8	137.4	171.7	46	0	0	0	0	109.7	S100 D104	S100-S102 PolarHBondContact O-N 3.49Å; S102-D104 PolarHBondContact O-N 2.89Å; S102-D104 VanDerWaalsContact O-N 3.09Å
103	D	42.9	Very low	43.3	Very low	105 Å²	105	91.1 Å²	91.1	56%	0.561	54%	0.54	S	S	*	.	S	Bend	trans	-68.3	-7	-179.6	-135.2	-43.8	0	0	0	112.5	K191	D103-K191 PolarHBondContact O-NZ 3.09Å; D103-K191 VanDerWaalsContact OD1-CE 3.25Å; D103-K191 WeakPolarHBondContact OD1-CE 3.28Å; D103-K191 IonicContact OD1-NZ 2.63Å; D103-K191 PolarHBondContact OD1-NZ 3.36Å
104	D	47.3	Very low	46	Very low	122 Å²	122	83.2 Å²	83.2	65%	0.652	50%	0.499	S	S	*	.	S	Bend	trans	-55.3	137.6	169.7	-63	-49.3	0	0	0	112	S102 V106	S102-D104 PolarHBondContact O-N 2.89Å; S102-D104 VanDerWaalsContact O-N 3.09Å; D104-V106 PolarHBondContact O-N 3.43Å
105	S	50.9	Low	48.4	Very low	73 Å²	73	81.4 Å²	81.4	51%	0.51	47%	0.471	S	S	.	.			trans	-69.9	96.6	177.8	56.4	0	0	0	0	111.6	L107	S105-L107 PolarHBondContact O-N 2.99Å
106	V	58.2	Low	51	Low	53 Å²	53	76.2 Å²	76.2	32%	0.321	44%	0.44	S	S	.	.	B	Isolated β-bridge	trans	-70	127.5	171.8	179.4	0	0	0	0	109.4	Y101 D104 M190	Y101-V106 HydrophobicContact CE1-CG2 4.48Å; D104-V106 PolarHBondContact O-N 3.43Å; V106-M190 HydrophobicContact CB-CB 4.14Å; V106-M190 HydrophobicContact CG1-CB 4.28Å; V106-M190 HydrophobicContact CG1-SD 4.38Å; V106-M190 WeakPolarHBondContact O-CA 3.48Å; V106-M190 WeakPolarHBondContact O-CB 3.38Å; V106-M190 PolarHBondContact O-N 3.48Å
107	L	64.8	Low	53.2	Low	71 Å²	71	68.6 Å²	68.6	37%	0.372	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-83.1	145.1	177.4	-65.8	158.4	0	0	0	110	S105 S109 I250 T252	S105-L107 PolarHBondContact O-N 2.99Å; L107-S109 PolarHBondContact O-N 2.85Å; L107-I250 VanDerWaalsContact CB-O 3.31Å; L107-I250 WeakPolarHBondContact CB-O 3.3Å; L107-I250 WeakPolarHBondContact CD1-O 3.38Å; L107-I250 HydrophobicContact CD2-CD1 4.48Å; L107-I250 HydrophobicContact CD2-CG1 4.42Å; L107-T252 HydrophobicContact CD2-CG2 3.76Å
108	Y	64.4	Low	55.2	Low	7 Å²	7	65.4 Å²	65.4	3%	0.027	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-66.4	128.8	179.2	-78	-77.6	0	0	0	111	V112 I114 F143 L187 M190 G251 I253	Y108-V112 HydrophobicContact CD1-CB 4.49Å; Y108-V112 HydrophobicContact CD1-CG1 4.16Å; Y108-I114 HydrophobicContact CD1-CD1 4.39Å; Y108-I114 HydrophobicContact CE1-CD1 4.16Å; Y108-F143 VanDerWaalsContact CB-CD2 3.49Å; Y108-F143 VanDerWaalsContact CB-CG 3.49Å; Y108-F143 HydrophobicContact CD1-CB 4.22Å; Y108-F143 HydrophobicContact CD1-CD2 4.45Å; Y108-F143 HydrophobicContact CD1-CG 4.45Å; Y108-F143 HydrophobicContact CD2-CD2 4.36Å; Y108-F143 HydrophobicContact CG-CB 4.42Å; Y108-F143 AromaticContact CG-CD2 3.9Å; Y108-F143 HydrophobicContact CG-CD2 3.9Å; Y108-F143 HydrophobicContact CG-CE2 4.34Å; Y108-F143 HydrophobicContact CG-CG 4.15Å; Y108-F143 WeakPolarHBondContact O-CE1 2.93Å; Y108-L187 WeakPolarHBondContact CE2-O 2.93Å; Y108-M190 HydrophobicContact CE1-CB 4.39Å; Y108-G251 WeakPolarHBondContact CB-O 3.13Å; Y108-G251 PolarHBondContact N-O 2.82Å; Y108-G251 WeakPolarHBondContact O-CA 3.33Å; Y108-I253 HydrophobicContact CD2-CD1 4.16Å; Y108-I253 HydrophobicContact CD2-CG1 4.17Å; Y108-I253 HydrophobicContact CE2-CD1 3.91Å; Y108-I253 HydrophobicContact CE2-CG1 4.31Å
109	S	54.9	Low	56.6	Low	76 Å²	76	63.8 Å²	63.8	53%	0.531	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-101.7	150	172.7	-65.5	0	0	0	0	110.5	L107 G111 V112	L107-S109 PolarHBondContact O-N 2.85Å; S109-G111 PolarHBondContact O-N 2.99Å; S109-V112 WeakPolarHBondContact O-CB 3.49Å; S109-V112 WeakPolarHBondContact O-CG2 3.5Å; S109-V112 PolarHBondContact O-N 3.2Å
110	I	54.5	Low	58	Low	106 Å²	106	64.6 Å²	64.6	54%	0.544	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	129.5	-178.3	-61.1	176	0	0	0	109.9	F143 Q145	I110-F143 WeakPolarHBondContact CA-O 3.44Å; I110-Q145 HydrophobicContact CG2-CG 4.43Å
111	G	51.7	Low	59.1	Low	29 Å²	29	64.7 Å²	64.7	30%	0.299	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.2	-11	-176.7	0	0	0	0	0	115.3	S109 S142 F143	S109-G111 PolarHBondContact O-N 2.99Å; G111-S142 VanDerWaalsContact O-CB 3.31Å; G111-S142 WeakPolarHBondContact O-CB 3.39Å; G111-S142 PolarHBondContact O-OG 2.8Å; G111-F143 PolarHBondContact N-O 2.88Å
112	V	66.3	Low	60.4	Low	39 Å²	39	63.8 Å²	63.8	24%	0.236	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-72.4	129.2	176.4	175.6	0	0	0	0	110.5	Y108 S109 I114 S142 F143 M190	Y108-V112 HydrophobicContact CD1-CB 4.49Å; Y108-V112 HydrophobicContact CD1-CG1 4.16Å; S109-V112 WeakPolarHBondContact O-CB 3.49Å; S109-V112 WeakPolarHBondContact O-CG2 3.5Å; S109-V112 PolarHBondContact O-N 3.2Å; V112-I114 PolarHBondContact O-N 2.93Å; V112-S142 WeakPolarHBondContact O-CA 3.44Å; V112-F143 WeakPolarHBondContact O-CB 3.13Å; V112-F143 PolarHBondContact O-N 3.03Å; V112-M190 HydrophobicContact CG1-CE 4.5Å; V112-M190 HydrophobicContact CG1-SD 3.89Å
113	P	74.4	Confident	61.8	Low	43 Å²	43	62.8 Å²	62.8	28%	0.279	37%	0.37	S	S	.	.	B	Isolated β-bridge	trans	-57.6	131.3	177.6	-28.5	37.1	0	0	0	113.8	H115 L125	P113-H115 PolarHBondContact O-ND1 3.09Å; P113-L125 HydrophobicContact CB-CD2 3.7Å
114	I	78.1	Confident	63.1	Low	0 Å²	0	58.5 Å²	58.5	0%	0	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-67.6	130.5	174.2	-64	-61.1	0	0	0	109.6	Y108 V112 I116 L126 V141 F143 M186 I253 F277	Y108-I114 HydrophobicContact CD1-CD1 4.39Å; Y108-I114 HydrophobicContact CE1-CD1 4.16Å; V112-I114 PolarHBondContact O-N 2.93Å; I114-I116 HydrophobicContact CG2-CG2 4.48Å; I114-L126 HydrophobicContact CB-CB 4.05Å; I114-L126 HydrophobicContact CB-CD2 4.31Å; I114-L126 HydrophobicContact CG2-CB 3.81Å; I114-L126 HydrophobicContact CG2-CD2 3.82Å; I114-L126 HydrophobicContact CG2-CG 4.48Å; I114-L126 PolarHBondContact O-N 2.95Å; I114-V141 WeakPolarHBondContact CB-O 3.44Å; I114-V141 HydrophobicContact CG1-CB 4.48Å; I114-V141 HydrophobicContact CG1-CG1 4.04Å; I114-V141 WeakPolarHBondContact CG1-O 3.39Å; I114-V141 PolarHBondContact N-O 2.95Å; I114-F143 HydrophobicContact CD1-CB 3.82Å; I114-F143 HydrophobicContact CD1-CD2 3.96Å; I114-F143 HydrophobicContact CD1-CG 4.41Å; I114-M186 HydrophobicContact CG2-CG 3.97Å; I114-M186 HydrophobicContact CG2-SD 3.4Å; I114-M186 WeakPolarHBondContact CG2-SD 3.3Å; I114-I253 HydrophobicContact CD1-CD1 4.19Å; I114-F277 HydrophobicContact CD1-CE1 4.02Å; I114-F277 HydrophobicContact CD1-CZ 4.06Å; I114-F277 HydrophobicContact CG1-CE1 4.38Å; I114-F277 HydrophobicContact CG1-CZ 3.93Å
115	H	75.1	Confident	64.6	Low	35 Å²	35	56.1 Å²	56.1	16%	0.162	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	133.4	173.7	-70.2	66.7	0	0	0	110	P113 V123 G124 L125 L187	P113-H115 PolarHBondContact O-ND1 3.09Å; H115-V123 HydrophobicContact CB-CG1 3.99Å; H115-G124 WeakPolarHBondContact CA-O 3.12Å; H115-L125 VanDerWaalsContact CE1-CD2 3.44Å; H115-L125 WeakPolarHBondContact CE1-CD2 3.32Å; H115-L187 HydrophobicContact CB-CD1 3.93Å
116	I	79.6	Confident	66	Low	3 Å²	3	52.6 Å²	52.6	2%	0.015	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	139.3	173.7	52.4	168.5	0	0	0	109.2	I114 Y118 V123 G124 L126 T180 V181 K185 M186	I114-I116 HydrophobicContact CG2-CG2 4.48Å; I116-Y118 HydrophobicContact CG1-CD1 4.42Å; I116-V123 WeakPolarHBondContact O-CA 3.48Å; I116-G124 PolarHBondContact N-O 3.46Å; I116-G124 PolarHBondContact O-N 3.49Å; I116-L126 HydrophobicContact CD1-CD1 4.25Å; I116-L126 HydrophobicContact CG1-CB 4.49Å; I116-L126 HydrophobicContact CG2-CB 4.22Å; I116-T180 HydrophobicContact CD1-CG2 4.34Å; I116-V181 HydrophobicContact CD1-CG2 4.31Å; I116-K185 CarbonylContact C-O 3.54Å; I116-K185 WeakPolarHBondContact CA-O 3.5Å; I116-M186 HydrophobicContact CG2-CB 4.15Å; I116-M186 HydrophobicContact CG2-CG 4.22Å
117	S	72.4	Confident	67.2	Low	7 Å²	7	53.6 Å²	53.6	5%	0.049	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	135.2	169.7	-170.2	0	0	0	0	109.8	E122 S184 K185	S117-E122 CarbonylContact C-O 3.5Å; S117-E122 WeakPolarHBondContact CA-O 3.01Å; S117-E122 WeakPolarHBondContact CB-O 3.45Å; S117-E122 PolarHBondContact OG-O 2.78Å; S117-S184 CarbonylContact O-C 3.52Å; S117-S184 WeakPolarHBondContact O-CA 3.42Å; S117-S184 WeakPolarHBondContact O-CB 3.15Å; S117-K185 PolarHBondContact N-O 3.09Å; S117-K185 PolarHBondContact O-N 2.85Å
118	Y	67	Low	68	Low	86 Å²	86	50.2 Å²	50.2	34%	0.337	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	159.6	178.7	55.4	-94.7	0	0	0	109.8	I116 E122	I116-Y118 HydrophobicContact CG1-CD1 4.42Å; Y118-E122 HydrophobicContact CD2-CB 4.05Å; Y118-E122 HydrophobicContact CE2-CB 3.76Å; Y118-E122 VanDerWaalsContact CE2-OE2 3.24Å; Y118-E122 WeakPolarHBondContact CE2-OE2 3.34Å; Y118-E122 PolarHBondContact N-O 3.45Å; Y118-E122 WeakPolarHBondContact O-CB 3.06Å; Y118-E122 PolarHBondContact O-N 2.86Å
119	G	58	Low	68.7	Low	66 Å²	66	50 Å²	50	68%	0.68	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	-149.8	-168.4	0	0	0	0	0	112.1
120	V	56	Low	69.7	Low	133 Å²	133	48.9 Å²	48.9	81%	0.806	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-29.1	-172.6	-177.9	0	0	0	0	113
121	N	52.9	Low	70.5	Confident	122 Å²	122	47.7 Å²	47.7	65%	0.652	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-152.2	0.8	-178.9	-94.9	-51.1	0	0	0	114.8
122	E	60.9	Low	71.2	Confident	97 Å²	97	51 Å²	51	45%	0.453	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	148.4	-173.1	-54.7	-177.3	175.9	0	0	110.3	S117 Y118	S117-E122 CarbonylContact C-O 3.5Å; S117-E122 WeakPolarHBondContact CA-O 3.01Å; S117-E122 WeakPolarHBondContact CB-O 3.45Å; S117-E122 PolarHBondContact OG-O 2.78Å; Y118-E122 HydrophobicContact CD2-CB 4.05Å; Y118-E122 HydrophobicContact CE2-CB 3.76Å; Y118-E122 VanDerWaalsContact CE2-OE2 3.24Å; Y118-E122 WeakPolarHBondContact CE2-OE2 3.34Å; Y118-E122 PolarHBondContact N-O 3.45Å; Y118-E122 WeakPolarHBondContact O-CB 3.06Å; Y118-E122 PolarHBondContact O-N 2.86Å
123	V	67.9	Low	71	Confident	45 Å²	45	58.7 Å²	58.7	27%	0.273	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	132	177.9	-175.6	0	0	0	0	108.2	H115 I116 L187 L192	H115-V123 HydrophobicContact CB-CG1 3.99Å; I116-V123 WeakPolarHBondContact O-CA 3.48Å; V123-L187 HydrophobicContact CG1-CD1 4.39Å; V123-L192 HydrophobicContact CG1-CD2 4.05Å
124	G	70.2	Confident	70.4	Confident	16 Å²	16	61.5 Å²	61.5	17%	0.165	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	178.1	177.9	0	0	0	0	0	111.9	H115 I116	H115-G124 WeakPolarHBondContact CA-O 3.12Å; I116-G124 PolarHBondContact N-O 3.46Å; I116-G124 PolarHBondContact O-N 3.49Å
125	L	77.5	Confident	70	Confident	71 Å²	71	63.8 Å²	63.8	37%	0.372	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	143.2	179	-61	-179	0	0	0	111.1	P113 H115 L127	P113-L125 HydrophobicContact CB-CD2 3.7Å; H115-L125 VanDerWaalsContact CE1-CD2 3.44Å; H115-L125 WeakPolarHBondContact CE1-CD2 3.32Å; L125-L127 HydrophobicContact CB-CD2 3.91Å; L125-L127 HydrophobicContact CB-CG 4.27Å; L125-L127 PolarHBondContact O-N 3.27Å; L125-L127 VanDerWaalsContact O-N 3.08Å
126	L	81.8	Confident	70	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	35%	0.35	C	S	.	.			trans	-70.8	99.8	165	176.3	58.5	0	0	0	108.5	I114 I116 S140 V141 V181 I245	I114-L126 HydrophobicContact CB-CB 4.05Å; I114-L126 HydrophobicContact CB-CD2 4.31Å; I114-L126 HydrophobicContact CG2-CB 3.81Å; I114-L126 HydrophobicContact CG2-CD2 3.82Å; I114-L126 HydrophobicContact CG2-CG 4.48Å; I114-L126 PolarHBondContact O-N 2.95Å; I116-L126 HydrophobicContact CD1-CD1 4.25Å; I116-L126 HydrophobicContact CG1-CB 4.49Å; I116-L126 HydrophobicContact CG2-CB 4.22Å; L126-S140 WeakPolarHBondContact O-CA 3.4Å; L126-V141 HydrophobicContact CB-CB 4.26Å; L126-V141 HydrophobicContact CB-CG2 4.47Å; L126-V141 HydrophobicContact CD2-CB 3.85Å; L126-V141 HydrophobicContact CD2-CG1 4.08Å; L126-V141 HydrophobicContact CD2-CG2 3.88Å; L126-V141 HydrophobicContact CG-CB 3.92Å; L126-V141 HydrophobicContact CG-CG2 3.71Å; L126-V141 PolarHBondContact O-N 2.81Å; L126-V181 HydrophobicContact CD1-CB 4.35Å; L126-V181 HydrophobicContact CD1-CG1 3.92Å; L126-V181 HydrophobicContact CD1-CG2 3.36Å; L126-I245 HydrophobicContact CD2-CD1 4.49Å
127	L	82.6	Confident	69.6	Low	73 Å²	73	65.3 Å²	65.3	38%	0.382	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	138.2	-179.6	-61.6	-179	0	0	0	111.6	L125 M138 V139	L125-L127 HydrophobicContact CB-CD2 3.91Å; L125-L127 HydrophobicContact CB-CG 4.27Å; L125-L127 PolarHBondContact O-N 3.27Å; L125-L127 VanDerWaalsContact O-N 3.08Å; L127-M138 HydrophobicContact CB-CB 4.28Å; L127-M138 HydrophobicContact CD1-CB 4.26Å; L127-V139 WeakPolarHBondContact CA-O 3.35Å
128	I	81.6	Confident	69.9	Low	0 Å²	0	69.6 Å²	69.6	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	136.4	176.7	-68.7	-177	0	0	0	109	Q130 V139 V141 F147 L243 Y273 V275	I128-Q130 PolarHBondContact O-N 2.03Å; I128-V139 PolarHBondContact N-O 3.14Å; I128-V139 PolarHBondContact O-N 2.83Å; I128-V141 HydrophobicContact CB-CG2 4.34Å; I128-V141 HydrophobicContact CD1-CG2 3.39Å; I128-V141 HydrophobicContact CG1-CG2 3.75Å; I128-F147 HydrophobicContact CB-CZ 4.18Å; I128-F147 HydrophobicContact CD1-CZ 4.06Å; I128-F147 HydrophobicContact CG2-CE2 3.98Å; I128-F147 HydrophobicContact CG2-CZ 4.09Å; I128-L243 HydrophobicContact CD1-CD1 3.43Å; I128-L243 VanDerWaalsContact CD1-CD1 3.43Å; I128-L243 HydrophobicContact CG1-CD1 4.39Å; I128-Y273 HydrophobicContact CG2-CD1 4.11Å; I128-Y273 HydrophobicContact CG2-CD2 4.29Å; I128-Y273 HydrophobicContact CG2-CG 3.72Å; I128-V275 HydrophobicContact CD1-CG2 3.35Å
129	P	79.8	Confident	70.2	Confident	2 Å²	2	67.8 Å²	67.8	1%	0.013	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	131.8	177.4	28.9	-35.2	0	0	0	110.7	C136 E137 M138 S149 W153 Y273	P129-C136 HydrophobicContact CB-CB 4.43Å; P129-E137 CarbonylContact C-O 3.54Å; P129-E137 VanDerWaalsContact CA-O 3.3Å; P129-E137 WeakPolarHBondContact CA-O 3.4Å; P129-M138 HydrophobicContact CB-CE 4.4Å; P129-M138 HydrophobicContact CB-SD 4.05Å; P129-M138 HydrophobicContact CG-SD 4.44Å; P129-S149 WeakPolarHBondContact O-CB 3.47Å; P129-S149 PolarHBondContact O-OG 3.06Å; P129-W153 HydrophobicContact CB-CZ2 3.99Å; P129-W153 HydrophobicContact CG-CZ2 4.3Å; P129-Y273 HydrophobicContact CG-CD2 3.67Å; P129-Y273 HydrophobicContact CG-CE2 3.41Å; P129-Y273 VanDerWaalsContact CG-CE2 3.41Å
130	Q	76.3	Confident	71.2	Confident	54 Å²	54	66.5 Å²	66.5	25%	0.252	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	143.9	174.6	-62.8	-169.8	20.4	0	0	111.4	I128 C136 E137 V139 F147 S149	I128-Q130 PolarHBondContact O-N 2.03Å; Q130-C136 WeakPolarHBondContact O-CA 3.33Å; Q130-E137 PolarHBondContact N-O 3.46Å; Q130-E137 PolarHBondContact O-N 2.94Å; Q130-V139 HydrophobicContact CB-CB 4.4Å; Q130-V139 HydrophobicContact CB-CG2 3.91Å; Q130-V139 HydrophobicContact CG-CB 3.98Å; Q130-V139 HydrophobicContact CG-CG2 4.05Å; Q130-F147 HydrophobicContact CG-CE2 4.15Å; Q130-F147 VanDerWaalsContact NE2-CE2 3.3Å; Q130-F147 VanDerWaalsContact NE2-CZ 3.31Å; Q130-S149 WeakPolarHBondContact CA-OG 3.35Å
131	P	69.8	Low	72.2	Confident	80 Å²	80	60.2 Å²	60.2	52%	0.519	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	130.2	179.8	29.3	-35.5	0	0	0	111.9	S149 Y150	P131-S149 WeakPolarHBondContact CD-OG 3.09Å; P131-Y150 WeakPolarHBondContact CG-O 3.49Å
132	K	67.4	Low	73.3	Confident	98 Å²	98	55.1 Å²	55.1	43%	0.426	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	102.6	-177	-170.7	-173.7	-177	-178.5	0	110.9	N29 I134 S135 E137	N29-K132 PolarHBondContact ND2-NZ 2.69Å; K132-I134 PolarHBondContact O-N 2.77Å; K132-S135 PolarHBondContact N-O 3.35Å; K132-S135 PolarHBondContact O-N 2.81Å; K132-S135 VanDerWaalsContact O-N 3.17Å; K132-E137 HydrophobicContact CD-CB 4.31Å; K132-E137 WeakPolarHBondContact CD-OE2 3.2Å; K132-E137 WeakPolarHBondContact CE-OE2 3.12Å; K132-E137 IonicContact NZ-OE1 2.7Å; K132-E137 PolarHBondContact NZ-OE1 2.74Å; K132-E137 IonicContact NZ-OE2 2.62Å; K132-E137 PolarHBondContact NZ-OE2 3.21Å
133	Q	61.1	Low	73.8	Confident	202 Å²	202	50.7 Å²	50.7	94%	0.944	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	-70.6	-176.3	-61.4	-176.8	-12.6	0	0	115.1
134	I	61.7	Low	73.6	Confident	101 Å²	101	49.2 Å²	49.2	52%	0.518	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.6	-22	-174.2	-56.5	173.5	0	0	0	111.3	K132 R165	K132-I134 PolarHBondContact O-N 2.77Å; I134-R165 HydrophobicContact CD1-CG 4.35Å; I134-R165 HydrophobicContact CG2-CB 4.09Å; I134-R165 HydrophobicContact CG2-CG 4.05Å
135	S	71.2	Confident	73.4	Confident	49 Å²	49	51.1 Å²	51.1	34%	0.343	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	171.4	-176.7	59.6	0	0	0	0	113.3	K132 N167	K132-S135 PolarHBondContact N-O 3.35Å; K132-S135 PolarHBondContact O-N 2.81Å; K132-S135 VanDerWaalsContact O-N 3.17Å; S135-N167 WeakPolarHBondContact CA-OD1 3.24Å
136	C	73.5	Confident	73.3	Confident	23 Å²	23	48.7 Å²	48.7	16%	0.155	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	130.8	168	-84.1	0	0	0	0	112.1	P129 Q130 C151 W153 N167	P129-C136 HydrophobicContact CB-CB 4.43Å; Q130-C136 WeakPolarHBondContact O-CA 3.33Å; C136-C151 HydrophobicContact CB-CB 4.01Å; C136-C151 WeakPolarHBondContact CB-SG 3.16Å; C136-C151 WeakPolarHBondContact SG-CA 3.45Å; C136-C151 WeakPolarHBondContact SG-CB 3.49Å; C136-C151 CovalentContact SG-SG 2.04Å; C136-C151 PolarHBondContact SG-SG 2.69Å; C136-W153 HydrophobicContact CB-CH2 3.74Å; C136-W153 HydrophobicContact CB-CZ2 4.08Å; C136-W153 HydrophobicContact CB-CZ3 4.26Å; C136-N167 PolarHBondContact N-OD1 2.85Å
137	E	72.7	Confident	72.7	Confident	47 Å²	47	49.5 Å²	49.5	22%	0.22	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	140.8	-171.8	180	168	126.8	0	0	110.8	N29 P129 Q130 K132 V139	N29-E137 PolarHBondContact ND2-OE1 3.36Å; N29-E137 PolarHBondContact ND2-OE2 2.87Å; P129-E137 CarbonylContact C-O 3.54Å; P129-E137 VanDerWaalsContact CA-O 3.3Å; P129-E137 WeakPolarHBondContact CA-O 3.4Å; Q130-E137 PolarHBondContact N-O 3.46Å; Q130-E137 PolarHBondContact O-N 2.94Å; K132-E137 HydrophobicContact CD-CB 4.31Å; K132-E137 WeakPolarHBondContact CD-OE2 3.2Å; K132-E137 WeakPolarHBondContact CE-OE2 3.12Å; K132-E137 IonicContact NZ-OE1 2.7Å; K132-E137 PolarHBondContact NZ-OE1 2.74Å; K132-E137 IonicContact NZ-OE2 2.62Å; K132-E137 PolarHBondContact NZ-OE2 3.21Å; E137-V139 PolarHBondContact O-N 2.86Å
138	M	78.5	Confident	72.4	Confident	97 Å²	97	46.9 Å²	46.9	48%	0.478	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	109.2	178.2	-69.3	-62.4	-178	0	0	110.6	L127 P129 V177	L127-M138 HydrophobicContact CB-CB 4.28Å; L127-M138 HydrophobicContact CD1-CB 4.26Å; P129-M138 HydrophobicContact CB-CE 4.4Å; P129-M138 HydrophobicContact CB-SD 4.05Å; P129-M138 HydrophobicContact CG-SD 4.44Å; M138-V177 HydrophobicContact CE-CG2 3.71Å; M138-V177 HydrophobicContact SD-CG2 4.23Å
139	V	73.3	Confident	72.1	Confident	48 Å²	48	47 Å²	47	29%	0.291	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	140.3	178.9	-179.2	0	0	0	0	109.3	L127 I128 Q130 E137	L127-V139 WeakPolarHBondContact CA-O 3.35Å; I128-V139 PolarHBondContact N-O 3.14Å; I128-V139 PolarHBondContact O-N 2.83Å; Q130-V139 HydrophobicContact CB-CB 4.4Å; Q130-V139 HydrophobicContact CB-CG2 3.91Å; Q130-V139 HydrophobicContact CG-CB 3.98Å; Q130-V139 HydrophobicContact CG-CG2 4.05Å; E137-V139 PolarHBondContact O-N 2.86Å
140	S	78.5	Confident	72	Confident	39 Å²	39	50.4 Å²	50.4	27%	0.273	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	136.4	175.8	45.2	0	0	0	0	112.1	L126 S142	L126-S140 WeakPolarHBondContact O-CA 3.4Å; S140-S142 PolarHBondContact O-N 2.88Å
141	V	77.7	Confident	72.1	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.253	C	S	.	.			trans	-72.6	124.6	169.1	178	0	0	0	0	108.5	I114 L126 I128 F147 V275 F277	I114-V141 WeakPolarHBondContact CB-O 3.44Å; I114-V141 HydrophobicContact CG1-CB 4.48Å; I114-V141 HydrophobicContact CG1-CG1 4.04Å; I114-V141 WeakPolarHBondContact CG1-O 3.39Å; I114-V141 PolarHBondContact N-O 2.95Å; L126-V141 HydrophobicContact CB-CB 4.26Å; L126-V141 HydrophobicContact CB-CG2 4.47Å; L126-V141 HydrophobicContact CD2-CB 3.85Å; L126-V141 HydrophobicContact CD2-CG1 4.08Å; L126-V141 HydrophobicContact CD2-CG2 3.88Å; L126-V141 HydrophobicContact CG-CB 3.92Å; L126-V141 HydrophobicContact CG-CG2 3.71Å; L126-V141 PolarHBondContact O-N 2.81Å; I128-V141 HydrophobicContact CB-CG2 4.34Å; I128-V141 HydrophobicContact CD1-CG2 3.39Å; I128-V141 HydrophobicContact CG1-CG2 3.75Å; V141-F147 HydrophobicContact CG1-CE1 4.43Å; V141-F147 HydrophobicContact CG2-CE1 4.03Å; V141-F147 HydrophobicContact CG2-CZ 4.04Å; V141-V275 HydrophobicContact CG1-CG1 3.92Å; V141-V275 HydrophobicContact CG1-CG2 4.42Å; V141-V275 HydrophobicContact CG2-CG2 4.07Å; V141-F277 HydrophobicContact CG1-CE2 3.91Å; V141-F277 HydrophobicContact CG1-CZ 3.87Å
142	S	75.6	Confident	72.8	Confident	16 Å²	16	45.6 Å²	45.6	11%	0.112	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-104.2	142.5	175.6	-87.9	0	0	0	0	112.2	G111 V112 S140 G144 Q145 F277	G111-S142 VanDerWaalsContact O-CB 3.31Å; G111-S142 WeakPolarHBondContact O-CB 3.39Å; G111-S142 PolarHBondContact O-OG 2.8Å; V112-S142 WeakPolarHBondContact O-CA 3.44Å; S140-S142 PolarHBondContact O-N 2.88Å; S142-G144 PolarHBondContact O-N 3.18Å; S142-Q145 WeakPolarHBondContact O-CB 3.21Å; S142-Q145 PolarHBondContact O-N 3.07Å; S142-F277 WeakPolarHBondContact O-CE2 3.33Å; S142-F277 WeakPolarHBondContact O-CZ 3.36Å
143	F	71.5	Confident	73.6	Confident	4 Å²	4	42.6 Å²	42.6	2%	0.018	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	135.2	-176	-179.6	-97.4	0	0	0	112.4	Y108 I110 G111 V112 I114 Q145 Y247 I253 F277	Y108-F143 VanDerWaalsContact CB-CD2 3.49Å; Y108-F143 VanDerWaalsContact CB-CG 3.49Å; Y108-F143 HydrophobicContact CD1-CB 4.22Å; Y108-F143 HydrophobicContact CD1-CD2 4.45Å; Y108-F143 HydrophobicContact CD1-CG 4.45Å; Y108-F143 HydrophobicContact CD2-CD2 4.36Å; Y108-F143 HydrophobicContact CG-CB 4.42Å; Y108-F143 AromaticContact CG-CD2 3.9Å; Y108-F143 HydrophobicContact CG-CD2 3.9Å; Y108-F143 HydrophobicContact CG-CE2 4.34Å; Y108-F143 HydrophobicContact CG-CG 4.15Å; Y108-F143 WeakPolarHBondContact O-CE1 2.93Å; I110-F143 WeakPolarHBondContact CA-O 3.44Å; G111-F143 PolarHBondContact N-O 2.88Å; V112-F143 WeakPolarHBondContact O-CB 3.13Å; V112-F143 PolarHBondContact O-N 3.03Å; I114-F143 HydrophobicContact CD1-CB 3.82Å; I114-F143 HydrophobicContact CD1-CD2 3.96Å; I114-F143 HydrophobicContact CD1-CG 4.41Å; F143-Q145 PolarHBondContact O-N 3.5Å; F143-Y247 HydrophobicContact CE1-CD2 4.16Å; F143-Y247 HydrophobicContact CE1-CE2 4.32Å; F143-Y247 HydrophobicContact CE2-CD2 4.1Å; F143-Y247 HydrophobicContact CE2-CG 4.02Å; F143-Y247 AromaticContact CZ-CD2 3.4Å; F143-Y247 HydrophobicContact CZ-CD2 3.4Å; F143-Y247 AromaticContact CZ-CE2 4Å; F143-Y247 HydrophobicContact CZ-CE2 4Å; F143-Y247 AromaticContact CZ-CG 3.8Å; F143-Y247 HydrophobicContact CZ-CG 3.8Å; F143-I253 HydrophobicContact CE2-CG1 4.09Å; F143-F277 HydrophobicContact CD2-CD1 4.28Å; F143-F277 AromaticContact CD2-CE1 3.89Å; F143-F277 HydrophobicContact CD2-CE1 3.89Å; F143-F277 HydrophobicContact CG-CE1 4.42Å
144	G	62.9	Low	74.7	Confident	13 Å²	13	35.3 Å²	35.3	13%	0.134	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.4	8.3	179.8	0	0	0	0	0	114.8	S142	S142-G144 PolarHBondContact O-N 3.18Å
145	Q	66.3	Low	75.7	Confident	57 Å²	57	31 Å²	31	27%	0.266	18%	0.176	S	C	.	.			trans	-112.5	83.5	178.6	-65.4	-176.9	-28.9	0	0	110.1	I110 S142 F143 F147	I110-Q145 HydrophobicContact CG2-CG 4.43Å; S142-Q145 WeakPolarHBondContact O-CB 3.21Å; S142-Q145 PolarHBondContact O-N 3.07Å; F143-Q145 PolarHBondContact O-N 3.5Å; Q145-F147 WeakPolarHBondContact O-CD1 3.16Å
146	S	75	Confident	76	Confident	19 Å²	19	29.8 Å²	29.8	13%	0.133	17%	0.167	C	C	.	.			trans	-62.5	140.5	170.2	-53.8	0	0	0	0	110.6	V275 F277 L295	S146-V275 CarbonylContact C-O 3.56Å; S146-V275 VanDerWaalsContact CA-O 3.23Å; S146-V275 WeakPolarHBondContact CA-O 3.5Å; S146-V275 WeakPolarHBondContact CB-O 3.26Å; S146-F277 PolarHBondContact OG-N 3Å; S146-L295 WeakPolarHBondContact O-CD1 3.48Å
147	F	69.2	Low	75.9	Confident	17 Å²	17	34.3 Å²	34.3	8%	0.075	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	167.7	175.6	66.8	-92.4	0	0	0	113.5	I128 Q130 V141 Q145 E274 V275 L295	I128-F147 HydrophobicContact CB-CZ 4.18Å; I128-F147 HydrophobicContact CD1-CZ 4.06Å; I128-F147 HydrophobicContact CG2-CE2 3.98Å; I128-F147 HydrophobicContact CG2-CZ 4.09Å; Q130-F147 HydrophobicContact CG-CE2 4.15Å; Q130-F147 VanDerWaalsContact NE2-CE2 3.3Å; Q130-F147 VanDerWaalsContact NE2-CZ 3.31Å; V141-F147 HydrophobicContact CG1-CE1 4.43Å; V141-F147 HydrophobicContact CG2-CE1 4.03Å; V141-F147 HydrophobicContact CG2-CZ 4.04Å; Q145-F147 WeakPolarHBondContact O-CD1 3.16Å; F147-E274 WeakPolarHBondContact O-CA 3.31Å; F147-V275 HydrophobicContact CD1-CB 4.12Å; F147-V275 HydrophobicContact CD1-CG2 4.26Å; F147-V275 HydrophobicContact CE1-CB 4.02Å; F147-V275 HydrophobicContact CE1-CG2 3.7Å; F147-V275 HydrophobicContact CE2-CG2 4.26Å; F147-V275 HydrophobicContact CZ-CB 4.44Å; F147-V275 HydrophobicContact CZ-CG2 3.69Å; F147-V275 PolarHBondContact N-O 3.44Å; F147-V275 PolarHBondContact O-N 2.64Å; F147-L295 HydrophobicContact CB-CD1 4.12Å
148	V	76.7	Confident	75.4	Confident	18 Å²	18	38.1 Å²	38.1	11%	0.109	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	142.9	166.2	-166.9	0	0	0	0	108.1	Y150 K272 Y273 E274 R298	V148-Y150 HydrophobicContact CG1-CD2 4.3Å; V148-Y150 HydrophobicContact CG1-CE1 4.21Å; V148-Y150 HydrophobicContact CG1-CE2 3.83Å; V148-K272 HydrophobicContact CG1-CG 4.26Å; V148-Y273 CarbonylContact C-O 3.52Å; V148-E274 HydrophobicContact CG2-CG 4.2Å; V148-R298 HydrophobicContact CG2-CG 4.39Å; V148-R298 VanDerWaalsContact CG2-CZ 3.42Å; V148-R298 VanDerWaalsContact CG2-NH1 3.35Å
149	S	75.7	Confident	74.3	Confident	2 Å²	2	36.2 Å²	36.2	1%	0.014	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	138.1	170.9	173.8	0	0	0	0	109.6	P129 Q130 P131 K272 Y273	P129-S149 WeakPolarHBondContact O-CB 3.47Å; P129-S149 PolarHBondContact O-OG 3.06Å; Q130-S149 WeakPolarHBondContact CA-OG 3.35Å; P131-S149 WeakPolarHBondContact CD-OG 3.09Å; S149-K272 WeakPolarHBondContact O-CA 3.49Å; S149-Y273 PolarHBondContact N-O 2.76Å; S149-Y273 PolarHBondContact O-N 3.36Å
150	Y	77.5	Confident	73.2	Confident	75 Å²	75	37.7 Å²	37.7	29%	0.294	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	113.9	173.1	-61.6	-74.1	0	0	0	108.3	P131 V148 T270 K272 I296 E373	P131-Y150 WeakPolarHBondContact CG-O 3.49Å; V148-Y150 HydrophobicContact CG1-CD2 4.3Å; V148-Y150 HydrophobicContact CG1-CE1 4.21Å; V148-Y150 HydrophobicContact CG1-CE2 3.83Å; Y150-T270 HydrophobicContact CD1-CG2 4.39Å; Y150-K272 HydrophobicContact CD1-CB 4.19Å; Y150-K272 HydrophobicContact CD1-CD 4.4Å; Y150-K272 HydrophobicContact CD1-CG 3.91Å; Y150-K272 HydrophobicContact CE1-CB 4.38Å; Y150-K272 HydrophobicContact CE1-CD 3.77Å; Y150-K272 HydrophobicContact CE1-CG 3.77Å; Y150-I296 HydrophobicContact CE2-CG2 4.35Å; Y150-E373 WeakPolarHBondContact CE2-OE1 3.45Å; Y150-E373 VanDerWaalsContact CZ-OE1 3.25Å; Y150-E373 PolarHBondContact OH-OE1 2.84Å
151	C	79.2	Confident	71.8	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	106.8	-177.6	-90.4	0	0	0	0	111.4	C136 W153 T270 Q271	C136-C151 HydrophobicContact CB-CB 4.01Å; C136-C151 WeakPolarHBondContact CB-SG 3.16Å; C136-C151 WeakPolarHBondContact SG-CA 3.45Å; C136-C151 WeakPolarHBondContact SG-CB 3.49Å; C136-C151 CovalentContact SG-SG 2.04Å; C136-C151 PolarHBondContact SG-SG 2.69Å; C151-W153 HydrophobicContact CB-CZ2 4.28Å; C151-W153 PolarHBondContact O-N 2.75Å; C151-T270 WeakPolarHBondContact O-CA 3.38Å; C151-Q271 PolarHBondContact N-O 2.74Å; C151-Q271 PolarHBondContact O-N 3.3Å
152	G	83.2	Confident	70.1	Confident	33 Å²	33	46.4 Å²	46.4	34%	0.34	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	110.9	173	0	0	0	0	0	110.9	N167 F269	G152-N167 WeakPolarHBondContact O-CB 3.46Å; G152-N167 PolarHBondContact O-ND2 2.83Å; G152-F269 CarbonylContact C-O 3.47Å; G152-F269 WeakPolarHBondContact CA-O 3.19Å
153	W	84.3	Confident	68.4	Low	34 Å²	34	50.4 Å²	50.4	13%	0.129	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	153.3	176.7	-63.7	117.1	0	0	0	111.4	P129 C136 C151 N167 V169 L174 T268 F269	P129-W153 HydrophobicContact CB-CZ2 3.99Å; P129-W153 HydrophobicContact CG-CZ2 4.3Å; C136-W153 HydrophobicContact CB-CH2 3.74Å; C136-W153 HydrophobicContact CB-CZ2 4.08Å; C136-W153 HydrophobicContact CB-CZ3 4.26Å; C151-W153 HydrophobicContact CB-CZ2 4.28Å; C151-W153 PolarHBondContact O-N 2.75Å; W153-N167 HydrophobicContact CE3-CB 3.89Å; W153-N167 HydrophobicContact CZ3-CB 4.33Å; W153-V169 HydrophobicContact CB-CG1 3.77Å; W153-V169 HydrophobicContact CD2-CG1 4.01Å; W153-V169 HydrophobicContact CE3-CB 3.99Å; W153-V169 HydrophobicContact CE3-CG1 3.85Å; W153-V169 HydrophobicContact CG-CG1 3.99Å; W153-L174 HydrophobicContact CB-CD2 4.29Å; W153-L174 HydrophobicContact CD2-CD2 4.45Å; W153-L174 HydrophobicContact CG-CD2 3.95Å; W153-T268 CarbonylContact O-C 3.54Å; W153-T268 VanDerWaalsContact O-CA 3.26Å; W153-T268 WeakPolarHBondContact O-CA 3.49Å; W153-F269 HydrophobicContact CB-CD1 4.29Å; W153-F269 HydrophobicContact CB-CE1 3.83Å; W153-F269 HydrophobicContact CB-CZ 4.36Å; W153-F269 AromaticContact CD1-CZ 3.98Å; W153-F269 HydrophobicContact CG-CE1 4.48Å; W153-F269 PolarHBondContact N-O 2.84Å; W153-F269 PolarHBondContact O-N 2.76Å
154	N	84.7	Confident	67	Low	49 Å²	49	56.4 Å²	56.4	26%	0.262	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	117.2	169.7	-175.6	36.4	0	0	0	109.2	V156 N167 N168 V169 T268	N154-V156 PolarHBondContact O-N 2.92Å; N154-N167 PolarHBondContact N-O 3.34Å; N154-N168 PolarHBondContact ND2-OD1 2.98Å; N154-N168 CarbonylContact O-C 3.58Å; N154-N168 WeakPolarHBondContact O-CA 3.31Å; N154-V169 PolarHBondContact O-N 2.79Å; N154-T268 HydrophobicContact CB-CG2 3.99Å; N154-T268 WeakPolarHBondContact OD1-CG2 3.47Å
155	V	82.3	Confident	66.3	Low	10 Å²	10	64.8 Å²	64.8	6%	0.061	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	122.8	-176.1	-174.2	0	0	0	0	110.3	V169 C171 L174 C234 V265 G267 F269	V155-V169 WeakPolarHBondContact CA-O 3.38Å; V155-C171 HydrophobicContact CG1-CB 4.19Å; V155-L174 HydrophobicContact CG2-CD1 4.07Å; V155-C234 HydrophobicContact CG1-CB 4.1Å; V155-V265 HydrophobicContact CG2-CG2 4.28Å; V155-G267 PolarHBondContact N-O 2.7Å; V155-F269 HydrophobicContact CG2-CD1 4.08Å; V155-F269 HydrophobicContact CG2-CE1 3.94Å
156	V	78.7	Confident	65.7	Low	25 Å²	25	65 Å²	65	15%	0.152	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	145.4	177.4	-62.2	0	0	0	0	111.6	N154 I158 N168 V169 K170	N154-V156 PolarHBondContact O-N 2.92Å; V156-I158 VanDerWaalsContact CG2-O 3.31Å; V156-I158 WeakPolarHBondContact CG2-O 3.3Å; V156-N168 HydrophobicContact CG1-CB 4Å; V156-N168 HydrophobicContact CG2-CB 4.03Å; V156-V169 PolarHBondContact N-O 2.9Å; V156-K170 WeakPolarHBondContact O-CA 3.48Å
157	E	69.8	Low	65.4	Low	118 Å²	118	65.7 Å²	65.7	55%	0.551	33%	0.334	S	S	*	.	S	Bend	trans	-70.5	-39.5	173.3	-57.8	-171.2	135.2	0	0	111.5	I224 T232	E157-I224 HydrophobicContact CG-CD1 4.23Å; E157-T232 HydrophobicContact CG-CG2 3.98Å; E157-T232 WeakPolarHBondContact OE1-CG2 3.42Å
158	I	63.9	Low	65.9	Low	126 Å²	126	66.8 Å²	66.8	65%	0.646	34%	0.341	S	S	*	.	S	Bend	trans	-119.7	128.3	-176.3	-53.1	178.1	0	0	0	108.9	V156 T160	V156-I158 VanDerWaalsContact CG2-O 3.31Å; V156-I158 WeakPolarHBondContact CG2-O 3.3Å; I158-T160 PolarHBondContact O-N 2.81Å; I158-T160 VanDerWaalsContact O-N 3.1Å
159	E	54.1	Low	66	Low	58 Å²	58	66.5 Å²	66.5	27%	0.271	34%	0.339	S	S	.	.			trans	-69.4	105.5	172.4	-91	161	154.5	0	0	108.8	T161 K170 R173	E159-T161 PolarHBondContact O-N 2.69Å; E159-K170 HydrophobicContact CG-CD 3.94Å; E159-K170 HydrophobicContact CG-CG 3.99Å; E159-K170 WeakPolarHBondContact OE2-CD 3.32Å; E159-K170 VanDerWaalsContact OE2-CE 3.24Å; E159-K170 WeakPolarHBondContact OE2-CE 3.49Å; E159-K170 IonicContact OE2-NZ 2.68Å; E159-K170 PolarHBondContact OE2-NZ 2.97Å; E159-R173 WeakPolarHBondContact OE1-CD 3.12Å; E159-R173 IonicContact OE1-CZ 3.71Å; E159-R173 IonicContact OE1-NE 3.88Å; E159-R173 IonicContact OE1-NH1 2.76Å; E159-R173 PolarHBondContact OE1-NH1 2.76Å
160	T	50.8	Low	66.2	Low	79 Å²	79	69.4 Å²	69.4	49%	0.485	35%	0.351	S	S	.	.			trans	-84.3	100.1	173.6	35.1	0	0	0	0	109.3	I158 N162 N168	I158-T160 PolarHBondContact O-N 2.81Å; I158-T160 VanDerWaalsContact O-N 3.1Å; T160-N162 PolarHBondContact O-N 2.89Å; T160-N168 PolarHBondContact OG1-ND2 3.16Å
161	T	49	Very low	66.5	Low	94 Å²	94	66 Å²	66	58%	0.577	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-17.1	-173	47.1	0	0	0	0	115.5	E159	E159-T161 PolarHBondContact O-N 2.69Å
162	N	41.8	Very low	66.6	Low	127 Å²	127	68.8 Å²	68.8	68%	0.679	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-1.9	-160.5	-64.7	8.4	0	0	0	115.1	T160	T160-N162 PolarHBondContact O-N 2.89Å
163	N	39.7	Very low	66.5	Low	100 Å²	100	70.3 Å²	70.3	54%	0.535	35%	0.349	S	S	.	.			trans	-109.6	81.9	-176.8	-78.4	-18.8	0	0	0	112.7	R165 T166	N163-R165 PolarHBondContact O-N 2.97Å; N163-T166 HydrophobicContact CB-CG2 4.18Å; N163-T166 WeakPolarHBondContact CB-OG1 3.42Å; N163-T166 PolarHBondContact O-N 2.81Å; N163-T166 PolarHBondContact O-OG1 3.35Å; N163-T166 VanDerWaalsContact O-OG1 3.1Å
164	F	41.6	Very low	66.4	Low	130 Å²	130	68.9 Å²	68.9	57%	0.57	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	3.4	175.2	-69.3	-84.8	0	0	0	117	I27 Y30	I27-F164 HydrophobicContact CD1-CE1 3.88Å; I27-F164 HydrophobicContact CD1-CZ 3.86Å; I27-F164 HydrophobicContact CG2-CE1 4.29Å; Y30-F164 AromaticContact CD2-CE1 3.98Å; Y30-F164 HydrophobicContact CD2-CE1 3.98Å; Y30-F164 HydrophobicContact CE2-CE1 4.17Å; Y30-F164 HydrophobicContact CG-CE1 4.32Å
165	R	48.3	Very low	66.2	Low	189 Å²	189	66.6 Å²	66.6	71%	0.713	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.6	10.3	-176.1	-82.5	-173.8	-85.6	-98.3	-0.1	114.2	I134 N163	I134-R165 HydrophobicContact CD1-CG 4.35Å; I134-R165 HydrophobicContact CG2-CB 4.09Å; I134-R165 HydrophobicContact CG2-CG 4.05Å; N163-R165 PolarHBondContact O-N 2.97Å
166	T	54.7	Low	66	Low	61 Å²	61	67.8 Å²	67.8	37%	0.374	34%	0.338	S	S	.	.			trans	-116.8	128.5	177.9	52.5	0	0	0	0	110.8	N163 N168	N163-T166 HydrophobicContact CB-CG2 4.18Å; N163-T166 WeakPolarHBondContact CB-OG1 3.42Å; N163-T166 PolarHBondContact O-N 2.81Å; N163-T166 PolarHBondContact O-OG1 3.35Å; N163-T166 VanDerWaalsContact O-OG1 3.1Å; T166-N168 WeakPolarHBondContact CB-OD1 3.42Å; T166-N168 PolarHBondContact O-N 3.06Å; T166-N168 PolarHBondContact OG1-ND2 2.95Å
167	N	68.3	Low	65.9	Low	35 Å²	35	67.6 Å²	67.6	19%	0.187	34%	0.337	C	S	.	.			trans	-73.7	45.3	169.9	-68.7	-27.8	0	0	0	111.8	S135 C136 G152 W153 N154 V169	S135-N167 WeakPolarHBondContact CA-OD1 3.24Å; C136-N167 PolarHBondContact N-OD1 2.85Å; G152-N167 WeakPolarHBondContact O-CB 3.46Å; G152-N167 PolarHBondContact O-ND2 2.83Å; W153-N167 HydrophobicContact CE3-CB 3.89Å; W153-N167 HydrophobicContact CZ3-CB 4.33Å; N154-N167 PolarHBondContact N-O 3.34Å; N167-V169 PolarHBondContact O-N 3.43Å
168	N	79	Confident	66.5	Low	39 Å²	39	62.3 Å²	62.3	21%	0.209	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	122.3	176.9	-75.7	-0.4	0	0	0	108.9	N154 V156 T160 T166	N154-N168 PolarHBondContact ND2-OD1 2.98Å; N154-N168 CarbonylContact O-C 3.58Å; N154-N168 WeakPolarHBondContact O-CA 3.31Å; V156-N168 HydrophobicContact CG1-CB 4Å; V156-N168 HydrophobicContact CG2-CB 4.03Å; T160-N168 PolarHBondContact OG1-ND2 3.16Å; T166-N168 WeakPolarHBondContact CB-OD1 3.42Å; T166-N168 PolarHBondContact O-N 3.06Å; T166-N168 PolarHBondContact OG1-ND2 2.95Å
169	V	78.8	Confident	67.2	Low	12 Å²	12	57.2 Å²	57.2	7%	0.073	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	139.6	-177.2	64.8	0	0	0	0	110.9	W153 N154 V155 V156 N167 R173 L174	W153-V169 HydrophobicContact CB-CG1 3.77Å; W153-V169 HydrophobicContact CD2-CG1 4.01Å; W153-V169 HydrophobicContact CE3-CB 3.99Å; W153-V169 HydrophobicContact CE3-CG1 3.85Å; W153-V169 HydrophobicContact CG-CG1 3.99Å; N154-V169 PolarHBondContact O-N 2.79Å; V155-V169 WeakPolarHBondContact CA-O 3.38Å; V156-V169 PolarHBondContact N-O 2.9Å; N167-V169 PolarHBondContact O-N 3.43Å; V169-R173 HydrophobicContact CG2-CB 3.93Å; V169-L174 HydrophobicContact CG1-CD2 3.53Å; V169-L174 HydrophobicContact CG1-CG 4.15Å; V169-L174 HydrophobicContact CG2-CD2 4.25Å
170	K	81.3	Confident	68.2	Low	63 Å²	63	57.8 Å²	57.8	27%	0.274	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	138.9	171.3	-84.3	169.2	-173.5	159.4	0	110.6	V156 E159 N172 R173	V156-K170 WeakPolarHBondContact O-CA 3.48Å; E159-K170 HydrophobicContact CG-CD 3.94Å; E159-K170 HydrophobicContact CG-CG 3.99Å; E159-K170 WeakPolarHBondContact OE2-CD 3.32Å; E159-K170 VanDerWaalsContact OE2-CE 3.24Å; E159-K170 WeakPolarHBondContact OE2-CE 3.49Å; E159-K170 IonicContact OE2-NZ 2.68Å; E159-K170 PolarHBondContact OE2-NZ 2.97Å; K170-N172 VanDerWaalsContact C-N 3.26Å; K170-N172 WeakPolarHBondContact CB-OD1 3.45Å; K170-N172 PolarHBondContact O-N 3.26Å; K170-N172 VanDerWaalsContact O-N 3.15Å; K170-R173 HydrophobicContact CB-CG 4.36Å; K170-R173 PolarHBondContact O-N 2.83Å
171	C	83.8	Confident	69.6	Low	3 Å²	3	54.3 Å²	54.3	2%	0.02	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-43.9	-49.7	176.6	175	0	0	0	0	113	V155 R173 L174 P222 S223 I224 C234	V155-C171 HydrophobicContact CG1-CB 4.19Å; C171-R173 PolarHBondContact O-N 3.31Å; C171-R173 VanDerWaalsContact O-N 3.11Å; C171-L174 WeakPolarHBondContact O-CB 3.44Å; C171-L174 PolarHBondContact O-N 3.15Å; C171-L174 VanDerWaalsContact O-N 3.12Å; C171-P222 WeakPolarHBondContact O-CB 3.29Å; C171-S223 PolarHBondContact SG-O 3.02Å; C171-I224 HydrophobicContact CB-CD1 4.18Å; C171-I224 HydrophobicContact CB-CG1 3.6Å; C171-C234 WeakPolarHBondContact CA-SG 3.14Å; C171-C234 HydrophobicContact CB-CB 3.78Å; C171-C234 WeakPolarHBondContact CB-SG 3.44Å; C171-C234 VanDerWaalsContact SG-CA 3.52Å; C171-C234 WeakPolarHBondContact SG-CB 3.45Å; C171-C234 CovalentContact SG-SG 2.02Å; C171-C234 PolarHBondContact SG-SG 2.84Å
172	N	80.3	Confident	71	Confident	59 Å²	59	51.7 Å²	51.7	32%	0.316	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-66	-14.2	-177.5	69.6	-13.8	0	0	0	115.6	K170 T221 P222	K170-N172 VanDerWaalsContact C-N 3.26Å; K170-N172 WeakPolarHBondContact CB-OD1 3.45Å; K170-N172 PolarHBondContact O-N 3.26Å; K170-N172 VanDerWaalsContact O-N 3.15Å; N172-T221 WeakPolarHBondContact O-CB 3.39Å; N172-P222 VanDerWaalsContact CA-O 3.27Å; N172-P222 WeakPolarHBondContact CA-O 3.45Å
173	R	82	Confident	72.9	Confident	65 Å²	65	50.8 Å²	50.8	25%	0.245	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-87.8	-19.3	175.6	-61.9	-173.4	68.4	-175.3	-1	113.3	E159 V169 K170 C171 G175 D176	E159-R173 WeakPolarHBondContact OE1-CD 3.12Å; E159-R173 IonicContact OE1-CZ 3.71Å; E159-R173 IonicContact OE1-NE 3.88Å; E159-R173 IonicContact OE1-NH1 2.76Å; E159-R173 PolarHBondContact OE1-NH1 2.76Å; V169-R173 HydrophobicContact CG2-CB 3.93Å; K170-R173 HydrophobicContact CB-CG 4.36Å; K170-R173 PolarHBondContact O-N 2.83Å; C171-R173 PolarHBondContact O-N 3.31Å; C171-R173 VanDerWaalsContact O-N 3.11Å; R173-G175 PolarHBondContact O-N 2.89Å; R173-G175 VanDerWaalsContact O-N 3.12Å; R173-D176 WeakPolarHBondContact O-CB 3.37Å; R173-D176 PolarHBondContact O-N 3.42Å
174	L	82.4	Confident	74.9	Confident	4 Å²	4	46.1 Å²	46.1	2%	0.021	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-21	-179	-69.5	173.9	0	0	0	113.8	W153 V155 V169 C171 P222 V237 V265 F269 Q271	W153-L174 HydrophobicContact CB-CD2 4.29Å; W153-L174 HydrophobicContact CD2-CD2 4.45Å; W153-L174 HydrophobicContact CG-CD2 3.95Å; V155-L174 HydrophobicContact CG2-CD1 4.07Å; V169-L174 HydrophobicContact CG1-CD2 3.53Å; V169-L174 HydrophobicContact CG1-CG 4.15Å; V169-L174 HydrophobicContact CG2-CD2 4.25Å; C171-L174 WeakPolarHBondContact O-CB 3.44Å; C171-L174 PolarHBondContact O-N 3.15Å; C171-L174 VanDerWaalsContact O-N 3.12Å; L174-P222 HydrophobicContact CB-CG 4.43Å; L174-V237 HydrophobicContact CB-CG1 4.17Å; L174-V237 HydrophobicContact CB-CG2 4.34Å; L174-V237 HydrophobicContact CD1-CG1 4.15Å; L174-V237 HydrophobicContact CD1-CG2 3.84Å; L174-V265 HydrophobicContact CD1-CG2 4.44Å; L174-F269 HydrophobicContact CD1-CE1 3.7Å; L174-F269 HydrophobicContact CD1-CZ 3.83Å; L174-F269 HydrophobicContact CD2-CE1 3.99Å; L174-F269 HydrophobicContact CD2-CZ 3.81Å; L174-F269 HydrophobicContact CG-CZ 4.41Å; L174-Q271 PolarHBondContact O-NE2 3.37Å
175	G	79.3	Confident	76.8	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.01	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-8.7	175	0	0	0	0	0	115	R173 V177 F178 L179	R173-G175 PolarHBondContact O-N 2.89Å; R173-G175 VanDerWaalsContact O-N 3.12Å; G175-V177 PolarHBondContact O-N 3.46Å; G175-F178 PolarHBondContact O-N 2.93Å; G175-L179 WeakPolarHBondContact O-CB 3.35Å; G175-L179 WeakPolarHBondContact O-CG 3.2Å; G175-L179 PolarHBondContact O-N 3.46Å
176	D	79	Confident	78.4	Confident	36 Å²	36	34.9 Å²	34.9	19%	0.193	18%	0.18	C	C	.	.	H	α-helix	trans	-56.5	-50.2	-168.3	-76.1	-11.4	0	0	0	111.9	R44 R173 F178 L179 T180	R44-D176 IonicContact CZ-OD1 3.37Å; R44-D176 IonicContact CZ-OD2 3.75Å; R44-D176 IonicContact NE-OD1 3.22Å; R44-D176 PolarHBondContact NE-OD1 2.82Å; R44-D176 IonicContact NE-OD2 2.82Å; R44-D176 PolarHBondContact NE-OD2 3.37Å; R44-D176 IonicContact NH2-OD1 2.69Å; R44-D176 PolarHBondContact NH2-OD1 2.85Å; R44-D176 IonicContact NH2-OD2 3.8Å; R173-D176 WeakPolarHBondContact O-CB 3.37Å; R173-D176 PolarHBondContact O-N 3.42Å; D176-F178 PolarHBondContact O-N 3.38Å; D176-L179 PolarHBondContact O-N 3.3Å; D176-T180 WeakPolarHBondContact O-CB 3.22Å; D176-T180 PolarHBondContact O-N 2.91Å; D176-T180 PolarHBondContact O-OG1 3.07Å
177	V	76.9	Confident	79.5	Confident	21 Å²	21	32.1 Å²	32.1	13%	0.127	16%	0.163	C	C	.	.	H	α-helix	trans	-61	-48.9	179.5	179.6	0	0	0	0	111.3	M138 G175 L179 V181 Y273	M138-V177 HydrophobicContact CE-CG2 3.71Å; M138-V177 HydrophobicContact SD-CG2 4.23Å; G175-V177 PolarHBondContact O-N 3.46Å; V177-L179 PolarHBondContact O-N 2.85Å; V177-V181 HydrophobicContact CG1-CG2 4.49Å; V177-V181 WeakPolarHBondContact O-CB 3.1Å; V177-V181 VanDerWaalsContact O-CG2 3.22Å; V177-V181 WeakPolarHBondContact O-CG2 3.26Å; V177-V181 PolarHBondContact O-N 3.49Å; V177-Y273 HydrophobicContact CB-CE1 4.18Å; V177-Y273 HydrophobicContact CG1-CE1 3.75Å
178	F	81.6	Confident	79.9	Confident	6 Å²	6	33.6 Å²	33.6	3%	0.026	17%	0.167	C	C	.	.	H	α-helix	trans	-60.7	-45.8	179	171	-108.9	0	0	0	111.9	G175 D176 V181 K182 V204 C217 P238 V241 I258 A260	G175-F178 PolarHBondContact O-N 2.93Å; D176-F178 PolarHBondContact O-N 3.38Å; F178-V181 PolarHBondContact O-N 3.09Å; F178-K182 HydrophobicContact CE1-CD 4.12Å; F178-K182 HydrophobicContact CZ-CB 4.5Å; F178-K182 HydrophobicContact CZ-CD 4.14Å; F178-K182 WeakPolarHBondContact O-CB 3.34Å; F178-K182 PolarHBondContact O-N 3.09Å; F178-V204 HydrophobicContact CE2-CG1 3.95Å; F178-V204 HydrophobicContact CZ-CG1 4Å; F178-C217 HydrophobicContact CZ-CB 4.39Å; F178-P238 HydrophobicContact CB-CB 4.08Å; F178-P238 HydrophobicContact CB-CG 3.79Å; F178-P238 HydrophobicContact CD1-CB 4.34Å; F178-P238 HydrophobicContact CD1-CG 4.38Å; F178-P238 HydrophobicContact CG-CB 4.11Å; F178-P238 HydrophobicContact CG-CG 4.24Å; F178-V241 HydrophobicContact CB-CG2 4.3Å; F178-V241 HydrophobicContact CD2-CG1 4.23Å; F178-V241 HydrophobicContact CD2-CG2 4.28Å; F178-I258 HydrophobicContact CD2-CG2 4.3Å; F178-I258 HydrophobicContact CE2-CG2 4.02Å; F178-A260 HydrophobicContact CD2-CB 4.03Å; F178-A260 HydrophobicContact CE2-CB 3.59Å; F178-A260 HydrophobicContact CZ-CB 4.06Å
179	L	78	Confident	79.5	Confident	19 Å²	19	32.9 Å²	32.9	10%	0.099	16%	0.163	C	C	.	.	H	α-helix	trans	-70.4	-40.5	-177.2	-68.7	169.8	0	0	0	112.2	G175 D176 V177 K182 N183 T221	G175-L179 WeakPolarHBondContact O-CB 3.35Å; G175-L179 WeakPolarHBondContact O-CG 3.2Å; G175-L179 PolarHBondContact O-N 3.46Å; D176-L179 PolarHBondContact O-N 3.3Å; V177-L179 PolarHBondContact O-N 2.85Å; L179-K182 HydrophobicContact CD2-CD 4.39Å; L179-N183 VanDerWaalsContact O-CB 3.29Å; L179-N183 WeakPolarHBondContact O-CB 3.15Å; L179-N183 PolarHBondContact O-N 2.82Å; L179-N183 PolarHBondContact O-ND2 3.14Å; L179-T221 HydrophobicContact CD1-CG2 3.91Å
180	T	75.1	Confident	78.7	Confident	71 Å²	71	33.4 Å²	33.4	44%	0.436	17%	0.165	S	C	.	.	H	α-helix	trans	-59.2	-50	172.3	-70.1	0	0	0	0	110.6	I116 D176 N183 S184	I116-T180 HydrophobicContact CD1-CG2 4.34Å; D176-T180 WeakPolarHBondContact O-CB 3.22Å; D176-T180 PolarHBondContact O-N 2.91Å; D176-T180 PolarHBondContact O-OG1 3.07Å; T180-N183 CarbonylContact O-C 3.58Å; T180-N183 PolarHBondContact O-N 3.19Å; T180-S184 VanDerWaalsContact O-CB 3.27Å; T180-S184 WeakPolarHBondContact O-CB 3.41Å; T180-S184 PolarHBondContact O-N 3.15Å
181	V	80.3	Confident	77.8	Confident	6 Å²	6	32.2 Å²	32.2	4%	0.036	16%	0.16	C	C	.	.	H	α-helix	trans	-71	-41.1	-175.8	-175.6	0	0	0	0	111.4	I116 L126 V177 F178 N183 S184 L243 F256 I258	I116-V181 HydrophobicContact CD1-CG2 4.31Å; L126-V181 HydrophobicContact CD1-CB 4.35Å; L126-V181 HydrophobicContact CD1-CG1 3.92Å; L126-V181 HydrophobicContact CD1-CG2 3.36Å; V177-V181 HydrophobicContact CG1-CG2 4.49Å; V177-V181 WeakPolarHBondContact O-CB 3.1Å; V177-V181 VanDerWaalsContact O-CG2 3.22Å; V177-V181 WeakPolarHBondContact O-CG2 3.26Å; V177-V181 PolarHBondContact O-N 3.49Å; F178-V181 PolarHBondContact O-N 3.09Å; V181-N183 VanDerWaalsContact C-N 3.29Å; V181-N183 PolarHBondContact O-N 2.91Å; V181-S184 WeakPolarHBondContact CA-OG 3.26Å; V181-S184 PolarHBondContact O-N 2.77Å; V181-S184 VanDerWaalsContact O-N 3.17Å; V181-S184 PolarHBondContact O-OG 3.44Å; V181-L243 HydrophobicContact CG1-CD2 4.11Å; V181-F256 HydrophobicContact CG1-CE1 3.9Å; V181-F256 HydrophobicContact CG1-CZ 3.55Å; V181-I258 HydrophobicContact CB-CD1 4.47Å; V181-I258 HydrophobicContact CG1-CD1 3.72Å
182	K	80.1	Confident	76.6	Confident	38 Å²	38	34.2 Å²	34.2	17%	0.165	17%	0.17	C	C	.	.	H	α-helix	trans	-53.1	-43.3	171.9	175.2	-166.3	-176.1	-162.5	0	112.7	F178 L179 V204 C217 P218	F178-K182 HydrophobicContact CE1-CD 4.12Å; F178-K182 HydrophobicContact CZ-CB 4.5Å; F178-K182 HydrophobicContact CZ-CD 4.14Å; F178-K182 WeakPolarHBondContact O-CB 3.34Å; F178-K182 PolarHBondContact O-N 3.09Å; L179-K182 HydrophobicContact CD2-CD 4.39Å; K182-V204 HydrophobicContact CB-CG2 4.44Å; K182-V204 HydrophobicContact CG-CB 4.45Å; K182-V204 HydrophobicContact CG-CG1 4.16Å; K182-V204 HydrophobicContact CG-CG2 4.06Å; K182-C217 PolarHBondContact NZ-O 3.02Å; K182-P218 PolarHBondContact NZ-O 2.92Å
183	N	80.5	Confident	75.3	Confident	108 Å²	108	35.9 Å²	35.9	58%	0.578	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.4	4.2	-175.8	-59.5	-20.5	0	0	0	112.7	L179 T180 V181	L179-N183 VanDerWaalsContact O-CB 3.29Å; L179-N183 WeakPolarHBondContact O-CB 3.15Å; L179-N183 PolarHBondContact O-N 2.82Å; L179-N183 PolarHBondContact O-ND2 3.14Å; T180-N183 CarbonylContact O-C 3.58Å; T180-N183 PolarHBondContact O-N 3.19Å; V181-N183 VanDerWaalsContact C-N 3.29Å; V181-N183 PolarHBondContact O-N 2.91Å
184	S	81.4	Confident	73.8	Confident	3 Å²	3	34.5 Å²	34.5	2%	0.021	19%	0.185	C	C	.	.			trans	-91.4	173.7	173.8	76.3	0	0	0	0	111.7	S117 T180 V181 P202	S117-S184 CarbonylContact O-C 3.52Å; S117-S184 WeakPolarHBondContact O-CA 3.42Å; S117-S184 WeakPolarHBondContact O-CB 3.15Å; T180-S184 VanDerWaalsContact O-CB 3.27Å; T180-S184 WeakPolarHBondContact O-CB 3.41Å; T180-S184 PolarHBondContact O-N 3.15Å; V181-S184 WeakPolarHBondContact CA-OG 3.26Å; V181-S184 PolarHBondContact O-N 2.77Å; V181-S184 VanDerWaalsContact O-N 3.17Å; V181-S184 PolarHBondContact O-OG 3.44Å; S184-P202 WeakPolarHBondContact O-CD 3.26Å
185	K	81.4	Confident	72.3	Confident	83 Å²	83	41.3 Å²	41.3	36%	0.361	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	145.8	161.8	-39.2	173.3	-163.3	155.3	0	108.3	I116 S117 D199 I200 V201	I116-K185 CarbonylContact C-O 3.54Å; I116-K185 WeakPolarHBondContact CA-O 3.5Å; S117-K185 PolarHBondContact N-O 3.09Å; S117-K185 PolarHBondContact O-N 2.85Å; K185-D199 HydrophobicContact CB-CB 3.89Å; K185-D199 HydrophobicContact CD-CB 3.42Å; K185-D199 VanDerWaalsContact CD-CB 3.42Å; K185-D199 WeakPolarHBondContact CD-OD2 3.35Å; K185-D199 HydrophobicContact CG-CB 4.34Å; K185-D199 IonicContact NZ-OD2 2.69Å; K185-D199 PolarHBondContact NZ-OD2 2.79Å; K185-I200 CarbonylContact C-O 3.56Å; K185-I200 WeakPolarHBondContact CA-O 3.46Å; K185-V201 HydrophobicContact CG-CG2 4.44Å
186	M	82.4	Confident	71.1	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	138.4	174.5	-170.9	164.9	49	0	0	110.7	I114 I116 I200 I245 I253 F256	I114-M186 HydrophobicContact CG2-CG 3.97Å; I114-M186 HydrophobicContact CG2-SD 3.4Å; I114-M186 WeakPolarHBondContact CG2-SD 3.3Å; I116-M186 HydrophobicContact CG2-CB 4.15Å; I116-M186 HydrophobicContact CG2-CG 4.22Å; M186-I200 PolarHBondContact N-O 2.76Å; M186-I200 WeakPolarHBondContact O-CB 3.46Å; M186-I200 PolarHBondContact O-N 2.83Å; M186-I245 HydrophobicContact CE-CB 4.45Å; M186-I245 HydrophobicContact CE-CD1 4.08Å; M186-I245 HydrophobicContact CE-CG1 3.95Å; M186-I245 HydrophobicContact CE-CG2 3.82Å; M186-I245 HydrophobicContact SD-CD1 4.06Å; M186-I253 HydrophobicContact CE-CD1 3.83Å; M186-I253 HydrophobicContact CE-CG2 3.94Å; M186-I253 HydrophobicContact CG-CD1 4.01Å; M186-I253 HydrophobicContact SD-CD1 3.71Å; M186-F256 HydrophobicContact CB-CD1 3.86Å; M186-F256 HydrophobicContact CB-CE1 4.16Å; M186-F256 HydrophobicContact CE-CB 3.67Å; M186-F256 HydrophobicContact CE-CD1 3.67Å; M186-F256 HydrophobicContact CE-CD2 3.79Å; M186-F256 HydrophobicContact CE-CE1 4.17Å; M186-F256 HydrophobicContact CE-CE2 4.27Å; M186-F256 HydrophobicContact CE-CG 3.46Å; M186-F256 VanDerWaalsContact CE-CG 3.46Å; M186-F256 HydrophobicContact CE-CZ 4.43Å
187	L	77.5	Confident	70.3	Confident	3 Å²	3	49.1 Å²	49.1	2%	0.016	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	133.4	-179.5	-52	177	0	0	0	110.3	Y108 H115 V123 N189 L192	Y108-L187 WeakPolarHBondContact CE2-O 2.93Å; H115-L187 HydrophobicContact CB-CD1 3.93Å; V123-L187 HydrophobicContact CG1-CD1 4.39Å; L187-N189 VanDerWaalsContact C-N 3.26Å; L187-N189 WeakPolarHBondContact CB-O 3.42Å; L187-N189 PolarHBondContact O-N 2.81Å; L187-L192 HydrophobicContact CD1-CD2 4.43Å
188	K	76.4	Confident	70.1	Confident	66 Å²	66	53.6 Å²	53.6	29%	0.287	28%	0.283	S	S	.	.	S	Bend	trans	-63.7	-31.8	177.9	-169.2	-172.1	-172.5	-176.2	0	113	E198 I200 T252 I253	K188-E198 HydrophobicContact CB-CB 3.96Å; K188-E198 WeakPolarHBondContact CB-O 3.31Å; K188-E198 HydrophobicContact CD-CB 3.78Å; K188-E198 WeakPolarHBondContact CD-OE2 3.41Å; K188-E198 WeakPolarHBondContact CE-OE2 3.49Å; K188-E198 PolarHBondContact N-O 2.82Å; K188-E198 IonicContact NZ-OE2 3.74Å; K188-E198 PolarHBondContact NZ-OE2 2.82Å; K188-I200 HydrophobicContact CB-CD1 4.21Å; K188-I200 HydrophobicContact CB-CG1 4.25Å; K188-I200 HydrophobicContact CG-CD1 4.26Å; K188-T252 WeakPolarHBondContact O-CA 3.4Å; K188-I253 VanDerWaalsContact CG-O 3.25Å; K188-I253 WeakPolarHBondContact CG-O 3.17Å; K188-I253 PolarHBondContact O-N 2.84Å
189	N	71.1	Confident	70	Confident	24 Å²	24	55.8 Å²	55.8	13%	0.128	30%	0.295	C	S	.	.	S	Bend	trans	-145.9	174.7	174.8	57.7	34	0	0	0	109.1	L187 K191	L187-N189 VanDerWaalsContact C-N 3.26Å; L187-N189 WeakPolarHBondContact CB-O 3.42Å; L187-N189 PolarHBondContact O-N 2.81Å; N189-K191 PolarHBondContact O-N 3.1Å; N189-K191 WeakPolarHBondContact OD1-CB 3.37Å
190	M	61.6	Low	70.2	Confident	22 Å²	22	56 Å²	56	11%	0.108	30%	0.296	C	S	.	.	B	Isolated β-bridge	trans	-81.5	67.4	-176.1	-169.8	177.4	178.1	0	0	111.5	Y101 V106 Y108 V112 L192	Y101-M190 HydrophobicContact CE1-CE 4.33Å; Y101-M190 WeakPolarHBondContact OH-CE 3.43Å; V106-M190 HydrophobicContact CB-CB 4.14Å; V106-M190 HydrophobicContact CG1-CB 4.28Å; V106-M190 HydrophobicContact CG1-SD 4.38Å; V106-M190 WeakPolarHBondContact O-CA 3.48Å; V106-M190 WeakPolarHBondContact O-CB 3.38Å; V106-M190 PolarHBondContact O-N 3.48Å; Y108-M190 HydrophobicContact CE1-CB 4.39Å; V112-M190 HydrophobicContact CG1-CE 4.5Å; V112-M190 HydrophobicContact CG1-SD 3.89Å; M190-L192 HydrophobicContact CE-CD1 4.27Å
191	K	63.2	Low	70.6	Confident	39 Å²	39	57.7 Å²	57.7	17%	0.17	31%	0.306	C	S	.	.			trans	-108.7	90.1	175.9	-175.4	150.7	-174.6	141.8	0	111.9	D103 N189 N193	D103-K191 PolarHBondContact O-NZ 3.09Å; D103-K191 VanDerWaalsContact OD1-CE 3.25Å; D103-K191 WeakPolarHBondContact OD1-CE 3.28Å; D103-K191 IonicContact OD1-NZ 2.63Å; D103-K191 PolarHBondContact OD1-NZ 3.36Å; N189-K191 PolarHBondContact O-N 3.1Å; N189-K191 WeakPolarHBondContact OD1-CB 3.37Å; K191-N193 WeakPolarHBondContact CE-O 3.38Å; K191-N193 WeakPolarHBondContact CG-O 3.4Å
192	L	57.6	Low	71	Confident	45 Å²	45	57.9 Å²	57.9	24%	0.236	31%	0.307	C	S	.	.			trans	-76.5	-36.4	-177.9	-67.8	170.3	0	0	0	113	V123 L187 M190 R197	V123-L192 HydrophobicContact CG1-CD2 4.05Å; L187-L192 HydrophobicContact CD1-CD2 4.43Å; M190-L192 HydrophobicContact CE-CD1 4.27Å; L192-R197 PolarHBondContact O-NE 2.89Å; L192-R197 PolarHBondContact O-NH2 2.88Å
193	N	54	Low	71.4	Confident	93 Å²	93	59.5 Å²	59.5	50%	0.497	32%	0.32	S	S	.	.	S	Bend	trans	-107.4	158.6	177.9	-68.3	-18.5	0	0	0	111.3	K191	K191-N193 WeakPolarHBondContact CE-O 3.38Å; K191-N193 WeakPolarHBondContact CG-O 3.4Å
194	G	50.7	Low	71.8	Confident	36 Å²	36	56.1 Å²	56.1	37%	0.371	30%	0.303	S	S	.	.	S	Bend	trans	106.5	155.5	168.3	0	0	0	0	0	115.7
195	V	51.5	Low	72	Confident	147 Å²	147	58.8 Å²	58.8	89%	0.891	32%	0.317	S	S	*	.	S	Bend	trans	-74.4	-32.9	-172.3	-179.7	0	0	0	0	112.6	R197	V195-R197 PolarHBondContact O-N 3.01Å
196	N	52.8	Low	72.4	Confident	137 Å²	137	54.9 Å²	54.9	73%	0.733	30%	0.3	S	S	*	.			trans	-91.9	77.3	174.9	-70.5	3.1	0	0	0	110.2
197	R	62.8	Low	72.3	Confident	65 Å²	65	57.9 Å²	57.9	25%	0.245	31%	0.312	C	S	.	.			trans	-86.1	124	160.2	-69.5	-177.8	-177.5	153.9	0.9	108.5	L192 V195 D199	L192-R197 PolarHBondContact O-NE 2.89Å; L192-R197 PolarHBondContact O-NH2 2.88Å; V195-R197 PolarHBondContact O-N 3.01Å; R197-D199 PolarHBondContact O-N 2.91Å
198	E	72.6	Confident	72.5	Confident	114 Å²	114	61.4 Å²	61.4	53%	0.533	33%	0.328	S	S	.	.			trans	-87.7	103.1	166.5	-73.3	-172.2	-143.3	0	0	108.7	K188	K188-E198 HydrophobicContact CB-CB 3.96Å; K188-E198 WeakPolarHBondContact CB-O 3.31Å; K188-E198 HydrophobicContact CD-CB 3.78Å; K188-E198 WeakPolarHBondContact CD-OE2 3.41Å; K188-E198 WeakPolarHBondContact CE-OE2 3.49Å; K188-E198 PolarHBondContact N-O 2.82Å; K188-E198 IonicContact NZ-OE2 3.74Å; K188-E198 PolarHBondContact NZ-OE2 2.82Å
199	D	79.4	Confident	72.6	Confident	52 Å²	52	61.2 Å²	61.2	28%	0.278	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	139.6	-178.7	-64.4	-29.2	0	0	0	111.6	K185 R197	K185-D199 HydrophobicContact CB-CB 3.89Å; K185-D199 HydrophobicContact CD-CB 3.42Å; K185-D199 VanDerWaalsContact CD-CB 3.42Å; K185-D199 WeakPolarHBondContact CD-OD2 3.35Å; K185-D199 HydrophobicContact CG-CB 4.34Å; K185-D199 IonicContact NZ-OD2 2.69Å; K185-D199 PolarHBondContact NZ-OD2 2.79Å; R197-D199 PolarHBondContact O-N 2.91Å
200	I	82	Confident	72.9	Confident	25 Å²	25	67.8 Å²	67.8	13%	0.128	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	114.3	173.3	-55.6	175.1	0	0	0	108.9	K185 M186 K188 I253 F256	K185-I200 CarbonylContact C-O 3.56Å; K185-I200 WeakPolarHBondContact CA-O 3.46Å; M186-I200 PolarHBondContact N-O 2.76Å; M186-I200 WeakPolarHBondContact O-CB 3.46Å; M186-I200 PolarHBondContact O-N 2.83Å; K188-I200 HydrophobicContact CB-CD1 4.21Å; K188-I200 HydrophobicContact CB-CG1 4.25Å; K188-I200 HydrophobicContact CG-CD1 4.26Å; I200-I253 HydrophobicContact CD1-CB 3.72Å; I200-I253 HydrophobicContact CD1-CG2 3.6Å; I200-I253 WeakPolarHBondContact CD1-O 3.43Å; I200-F256 HydrophobicContact CG2-CB 3.96Å
201	V	84	Confident	73.5	Confident	106 Å²	106	70.1 Å²	70.1	64%	0.642	37%	0.368	S	S	*	.			trans	-74.3	130.5	170.9	-178.4	0	0	0	0	108.8	K185	K185-V201 HydrophobicContact CG-CG2 4.44Å
202	P	88.5	Confident	73.8	Confident	10 Å²	10	72.9 Å²	72.9	7%	0.065	38%	0.384	C	S	.	.			trans	-65.8	135.7	176.4	25.5	-33.3	0	0	0	112.2	S184 V204 F256 I258	S184-P202 WeakPolarHBondContact O-CD 3.26Å; P202-V204 HydrophobicContact CB-CG2 3.88Å; P202-V204 HydrophobicContact CG-CG2 4.07Å; P202-V204 PolarHBondContact O-N 2.66Å; P202-F256 HydrophobicContact CB-CD1 3.61Å; P202-F256 HydrophobicContact CB-CE1 3.99Å; P202-F256 HydrophobicContact CB-CG 4.11Å; P202-F256 HydrophobicContact CG-CD1 4.36Å; P202-I258 HydrophobicContact CB-CD1 3.53Å; P202-I258 HydrophobicContact CB-CG1 3.83Å; P202-I258 HydrophobicContact CG-CD1 4.12Å
203	V	87.4	Confident	74.7	Confident	71 Å²	71	75.9 Å²	75.9	43%	0.43	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	108.5	165.1	-179.9	0	0	0	0	107.6	F256 E257 I258	V203-F256 PolarHBondContact N-O 2.93Å; V203-E257 HydrophobicContact CB-CG 4.3Å; V203-E257 CarbonylContact O-C 3.53Å; V203-E257 WeakPolarHBondContact O-CA 3.09Å; V203-I258 PolarHBondContact O-N 3.28Å
204	V	89.9	Confident	76	Confident	38 Å²	38	76 Å²	76	23%	0.23	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	124.5	-173.4	-167.8	0	0	0	0	111.3	F178 K182 P202 I258	F178-V204 HydrophobicContact CE2-CG1 3.95Å; F178-V204 HydrophobicContact CZ-CG1 4Å; K182-V204 HydrophobicContact CB-CG2 4.44Å; K182-V204 HydrophobicContact CG-CB 4.45Å; K182-V204 HydrophobicContact CG-CG1 4.16Å; K182-V204 HydrophobicContact CG-CG2 4.06Å; P202-V204 HydrophobicContact CB-CG2 3.88Å; P202-V204 HydrophobicContact CG-CG2 4.07Å; P202-V204 PolarHBondContact O-N 2.66Å; V204-I258 WeakPolarHBondContact CA-O 2.94Å; V204-I258 HydrophobicContact CB-CB 4.42Å; V204-I258 HydrophobicContact CG1-CB 4.1Å; V204-I258 HydrophobicContact CG1-CG2 4.24Å; V204-I258 HydrophobicContact CG2-CB 4.11Å; V204-I258 HydrophobicContact CG2-CD1 4Å; V204-I258 HydrophobicContact CG2-CG1 4.23Å
205	I	85.5	Confident	77.8	Confident	58 Å²	58	77.6 Å²	77.6	30%	0.297	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	136.1	-180	-60	173.2	0	0	0	108.1	Y207 I258 Y259 A260	I205-Y207 HydrophobicContact CG2-CD2 4.44Å; I205-Y207 HydrophobicContact CG2-CE1 4.35Å; I205-Y207 HydrophobicContact CG2-CE2 3.72Å; I205-I258 PolarHBondContact N-O 3.49Å; I205-Y259 HydrophobicContact CB-CD1 4.1Å; I205-Y259 HydrophobicContact CD1-CD1 4.31Å; I205-Y259 HydrophobicContact CD1-CE1 3.9Å; I205-Y259 VanDerWaalsContact O-CA 3.3Å; I205-Y259 WeakPolarHBondContact O-CA 3.18Å; I205-A260 PolarHBondContact O-N 2.82Å
206	C	88.8	Confident	79.7	Confident	1 Å²	1	78.4 Å²	78.4	1%	0.007	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	148.3	177.5	-64.4	0	0	0	0	110.8	P214 I215 C217 A260 I262	C206-P214 CarbonylContact O-C 3.5Å; C206-P214 WeakPolarHBondContact O-CA 3.29Å; C206-I215 HydrophobicContact CB-CG1 3.9Å; C206-I215 PolarHBondContact O-N 3.06Å; C206-C217 HydrophobicContact CB-CB 3.99Å; C206-C217 WeakPolarHBondContact CB-SG 3.38Å; C206-C217 PolarHBondContact N-SG 3.23Å; C206-C217 VanDerWaalsContact N-SG 3.41Å; C206-C217 WeakPolarHBondContact SG-CA 3.24Å; C206-C217 WeakPolarHBondContact SG-CB 3.41Å; C206-C217 CovalentContact SG-SG 2.03Å; C206-C217 PolarHBondContact SG-SG 2.93Å; C206-A260 CarbonylContact C-O 3.47Å; C206-A260 WeakPolarHBondContact CA-O 3.15Å; C206-I262 HydrophobicContact CB-CG1 3.93Å
207	Y	81.3	Confident	81.5	Confident	64 Å²	64	72.5 Å²	72.5	25%	0.251	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	152.7	175.4	-51.5	-96.7	0	0	0	110	I205 N212 L213 P214 Y259 A260 L261 I262	I205-Y207 HydrophobicContact CG2-CD2 4.44Å; I205-Y207 HydrophobicContact CG2-CE1 4.35Å; I205-Y207 HydrophobicContact CG2-CE2 3.72Å; Y207-N212 WeakPolarHBondContact CD1-O 3.4Å; Y207-L213 CarbonylContact C-O 3.59Å; Y207-L213 WeakPolarHBondContact CA-O 3.41Å; Y207-P214 HydrophobicContact CD1-CB 4.39Å; Y207-P214 HydrophobicContact CD1-CG 4.07Å; Y207-P214 HydrophobicContact CE1-CB 4.48Å; Y207-P214 HydrophobicContact CE1-CG 3.94Å; Y207-Y259 HydrophobicContact CE2-CD1 4.15Å; Y207-A260 PolarHBondContact N-O 3.09Å; Y207-L261 HydrophobicContact CD2-CD2 4.31Å; Y207-L261 HydrophobicContact CG-CD2 4.45Å; Y207-I262 PolarHBondContact O-N 2.82Å
208	E	82.3	Confident	82.6	Confident	77 Å²	77	70.3 Å²	70.3	36%	0.36	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	132.4	171.1	-176	-171.7	-115.8	0	0	111.1	Y210 T211 N212 L213 I215	E208-Y210 PolarHBondContact O-N 2.89Å; E208-Y210 VanDerWaalsContact O-N 3.13Å; E208-T211 PolarHBondContact O-N 2.86Å; E208-T211 WeakPolarHBondContact OE2-CB 3.12Å; E208-T211 WeakPolarHBondContact OE2-CG2 3.29Å; E208-T211 PolarHBondContact OE2-OG1 2.85Å; E208-N212 VanDerWaalsContact O-CA 3.3Å; E208-N212 WeakPolarHBondContact O-CA 3.48Å; E208-N212 PolarHBondContact O-N 3.15Å; E208-L213 PolarHBondContact N-O 2.96Å; E208-I215 HydrophobicContact CB-CG2 4.07Å
209	Q	78.8	Confident	82.9	Confident	62 Å²	62	70.3 Å²	70.3	29%	0.29	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-34.8	-177.5	-178.5	-177.2	1.1	0	0	114.7	I262	Q209-I262 WeakPolarHBondContact CB-O 3.17Å; Q209-I262 PolarHBondContact N-O 3.24Å
210	Y	77	Confident	82.9	Confident	161 Å²	161	72.3 Å²	72.3	63%	0.631	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-34.4	-171.5	-63.5	-70.7	0	0	0	113.9	E208	E208-Y210 PolarHBondContact O-N 2.89Å; E208-Y210 VanDerWaalsContact O-N 3.13Å
211	T	73.7	Confident	82.9	Confident	71 Å²	71	73.6 Å²	73.6	44%	0.436	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-16.3	-177.4	59.4	0	0	0	0	113.5	E208 L213	E208-T211 PolarHBondContact O-N 2.86Å; E208-T211 WeakPolarHBondContact OE2-CB 3.12Å; E208-T211 WeakPolarHBondContact OE2-CG2 3.29Å; E208-T211 PolarHBondContact OE2-OG1 2.85Å; T211-L213 HydrophobicContact CG2-CD1 4.4Å; T211-L213 PolarHBondContact O-N 2.73Å; T211-L213 PolarHBondContact OG1-N 2.81Å
212	N	69.1	Low	83	Confident	97 Å²	97	68.7 Å²	68.7	52%	0.519	37%	0.369	S	S	.	.			trans	52.9	23.3	-166.9	-63.6	-73	0	0	0	113.8	Y207 E208	Y207-N212 WeakPolarHBondContact CD1-O 3.4Å; E208-N212 VanDerWaalsContact O-CA 3.3Å; E208-N212 WeakPolarHBondContact O-CA 3.48Å; E208-N212 PolarHBondContact O-N 3.15Å
213	L	76.1	Confident	82.8	Confident	108 Å²	108	71.2 Å²	71.2	57%	0.565	39%	0.387	S	S	*	.			trans	-80.6	143.3	173.9	-67.9	172.4	0	0	0	110.7	Y207 E208 T211	Y207-L213 CarbonylContact C-O 3.59Å; Y207-L213 WeakPolarHBondContact CA-O 3.41Å; E208-L213 PolarHBondContact N-O 2.96Å; T211-L213 HydrophobicContact CG2-CD1 4.4Å; T211-L213 PolarHBondContact O-N 2.73Å; T211-L213 PolarHBondContact OG1-N 2.81Å
214	P	81.8	Confident	82.7	Confident	95 Å²	95	70.9 Å²	70.9	62%	0.617	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62	137.2	175.4	-21.4	32.1	0	0	0	112.6	C206 Y207	C206-P214 CarbonylContact O-C 3.5Å; C206-P214 WeakPolarHBondContact O-CA 3.29Å; Y207-P214 HydrophobicContact CD1-CB 4.39Å; Y207-P214 HydrophobicContact CD1-CG 4.07Å; Y207-P214 HydrophobicContact CE1-CB 4.48Å; Y207-P214 HydrophobicContact CE1-CG 3.94Å
215	I	88.6	Confident	82.2	Confident	71 Å²	71	73.1 Å²	73.1	36%	0.364	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	165.5	178.5	64.5	170.1	0	0	0	111.5	C206 E208 C217 I262	C206-I215 HydrophobicContact CB-CG1 3.9Å; C206-I215 PolarHBondContact O-N 3.06Å; E208-I215 HydrophobicContact CB-CG2 4.07Å; I215-C217 PolarHBondContact O-N 3.04Å; I215-I262 HydrophobicContact CD1-CB 3.93Å; I215-I262 HydrophobicContact CD1-CG1 4.12Å; I215-I262 HydrophobicContact CD1-CG2 4.48Å
216	L	90.9	Very high	81.3	Confident	163 Å²	163	76.6 Å²	76.6	85%	0.853	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-69	124	169.6	-176.2	64.5	0	0	0	110.2
217	C	90.2	Very high	79.9	Confident	14 Å²	14	77.5 Å²	77.5	10%	0.095	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-63.1	132.8	179.7	-71.1	0	0	0	0	113	F178 K182 C206 I215 T219	F178-C217 HydrophobicContact CZ-CB 4.39Å; K182-C217 PolarHBondContact NZ-O 3.02Å; C206-C217 HydrophobicContact CB-CB 3.99Å; C206-C217 WeakPolarHBondContact CB-SG 3.38Å; C206-C217 PolarHBondContact N-SG 3.23Å; C206-C217 VanDerWaalsContact N-SG 3.41Å; C206-C217 WeakPolarHBondContact SG-CA 3.24Å; C206-C217 WeakPolarHBondContact SG-CB 3.41Å; C206-C217 CovalentContact SG-SG 2.03Å; C206-C217 PolarHBondContact SG-SG 2.93Å; I215-C217 PolarHBondContact O-N 3.04Å; C217-T219 PolarHBondContact O-N 3.01Å
218	P	86.4	Confident	78.9	Confident	18 Å²	18	80.8 Å²	80.8	12%	0.117	45%	0.448	C	S	.	.	P	Polyproline II helix	trans	-48.1	133.5	176.3	-29.8	35.1	0	0	0	113.4	K182 N236 I262	K182-P218 PolarHBondContact NZ-O 2.92Å; P218-N236 HydrophobicContact CB-CB 4.45Å; P218-N236 HydrophobicContact CG-CB 4.09Å; P218-I262 HydrophobicContact CG-CD1 4.24Å; P218-I262 HydrophobicContact CG-CG1 4.26Å; P218-I262 HydrophobicContact CG-CG2 3.87Å
219	T	78.9	Confident	77.8	Confident	114 Å²	114	80.5 Å²	80.5	70%	0.699	46%	0.455	S	S	*	.	S	Bend	trans	-96.3	-20.9	176	48.5	0	0	0	0	112.7	C217	C217-T219 PolarHBondContact O-N 3.01Å
220	T	79.1	Confident	77.1	Confident	94 Å²	94	84.4 Å²	84.4	58%	0.577	48%	0.477	S	S	*	.	S	Bend	trans	-109.6	166.2	179.2	51.1	0	0	0	0	111.3
221	T	82.9	Confident	76.6	Confident	53 Å²	53	82 Å²	82	33%	0.325	47%	0.472	S	S	.	.			trans	-66.5	152.2	171.7	53.3	0	0	0	0	111.8	N172 L179	N172-T221 WeakPolarHBondContact O-CB 3.39Å; L179-T221 HydrophobicContact CD1-CG2 3.91Å
222	P	86.8	Confident	76.6	Confident	3 Å²	3	80.6 Å²	80.6	2%	0.019	46%	0.464	C	S	.	.			trans	-53.4	147.8	173.3	-23.9	33	0	0	0	112.5	C171 N172 L174 S235 V237	C171-P222 WeakPolarHBondContact O-CB 3.29Å; N172-P222 VanDerWaalsContact CA-O 3.27Å; N172-P222 WeakPolarHBondContact CA-O 3.45Å; L174-P222 HydrophobicContact CB-CG 4.43Å; P222-S235 VanDerWaalsContact CA-O 3.25Å; P222-S235 WeakPolarHBondContact CA-O 3.38Å; P222-S235 VanDerWaalsContact CB-O 3.28Å; P222-S235 WeakPolarHBondContact CB-O 3.24Å; P222-V237 HydrophobicContact CB-CG2 3.88Å; P222-V237 HydrophobicContact CG-CG2 4.22Å
223	S	84.4	Confident	77.4	Confident	62 Å²	62	78.1 Å²	78.1	43%	0.434	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	150.4	-174.9	58.8	0	0	0	0	112.2	C171 S235	C171-S223 PolarHBondContact SG-O 3.02Å; S223-S235 PolarHBondContact N-O 2.95Å; S223-S235 PolarHBondContact O-N 2.96Å
224	I	83.5	Confident	78.1	Confident	65 Å²	65	73 Å²	73	33%	0.333	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	128.6	178.3	-58.3	178.3	0	0	0	108.9	E157 C171 I233	E157-I224 HydrophobicContact CG-CD1 4.23Å; C171-I224 HydrophobicContact CB-CD1 4.18Å; C171-I224 HydrophobicContact CB-CG1 3.6Å; I224-I233 CarbonylContact C-O 3.38Å; I224-I233 WeakPolarHBondContact CA-O 3.21Å
225	I	79.8	Confident	78.5	Confident	84 Å²	84	69 Å²	69	43%	0.431	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	119.1	165.8	-58.5	-178.3	0	0	0	106.8	S227 I233 S235	I225-S227 PolarHBondContact O-N 3.31Å; I225-I233 PolarHBondContact N-O 2.75Å; I225-I233 PolarHBondContact O-N 2.93Å; I225-S235 VanDerWaalsContact CD1-CB 3.48Å
226	I	67.7	Low	78.5	Confident	131 Å²	131	69 Å²	69	67%	0.672	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	118.1	174.9	-55.2	177.4	0	0	0	107.7
227	S	59.3	Low	78.5	Confident	20 Å²	20	61.2 Å²	61.2	14%	0.14	36%	0.357	C	S	.	.			trans	-83.4	161	175.2	66.9	0	0	0	0	111.8	I225 S229 N230 E231	I225-S227 PolarHBondContact O-N 3.31Å; S227-S229 PolarHBondContact O-N 3.25Å; S227-S229 PolarHBondContact OG-OG 3.28Å; S227-S229 VanDerWaalsContact OG-OG 3.08Å; S227-N230 PolarHBondContact O-N 3.08Å; S227-N230 VanDerWaalsContact O-N 3.14Å; S227-E231 WeakPolarHBondContact CB-O 3.41Å; S227-E231 PolarHBondContact N-O 3.29Å; S227-E231 WeakPolarHBondContact OG-CA 2.99Å; S227-E231 WeakPolarHBondContact OG-CB 3.3Å; S227-E231 PolarHBondContact OG-N 2.86Å; S227-E231 PolarHBondContact OG-O 2.74Å
228	S	60.2	Low	78.4	Confident	133 Å²	133	60.6 Å²	60.6	93%	0.93	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-11.8	176.7	49.5	0	0	0	0	114.4
229	S	59.6	Low	78.5	Confident	72 Å²	72	60.7 Å²	60.7	50%	0.503	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	4.8	173.7	50.6	0	0	0	0	113.8	S227 E231	S227-S229 PolarHBondContact O-N 3.25Å; S227-S229 PolarHBondContact OG-OG 3.28Å; S227-S229 VanDerWaalsContact OG-OG 3.08Å; S229-E231 PolarHBondContact O-N 3.46Å
230	N	62.8	Low	78.8	Confident	143 Å²	143	56.2 Å²	56.2	77%	0.765	33%	0.327	S	S	*	.	S	Bend	trans	60.9	15.9	-167.6	-62.2	-31.1	0	0	0	114.5	S227	S227-N230 PolarHBondContact O-N 3.08Å; S227-N230 VanDerWaalsContact O-N 3.14Å
231	E	67.3	Low	79.2	Confident	110 Å²	110	51.9 Å²	51.9	51%	0.514	30%	0.3	S	S	.	.			trans	-78.8	133.5	169.9	-69	179.3	-157.6	0	0	110.7	S227 S229 I233	S227-E231 WeakPolarHBondContact CB-O 3.41Å; S227-E231 PolarHBondContact N-O 3.29Å; S227-E231 WeakPolarHBondContact OG-CA 2.99Å; S227-E231 WeakPolarHBondContact OG-CB 3.3Å; S227-E231 PolarHBondContact OG-N 2.86Å; S227-E231 PolarHBondContact OG-O 2.74Å; S229-E231 PolarHBondContact O-N 3.46Å; E231-I233 PolarHBondContact O-N 2.91Å
232	T	73.5	Confident	79.3	Confident	43 Å²	43	52.2 Å²	52.2	26%	0.264	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	95.7	179	42.4	0	0	0	0	110.7	E157	E157-T232 HydrophobicContact CG-CG2 3.98Å; E157-T232 WeakPolarHBondContact OE1-CG2 3.42Å
233	I	86.4	Confident	79.4	Confident	45 Å²	45	52.2 Å²	52.2	23%	0.231	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	120.9	176.1	-48.5	-175.8	0	0	0	108.8	I224 I225 E231 N264 T266	I224-I233 CarbonylContact C-O 3.38Å; I224-I233 WeakPolarHBondContact CA-O 3.21Å; I225-I233 PolarHBondContact N-O 2.75Å; I225-I233 PolarHBondContact O-N 2.93Å; E231-I233 PolarHBondContact O-N 2.91Å; I233-N264 HydrophobicContact CG2-CB 3.93Å; I233-T266 HydrophobicContact CB-CG2 4.17Å; I233-T266 HydrophobicContact CG1-CG2 3.7Å; I233-T266 HydrophobicContact CG2-CG2 4.35Å
234	C	89.4	Confident	79.3	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	121.9	167	-173.8	0	0	0	0	109.7	V155 C171 V237 N264 V265	V155-C234 HydrophobicContact CG1-CB 4.1Å; C171-C234 WeakPolarHBondContact CA-SG 3.14Å; C171-C234 HydrophobicContact CB-CB 3.78Å; C171-C234 WeakPolarHBondContact CB-SG 3.44Å; C171-C234 VanDerWaalsContact SG-CA 3.52Å; C171-C234 WeakPolarHBondContact SG-CB 3.45Å; C171-C234 CovalentContact SG-SG 2.02Å; C171-C234 PolarHBondContact SG-SG 2.84Å; C234-V237 HydrophobicContact CB-CG2 3.99Å; C234-V237 WeakPolarHBondContact SG-CG2 3.13Å; C234-N264 WeakPolarHBondContact O-CA 3.49Å; C234-V265 HydrophobicContact CB-CG2 3.96Å; C234-V265 PolarHBondContact N-O 3.46Å; C234-V265 PolarHBondContact O-N 3.12Å
235	S	90.7	Very high	79.3	Confident	12 Å²	12	48.4 Å²	48.4	8%	0.084	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	152.6	-171.7	-178.4	0	0	0	0	112.4	P222 S223 I225 V237 N264	P222-S235 VanDerWaalsContact CA-O 3.25Å; P222-S235 WeakPolarHBondContact CA-O 3.38Å; P222-S235 VanDerWaalsContact CB-O 3.28Å; P222-S235 WeakPolarHBondContact CB-O 3.24Å; S223-S235 PolarHBondContact N-O 2.95Å; S223-S235 PolarHBondContact O-N 2.96Å; I225-S235 VanDerWaalsContact CD1-CB 3.48Å; S235-V237 VanDerWaalsContact C-N 3.29Å; S235-V237 PolarHBondContact O-N 3.42Å; S235-N264 WeakPolarHBondContact CA-OD1 3.13Å; S235-N264 PolarHBondContact OG-OD1 2.99Å
236	N	89.1	Confident	79.4	Confident	69 Å²	69	45.2 Å²	45.2	37%	0.369	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	60	31.6	-173.9	-63.1	-46.9	0	0	0	114.1	P218 I262 G263 N264	P218-N236 HydrophobicContact CB-CB 4.45Å; P218-N236 HydrophobicContact CG-CB 4.09Å; N236-I262 HydrophobicContact CB-CG2 4.37Å; N236-G263 PolarHBondContact N-O 3.29Å; N236-N264 PolarHBondContact N-OD1 3.26Å
237	V	90.6	Very high	79.6	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	131.2	176.7	173.2	0	0	0	0	110.2	L174 P222 C234 S235 V239 I262 G263 V265 F269	L174-V237 HydrophobicContact CB-CG1 4.17Å; L174-V237 HydrophobicContact CB-CG2 4.34Å; L174-V237 HydrophobicContact CD1-CG1 4.15Å; L174-V237 HydrophobicContact CD1-CG2 3.84Å; P222-V237 HydrophobicContact CB-CG2 3.88Å; P222-V237 HydrophobicContact CG-CG2 4.22Å; C234-V237 HydrophobicContact CB-CG2 3.99Å; C234-V237 WeakPolarHBondContact SG-CG2 3.13Å; S235-V237 VanDerWaalsContact C-N 3.29Å; S235-V237 PolarHBondContact O-N 3.42Å; V237-V239 HydrophobicContact CB-CG2 4.45Å; V237-V239 HydrophobicContact CG1-CG2 4.21Å; V237-V239 PolarHBondContact O-N 3.13Å; V237-I262 WeakPolarHBondContact O-CA 3.43Å; V237-G263 PolarHBondContact N-O 2.68Å; V237-G263 PolarHBondContact O-N 2.88Å; V237-V265 HydrophobicContact CB-CG2 4.15Å; V237-V265 HydrophobicContact CG1-CG2 4.22Å; V237-V265 HydrophobicContact CG2-CG2 3.78Å; V237-F269 HydrophobicContact CG1-CE2 4.13Å; V237-F269 HydrophobicContact CG1-CZ 3.91Å
238	P	88.7	Confident	79.9	Confident	2 Å²	2	43.2 Å²	43.2	1%	0.013	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	90	167.7	30.6	-31.6	0	0	0	109.1	F178 S240 V241 L261 I262 Q271	F178-P238 HydrophobicContact CB-CB 4.08Å; F178-P238 HydrophobicContact CB-CG 3.79Å; F178-P238 HydrophobicContact CD1-CB 4.34Å; F178-P238 HydrophobicContact CD1-CG 4.38Å; F178-P238 HydrophobicContact CG-CB 4.11Å; F178-P238 HydrophobicContact CG-CG 4.24Å; P238-S240 VanDerWaalsContact C-N 3.35Å; P238-V241 HydrophobicContact CB-CG2 3.78Å; P238-L261 CarbonylContact C-O 3.41Å; P238-I262 HydrophobicContact CB-CD1 3.95Å; P238-Q271 PolarHBondContact O-NE2 2.81Å
239	V	87.3	Confident	79.8	Confident	19 Å²	19	42.3 Å²	42.3	12%	0.115	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	-34.5	-175.4	-173.5	0	0	0	0	111.4	V237 L261 V265 F269 Q271 K272	V237-V239 HydrophobicContact CB-CG2 4.45Å; V237-V239 HydrophobicContact CG1-CG2 4.21Å; V237-V239 PolarHBondContact O-N 3.13Å; V239-L261 PolarHBondContact N-O 2.98Å; V239-V265 HydrophobicContact CG2-CG1 3.87Å; V239-F269 HydrophobicContact CG1-CD2 4.39Å; V239-Q271 WeakPolarHBondContact O-CA 3.42Å; V239-K272 PolarHBondContact O-N 3.38Å
240	S	86.2	Confident	79.8	Confident	21 Å²	21	44 Å²	44	15%	0.147	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	134	171.3	-176.4	0	0	0	0	110.1	P238 A260 L261 K272	P238-S240 VanDerWaalsContact C-N 3.35Å; S240-A260 CarbonylContact O-C 3.49Å; S240-A260 VanDerWaalsContact O-CA 3.32Å; S240-A260 WeakPolarHBondContact O-CA 3.43Å; S240-L261 PolarHBondContact N-O 2.7Å; S240-L261 PolarHBondContact O-N 2.68Å; S240-K272 CarbonylContact C-O 3.57Å; S240-K272 VanDerWaalsContact CA-O 3.29Å; S240-K272 WeakPolarHBondContact CA-O 3.07Å
241	V	86.1	Confident	79.7	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.012	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	116.6	175	-175	0	0	0	0	109.7	F178 P238 L243 I258 A260 K272 Y273 E274	F178-V241 HydrophobicContact CB-CG2 4.3Å; F178-V241 HydrophobicContact CD2-CG1 4.23Å; F178-V241 HydrophobicContact CD2-CG2 4.28Å; P238-V241 HydrophobicContact CB-CG2 3.78Å; V241-L243 HydrophobicContact CG1-CD2 4.27Å; V241-L243 HydrophobicContact CG1-CG 4.17Å; V241-I258 HydrophobicContact CG1-CG2 4.12Å; V241-A260 HydrophobicContact CG2-CB 4.47Å; V241-K272 PolarHBondContact N-O 2.82Å; V241-Y273 HydrophobicContact CB-CD1 3.76Å; V241-Y273 HydrophobicContact CB-CE1 3.81Å; V241-Y273 HydrophobicContact CG1-CD1 4.36Å; V241-Y273 HydrophobicContact CG1-CE1 4.37Å; V241-Y273 HydrophobicContact CG2-CD1 4.3Å; V241-Y273 HydrophobicContact CG2-CE1 3.85Å; V241-Y273 CarbonylContact O-C 3.57Å; V241-Y273 WeakPolarHBondContact O-CA 3Å; V241-E274 PolarHBondContact O-N 3.39Å
242	Y	86.2	Confident	79.9	Confident	60 Å²	60	32.7 Å²	32.7	24%	0.235	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	126.3	176	167.4	-127.8	0	0	0	109.7	K244 I258 Y259 E274 E276	Y242-K244 HydrophobicContact CE1-CB 4.22Å; Y242-K244 HydrophobicContact CE2-CB 4.32Å; Y242-I258 WeakPolarHBondContact O-CA 3.42Å; Y242-Y259 AromaticContact CD1-CD2 3.28Å; Y242-Y259 HydrophobicContact CD1-CD2 3.28Å; Y242-Y259 AromaticContact CD1-CE2 3.97Å; Y242-Y259 HydrophobicContact CD1-CE2 3.97Å; Y242-Y259 AromaticContact CD1-CG 3.93Å; Y242-Y259 HydrophobicContact CD1-CG 3.93Å; Y242-Y259 AromaticContact CE1-CD2 3.6Å; Y242-Y259 HydrophobicContact CE1-CD2 3.6Å; Y242-Y259 AromaticContact CE1-CE2 3.77Å; Y242-Y259 HydrophobicContact CE1-CE2 3.77Å; Y242-Y259 HydrophobicContact CE1-CG 4.47Å; Y242-Y259 HydrophobicContact CG-CD2 4.26Å; Y242-Y259 PolarHBondContact N-O 3.43Å; Y242-Y259 PolarHBondContact O-N 2.96Å; Y242-E274 CarbonylContact C-O 3.49Å; Y242-E274 WeakPolarHBondContact CA-O 3.1Å; Y242-E274 HydrophobicContact CD2-CB 4.13Å; Y242-E274 HydrophobicContact CD2-CG 3.91Å; Y242-E274 HydrophobicContact CE2-CG 4.48Å; Y242-E276 HydrophobicContact CE2-CB 3.82Å; Y242-E276 WeakPolarHBondContact CE2-OE2 2.95Å; Y242-E276 PolarHBondContact OH-OE2 2.87Å
243	L	87.7	Confident	80.4	Confident	3 Å²	3	30.7 Å²	30.7	2%	0.016	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	104.6	-173.1	-66.6	165.6	0	0	0	108.5	I128 V181 V241 F256 I258 E274 V275 E276	I128-L243 HydrophobicContact CD1-CD1 3.43Å; I128-L243 VanDerWaalsContact CD1-CD1 3.43Å; I128-L243 HydrophobicContact CG1-CD1 4.39Å; V181-L243 HydrophobicContact CG1-CD2 4.11Å; V241-L243 HydrophobicContact CG1-CD2 4.27Å; V241-L243 HydrophobicContact CG1-CG 4.17Å; L243-F256 HydrophobicContact CB-CE2 4.4Å; L243-F256 HydrophobicContact CD2-CE2 3.9Å; L243-F256 HydrophobicContact CD2-CZ 4.03Å; L243-I258 HydrophobicContact CD2-CB 4.16Å; L243-I258 HydrophobicContact CD2-CD1 3.92Å; L243-I258 HydrophobicContact CD2-CG1 3.7Å; L243-I258 HydrophobicContact CD2-CG2 3.77Å; L243-E274 PolarHBondContact N-O 2.95Å; L243-V275 HydrophobicContact CB-CG2 4.39Å; L243-V275 HydrophobicContact CD1-CG2 4.27Å; L243-V275 WeakPolarHBondContact O-CA 3.3Å; L243-E276 PolarHBondContact O-N 3.48Å
244	K	83.7	Confident	80.1	Confident	47 Å²	47	30.8 Å²	30.8	20%	0.204	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	120.9	-178.1	180	-175	163.3	-148.3	0	109.6	Y242 E257 Y259 E276 V278	Y242-K244 HydrophobicContact CE1-CB 4.22Å; Y242-K244 HydrophobicContact CE2-CB 4.32Å; K244-E257 HydrophobicContact CB-CB 4.31Å; K244-E257 WeakPolarHBondContact CD-OE2 3.47Å; K244-E257 VanDerWaalsContact CE-OE2 3.28Å; K244-E257 WeakPolarHBondContact CE-OE2 3.43Å; K244-E257 PolarHBondContact N-O 3.26Å; K244-E257 IonicContact NZ-OE2 2.66Å; K244-E257 PolarHBondContact NZ-OE2 2.99Å; K244-E257 PolarHBondContact O-N 2.8Å; K244-Y259 HydrophobicContact CB-CE2 4.25Å; K244-Y259 HydrophobicContact CD-CE2 4.41Å; K244-E276 WeakPolarHBondContact CA-O 3.1Å; K244-V278 HydrophobicContact CG-CG2 4.1Å
245	I	83.8	Confident	80	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	103.4	-174.4	-59.5	176.2	0	0	0	108	L126 M186 I253 F256 V275 E276 F277 V278	L126-I245 HydrophobicContact CD2-CD1 4.49Å; M186-I245 HydrophobicContact CE-CB 4.45Å; M186-I245 HydrophobicContact CE-CD1 4.08Å; M186-I245 HydrophobicContact CE-CG1 3.95Å; M186-I245 HydrophobicContact CE-CG2 3.82Å; M186-I245 HydrophobicContact SD-CD1 4.06Å; I245-I253 HydrophobicContact CG2-CD1 4.13Å; I245-I253 HydrophobicContact CG2-CG1 4.38Å; I245-I253 HydrophobicContact CG2-CG2 3.78Å; I245-F256 HydrophobicContact CD1-CE2 4.41Å; I245-F256 HydrophobicContact CG1-CD2 3.9Å; I245-F256 HydrophobicContact CG1-CE2 3.99Å; I245-V275 HydrophobicContact CD1-CG1 4.38Å; I245-E276 PolarHBondContact N-O 2.77Å; I245-F277 HydrophobicContact CB-CD1 3.83Å; I245-F277 HydrophobicContact CB-CE1 3.93Å; I245-F277 HydrophobicContact CB-CG 4.46Å; I245-F277 HydrophobicContact CD1-CD1 4.45Å; I245-F277 HydrophobicContact CD1-CE1 3.76Å; I245-F277 HydrophobicContact CD1-CE2 4.41Å; I245-F277 HydrophobicContact CD1-CZ 3.74Å; I245-F277 HydrophobicContact CG1-CE1 4.43Å; I245-F277 HydrophobicContact CG2-CD1 3.71Å; I245-F277 HydrophobicContact CG2-CE1 3.65Å; I245-F277 CarbonylContact O-C 3.59Å; I245-F277 WeakPolarHBondContact O-CA 3.36Å; I245-V278 PolarHBondContact O-N 3.18Å
246	T	80.3	Confident	79.9	Confident	18 Å²	18	33.6 Å²	33.6	11%	0.11	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	124	178.9	-47.6	0	0	0	0	109.3	I253 G254 Q255 V278 T280	T246-I253 WeakPolarHBondContact O-CG2 3.29Å; T246-G254 PolarHBondContact O-N 2.79Å; T246-Q255 PolarHBondContact N-O 2.9Å; T246-Q255 PolarHBondContact O-N 2.52Å; T246-Q255 VanDerWaalsContact O-N 3.11Å; T246-V278 CarbonylContact C-O 3.53Å; T246-V278 VanDerWaalsContact CA-O 3.23Å; T246-V278 WeakPolarHBondContact CA-O 3.37Å; T246-T280 HydrophobicContact CG2-CG2 3.7Å
247	Y	73.4	Confident	79.8	Confident	30 Å²	30	31.4 Å²	31.4	12%	0.118	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	155	-172.3	76.5	-83.8	0	0	0	112.6	F143 T252 F277 V278 Q279 T280	F143-Y247 HydrophobicContact CE1-CD2 4.16Å; F143-Y247 HydrophobicContact CE1-CE2 4.32Å; F143-Y247 HydrophobicContact CE2-CD2 4.1Å; F143-Y247 HydrophobicContact CE2-CG 4.02Å; F143-Y247 AromaticContact CZ-CD2 3.4Å; F143-Y247 HydrophobicContact CZ-CD2 3.4Å; F143-Y247 AromaticContact CZ-CE2 4Å; F143-Y247 HydrophobicContact CZ-CE2 4Å; F143-Y247 AromaticContact CZ-CG 3.8Å; F143-Y247 HydrophobicContact CZ-CG 3.8Å; Y247-T252 CarbonylContact C-O 3.56Å; Y247-T252 VanDerWaalsContact CA-O 3.3Å; Y247-T252 WeakPolarHBondContact CA-O 3.5Å; Y247-T252 WeakPolarHBondContact CB-O 3.05Å; Y247-F277 HydrophobicContact CD1-CB 3.97Å; Y247-F277 HydrophobicContact CD1-CD1 4.28Å; Y247-F277 HydrophobicContact CE1-CB 3.72Å; Y247-V278 VanDerWaalsContact CD1-O 3.23Å; Y247-V278 WeakPolarHBondContact CD1-O 3.46Å; Y247-V278 PolarHBondContact N-O 2.57Å; Y247-Q279 HydrophobicContact CE1-CB 3.94Å; Y247-Q279 HydrophobicContact CE2-CB 4.21Å; Y247-Q279 HydrophobicContact CE2-CG 4.2Å; Y247-Q279 CarbonylContact O-C 3.5Å; Y247-Q279 VanDerWaalsContact O-CA 3.28Å; Y247-Q279 WeakPolarHBondContact O-CA 3.41Å; Y247-T280 PolarHBondContact O-N 3Å
248	E	65.6	Low	79.7	Confident	79 Å²	79	31.4 Å²	31.4	37%	0.369	17%	0.173	S	C	.	.			trans	-96.1	161.5	-178.8	-44.2	-175.9	107.3	0	0	112.2	I250 G251 T252 T280	E248-I250 HydrophobicContact CB-CG1 4.27Å; E248-I250 PolarHBondContact O-N 3.04Å; E248-G251 PolarHBondContact O-N 3.3Å; E248-T252 WeakPolarHBondContact CB-OG1 3.45Å; E248-T252 WeakPolarHBondContact CG-OG1 3.45Å; E248-T252 PolarHBondContact N-O 3.04Å; E248-T252 PolarHBondContact OE2-OG1 2.59Å; E248-T280 WeakPolarHBondContact CA-OG1 3.47Å; E248-T280 HydrophobicContact CG-CG2 4.18Å
249	V	56.7	Low	79.6	Confident	114 Å²	114	33.5 Å²	33.5	69%	0.691	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-29	-179.7	-175.8	0	0	0	0	113.1	Q279	V249-Q279 HydrophobicContact CG2-CG 4.3Å
250	I	59.9	Low	79.6	Confident	106 Å²	106	32.7 Å²	32.7	54%	0.544	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-7.9	-179.6	63.9	174.1	0	0	0	114.6	L107 E248 T252	L107-I250 VanDerWaalsContact CB-O 3.31Å; L107-I250 WeakPolarHBondContact CB-O 3.3Å; L107-I250 WeakPolarHBondContact CD1-O 3.38Å; L107-I250 HydrophobicContact CD2-CD1 4.48Å; L107-I250 HydrophobicContact CD2-CG1 4.42Å; E248-I250 HydrophobicContact CB-CG1 4.27Å; E248-I250 PolarHBondContact O-N 3.04Å; I250-T252 HydrophobicContact CD1-CG2 3.94Å; I250-T252 HydrophobicContact CG1-CG2 4.18Å; I250-T252 WeakPolarHBondContact CG1-OG1 3.43Å
251	G	62	Low	79.5	Confident	5 Å²	5	34.2 Å²	34.2	5%	0.052	18%	0.182	C	C	.	.	S	Bend	trans	91	14.5	-177	0	0	0	0	0	115.1	Y108 E248	Y108-G251 WeakPolarHBondContact CB-O 3.13Å; Y108-G251 PolarHBondContact N-O 2.82Å; Y108-G251 WeakPolarHBondContact O-CA 3.33Å; E248-G251 PolarHBondContact O-N 3.3Å
252	T	71.3	Confident	79.7	Confident	12 Å²	12	34.3 Å²	34.3	7%	0.074	18%	0.182	C	C	.	.			trans	-80.9	144.7	162.4	36.4	0	0	0	0	110.1	L107 K188 Y247 E248 I250	L107-T252 HydrophobicContact CD2-CG2 3.76Å; K188-T252 WeakPolarHBondContact O-CA 3.4Å; Y247-T252 CarbonylContact C-O 3.56Å; Y247-T252 VanDerWaalsContact CA-O 3.3Å; Y247-T252 WeakPolarHBondContact CA-O 3.5Å; Y247-T252 WeakPolarHBondContact CB-O 3.05Å; E248-T252 WeakPolarHBondContact CB-OG1 3.45Å; E248-T252 WeakPolarHBondContact CG-OG1 3.45Å; E248-T252 PolarHBondContact N-O 3.04Å; E248-T252 PolarHBondContact OE2-OG1 2.59Å; I250-T252 HydrophobicContact CD1-CG2 3.94Å; I250-T252 HydrophobicContact CG1-CG2 4.18Å; I250-T252 WeakPolarHBondContact CG1-OG1 3.43Å
253	I	83	Confident	79.8	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	138.7	164.3	-53.5	179.7	0	0	0	108	Y108 I114 F143 M186 K188 I200 I245 T246	Y108-I253 HydrophobicContact CD2-CD1 4.16Å; Y108-I253 HydrophobicContact CD2-CG1 4.17Å; Y108-I253 HydrophobicContact CE2-CD1 3.91Å; Y108-I253 HydrophobicContact CE2-CG1 4.31Å; I114-I253 HydrophobicContact CD1-CD1 4.19Å; F143-I253 HydrophobicContact CE2-CG1 4.09Å; M186-I253 HydrophobicContact CE-CD1 3.83Å; M186-I253 HydrophobicContact CE-CG2 3.94Å; M186-I253 HydrophobicContact CG-CD1 4.01Å; M186-I253 HydrophobicContact SD-CD1 3.71Å; K188-I253 VanDerWaalsContact CG-O 3.25Å; K188-I253 WeakPolarHBondContact CG-O 3.17Å; K188-I253 PolarHBondContact O-N 2.84Å; I200-I253 HydrophobicContact CD1-CB 3.72Å; I200-I253 HydrophobicContact CD1-CG2 3.6Å; I200-I253 WeakPolarHBondContact CD1-O 3.43Å; I245-I253 HydrophobicContact CG2-CD1 4.13Å; I245-I253 HydrophobicContact CG2-CG1 4.38Å; I245-I253 HydrophobicContact CG2-CG2 3.78Å; T246-I253 WeakPolarHBondContact O-CG2 3.29Å
254	G	81.4	Confident	79.9	Confident	47 Å²	47	34.9 Å²	34.9	49%	0.485	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	-33.5	178.9	0	0	0	0	0	114	T246	T246-G254 PolarHBondContact O-N 2.79Å
255	Q	85.9	Confident	80.2	Confident	72 Å²	72	33.2 Å²	33.2	34%	0.336	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	148.8	-178.3	-161.5	-171.1	-3.4	0	0	111	T246 E257	T246-Q255 PolarHBondContact N-O 2.9Å; T246-Q255 PolarHBondContact O-N 2.52Å; T246-Q255 VanDerWaalsContact O-N 3.11Å; Q255-E257 HydrophobicContact CG-CG 4.09Å; Q255-E257 VanDerWaalsContact NE2-CG 3.3Å; Q255-E257 PolarHBondContact NE2-OE1 2.69Å
256	F	88.9	Confident	80.2	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	124.1	171.1	-173.1	-163.3	0	0	0	109.4	V181 M186 I200 P202 V203 L243 I245 I258	V181-F256 HydrophobicContact CG1-CE1 3.9Å; V181-F256 HydrophobicContact CG1-CZ 3.55Å; M186-F256 HydrophobicContact CB-CD1 3.86Å; M186-F256 HydrophobicContact CB-CE1 4.16Å; M186-F256 HydrophobicContact CE-CB 3.67Å; M186-F256 HydrophobicContact CE-CD1 3.67Å; M186-F256 HydrophobicContact CE-CD2 3.79Å; M186-F256 HydrophobicContact CE-CE1 4.17Å; M186-F256 HydrophobicContact CE-CE2 4.27Å; M186-F256 HydrophobicContact CE-CG 3.46Å; M186-F256 VanDerWaalsContact CE-CG 3.46Å; M186-F256 HydrophobicContact CE-CZ 4.43Å; I200-F256 HydrophobicContact CG2-CB 3.96Å; P202-F256 HydrophobicContact CB-CD1 3.61Å; P202-F256 HydrophobicContact CB-CE1 3.99Å; P202-F256 HydrophobicContact CB-CG 4.11Å; P202-F256 HydrophobicContact CG-CD1 4.36Å; V203-F256 PolarHBondContact N-O 2.93Å; L243-F256 HydrophobicContact CB-CE2 4.4Å; L243-F256 HydrophobicContact CD2-CE2 3.9Å; L243-F256 HydrophobicContact CD2-CZ 4.03Å; I245-F256 HydrophobicContact CD1-CE2 4.41Å; I245-F256 HydrophobicContact CG1-CD2 3.9Å; I245-F256 HydrophobicContact CG1-CE2 3.99Å; F256-I258 HydrophobicContact CD2-CG1 4.4Å; F256-I258 HydrophobicContact CE1-CD1 4.19Å; F256-I258 HydrophobicContact CE2-CD1 4.37Å; F256-I258 HydrophobicContact CE2-CG1 4.02Å; F256-I258 HydrophobicContact CZ-CD1 3.96Å; F256-I258 HydrophobicContact CZ-CG1 4.13Å
257	E	88	Confident	80.3	Confident	22 Å²	22	36.7 Å²	36.7	10%	0.103	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	138.7	179.1	-57.2	178	111.5	0	0	109.8	V203 K244 Q255 Y259	V203-E257 HydrophobicContact CB-CG 4.3Å; V203-E257 CarbonylContact O-C 3.53Å; V203-E257 WeakPolarHBondContact O-CA 3.09Å; K244-E257 HydrophobicContact CB-CB 4.31Å; K244-E257 WeakPolarHBondContact CD-OE2 3.47Å; K244-E257 VanDerWaalsContact CE-OE2 3.28Å; K244-E257 WeakPolarHBondContact CE-OE2 3.43Å; K244-E257 PolarHBondContact N-O 3.26Å; K244-E257 IonicContact NZ-OE2 2.66Å; K244-E257 PolarHBondContact NZ-OE2 2.99Å; K244-E257 PolarHBondContact O-N 2.8Å; Q255-E257 HydrophobicContact CG-CG 4.09Å; Q255-E257 VanDerWaalsContact NE2-CG 3.3Å; Q255-E257 PolarHBondContact NE2-OE1 2.69Å; E257-Y259 HydrophobicContact CB-CD2 4.48Å; E257-Y259 HydrophobicContact CB-CE2 3.61Å; E257-Y259 PolarHBondContact OE1-OH 2.88Å; E257-Y259 VanDerWaalsContact OE1-OH 3.13Å; E257-Y259 PolarHBondContact OE2-OH 2.88Å
258	I	87.9	Confident	80.7	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	121.8	-178.3	-48.8	-173.3	0	0	0	108.3	F178 V181 P202 V203 V204 I205 V241 Y242 L243 F256	F178-I258 HydrophobicContact CD2-CG2 4.3Å; F178-I258 HydrophobicContact CE2-CG2 4.02Å; V181-I258 HydrophobicContact CB-CD1 4.47Å; V181-I258 HydrophobicContact CG1-CD1 3.72Å; P202-I258 HydrophobicContact CB-CD1 3.53Å; P202-I258 HydrophobicContact CB-CG1 3.83Å; P202-I258 HydrophobicContact CG-CD1 4.12Å; V203-I258 PolarHBondContact O-N 3.28Å; V204-I258 WeakPolarHBondContact CA-O 2.94Å; V204-I258 HydrophobicContact CB-CB 4.42Å; V204-I258 HydrophobicContact CG1-CB 4.1Å; V204-I258 HydrophobicContact CG1-CG2 4.24Å; V204-I258 HydrophobicContact CG2-CB 4.11Å; V204-I258 HydrophobicContact CG2-CD1 4Å; V204-I258 HydrophobicContact CG2-CG1 4.23Å; I205-I258 PolarHBondContact N-O 3.49Å; V241-I258 HydrophobicContact CG1-CG2 4.12Å; Y242-I258 WeakPolarHBondContact O-CA 3.42Å; L243-I258 HydrophobicContact CD2-CB 4.16Å; L243-I258 HydrophobicContact CD2-CD1 3.92Å; L243-I258 HydrophobicContact CD2-CG1 3.7Å; L243-I258 HydrophobicContact CD2-CG2 3.77Å; F256-I258 HydrophobicContact CD2-CG1 4.4Å; F256-I258 HydrophobicContact CE1-CD1 4.19Å; F256-I258 HydrophobicContact CE2-CD1 4.37Å; F256-I258 HydrophobicContact CE2-CG1 4.02Å; F256-I258 HydrophobicContact CZ-CD1 3.96Å; F256-I258 HydrophobicContact CZ-CG1 4.13Å
259	Y	87	Confident	81.5	Confident	47 Å²	47	38.1 Å²	38.1	18%	0.184	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	119.2	178.4	-50.8	-95.5	0	0	0	109	I205 Y207 Y242 K244 E257	I205-Y259 HydrophobicContact CB-CD1 4.1Å; I205-Y259 HydrophobicContact CD1-CD1 4.31Å; I205-Y259 HydrophobicContact CD1-CE1 3.9Å; I205-Y259 VanDerWaalsContact O-CA 3.3Å; I205-Y259 WeakPolarHBondContact O-CA 3.18Å; Y207-Y259 HydrophobicContact CE2-CD1 4.15Å; Y242-Y259 AromaticContact CD1-CD2 3.28Å; Y242-Y259 HydrophobicContact CD1-CD2 3.28Å; Y242-Y259 AromaticContact CD1-CE2 3.97Å; Y242-Y259 HydrophobicContact CD1-CE2 3.97Å; Y242-Y259 AromaticContact CD1-CG 3.93Å; Y242-Y259 HydrophobicContact CD1-CG 3.93Å; Y242-Y259 AromaticContact CE1-CD2 3.6Å; Y242-Y259 HydrophobicContact CE1-CD2 3.6Å; Y242-Y259 AromaticContact CE1-CE2 3.77Å; Y242-Y259 HydrophobicContact CE1-CE2 3.77Å; Y242-Y259 HydrophobicContact CE1-CG 4.47Å; Y242-Y259 HydrophobicContact CG-CD2 4.26Å; Y242-Y259 PolarHBondContact N-O 3.43Å; Y242-Y259 PolarHBondContact O-N 2.96Å; K244-Y259 HydrophobicContact CB-CE2 4.25Å; K244-Y259 HydrophobicContact CD-CE2 4.41Å; E257-Y259 HydrophobicContact CB-CD2 4.48Å; E257-Y259 HydrophobicContact CB-CE2 3.61Å; E257-Y259 PolarHBondContact OE1-OH 2.88Å; E257-Y259 VanDerWaalsContact OE1-OH 3.13Å; E257-Y259 PolarHBondContact OE2-OH 2.88Å
260	A	87.5	Confident	82.8	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.008	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	130.9	-178.3	0	0	0	0	0	112.5	F178 I205 C206 Y207 S240 V241 I262	F178-A260 HydrophobicContact CD2-CB 4.03Å; F178-A260 HydrophobicContact CE2-CB 3.59Å; F178-A260 HydrophobicContact CZ-CB 4.06Å; I205-A260 PolarHBondContact O-N 2.82Å; C206-A260 CarbonylContact C-O 3.47Å; C206-A260 WeakPolarHBondContact CA-O 3.15Å; Y207-A260 PolarHBondContact N-O 3.09Å; S240-A260 CarbonylContact O-C 3.49Å; S240-A260 VanDerWaalsContact O-CA 3.32Å; S240-A260 WeakPolarHBondContact O-CA 3.43Å; V241-A260 HydrophobicContact CG2-CB 4.47Å; A260-I262 HydrophobicContact CB-CD1 3.8Å
261	L	83.6	Confident	83.9	Confident	53 Å²	53	31.6 Å²	31.6	28%	0.277	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	112.2	164.4	-56.9	-173.8	0	0	0	108	Y207 P238 V239 S240	Y207-L261 HydrophobicContact CD2-CD2 4.31Å; Y207-L261 HydrophobicContact CG-CD2 4.45Å; P238-L261 CarbonylContact C-O 3.41Å; V239-L261 PolarHBondContact N-O 2.98Å; S240-L261 PolarHBondContact N-O 2.7Å; S240-L261 PolarHBondContact O-N 2.68Å
262	I	89.5	Confident	84.9	Confident	5 Å²	5	33.9 Å²	33.9	3%	0.026	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	135.9	179.2	-49.1	-58.4	0	0	0	108.8	C206 Y207 Q209 I215 P218 N236 V237 P238 A260	C206-I262 HydrophobicContact CB-CG1 3.93Å; Y207-I262 PolarHBondContact O-N 2.82Å; Q209-I262 WeakPolarHBondContact CB-O 3.17Å; Q209-I262 PolarHBondContact N-O 3.24Å; I215-I262 HydrophobicContact CD1-CB 3.93Å; I215-I262 HydrophobicContact CD1-CG1 4.12Å; I215-I262 HydrophobicContact CD1-CG2 4.48Å; P218-I262 HydrophobicContact CG-CD1 4.24Å; P218-I262 HydrophobicContact CG-CG1 4.26Å; P218-I262 HydrophobicContact CG-CG2 3.87Å; N236-I262 HydrophobicContact CB-CG2 4.37Å; V237-I262 WeakPolarHBondContact O-CA 3.43Å; P238-I262 HydrophobicContact CB-CD1 3.95Å; A260-I262 HydrophobicContact CB-CD1 3.8Å
263	G	89	Confident	85.5	Confident	6 Å²	6	33.4 Å²	33.4	6%	0.062	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.3	-165	179	0	0	0	0	0	113.8	N236 V237	N236-G263 PolarHBondContact N-O 3.29Å; V237-G263 PolarHBondContact N-O 2.68Å; V237-G263 PolarHBondContact O-N 2.88Å
264	N	90.5	Very high	85.4	Confident	69 Å²	69	34.8 Å²	34.8	37%	0.369	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	134.8	-172.7	-62.3	-12.9	0	0	0	109.5	I233 C234 S235 N236	I233-N264 HydrophobicContact CG2-CB 3.93Å; C234-N264 WeakPolarHBondContact O-CA 3.49Å; S235-N264 WeakPolarHBondContact CA-OD1 3.13Å; S235-N264 PolarHBondContact OG-OD1 2.99Å; N236-N264 PolarHBondContact N-OD1 3.26Å
265	V	88.6	Confident	85.3	Confident	11 Å²	11	32.5 Å²	32.5	7%	0.067	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	145.9	-173	-62.1	0	0	0	0	111.5	V155 L174 C234 V237 V239 F269	V155-V265 HydrophobicContact CG2-CG2 4.28Å; L174-V265 HydrophobicContact CD1-CG2 4.44Å; C234-V265 HydrophobicContact CB-CG2 3.96Å; C234-V265 PolarHBondContact N-O 3.46Å; C234-V265 PolarHBondContact O-N 3.12Å; V237-V265 HydrophobicContact CB-CG2 4.15Å; V237-V265 HydrophobicContact CG1-CG2 4.22Å; V237-V265 HydrophobicContact CG2-CG2 3.78Å; V239-V265 HydrophobicContact CG2-CG1 3.87Å; V265-F269 HydrophobicContact CB-CB 4.25Å; V265-F269 HydrophobicContact CB-CD1 3.9Å; V265-F269 HydrophobicContact CB-CD2 4.26Å; V265-F269 HydrophobicContact CB-CE1 4.33Å; V265-F269 HydrophobicContact CB-CG 3.87Å; V265-F269 HydrophobicContact CG1-CB 4.25Å; V265-F269 HydrophobicContact CG1-CD1 4.27Å; V265-F269 HydrophobicContact CG1-CD2 3.7Å; V265-F269 HydrophobicContact CG1-CE2 4.07Å; V265-F269 HydrophobicContact CG1-CG 3.8Å; V265-F269 HydrophobicContact CG2-CD1 3.8Å; V265-F269 HydrophobicContact CG2-CE1 3.76Å; V265-F269 HydrophobicContact CG2-CE2 4.49Å; V265-F269 HydrophobicContact CG2-CG 4.21Å; V265-F269 HydrophobicContact CG2-CZ 4.11Å
266	T	84.1	Confident	85	Confident	62 Å²	62	30.6 Å²	30.6	38%	0.38	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	146.9	177.4	45.9	0	0	0	0	110.2	I233 T268	I233-T266 HydrophobicContact CB-CG2 4.17Å; I233-T266 HydrophobicContact CG1-CG2 3.7Å; I233-T266 HydrophobicContact CG2-CG2 4.35Å; T266-T268 PolarHBondContact O-N 2.66Å
267	G	82.1	Confident	84.2	Confident	30 Å²	30	31.3 Å²	31.3	31%	0.309	18%	0.175	S	C	.	.	S	Bend	trans	52	-120.4	174.9	0	0	0	0	0	113.9	V155	V155-G267 PolarHBondContact N-O 2.7Å
268	T	82.9	Confident	83.1	Confident	113 Å²	113	32.6 Å²	32.6	69%	0.693	18%	0.184	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-94.4	125.8	178.4	53.3	0	0	0	0	112.5	W153 N154 T266	W153-T268 CarbonylContact O-C 3.54Å; W153-T268 VanDerWaalsContact O-CA 3.26Å; W153-T268 WeakPolarHBondContact O-CA 3.49Å; N154-T268 HydrophobicContact CB-CG2 3.99Å; N154-T268 WeakPolarHBondContact OD1-CG2 3.47Å; T266-T268 PolarHBondContact O-N 2.66Å
269	F	82.4	Confident	82	Confident	26 Å²	26	35.7 Å²	35.7	11%	0.114	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	161.2	176	82.7	-76.8	0	0	0	111.4	G152 W153 V155 L174 V237 V239 V265 Q271	G152-F269 CarbonylContact C-O 3.47Å; G152-F269 WeakPolarHBondContact CA-O 3.19Å; W153-F269 HydrophobicContact CB-CD1 4.29Å; W153-F269 HydrophobicContact CB-CE1 3.83Å; W153-F269 HydrophobicContact CB-CZ 4.36Å; W153-F269 AromaticContact CD1-CZ 3.98Å; W153-F269 HydrophobicContact CG-CE1 4.48Å; W153-F269 PolarHBondContact N-O 2.84Å; W153-F269 PolarHBondContact O-N 2.76Å; V155-F269 HydrophobicContact CG2-CD1 4.08Å; V155-F269 HydrophobicContact CG2-CE1 3.94Å; L174-F269 HydrophobicContact CD1-CE1 3.7Å; L174-F269 HydrophobicContact CD1-CZ 3.83Å; L174-F269 HydrophobicContact CD2-CE1 3.99Å; L174-F269 HydrophobicContact CD2-CZ 3.81Å; L174-F269 HydrophobicContact CG-CZ 4.41Å; V237-F269 HydrophobicContact CG1-CE2 4.13Å; V237-F269 HydrophobicContact CG1-CZ 3.91Å; V239-F269 HydrophobicContact CG1-CD2 4.39Å; V265-F269 HydrophobicContact CB-CB 4.25Å; V265-F269 HydrophobicContact CB-CD1 3.9Å; V265-F269 HydrophobicContact CB-CD2 4.26Å; V265-F269 HydrophobicContact CB-CE1 4.33Å; V265-F269 HydrophobicContact CB-CG 3.87Å; V265-F269 HydrophobicContact CG1-CB 4.25Å; V265-F269 HydrophobicContact CG1-CD1 4.27Å; V265-F269 HydrophobicContact CG1-CD2 3.7Å; V265-F269 HydrophobicContact CG1-CE2 4.07Å; V265-F269 HydrophobicContact CG1-CG 3.8Å; V265-F269 HydrophobicContact CG2-CD1 3.8Å; V265-F269 HydrophobicContact CG2-CE1 3.76Å; V265-F269 HydrophobicContact CG2-CE2 4.49Å; V265-F269 HydrophobicContact CG2-CG 4.21Å; V265-F269 HydrophobicContact CG2-CZ 4.11Å; F269-Q271 HydrophobicContact CE2-CB 3.74Å; F269-Q271 HydrophobicContact CE2-CG 4.38Å; F269-Q271 HydrophobicContact CZ-CB 4.21Å
270	T	83.1	Confident	80.8	Confident	80 Å²	80	35.1 Å²	35.1	49%	0.491	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	118.9	174.4	-59.7	0	0	0	0	110.4	Y150 C151	Y150-T270 HydrophobicContact CD1-CG2 4.39Å; C151-T270 WeakPolarHBondContact O-CA 3.38Å
271	Q	83.2	Confident	79	Confident	3 Å²	3	43.1 Å²	43.1	1%	0.014	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	132.9	170.6	-168.2	174.7	40.9	0	0	109.6	C151 L174 P238 V239 F269 Y273	C151-Q271 PolarHBondContact N-O 2.74Å; C151-Q271 PolarHBondContact O-N 3.3Å; L174-Q271 PolarHBondContact O-NE2 3.37Å; P238-Q271 PolarHBondContact O-NE2 2.81Å; V239-Q271 WeakPolarHBondContact O-CA 3.42Å; F269-Q271 HydrophobicContact CE2-CB 3.74Å; F269-Q271 HydrophobicContact CE2-CG 4.38Å; F269-Q271 HydrophobicContact CZ-CB 4.21Å; Q271-Y273 VanDerWaalsContact CD-CE2 3.48Å; Q271-Y273 HydrophobicContact CG-CD2 4.37Å; Q271-Y273 HydrophobicContact CG-CE2 3.74Å; Q271-Y273 PolarHBondContact NE2-OH 2.87Å; Q271-Y273 PolarHBondContact OE1-OH 2.87Å
272	K	83.7	Confident	77.2	Confident	53 Å²	53	42.9 Å²	42.9	23%	0.23	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	131.6	177.7	-173.5	-175.2	178	-165.9	0	110.8	V148 S149 Y150 V239 S240 V241 E274	V148-K272 HydrophobicContact CG1-CG 4.26Å; S149-K272 WeakPolarHBondContact O-CA 3.49Å; Y150-K272 HydrophobicContact CD1-CB 4.19Å; Y150-K272 HydrophobicContact CD1-CD 4.4Å; Y150-K272 HydrophobicContact CD1-CG 3.91Å; Y150-K272 HydrophobicContact CE1-CB 4.38Å; Y150-K272 HydrophobicContact CE1-CD 3.77Å; Y150-K272 HydrophobicContact CE1-CG 3.77Å; V239-K272 PolarHBondContact O-N 3.38Å; S240-K272 CarbonylContact C-O 3.57Å; S240-K272 VanDerWaalsContact CA-O 3.29Å; S240-K272 WeakPolarHBondContact CA-O 3.07Å; V241-K272 PolarHBondContact N-O 2.82Å; K272-E274 WeakPolarHBondContact CE-OE2 3.46Å; K272-E274 IonicContact NZ-OE2 2.69Å; K272-E274 PolarHBondContact NZ-OE2 2.68Å
273	Y	82.7	Confident	75	Confident	2 Å²	2	47 Å²	47	1%	0.008	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	141.3	162.7	-71.5	-91.6	0	0	0	109.5	I128 P129 V148 S149 V177 V241 Q271	I128-Y273 HydrophobicContact CG2-CD1 4.11Å; I128-Y273 HydrophobicContact CG2-CD2 4.29Å; I128-Y273 HydrophobicContact CG2-CG 3.72Å; P129-Y273 HydrophobicContact CG-CD2 3.67Å; P129-Y273 HydrophobicContact CG-CE2 3.41Å; P129-Y273 VanDerWaalsContact CG-CE2 3.41Å; V148-Y273 CarbonylContact C-O 3.52Å; S149-Y273 PolarHBondContact N-O 2.76Å; S149-Y273 PolarHBondContact O-N 3.36Å; V177-Y273 HydrophobicContact CB-CE1 4.18Å; V177-Y273 HydrophobicContact CG1-CE1 3.75Å; V241-Y273 HydrophobicContact CB-CD1 3.76Å; V241-Y273 HydrophobicContact CB-CE1 3.81Å; V241-Y273 HydrophobicContact CG1-CD1 4.36Å; V241-Y273 HydrophobicContact CG1-CE1 4.37Å; V241-Y273 HydrophobicContact CG2-CD1 4.3Å; V241-Y273 HydrophobicContact CG2-CE1 3.85Å; V241-Y273 CarbonylContact O-C 3.57Å; V241-Y273 WeakPolarHBondContact O-CA 3Å; Q271-Y273 VanDerWaalsContact CD-CE2 3.48Å; Q271-Y273 HydrophobicContact CG-CD2 4.37Å; Q271-Y273 HydrophobicContact CG-CE2 3.74Å; Q271-Y273 PolarHBondContact NE2-OH 2.87Å; Q271-Y273 PolarHBondContact OE1-OH 2.87Å
274	E	81.5	Confident	72.5	Confident	28 Å²	28	53.4 Å²	53.4	13%	0.131	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	124.6	179.9	-174.7	163.6	177	0	0	109.7	F147 V148 V241 Y242 L243 K272 R298	F147-E274 WeakPolarHBondContact O-CA 3.31Å; V148-E274 HydrophobicContact CG2-CG 4.2Å; V241-E274 PolarHBondContact O-N 3.39Å; Y242-E274 CarbonylContact C-O 3.49Å; Y242-E274 WeakPolarHBondContact CA-O 3.1Å; Y242-E274 HydrophobicContact CD2-CB 4.13Å; Y242-E274 HydrophobicContact CD2-CG 3.91Å; Y242-E274 HydrophobicContact CE2-CG 4.48Å; L243-E274 PolarHBondContact N-O 2.95Å; K272-E274 WeakPolarHBondContact CE-OE2 3.46Å; K272-E274 IonicContact NZ-OE2 2.69Å; K272-E274 PolarHBondContact NZ-OE2 2.68Å; E274-R298 IonicContact OE1-CZ 3.79Å; E274-R298 IonicContact OE1-NH1 2.76Å; E274-R298 PolarHBondContact OE1-NH1 2.83Å; E274-R298 IonicContact OE1-NH2 3.6Å; E274-R298 PolarHBondContact OE1-NH2 2.91Å
275	V	80.1	Confident	70.1	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	133.6	175.3	-176.2	0	0	0	0	108.9	I128 V141 S146 F147 L243 I245 F277	I128-V275 HydrophobicContact CD1-CG2 3.35Å; V141-V275 HydrophobicContact CG1-CG1 3.92Å; V141-V275 HydrophobicContact CG1-CG2 4.42Å; V141-V275 HydrophobicContact CG2-CG2 4.07Å; S146-V275 CarbonylContact C-O 3.56Å; S146-V275 VanDerWaalsContact CA-O 3.23Å; S146-V275 WeakPolarHBondContact CA-O 3.5Å; S146-V275 WeakPolarHBondContact CB-O 3.26Å; F147-V275 HydrophobicContact CD1-CB 4.12Å; F147-V275 HydrophobicContact CD1-CG2 4.26Å; F147-V275 HydrophobicContact CE1-CB 4.02Å; F147-V275 HydrophobicContact CE1-CG2 3.7Å; F147-V275 HydrophobicContact CE2-CG2 4.26Å; F147-V275 HydrophobicContact CZ-CB 4.44Å; F147-V275 HydrophobicContact CZ-CG2 3.69Å; F147-V275 PolarHBondContact N-O 3.44Å; F147-V275 PolarHBondContact O-N 2.64Å; L243-V275 HydrophobicContact CB-CG2 4.39Å; L243-V275 HydrophobicContact CD1-CG2 4.27Å; L243-V275 WeakPolarHBondContact O-CA 3.3Å; I245-V275 HydrophobicContact CD1-CG1 4.38Å; V275-F277 HydrophobicContact CG1-CD2 4.03Å; V275-F277 HydrophobicContact CG1-CE2 3.67Å; V275-F277 HydrophobicContact CG1-CZ 4.44Å
276	E	78.8	Confident	67.8	Low	31 Å²	31	58.8 Å²	58.8	15%	0.145	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	118.4	173.7	-170.7	177.1	-163.1	0	0	111.2	Y242 L243 K244 I245 V278 P287	Y242-E276 HydrophobicContact CE2-CB 3.82Å; Y242-E276 WeakPolarHBondContact CE2-OE2 2.95Å; Y242-E276 PolarHBondContact OH-OE2 2.87Å; L243-E276 PolarHBondContact O-N 3.48Å; K244-E276 WeakPolarHBondContact CA-O 3.1Å; I245-E276 PolarHBondContact N-O 2.77Å; E276-V278 HydrophobicContact CG-CG2 3.89Å; E276-P287 WeakPolarHBondContact OE1-CB 3.4Å
277	F	71.2	Confident	66	Low	16 Å²	16	57.7 Å²	57.7	7%	0.07	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	116.8	168.3	-71.9	-90.2	0	0	0	109.6	I114 V141 S142 F143 S146 I245 Y247 V275	I114-F277 HydrophobicContact CD1-CE1 4.02Å; I114-F277 HydrophobicContact CD1-CZ 4.06Å; I114-F277 HydrophobicContact CG1-CE1 4.38Å; I114-F277 HydrophobicContact CG1-CZ 3.93Å; V141-F277 HydrophobicContact CG1-CE2 3.91Å; V141-F277 HydrophobicContact CG1-CZ 3.87Å; S142-F277 WeakPolarHBondContact O-CE2 3.33Å; S142-F277 WeakPolarHBondContact O-CZ 3.36Å; F143-F277 HydrophobicContact CD2-CD1 4.28Å; F143-F277 AromaticContact CD2-CE1 3.89Å; F143-F277 HydrophobicContact CD2-CE1 3.89Å; F143-F277 HydrophobicContact CG-CE1 4.42Å; S146-F277 PolarHBondContact OG-N 3Å; I245-F277 HydrophobicContact CB-CD1 3.83Å; I245-F277 HydrophobicContact CB-CE1 3.93Å; I245-F277 HydrophobicContact CB-CG 4.46Å; I245-F277 HydrophobicContact CD1-CD1 4.45Å; I245-F277 HydrophobicContact CD1-CE1 3.76Å; I245-F277 HydrophobicContact CD1-CE2 4.41Å; I245-F277 HydrophobicContact CD1-CZ 3.74Å; I245-F277 HydrophobicContact CG1-CE1 4.43Å; I245-F277 HydrophobicContact CG2-CD1 3.71Å; I245-F277 HydrophobicContact CG2-CE1 3.65Å; I245-F277 CarbonylContact O-C 3.59Å; I245-F277 WeakPolarHBondContact O-CA 3.36Å; Y247-F277 HydrophobicContact CD1-CB 3.97Å; Y247-F277 HydrophobicContact CD1-CD1 4.28Å; Y247-F277 HydrophobicContact CE1-CB 3.72Å; V275-F277 HydrophobicContact CG1-CD2 4.03Å; V275-F277 HydrophobicContact CG1-CE2 3.67Å; V275-F277 HydrophobicContact CG1-CZ 4.44Å
278	V	66.5	Low	64.6	Low	48 Å²	48	62 Å²	62	29%	0.291	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	124.3	179.9	-177.2	0	0	0	0	109.3	K244 I245 T246 Y247 E276	K244-V278 HydrophobicContact CG-CG2 4.1Å; I245-V278 PolarHBondContact O-N 3.18Å; T246-V278 CarbonylContact C-O 3.53Å; T246-V278 VanDerWaalsContact CA-O 3.23Å; T246-V278 WeakPolarHBondContact CA-O 3.37Å; Y247-V278 VanDerWaalsContact CD1-O 3.23Å; Y247-V278 WeakPolarHBondContact CD1-O 3.46Å; Y247-V278 PolarHBondContact N-O 2.57Å; E276-V278 HydrophobicContact CG-CG2 3.89Å
279	Q	64.1	Low	63.7	Low	66 Å²	66	56.6 Å²	56.6	31%	0.308	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	132.6	179.6	-175.5	166.9	66.6	0	0	111.5	Y247 V249 N281 A282	Y247-Q279 HydrophobicContact CE1-CB 3.94Å; Y247-Q279 HydrophobicContact CE2-CB 4.21Å; Y247-Q279 HydrophobicContact CE2-CG 4.2Å; Y247-Q279 CarbonylContact O-C 3.5Å; Y247-Q279 VanDerWaalsContact O-CA 3.28Å; Y247-Q279 WeakPolarHBondContact O-CA 3.41Å; V249-Q279 HydrophobicContact CG2-CG 4.3Å; Q279-N281 PolarHBondContact O-N 3.21Å; Q279-A282 HydrophobicContact CB-CB 3.92Å; Q279-A282 HydrophobicContact CG-CB 4.41Å; Q279-A282 WeakPolarHBondContact O-CB 3.44Å; Q279-A282 PolarHBondContact O-N 3.49Å
280	T	62.2	Low	62.7	Low	35 Å²	35	55.6 Å²	55.6	22%	0.215	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	137.2	175.6	58.9	0	0	0	0	110.7	T246 Y247 E248 A282	T246-T280 HydrophobicContact CG2-CG2 3.7Å; Y247-T280 PolarHBondContact O-N 3Å; E248-T280 WeakPolarHBondContact CA-OG1 3.47Å; E248-T280 HydrophobicContact CG-CG2 4.18Å; T280-A282 PolarHBondContact O-N 3.42Å
281	N	49.6	Very low	61.8	Low	168 Å²	168	54.6 Å²	54.6	90%	0.898	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.2	5	-176.2	-51.5	-54.1	0	0	0	115.9	Q279	Q279-N281 PolarHBondContact O-N 3.21Å
282	A	44.9	Very low	60.9	Low	48 Å²	48	56.9 Å²	56.9	40%	0.397	32%	0.316	S	S	.	.			trans	-64.3	138	159.3	0	0	0	0	0	108.6	Q279 T280	Q279-A282 HydrophobicContact CB-CB 3.92Å; Q279-A282 HydrophobicContact CG-CB 4.41Å; Q279-A282 WeakPolarHBondContact O-CB 3.44Å; Q279-A282 PolarHBondContact O-N 3.49Å; T280-A282 PolarHBondContact O-N 3.42Å
283	S	43	Very low	60.7	Low	92 Å²	92	54.4 Å²	54.4	64%	0.643	31%	0.305	S	S	*	.			trans	-60.4	160.3	168.7	58.9	0	0	0	0	111	V285	S283-V285 PolarHBondContact O-N 2.95Å
284	N	37	Very low	60.8	Low	141 Å²	141	54.4 Å²	54.4	75%	0.754	31%	0.305	S	S	*	.			trans	-68.8	55.9	178.6	-66.6	-5.2	0	0	0	113.1	F286	N284-F286 PolarHBondContact O-N 3.48Å
285	V	39.4	Very low	60.6	Low	92 Å²	92	55.1 Å²	55.1	56%	0.558	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-62	126	162.5	-178.6	0	0	0	0	106.1	S283	S283-V285 PolarHBondContact O-N 2.95Å
286	F	41.9	Very low	60.5	Low	101 Å²	101	58.9 Å²	58.9	44%	0.443	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-59.3	150.9	179.6	-87.6	-147.6	0	0	0	110.8	N284 M288 N344	N284-F286 PolarHBondContact O-N 3.48Å; F286-M288 PolarHBondContact O-N 3.12Å; F286-M288 VanDerWaalsContact O-N 3.12Å; F286-N344 HydrophobicContact CB-CB 4.31Å; F286-N344 WeakPolarHBondContact CD2-ND2 3.2Å; F286-N344 VanDerWaalsContact CE2-ND2 3.3Å; F286-N344 WeakPolarHBondContact CE2-ND2 3.09Å; F286-N344 HydrophobicContact CG-CB 4.42Å; F286-N344 WeakPolarHBondContact CG-ND2 3.03Å
287	P	45.5	Very low	60.1	Low	39 Å²	39	57.5 Å²	57.5	25%	0.253	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-46.8	120.5	-172.7	11.3	-28.3	0	0	0	111.7	E276 S289	E276-P287 WeakPolarHBondContact OE1-CB 3.4Å; P287-S289 PolarHBondContact O-N 3.03Å
288	M	52.2	Low	60.2	Low	119 Å²	119	57 Å²	57	59%	0.586	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-47.5	129.5	179.4	-67.8	-176.5	179.6	0	0	109.5	F286 G290	F286-M288 PolarHBondContact O-N 3.12Å; F286-M288 VanDerWaalsContact O-N 3.12Å; M288-G290 PolarHBondContact O-N 2.85Å
289	S	63.7	Low	60.8	Low	1 Å²	1	55.1 Å²	55.1	1%	0.007	31%	0.309	C	S	.	.	S	Bend	trans	-68.3	-4.6	-177.1	-25.6	0	0	0	0	113.7	P287 Y294 L295 P299 I301	P287-S289 PolarHBondContact O-N 3.03Å; S289-Y294 CarbonylContact O-C 3.5Å; S289-Y294 WeakPolarHBondContact O-CA 3.4Å; S289-L295 WeakPolarHBondContact O-CB 3.42Å; S289-L295 PolarHBondContact O-N 2.9Å; S289-P299 WeakPolarHBondContact CB-O 3.5Å; S289-P299 PolarHBondContact OG-O 2.87Å; S289-I301 WeakPolarHBondContact OG-CD1 3.48Å; S289-I301 WeakPolarHBondContact OG-CG1 3.32Å
290	G	63.1	Low	61.8	Low	4 Å²	4	52 Å²	52	4%	0.041	30%	0.295	C	S	.	.			trans	142.6	177.9	166.9	0	0	0	0	0	111	M288 G293 L295 P442	M288-G290 PolarHBondContact O-N 2.85Å; G290-G293 CarbonylContact C-O 3.5Å; G290-G293 WeakPolarHBondContact CA-O 3.49Å; G290-L295 VanDerWaalsContact CA-CD1 3.45Å; G290-P442 WeakPolarHBondContact O-CB 3.47Å
291	N	63.3	Low	62.9	Low	60 Å²	60	51.7 Å²	51.7	32%	0.321	29%	0.291	S	S	.	.	S	Bend	trans	-147.5	119.4	-177.1	-175.8	6.4	0	0	0	112.1	G293 I443 Q497	N291-G293 VanDerWaalsContact C-N 3.34Å; N291-G293 PolarHBondContact N-O 2.84Å; N291-I443 HydrophobicContact CB-CG2 4.45Å; N291-Q497 PolarHBondContact O-NE2 2.91Å
292	P	64.4	Low	64.7	Low	51 Å²	51	43.7 Å²	43.7	33%	0.331	25%	0.249	S	C	.	.	S	Bend	cis	-73.2	-15.9	-14.9	28.9	-38.1	0	0	0	114.2	W441 P442 I443 Q497	P292-W441 HydrophobicContact CB-CE3 4.42Å; P292-W441 WeakPolarHBondContact O-CB 3.46Å; P292-P442 WeakPolarHBondContact O-CD 3.27Å; P292-I443 HydrophobicContact CB-CD1 3.86Å; P292-I443 HydrophobicContact CB-CG1 4.5Å; P292-Q497 VanDerWaalsContact CD-NE2 3.35Å; P292-Q497 HydrophobicContact CG-CB 4.49Å; P292-Q497 HydrophobicContact CG-CG 4.05Å
293	G	79.8	Confident	66.6	Low	1 Å²	1	41.4 Å²	41.4	1%	0.01	23%	0.23	C	C	.	.	S	Bend	trans	-87.5	159.8	-172.9	0	0	0	0	0	114.9	G290 N291 N498	G290-G293 CarbonylContact C-O 3.5Å; G290-G293 WeakPolarHBondContact CA-O 3.49Å; N291-G293 VanDerWaalsContact C-N 3.34Å; N291-G293 PolarHBondContact N-O 2.84Å; G293-N498 CarbonylContact C-O 3.6Å; G293-N498 WeakPolarHBondContact CA-O 3.2Å
294	Y	83.8	Confident	68.4	Low	1 Å²	1	39.6 Å²	39.6	0%	0.004	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-69.9	145.4	167.1	-80	-85	0	0	0	112.3	S289 I300 I301 F371 A439 I440 P442 N498 I500	S289-Y294 CarbonylContact O-C 3.5Å; S289-Y294 WeakPolarHBondContact O-CA 3.4Å; Y294-I300 HydrophobicContact CE1-CG1 4.29Å; Y294-I301 HydrophobicContact CE1-CG1 4.48Å; Y294-I301 PolarHBondContact OH-N 2.78Å; Y294-F371 HydrophobicContact CD1-CB 4.16Å; Y294-F371 HydrophobicContact CD1-CD2 4.02Å; Y294-F371 HydrophobicContact CD1-CG 4.14Å; Y294-F371 HydrophobicContact CD2-CD2 4.44Å; Y294-F371 HydrophobicContact CD2-CE2 4.5Å; Y294-F371 AromaticContact CG-CD2 3.79Å; Y294-F371 HydrophobicContact CG-CD2 3.79Å; Y294-F371 HydrophobicContact CG-CE2 4.14Å; Y294-F371 HydrophobicContact CG-CG 4.1Å; Y294-A439 VanDerWaalsContact CE2-O 3.29Å; Y294-A439 WeakPolarHBondContact CE2-O 3.41Å; Y294-A439 PolarHBondContact OH-O 3.37Å; Y294-I440 WeakPolarHBondContact CE2-O 3.31Å; Y294-P442 HydrophobicContact CD1-CG 3.72Å; Y294-P442 HydrophobicContact CD2-CG 3.96Å; Y294-P442 HydrophobicContact CE1-CB 4.46Å; Y294-P442 HydrophobicContact CE1-CG 3.83Å; Y294-P442 HydrophobicContact CE2-CG 4.1Å; Y294-P442 HydrophobicContact CG-CG 3.79Å; Y294-N498 PolarHBondContact N-O 3.11Å; Y294-N498 WeakPolarHBondContact O-CB 3.19Å; Y294-N498 PolarHBondContact O-ND2 3.33Å; Y294-I500 HydrophobicContact CD2-CD1 4.27Å; Y294-I500 HydrophobicContact CD2-CG1 3.99Å; Y294-I500 HydrophobicContact CE1-CD1 4.33Å; Y294-I500 HydrophobicContact CE2-CB 4.4Å; Y294-I500 HydrophobicContact CE2-CD1 3.62Å; Y294-I500 HydrophobicContact CE2-CG1 3.67Å
295	L	77.5	Confident	70.6	Confident	44 Å²	44	36.6 Å²	36.6	23%	0.23	19%	0.194	C	C	.	.			trans	-118.4	143.7	-179.1	-60.2	167.1	0	0	0	110	S146 F147 S289 G290 R298	S146-L295 WeakPolarHBondContact O-CD1 3.48Å; F147-L295 HydrophobicContact CB-CD1 4.12Å; S289-L295 WeakPolarHBondContact O-CB 3.42Å; S289-L295 PolarHBondContact O-N 2.9Å; G290-L295 VanDerWaalsContact CA-CD1 3.45Å; L295-R298 HydrophobicContact CB-CG 4.09Å; L295-R298 WeakPolarHBondContact O-CB 3.37Å; L295-R298 PolarHBondContact O-N 2.62Å
296	I	78.7	Confident	72.5	Confident	79 Å²	79	35 Å²	35	41%	0.405	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	138.7	-174.7	-58.5	174.4	0	0	0	109.9	Y150 R298 F371 E373	Y150-I296 HydrophobicContact CE2-CG2 4.35Å; I296-R298 VanDerWaalsContact C-N 3.27Å; I296-R298 PolarHBondContact O-N 2.9Å; I296-F371 VanDerWaalsContact CA-O 3.29Å; I296-F371 WeakPolarHBondContact CA-O 3.19Å; I296-F371 HydrophobicContact CG1-CD1 4.43Å; I296-E373 HydrophobicContact CG2-CG 4.08Å
297	G	69.4	Low	74	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.01	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.1	-3	-178.7	0	0	0	0	0	116	R370 F371 E373	G297-R370 PolarHBondContact O-NH1 2.91Å; G297-F371 PolarHBondContact N-O 2.82Å; G297-E373 VanDerWaalsContact CA-CD 3.4Å; G297-E373 WeakPolarHBondContact CA-OE1 3.49Å
298	R	73.9	Confident	75.2	Confident	6 Å²	6	35 Å²	35	2%	0.023	19%	0.185	C	C	.	.	S	Bend	trans	-92.1	150	177.4	-69.8	-78.7	173	-114	13.7	112.7	V148 E274 L295 I296 R370 F371	V148-R298 HydrophobicContact CG2-CG 4.39Å; V148-R298 VanDerWaalsContact CG2-CZ 3.42Å; V148-R298 VanDerWaalsContact CG2-NH1 3.35Å; E274-R298 IonicContact OE1-CZ 3.79Å; E274-R298 IonicContact OE1-NH1 2.76Å; E274-R298 PolarHBondContact OE1-NH1 2.83Å; E274-R298 IonicContact OE1-NH2 3.6Å; E274-R298 PolarHBondContact OE1-NH2 2.91Å; L295-R298 HydrophobicContact CB-CG 4.09Å; L295-R298 WeakPolarHBondContact O-CB 3.37Å; L295-R298 PolarHBondContact O-N 2.62Å; I296-R298 VanDerWaalsContact C-N 3.27Å; I296-R298 PolarHBondContact O-N 2.9Å; R298-R370 CarbonylContact O-C 3.59Å; R298-R370 WeakPolarHBondContact O-CA 3.36Å; R298-F371 PolarHBondContact O-N 2.92Å
299	P	79.3	Confident	76.1	Confident	9 Å²	9	33.5 Å²	33.5	6%	0.058	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-60.3	142.7	-178.2	-24.2	35	0	0	0	114.1	S289 V346 P368 I369	S289-P299 WeakPolarHBondContact CB-O 3.5Å; S289-P299 PolarHBondContact OG-O 2.87Å; P299-V346 HydrophobicContact CB-CG1 3.7Å; P299-V346 HydrophobicContact CB-CG2 4.08Å; P299-P368 HydrophobicContact CB-CB 3.91Å; P299-P368 HydrophobicContact CG-CB 4.15Å; P299-P368 HydrophobicContact CG-CG 4.36Å; P299-I369 CarbonylContact C-O 3.5Å; P299-I369 WeakPolarHBondContact CA-O 3.33Å
300	I	86.2	Confident	76.2	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-81	135.9	173.8	-75.1	-174	0	0	0	112.1	Y294 V346 W347 I369 F371 L438 I485 I500 F529	Y294-I300 HydrophobicContact CE1-CG1 4.29Å; I300-V346 WeakPolarHBondContact O-CA 3.39Å; I300-W347 PolarHBondContact O-N 2.92Å; I300-W347 VanDerWaalsContact O-N 3.15Å; I300-I369 HydrophobicContact CD1-CG2 3.94Å; I300-I369 HydrophobicContact CG1-CG2 4.39Å; I300-I369 PolarHBondContact N-O 2.86Å; I300-F371 HydrophobicContact CD1-CB 4.3Å; I300-F371 HydrophobicContact CD1-CD2 4.16Å; I300-F371 HydrophobicContact CG1-CB 3.97Å; I300-F371 HydrophobicContact CG1-CD2 4.39Å; I300-L438 HydrophobicContact CG2-CD1 3.98Å; I300-L438 HydrophobicContact CG2-CD2 3.96Å; I300-L438 HydrophobicContact CG2-CG 4.45Å; I300-I485 HydrophobicContact CD1-CD1 3.56Å; I300-I485 HydrophobicContact CD1-CG2 4.36Å; I300-I500 HydrophobicContact CD1-CD1 4.02Å; I300-I500 HydrophobicContact CG1-CD1 4.32Å; I300-I500 HydrophobicContact CG2-CD1 3.87Å; I300-F529 HydrophobicContact CD1-CE1 3.53Å; I300-F529 HydrophobicContact CD1-CZ 3.49Å; I300-F529 VanDerWaalsContact CD1-CZ 3.49Å
301	I	84.7	Confident	76.3	Confident	28 Å²	28	37.6 Å²	37.6	14%	0.144	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-88.5	127	-179.8	-53	-55.6	0	0	0	110.7	S289 Y294 G345 L438 A439 P442 W452	S289-I301 WeakPolarHBondContact OG-CD1 3.48Å; S289-I301 WeakPolarHBondContact OG-CG1 3.32Å; Y294-I301 HydrophobicContact CE1-CG1 4.48Å; Y294-I301 PolarHBondContact OH-N 2.78Å; I301-G345 CarbonylContact C-O 3.53Å; I301-G345 WeakPolarHBondContact CA-O 3.29Å; I301-L438 CarbonylContact O-C 3.55Å; I301-L438 WeakPolarHBondContact O-CA 3.46Å; I301-A439 HydrophobicContact CB-CB 3.87Å; I301-A439 HydrophobicContact CG2-CB 3.83Å; I301-A439 PolarHBondContact O-N 2.99Å; I301-P442 HydrophobicContact CG1-CB 4.36Å; I301-W452 HydrophobicContact CG2-CH2 3.88Å; I301-W452 HydrophobicContact CG2-CZ3 4.21Å
302	G	87.2	Confident	76.3	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	155.6	179.3	0	0	0	0	0	113.2	T328 G345 L437	G302-T328 PolarHBondContact O-N 2.85Å; G302-T328 PolarHBondContact O-OG1 3.32Å; G302-G345 PolarHBondContact N-O 2.89Å; G302-G345 CarbonylContact O-C 3.59Å; G302-G345 VanDerWaalsContact O-CA 3.31Å; G302-G345 WeakPolarHBondContact O-CA 3.43Å; G302-L437 CarbonylContact C-O 3.57Å; G302-L437 VanDerWaalsContact CA-O 3.22Å; G302-L437 WeakPolarHBondContact CA-O 3.12Å
303	A	83.9	Confident	76.2	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	154.9	-177.3	0	0	0	0	0	112.1	M325 L326 P435 D436 L437 W452	A303-M325 HydrophobicContact CB-CB 3.73Å; A303-M325 HydrophobicContact CB-CG 4.35Å; A303-L326 CarbonylContact C-O 3.58Å; A303-L326 VanDerWaalsContact CA-O 3.26Å; A303-L326 WeakPolarHBondContact CA-O 3.43Å; A303-L326 VanDerWaalsContact CB-O 3.31Å; A303-L326 WeakPolarHBondContact CB-O 3.34Å; A303-P435 WeakPolarHBondContact O-CB 3.44Å; A303-D436 PolarHBondContact O-N 2.84Å; A303-L437 PolarHBondContact N-O 3.33Å; A303-L437 PolarHBondContact O-N 3.17Å; A303-W452 HydrophobicContact CB-CE3 3.94Å; A303-W452 HydrophobicContact CB-CH2 3.78Å; A303-W452 HydrophobicContact CB-CZ3 3.38Å
304	K	82.4	Confident	75.4	Confident	55 Å²	55	44 Å²	44	24%	0.239	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	144.1	162.5	-76.6	-59.3	-163.2	-169.1	0	110.4	L326 K434 D436	K304-L326 HydrophobicContact CB-CB 4.41Å; K304-L326 PolarHBondContact N-O 2.93Å; K304-L326 PolarHBondContact O-N 3.37Å; K304-K434 WeakPolarHBondContact CE-O 3.49Å; K304-K434 PolarHBondContact NZ-O 2.88Å; K304-D436 WeakPolarHBondContact CA-OD2 3.25Å; K304-D436 VanDerWaalsContact CD-CG 3.48Å; K304-D436 WeakPolarHBondContact CD-OD1 3.06Å; K304-D436 WeakPolarHBondContact CD-OD2 3.38Å; K304-D436 IonicContact NZ-OD1 2.69Å; K304-D436 PolarHBondContact NZ-OD1 2.97Å; K304-D436 IonicContact NZ-OD2 3.21Å
305	I	82.2	Confident	74.4	Confident	78 Å²	78	50.8 Å²	50.8	40%	0.4	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	134.3	172.5	-159.4	170.2	0	0	0	110	I307 T323 D436 L437	I305-I307 HydrophobicContact CD1-CD1 4.17Å; I305-I307 HydrophobicContact CD1-CG1 4.25Å; I305-I307 HydrophobicContact CG1-CG1 4.11Å; I305-T323 HydrophobicContact CD1-CG2 3.81Å; I305-T323 HydrophobicContact CG1-CG2 3.59Å; I305-D436 HydrophobicContact CG2-CB 4.49Å; I305-D436 PolarHBondContact N-OD2 2.72Å; I305-L437 HydrophobicContact CB-CD1 3.79Å; I305-L437 HydrophobicContact CD1-CD1 4.33Å; I305-L437 HydrophobicContact CG1-CD1 4.12Å
306	N	78.7	Confident	73.4	Confident	59 Å²	59	56.5 Å²	56.5	32%	0.316	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	109.4	174.6	178.4	58.9	0	0	0	109.4	T308 T324 L326	N306-T308 PolarHBondContact ND2-OG1 3.18Å; N306-T324 PolarHBondContact N-O 3.44Å; N306-T324 PolarHBondContact ND2-OG1 2.9Å; N306-T324 PolarHBondContact O-N 3.13Å; N306-T324 PolarHBondContact O-OG1 2.88Å; N306-L326 HydrophobicContact CB-CD1 3.68Å; N306-L326 HydrophobicContact CB-CG 3.75Å
307	I	75	Confident	72.7	Confident	95 Å²	95	56.9 Å²	56.9	49%	0.487	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	118.5	-175.6	-57.1	176.7	0	0	0	107.6	I305 T323	I305-I307 HydrophobicContact CD1-CD1 4.17Å; I305-I307 HydrophobicContact CD1-CG1 4.25Å; I305-I307 HydrophobicContact CG1-CG1 4.11Å; I307-T323 HydrophobicContact CG1-CG2 4.5Å
308	T	70.1	Confident	72.2	Confident	44 Å²	44	59.7 Å²	59.7	27%	0.27	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	117.7	-179.1	-38.5	0	0	0	0	110.2	N306 L313 V322	N306-T308 PolarHBondContact ND2-OG1 3.18Å; T308-L313 HydrophobicContact CG2-CD1 3.53Å; T308-V322 PolarHBondContact N-O 2.82Å; T308-V322 PolarHBondContact O-N 2.86Å
309	D	70.4	Confident	71.6	Confident	87 Å²	87	66.2 Å²	66.2	47%	0.465	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	134.7	178.8	-63.6	-29.4	0	0	0	111.2	S311 S312 L313 S321	D309-S311 PolarHBondContact O-N 2.76Å; D309-S312 WeakPolarHBondContact O-CB 3.35Å; D309-S312 PolarHBondContact O-N 3.26Å; D309-S312 PolarHBondContact O-OG 2.9Å; D309-L313 WeakPolarHBondContact O-CD1 3.23Å; D309-S321 WeakPolarHBondContact OD1-CB 3.4Å
310	L	66.5	Low	71.1	Confident	29 Å²	29	67.9 Å²	67.9	15%	0.152	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-65.1	-25.3	-177	-101	64.8	0	0	0	113.3	S312 L313 G314 Y315 N318 A320 V322	L310-S312 PolarHBondContact O-N 2.83Å; L310-L313 CarbonylContact O-C 3.58Å; L310-L313 PolarHBondContact O-N 2.86Å; L310-L313 VanDerWaalsContact O-N 3.09Å; L310-G314 PolarHBondContact O-N 3.34Å; L310-Y315 HydrophobicContact CB-CD2 4.22Å; L310-Y315 HydrophobicContact CB-CG 4.49Å; L310-Y315 HydrophobicContact CD2-CD2 4.3Å; L310-Y315 HydrophobicContact CD2-CG 4.45Å; L310-Y315 HydrophobicContact CG-CD2 3.97Å; L310-Y315 HydrophobicContact CG-CG 4.47Å; L310-Y315 WeakPolarHBondContact O-CB 3.37Å; L310-Y315 PolarHBondContact O-N 2.9Å; L310-N318 HydrophobicContact CB-CB 4.33Å; L310-N318 WeakPolarHBondContact CD2-ND2 3.21Å; L310-A320 WeakPolarHBondContact CB-O 3.23Å; L310-A320 PolarHBondContact N-O 2.77Å; L310-V322 HydrophobicContact CD1-CB 3.98Å; L310-V322 HydrophobicContact CD1-CG2 3.54Å
311	S	64.9	Low	70.2	Confident	63 Å²	63	70.7 Å²	70.7	44%	0.441	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-54.7	-39	168.3	57.3	0	0	0	0	112.4	D309 L313 G314	D309-S311 PolarHBondContact O-N 2.76Å; S311-L313 VanDerWaalsContact C-N 3.33Å; S311-L313 PolarHBondContact O-N 3.02Å; S311-G314 PolarHBondContact O-N 2.61Å; S311-G314 VanDerWaalsContact O-N 3.13Å
312	S	63.8	Low	69.3	Low	84 Å²	84	72.9 Å²	72.9	59%	0.587	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-74.1	-20.5	177.5	74.8	0	0	0	0	113.9	D309 L310 G314	D309-S312 WeakPolarHBondContact O-CB 3.35Å; D309-S312 PolarHBondContact O-N 3.26Å; D309-S312 PolarHBondContact O-OG 2.9Å; L310-S312 PolarHBondContact O-N 2.83Å; S312-G314 VanDerWaalsContact C-N 3.27Å
313	L	61.3	Low	68.4	Low	106 Å²	106	75 Å²	75	56%	0.555	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-86.1	6.7	168.9	-72.8	90.4	0	0	0	112.9	T308 D309 L310 S311 Y315	T308-L313 HydrophobicContact CG2-CD1 3.53Å; D309-L313 WeakPolarHBondContact O-CD1 3.23Å; L310-L313 CarbonylContact O-C 3.58Å; L310-L313 PolarHBondContact O-N 2.86Å; L310-L313 VanDerWaalsContact O-N 3.09Å; S311-L313 VanDerWaalsContact C-N 3.33Å; S311-L313 PolarHBondContact O-N 3.02Å; L313-Y315 HydrophobicContact CB-CD2 3.86Å; L313-Y315 HydrophobicContact CB-CE2 3.97Å
314	G	63.4	Low	67.7	Low	56 Å²	56	76.8 Å²	76.8	58%	0.577	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.3	4.2	178.4	0	0	0	0	0	115.4	L310 S311 S312 L316	L310-G314 PolarHBondContact O-N 3.34Å; S311-G314 PolarHBondContact O-N 2.61Å; S311-G314 VanDerWaalsContact O-N 3.13Å; S312-G314 VanDerWaalsContact C-N 3.27Å; G314-L316 PolarHBondContact O-N 2.82Å
315	Y	62.2	Low	67.3	Low	143 Å²	143	74.2 Å²	74.2	56%	0.561	45%	0.452	S	S	*	.			trans	-78.5	73.9	172.6	-61.9	-86.5	0	0	0	110.2	L310 L313 N318	L310-Y315 HydrophobicContact CB-CD2 4.22Å; L310-Y315 HydrophobicContact CB-CG 4.49Å; L310-Y315 HydrophobicContact CD2-CD2 4.3Å; L310-Y315 HydrophobicContact CD2-CG 4.45Å; L310-Y315 HydrophobicContact CG-CD2 3.97Å; L310-Y315 HydrophobicContact CG-CG 4.47Å; L310-Y315 WeakPolarHBondContact O-CB 3.37Å; L310-Y315 PolarHBondContact O-N 2.9Å; L313-Y315 HydrophobicContact CB-CD2 3.86Å; L313-Y315 HydrophobicContact CB-CE2 3.97Å; Y315-N318 WeakPolarHBondContact O-CB 3.46Å; Y315-N318 PolarHBondContact O-N 2.86Å
316	L	57.1	Low	67.1	Low	165 Å²	165	74.8 Å²	74.8	86%	0.864	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	136.8	179.2	-68.8	171.4	0	0	0	111.7	G314 N318	G314-L316 PolarHBondContact O-N 2.82Å; L316-N318 VanDerWaalsContact C-N 3.29Å; L316-N318 PolarHBondContact O-N 2.97Å
317	G	62.9	Low	66.9	Low	86 Å²	86	73.7 Å²	73.7	89%	0.887	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.1	-5.9	-177.9	0	0	0	0	0	115.4
318	N	60.3	Low	66.9	Low	61 Å²	61	69.3 Å²	69.3	33%	0.326	43%	0.429	S	S	.	.			trans	-94.7	127	177.2	-163.9	-13.1	0	0	0	111.8	L310 Y315 L316 A320	L310-N318 HydrophobicContact CB-CB 4.33Å; L310-N318 WeakPolarHBondContact CD2-ND2 3.21Å; Y315-N318 WeakPolarHBondContact O-CB 3.46Å; Y315-N318 PolarHBondContact O-N 2.86Å; L316-N318 VanDerWaalsContact C-N 3.29Å; L316-N318 PolarHBondContact O-N 2.97Å; N318-A320 VanDerWaalsContact OD1-CB 3.24Å; N318-A320 WeakPolarHBondContact OD1-CB 3.34Å; N318-A320 PolarHBondContact OD1-N 3.01Å
319	T	61.7	Low	66.6	Low	142 Å²	142	67.9 Å²	67.9	87%	0.871	42%	0.421	S	S	*	.			trans	-99.3	6	176.9	61.8	0	0	0	0	113.5
320	A	68.1	Low	65.9	Low	45 Å²	45	64.3 Å²	64.3	37%	0.372	40%	0.402	S	S	.	.			trans	-74.3	145.4	175	0	0	0	0	0	111.6	L310 N318	L310-A320 WeakPolarHBondContact CB-O 3.23Å; L310-A320 PolarHBondContact N-O 2.77Å; N318-A320 VanDerWaalsContact OD1-CB 3.24Å; N318-A320 WeakPolarHBondContact OD1-CB 3.34Å; N318-A320 PolarHBondContact OD1-N 3.01Å
321	S	67.7	Low	65.1	Low	58 Å²	58	64.7 Å²	64.7	41%	0.406	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	140.4	170.9	64.2	0	0	0	0	110.6	D309	D309-S321 WeakPolarHBondContact OD1-CB 3.4Å
322	V	66	Low	64.3	Low	75 Å²	75	65.2 Å²	65.2	46%	0.455	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	122.3	170.7	158.6	0	0	0	0	109.7	T308 L310 T324	T308-V322 PolarHBondContact N-O 2.82Å; T308-V322 PolarHBondContact O-N 2.86Å; L310-V322 HydrophobicContact CD1-CB 3.98Å; L310-V322 HydrophobicContact CD1-CG2 3.54Å; V322-T324 HydrophobicContact CG1-CG2 4.08Å
323	T	67.7	Low	63.1	Low	43 Å²	43	62.5 Å²	62.5	26%	0.264	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	126.2	171.2	-50.1	0	0	0	0	109.8	I305 I307 M325	I305-T323 HydrophobicContact CD1-CG2 3.81Å; I305-T323 HydrophobicContact CG1-CG2 3.59Å; I307-T323 HydrophobicContact CG1-CG2 4.5Å; T323-M325 HydrophobicContact CG2-SD 4.34Å
324	T	69.7	Low	62.1	Low	38 Å²	38	59.9 Å²	59.9	23%	0.233	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	150.3	170.4	51.4	0	0	0	0	109.4	N306 V322	N306-T324 PolarHBondContact N-O 3.44Å; N306-T324 PolarHBondContact ND2-OG1 2.9Å; N306-T324 PolarHBondContact O-N 3.13Å; N306-T324 PolarHBondContact O-OG1 2.88Å; V322-T324 HydrophobicContact CG1-CG2 4.08Å
325	M	73.5	Confident	61	Low	1 Å²	1	60.2 Å²	60.2	1%	0.005	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	112.6	178	-72.7	66.7	67.8	0	0	107.9	A303 T323 P327 L437 K445 I446 S449 W452	A303-M325 HydrophobicContact CB-CB 3.73Å; A303-M325 HydrophobicContact CB-CG 4.35Å; T323-M325 HydrophobicContact CG2-SD 4.34Å; M325-P327 WeakPolarHBondContact O-CD 3.35Å; M325-L437 HydrophobicContact CG-CD1 4.5Å; M325-K445 WeakPolarHBondContact CE-O 3.4Å; M325-I446 VanDerWaalsContact CE-C 3.47Å; M325-I446 VanDerWaalsContact CE-O 3.26Å; M325-I446 WeakPolarHBondContact CE-O 3.36Å; M325-I446 PolarHBondContact N-O 2.66Å; M325-I446 WeakPolarHBondContact O-CB 3.32Å; M325-I446 WeakPolarHBondContact O-CG2 3.34Å; M325-S449 VanDerWaalsContact CE-N 3.35Å; M325-W452 HydrophobicContact CB-CD2 4.3Å; M325-W452 HydrophobicContact CB-CZ2 4.21Å; M325-W452 HydrophobicContact CE-CG 4.28Å; M325-W452 HydrophobicContact CG-CD2 3.84Å; M325-W452 HydrophobicContact CG-CE3 4.35Å; M325-W452 HydrophobicContact CG-CG 3.93Å
326	L	77.3	Confident	60.1	Low	91 Å²	91	62.7 Å²	62.7	48%	0.476	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	111.7	173.8	-66.6	177.5	0	0	0	108.1	A303 K304 N306 T328	A303-L326 CarbonylContact C-O 3.58Å; A303-L326 VanDerWaalsContact CA-O 3.26Å; A303-L326 WeakPolarHBondContact CA-O 3.43Å; A303-L326 VanDerWaalsContact CB-O 3.31Å; A303-L326 WeakPolarHBondContact CB-O 3.34Å; K304-L326 HydrophobicContact CB-CB 4.41Å; K304-L326 PolarHBondContact N-O 2.93Å; K304-L326 PolarHBondContact O-N 3.37Å; N306-L326 HydrophobicContact CB-CD1 3.68Å; N306-L326 HydrophobicContact CB-CG 3.75Å; L326-T328 PolarHBondContact O-N 3.13Å
327	P	76	Confident	59.4	Low	36 Å²	36	57.6 Å²	57.6	23%	0.234	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	140.3	178.7	-20	32	0	0	0	110.1	M325 S343 G345 I446	M325-P327 WeakPolarHBondContact O-CD 3.35Å; P327-S343 PolarHBondContact O-OG 2.75Å; P327-G345 VanDerWaalsContact CB-CA 3.46Å; P327-I446 HydrophobicContact CG-CG2 3.84Å
328	T	74.6	Confident	58.4	Low	3 Å²	3	57.8 Å²	57.8	2%	0.018	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-58.2	139.7	174.9	49.3	0	0	0	0	111.4	G302 L326 G345 V346 N433 P435	G302-T328 PolarHBondContact O-N 2.85Å; G302-T328 PolarHBondContact O-OG1 3.32Å; L326-T328 PolarHBondContact O-N 3.13Å; T328-G345 WeakPolarHBondContact O-CA 3.49Å; T328-G345 PolarHBondContact O-N 3.28Å; T328-G345 WeakPolarHBondContact OG1-CA 3.4Å; T328-V346 VanDerWaalsContact OG1-C 3.3Å; T328-V346 PolarHBondContact OG1-N 3.14Å; T328-V346 PolarHBondContact OG1-O 3.41Å; T328-N433 WeakPolarHBondContact CG2-O 3.28Å; T328-P435 HydrophobicContact CG2-CB 3.87Å
329	S	63.3	Low	57.4	Low	14 Å²	14	62.2 Å²	62.2	10%	0.098	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-72.2	145.3	168.1	52.2	0	0	0	0	110.4	M431 S432	S329-M431 CarbonylContact C-O 3.44Å; S329-M431 PolarHBondContact OG-O 2.88Å; S329-S432 WeakPolarHBondContact O-CA 3.09Å
330	N	55.7	Low	56.5	Low	11 Å²	11	60.8 Å²	60.8	6%	0.059	34%	0.339	C	S	.	.			trans	-102	-41.1	166	-69.4	6	0	0	0	110.6	I342 V346 N348 F430	N330-I342 PolarHBondContact N-O 2.7Å; N330-I342 VanDerWaalsContact N-O 3.08Å; N330-V346 WeakPolarHBondContact OD1-CB 3.23Å; N330-N348 PolarHBondContact OD1-ND2 2.83Å; N330-F430 WeakPolarHBondContact O-CA 3.42Å; N330-F430 WeakPolarHBondContact O-CD1 3.4Å
331	M	49.8	Very low	55.7	Low	38 Å²	38	64 Å²	64	19%	0.187	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	135.2	-167.1	-174.8	169.7	59	0	0	111.4	L333 I342 I428 F430	M331-L333 HydrophobicContact CE-CD1 3.63Å; M331-L333 HydrophobicContact CE-CG 4.01Å; M331-L333 HydrophobicContact CG-CG 4.19Å; M331-L333 HydrophobicContact SD-CD1 4.26Å; M331-L333 HydrophobicContact SD-CG 4Å; M331-I342 HydrophobicContact CE-CD1 3.53Å; M331-I342 HydrophobicContact CE-CG1 4.16Å; M331-I342 PolarHBondContact O-N 3.2Å; M331-I428 HydrophobicContact CG-CG2 3.44Å; M331-I428 VanDerWaalsContact CG-CG2 3.44Å; M331-I428 HydrophobicContact SD-CG2 3.53Å; M331-I428 VanDerWaalsContact SD-CG2 3.53Å; M331-F430 HydrophobicContact CB-CD1 4.08Å; M331-F430 HydrophobicContact CB-CE1 3.97Å; M331-F430 HydrophobicContact CG-CD1 4.21Å; M331-F430 HydrophobicContact CG-CE1 3.84Å; M331-F430 HydrophobicContact CG-CZ 4.16Å; M331-F430 HydrophobicContact SD-CE1 3.72Å; M331-F430 HydrophobicContact SD-CZ 3.73Å
332	K	47.4	Very low	54.8	Low	73 Å²	73	63.3 Å²	63.3	32%	0.317	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	82.7	173.1	-164.7	168.4	-167.9	158.4	0	109.1	S334 Q340 N429	K332-S334 PolarHBondContact O-N 2.81Å; K332-Q340 CarbonylContact C-O 3.05Å; K332-Q340 WeakPolarHBondContact CA-O 3.28Å; K332-N429 WeakPolarHBondContact CB-O 3.47Å; K332-N429 PolarHBondContact N-O 3.34Å
333	L	39.3	Very low	54.2	Low	28 Å²	28	62.2 Å²	62.2	15%	0.147	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	124.8	174.2	-89.2	164.6	0	0	0	109.5	M331 I335 V338 K339 Q340 I342 I428	M331-L333 HydrophobicContact CE-CD1 3.63Å; M331-L333 HydrophobicContact CE-CG 4.01Å; M331-L333 HydrophobicContact CG-CG 4.19Å; M331-L333 HydrophobicContact SD-CD1 4.26Å; M331-L333 HydrophobicContact SD-CG 4Å; L333-I335 HydrophobicContact CB-CD1 4.42Å; L333-I335 HydrophobicContact CB-CG1 4.25Å; L333-I335 HydrophobicContact CD1-CD1 4.32Å; L333-I335 HydrophobicContact CD2-CD1 4.15Å; L333-I335 HydrophobicContact CD2-CG1 3.99Å; L333-V338 VanDerWaalsContact O-O 3.06Å; L333-K339 CarbonylContact O-C 3.59Å; L333-K339 VanDerWaalsContact O-CA 3.3Å; L333-K339 WeakPolarHBondContact O-CA 3.44Å; L333-Q340 HydrophobicContact CB-CB 4.27Å; L333-Q340 PolarHBondContact N-O 3.17Å; L333-Q340 PolarHBondContact O-N 2.86Å; L333-I342 HydrophobicContact CD1-CD1 4.42Å; L333-I428 HydrophobicContact CD2-CD1 3.85Å; L333-I428 HydrophobicContact CD2-CG1 3.86Å; L333-I428 HydrophobicContact CD2-CG2 4.2Å; L333-I428 HydrophobicContact CG-CG2 4.44Å
334	S	41.5	Very low	53.9	Low	50 Å²	50	61.4 Å²	61.4	35%	0.35	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	51.5	176.4	-174.8	0	0	0	0	111.5	K332 K336	K332-S334 PolarHBondContact O-N 2.81Å; S334-K336 PolarHBondContact O-N 3.19Å
335	I	39.6	Very low	54.1	Low	64 Å²	64	59.6 Å²	59.6	33%	0.328	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	107.8	-176.8	-56.1	170.4	0	0	0	109.3	L333 G337 V338 L426	L333-I335 HydrophobicContact CB-CD1 4.42Å; L333-I335 HydrophobicContact CB-CG1 4.25Å; L333-I335 HydrophobicContact CD1-CD1 4.32Å; L333-I335 HydrophobicContact CD2-CD1 4.15Å; L333-I335 HydrophobicContact CD2-CG1 3.99Å; I335-G337 PolarHBondContact O-N 2.83Å; I335-G337 VanDerWaalsContact O-N 3.09Å; I335-V338 PolarHBondContact N-O 2.8Å; I335-V338 VanDerWaalsContact N-O 3.15Å; I335-V338 WeakPolarHBondContact O-CA 3.41Å; I335-V338 VanDerWaalsContact O-CB 3.32Å; I335-V338 WeakPolarHBondContact O-CB 3.4Å; I335-V338 PolarHBondContact O-N 2.83Å; I335-L426 HydrophobicContact CB-CD2 4.45Å; I335-L426 HydrophobicContact CG1-CD2 4.03Å; I335-L426 HydrophobicContact CG2-CD2 4.19Å
336	K	43.5	Very low	54.3	Low	195 Å²	195	59.7 Å²	59.7	85%	0.848	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	36.6	176.3	-58.5	-179.5	178.8	178.3	0	113.8	S334 V338	S334-K336 PolarHBondContact O-N 3.19Å; K336-V338 VanDerWaalsContact C-N 3.31Å; K336-V338 PolarHBondContact O-N 3.34Å
337	G	42.1	Very low	54.7	Low	57 Å²	57	55.5 Å²	55.5	59%	0.588	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.6	-12.9	-177.2	0	0	0	0	0	115.4	I335 K339	I335-G337 PolarHBondContact O-N 2.83Å; I335-G337 VanDerWaalsContact O-N 3.09Å; G337-K339 PolarHBondContact O-N 3.21Å
338	V	41	Very low	54.9	Low	91 Å²	91	54.7 Å²	54.7	55%	0.552	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	106.4	169.6	-175.1	0	0	0	0	108.6	L333 I335 K336 Q340	L333-V338 VanDerWaalsContact O-O 3.06Å; I335-V338 PolarHBondContact N-O 2.8Å; I335-V338 VanDerWaalsContact N-O 3.15Å; I335-V338 WeakPolarHBondContact O-CA 3.41Å; I335-V338 VanDerWaalsContact O-CB 3.32Å; I335-V338 WeakPolarHBondContact O-CB 3.4Å; I335-V338 PolarHBondContact O-N 2.83Å; K336-V338 VanDerWaalsContact C-N 3.31Å; K336-V338 PolarHBondContact O-N 3.34Å; V338-Q340 HydrophobicContact CG1-CG 4.35Å; V338-Q340 PolarHBondContact O-N 3.03Å
339	K	40.6	Very low	55.2	Low	153 Å²	153	54.5 Å²	54.5	67%	0.665	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	86.6	179.3	-70.6	171.8	-179.1	171.3	0	110.5	L333 G337 Q341	L333-K339 CarbonylContact O-C 3.59Å; L333-K339 VanDerWaalsContact O-CA 3.3Å; L333-K339 WeakPolarHBondContact O-CA 3.44Å; G337-K339 PolarHBondContact O-N 3.21Å; K339-Q341 PolarHBondContact O-N 3.08Å
340	Q	43.1	Very low	55.9	Low	112 Å²	112	53.9 Å²	53.9	52%	0.523	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	111.8	170.8	-85.4	-174.7	-20.3	0	0	110.4	K332 L333 V338	K332-Q340 CarbonylContact C-O 3.05Å; K332-Q340 WeakPolarHBondContact CA-O 3.28Å; L333-Q340 HydrophobicContact CB-CB 4.27Å; L333-Q340 PolarHBondContact N-O 3.17Å; L333-Q340 PolarHBondContact O-N 2.86Å; V338-Q340 HydrophobicContact CG1-CG 4.35Å; V338-Q340 PolarHBondContact O-N 3.03Å
341	Q	50.6	Low	56.8	Low	112 Å²	112	54.8 Å²	54.8	52%	0.523	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	110.8	170.9	177.1	171.9	-38.9	0	0	109.1	K339	K339-Q341 PolarHBondContact O-N 3.08Å
342	I	48.6	Very low	57.8	Low	45 Å²	45	54.2 Å²	54.2	23%	0.231	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	116.8	174	-51.5	-163	0	0	0	108.7	N330 M331 L333 N344	N330-I342 PolarHBondContact N-O 2.7Å; N330-I342 VanDerWaalsContact N-O 3.08Å; M331-I342 HydrophobicContact CE-CD1 3.53Å; M331-I342 HydrophobicContact CE-CG1 4.16Å; M331-I342 PolarHBondContact O-N 3.2Å; L333-I342 HydrophobicContact CD1-CD1 4.42Å; I342-N344 WeakPolarHBondContact CG2-ND2 3.26Å; I342-N344 WeakPolarHBondContact CG2-OD1 3.46Å
343	S	54.1	Low	58.9	Low	52 Å²	52	52.4 Å²	52.4	36%	0.364	30%	0.299	S	S	.	.			trans	-114.2	73.2	-166.3	-177.1	0	0	0	0	110.6	P327	P327-S343 PolarHBondContact O-OG 2.75Å
344	N	60.1	Low	60.5	Low	25 Å²	25	52.6 Å²	52.6	13%	0.134	30%	0.302	C	S	.	.			trans	-87.5	-6.1	-175.1	-63.1	-26.6	0	0	0	113.5	F286 I342 V346	F286-N344 HydrophobicContact CB-CB 4.31Å; F286-N344 WeakPolarHBondContact CD2-ND2 3.2Å; F286-N344 VanDerWaalsContact CE2-ND2 3.3Å; F286-N344 WeakPolarHBondContact CE2-ND2 3.09Å; F286-N344 HydrophobicContact CG-CB 4.42Å; F286-N344 WeakPolarHBondContact CG-ND2 3.03Å; I342-N344 WeakPolarHBondContact CG2-ND2 3.26Å; I342-N344 WeakPolarHBondContact CG2-OD1 3.46Å; N344-V346 HydrophobicContact CB-CG2 4.14Å
345	G	74.9	Confident	62	Low	1 Å²	1	50.2 Å²	50.2	1%	0.01	29%	0.286	C	S	.	.			trans	69.7	35.5	178.4	0	0	0	0	0	113.8	I301 G302 P327 T328	I301-G345 CarbonylContact C-O 3.53Å; I301-G345 WeakPolarHBondContact CA-O 3.29Å; G302-G345 PolarHBondContact N-O 2.89Å; G302-G345 CarbonylContact O-C 3.59Å; G302-G345 VanDerWaalsContact O-CA 3.31Å; G302-G345 WeakPolarHBondContact O-CA 3.43Å; P327-G345 VanDerWaalsContact CB-CA 3.46Å; T328-G345 WeakPolarHBondContact O-CA 3.49Å; T328-G345 PolarHBondContact O-N 3.28Å; T328-G345 WeakPolarHBondContact OG1-CA 3.4Å
346	V	77.8	Confident	63	Low	2 Å²	2	48.4 Å²	48.4	1%	0.012	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-100.3	138.6	-177.9	-177	0	0	0	0	111.3	P299 I300 T328 N330 N344 N348 P368	P299-V346 HydrophobicContact CB-CG1 3.7Å; P299-V346 HydrophobicContact CB-CG2 4.08Å; I300-V346 WeakPolarHBondContact O-CA 3.39Å; T328-V346 VanDerWaalsContact OG1-C 3.3Å; T328-V346 PolarHBondContact OG1-N 3.14Å; T328-V346 PolarHBondContact OG1-O 3.41Å; N330-V346 WeakPolarHBondContact OD1-CB 3.23Å; N344-V346 HydrophobicContact CB-CG2 4.14Å; V346-N348 PolarHBondContact O-ND2 2.95Å; V346-P368 HydrophobicContact CG1-CB 3.57Å
347	W	85	Confident	63.4	Low	4 Å²	4	40 Å²	40	2%	0.015	25%	0.247	C	C	.	.			trans	-82.4	114.6	164.6	-164.9	-5.1	0	0	0	109.1	I300 I369 K434 P435 L438 I455 I483 I485 I505	I300-W347 PolarHBondContact O-N 2.92Å; I300-W347 VanDerWaalsContact O-N 3.15Å; W347-I369 HydrophobicContact CB-CD1 4.2Å; W347-I369 HydrophobicContact CB-CG1 4.49Å; W347-I369 HydrophobicContact CD2-CD1 3.44Å; W347-I369 VanDerWaalsContact CD2-CD1 3.44Å; W347-I369 HydrophobicContact CE3-CD1 3.63Å; W347-I369 HydrophobicContact CG-CD1 3.67Å; W347-I369 HydrophobicContact CG-CG1 4.33Å; W347-I369 HydrophobicContact CZ2-CD1 4.49Å; W347-I369 HydrophobicContact CZ3-CD1 4.27Å; W347-I369 PolarHBondContact O-N 2.04Å; W347-K434 HydrophobicContact CZ2-CG 4.09Å; W347-P435 HydrophobicContact CB-CG 3.9Å; W347-P435 VanDerWaalsContact CD1-CD 3.47Å; W347-P435 HydrophobicContact CD2-CG 3.71Å; W347-P435 HydrophobicContact CE3-CG 4.14Å; W347-P435 HydrophobicContact CG-CG 3.64Å; W347-L438 HydrophobicContact CD2-CD2 4.5Å; W347-L438 HydrophobicContact CE3-CD1 4.14Å; W347-L438 HydrophobicContact CE3-CD2 3.65Å; W347-L438 HydrophobicContact CE3-CG 4.42Å; W347-L438 HydrophobicContact CZ3-CD1 4.06Å; W347-L438 HydrophobicContact CZ3-CD2 4.14Å; W347-L438 HydrophobicContact CZ3-CG 4.48Å; W347-I455 HydrophobicContact CE3-CD1 4.31Å; W347-I455 HydrophobicContact CH2-CD1 3.96Å; W347-I455 HydrophobicContact CH2-CG2 4.41Å; W347-I455 HydrophobicContact CZ3-CD1 3.84Å; W347-I455 HydrophobicContact CZ3-CG1 4.38Å; W347-I483 HydrophobicContact CE3-CG2 4.5Å; W347-I483 HydrophobicContact CH2-CB 4.26Å; W347-I483 HydrophobicContact CH2-CD1 4.02Å; W347-I483 HydrophobicContact CH2-CG1 3.88Å; W347-I483 HydrophobicContact CH2-CG2 3.38Å; W347-I483 HydrophobicContact CZ2-CD1 3.56Å; W347-I483 HydrophobicContact CZ2-CG1 3.85Å; W347-I483 HydrophobicContact CZ2-CG2 4.11Å; W347-I483 HydrophobicContact CZ3-CG2 3.6Å; W347-I485 HydrophobicContact CE3-CD1 4.47Å; W347-I485 HydrophobicContact CZ3-CD1 4.29Å; W347-I505 HydrophobicContact CH2-CD1 3.87Å; W347-I505 HydrophobicContact CH2-CG1 4.12Å; W347-I505 HydrophobicContact CZ2-CD1 3.81Å; W347-I505 HydrophobicContact CZ2-CG1 4.47Å
348	N	79.7	Confident	63.7	Low	18 Å²	18	41.3 Å²	41.3	10%	0.096	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	153.5	171.9	-51.2	-83.5	0	0	0	111.1	N330 V346 V366 E367 P368 S432	N330-N348 PolarHBondContact OD1-ND2 2.83Å; V346-N348 PolarHBondContact O-ND2 2.95Å; N348-V366 HydrophobicContact CB-CB 4.43Å; N348-E367 CarbonylContact C-O 3.58Å; N348-E367 WeakPolarHBondContact CA-O 3.36Å; N348-E367 WeakPolarHBondContact CB-O 3.49Å; N348-P368 VanDerWaalsContact OD1-CA 3.24Å; N348-P368 WeakPolarHBondContact OD1-CA 3.32Å; N348-S432 WeakPolarHBondContact ND2-CB 3.1Å; N348-S432 PolarHBondContact ND2-OG 3Å
349	I	81.5	Confident	63.7	Low	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	166.4	178.9	47.1	166.9	0	0	0	110.2	V366 E367 I369 V375 I483 Q525 V527	I349-V366 CarbonylContact O-C 3.42Å; I349-V366 WeakPolarHBondContact O-CA 3.43Å; I349-V366 WeakPolarHBondContact O-CB 3.03Å; I349-E367 HydrophobicContact CD1-CG 4.32Å; I349-E367 HydrophobicContact CG1-CG 4.02Å; I349-E367 WeakPolarHBondContact CG1-O 2.98Å; I349-E367 PolarHBondContact N-O 2.85Å; I349-E367 PolarHBondContact O-N 3.41Å; I349-I369 HydrophobicContact CB-CG1 4.35Å; I349-I369 HydrophobicContact CD1-CG1 4.26Å; I349-I369 HydrophobicContact CG1-CG1 4.03Å; I349-I369 HydrophobicContact CG2-CD1 3.68Å; I349-I369 HydrophobicContact CG2-CG1 3.52Å; I349-V375 HydrophobicContact CD1-CB 4.24Å; I349-V375 HydrophobicContact CD1-CG1 3.77Å; I349-I483 HydrophobicContact CG2-CD1 4.02Å; I349-Q525 VanDerWaalsContact CA-OE1 3.29Å; I349-V527 HydrophobicContact CD1-CG2 4.03Å; I349-V527 HydrophobicContact CG2-CG2 4.2Å
350	L	78.6	Confident	63.6	Low	0 Å²	0	40.1 Å²	40.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	140.5	171.8	-53.1	170.8	0	0	0	109.6	L364 S377 L411 P414 I523 Q525	L350-L364 HydrophobicContact CD2-CD1 3.83Å; L350-L364 HydrophobicContact CD2-CD2 3.85Å; L350-L364 HydrophobicContact CD2-CG 4.32Å; L350-S377 WeakPolarHBondContact O-CB 3.32Å; L350-S377 PolarHBondContact O-OG 2.99Å; L350-L411 HydrophobicContact CD1-CD2 4.17Å; L350-P414 HydrophobicContact CD2-CB 3.89Å; L350-I523 HydrophobicContact CD1-CB 4.36Å; L350-I523 HydrophobicContact CD1-CG2 3.92Å; L350-Q525 HydrophobicContact CD1-CG 3.98Å; L350-Q525 HydrophobicContact CG-CG 4.33Å
351	A	73.4	Confident	63.6	Low	30 Å²	30	41.9 Å²	41.9	25%	0.248	25%	0.246	C	C	.	.			trans	-134.8	31.4	-176.3	0	0	0	0	0	112.7	L365 E367	A351-L365 HydrophobicContact CB-CB 4.01Å; A351-L365 PolarHBondContact N-O 3.48Å; A351-L365 WeakPolarHBondContact O-CB 3.38Å; A351-E367 HydrophobicContact CB-CB 3.84Å; A351-E367 HydrophobicContact CB-CG 3.89Å
352	G	71.6	Confident	63.1	Low	26 Å²	26	46.7 Å²	46.7	27%	0.268	26%	0.26	S	S	.	.	S	Bend	trans	98.8	-169.8	-176.8	0	0	0	0	0	114.1	L365 G378	G352-L365 PolarHBondContact O-N 3.21Å; G352-L365 VanDerWaalsContact O-N 3.16Å; G352-G378 WeakPolarHBondContact CA-O 2.99Å; G352-G378 PolarHBondContact N-O 2.03Å
353	G	71.4	Confident	63	Low	36 Å²	36	45 Å²	45	37%	0.371	25%	0.254	S	S	.	.	S	Bend	trans	77.9	-165.1	-171.9	0	0	0	0	0	112.9	I380	G353-I380 PolarHBondContact O-N 2.88Å
354	S	71.7	Confident	62.8	Low	32 Å²	32	43 Å²	43	22%	0.224	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-103.8	133.3	-177.9	173	0	0	0	0	111.3	T357 I380	S354-T357 WeakPolarHBondContact CB-OG1 3.39Å; S354-T357 PolarHBondContact O-OG1 3.46Å; S354-T357 PolarHBondContact OG-OG1 3.4Å; S354-I380 CarbonylContact C-O 3.56Å; S354-I380 WeakPolarHBondContact CA-O 3.02Å; S354-I380 PolarHBondContact OG-O 2.84Å
355	C	72.3	Confident	63	Low	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.257	C	S	.	.	S	Bend	trans	-72.7	144.7	-178.9	-44.1	0	0	0	0	111.2	T357 C379 I380 L381 I523	C355-T357 PolarHBondContact O-N 3.25Å; C355-C379 HydrophobicContact CB-CB 4.21Å; C355-C379 WeakPolarHBondContact CB-SG 3.39Å; C355-C379 WeakPolarHBondContact SG-CB 3.33Å; C355-C379 PolarHBondContact SG-O 3.33Å; C355-C379 CovalentContact SG-SG 2.03Å; C355-C379 PolarHBondContact SG-SG 3.06Å; C355-I380 PolarHBondContact N-O 3.41Å; C355-I380 PolarHBondContact SG-N 2.84Å; C355-L381 HydrophobicContact CB-CB 3.92Å; C355-L381 HydrophobicContact CB-CD1 3.8Å; C355-L381 HydrophobicContact CB-CG 4.47Å; C355-L381 PolarHBondContact SG-N 3.4Å; C355-I523 HydrophobicContact CB-CD1 3.95Å; C355-I523 WeakPolarHBondContact SG-CD1 3.48Å
356	G	60.9	Low	62.8	Low	26 Å²	26	48.5 Å²	48.5	27%	0.268	27%	0.268	S	S	.	.	S	Bend	trans	67	-21	175.5	0	0	0	0	0	116.4	V358 F385 N410	G356-V358 PolarHBondContact O-N 2.82Å; G356-F385 VanDerWaalsContact C-CZ 3.5Å; G356-F385 WeakPolarHBondContact O-CE2 3.47Å; G356-F385 WeakPolarHBondContact O-CZ 3.38Å; G356-N410 PolarHBondContact N-OD1 2.95Å
357	T	53.3	Low	62.4	Low	17 Å²	17	51.4 Å²	51.4	10%	0.104	28%	0.282	C	S	.	.			trans	-80.5	112.1	-179.2	49.6	0	0	0	0	111.9	S354 C355 L359 F385	S354-T357 WeakPolarHBondContact CB-OG1 3.39Å; S354-T357 PolarHBondContact O-OG1 3.46Å; S354-T357 PolarHBondContact OG-OG1 3.4Å; C355-T357 PolarHBondContact O-N 3.25Å; T357-L359 HydrophobicContact CG2-CD1 3.89Å; T357-L359 HydrophobicContact CG2-CG 4.33Å; T357-L359 PolarHBondContact O-N 2.88Å; T357-L359 VanDerWaalsContact O-N 3.07Å; T357-F385 HydrophobicContact CG2-CB 4.4Å; T357-F385 HydrophobicContact CG2-CD2 3.91Å; T357-F385 HydrophobicContact CG2-CG 4.26Å
358	V	47.6	Very low	62.1	Low	85 Å²	85	52.5 Å²	52.5	52%	0.515	29%	0.29	S	S	.	.			trans	-74.1	18.2	169.5	175.9	0	0	0	0	112	G356 Q360 I417	G356-V358 PolarHBondContact O-N 2.82Å; V358-Q360 PolarHBondContact O-N 3.4Å; V358-I417 HydrophobicContact CB-CD1 4.4Å; V358-I417 HydrophobicContact CG1-CB 4.21Å; V358-I417 HydrophobicContact CG1-CD1 3.5Å; V358-I417 HydrophobicContact CG1-CG1 4.39Å; V358-I417 HydrophobicContact CG1-CG2 4.18Å; V358-I417 HydrophobicContact CG2-CD1 4.05Å
359	L	40.4	Very low	62.3	Low	117 Å²	117	51.7 Å²	51.7	61%	0.613	29%	0.285	S	S	*	.			trans	-66.4	133.4	-165.1	-72	172.1	0	0	0	112.7	T357 E361 R362	T357-L359 HydrophobicContact CG2-CD1 3.89Å; T357-L359 HydrophobicContact CG2-CG 4.33Å; T357-L359 PolarHBondContact O-N 2.88Å; T357-L359 VanDerWaalsContact O-N 3.07Å; L359-E361 PolarHBondContact O-N 3.47Å; L359-R362 PolarHBondContact O-N 2.92Å
360	Q	39.8	Very low	62.3	Low	102 Å²	102	55.4 Å²	55.4	48%	0.477	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-2.5	-154.3	-62.6	170	-31.1	0	0	116.8	V358 N419 E420	V358-Q360 PolarHBondContact O-N 3.4Å; Q360-N419 WeakPolarHBondContact O-CA 3.37Å; Q360-N419 WeakPolarHBondContact O-CB 3.31Å; Q360-E420 HydrophobicContact CB-CB 4.14Å; Q360-E420 HydrophobicContact CG-CB 3.95Å; Q360-E420 PolarHBondContact NE2-OE1 3.11Å; Q360-E420 PolarHBondContact NE2-OE2 3.22Å
361	E	41.4	Very low	62.7	Low	149 Å²	149	55.5 Å²	55.5	70%	0.696	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.7	-28.9	-174.8	-66.2	-178.1	-168	0	0	114.5	L359 N419	L359-E361 PolarHBondContact O-N 3.47Å; E361-N419 PolarHBondContact O-ND2 3.23Å; E361-N419 PolarHBondContact O-OD1 2.87Å
362	R	41.5	Very low	63.3	Low	214 Å²	214	55.2 Å²	55.2	81%	0.808	30%	0.3	S	S	*	.	S	Bend	trans	-153.7	71.8	-176.5	-65.2	-170	-174.2	175.7	3	110.8	L359	L359-R362 PolarHBondContact O-N 2.92Å
363	G	46.1	Very low	63.9	Low	10 Å²	10	56.1 Å²	56.1	10%	0.103	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-62.1	173.8	172.4	0	0	0	0	0	113.1	L365	G363-L365 PolarHBondContact O-N 2.72Å
364	L	50.8	Low	64.8	Low	8 Å²	8	59.3 Å²	59.3	4%	0.042	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-56.7	123.7	174.9	175.9	62.3	0	0	0	110.9	L350 V366 C379 P414	L350-L364 HydrophobicContact CD2-CD1 3.83Å; L350-L364 HydrophobicContact CD2-CD2 3.85Å; L350-L364 HydrophobicContact CD2-CG 4.32Å; L364-V366 HydrophobicContact CD2-CG1 4.48Å; L364-V366 HydrophobicContact CG-CG1 4.35Å; L364-C379 HydrophobicContact CD1-CB 3.45Å; L364-C379 VanDerWaalsContact CD1-CB 3.45Å; L364-P414 HydrophobicContact CD2-CB 3.66Å
365	L	62.4	Low	65.5	Low	102 Å²	102	59.3 Å²	59.3	53%	0.534	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-81.7	138.5	173	-63.1	175.9	0	0	0	109.3	A351 G352 G363	A351-L365 HydrophobicContact CB-CB 4.01Å; A351-L365 PolarHBondContact N-O 3.48Å; A351-L365 WeakPolarHBondContact O-CB 3.38Å; G352-L365 PolarHBondContact O-N 3.21Å; G352-L365 VanDerWaalsContact O-N 3.16Å; G363-L365 PolarHBondContact O-N 2.72Å
366	V	71.4	Confident	66.2	Low	40 Å²	40	65.3 Å²	65.3	24%	0.242	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	143.9	172.5	-65.5	0	0	0	0	110.3	N348 I349 L364 P414	N348-V366 HydrophobicContact CB-CB 4.43Å; I349-V366 CarbonylContact O-C 3.42Å; I349-V366 WeakPolarHBondContact O-CA 3.43Å; I349-V366 WeakPolarHBondContact O-CB 3.03Å; L364-V366 HydrophobicContact CD2-CG1 4.48Å; L364-V366 HydrophobicContact CG-CG1 4.35Å; V366-P414 HydrophobicContact CG1-CB 3.82Å; V366-P414 HydrophobicContact CG1-CG 4.18Å
367	E	70.2	Confident	67.4	Low	64 Å²	64	64.7 Å²	64.7	30%	0.299	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	152.9	177.5	81.8	177.2	128	0	0	111.6	N348 I349 A351	N348-E367 CarbonylContact C-O 3.58Å; N348-E367 WeakPolarHBondContact CA-O 3.36Å; N348-E367 WeakPolarHBondContact CB-O 3.49Å; I349-E367 HydrophobicContact CD1-CG 4.32Å; I349-E367 HydrophobicContact CG1-CG 4.02Å; I349-E367 WeakPolarHBondContact CG1-O 2.98Å; I349-E367 PolarHBondContact N-O 2.85Å; I349-E367 PolarHBondContact O-N 3.41Å; A351-E367 HydrophobicContact CB-CB 3.84Å; A351-E367 HydrophobicContact CB-CG 3.89Å
368	P	78.1	Confident	68.9	Low	27 Å²	27	64.4 Å²	64.4	18%	0.175	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	138.1	177.6	29.7	-36.7	0	0	0	111.2	P299 V346 N348 R370	P299-P368 HydrophobicContact CB-CB 3.91Å; P299-P368 HydrophobicContact CG-CB 4.15Å; P299-P368 HydrophobicContact CG-CG 4.36Å; V346-P368 HydrophobicContact CG1-CB 3.57Å; N348-P368 VanDerWaalsContact OD1-CA 3.24Å; N348-P368 WeakPolarHBondContact OD1-CA 3.32Å; P368-R370 PolarHBondContact O-N 3.02Å; P368-R370 VanDerWaalsContact O-N 3.13Å
369	I	83.9	Confident	70.5	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-60.6	120.2	165.2	-61.2	-176.1	0	0	0	108	P299 I300 W347 I349 I483 I485 V527 F529	P299-I369 CarbonylContact C-O 3.5Å; P299-I369 WeakPolarHBondContact CA-O 3.33Å; I300-I369 HydrophobicContact CD1-CG2 3.94Å; I300-I369 HydrophobicContact CG1-CG2 4.39Å; I300-I369 PolarHBondContact N-O 2.86Å; W347-I369 HydrophobicContact CB-CD1 4.2Å; W347-I369 HydrophobicContact CB-CG1 4.49Å; W347-I369 HydrophobicContact CD2-CD1 3.44Å; W347-I369 VanDerWaalsContact CD2-CD1 3.44Å; W347-I369 HydrophobicContact CE3-CD1 3.63Å; W347-I369 HydrophobicContact CG-CD1 3.67Å; W347-I369 HydrophobicContact CG-CG1 4.33Å; W347-I369 HydrophobicContact CZ2-CD1 4.49Å; W347-I369 HydrophobicContact CZ3-CD1 4.27Å; W347-I369 PolarHBondContact O-N 2.04Å; I349-I369 HydrophobicContact CB-CG1 4.35Å; I349-I369 HydrophobicContact CD1-CG1 4.26Å; I349-I369 HydrophobicContact CG1-CG1 4.03Å; I349-I369 HydrophobicContact CG2-CD1 3.68Å; I349-I369 HydrophobicContact CG2-CG1 3.52Å; I369-I483 HydrophobicContact CD1-CD1 4.13Å; I369-I483 HydrophobicContact CD1-CG2 4.41Å; I369-I485 HydrophobicContact CG2-CD1 4.21Å; I369-V527 HydrophobicContact CD1-CG2 4Å; I369-V527 HydrophobicContact CG1-CG2 4.19Å; I369-V527 HydrophobicContact CG2-CG1 3.83Å; I369-F529 HydrophobicContact CG2-CE2 4.4Å; I369-F529 HydrophobicContact CG2-CZ 3.99Å
370	R	82.2	Confident	72.5	Confident	79 Å²	79	59 Å²	59	30%	0.298	29%	0.288	S	S	.	.	B	Isolated β-bridge	trans	-91.7	131.5	178	-66.1	177	-171.5	-81.3	-1.6	109.8	G297 R298 P368 G372 E373 F529	G297-R370 PolarHBondContact O-NH1 2.91Å; R298-R370 CarbonylContact O-C 3.59Å; R298-R370 WeakPolarHBondContact O-CA 3.36Å; P368-R370 PolarHBondContact O-N 3.02Å; P368-R370 VanDerWaalsContact O-N 3.13Å; R370-G372 PolarHBondContact O-N 3.04Å; R370-E373 HydrophobicContact CB-CB 4.15Å; R370-E373 HydrophobicContact CB-CG 4.47Å; R370-E373 WeakPolarHBondContact CB-OE2 3.44Å; R370-E373 WeakPolarHBondContact CD-OE2 3.3Å; R370-E373 PolarHBondContact O-N 3.29Å; R370-F529 WeakPolarHBondContact O-CE2 3.38Å; R370-F529 WeakPolarHBondContact O-CZ 3.45Å
371	F	86.1	Confident	74.6	Confident	1 Å²	1	54.1 Å²	54.1	0%	0.004	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	131.9	-179.7	178.1	-90.7	0	0	0	111	Y294 I296 G297 R298 I300 E373 Y487 N498 I500 F529	Y294-F371 HydrophobicContact CD1-CB 4.16Å; Y294-F371 HydrophobicContact CD1-CD2 4.02Å; Y294-F371 HydrophobicContact CD1-CG 4.14Å; Y294-F371 HydrophobicContact CD2-CD2 4.44Å; Y294-F371 HydrophobicContact CD2-CE2 4.5Å; Y294-F371 AromaticContact CG-CD2 3.79Å; Y294-F371 HydrophobicContact CG-CD2 3.79Å; Y294-F371 HydrophobicContact CG-CE2 4.14Å; Y294-F371 HydrophobicContact CG-CG 4.1Å; I296-F371 VanDerWaalsContact CA-O 3.29Å; I296-F371 WeakPolarHBondContact CA-O 3.19Å; I296-F371 HydrophobicContact CG1-CD1 4.43Å; G297-F371 PolarHBondContact N-O 2.82Å; R298-F371 PolarHBondContact O-N 2.92Å; I300-F371 HydrophobicContact CD1-CB 4.3Å; I300-F371 HydrophobicContact CD1-CD2 4.16Å; I300-F371 HydrophobicContact CG1-CB 3.97Å; I300-F371 HydrophobicContact CG1-CD2 4.39Å; F371-E373 PolarHBondContact O-N 3.48Å; F371-Y487 HydrophobicContact CE1-CD2 4.41Å; F371-Y487 HydrophobicContact CE2-CD1 4.48Å; F371-Y487 HydrophobicContact CE2-CD2 4.35Å; F371-Y487 AromaticContact CE2-CG 3.95Å; F371-Y487 HydrophobicContact CE2-CG 3.95Å; F371-Y487 HydrophobicContact CZ-CD1 4.22Å; F371-Y487 AromaticContact CZ-CD2 3.55Å; F371-Y487 HydrophobicContact CZ-CD2 3.55Å; F371-Y487 HydrophobicContact CZ-CE2 4.09Å; F371-Y487 AromaticContact CZ-CG 3.59Å; F371-Y487 HydrophobicContact CZ-CG 3.59Å; F371-N498 HydrophobicContact CE1-CB 3.82Å; F371-N498 HydrophobicContact CZ-CB 3.57Å; F371-I500 HydrophobicContact CE2-CG1 4.29Å; F371-F529 HydrophobicContact CD2-CE1 4.04Å; F371-F529 HydrophobicContact CE2-CE1 4.47Å
372	G	86.6	Confident	76.4	Confident	25 Å²	25	48.2 Å²	48.2	26%	0.258	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.7	7	175	0	0	0	0	0	115.5	R370	R370-G372 PolarHBondContact O-N 3.04Å
373	E	83.7	Confident	78.2	Confident	45 Å²	45	38.6 Å²	38.6	21%	0.21	21%	0.205	C	C	.	.			trans	-113.4	110	175.8	-67.9	175.6	175.7	0	0	108.4	Y150 I296 G297 R370 F371 F529	Y150-E373 WeakPolarHBondContact CE2-OE1 3.45Å; Y150-E373 VanDerWaalsContact CZ-OE1 3.25Å; Y150-E373 PolarHBondContact OH-OE1 2.84Å; I296-E373 HydrophobicContact CG2-CG 4.08Å; G297-E373 VanDerWaalsContact CA-CD 3.4Å; G297-E373 WeakPolarHBondContact CA-OE1 3.49Å; R370-E373 HydrophobicContact CB-CB 4.15Å; R370-E373 HydrophobicContact CB-CG 4.47Å; R370-E373 WeakPolarHBondContact CB-OE2 3.44Å; R370-E373 WeakPolarHBondContact CD-OE2 3.3Å; R370-E373 PolarHBondContact O-N 3.29Å; F371-E373 PolarHBondContact O-N 3.48Å; E373-F529 VanDerWaalsContact O-CE2 3.29Å; E373-F529 WeakPolarHBondContact O-CE2 3.07Å
374	D	90.8	Very high	79.7	Confident	102 Å²	102	41.7 Å²	41.7	55%	0.545	23%	0.225	S	C	.	.			trans	-68	134.4	175.5	-82.5	12.1	0	0	0	110.3	V527 R528 F529	D374-V527 WeakPolarHBondContact CA-O 3.31Å; D374-R528 WeakPolarHBondContact OD1-CA 3.44Å; D374-F529 PolarHBondContact OD1-N 2.93Å
375	V	85.9	Confident	80.8	Confident	33 Å²	33	42.7 Å²	42.7	20%	0.2	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	134.9	-174.4	178.9	0	0	0	0	111.1	I349 R526 V527	I349-V375 HydrophobicContact CD1-CB 4.24Å; I349-V375 HydrophobicContact CD1-CG1 3.77Å; V375-R526 CarbonylContact O-C 3.56Å; V375-R526 WeakPolarHBondContact O-CA 3.01Å; V375-V527 HydrophobicContact CB-CB 4.32Å; V375-V527 PolarHBondContact N-O 2.96Å; V375-V527 PolarHBondContact O-N 2.8Å
376	Y	87.7	Confident	81.5	Confident	125 Å²	125	37.9 Å²	37.9	49%	0.49	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	121.3	160.5	179.4	-90.1	0	0	0	108.8	E522 T524 R526	Y376-E522 PolarHBondContact OH-OE1 2.81Å; Y376-T524 HydrophobicContact CE2-CG2 4.5Å; Y376-T524 WeakPolarHBondContact OH-CG2 3.43Å; Y376-R526 HydrophobicContact CD2-CG 3.81Å; Y376-R526 HydrophobicContact CE2-CG 4.12Å
377	S	85.6	Confident	81.8	Confident	14 Å²	14	40.9 Å²	40.9	10%	0.098	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	-177.4	-177.3	72	0	0	0	0	111.6	L350 Q525	L350-S377 WeakPolarHBondContact O-CB 3.32Å; L350-S377 PolarHBondContact O-OG 2.99Å; S377-Q525 PolarHBondContact N-O 2.86Å; S377-Q525 PolarHBondContact O-N 2.87Å; S377-Q525 VanDerWaalsContact O-O 3.13Å
378	G	84.2	Confident	82.2	Confident	11 Å²	11	44.5 Å²	44.5	11%	0.113	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174	-169.1	-179	0	0	0	0	0	113.4	G352 I523	G352-G378 WeakPolarHBondContact CA-O 2.99Å; G352-G378 PolarHBondContact N-O 2.03Å; G378-I523 CarbonylContact C-O 3.46Å; G378-I523 WeakPolarHBondContact CA-O 3.33Å
379	C	82.2	Confident	82.2	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.014	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	164.2	167	63.7	0	0	0	0	110.4	C355 L364 E522 I523	C355-C379 HydrophobicContact CB-CB 4.21Å; C355-C379 WeakPolarHBondContact CB-SG 3.39Å; C355-C379 WeakPolarHBondContact SG-CB 3.33Å; C355-C379 PolarHBondContact SG-O 3.33Å; C355-C379 CovalentContact SG-SG 2.03Å; C355-C379 PolarHBondContact SG-SG 3.06Å; L364-C379 HydrophobicContact CD1-CB 3.45Å; L364-C379 VanDerWaalsContact CD1-CB 3.45Å; C379-E522 WeakPolarHBondContact O-CA 3.27Å; C379-I523 PolarHBondContact N-O 3.05Å; C379-I523 PolarHBondContact O-N 2.03Å
380	I	82.9	Confident	82.1	Confident	85 Å²	85	49.3 Å²	49.3	44%	0.436	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	114.7	-179.4	-55.7	-178.6	0	0	0	110.4	G353 S354 C355 N520 I521	G353-I380 PolarHBondContact O-N 2.88Å; S354-I380 CarbonylContact C-O 3.56Å; S354-I380 WeakPolarHBondContact CA-O 3.02Å; S354-I380 PolarHBondContact OG-O 2.84Å; C355-I380 PolarHBondContact N-O 3.41Å; C355-I380 PolarHBondContact SG-N 2.84Å; I380-N520 HydrophobicContact CG2-CB 3.67Å; I380-I521 CarbonylContact C-O 3.59Å
381	L	82.3	Confident	82.1	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	114.9	173.7	-175.7	69.5	0	0	0	109.5	C355 F385 L386 I406 I407 I521 I523	C355-L381 HydrophobicContact CB-CB 3.92Å; C355-L381 HydrophobicContact CB-CD1 3.8Å; C355-L381 HydrophobicContact CB-CG 4.47Å; C355-L381 PolarHBondContact SG-N 3.4Å; L381-F385 HydrophobicContact CD1-CD1 3.68Å; L381-F385 HydrophobicContact CD1-CE1 4.03Å; L381-L386 HydrophobicContact CD1-CG 4.43Å; L381-L386 HydrophobicContact CD2-CD1 3.77Å; L381-L386 HydrophobicContact CD2-CD2 3.88Å; L381-L386 HydrophobicContact CD2-CG 3.85Å; L381-L386 HydrophobicContact CG-CD1 4.2Å; L381-L386 HydrophobicContact CG-CD2 4.42Å; L381-L386 HydrophobicContact CG-CG 4.03Å; L381-I406 HydrophobicContact CD1-CG2 4.38Å; L381-I407 HydrophobicContact CD2-CD1 4.12Å; L381-I407 HydrophobicContact CD2-CG1 3.58Å; L381-I521 HydrophobicContact CB-CB 4.5Å; L381-I521 PolarHBondContact N-O 2.81Å; L381-I521 PolarHBondContact O-N 3.39Å; L381-I523 HydrophobicContact CB-CD1 4.17Å; L381-I523 HydrophobicContact CB-CG1 4.2Å; L381-I523 HydrophobicContact CD2-CD1 4.2Å
382	S	80.8	Confident	81.8	Confident	25 Å²	25	60 Å²	60	18%	0.175	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	141.1	178.3	-165.8	0	0	0	0	112.5	S384 F385 L386 N520	S382-S384 VanDerWaalsContact C-N 3.26Å; S382-S384 PolarHBondContact O-N 2.78Å; S382-S384 PolarHBondContact OG-OG 2.84Å; S382-F385 WeakPolarHBondContact O-CB 3.37Å; S382-F385 PolarHBondContact O-N 2.91Å; S382-F385 VanDerWaalsContact O-N 3.12Å; S382-L386 PolarHBondContact O-N 2.6Å; S382-N520 WeakPolarHBondContact CA-OD1 3.34Å; S382-N520 WeakPolarHBondContact CB-OD1 3.44Å; S382-N520 PolarHBondContact OG-OD1 3.19Å
383	L	78.6	Confident	81.8	Confident	12 Å²	12	67.5 Å²	67.5	6%	0.063	34%	0.336	C	S	.	.	H	α-helix	trans	-61	-35.9	172.8	-177.8	53.2	0	0	0	112.2	F385 L386 E387 F514 F519	L383-F385 PolarHBondContact O-N 3.11Å; L383-F385 VanDerWaalsContact O-N 3.15Å; L383-L386 HydrophobicContact CD1-CB 4.19Å; L383-L386 PolarHBondContact O-N 2.82Å; L383-L386 VanDerWaalsContact O-N 3.09Å; L383-E387 HydrophobicContact CD1-CG 3.83Å; L383-E387 HydrophobicContact CG-CG 4.06Å; L383-E387 WeakPolarHBondContact O-CG 3.3Å; L383-E387 PolarHBondContact O-N 2.78Å; L383-F514 HydrophobicContact CD1-CD1 3.62Å; L383-F514 HydrophobicContact CD1-CE1 4.18Å; L383-F514 HydrophobicContact CD2-CD1 4.45Å; L383-F514 WeakPolarHBondContact CD2-O 3.46Å; L383-F519 HydrophobicContact CB-CB 4.43Å; L383-F519 WeakPolarHBondContact CB-O 3.37Å; L383-F519 HydrophobicContact CD2-CB 4.13Å; L383-F519 PolarHBondContact N-O 3.37Å
384	S	76.9	Confident	82.1	Confident	76 Å²	76	67.4 Å²	67.4	53%	0.531	34%	0.336	S	S	.	.	H	α-helix	trans	-67.9	-12.8	177.8	65.2	0	0	0	0	113.9	S382 Q388	S382-S384 VanDerWaalsContact C-N 3.26Å; S382-S384 PolarHBondContact O-N 2.78Å; S382-S384 PolarHBondContact OG-OG 2.84Å; S384-Q388 WeakPolarHBondContact O-CG 3.41Å; S384-Q388 PolarHBondContact O-NE2 2.88Å
385	F	73.8	Confident	82.1	Confident	29 Å²	29	66.4 Å²	66.4	13%	0.127	33%	0.331	C	S	.	.	H	α-helix	trans	-87	-47.8	166.7	173	-95.8	0	0	0	110.9	G356 T357 L381 S382 L383 E387 Q388 F389 I406	G356-F385 VanDerWaalsContact C-CZ 3.5Å; G356-F385 WeakPolarHBondContact O-CE2 3.47Å; G356-F385 WeakPolarHBondContact O-CZ 3.38Å; T357-F385 HydrophobicContact CG2-CB 4.4Å; T357-F385 HydrophobicContact CG2-CD2 3.91Å; T357-F385 HydrophobicContact CG2-CG 4.26Å; L381-F385 HydrophobicContact CD1-CD1 3.68Å; L381-F385 HydrophobicContact CD1-CE1 4.03Å; S382-F385 WeakPolarHBondContact O-CB 3.37Å; S382-F385 PolarHBondContact O-N 2.91Å; S382-F385 VanDerWaalsContact O-N 3.12Å; L383-F385 PolarHBondContact O-N 3.11Å; L383-F385 VanDerWaalsContact O-N 3.15Å; F385-E387 VanDerWaalsContact C-N 3.32Å; F385-E387 PolarHBondContact O-N 2.89Å; F385-Q388 WeakPolarHBondContact O-CB 3.42Å; F385-Q388 PolarHBondContact O-N 3.34Å; F385-F389 HydrophobicContact CD1-CE2 4.19Å; F385-F389 HydrophobicContact CD2-CE2 4.24Å; F385-F389 AromaticContact CE1-CE2 3.75Å; F385-F389 HydrophobicContact CE1-CE2 3.75Å; F385-F389 HydrophobicContact CE1-CZ 4.46Å; F385-F389 AromaticContact CE2-CE2 3.81Å; F385-F389 HydrophobicContact CE2-CE2 3.81Å; F385-F389 HydrophobicContact CE2-CZ 4.1Å; F385-F389 HydrophobicContact CG-CE2 4.42Å; F385-F389 AromaticContact CZ-CE2 3.55Å; F385-F389 HydrophobicContact CZ-CE2 3.55Å; F385-F389 AromaticContact CZ-CZ 3.86Å; F385-F389 HydrophobicContact CZ-CZ 3.86Å; F385-F389 WeakPolarHBondContact O-CD2 3.38Å; F385-F389 WeakPolarHBondContact O-CE2 3.31Å; F385-I406 HydrophobicContact CE1-CG2 4.02Å
386	L	76.9	Confident	82.2	Confident	1 Å²	1	67.7 Å²	67.7	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-56.8	-41.2	177.4	-82.1	179.5	0	0	0	113.5	L381 S382 L383 Q388 F389 Y403 I406 F514 I521	L381-L386 HydrophobicContact CD1-CG 4.43Å; L381-L386 HydrophobicContact CD2-CD1 3.77Å; L381-L386 HydrophobicContact CD2-CD2 3.88Å; L381-L386 HydrophobicContact CD2-CG 3.85Å; L381-L386 HydrophobicContact CG-CD1 4.2Å; L381-L386 HydrophobicContact CG-CD2 4.42Å; L381-L386 HydrophobicContact CG-CG 4.03Å; S382-L386 PolarHBondContact O-N 2.6Å; L383-L386 HydrophobicContact CD1-CB 4.19Å; L383-L386 PolarHBondContact O-N 2.82Å; L383-L386 VanDerWaalsContact O-N 3.09Å; L386-Q388 PolarHBondContact O-N 3.43Å; L386-F389 PolarHBondContact O-N 3.19Å; L386-Y403 HydrophobicContact CB-CD1 4.06Å; L386-Y403 HydrophobicContact CB-CE1 3.77Å; L386-Y403 HydrophobicContact CD1-CD1 4.14Å; L386-Y403 HydrophobicContact CD1-CD2 4.37Å; L386-Y403 HydrophobicContact CD1-CE1 4.41Å; L386-Y403 HydrophobicContact CD1-CG 4.1Å; L386-Y403 HydrophobicContact CD2-CD1 3.71Å; L386-Y403 HydrophobicContact CD2-CE1 4.3Å; L386-Y403 HydrophobicContact CD2-CG 4.2Å; L386-Y403 HydrophobicContact CG-CD1 4.2Å; L386-Y403 HydrophobicContact CG-CE1 4.4Å; L386-I406 HydrophobicContact CD2-CB 4.08Å; L386-I406 HydrophobicContact CD2-CD1 3.66Å; L386-I406 HydrophobicContact CD2-CG1 4.48Å; L386-I406 HydrophobicContact CD2-CG2 3.92Å; L386-F514 HydrophobicContact CD1-CE1 3.8Å; L386-F514 HydrophobicContact CD1-CZ 4.46Å; L386-I521 HydrophobicContact CD1-CD1 4.46Å
387	E	79.3	Confident	82.4	Confident	102 Å²	102	64.6 Å²	64.6	48%	0.477	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-62	-28.7	-177.2	-76.3	178.9	150.4	0	0	112.8	L383 F385 F389 T390	L383-E387 HydrophobicContact CD1-CG 3.83Å; L383-E387 HydrophobicContact CG-CG 4.06Å; L383-E387 WeakPolarHBondContact O-CG 3.3Å; L383-E387 PolarHBondContact O-N 2.78Å; F385-E387 VanDerWaalsContact C-N 3.32Å; F385-E387 PolarHBondContact O-N 2.89Å; E387-F389 PolarHBondContact O-N 3.1Å; E387-F389 VanDerWaalsContact O-N 3.14Å; E387-T390 PolarHBondContact O-N 3.14Å; E387-T390 PolarHBondContact O-OG1 2.69Å
388	Q	77.7	Confident	82.7	Confident	141 Å²	141	66.7 Å²	66.7	66%	0.659	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-61.2	-23.5	178.9	-56.5	176.6	26.6	0	0	113	S384 F385 L386	S384-Q388 WeakPolarHBondContact O-CG 3.41Å; S384-Q388 PolarHBondContact O-NE2 2.88Å; F385-Q388 WeakPolarHBondContact O-CB 3.42Å; F385-Q388 PolarHBondContact O-N 3.34Å; L386-Q388 PolarHBondContact O-N 3.43Å
389	F	77	Confident	83	Confident	108 Å²	108	67.7 Å²	67.7	47%	0.474	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-95.8	3.8	178.7	-57.6	-84.7	0	0	0	113	F385 L386 E387 I406	F385-F389 HydrophobicContact CD1-CE2 4.19Å; F385-F389 HydrophobicContact CD2-CE2 4.24Å; F385-F389 AromaticContact CE1-CE2 3.75Å; F385-F389 HydrophobicContact CE1-CE2 3.75Å; F385-F389 HydrophobicContact CE1-CZ 4.46Å; F385-F389 AromaticContact CE2-CE2 3.81Å; F385-F389 HydrophobicContact CE2-CE2 3.81Å; F385-F389 HydrophobicContact CE2-CZ 4.1Å; F385-F389 HydrophobicContact CG-CE2 4.42Å; F385-F389 AromaticContact CZ-CE2 3.55Å; F385-F389 HydrophobicContact CZ-CE2 3.55Å; F385-F389 AromaticContact CZ-CZ 3.86Å; F385-F389 HydrophobicContact CZ-CZ 3.86Å; F385-F389 WeakPolarHBondContact O-CD2 3.38Å; F385-F389 WeakPolarHBondContact O-CE2 3.31Å; L386-F389 PolarHBondContact O-N 3.19Å; E387-F389 PolarHBondContact O-N 3.1Å; E387-F389 VanDerWaalsContact O-N 3.14Å; F389-I406 HydrophobicContact CB-CD1 3.84Å; F389-I406 HydrophobicContact CD2-CD1 3.79Å; F389-I406 HydrophobicContact CG-CD1 3.83Å
390	T	82.7	Confident	83.4	Confident	20 Å²	20	67.6 Å²	67.6	12%	0.123	34%	0.338	C	S	.	.			trans	-122.9	176.7	-178.5	66.4	0	0	0	0	112.1	E387 M394 R399 Y403	E387-T390 PolarHBondContact O-N 3.14Å; E387-T390 PolarHBondContact O-OG1 2.69Å; T390-M394 HydrophobicContact CG2-SD 4.18Å; T390-R399 HydrophobicContact CG2-CG 4.16Å; T390-Y403 HydrophobicContact CG2-CD1 4.21Å; T390-Y403 HydrophobicContact CG2-CE1 3.44Å; T390-Y403 VanDerWaalsContact CG2-CE1 3.44Å
391	R	82.9	Confident	83.9	Confident	186 Å²	186	65.6 Å²	65.6	70%	0.702	33%	0.33	S	S	*	.			trans	-132.3	148.7	177.1	-62.7	-176.2	-177.6	178.3	0.8	109.9	E393 M394 R399	R391-E393 PolarHBondContact O-N 3.26Å; R391-M394 HydrophobicContact CB-CB 4.48Å; R391-M394 WeakPolarHBondContact O-CB 3.43Å; R391-M394 PolarHBondContact O-N 2.66Å; R391-R399 PolarHBondContact O-NH2 3.12Å
392	P	79.6	Confident	84.1	Confident	119 Å²	119	69.2 Å²	69.2	77%	0.773	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-36.6	176.7	-28.3	36.3	0	0	0	113.9	M394 R399	P392-M394 VanDerWaalsContact C-N 3.27Å; P392-M394 PolarHBondContact O-N 3.03Å; P392-R399 PolarHBondContact O-NH2 2.66Å
393	E	86.7	Confident	84.6	Confident	181 Å²	181	68 Å²	68	85%	0.846	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-16.5	177.2	-48.8	-58.6	157.4	0	0	114.5	R391	R391-E393 PolarHBondContact O-N 3.26Å
394	M	88.8	Confident	85.1	Confident	43 Å²	43	67.8 Å²	67.8	21%	0.212	34%	0.337	C	S	.	.	S	Bend	trans	-73.3	131.9	-171.9	-171.4	-177.3	-74.2	0	0	110.9	T390 R391 P392 T398 R399 Q402	T390-M394 HydrophobicContact CG2-SD 4.18Å; R391-M394 HydrophobicContact CB-CB 4.48Å; R391-M394 WeakPolarHBondContact O-CB 3.43Å; R391-M394 PolarHBondContact O-N 2.66Å; P392-M394 VanDerWaalsContact C-N 3.27Å; P392-M394 PolarHBondContact O-N 3.03Å; M394-T398 HydrophobicContact CE-CG2 4.35Å; M394-T398 HydrophobicContact CG-CG2 3.83Å; M394-T398 HydrophobicContact SD-CG2 3.78Å; M394-R399 HydrophobicContact CB-CG 4.13Å; M394-R399 HydrophobicContact CG-CG 3.86Å; M394-R399 PolarHBondContact O-NE 2.89Å; M394-R399 PolarHBondContact O-NH2 3.44Å; M394-R399 HydrophobicContact SD-CB 4.45Å; M394-R399 HydrophobicContact SD-CG 3.72Å; M394-Q402 HydrophobicContact SD-CG 4.48Å
395	D	90.8	Very high	85.6	Confident	82 Å²	82	67.7 Å²	67.7	44%	0.439	33%	0.331	S	S	.	.			trans	-66.9	156.4	177	78.1	-84.3	0	0	0	112	T397 T398 R399	D395-T397 VanDerWaalsContact C-N 3.34Å; D395-T397 PolarHBondContact O-N 3.39Å; D395-T397 WeakPolarHBondContact OD2-CA 3.36Å; D395-T397 WeakPolarHBondContact OD2-CB 3.32Å; D395-T397 PolarHBondContact OD2-N 3.24Å; D395-T398 PolarHBondContact O-N 2.8Å; D395-T398 WeakPolarHBondContact OD1-CB 3.2Å; D395-T398 PolarHBondContact OD1-OG1 2.9Å; D395-T398 PolarHBondContact OD2-N 3Å; D395-R399 WeakPolarHBondContact O-CG 3.35Å; D395-R399 PolarHBondContact O-N 3.24Å
396	W	88.9	Confident	86.1	Confident	59 Å²	59	67.5 Å²	67.5	22%	0.223	33%	0.331	C	S	.	.	H	α-helix	trans	-65.6	-31.6	-175.6	-79	102.1	0	0	0	113.8	R399 C400 Y403 G472 F514 M515	W396-R399 HydrophobicContact CE3-CB 4.34Å; W396-R399 PolarHBondContact O-N 3.45Å; W396-C400 WeakPolarHBondContact O-CB 3.44Å; W396-C400 PolarHBondContact O-N 3.26Å; W396-C400 PolarHBondContact O-SG 3.35Å; W396-Y403 HydrophobicContact CZ3-CE2 4.49Å; W396-G472 VanDerWaalsContact CE2-N 3.31Å; W396-F514 HydrophobicContact CH2-CB 4.04Å; W396-F514 HydrophobicContact CZ3-CB 3.9Å; W396-F514 HydrophobicContact CZ3-CG 4.43Å; W396-M515 HydrophobicContact CZ2-CG 4.39Å
397	T	91.3	Very high	86.6	Confident	60 Å²	60	67.4 Å²	67.4	37%	0.368	33%	0.331	S	S	.	.	H	α-helix	trans	-69.1	-44.6	177.7	-71.6	0	0	0	0	111	D395 R399 C400 V401 G469	D395-T397 VanDerWaalsContact C-N 3.34Å; D395-T397 PolarHBondContact O-N 3.39Å; D395-T397 WeakPolarHBondContact OD2-CA 3.36Å; D395-T397 WeakPolarHBondContact OD2-CB 3.32Å; D395-T397 PolarHBondContact OD2-N 3.24Å; T397-R399 PolarHBondContact O-N 2.8Å; T397-C400 PolarHBondContact O-N 2.02Å; T397-V401 WeakPolarHBondContact O-CG2 3.48Å; T397-V401 PolarHBondContact O-N 3.48Å; T397-V401 VanDerWaalsContact O-N 3.12Å; T397-G469 PolarHBondContact OG1-N 3.12Å; T397-G469 VanDerWaalsContact OG1-N 3.09Å; T397-G469 PolarHBondContact OG1-O 2.99Å
398	T	91.7	Very high	86.9	Confident	58 Å²	58	63.4 Å²	63.4	36%	0.356	31%	0.311	S	S	.	.	H	α-helix	trans	-61	-42.1	172.3	-57	0	0	0	0	111.8	M394 D395 V401 Q402	M394-T398 HydrophobicContact CE-CG2 4.35Å; M394-T398 HydrophobicContact CG-CG2 3.83Å; M394-T398 HydrophobicContact SD-CG2 3.78Å; D395-T398 PolarHBondContact O-N 2.8Å; D395-T398 WeakPolarHBondContact OD1-CB 3.2Å; D395-T398 PolarHBondContact OD1-OG1 2.9Å; D395-T398 PolarHBondContact OD2-N 3Å; T398-V401 PolarHBondContact O-N 2.84Å; T398-Q402 WeakPolarHBondContact O-CG 3.33Å; T398-Q402 PolarHBondContact O-N 3.22Å
399	R	90.8	Very high	86.9	Confident	32 Å²	32	61.4 Å²	61.4	12%	0.121	30%	0.302	C	S	.	.	H	α-helix	trans	-58.2	-49.1	174.5	-70.7	-178.3	-159.2	-149.5	5.4	112.4	T390 R391 P392 M394 D395 W396 T397 V401 Q402 Y403	T390-R399 HydrophobicContact CG2-CG 4.16Å; R391-R399 PolarHBondContact O-NH2 3.12Å; P392-R399 PolarHBondContact O-NH2 2.66Å; M394-R399 HydrophobicContact CB-CG 4.13Å; M394-R399 HydrophobicContact CG-CG 3.86Å; M394-R399 PolarHBondContact O-NE 2.89Å; M394-R399 PolarHBondContact O-NH2 3.44Å; M394-R399 HydrophobicContact SD-CB 4.45Å; M394-R399 HydrophobicContact SD-CG 3.72Å; D395-R399 WeakPolarHBondContact O-CG 3.35Å; D395-R399 PolarHBondContact O-N 3.24Å; W396-R399 HydrophobicContact CE3-CB 4.34Å; W396-R399 PolarHBondContact O-N 3.45Å; T397-R399 PolarHBondContact O-N 2.8Å; R399-V401 VanDerWaalsContact C-N 3.28Å; R399-V401 PolarHBondContact O-N 2.84Å; R399-Q402 PolarHBondContact O-N 3.15Å; R399-Q402 VanDerWaalsContact O-N 3.1Å; R399-Y403 HydrophobicContact CB-CE2 4.45Å; R399-Y403 WeakPolarHBondContact O-CD1 3.48Å; R399-Y403 VanDerWaalsContact O-CG 3.28Å; R399-Y403 PolarHBondContact O-N 2.89Å
400	C	92	Very high	87.1	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62	-36.4	-178.3	-63.6	0	0	0	0	112.3	W396 T397 Y403 Q404 P467 G469 C474	W396-C400 WeakPolarHBondContact O-CB 3.44Å; W396-C400 PolarHBondContact O-N 3.26Å; W396-C400 PolarHBondContact O-SG 3.35Å; T397-C400 PolarHBondContact O-N 2.02Å; C400-Y403 PolarHBondContact O-N 3.12Å; C400-Q404 WeakPolarHBondContact O-CB 3.35Å; C400-Q404 PolarHBondContact O-N 3.46Å; C400-P467 HydrophobicContact CB-CB 4.14Å; C400-P467 HydrophobicContact CB-CG 3.84Å; C400-P467 WeakPolarHBondContact O-CG 3.4Å; C400-G469 WeakPolarHBondContact SG-CA 3.41Å; C400-C474 WeakPolarHBondContact CA-SG 3.3Å; C400-C474 HydrophobicContact CB-CB 3.73Å; C400-C474 WeakPolarHBondContact CB-SG 3Å; C400-C474 WeakPolarHBondContact SG-CA 3.41Å; C400-C474 WeakPolarHBondContact SG-CB 3.24Å; C400-C474 CovalentContact SG-SG 2.02Å; C400-C474 PolarHBondContact SG-SG 3.19Å
401	V	91.4	Very high	87	Confident	44 Å²	44	56.3 Å²	56.3	27%	0.267	28%	0.279	S	S	.	.	H	α-helix	trans	-64.5	-44.4	173.2	173.6	0	0	0	0	111	T397 T398 R399 Q404 N405 T466 P467	T397-V401 WeakPolarHBondContact O-CG2 3.48Å; T397-V401 PolarHBondContact O-N 3.48Å; T397-V401 VanDerWaalsContact O-N 3.12Å; T398-V401 PolarHBondContact O-N 2.84Å; R399-V401 VanDerWaalsContact C-N 3.28Å; R399-V401 PolarHBondContact O-N 2.84Å; V401-Q404 PolarHBondContact O-N 3.08Å; V401-N405 PolarHBondContact O-N 3.02Å; V401-N405 PolarHBondContact O-ND2 3.46Å; V401-N405 PolarHBondContact O-OD1 3.5Å; V401-T466 HydrophobicContact CG2-CG2 3.88Å; V401-P467 HydrophobicContact CG2-CG 4.43Å
402	Q	88.6	Confident	86.7	Confident	75 Å²	75	48.8 Å²	48.8	35%	0.35	25%	0.251	S	S	.	.	H	α-helix	trans	-63.8	-43.4	175.8	-64.7	-59.6	-17.2	0	0	112.3	M394 T398 R399 Q404 N405 I406	M394-Q402 HydrophobicContact SD-CG 4.48Å; T398-Q402 WeakPolarHBondContact O-CG 3.33Å; T398-Q402 PolarHBondContact O-N 3.22Å; R399-Q402 PolarHBondContact O-N 3.15Å; R399-Q402 VanDerWaalsContact O-N 3.1Å; Q402-Q404 VanDerWaalsContact C-N 3.33Å; Q402-Q404 PolarHBondContact O-N 3.42Å; Q402-N405 PolarHBondContact O-N 3.4Å; Q402-I406 WeakPolarHBondContact O-CG1 3.49Å; Q402-I406 PolarHBondContact O-N 2.91Å
403	Y	89.3	Confident	86.4	Confident	1 Å²	1	45.2 Å²	45.2	0%	0.004	23%	0.226	C	C	.	.	H	α-helix	trans	-60.6	-42.2	175.8	-64.9	-11.2	0	0	0	111.6	L386 T390 W396 R399 C400 I406 I407 F514	L386-Y403 HydrophobicContact CB-CD1 4.06Å; L386-Y403 HydrophobicContact CB-CE1 3.77Å; L386-Y403 HydrophobicContact CD1-CD1 4.14Å; L386-Y403 HydrophobicContact CD1-CD2 4.37Å; L386-Y403 HydrophobicContact CD1-CE1 4.41Å; L386-Y403 HydrophobicContact CD1-CG 4.1Å; L386-Y403 HydrophobicContact CD2-CD1 3.71Å; L386-Y403 HydrophobicContact CD2-CE1 4.3Å; L386-Y403 HydrophobicContact CD2-CG 4.2Å; L386-Y403 HydrophobicContact CG-CD1 4.2Å; L386-Y403 HydrophobicContact CG-CE1 4.4Å; T390-Y403 HydrophobicContact CG2-CD1 4.21Å; T390-Y403 HydrophobicContact CG2-CE1 3.44Å; T390-Y403 VanDerWaalsContact CG2-CE1 3.44Å; W396-Y403 HydrophobicContact CZ3-CE2 4.49Å; R399-Y403 HydrophobicContact CB-CE2 4.45Å; R399-Y403 WeakPolarHBondContact O-CD1 3.48Å; R399-Y403 VanDerWaalsContact O-CG 3.28Å; R399-Y403 PolarHBondContact O-N 2.89Å; C400-Y403 PolarHBondContact O-N 3.12Å; Y403-I406 PolarHBondContact O-N 3.18Å; Y403-I407 WeakPolarHBondContact O-CG1 3.05Å; Y403-I407 PolarHBondContact O-N 2.91Å; Y403-F514 HydrophobicContact CD2-CD1 4.19Å; Y403-F514 HydrophobicContact CD2-CD2 4.29Å; Y403-F514 AromaticContact CD2-CE1 3.65Å; Y403-F514 HydrophobicContact CD2-CE1 3.65Å; Y403-F514 AromaticContact CD2-CE2 3.8Å; Y403-F514 HydrophobicContact CD2-CE2 3.8Å; Y403-F514 HydrophobicContact CD2-CG 4.46Å; Y403-F514 AromaticContact CD2-CZ 3.42Å; Y403-F514 HydrophobicContact CD2-CZ 3.42Å; Y403-F514 VanDerWaalsContact CD2-CZ 3.42Å; Y403-F514 AromaticContact CE2-CD1 3.71Å; Y403-F514 HydrophobicContact CE2-CD1 3.71Å; Y403-F514 HydrophobicContact CE2-CD2 4.14Å; Y403-F514 AromaticContact CE2-CE1 3.63Å; Y403-F514 HydrophobicContact CE2-CE1 3.63Å; Y403-F514 HydrophobicContact CE2-CE2 4.09Å; Y403-F514 AromaticContact CE2-CG 3.94Å; Y403-F514 HydrophobicContact CE2-CG 3.94Å; Y403-F514 AromaticContact CE2-CZ 3.82Å; Y403-F514 HydrophobicContact CE2-CZ 3.82Å; Y403-F514 HydrophobicContact CG-CZ 4.38Å
404	Q	90.6	Very high	85.2	Confident	6 Å²	6	36.9 Å²	36.9	3%	0.028	19%	0.187	C	C	.	.	H	α-helix	trans	-64.6	-40.3	175.1	-178	154.7	-72.2	0	0	112.7	C400 V401 Q402 I406 I407 W408 P464 T465 P467 L477 L478	C400-Q404 WeakPolarHBondContact O-CB 3.35Å; C400-Q404 PolarHBondContact O-N 3.46Å; V401-Q404 PolarHBondContact O-N 3.08Å; Q402-Q404 VanDerWaalsContact C-N 3.33Å; Q402-Q404 PolarHBondContact O-N 3.42Å; Q404-I406 VanDerWaalsContact C-N 3.31Å; Q404-I406 PolarHBondContact O-N 2.8Å; Q404-I407 PolarHBondContact O-N 2.84Å; Q404-W408 VanDerWaalsContact O-CB 3.24Å; Q404-W408 WeakPolarHBondContact O-CB 3.38Å; Q404-W408 PolarHBondContact O-N 3.45Å; Q404-P464 HydrophobicContact CG-CG 3.98Å; Q404-T465 PolarHBondContact NE2-O 2.62Å; Q404-P467 HydrophobicContact CB-CG 4.15Å; Q404-L477 HydrophobicContact CB-CD1 3.97Å; Q404-L478 HydrophobicContact CG-CB 3.94Å
405	N	86.7	Confident	83.6	Confident	74 Å²	74	38.6 Å²	38.6	40%	0.396	20%	0.196	S	C	.	.	H	α-helix	trans	-61.5	-40.1	176.3	-66.9	-19.3	0	0	0	111.6	V401 Q402 W408 E409	V401-N405 PolarHBondContact O-N 3.02Å; V401-N405 PolarHBondContact O-ND2 3.46Å; V401-N405 PolarHBondContact O-OD1 3.5Å; Q402-N405 PolarHBondContact O-N 3.4Å; N405-W408 PolarHBondContact O-N 2.82Å; N405-E409 PolarHBondContact O-N 3.48Å
406	I	84.5	Confident	81.7	Confident	25 Å²	25	34.9 Å²	34.9	13%	0.128	18%	0.177	C	C	.	.	H	α-helix	trans	-65.6	-43.4	176.3	-66	163.8	0	0	0	111.1	L381 F385 L386 F389 Q402 Y403 Q404 N410	L381-I406 HydrophobicContact CD1-CG2 4.38Å; F385-I406 HydrophobicContact CE1-CG2 4.02Å; L386-I406 HydrophobicContact CD2-CB 4.08Å; L386-I406 HydrophobicContact CD2-CD1 3.66Å; L386-I406 HydrophobicContact CD2-CG1 4.48Å; L386-I406 HydrophobicContact CD2-CG2 3.92Å; F389-I406 HydrophobicContact CB-CD1 3.84Å; F389-I406 HydrophobicContact CD2-CD1 3.79Å; F389-I406 HydrophobicContact CG-CD1 3.83Å; Q402-I406 WeakPolarHBondContact O-CG1 3.49Å; Q402-I406 PolarHBondContact O-N 2.91Å; Y403-I406 PolarHBondContact O-N 3.18Å; Q404-I406 VanDerWaalsContact C-N 3.31Å; Q404-I406 PolarHBondContact O-N 2.8Å; I406-N410 PolarHBondContact O-N 3.02Å; I406-N410 PolarHBondContact O-ND2 2.74Å
407	I	87.3	Confident	79.6	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-65	-41.5	176.6	-68.4	165.6	0	0	0	111	L381 Y403 Q404 N410 L411 L477 L478 I523	L381-I407 HydrophobicContact CD2-CD1 4.12Å; L381-I407 HydrophobicContact CD2-CG1 3.58Å; Y403-I407 WeakPolarHBondContact O-CG1 3.05Å; Y403-I407 PolarHBondContact O-N 2.91Å; Q404-I407 PolarHBondContact O-N 2.84Å; I407-N410 PolarHBondContact O-N 3.43Å; I407-L411 HydrophobicContact CG2-CD1 3.98Å; I407-L411 WeakPolarHBondContact O-CG 3.4Å; I407-L411 PolarHBondContact O-N 3.46Å; I407-L477 HydrophobicContact CD1-CD2 4.02Å; I407-L477 HydrophobicContact CD1-CG 4.3Å; I407-L478 WeakPolarHBondContact CD1-O 3.37Å; I407-L478 HydrophobicContact CG2-CB 4.32Å; I407-L478 HydrophobicContact CG2-CD2 4.05Å; I407-L478 HydrophobicContact CG2-CG 3.98Å; I407-I523 HydrophobicContact CB-CD1 4.3Å; I407-I523 HydrophobicContact CG1-CD1 4.04Å; I407-I523 HydrophobicContact CG1-CG1 4.42Å; I407-I523 HydrophobicContact CG2-CD1 4.06Å; I407-I523 HydrophobicContact CG2-CG1 4.3Å; I407-I523 HydrophobicContact CG2-CG2 4.34Å
408	W	85.7	Confident	77.2	Confident	18 Å²	18	33.9 Å²	33.9	7%	0.068	18%	0.176	C	C	.	.	H	α-helix	trans	-60.2	-50	177.9	179.4	-99.9	0	0	0	112.2	Q404 N405 N410 L411 F412 N462 P464 L478 Y507	Q404-W408 VanDerWaalsContact O-CB 3.24Å; Q404-W408 WeakPolarHBondContact O-CB 3.38Å; Q404-W408 PolarHBondContact O-N 3.45Å; N405-W408 PolarHBondContact O-N 2.82Å; W408-N410 VanDerWaalsContact C-N 3.32Å; W408-N410 PolarHBondContact O-N 3.1Å; W408-L411 PolarHBondContact O-N 3.37Å; W408-L411 VanDerWaalsContact O-N 3.1Å; W408-F412 AromaticContact CD2-CD2 3.92Å; W408-F412 HydrophobicContact CD2-CD2 3.92Å; W408-F412 AromaticContact CD2-CE2 3.81Å; W408-F412 HydrophobicContact CD2-CE2 3.81Å; W408-F412 HydrophobicContact CD2-CZ 4.44Å; W408-F412 AromaticContact CE2-CD2 3.86Å; W408-F412 AromaticContact CE2-CE2 3.61Å; W408-F412 AromaticContact CE2-CZ 3.78Å; W408-F412 HydrophobicContact CE3-CD2 4.13Å; W408-F412 AromaticContact CE3-CE2 3.71Å; W408-F412 HydrophobicContact CE3-CE2 3.71Å; W408-F412 HydrophobicContact CE3-CZ 4.46Å; W408-F412 HydrophobicContact CG-CD2 4.46Å; W408-F412 HydrophobicContact CH2-CD2 4.37Å; W408-F412 HydrophobicContact CH2-CE1 4.29Å; W408-F412 AromaticContact CH2-CE2 3.35Å; W408-F412 HydrophobicContact CH2-CE2 3.35Å; W408-F412 AromaticContact CH2-CZ 3.29Å; W408-F412 HydrophobicContact CH2-CZ 3.29Å; W408-F412 HydrophobicContact CZ2-CD1 4.43Å; W408-F412 HydrophobicContact CZ2-CD2 4.11Å; W408-F412 AromaticContact CZ2-CE1 3.75Å; W408-F412 HydrophobicContact CZ2-CE1 3.75Å; W408-F412 AromaticContact CZ2-CE2 3.39Å; W408-F412 HydrophobicContact CZ2-CE2 3.39Å; W408-F412 AromaticContact CZ2-CZ 3.17Å; W408-F412 HydrophobicContact CZ2-CZ 3.17Å; W408-F412 HydrophobicContact CZ3-CD2 4.36Å; W408-F412 AromaticContact CZ3-CE2 3.49Å; W408-F412 HydrophobicContact CZ3-CE2 3.49Å; W408-F412 VanDerWaalsContact CZ3-CE2 3.49Å; W408-F412 AromaticContact CZ3-CZ 3.96Å; W408-F412 HydrophobicContact CZ3-CZ 3.96Å; W408-F412 WeakPolarHBondContact O-CB 3.28Å; W408-F412 PolarHBondContact O-N 2.62Å; W408-N462 WeakPolarHBondContact CZ2-O 3.49Å; W408-P464 HydrophobicContact CD2-CG 4.02Å; W408-P464 HydrophobicContact CE3-CB 4.09Å; W408-P464 HydrophobicContact CE3-CG 3.56Å; W408-P464 HydrophobicContact CZ3-CB 4.03Å; W408-P464 HydrophobicContact CZ3-CG 3.86Å; W408-L478 HydrophobicContact CB-CD2 4.21Å; W408-L478 HydrophobicContact CE3-CD2 3.69Å; W408-Y507 HydrophobicContact CE3-CE1 4.48Å; W408-Y507 HydrophobicContact CH2-CE1 4.23Å; W408-Y507 HydrophobicContact CH2-CE2 4.08Å; W408-Y507 AromaticContact CH2-CZ 3.71Å; W408-Y507 HydrophobicContact CZ3-CD1 4.13Å; W408-Y507 HydrophobicContact CZ3-CD2 4.44Å; W408-Y507 AromaticContact CZ3-CE1 3.62Å; W408-Y507 HydrophobicContact CZ3-CE1 3.62Å; W408-Y507 AromaticContact CZ3-CE2 3.96Å; W408-Y507 HydrophobicContact CZ3-CE2 3.96Å; W408-Y507 AromaticContact CZ3-CZ 3.53Å
409	E	78.7	Confident	74.7	Confident	98 Å²	98	34.5 Å²	34.5	46%	0.458	18%	0.177	S	C	.	.	H	α-helix	trans	-63.4	-35.4	177	-73.4	-57	141.3	0	0	112.6	N405 L411 F412 N413	N405-E409 PolarHBondContact O-N 3.48Å; E409-L411 VanDerWaalsContact C-N 3.32Å; E409-L411 PolarHBondContact O-N 3.34Å; E409-F412 PolarHBondContact O-N 2.99Å; E409-N413 CarbonylContact O-C 3.55Å; E409-N413 WeakPolarHBondContact O-CA 3.25Å; E409-N413 PolarHBondContact O-N 3.15Å; E409-N413 PolarHBondContact OE2-ND2 2.82Å
410	N	79.6	Confident	72.5	Confident	18 Å²	18	38.1 Å²	38.1	10%	0.096	20%	0.195	C	C	.	.	H	α-helix	trans	-66.9	-31.7	173.7	-82.3	-94.7	0	0	0	112.8	G356 I406 I407 W408 I523	G356-N410 PolarHBondContact N-OD1 2.95Å; I406-N410 PolarHBondContact O-N 3.02Å; I406-N410 PolarHBondContact O-ND2 2.74Å; I407-N410 PolarHBondContact O-N 3.43Å; W408-N410 VanDerWaalsContact C-N 3.32Å; W408-N410 PolarHBondContact O-N 3.1Å; N410-I523 HydrophobicContact CB-CD1 4.11Å
411	L	81.7	Confident	70.1	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.016	23%	0.225	C	C	.	.	H	α-helix	trans	-78.9	-25.6	175.4	-74.9	170.3	0	0	0	113.5	L350 I407 W408 E409 L478 Q481 I523 Q525	L350-L411 HydrophobicContact CD1-CD2 4.17Å; I407-L411 HydrophobicContact CG2-CD1 3.98Å; I407-L411 WeakPolarHBondContact O-CG 3.4Å; I407-L411 PolarHBondContact O-N 3.46Å; W408-L411 PolarHBondContact O-N 3.37Å; W408-L411 VanDerWaalsContact O-N 3.1Å; E409-L411 VanDerWaalsContact C-N 3.32Å; E409-L411 PolarHBondContact O-N 3.34Å; L411-L478 HydrophobicContact CD1-CD1 4.35Å; L411-L478 HydrophobicContact CD1-CD2 3.8Å; L411-L478 HydrophobicContact CD1-CG 3.98Å; L411-Q481 HydrophobicContact CD2-CG 4.16Å; L411-Q481 PolarHBondContact O-NE2 3.47Å; L411-I523 HydrophobicContact CD1-CG2 4.18Å; L411-I523 HydrophobicContact CD2-CG2 3.51Å; L411-I523 HydrophobicContact CG-CG2 3.75Å; L411-Q525 HydrophobicContact CD2-CG 3.71Å; L411-Q525 VanDerWaalsContact CD2-NE2 3.27Å
412	F	76.9	Confident	67.7	Low	29 Å²	29	46 Å²	46	13%	0.127	24%	0.236	C	C	.	.	H	α-helix	trans	-99.2	-38.7	-175.3	-93.9	-116.5	0	0	0	114.3	W408 E409 K434 Y507	W408-F412 AromaticContact CD2-CD2 3.92Å; W408-F412 HydrophobicContact CD2-CD2 3.92Å; W408-F412 AromaticContact CD2-CE2 3.81Å; W408-F412 HydrophobicContact CD2-CE2 3.81Å; W408-F412 HydrophobicContact CD2-CZ 4.44Å; W408-F412 AromaticContact CE2-CD2 3.86Å; W408-F412 AromaticContact CE2-CE2 3.61Å; W408-F412 AromaticContact CE2-CZ 3.78Å; W408-F412 HydrophobicContact CE3-CD2 4.13Å; W408-F412 AromaticContact CE3-CE2 3.71Å; W408-F412 HydrophobicContact CE3-CE2 3.71Å; W408-F412 HydrophobicContact CE3-CZ 4.46Å; W408-F412 HydrophobicContact CG-CD2 4.46Å; W408-F412 HydrophobicContact CH2-CD2 4.37Å; W408-F412 HydrophobicContact CH2-CE1 4.29Å; W408-F412 AromaticContact CH2-CE2 3.35Å; W408-F412 HydrophobicContact CH2-CE2 3.35Å; W408-F412 AromaticContact CH2-CZ 3.29Å; W408-F412 HydrophobicContact CH2-CZ 3.29Å; W408-F412 HydrophobicContact CZ2-CD1 4.43Å; W408-F412 HydrophobicContact CZ2-CD2 4.11Å; W408-F412 AromaticContact CZ2-CE1 3.75Å; W408-F412 HydrophobicContact CZ2-CE1 3.75Å; W408-F412 AromaticContact CZ2-CE2 3.39Å; W408-F412 HydrophobicContact CZ2-CE2 3.39Å; W408-F412 AromaticContact CZ2-CZ 3.17Å; W408-F412 HydrophobicContact CZ2-CZ 3.17Å; W408-F412 HydrophobicContact CZ3-CD2 4.36Å; W408-F412 AromaticContact CZ3-CE2 3.49Å; W408-F412 HydrophobicContact CZ3-CE2 3.49Å; W408-F412 VanDerWaalsContact CZ3-CE2 3.49Å; W408-F412 AromaticContact CZ3-CZ 3.96Å; W408-F412 HydrophobicContact CZ3-CZ 3.96Å; W408-F412 WeakPolarHBondContact O-CB 3.28Å; W408-F412 PolarHBondContact O-N 2.62Å; E409-F412 PolarHBondContact O-N 2.99Å; F412-K434 HydrophobicContact CD1-CD 4.15Å; F412-K434 HydrophobicContact CD2-CD 4.49Å; F412-K434 HydrophobicContact CE1-CD 3.98Å; F412-K434 HydrophobicContact CE2-CD 4.3Å; F412-K434 HydrophobicContact CG-CD 4.4Å; F412-K434 HydrophobicContact CZ-CD 4.05Å; F412-K434 VanDerWaalsContact O-CB 3.32Å; F412-K434 WeakPolarHBondContact O-CB 3.41Å; F412-K434 PolarHBondContact O-N 2.76Å; F412-Y507 HydrophobicContact CE2-CE1 4.11Å; F412-Y507 WeakPolarHBondContact CE2-OH 3.05Å; F412-Y507 VanDerWaalsContact CZ-OH 3.3Å; F412-Y507 WeakPolarHBondContact CZ-OH 3.3Å
413	N	71.4	Confident	65.3	Low	44 Å²	44	52 Å²	52	24%	0.235	26%	0.255	C	S	.	.	S	Bend	trans	-135.8	56.6	-175.7	-56.8	-59.6	0	0	0	109.9	E409 I415	E409-N413 CarbonylContact O-C 3.55Å; E409-N413 WeakPolarHBondContact O-CA 3.25Å; E409-N413 PolarHBondContact O-N 3.15Å; E409-N413 PolarHBondContact OE2-ND2 2.82Å; N413-I415 WeakPolarHBondContact O-CG1 3.22Å; N413-I415 PolarHBondContact O-N 2.94Å
414	P	61.9	Low	63	Low	5 Å²	5	61.3 Å²	61.3	3%	0.032	30%	0.296	C	S	.	.			trans	-53.8	123.8	-179.8	22.9	-35.3	0	0	0	111.5	L350 L364 V366 S432	L350-P414 HydrophobicContact CD2-CB 3.89Å; L364-P414 HydrophobicContact CD2-CB 3.66Å; V366-P414 HydrophobicContact CG1-CB 3.82Å; V366-P414 HydrophobicContact CG1-CG 4.18Å; P414-S432 WeakPolarHBondContact CD-O 3.47Å
415	I	56.5	Low	60.3	Low	80 Å²	80	63.1 Å²	63.1	41%	0.41	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	107.6	-179.1	-54	-176.4	0	0	0	109.2	N413 I417 F430	N413-I415 WeakPolarHBondContact O-CG1 3.22Å; N413-I415 PolarHBondContact O-N 2.94Å; I415-I417 HydrophobicContact CG2-CD1 4.27Å; I415-I417 HydrophobicContact CG2-CG1 4.26Å; I415-F430 WeakPolarHBondContact CA-O 3.45Å
416	G	49.9	Very low	58.1	Low	3 Å²	3	62.9 Å²	62.9	3%	0.031	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	138.1	167	0	0	0	0	0	110.9	F430	G416-F430 PolarHBondContact N-O 2.69Å; G416-F430 PolarHBondContact O-N 3.45Å
417	I	44.9	Very low	56	Low	40 Å²	40	63.4 Å²	63.4	21%	0.205	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	135.4	172.2	-73.3	175.6	0	0	0	108.8	V358 I415	V358-I417 HydrophobicContact CB-CD1 4.4Å; V358-I417 HydrophobicContact CG1-CB 4.21Å; V358-I417 HydrophobicContact CG1-CD1 3.5Å; V358-I417 HydrophobicContact CG1-CG1 4.39Å; V358-I417 HydrophobicContact CG1-CG2 4.18Å; V358-I417 HydrophobicContact CG2-CD1 4.05Å; I415-I417 HydrophobicContact CG2-CD1 4.27Å; I415-I417 HydrophobicContact CG2-CG1 4.26Å
418	T	40.5	Very low	53.9	Low	59 Å²	59	65.2 Å²	65.2	36%	0.362	34%	0.335	S	S	.	.			trans	-89.1	156.8	177.2	51.9	0	0	0	0	112.1	F430	T418-F430 HydrophobicContact CG2-CE2 3.9Å
419	N	39.9	Very low	52	Low	71 Å²	71	67.3 Å²	67.3	38%	0.38	35%	0.348	S	S	.	.			trans	-51.9	146.8	-165.8	-62.6	24.7	0	0	0	115.8	Q360 E361 D421	Q360-N419 WeakPolarHBondContact O-CA 3.37Å; Q360-N419 WeakPolarHBondContact O-CB 3.31Å; E361-N419 PolarHBondContact O-ND2 3.23Å; E361-N419 PolarHBondContact O-OD1 2.87Å; N419-D421 VanDerWaalsContact C-N 3.31Å; N419-D421 PolarHBondContact O-N 3.22Å
420	E	43.9	Very low	50.6	Low	107 Å²	107	65.5 Å²	65.5	50%	0.5	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-6.3	-179.4	-148.8	-175.8	-79.9	0	0	113.5	Q360 D422 R423	Q360-E420 HydrophobicContact CB-CB 4.14Å; Q360-E420 HydrophobicContact CG-CB 3.95Å; Q360-E420 PolarHBondContact NE2-OE1 3.11Å; Q360-E420 PolarHBondContact NE2-OE2 3.22Å; E420-D422 CarbonylContact O-C 3.47Å; E420-D422 PolarHBondContact O-N 3Å; E420-D422 VanDerWaalsContact O-N 3.14Å; E420-R423 WeakPolarHBondContact O-CG 3.49Å; E420-R423 PolarHBondContact O-N 2.88Å; E420-R423 VanDerWaalsContact O-N 3.09Å
421	D	42.9	Very low	49.3	Very low	119 Å²	119	67.7 Å²	67.7	64%	0.636	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-17.2	175	-77.7	-43.4	0	0	0	113.4	N419 R423	N419-D421 VanDerWaalsContact C-N 3.31Å; N419-D421 PolarHBondContact O-N 3.22Å; D421-R423 PolarHBondContact O-N 3.38Å
422	D	39.9	Very low	48.4	Very low	92 Å²	92	67.7 Å²	67.7	49%	0.492	35%	0.349	S	S	.	.			trans	-70.5	55.3	155.8	-114.6	-24.1	0	0	0	111	E420 K424 G425 L426	E420-D422 CarbonylContact O-C 3.47Å; E420-D422 PolarHBondContact O-N 3Å; E420-D422 VanDerWaalsContact O-N 3.14Å; D422-K424 PolarHBondContact O-N 2.95Å; D422-G425 PolarHBondContact O-N 3.18Å; D422-L426 HydrophobicContact CB-CB 4.3Å
423	R	38.5	Very low	48.3	Very low	200 Å²	200	68.3 Å²	68.3	76%	0.755	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	6.3	177.7	-67.9	-172.5	173.9	-179.8	-0.8	113.8	E420 D421	E420-R423 WeakPolarHBondContact O-CG 3.49Å; E420-R423 PolarHBondContact O-N 2.88Å; E420-R423 VanDerWaalsContact O-N 3.09Å; D421-R423 PolarHBondContact O-N 3.38Å
424	K	41.3	Very low	48.9	Very low	196 Å²	196	66.9 Å²	66.9	85%	0.852	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	17.7	168.3	-66.9	178	-179.2	171.1	0	113	D422	D422-K424 PolarHBondContact O-N 2.95Å
425	G	34.4	Very low	50.1	Low	45 Å²	45	66.7 Å²	66.7	46%	0.464	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.9	46.2	158.4	0	0	0	0	0	115.3	D422	D422-G425 PolarHBondContact O-N 3.18Å
426	L	39.8	Very low	51.5	Low	69 Å²	69	65.1 Å²	65.1	36%	0.361	34%	0.337	S	S	.	.			trans	-119.2	41.1	-179.8	-71.8	170.3	0	0	0	113.4	I335 D422 I428	I335-L426 HydrophobicContact CB-CD2 4.45Å; I335-L426 HydrophobicContact CG1-CD2 4.03Å; I335-L426 HydrophobicContact CG2-CD2 4.19Å; D422-L426 HydrophobicContact CB-CB 4.3Å; L426-I428 WeakPolarHBondContact O-CG1 3.27Å; L426-I428 PolarHBondContact O-N 2.87Å; L426-I428 VanDerWaalsContact O-N 3.09Å
427	G	40.3	Very low	53.4	Low	36 Å²	36	65.8 Å²	65.8	37%	0.371	34%	0.34	S	S	.	.			trans	-59.8	113.1	170.3	0	0	0	0	0	111.4
428	I	42.9	Very low	55.7	Low	37 Å²	37	63.9 Å²	63.9	19%	0.19	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	112.6	177.1	-46.9	-173	0	0	0	108.7	M331 L333 L426 F430	M331-I428 HydrophobicContact CG-CG2 3.44Å; M331-I428 VanDerWaalsContact CG-CG2 3.44Å; M331-I428 HydrophobicContact SD-CG2 3.53Å; M331-I428 VanDerWaalsContact SD-CG2 3.53Å; L333-I428 HydrophobicContact CD2-CD1 3.85Å; L333-I428 HydrophobicContact CD2-CG1 3.86Å; L333-I428 HydrophobicContact CD2-CG2 4.2Å; L333-I428 HydrophobicContact CG-CG2 4.44Å; L426-I428 WeakPolarHBondContact O-CG1 3.27Å; L426-I428 PolarHBondContact O-N 2.87Å; L426-I428 VanDerWaalsContact O-N 3.09Å; I428-F430 HydrophobicContact CB-CD2 4.49Å; I428-F430 HydrophobicContact CB-CE2 3.87Å; I428-F430 HydrophobicContact CB-CZ 4.49Å; I428-F430 HydrophobicContact CG2-CD2 4.01Å; I428-F430 HydrophobicContact CG2-CE1 4.47Å; I428-F430 HydrophobicContact CG2-CE2 3.42Å; I428-F430 VanDerWaalsContact CG2-CE2 3.42Å; I428-F430 HydrophobicContact CG2-CZ 3.7Å
429	N	47.1	Very low	58	Low	63 Å²	63	61 Å²	61	34%	0.337	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	112.2	173.4	-70.9	34.3	0	0	0	109.4	K332 M431	K332-N429 WeakPolarHBondContact CB-O 3.47Å; K332-N429 PolarHBondContact N-O 3.34Å; N429-M431 PolarHBondContact O-N 2.75Å
430	F	48.8	Very low	60.3	Low	59 Å²	59	58.9 Å²	58.9	26%	0.259	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	102.3	167.8	-65.9	-92.5	0	0	0	108.2	N330 M331 I415 G416 T418 I428	N330-F430 WeakPolarHBondContact O-CA 3.42Å; N330-F430 WeakPolarHBondContact O-CD1 3.4Å; M331-F430 HydrophobicContact CB-CD1 4.08Å; M331-F430 HydrophobicContact CB-CE1 3.97Å; M331-F430 HydrophobicContact CG-CD1 4.21Å; M331-F430 HydrophobicContact CG-CE1 3.84Å; M331-F430 HydrophobicContact CG-CZ 4.16Å; M331-F430 HydrophobicContact SD-CE1 3.72Å; M331-F430 HydrophobicContact SD-CZ 3.73Å; I415-F430 WeakPolarHBondContact CA-O 3.45Å; G416-F430 PolarHBondContact N-O 2.69Å; G416-F430 PolarHBondContact O-N 3.45Å; T418-F430 HydrophobicContact CG2-CE2 3.9Å; I428-F430 HydrophobicContact CB-CD2 4.49Å; I428-F430 HydrophobicContact CB-CE2 3.87Å; I428-F430 HydrophobicContact CB-CZ 4.49Å; I428-F430 HydrophobicContact CG2-CD2 4.01Å; I428-F430 HydrophobicContact CG2-CE1 4.47Å; I428-F430 HydrophobicContact CG2-CE2 3.42Å; I428-F430 VanDerWaalsContact CG2-CE2 3.42Å; I428-F430 HydrophobicContact CG2-CZ 3.7Å
431	M	53	Low	62.3	Low	64 Å²	64	56.8 Å²	56.8	32%	0.315	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	98.5	169.6	-70.5	-178.5	68.5	0	0	108.1	S329 N429	S329-M431 CarbonylContact C-O 3.44Å; S329-M431 PolarHBondContact OG-O 2.88Å; N429-M431 PolarHBondContact O-N 2.75Å
432	S	62.2	Low	63.9	Low	3 Å²	3	52.2 Å²	52.2	2%	0.021	27%	0.265	C	S	.	.			trans	-100.4	97.4	169.2	-166.8	0	0	0	0	110	S329 N348 P414	S329-S432 WeakPolarHBondContact O-CA 3.09Å; N348-S432 WeakPolarHBondContact ND2-CB 3.1Å; N348-S432 PolarHBondContact ND2-OG 3Å; P414-S432 WeakPolarHBondContact CD-O 3.47Å
433	N	74	Confident	65.5	Low	43 Å²	43	52 Å²	52	23%	0.23	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-73.8	131.1	175	-54.6	-0.6	0	0	0	108.6	T328	T328-N433 WeakPolarHBondContact CG2-O 3.28Å
434	K	84.2	Confident	67.5	Low	14 Å²	14	43.1 Å²	43.1	6%	0.061	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-51.5	125	172.9	-174.1	-161	76.8	68.2	0	109.7	K304 W347 F412 I505	K304-K434 WeakPolarHBondContact CE-O 3.49Å; K304-K434 PolarHBondContact NZ-O 2.88Å; W347-K434 HydrophobicContact CZ2-CG 4.09Å; F412-K434 HydrophobicContact CD1-CD 4.15Å; F412-K434 HydrophobicContact CD2-CD 4.49Å; F412-K434 HydrophobicContact CE1-CD 3.98Å; F412-K434 HydrophobicContact CE2-CD 4.3Å; F412-K434 HydrophobicContact CG-CD 4.4Å; F412-K434 HydrophobicContact CZ-CD 4.05Å; F412-K434 VanDerWaalsContact O-CB 3.32Å; F412-K434 WeakPolarHBondContact O-CB 3.41Å; F412-K434 PolarHBondContact O-N 2.76Å; K434-I505 HydrophobicContact CD-CD1 3.75Å
435	P	87.8	Confident	69	Low	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-63.1	163.8	176.6	25.8	-33.2	0	0	0	112.1	A303 T328 W347 L438 I455	A303-P435 WeakPolarHBondContact O-CB 3.44Å; T328-P435 HydrophobicContact CG2-CB 3.87Å; W347-P435 HydrophobicContact CB-CG 3.9Å; W347-P435 VanDerWaalsContact CD1-CD 3.47Å; W347-P435 HydrophobicContact CD2-CG 3.71Å; W347-P435 HydrophobicContact CE3-CG 4.14Å; W347-P435 HydrophobicContact CG-CG 3.64Å; P435-L438 HydrophobicContact CB-CD2 4.45Å; P435-L438 HydrophobicContact CG-CD2 3.9Å; P435-I455 HydrophobicContact CB-CD1 4.21Å; P435-I455 HydrophobicContact CG-CD1 3.82Å; P435-I455 WeakPolarHBondContact O-CD1 3.29Å
436	D	86.4	Confident	70.8	Confident	48 Å²	48	41.5 Å²	41.5	26%	0.257	22%	0.215	S	C	.	.	S	Bend	trans	-102.8	-29.7	170.3	-46.5	-41.4	0	0	0	111.1	A303 K304 I305 I455	A303-D436 PolarHBondContact O-N 2.84Å; K304-D436 WeakPolarHBondContact CA-OD2 3.25Å; K304-D436 VanDerWaalsContact CD-CG 3.48Å; K304-D436 WeakPolarHBondContact CD-OD1 3.06Å; K304-D436 WeakPolarHBondContact CD-OD2 3.38Å; K304-D436 IonicContact NZ-OD1 2.69Å; K304-D436 PolarHBondContact NZ-OD1 2.97Å; K304-D436 IonicContact NZ-OD2 3.21Å; I305-D436 HydrophobicContact CG2-CB 4.49Å; I305-D436 PolarHBondContact N-OD2 2.72Å; D436-I455 PolarHBondContact O-N 3.22Å
437	L	89.7	Confident	72.2	Confident	16 Å²	16	43.7 Å²	43.7	8%	0.084	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	150.3	172.1	-53.1	96.5	0	0	0	111.3	G302 A303 I305 M325 W452 V453	G302-L437 CarbonylContact C-O 3.57Å; G302-L437 VanDerWaalsContact CA-O 3.22Å; G302-L437 WeakPolarHBondContact CA-O 3.12Å; A303-L437 PolarHBondContact N-O 3.33Å; A303-L437 PolarHBondContact O-N 3.17Å; I305-L437 HydrophobicContact CB-CD1 3.79Å; I305-L437 HydrophobicContact CD1-CD1 4.33Å; I305-L437 HydrophobicContact CG1-CD1 4.12Å; M325-L437 HydrophobicContact CG-CD1 4.5Å; L437-W452 HydrophobicContact CB-CB 4.06Å; L437-W452 HydrophobicContact CB-CE3 4.23Å; L437-W452 HydrophobicContact CD2-CB 3.82Å; L437-V453 CarbonylContact C-O 3.5Å; L437-V453 WeakPolarHBondContact CA-O 3.27Å; L437-V453 WeakPolarHBondContact CB-O 3.37Å
438	L	91.6	Very high	73.7	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	149.9	164.7	-57.8	-171.9	0	0	0	110.6	I300 I301 W347 P435 W452 V453 I455 I485 I500 A503	I300-L438 HydrophobicContact CG2-CD1 3.98Å; I300-L438 HydrophobicContact CG2-CD2 3.96Å; I300-L438 HydrophobicContact CG2-CG 4.45Å; I301-L438 CarbonylContact O-C 3.55Å; I301-L438 WeakPolarHBondContact O-CA 3.46Å; W347-L438 HydrophobicContact CD2-CD2 4.5Å; W347-L438 HydrophobicContact CE3-CD1 4.14Å; W347-L438 HydrophobicContact CE3-CD2 3.65Å; W347-L438 HydrophobicContact CE3-CG 4.42Å; W347-L438 HydrophobicContact CZ3-CD1 4.06Å; W347-L438 HydrophobicContact CZ3-CD2 4.14Å; W347-L438 HydrophobicContact CZ3-CG 4.48Å; P435-L438 HydrophobicContact CB-CD2 4.45Å; P435-L438 HydrophobicContact CG-CD2 3.9Å; L438-W452 VanDerWaalsContact C-CE3 3.47Å; L438-W452 CarbonylContact O-C 3.53Å; L438-W452 VanDerWaalsContact O-CA 3.26Å; L438-W452 WeakPolarHBondContact O-CA 3.49Å; L438-V453 PolarHBondContact N-O 2.77Å; L438-V453 PolarHBondContact O-N 2.81Å; L438-I455 HydrophobicContact CD2-CD1 3.88Å; L438-I455 HydrophobicContact CD2-CG1 4.38Å; L438-I455 HydrophobicContact CG-CD1 4.03Å; L438-I455 HydrophobicContact CG-CG1 3.97Å; L438-I485 HydrophobicContact CD1-CD1 4.18Å; L438-I485 HydrophobicContact CD1-CG1 4.47Å; L438-I485 HydrophobicContact CD1-CG2 4.48Å; L438-I500 HydrophobicContact CB-CD1 4.33Å; L438-I500 HydrophobicContact CB-CG2 4.4Å; L438-I500 HydrophobicContact CD1-CD1 4.09Å; L438-I500 HydrophobicContact CD1-CG2 4.32Å; L438-A503 HydrophobicContact CD1-CB 3.68Å; L438-A503 HydrophobicContact CG-CB 4.32Å
439	A	89.2	Confident	75.3	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	131.8	173.5	0	0	0	0	0	109.7	Y294 I301 W441 W452	Y294-A439 VanDerWaalsContact CE2-O 3.29Å; Y294-A439 WeakPolarHBondContact CE2-O 3.41Å; Y294-A439 PolarHBondContact OH-O 3.37Å; I301-A439 HydrophobicContact CB-CB 3.87Å; I301-A439 HydrophobicContact CG2-CB 3.83Å; I301-A439 PolarHBondContact O-N 2.99Å; A439-W441 WeakPolarHBondContact CB-O 3.39Å; A439-W441 PolarHBondContact O-N 3.25Å; A439-W452 HydrophobicContact CB-CD2 4.15Å; A439-W452 HydrophobicContact CB-CE3 3.86Å; A439-W452 HydrophobicContact CB-CH2 3.92Å; A439-W452 HydrophobicContact CB-CZ2 4.22Å; A439-W452 HydrophobicContact CB-CZ3 3.73Å
440	I	89.3	Confident	76.9	Confident	26 Å²	26	50.7 Å²	50.7	13%	0.133	26%	0.261	C	S	.	.	S	Bend	trans	-59.9	-41.5	174.3	-66.9	174.4	0	0	0	109.9	Y294 E451 V453 Q499 I500	Y294-I440 WeakPolarHBondContact CE2-O 3.31Å; I440-E451 WeakPolarHBondContact CB-O 3.06Å; I440-E451 WeakPolarHBondContact CG1-O 3.21Å; I440-E451 PolarHBondContact N-O 3.06Å; I440-V453 HydrophobicContact CD1-CG2 4.09Å; I440-V453 HydrophobicContact CG1-CG2 3.63Å; I440-Q499 HydrophobicContact CG2-CB 3.83Å; I440-Q499 HydrophobicContact CG2-CG 3.84Å; I440-Q499 CarbonylContact O-C 3.57Å; I440-Q499 VanDerWaalsContact O-CA 3.29Å; I440-Q499 WeakPolarHBondContact O-CA 3.29Å; I440-Q499 WeakPolarHBondContact O-CB 3.42Å; I440-I500 PolarHBondContact O-N 3.3Å
441	W	84.6	Confident	78.5	Confident	62 Å²	62	49.8 Å²	49.8	24%	0.235	26%	0.258	C	S	.	.	S	Bend	trans	-123.4	148	177.7	-58.1	111.4	0	0	0	109	P292 A439 I443 S444 F490 Q497 N498 Q499	P292-W441 HydrophobicContact CB-CE3 4.42Å; P292-W441 WeakPolarHBondContact O-CB 3.46Å; A439-W441 WeakPolarHBondContact CB-O 3.39Å; A439-W441 PolarHBondContact O-N 3.25Å; W441-I443 HydrophobicContact CB-CG1 4.05Å; W441-I443 PolarHBondContact O-N 2.73Å; W441-S444 PolarHBondContact N-OG 2.81Å; W441-S444 WeakPolarHBondContact O-CB 3.44Å; W441-S444 PolarHBondContact O-N 2.88Å; W441-S444 PolarHBondContact O-OG 2.83Å; W441-F490 HydrophobicContact CH2-CB 4.18Å; W441-Q497 HydrophobicContact CH2-CB 4.13Å; W441-Q497 HydrophobicContact CZ3-CB 3.81Å; W441-N498 WeakPolarHBondContact CZ3-O 3.37Å; W441-Q499 HydrophobicContact CD2-CB 3.98Å; W441-Q499 HydrophobicContact CE3-CB 3.65Å; W441-Q499 HydrophobicContact CH2-CB 3.74Å; W441-Q499 HydrophobicContact CZ2-CB 3.99Å; W441-Q499 HydrophobicContact CZ3-CB 3.55Å
442	P	77.7	Confident	80.1	Confident	24 Å²	24	47.5 Å²	47.5	16%	0.156	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-19.9	177.5	-20.9	34.8	0	0	0	113.4	G290 P292 Y294 I301	G290-P442 WeakPolarHBondContact O-CB 3.47Å; P292-P442 WeakPolarHBondContact O-CD 3.27Å; Y294-P442 HydrophobicContact CD1-CG 3.72Å; Y294-P442 HydrophobicContact CD2-CG 3.96Å; Y294-P442 HydrophobicContact CE1-CB 4.46Å; Y294-P442 HydrophobicContact CE1-CG 3.83Å; Y294-P442 HydrophobicContact CE2-CG 4.1Å; Y294-P442 HydrophobicContact CG-CG 3.79Å; I301-P442 HydrophobicContact CG1-CB 4.36Å
443	I	73.2	Confident	81.5	Confident	86 Å²	86	48.2 Å²	48.2	44%	0.441	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	6.2	178.6	63.8	166.1	0	0	0	114.2	N291 P292 W441	N291-I443 HydrophobicContact CB-CG2 4.45Å; P292-I443 HydrophobicContact CB-CD1 3.86Å; P292-I443 HydrophobicContact CB-CG1 4.5Å; W441-I443 HydrophobicContact CB-CG1 4.05Å; W441-I443 PolarHBondContact O-N 2.73Å
444	S	79.3	Confident	82.2	Confident	14 Å²	14	49.9 Å²	49.9	10%	0.098	26%	0.262	C	S	.	.			trans	-58.6	136	-178	-66.8	0	0	0	0	112.4	W441 E451	W441-S444 PolarHBondContact N-OG 2.81Å; W441-S444 WeakPolarHBondContact O-CB 3.44Å; W441-S444 PolarHBondContact O-N 2.88Å; W441-S444 PolarHBondContact O-OG 2.83Å; S444-E451 VanDerWaalsContact CB-O 3.3Å; S444-E451 WeakPolarHBondContact CB-O 3.35Å; S444-E451 PolarHBondContact OG-O 2.72Å
445	K	73.7	Confident	82.5	Confident	112 Å²	112	50 Å²	50	49%	0.487	26%	0.264	S	S	.	.			trans	-82.7	137.8	-173.8	-56.6	-169.2	-179.8	-169.4	0	111.8	M325 N447 R448 E451 W452	M325-K445 WeakPolarHBondContact CE-O 3.4Å; K445-N447 WeakPolarHBondContact CB-OD1 3.36Å; K445-N447 PolarHBondContact O-N 2.98Å; K445-R448 HydrophobicContact CB-CB 4.33Å; K445-R448 HydrophobicContact CB-CG 4.19Å; K445-R448 PolarHBondContact O-N 2.91Å; K445-E451 PolarHBondContact N-OE2 3.38Å; K445-W452 PolarHBondContact O-NE1 2.92Å
446	I	71.6	Confident	82.2	Confident	95 Å²	95	55.8 Å²	55.8	49%	0.487	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-8.6	179.5	58.7	166.9	0	0	0	115	M325 P327 W452	M325-I446 VanDerWaalsContact CE-C 3.47Å; M325-I446 VanDerWaalsContact CE-O 3.26Å; M325-I446 WeakPolarHBondContact CE-O 3.36Å; M325-I446 PolarHBondContact N-O 2.66Å; M325-I446 WeakPolarHBondContact O-CB 3.32Å; M325-I446 WeakPolarHBondContact O-CG2 3.34Å; P327-I446 HydrophobicContact CG-CG2 3.84Å; I446-W452 HydrophobicContact CG2-CZ2 4.45Å
447	N	69.4	Low	81.3	Confident	116 Å²	116	55 Å²	55	62%	0.62	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.5	13.6	176.7	67.7	-14.1	0	0	0	113.8	K445	K445-N447 WeakPolarHBondContact CB-OD1 3.36Å; K445-N447 PolarHBondContact O-N 2.98Å
448	R	71	Confident	79.5	Confident	119 Å²	119	59.7 Å²	59.7	45%	0.449	31%	0.311	S	S	.	.			trans	-125.9	86.6	176.8	-69.8	-176.9	170.3	-173.7	-8.1	110.8	K445 S450 E451 W452	K445-R448 HydrophobicContact CB-CB 4.33Å; K445-R448 HydrophobicContact CB-CG 4.19Å; K445-R448 PolarHBondContact O-N 2.91Å; R448-S450 PolarHBondContact O-N 2.8Å; R448-S450 VanDerWaalsContact O-N 3.09Å; R448-E451 HydrophobicContact CB-CB 4.38Å; R448-E451 HydrophobicContact CB-CG 3.94Å; R448-E451 WeakPolarHBondContact CD-OE1 3.41Å; R448-E451 WeakPolarHBondContact CD-OE2 3.36Å; R448-E451 IonicContact CZ-OE1 2.88Å; R448-E451 IonicContact NE-OE1 2.66Å; R448-E451 IonicContact NH1-OE1 3.12Å; R448-E451 PolarHBondContact NH1-OE1 3.39Å; R448-E451 PolarHBondContact O-N 3.46Å; R448-W452 VanDerWaalsContact O-CD1 3.29Å
449	S	77.7	Confident	77.5	Confident	65 Å²	65	62.7 Å²	62.7	46%	0.455	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-56.4	-27.3	-178.6	50.7	0	0	0	0	113.9	M325 E451 W452	M325-S449 VanDerWaalsContact CE-N 3.35Å; S449-E451 PolarHBondContact O-N 2.82Å; S449-W452 PolarHBondContact O-N 2.95Å
450	S	79.9	Confident	75.6	Confident	99 Å²	99	70.5 Å²	70.5	69%	0.692	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-65	-13.6	173.5	59.4	0	0	0	0	115.2	R448 W452	R448-S450 PolarHBondContact O-N 2.8Å; R448-S450 VanDerWaalsContact O-N 3.09Å; S450-W452 VanDerWaalsContact C-N 3.35Å
451	E	82.6	Confident	73.7	Confident	40 Å²	40	75 Å²	75	19%	0.187	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-95.8	11.3	178	-61.1	178.9	171	0	0	112.2	I440 S444 K445 R448 S449	I440-E451 WeakPolarHBondContact CB-O 3.06Å; I440-E451 WeakPolarHBondContact CG1-O 3.21Å; I440-E451 PolarHBondContact N-O 3.06Å; S444-E451 VanDerWaalsContact CB-O 3.3Å; S444-E451 WeakPolarHBondContact CB-O 3.35Å; S444-E451 PolarHBondContact OG-O 2.72Å; K445-E451 PolarHBondContact N-OE2 3.38Å; R448-E451 HydrophobicContact CB-CB 4.38Å; R448-E451 HydrophobicContact CB-CG 3.94Å; R448-E451 WeakPolarHBondContact CD-OE1 3.41Å; R448-E451 WeakPolarHBondContact CD-OE2 3.36Å; R448-E451 IonicContact CZ-OE1 2.88Å; R448-E451 IonicContact NE-OE1 2.66Å; R448-E451 IonicContact NH1-OE1 3.12Å; R448-E451 PolarHBondContact NH1-OE1 3.39Å; R448-E451 PolarHBondContact O-N 3.46Å; S449-E451 PolarHBondContact O-N 2.82Å
452	W	86.8	Confident	72.5	Confident	16 Å²	16	77.6 Å²	77.6	6%	0.061	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	145.4	-175.6	-61.4	72.9	0	0	0	111.7	I301 A303 M325 L437 L438 A439 K445 I446 R448 S449 S450	I301-W452 HydrophobicContact CG2-CH2 3.88Å; I301-W452 HydrophobicContact CG2-CZ3 4.21Å; A303-W452 HydrophobicContact CB-CE3 3.94Å; A303-W452 HydrophobicContact CB-CH2 3.78Å; A303-W452 HydrophobicContact CB-CZ3 3.38Å; M325-W452 HydrophobicContact CB-CD2 4.3Å; M325-W452 HydrophobicContact CB-CZ2 4.21Å; M325-W452 HydrophobicContact CE-CG 4.28Å; M325-W452 HydrophobicContact CG-CD2 3.84Å; M325-W452 HydrophobicContact CG-CE3 4.35Å; M325-W452 HydrophobicContact CG-CG 3.93Å; L437-W452 HydrophobicContact CB-CB 4.06Å; L437-W452 HydrophobicContact CB-CE3 4.23Å; L437-W452 HydrophobicContact CD2-CB 3.82Å; L438-W452 VanDerWaalsContact C-CE3 3.47Å; L438-W452 CarbonylContact O-C 3.53Å; L438-W452 VanDerWaalsContact O-CA 3.26Å; L438-W452 WeakPolarHBondContact O-CA 3.49Å; A439-W452 HydrophobicContact CB-CD2 4.15Å; A439-W452 HydrophobicContact CB-CE3 3.86Å; A439-W452 HydrophobicContact CB-CH2 3.92Å; A439-W452 HydrophobicContact CB-CZ2 4.22Å; A439-W452 HydrophobicContact CB-CZ3 3.73Å; K445-W452 PolarHBondContact O-NE1 2.92Å; I446-W452 HydrophobicContact CG2-CZ2 4.45Å; R448-W452 VanDerWaalsContact O-CD1 3.29Å; S449-W452 PolarHBondContact O-N 2.95Å; S450-W452 VanDerWaalsContact C-N 3.35Å
453	V	91.2	Very high	71.9	Confident	18 Å²	18	83.6 Å²	83.6	11%	0.109	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	124.4	-179.8	159.7	0	0	0	0	109.3	L437 L438 I440 V501	L437-V453 CarbonylContact C-O 3.5Å; L437-V453 WeakPolarHBondContact CA-O 3.27Å; L437-V453 WeakPolarHBondContact CB-O 3.37Å; L438-V453 PolarHBondContact N-O 2.77Å; L438-V453 PolarHBondContact O-N 2.81Å; I440-V453 HydrophobicContact CD1-CG2 4.09Å; I440-V453 HydrophobicContact CG1-CG2 3.63Å; V453-V501 WeakPolarHBondContact CG2-O 3.17Å
454	P	90.2	Very high	71.9	Confident	77 Å²	77	80.1 Å²	80.1	50%	0.5	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	140.1	174.9	30.1	-34.5	0	0	0	110.8	Q456	P454-Q456 PolarHBondContact O-N 2.03Å
455	I	89.6	Confident	72.1	Confident	18 Å²	18	82.2 Å²	82.2	9%	0.092	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	113.1	173.2	-64.4	160.1	0	0	0	108.2	W347 P435 D436 L438 N457 A503 I505	W347-I455 HydrophobicContact CE3-CD1 4.31Å; W347-I455 HydrophobicContact CH2-CD1 3.96Å; W347-I455 HydrophobicContact CH2-CG2 4.41Å; W347-I455 HydrophobicContact CZ3-CD1 3.84Å; W347-I455 HydrophobicContact CZ3-CG1 4.38Å; P435-I455 HydrophobicContact CB-CD1 4.21Å; P435-I455 HydrophobicContact CG-CD1 3.82Å; P435-I455 WeakPolarHBondContact O-CD1 3.29Å; D436-I455 PolarHBondContact O-N 3.22Å; L438-I455 HydrophobicContact CD2-CD1 3.88Å; L438-I455 HydrophobicContact CD2-CG1 4.38Å; L438-I455 HydrophobicContact CG-CD1 4.03Å; L438-I455 HydrophobicContact CG-CG1 3.97Å; I455-N457 PolarHBondContact O-N 3.37Å; I455-A503 HydrophobicContact CG1-CB 3.99Å; I455-I505 HydrophobicContact CG2-CD1 3.78Å; I455-I505 HydrophobicContact CG2-CG1 3.68Å
456	Q	82.4	Confident	72.7	Confident	120 Å²	120	82.2 Å²	82.2	56%	0.561	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.6	119.5	-178.2	-63.1	-176.2	-3	0	0	111	P454 A503 K504 I505	P454-Q456 PolarHBondContact O-N 2.03Å; Q456-A503 PolarHBondContact N-O 2.77Å; Q456-K504 HydrophobicContact CB-CB 4.06Å; Q456-K504 CarbonylContact O-C 3.58Å; Q456-K504 WeakPolarHBondContact O-CA 3.34Å; Q456-K504 VanDerWaalsContact O-CB 3.28Å; Q456-K504 WeakPolarHBondContact O-CB 3.41Å; Q456-I505 PolarHBondContact O-N 2.68Å
457	N	66.5	Low	73.6	Confident	32 Å²	32	77.8 Å²	77.8	17%	0.171	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	120.2	156.8	-83.4	5.8	0	0	0	107.8	I455 I459 Y507	I455-N457 PolarHBondContact O-N 3.37Å; N457-I459 PolarHBondContact O-N 2.87Å; N457-Y507 PolarHBondContact ND2-OH 2.85Å; N457-Y507 VanDerWaalsContact ND2-OH 3.09Å; N457-Y507 PolarHBondContact OD1-OH 3.37Å
458	L	52.7	Low	74.7	Confident	115 Å²	115	81 Å²	81	60%	0.602	42%	0.421	S	S	*	.	S	Bend	trans	-68.5	-10	176.1	-80.3	168.1	0	0	0	113.3	K504	L458-K504 HydrophobicContact CD1-CD 4.07Å
459	I	50	Low	75.5	Confident	62 Å²	62	75.7 Å²	75.7	32%	0.318	40%	0.404	S	S	.	.	S	Bend	trans	-96.4	113.3	171.9	-50.7	-178.6	0	0	0	107.4	N457 N461 Y507	N457-I459 PolarHBondContact O-N 2.87Å; I459-N461 HydrophobicContact CG2-CB 4.31Å; I459-N461 CarbonylContact O-C 3.46Å; I459-N461 PolarHBondContact O-N 3.4Å; I459-Y507 HydrophobicContact CD1-CD2 4.19Å
460	N	47.7	Very low	76.2	Confident	165 Å²	165	77.5 Å²	77.5	88%	0.882	41%	0.408	S	S	*	.	S	Bend	trans	-58.8	-15.7	179.8	-75.2	-21.3	0	0	0	114.2
461	N	49.9	Very low	76.5	Confident	121 Å²	121	76.7 Å²	76.7	65%	0.647	40%	0.402	S	S	*	.	S	Bend	trans	-97	123.2	171.3	-62	-26.2	0	0	0	108.6	I459 F463	I459-N461 HydrophobicContact CG2-CB 4.31Å; I459-N461 CarbonylContact O-C 3.46Å; I459-N461 PolarHBondContact O-N 3.4Å; N461-F463 PolarHBondContact O-N 3.46Å
462	N	58.7	Low	76.6	Confident	115 Å²	115	74.8 Å²	74.8	62%	0.615	39%	0.393	S	S	*	.	S	Bend	trans	-68	19.5	178.1	-79.8	-29.3	0	0	0	114.9	W408	W408-N462 WeakPolarHBondContact CZ2-O 3.49Å
463	F	66.1	Low	76.8	Confident	151 Å²	151	78.6 Å²	78.6	66%	0.662	41%	0.408	S	S	*	.	S	Bend	trans	-128.6	143.7	-178.6	-75.3	-83.6	0	0	0	110.8	N461	N461-F463 PolarHBondContact O-N 3.46Å
464	P	72.9	Confident	76.9	Confident	13 Å²	13	77.7 Å²	77.7	8%	0.084	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-68.3	154.3	177.1	29.5	-32.3	0	0	0	110.8	Q404 W408 T466 L478 Y509	Q404-P464 HydrophobicContact CG-CG 3.98Å; W408-P464 HydrophobicContact CD2-CG 4.02Å; W408-P464 HydrophobicContact CE3-CB 4.09Å; W408-P464 HydrophobicContact CE3-CG 3.56Å; W408-P464 HydrophobicContact CZ3-CB 4.03Å; W408-P464 HydrophobicContact CZ3-CG 3.86Å; P464-T466 PolarHBondContact O-N 3.14Å; P464-L478 HydrophobicContact CB-CD2 4.33Å; P464-L478 HydrophobicContact CG-CD2 4.39Å; P464-Y509 VanDerWaalsContact CA-OH 3.3Å; P464-Y509 WeakPolarHBondContact CA-OH 3.22Å; P464-Y509 HydrophobicContact CB-CE1 4.02Å; P464-Y509 WeakPolarHBondContact CB-OH 3.35Å
465	T	82.6	Confident	77	Confident	58 Å²	58	78 Å²	78	36%	0.356	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-58.6	132.5	-179.7	46.9	0	0	0	0	111.3	Q404 P467 Y509	Q404-T465 PolarHBondContact NE2-O 2.62Å; T465-P467 WeakPolarHBondContact O-CD 3.45Å; T465-Y509 PolarHBondContact N-OH 3.46Å; T465-Y509 WeakPolarHBondContact OG1-CE1 3.33Å
466	T	86.3	Confident	77.1	Confident	111 Å²	111	82.5 Å²	82.5	68%	0.681	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-61.7	120.3	-178.6	-46	0	0	0	0	110.9	V401 P464	V401-T466 HydrophobicContact CG2-CG2 3.88Å; P464-T466 PolarHBondContact O-N 3.14Å
467	P	91.3	Very high	77.6	Confident	3 Å²	3	76.8 Å²	76.8	2%	0.019	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-75.9	148.7	-176.1	32.2	-35.5	0	0	0	110.3	C400 V401 Q404 T465 Y475 L477	C400-P467 HydrophobicContact CB-CB 4.14Å; C400-P467 HydrophobicContact CB-CG 3.84Å; C400-P467 WeakPolarHBondContact O-CG 3.4Å; V401-P467 HydrophobicContact CG2-CG 4.43Å; Q404-P467 HydrophobicContact CB-CG 4.15Å; T465-P467 WeakPolarHBondContact O-CD 3.45Å; P467-Y475 VanDerWaalsContact CA-O 3.28Å; P467-Y475 WeakPolarHBondContact CA-O 3.05Å; P467-Y475 WeakPolarHBondContact CB-O 3.43Å; P467-L477 HydrophobicContact CB-CD1 4.31Å; P467-L477 HydrophobicContact CG-CD1 4.29Å
468	R	91.8	Very high	78.8	Confident	182 Å²	182	75.3 Å²	75.3	69%	0.687	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	125.2	175.1	175.9	177.1	-71.5	-174.2	-2.3	109.7	Y475	R468-Y475 PolarHBondContact N-O 2.84Å; R468-Y475 VanDerWaalsContact N-O 3.09Å; R468-Y475 PolarHBondContact O-N 2.63Å
469	G	89.5	Confident	80.7	Confident	9 Å²	9	71.8 Å²	71.8	9%	0.093	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	127.1	177.4	0	0	0	0	0	113.3	T397 C400 Y473	T397-G469 PolarHBondContact OG1-N 3.12Å; T397-G469 VanDerWaalsContact OG1-N 3.09Å; T397-G469 PolarHBondContact OG1-O 2.99Å; C400-G469 WeakPolarHBondContact SG-CA 3.41Å; G469-Y473 WeakPolarHBondContact CA-O 3.36Å
470	L	90.7	Very high	82.6	Confident	103 Å²	103	68.8 Å²	68.8	54%	0.539	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	121.4	177.2	-179.8	64.3	0	0	0	110.7	G472 Y473 Y475	L470-G472 VanDerWaalsContact C-N 3.31Å; L470-G472 PolarHBondContact O-N 3.2Å; L470-G472 VanDerWaalsContact O-N 3.12Å; L470-Y473 PolarHBondContact N-O 2.78Å; L470-Y473 WeakPolarHBondContact O-CB 3.27Å; L470-Y473 PolarHBondContact O-N 3.3Å; L470-Y475 HydrophobicContact CB-CE2 4.33Å
471	S	86.4	Confident	84.7	Confident	82 Å²	82	61 Å²	61	57%	0.573	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.9	47.5	167.7	-55.7	0	0	0	0	115.2
472	G	85.6	Confident	86.7	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.2	-12.2	-179.8	0	0	0	0	0	115.8	W396 L470 F513 F514	W396-G472 VanDerWaalsContact CE2-N 3.31Å; L470-G472 VanDerWaalsContact C-N 3.31Å; L470-G472 PolarHBondContact O-N 3.2Å; L470-G472 VanDerWaalsContact O-N 3.12Å; G472-F513 WeakPolarHBondContact O-CD2 3.3Å; G472-F514 PolarHBondContact O-N 2.76Å
473	Y	90.6	Very high	88.3	Confident	95 Å²	95	52.3 Å²	52.3	37%	0.373	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	138.1	172.6	-72.8	-93.8	0	0	0	111.5	G469 L470 Y475 V512 F513	G469-Y473 WeakPolarHBondContact CA-O 3.36Å; L470-Y473 PolarHBondContact N-O 2.78Å; L470-Y473 WeakPolarHBondContact O-CB 3.27Å; L470-Y473 PolarHBondContact O-N 3.3Å; Y473-Y475 HydrophobicContact CG-CE2 4.32Å; Y473-V512 CarbonylContact C-O 3.59Å; Y473-V512 WeakPolarHBondContact CA-O 3.03Å; Y473-F513 HydrophobicContact CD1-CB 3.95Å; Y473-F513 HydrophobicContact CD1-CD2 4.02Å; Y473-F513 HydrophobicContact CD1-CG 4.39Å; Y473-F513 AromaticContact CD2-CD2 3.4Å; Y473-F513 HydrophobicContact CD2-CD2 3.4Å; Y473-F513 AromaticContact CD2-CE2 3.75Å; Y473-F513 HydrophobicContact CD2-CE2 3.75Å; Y473-F513 HydrophobicContact CD2-CG 4.42Å; Y473-F513 HydrophobicContact CE1-CB 3.66Å; Y473-F513 AromaticContact CE1-CD2 3.89Å; Y473-F513 HydrophobicContact CE1-CD2 3.89Å; Y473-F513 AromaticContact CE1-CG 3.99Å; Y473-F513 HydrophobicContact CE1-CG 3.99Å; Y473-F513 AromaticContact CE2-CD2 3.22Å; Y473-F513 HydrophobicContact CE2-CD2 3.22Å; Y473-F513 AromaticContact CE2-CE2 3.44Å; Y473-F513 HydrophobicContact CE2-CE2 3.44Å; Y473-F513 VanDerWaalsContact CE2-CE2 3.44Å; Y473-F513 HydrophobicContact CE2-CG 4Å; Y473-F513 HydrophobicContact CE2-CZ 4.36Å; Y473-F513 AromaticContact CG-CD2 3.79Å; Y473-F513 HydrophobicContact CG-CD2 3.79Å; Y473-F513 AromaticContact CZ-CD2 3.47Å; Y473-F513 VanDerWaalsContact CZ-CD2 3.47Å; Y473-F513 AromaticContact CZ-CG 3.76Å
474	C	93	Very high	89.6	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	112	158.7	-61.5	0	0	0	0	108.7	C400 L477 D511 V512 F514	C400-C474 WeakPolarHBondContact CA-SG 3.3Å; C400-C474 HydrophobicContact CB-CB 3.73Å; C400-C474 WeakPolarHBondContact CB-SG 3Å; C400-C474 WeakPolarHBondContact SG-CA 3.41Å; C400-C474 WeakPolarHBondContact SG-CB 3.24Å; C400-C474 CovalentContact SG-SG 2.02Å; C400-C474 PolarHBondContact SG-SG 3.19Å; C474-L477 HydrophobicContact CB-CB 4.06Å; C474-L477 HydrophobicContact CB-CD1 4.12Å; C474-L477 HydrophobicContact CB-CD2 4.32Å; C474-L477 HydrophobicContact CB-CG 4.4Å; C474-D511 WeakPolarHBondContact O-CA 3.22Å; C474-V512 PolarHBondContact N-O 3.5Å; C474-V512 PolarHBondContact O-N 3.09Å; C474-F514 HydrophobicContact CB-CD2 4.41Å; C474-F514 HydrophobicContact CB-CE2 3.87Å; C474-F514 WeakPolarHBondContact SG-CE2 3.44Å
475	Y	93.7	Very high	90.7	Very high	82 Å²	82	44.9 Å²	44.9	32%	0.322	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	141.5	175.7	-63	-86.2	0	0	0	110.7	P467 R468 L470 Y473 L477 D511	P467-Y475 VanDerWaalsContact CA-O 3.28Å; P467-Y475 WeakPolarHBondContact CA-O 3.05Å; P467-Y475 WeakPolarHBondContact CB-O 3.43Å; R468-Y475 PolarHBondContact N-O 2.84Å; R468-Y475 VanDerWaalsContact N-O 3.09Å; R468-Y475 PolarHBondContact O-N 2.63Å; L470-Y475 HydrophobicContact CB-CE2 4.33Å; Y473-Y475 HydrophobicContact CG-CE2 4.32Å; Y475-L477 PolarHBondContact O-N 2.69Å; Y475-D511 WeakPolarHBondContact CA-OD1 3.38Å; Y475-D511 HydrophobicContact CD1-CB 4.14Å
476	Q	91.7	Very high	91.4	Very high	114 Å²	114	45.2 Å²	45.2	53%	0.533	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	53.7	37.9	-175.7	-51.4	-175.8	-91.2	0	0	112.9	Y509 D511	Q476-Y509 WeakPolarHBondContact O-CD1 3.24Å; Q476-D511 PolarHBondContact N-OD1 3.42Å
477	L	92.2	Very high	91.8	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	134.6	174	-170.4	74.7	0	0	0	109.3	Q404 I407 P467 C474 Y475 I479 Y509 G510 V512 F514	Q404-L477 HydrophobicContact CB-CD1 3.97Å; I407-L477 HydrophobicContact CD1-CD2 4.02Å; I407-L477 HydrophobicContact CD1-CG 4.3Å; P467-L477 HydrophobicContact CB-CD1 4.31Å; P467-L477 HydrophobicContact CG-CD1 4.29Å; C474-L477 HydrophobicContact CB-CB 4.06Å; C474-L477 HydrophobicContact CB-CD1 4.12Å; C474-L477 HydrophobicContact CB-CD2 4.32Å; C474-L477 HydrophobicContact CB-CG 4.4Å; Y475-L477 PolarHBondContact O-N 2.69Å; L477-I479 PolarHBondContact O-N 2.74Å; L477-Y509 CarbonylContact O-C 3.52Å; L477-Y509 VanDerWaalsContact O-CA 3.27Å; L477-Y509 WeakPolarHBondContact O-CA 3.01Å; L477-G510 PolarHBondContact N-O 2.91Å; L477-G510 PolarHBondContact O-N 3.36Å; L477-V512 HydrophobicContact CB-CG2 4.39Å; L477-V512 HydrophobicContact CD2-CB 4.11Å; L477-V512 HydrophobicContact CD2-CG2 3.96Å; L477-F514 HydrophobicContact CD2-CE2 4Å; L477-F514 HydrophobicContact CD2-CZ 3.81Å
478	L	91.9	Very high	91.7	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	127.9	167.9	-176.5	66.5	0	0	0	110.4	Q404 I407 W408 L411 P464 G480 Y507 Y509	Q404-L478 HydrophobicContact CG-CB 3.94Å; I407-L478 WeakPolarHBondContact CD1-O 3.37Å; I407-L478 HydrophobicContact CG2-CB 4.32Å; I407-L478 HydrophobicContact CG2-CD2 4.05Å; I407-L478 HydrophobicContact CG2-CG 3.98Å; W408-L478 HydrophobicContact CB-CD2 4.21Å; W408-L478 HydrophobicContact CE3-CD2 3.69Å; L411-L478 HydrophobicContact CD1-CD1 4.35Å; L411-L478 HydrophobicContact CD1-CD2 3.8Å; L411-L478 HydrophobicContact CD1-CG 3.98Å; P464-L478 HydrophobicContact CB-CD2 4.33Å; P464-L478 HydrophobicContact CG-CD2 4.39Å; L478-G480 WeakPolarHBondContact CD1-O 3.35Å; L478-Y507 HydrophobicContact CD1-CD1 4.03Å; L478-Y507 HydrophobicContact CD1-CG 4.24Å; L478-Y509 HydrophobicContact CB-CD1 4.32Å; L478-Y509 HydrophobicContact CB-CE1 4.25Å; L478-Y509 HydrophobicContact CD1-CD1 4.49Å; L478-Y509 HydrophobicContact CD1-CE1 4.16Å
479	I	91.4	Very high	91.4	Very high	41 Å²	41	38.2 Å²	38.2	21%	0.21	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	1.3	177.8	59.1	168	0	0	0	113.1	L477 I508 V512 I523 T524	L477-I479 PolarHBondContact O-N 2.74Å; I479-I508 HydrophobicContact CD1-CG2 4.11Å; I479-I508 HydrophobicContact CG1-CB 4.41Å; I479-I508 HydrophobicContact CG1-CG2 3.89Å; I479-I508 WeakPolarHBondContact CG1-O 3.35Å; I479-I508 PolarHBondContact N-O 3.15Å; I479-V512 HydrophobicContact CG2-CG2 4.01Å; I479-I523 WeakPolarHBondContact O-CA 3.31Å; I479-T524 PolarHBondContact O-N 3.04Å; I479-T524 PolarHBondContact O-OG1 3.38Å
480	G	91.1	Very high	90.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.1	-173.6	176.8	0	0	0	0	0	114.7	L478 I508 T524	L478-G480 WeakPolarHBondContact CD1-O 3.35Å; G480-I508 PolarHBondContact N-O 3.49Å; G480-I508 PolarHBondContact O-N 3.25Å; G480-T524 CarbonylContact C-O 3.15Å; G480-T524 WeakPolarHBondContact CA-O 3.2Å
481	Q	90.2	Very high	90.2	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	148.9	171.3	69.3	-170.2	-6.7	0	0	112	L411 I483 I505 N506 Y507 T524 Q525 R526	L411-Q481 HydrophobicContact CD2-CG 4.16Å; L411-Q481 PolarHBondContact O-NE2 3.47Å; Q481-I483 HydrophobicContact CG-CD1 4.47Å; Q481-I483 HydrophobicContact CG-CG1 4.35Å; Q481-I505 HydrophobicContact CB-CG2 3.87Å; Q481-I505 HydrophobicContact CG-CG2 4.35Å; Q481-N506 CarbonylContact C-O 3.53Å; Q481-N506 WeakPolarHBondContact CA-O 3.04Å; Q481-Y507 HydrophobicContact CB-CD1 3.99Å; Q481-Y507 HydrophobicContact CB-CE1 4.24Å; Q481-T524 PolarHBondContact N-O 3.29Å; Q481-Q525 HydrophobicContact CG-CG 4.09Å; Q481-Q525 WeakPolarHBondContact O-CA 3.02Å; Q481-R526 PolarHBondContact O-N 3.2Å
482	E	92.3	Very high	89.4	Confident	55 Å²	55	39.6 Å²	39.6	26%	0.257	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	122.3	169.4	171	-173.9	-106.7	0	0	108.4	I505 N506 I508 R526	E482-I505 WeakPolarHBondContact O-CA 3.44Å; E482-N506 HydrophobicContact CB-CB 4.24Å; E482-N506 PolarHBondContact N-O 2.92Å; E482-N506 PolarHBondContact O-N 3.19Å; E482-N506 PolarHBondContact OE2-ND2 3.23Å; E482-I508 HydrophobicContact CB-CD1 4.5Å; E482-R526 CarbonylContact C-O 3.57Å; E482-R526 WeakPolarHBondContact CA-O 3.48Å; E482-R526 HydrophobicContact CB-CB 4.32Å; E482-R526 HydrophobicContact CG-CB 4.38Å
483	I	92.4	Very high	88.6	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	115.1	179.1	-64.7	161.1	0	0	0	106.8	W347 I349 I369 Q481 I485 I505 R526 V527 R528	W347-I483 HydrophobicContact CE3-CG2 4.5Å; W347-I483 HydrophobicContact CH2-CB 4.26Å; W347-I483 HydrophobicContact CH2-CD1 4.02Å; W347-I483 HydrophobicContact CH2-CG1 3.88Å; W347-I483 HydrophobicContact CH2-CG2 3.38Å; W347-I483 HydrophobicContact CZ2-CD1 3.56Å; W347-I483 HydrophobicContact CZ2-CG1 3.85Å; W347-I483 HydrophobicContact CZ2-CG2 4.11Å; W347-I483 HydrophobicContact CZ3-CG2 3.6Å; I349-I483 HydrophobicContact CG2-CD1 4.02Å; I369-I483 HydrophobicContact CD1-CD1 4.13Å; I369-I483 HydrophobicContact CD1-CG2 4.41Å; Q481-I483 HydrophobicContact CG-CD1 4.47Å; Q481-I483 HydrophobicContact CG-CG1 4.35Å; I483-I485 HydrophobicContact CG2-CD1 4.07Å; I483-I485 HydrophobicContact CG2-CG1 3.9Å; I483-I505 HydrophobicContact CG1-CG1 4.23Å; I483-R526 PolarHBondContact N-O 3.32Å; I483-V527 HydrophobicContact CB-CG2 4.3Å; I483-V527 HydrophobicContact CD1-CG2 4.2Å; I483-V527 HydrophobicContact CG2-CG1 4.34Å; I483-V527 WeakPolarHBondContact O-CA 3.48Å; I483-R528 PolarHBondContact O-N 3.46Å
484	E	94.9	Very high	87.4	Confident	8 Å²	8	50.1 Å²	50.1	4%	0.037	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	123.4	175.1	-178.8	-172	106.6	0	0	109.3	Q486 A503 K504 R528 I530	E484-Q486 HydrophobicContact CG-CG 4.5Å; E484-Q486 PolarHBondContact OE1-NE2 3.47Å; E484-A503 CarbonylContact O-C 3.46Å; E484-A503 VanDerWaalsContact O-CA 3.31Å; E484-A503 WeakPolarHBondContact O-CA 3.37Å; E484-K504 HydrophobicContact CB-CG 3.91Å; E484-K504 PolarHBondContact N-O 2.96Å; E484-K504 PolarHBondContact O-N 3.04Å; E484-K504 WeakPolarHBondContact OE1-CE 3.07Å; E484-K504 IonicContact OE1-NZ 2.69Å; E484-K504 PolarHBondContact OE1-NZ 3.15Å; E484-K504 WeakPolarHBondContact OE2-CE 3.05Å; E484-K504 IonicContact OE2-NZ 3.78Å; E484-K504 PolarHBondContact OE2-NZ 3.2Å; E484-R528 WeakPolarHBondContact CA-O 3.46Å; E484-R528 IonicContact OE2-CZ 2.74Å; E484-R528 IonicContact OE2-NH2 2.69Å; E484-R528 PolarHBondContact OE2-NH2 3.41Å; E484-I530 HydrophobicContact CG-CD1 3.64Å; E484-I530 HydrophobicContact CG-CG1 4.02Å
485	I	96	Very high	86	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	116.2	-179.7	-55.5	-179.5	0	0	0	108.6	I300 W347 I369 L438 I483 I500 V527 R528 F529 I530	I300-I485 HydrophobicContact CD1-CD1 3.56Å; I300-I485 HydrophobicContact CD1-CG2 4.36Å; W347-I485 HydrophobicContact CE3-CD1 4.47Å; W347-I485 HydrophobicContact CZ3-CD1 4.29Å; I369-I485 HydrophobicContact CG2-CD1 4.21Å; L438-I485 HydrophobicContact CD1-CD1 4.18Å; L438-I485 HydrophobicContact CD1-CG1 4.47Å; L438-I485 HydrophobicContact CD1-CG2 4.48Å; I483-I485 HydrophobicContact CG2-CD1 4.07Å; I483-I485 HydrophobicContact CG2-CG1 3.9Å; I485-I500 HydrophobicContact CG2-CD1 4.19Å; I485-I500 HydrophobicContact CG2-CG1 4.19Å; I485-I500 HydrophobicContact CG2-CG2 4.07Å; I485-V527 HydrophobicContact CD1-CG1 4.36Å; I485-R528 PolarHBondContact N-O 3.42Å; I485-F529 HydrophobicContact CB-CD1 3.99Å; I485-F529 HydrophobicContact CB-CE1 3.78Å; I485-F529 HydrophobicContact CB-CZ 4.49Å; I485-F529 HydrophobicContact CD1-CE1 4.07Å; I485-F529 HydrophobicContact CD1-CZ 4.05Å; I485-F529 HydrophobicContact CG1-CE1 4.45Å; I485-F529 HydrophobicContact CG2-CD1 4.17Å; I485-F529 HydrophobicContact CG2-CE1 3.81Å; I485-F529 WeakPolarHBondContact O-CA 3.34Å; I485-I530 PolarHBondContact O-N 2.99Å
486	Q	96.2	Very high	85.3	Confident	65 Å²	65	54.5 Å²	54.5	30%	0.304	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	122.2	-179.9	-59.1	-178	-0.2	0	0	108.7	E484 V501 G502 I530 V532	E484-Q486 HydrophobicContact CG-CG 4.5Å; E484-Q486 PolarHBondContact OE1-NE2 3.47Å; Q486-V501 PolarHBondContact O-N 3.28Å; Q486-G502 PolarHBondContact N-O 2.97Å; Q486-G502 PolarHBondContact O-N 2.87Å; Q486-G502 VanDerWaalsContact O-N 3.1Å; Q486-I530 WeakPolarHBondContact CA-O 3.26Å; Q486-I530 HydrophobicContact CG-CB 4.33Å; Q486-I530 HydrophobicContact CG-CD1 4.41Å; Q486-V532 HydrophobicContact CB-CG1 4.21Å; Q486-V532 HydrophobicContact CB-CG2 4.11Å; Q486-V532 HydrophobicContact CG-CG1 4.43Å
487	Y	95.1	Very high	84.8	Confident	29 Å²	29	50.4 Å²	50.4	11%	0.114	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	156	-178.5	77.8	-88	0	0	0	110.9	F371 N498 Q499 F529 I530 D531 V532	F371-Y487 HydrophobicContact CE1-CD2 4.41Å; F371-Y487 HydrophobicContact CE2-CD1 4.48Å; F371-Y487 HydrophobicContact CE2-CD2 4.35Å; F371-Y487 AromaticContact CE2-CG 3.95Å; F371-Y487 HydrophobicContact CE2-CG 3.95Å; F371-Y487 HydrophobicContact CZ-CD1 4.22Å; F371-Y487 AromaticContact CZ-CD2 3.55Å; F371-Y487 HydrophobicContact CZ-CD2 3.55Å; F371-Y487 HydrophobicContact CZ-CE2 4.09Å; F371-Y487 AromaticContact CZ-CG 3.59Å; F371-Y487 HydrophobicContact CZ-CG 3.59Å; Y487-N498 HydrophobicContact CD2-CB 4.38Å; Y487-Q499 CarbonylContact C-O 3.59Å; Y487-Q499 VanDerWaalsContact CA-O 3.24Å; Y487-Q499 WeakPolarHBondContact CA-O 3.18Å; Y487-Q499 WeakPolarHBondContact CB-O 3.24Å; Y487-F529 HydrophobicContact CD1-CB 4.23Å; Y487-F529 HydrophobicContact CD1-CD1 4.14Å; Y487-F529 HydrophobicContact CE1-CB 3.98Å; Y487-I530 VanDerWaalsContact CD1-O 3.26Å; Y487-I530 WeakPolarHBondContact CD1-O 3.47Å; Y487-I530 PolarHBondContact N-O 3.23Å; Y487-D531 HydrophobicContact CE1-CB 3.94Å; Y487-D531 HydrophobicContact CE2-CB 4.09Å; Y487-V532 WeakPolarHBondContact O-CG2 3.31Å; Y487-V532 PolarHBondContact O-N 3.3Å
488	A	89.8	Confident	84.6	Confident	2 Å²	2	51.5 Å²	51.5	2%	0.017	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	156.4	174.7	0	0	0	0	0	112	F490 N498 Q499 V501 V532 T533	A488-F490 HydrophobicContact CB-CD2 4.28Å; A488-F490 HydrophobicContact CB-CE2 3.68Å; A488-F490 HydrophobicContact CB-CZ 4.45Å; A488-N498 WeakPolarHBondContact O-CA 3.13Å; A488-Q499 PolarHBondContact N-O 2.99Å; A488-Q499 PolarHBondContact O-N 2.04Å; A488-V501 HydrophobicContact CB-CG2 3.83Å; A488-V532 HydrophobicContact CB-CG2 4.21Å; A488-T533 WeakPolarHBondContact CA-OG1 3.02Å
489	R	85.5	Confident	84.5	Confident	117 Å²	117	52.9 Å²	52.9	44%	0.442	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	122	-179.4	-67	169.3	-149.4	-133.1	3.1	110.2	P496 N498 D531 T533	R489-P496 HydrophobicContact CB-CB 3.85Å; R489-P496 HydrophobicContact CG-CB 4.3Å; R489-N498 WeakPolarHBondContact CG-OD1 3.38Å; R489-D531 IonicContact CZ-OD2 2.76Å; R489-D531 IonicContact NE-OD2 3.18Å; R489-D531 PolarHBondContact NE-OD2 3.13Å; R489-D531 IonicContact NH2-OD2 3.88Å; R489-D531 PolarHBondContact NH2-OD2 3.23Å; R489-T533 HydrophobicContact CB-CG2 3.83Å; R489-T533 WeakPolarHBondContact CB-OG1 3.36Å; R489-T533 HydrophobicContact CG-CG2 4.45Å; R489-T533 WeakPolarHBondContact CG-OG1 3.45Å; R489-T533 PolarHBondContact N-OG1 3.24Å
490	F	78.9	Confident	84.6	Confident	84 Å²	84	51 Å²	51	37%	0.368	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	156.2	179.9	-74.5	-93	0	0	0	112.1	W441 A488 Q497 Q499 V501	W441-F490 HydrophobicContact CH2-CB 4.18Å; A488-F490 HydrophobicContact CB-CD2 4.28Å; A488-F490 HydrophobicContact CB-CE2 3.68Å; A488-F490 HydrophobicContact CB-CZ 4.45Å; F490-Q497 PolarHBondContact N-O 2.86Å; F490-Q497 PolarHBondContact O-N 2.87Å; F490-Q499 HydrophobicContact CD2-CB 4.33Å; F490-Q499 HydrophobicContact CD2-CG 3.58Å; F490-Q499 VanDerWaalsContact CD2-OE1 3.32Å; F490-Q499 HydrophobicContact CE2-CG 3.55Å; F490-V501 HydrophobicContact CE2-CG2 4.12Å
491	G	75.7	Confident	84.7	Confident	79 Å²	79	54 Å²	54	81%	0.814	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	101.4	-132.8	178.6	0	0	0	0	0	112.8
492	S	69.5	Low	84.8	Confident	60 Å²	60	54.5 Å²	54.5	42%	0.42	29%	0.292	S	S	.	.			trans	-83.7	139.8	-176.1	-179.5	0	0	0	0	111.3	I494 F495 P496	S492-I494 PolarHBondContact O-N 2.93Å; S492-I494 VanDerWaalsContact O-N 3.12Å; S492-I494 PolarHBondContact OG-N 2.04Å; S492-I494 VanDerWaalsContact OG-N 3.14Å; S492-F495 PolarHBondContact N-O 3.35Å; S492-F495 CarbonylContact O-C 3.36Å; S492-F495 PolarHBondContact O-N 3.37Å; S492-P496 WeakPolarHBondContact O-CA 3.25Å; S492-P496 WeakPolarHBondContact O-CD 3.1Å
493	M	68.5	Low	84.9	Confident	159 Å²	159	52.1 Å²	52.1	78%	0.783	28%	0.282	S	S	*	.	S	Bend	trans	-54.7	-25.8	166.5	-90.2	-90.9	-83.1	0	0	113.3	A536	M493-A536 HydrophobicContact CE-CB 4.15Å; M493-A536 HydrophobicContact CG-CB 3.72Å; M493-A536 HydrophobicContact SD-CB 3.37Å; M493-A536 WeakPolarHBondContact SD-CB 3.34Å
494	I	64.7	Low	84.8	Confident	158 Å²	158	54.1 Å²	54.1	81%	0.81	29%	0.29	S	S	*	.	S	Bend	trans	-87.6	-27.5	178.9	-54.3	173.8	0	0	0	111.4	S492	S492-I494 PolarHBondContact O-N 2.93Å; S492-I494 VanDerWaalsContact O-N 3.12Å; S492-I494 PolarHBondContact OG-N 2.04Å; S492-I494 VanDerWaalsContact OG-N 3.14Å
495	F	64.9	Low	84.6	Confident	122 Å²	122	53.8 Å²	53.8	54%	0.535	29%	0.289	S	S	.	.	S	Bend	trans	-143.1	78.3	-179.2	-165.8	-105.1	0	0	0	110.2	S492 Q497	S492-F495 PolarHBondContact N-O 3.35Å; S492-F495 CarbonylContact O-C 3.36Å; S492-F495 PolarHBondContact O-N 3.37Å; F495-Q497 HydrophobicContact CE1-CG 4.47Å
496	P	77.9	Confident	84.3	Confident	52 Å²	52	56 Å²	56	34%	0.338	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	129.8	-178.8	28.4	-31.1	0	0	0	112.2	R489 S492	R489-P496 HydrophobicContact CB-CB 3.85Å; R489-P496 HydrophobicContact CG-CB 4.3Å; S492-P496 WeakPolarHBondContact O-CA 3.25Å; S492-P496 WeakPolarHBondContact O-CD 3.1Å
497	Q	82	Confident	84	Confident	27 Å²	27	54.1 Å²	54.1	13%	0.126	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	124.1	177.4	-59.3	-59.5	87.6	0	0	110.1	N291 P292 W441 F490 F495	N291-Q497 PolarHBondContact O-NE2 2.91Å; P292-Q497 VanDerWaalsContact CD-NE2 3.35Å; P292-Q497 HydrophobicContact CG-CB 4.49Å; P292-Q497 HydrophobicContact CG-CG 4.05Å; W441-Q497 HydrophobicContact CH2-CB 4.13Å; W441-Q497 HydrophobicContact CZ3-CB 3.81Å; F490-Q497 PolarHBondContact N-O 2.86Å; F490-Q497 PolarHBondContact O-N 2.87Å; F495-Q497 HydrophobicContact CE1-CG 4.47Å
498	N	87.3	Confident	83.8	Confident	23 Å²	23	54.3 Å²	54.3	12%	0.123	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	134.6	177.4	-53.9	-62	0	0	0	111	G293 Y294 F371 W441 Y487 A488 R489	G293-N498 CarbonylContact C-O 3.6Å; G293-N498 WeakPolarHBondContact CA-O 3.2Å; Y294-N498 PolarHBondContact N-O 3.11Å; Y294-N498 WeakPolarHBondContact O-CB 3.19Å; Y294-N498 PolarHBondContact O-ND2 3.33Å; F371-N498 HydrophobicContact CE1-CB 3.82Å; F371-N498 HydrophobicContact CZ-CB 3.57Å; W441-N498 WeakPolarHBondContact CZ3-O 3.37Å; Y487-N498 HydrophobicContact CD2-CB 4.38Å; A488-N498 WeakPolarHBondContact O-CA 3.13Å; R489-N498 WeakPolarHBondContact CG-OD1 3.38Å
499	Q	89.9	Confident	83.9	Confident	30 Å²	30	57.2 Å²	57.2	14%	0.14	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	150.6	169.4	92.9	-178.7	31.6	0	0	110.1	I440 W441 Y487 A488 F490 V501	I440-Q499 HydrophobicContact CG2-CB 3.83Å; I440-Q499 HydrophobicContact CG2-CG 3.84Å; I440-Q499 CarbonylContact O-C 3.57Å; I440-Q499 VanDerWaalsContact O-CA 3.29Å; I440-Q499 WeakPolarHBondContact O-CA 3.29Å; I440-Q499 WeakPolarHBondContact O-CB 3.42Å; W441-Q499 HydrophobicContact CD2-CB 3.98Å; W441-Q499 HydrophobicContact CE3-CB 3.65Å; W441-Q499 HydrophobicContact CH2-CB 3.74Å; W441-Q499 HydrophobicContact CZ2-CB 3.99Å; W441-Q499 HydrophobicContact CZ3-CB 3.55Å; Y487-Q499 CarbonylContact C-O 3.59Å; Y487-Q499 VanDerWaalsContact CA-O 3.24Å; Y487-Q499 WeakPolarHBondContact CA-O 3.18Å; Y487-Q499 WeakPolarHBondContact CB-O 3.24Å; A488-Q499 PolarHBondContact N-O 2.99Å; A488-Q499 PolarHBondContact O-N 2.04Å; F490-Q499 HydrophobicContact CD2-CB 4.33Å; F490-Q499 HydrophobicContact CD2-CG 3.58Å; F490-Q499 VanDerWaalsContact CD2-OE1 3.32Å; F490-Q499 HydrophobicContact CE2-CG 3.55Å; Q499-V501 HydrophobicContact CG-CG2 3.95Å
500	I	93.7	Very high	84.2	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	127.8	168.6	-64.2	175.6	0	0	0	108.4	Y294 I300 F371 L438 I440 I485	Y294-I500 HydrophobicContact CD2-CD1 4.27Å; Y294-I500 HydrophobicContact CD2-CG1 3.99Å; Y294-I500 HydrophobicContact CE1-CD1 4.33Å; Y294-I500 HydrophobicContact CE2-CB 4.4Å; Y294-I500 HydrophobicContact CE2-CD1 3.62Å; Y294-I500 HydrophobicContact CE2-CG1 3.67Å; I300-I500 HydrophobicContact CD1-CD1 4.02Å; I300-I500 HydrophobicContact CG1-CD1 4.32Å; I300-I500 HydrophobicContact CG2-CD1 3.87Å; F371-I500 HydrophobicContact CE2-CG1 4.29Å; L438-I500 HydrophobicContact CB-CD1 4.33Å; L438-I500 HydrophobicContact CB-CG2 4.4Å; L438-I500 HydrophobicContact CD1-CD1 4.09Å; L438-I500 HydrophobicContact CD1-CG2 4.32Å; I440-I500 PolarHBondContact O-N 3.3Å; I485-I500 HydrophobicContact CG2-CD1 4.19Å; I485-I500 HydrophobicContact CG2-CG1 4.19Å; I485-I500 HydrophobicContact CG2-CG2 4.07Å
501	V	93	Very high	84.8	Confident	63 Å²	63	53.5 Å²	53.5	38%	0.382	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	-35.6	-177.7	-177.8	0	0	0	0	111.3	V453 Q486 A488 F490 Q499 V532	V453-V501 WeakPolarHBondContact CG2-O 3.17Å; Q486-V501 PolarHBondContact O-N 3.28Å; A488-V501 HydrophobicContact CB-CG2 3.83Å; F490-V501 HydrophobicContact CE2-CG2 4.12Å; Q499-V501 HydrophobicContact CG-CG2 3.95Å; V501-V532 HydrophobicContact CB-CG2 4.43Å
502	G	93.2	Very high	85.5	Confident	12 Å²	12	50.4 Å²	50.4	12%	0.124	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	152.4	-179.1	0	0	0	0	0	111.2	Q486	Q486-G502 PolarHBondContact N-O 2.97Å; Q486-G502 PolarHBondContact O-N 2.87Å; Q486-G502 VanDerWaalsContact O-N 3.1Å
503	A	93.7	Very high	86.4	Confident	5 Å²	5	50.5 Å²	50.5	4%	0.041	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	141.6	165.9	0	0	0	0	0	109.2	L438 I455 Q456 E484	L438-A503 HydrophobicContact CD1-CB 3.68Å; L438-A503 HydrophobicContact CG-CB 4.32Å; I455-A503 HydrophobicContact CG1-CB 3.99Å; Q456-A503 PolarHBondContact N-O 2.77Å; E484-A503 CarbonylContact O-C 3.46Å; E484-A503 VanDerWaalsContact O-CA 3.31Å; E484-A503 WeakPolarHBondContact O-CA 3.37Å
504	K	90.9	Very high	87.1	Confident	41 Å²	41	43.2 Å²	43.2	18%	0.178	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	159.4	174.4	72.2	176.5	-161.7	-128.5	0	111.9	Q456 L458 E484	Q456-K504 HydrophobicContact CB-CB 4.06Å; Q456-K504 CarbonylContact O-C 3.58Å; Q456-K504 WeakPolarHBondContact O-CA 3.34Å; Q456-K504 VanDerWaalsContact O-CB 3.28Å; Q456-K504 WeakPolarHBondContact O-CB 3.41Å; L458-K504 HydrophobicContact CD1-CD 4.07Å; E484-K504 HydrophobicContact CB-CG 3.91Å; E484-K504 PolarHBondContact N-O 2.96Å; E484-K504 PolarHBondContact O-N 3.04Å; E484-K504 WeakPolarHBondContact OE1-CE 3.07Å; E484-K504 IonicContact OE1-NZ 2.69Å; E484-K504 PolarHBondContact OE1-NZ 3.15Å; E484-K504 WeakPolarHBondContact OE2-CE 3.05Å; E484-K504 IonicContact OE2-NZ 3.78Å; E484-K504 PolarHBondContact OE2-NZ 3.2Å
505	I	89.9	Confident	87.5	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.01	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	128.6	173	-57.2	177.3	0	0	0	109.9	W347 K434 I455 Q456 Q481 E482 I483 Y507	W347-I505 HydrophobicContact CH2-CD1 3.87Å; W347-I505 HydrophobicContact CH2-CG1 4.12Å; W347-I505 HydrophobicContact CZ2-CD1 3.81Å; W347-I505 HydrophobicContact CZ2-CG1 4.47Å; K434-I505 HydrophobicContact CD-CD1 3.75Å; I455-I505 HydrophobicContact CG2-CD1 3.78Å; I455-I505 HydrophobicContact CG2-CG1 3.68Å; Q456-I505 PolarHBondContact O-N 2.68Å; Q481-I505 HydrophobicContact CB-CG2 3.87Å; Q481-I505 HydrophobicContact CG-CG2 4.35Å; E482-I505 WeakPolarHBondContact O-CA 3.44Å; I483-I505 HydrophobicContact CG1-CG1 4.23Å; I505-Y507 HydrophobicContact CG2-CD1 4.26Å; I505-Y507 HydrophobicContact CG2-CE1 3.74Å
506	N	89.8	Confident	87.7	Confident	45 Å²	45	41.3 Å²	41.3	24%	0.241	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	136.1	167.9	-61.5	-28.6	0	0	0	108.5	Q481 E482	Q481-N506 CarbonylContact C-O 3.53Å; Q481-N506 WeakPolarHBondContact CA-O 3.04Å; E482-N506 HydrophobicContact CB-CB 4.24Å; E482-N506 PolarHBondContact N-O 2.92Å; E482-N506 PolarHBondContact O-N 3.19Å; E482-N506 PolarHBondContact OE2-ND2 3.23Å
507	Y	89.6	Confident	87.2	Confident	26 Å²	26	44.6 Å²	44.6	10%	0.102	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	135.4	175.9	-64.3	-61.6	0	0	0	111.4	W408 F412 N457 I459 L478 Q481 I505 Y509	W408-Y507 HydrophobicContact CE3-CE1 4.48Å; W408-Y507 HydrophobicContact CH2-CE1 4.23Å; W408-Y507 HydrophobicContact CH2-CE2 4.08Å; W408-Y507 AromaticContact CH2-CZ 3.71Å; W408-Y507 HydrophobicContact CZ3-CD1 4.13Å; W408-Y507 HydrophobicContact CZ3-CD2 4.44Å; W408-Y507 AromaticContact CZ3-CE1 3.62Å; W408-Y507 HydrophobicContact CZ3-CE1 3.62Å; W408-Y507 AromaticContact CZ3-CE2 3.96Å; W408-Y507 HydrophobicContact CZ3-CE2 3.96Å; W408-Y507 AromaticContact CZ3-CZ 3.53Å; F412-Y507 HydrophobicContact CE2-CE1 4.11Å; F412-Y507 WeakPolarHBondContact CE2-OH 3.05Å; F412-Y507 VanDerWaalsContact CZ-OH 3.3Å; F412-Y507 WeakPolarHBondContact CZ-OH 3.3Å; N457-Y507 PolarHBondContact ND2-OH 2.85Å; N457-Y507 VanDerWaalsContact ND2-OH 3.09Å; N457-Y507 PolarHBondContact OD1-OH 3.37Å; I459-Y507 HydrophobicContact CD1-CD2 4.19Å; L478-Y507 HydrophobicContact CD1-CD1 4.03Å; L478-Y507 HydrophobicContact CD1-CG 4.24Å; Q481-Y507 HydrophobicContact CB-CD1 3.99Å; Q481-Y507 HydrophobicContact CB-CE1 4.24Å; I505-Y507 HydrophobicContact CG2-CD1 4.26Å; I505-Y507 HydrophobicContact CG2-CE1 3.74Å; Y507-Y509 WeakPolarHBondContact O-CD2 3.3Å
508	I	91.7	Very high	86.4	Confident	33 Å²	33	51 Å²	51	17%	0.169	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	120.5	-179.2	-52.6	171	0	0	0	107.7	I479 G480 E482 R526	I479-I508 HydrophobicContact CD1-CG2 4.11Å; I479-I508 HydrophobicContact CG1-CB 4.41Å; I479-I508 HydrophobicContact CG1-CG2 3.89Å; I479-I508 WeakPolarHBondContact CG1-O 3.35Å; I479-I508 PolarHBondContact N-O 3.15Å; G480-I508 PolarHBondContact N-O 3.49Å; G480-I508 PolarHBondContact O-N 3.25Å; E482-I508 HydrophobicContact CB-CD1 4.5Å; I508-R526 HydrophobicContact CD1-CG 4.44Å
509	Y	91.8	Very high	86	Confident	64 Å²	64	52 Å²	52	25%	0.251	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	150.8	179.3	-59.3	-84.8	0	0	0	110.9	P464 T465 Q476 L477 L478 Y507	P464-Y509 VanDerWaalsContact CA-OH 3.3Å; P464-Y509 WeakPolarHBondContact CA-OH 3.22Å; P464-Y509 HydrophobicContact CB-CE1 4.02Å; P464-Y509 WeakPolarHBondContact CB-OH 3.35Å; T465-Y509 PolarHBondContact N-OH 3.46Å; T465-Y509 WeakPolarHBondContact OG1-CE1 3.33Å; Q476-Y509 WeakPolarHBondContact O-CD1 3.24Å; L477-Y509 CarbonylContact O-C 3.52Å; L477-Y509 VanDerWaalsContact O-CA 3.27Å; L477-Y509 WeakPolarHBondContact O-CA 3.01Å; L478-Y509 HydrophobicContact CB-CD1 4.32Å; L478-Y509 HydrophobicContact CB-CE1 4.25Å; L478-Y509 HydrophobicContact CD1-CD1 4.49Å; L478-Y509 HydrophobicContact CD1-CE1 4.16Å; Y507-Y509 WeakPolarHBondContact O-CD2 3.3Å
510	G	91.4	Very high	85.7	Confident	18 Å²	18	54.5 Å²	54.5	19%	0.186	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	165	175.2	0	0	0	0	0	112.6	L477	L477-G510 PolarHBondContact N-O 2.91Å; L477-G510 PolarHBondContact O-N 3.36Å
511	D	91.8	Very high	85.3	Confident	104 Å²	104	55 Å²	55	56%	0.556	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.7	121.8	179.5	-63	-21	0	0	0	109.7	C474 Y475 Q476	C474-D511 WeakPolarHBondContact O-CA 3.22Å; Y475-D511 WeakPolarHBondContact CA-OD1 3.38Å; Y475-D511 HydrophobicContact CD1-CB 4.14Å; Q476-D511 PolarHBondContact N-OD1 3.42Å
512	V	90.2	Very high	85	Confident	15 Å²	15	56.8 Å²	56.8	9%	0.091	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	130.4	-166.2	-177	0	0	0	0	111.2	Y473 C474 L477 I479 F514 F519 I521	Y473-V512 CarbonylContact C-O 3.59Å; Y473-V512 WeakPolarHBondContact CA-O 3.03Å; C474-V512 PolarHBondContact N-O 3.5Å; C474-V512 PolarHBondContact O-N 3.09Å; L477-V512 HydrophobicContact CB-CG2 4.39Å; L477-V512 HydrophobicContact CD2-CB 4.11Å; L477-V512 HydrophobicContact CD2-CG2 3.96Å; I479-V512 HydrophobicContact CG2-CG2 4.01Å; V512-F514 HydrophobicContact CB-CE2 3.9Å; V512-F514 HydrophobicContact CB-CZ 4.41Å; V512-F514 HydrophobicContact CG1-CD2 4.12Å; V512-F514 HydrophobicContact CG1-CE1 4.41Å; V512-F514 HydrophobicContact CG1-CE2 3.62Å; V512-F514 HydrophobicContact CG1-CZ 3.81Å; V512-F519 HydrophobicContact CG1-CE1 3.53Å; V512-F519 HydrophobicContact CG1-CZ 3.85Å; V512-I521 HydrophobicContact CG1-CD1 3.84Å; V512-I521 HydrophobicContact CG1-CG1 4.2Å
513	F	88.6	Confident	84.8	Confident	62 Å²	62	56.2 Å²	56.2	27%	0.272	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	113.9	179.5	-174.7	-121.3	0	0	0	112.2	G472 Y473 M515 K516	G472-F513 WeakPolarHBondContact O-CD2 3.3Å; Y473-F513 HydrophobicContact CD1-CB 3.95Å; Y473-F513 HydrophobicContact CD1-CD2 4.02Å; Y473-F513 HydrophobicContact CD1-CG 4.39Å; Y473-F513 AromaticContact CD2-CD2 3.4Å; Y473-F513 HydrophobicContact CD2-CD2 3.4Å; Y473-F513 AromaticContact CD2-CE2 3.75Å; Y473-F513 HydrophobicContact CD2-CE2 3.75Å; Y473-F513 HydrophobicContact CD2-CG 4.42Å; Y473-F513 HydrophobicContact CE1-CB 3.66Å; Y473-F513 AromaticContact CE1-CD2 3.89Å; Y473-F513 HydrophobicContact CE1-CD2 3.89Å; Y473-F513 AromaticContact CE1-CG 3.99Å; Y473-F513 HydrophobicContact CE1-CG 3.99Å; Y473-F513 AromaticContact CE2-CD2 3.22Å; Y473-F513 HydrophobicContact CE2-CD2 3.22Å; Y473-F513 AromaticContact CE2-CE2 3.44Å; Y473-F513 HydrophobicContact CE2-CE2 3.44Å; Y473-F513 VanDerWaalsContact CE2-CE2 3.44Å; Y473-F513 HydrophobicContact CE2-CG 4Å; Y473-F513 HydrophobicContact CE2-CZ 4.36Å; Y473-F513 AromaticContact CG-CD2 3.79Å; Y473-F513 HydrophobicContact CG-CD2 3.79Å; Y473-F513 AromaticContact CZ-CD2 3.47Å; Y473-F513 VanDerWaalsContact CZ-CD2 3.47Å; Y473-F513 AromaticContact CZ-CG 3.76Å; F513-M515 HydrophobicContact CE1-CB 3.94Å; F513-M515 HydrophobicContact CE2-CB 4.06Å; F513-M515 HydrophobicContact CE2-CG 3.93Å; F513-M515 HydrophobicContact CE2-SD 4.04Å; F513-M515 HydrophobicContact CZ-CB 3.58Å; F513-M515 HydrophobicContact CZ-CG 3.93Å; F513-M515 HydrophobicContact CZ-SD 4.07Å; F513-K516 HydrophobicContact CD1-CG 4.45Å
514	F	83.5	Confident	84.6	Confident	5 Å²	5	56.6 Å²	56.6	2%	0.022	29%	0.289	C	S	.	.			trans	-90.2	-11	-168.9	-76.9	-84.6	0	0	0	115.4	L383 L386 W396 Y403 G472 C474 L477 V512 K516 F519 I521	L383-F514 HydrophobicContact CD1-CD1 3.62Å; L383-F514 HydrophobicContact CD1-CE1 4.18Å; L383-F514 HydrophobicContact CD2-CD1 4.45Å; L383-F514 WeakPolarHBondContact CD2-O 3.46Å; L386-F514 HydrophobicContact CD1-CE1 3.8Å; L386-F514 HydrophobicContact CD1-CZ 4.46Å; W396-F514 HydrophobicContact CH2-CB 4.04Å; W396-F514 HydrophobicContact CZ3-CB 3.9Å; W396-F514 HydrophobicContact CZ3-CG 4.43Å; Y403-F514 HydrophobicContact CD2-CD1 4.19Å; Y403-F514 HydrophobicContact CD2-CD2 4.29Å; Y403-F514 AromaticContact CD2-CE1 3.65Å; Y403-F514 HydrophobicContact CD2-CE1 3.65Å; Y403-F514 AromaticContact CD2-CE2 3.8Å; Y403-F514 HydrophobicContact CD2-CE2 3.8Å; Y403-F514 HydrophobicContact CD2-CG 4.46Å; Y403-F514 AromaticContact CD2-CZ 3.42Å; Y403-F514 HydrophobicContact CD2-CZ 3.42Å; Y403-F514 VanDerWaalsContact CD2-CZ 3.42Å; Y403-F514 AromaticContact CE2-CD1 3.71Å; Y403-F514 HydrophobicContact CE2-CD1 3.71Å; Y403-F514 HydrophobicContact CE2-CD2 4.14Å; Y403-F514 AromaticContact CE2-CE1 3.63Å; Y403-F514 HydrophobicContact CE2-CE1 3.63Å; Y403-F514 HydrophobicContact CE2-CE2 4.09Å; Y403-F514 AromaticContact CE2-CG 3.94Å; Y403-F514 HydrophobicContact CE2-CG 3.94Å; Y403-F514 AromaticContact CE2-CZ 3.82Å; Y403-F514 HydrophobicContact CE2-CZ 3.82Å; Y403-F514 HydrophobicContact CG-CZ 4.38Å; G472-F514 PolarHBondContact O-N 2.76Å; C474-F514 HydrophobicContact CB-CD2 4.41Å; C474-F514 HydrophobicContact CB-CE2 3.87Å; C474-F514 WeakPolarHBondContact SG-CE2 3.44Å; L477-F514 HydrophobicContact CD2-CE2 4Å; L477-F514 HydrophobicContact CD2-CZ 3.81Å; V512-F514 HydrophobicContact CB-CE2 3.9Å; V512-F514 HydrophobicContact CB-CZ 4.41Å; V512-F514 HydrophobicContact CG1-CD2 4.12Å; V512-F514 HydrophobicContact CG1-CE1 4.41Å; V512-F514 HydrophobicContact CG1-CE2 3.62Å; V512-F514 HydrophobicContact CG1-CZ 3.81Å; F514-K516 PolarHBondContact O-N 2.79Å; F514-F519 HydrophobicContact CD1-CD1 4.35Å; F514-I521 HydrophobicContact CE1-CD1 3.5Å; F514-I521 HydrophobicContact CZ-CD1 3.5Å; F514-I521 VanDerWaalsContact CZ-CD1 3.5Å
515	M	72.6	Confident	84.5	Confident	122 Å²	122	54.8 Å²	54.8	60%	0.601	28%	0.282	S	S	*	.			trans	-82	26.5	-175.7	-52.5	-178.9	69	0	0	114	W396 F513	W396-M515 HydrophobicContact CZ2-CG 4.39Å; F513-M515 HydrophobicContact CE1-CB 3.94Å; F513-M515 HydrophobicContact CE2-CB 4.06Å; F513-M515 HydrophobicContact CE2-CG 3.93Å; F513-M515 HydrophobicContact CE2-SD 4.04Å; F513-M515 HydrophobicContact CZ-CB 3.58Å; F513-M515 HydrophobicContact CZ-CG 3.93Å; F513-M515 HydrophobicContact CZ-SD 4.07Å
516	K	70.3	Confident	84.7	Confident	118 Å²	118	59.5 Å²	59.5	51%	0.513	30%	0.299	S	S	.	.	S	Bend	trans	-98.1	128.9	173.8	-77.8	178.1	177.4	178.7	0	109.4	F513 F514 F519	F513-K516 HydrophobicContact CD1-CG 4.45Å; F514-K516 PolarHBondContact O-N 2.79Å; K516-F519 HydrophobicContact CB-CB 3.91Å; K516-F519 HydrophobicContact CB-CD2 4.17Å; K516-F519 HydrophobicContact CB-CG 4.27Å; K516-F519 HydrophobicContact CD-CD2 4.08Å; K516-F519 HydrophobicContact CD-CE2 4.46Å; K516-F519 VanDerWaalsContact O-CB 3.26Å; K516-F519 WeakPolarHBondContact O-CB 3.21Å; K516-F519 PolarHBondContact O-N 2.83Å
517	P	66.9	Low	84.8	Confident	122 Å²	122	57.6 Å²	57.6	79%	0.792	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	144.3	173.2	28.3	-34.3	0	0	0	110.3	F519	P517-F519 PolarHBondContact O-N 3.36Å
518	N	65.5	Low	85.1	Confident	160 Å²	160	61.2 Å²	61.2	86%	0.856	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	32.2	-176.1	-59.4	-13.7	0	0	0	114.1
519	F	78.9	Confident	85.3	Confident	46 Å²	46	60.6 Å²	60.6	20%	0.202	30%	0.299	C	S	.	.			trans	-70.6	137.5	176.5	-172.1	-114.1	0	0	0	111.8	L383 V512 F514 K516 P517 I521	L383-F519 HydrophobicContact CB-CB 4.43Å; L383-F519 WeakPolarHBondContact CB-O 3.37Å; L383-F519 HydrophobicContact CD2-CB 4.13Å; L383-F519 PolarHBondContact N-O 3.37Å; V512-F519 HydrophobicContact CG1-CE1 3.53Å; V512-F519 HydrophobicContact CG1-CZ 3.85Å; F514-F519 HydrophobicContact CD1-CD1 4.35Å; K516-F519 HydrophobicContact CB-CB 3.91Å; K516-F519 HydrophobicContact CB-CD2 4.17Å; K516-F519 HydrophobicContact CB-CG 4.27Å; K516-F519 HydrophobicContact CD-CD2 4.08Å; K516-F519 HydrophobicContact CD-CE2 4.46Å; K516-F519 VanDerWaalsContact O-CB 3.26Å; K516-F519 WeakPolarHBondContact O-CB 3.21Å; K516-F519 PolarHBondContact O-N 2.83Å; P517-F519 PolarHBondContact O-N 3.36Å; F519-I521 HydrophobicContact CD1-CG1 4.21Å; F519-I521 HydrophobicContact CE1-CD1 4.06Å; F519-I521 HydrophobicContact CE1-CG1 3.51Å; F519-I521 HydrophobicContact CZ-CG1 4.12Å
520	N	82.8	Confident	85.4	Confident	81 Å²	81	59.5 Å²	59.5	43%	0.433	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	140.5	-179.7	-72.8	-24.2	0	0	0	108.3	I380 S382	I380-N520 HydrophobicContact CG2-CB 3.67Å; S382-N520 WeakPolarHBondContact CA-OD1 3.34Å; S382-N520 WeakPolarHBondContact CB-OD1 3.44Å; S382-N520 PolarHBondContact OG-OD1 3.19Å
521	I	85.5	Confident	85.5	Confident	11 Å²	11	61.5 Å²	61.5	6%	0.056	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	130.7	176.5	-62.6	170.4	0	0	0	108.5	I380 L381 L386 V512 F514 F519 I523	I380-I521 CarbonylContact C-O 3.59Å; L381-I521 HydrophobicContact CB-CB 4.5Å; L381-I521 PolarHBondContact N-O 2.81Å; L381-I521 PolarHBondContact O-N 3.39Å; L386-I521 HydrophobicContact CD1-CD1 4.46Å; V512-I521 HydrophobicContact CG1-CD1 3.84Å; V512-I521 HydrophobicContact CG1-CG1 4.2Å; F514-I521 HydrophobicContact CE1-CD1 3.5Å; F514-I521 HydrophobicContact CZ-CD1 3.5Å; F514-I521 VanDerWaalsContact CZ-CD1 3.5Å; F519-I521 HydrophobicContact CD1-CG1 4.21Å; F519-I521 HydrophobicContact CE1-CD1 4.06Å; F519-I521 HydrophobicContact CE1-CG1 3.51Å; F519-I521 HydrophobicContact CZ-CG1 4.12Å; I521-I523 PolarHBondContact O-N 3.28Å
522	E	86.5	Confident	85.6	Confident	100 Å²	100	59.3 Å²	59.3	47%	0.467	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	112.6	166.3	-168	-177.5	139.3	0	0	108.5	Y376 C379 T524	Y376-E522 PolarHBondContact OH-OE1 2.81Å; C379-E522 WeakPolarHBondContact O-CA 3.27Å; E522-T524 HydrophobicContact CB-CG2 4.39Å; E522-T524 HydrophobicContact CG-CG2 3.87Å
523	I	88.6	Confident	85.5	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	119.8	166.1	-56.9	-178.5	0	0	0	106.7	L350 C355 G378 C379 L381 I407 N410 L411 I479 I521	L350-I523 HydrophobicContact CD1-CB 4.36Å; L350-I523 HydrophobicContact CD1-CG2 3.92Å; C355-I523 HydrophobicContact CB-CD1 3.95Å; C355-I523 WeakPolarHBondContact SG-CD1 3.48Å; G378-I523 CarbonylContact C-O 3.46Å; G378-I523 WeakPolarHBondContact CA-O 3.33Å; C379-I523 PolarHBondContact N-O 3.05Å; C379-I523 PolarHBondContact O-N 2.03Å; L381-I523 HydrophobicContact CB-CD1 4.17Å; L381-I523 HydrophobicContact CB-CG1 4.2Å; L381-I523 HydrophobicContact CD2-CD1 4.2Å; I407-I523 HydrophobicContact CB-CD1 4.3Å; I407-I523 HydrophobicContact CG1-CD1 4.04Å; I407-I523 HydrophobicContact CG1-CG1 4.42Å; I407-I523 HydrophobicContact CG2-CD1 4.06Å; I407-I523 HydrophobicContact CG2-CG1 4.3Å; I407-I523 HydrophobicContact CG2-CG2 4.34Å; N410-I523 HydrophobicContact CB-CD1 4.11Å; L411-I523 HydrophobicContact CD1-CG2 4.18Å; L411-I523 HydrophobicContact CD2-CG2 3.51Å; L411-I523 HydrophobicContact CG-CG2 3.75Å; I479-I523 WeakPolarHBondContact O-CA 3.31Å; I521-I523 PolarHBondContact O-N 3.28Å
524	T	90.2	Very high	85.1	Confident	13 Å²	13	62.2 Å²	62.2	8%	0.08	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	143.8	-170.6	59.4	0	0	0	0	112.9	Y376 I479 G480 Q481 E522	Y376-T524 HydrophobicContact CE2-CG2 4.5Å; Y376-T524 WeakPolarHBondContact OH-CG2 3.43Å; I479-T524 PolarHBondContact O-N 3.04Å; I479-T524 PolarHBondContact O-OG1 3.38Å; G480-T524 CarbonylContact C-O 3.15Å; G480-T524 WeakPolarHBondContact CA-O 3.2Å; Q481-T524 PolarHBondContact N-O 3.29Å; E522-T524 HydrophobicContact CB-CG2 4.39Å; E522-T524 HydrophobicContact CG-CG2 3.87Å
525	Q	89.2	Confident	84.9	Confident	3 Å²	3	68.7 Å²	68.7	1%	0.014	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	128.5	170.5	-73.8	-172.6	-18.4	0	0	109.7	I349 L350 S377 L411 Q481	I349-Q525 VanDerWaalsContact CA-OE1 3.29Å; L350-Q525 HydrophobicContact CD1-CG 3.98Å; L350-Q525 HydrophobicContact CG-CG 4.33Å; S377-Q525 PolarHBondContact N-O 2.86Å; S377-Q525 PolarHBondContact O-N 2.87Å; S377-Q525 VanDerWaalsContact O-O 3.13Å; L411-Q525 HydrophobicContact CD2-CG 3.71Å; L411-Q525 VanDerWaalsContact CD2-NE2 3.27Å; Q481-Q525 HydrophobicContact CG-CG 4.09Å; Q481-Q525 WeakPolarHBondContact O-CA 3.02Å
526	R	92.7	Very high	85	Confident	102 Å²	102	65.6 Å²	65.6	39%	0.385	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	129.5	173.2	-49.2	-157.5	170.3	105.7	9.5	108.3	V375 Y376 Q481 E482 I483 I508	V375-R526 CarbonylContact O-C 3.56Å; V375-R526 WeakPolarHBondContact O-CA 3.01Å; Y376-R526 HydrophobicContact CD2-CG 3.81Å; Y376-R526 HydrophobicContact CE2-CG 4.12Å; Q481-R526 PolarHBondContact O-N 3.2Å; E482-R526 CarbonylContact C-O 3.57Å; E482-R526 WeakPolarHBondContact CA-O 3.48Å; E482-R526 HydrophobicContact CB-CB 4.32Å; E482-R526 HydrophobicContact CG-CB 4.38Å; I483-R526 PolarHBondContact N-O 3.32Å; I508-R526 HydrophobicContact CD1-CG 4.44Å
527	V	93.4	Very high	85.1	Confident	5 Å²	5	66.4 Å²	66.4	3%	0.03	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	128.1	168.7	-173.5	0	0	0	0	108.4	I349 I369 D374 V375 I483 I485 F529	I349-V527 HydrophobicContact CD1-CG2 4.03Å; I349-V527 HydrophobicContact CG2-CG2 4.2Å; I369-V527 HydrophobicContact CD1-CG2 4Å; I369-V527 HydrophobicContact CG1-CG2 4.19Å; I369-V527 HydrophobicContact CG2-CG1 3.83Å; D374-V527 WeakPolarHBondContact CA-O 3.31Å; V375-V527 HydrophobicContact CB-CB 4.32Å; V375-V527 PolarHBondContact N-O 2.96Å; V375-V527 PolarHBondContact O-N 2.8Å; I483-V527 HydrophobicContact CB-CG2 4.3Å; I483-V527 HydrophobicContact CD1-CG2 4.2Å; I483-V527 HydrophobicContact CG2-CG1 4.34Å; I483-V527 WeakPolarHBondContact O-CA 3.48Å; I485-V527 HydrophobicContact CD1-CG1 4.36Å; V527-F529 HydrophobicContact CG1-CD2 4.45Å; V527-F529 HydrophobicContact CG1-CE2 3.81Å; V527-F529 HydrophobicContact CG1-CZ 4.25Å
528	R	95.4	Very high	85.3	Confident	101 Å²	101	67.7 Å²	67.7	38%	0.381	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	128.7	179.2	-171.6	172.1	72.5	109.9	-3.8	111.4	D374 I483 E484 I485	D374-R528 WeakPolarHBondContact OD1-CA 3.44Å; I483-R528 PolarHBondContact O-N 3.46Å; E484-R528 WeakPolarHBondContact CA-O 3.46Å; E484-R528 IonicContact OE2-CZ 2.74Å; E484-R528 IonicContact OE2-NH2 2.69Å; E484-R528 PolarHBondContact OE2-NH2 3.41Å; I485-R528 PolarHBondContact N-O 3.42Å
529	F	95.5	Very high	85.5	Confident	20 Å²	20	69.6 Å²	69.6	9%	0.088	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	134.6	174	-73	-82.9	0	0	0	111	I300 I369 R370 F371 E373 D374 I485 Y487 V527	I300-F529 HydrophobicContact CD1-CE1 3.53Å; I300-F529 HydrophobicContact CD1-CZ 3.49Å; I300-F529 VanDerWaalsContact CD1-CZ 3.49Å; I369-F529 HydrophobicContact CG2-CE2 4.4Å; I369-F529 HydrophobicContact CG2-CZ 3.99Å; R370-F529 WeakPolarHBondContact O-CE2 3.38Å; R370-F529 WeakPolarHBondContact O-CZ 3.45Å; F371-F529 HydrophobicContact CD2-CE1 4.04Å; F371-F529 HydrophobicContact CE2-CE1 4.47Å; E373-F529 VanDerWaalsContact O-CE2 3.29Å; E373-F529 WeakPolarHBondContact O-CE2 3.07Å; D374-F529 PolarHBondContact OD1-N 2.93Å; I485-F529 HydrophobicContact CB-CD1 3.99Å; I485-F529 HydrophobicContact CB-CE1 3.78Å; I485-F529 HydrophobicContact CB-CZ 4.49Å; I485-F529 HydrophobicContact CD1-CE1 4.07Å; I485-F529 HydrophobicContact CD1-CZ 4.05Å; I485-F529 HydrophobicContact CG1-CE1 4.45Å; I485-F529 HydrophobicContact CG2-CD1 4.17Å; I485-F529 HydrophobicContact CG2-CE1 3.81Å; I485-F529 WeakPolarHBondContact O-CA 3.34Å; Y487-F529 HydrophobicContact CD1-CB 4.23Å; Y487-F529 HydrophobicContact CD1-CD1 4.14Å; Y487-F529 HydrophobicContact CE1-CB 3.98Å; V527-F529 HydrophobicContact CG1-CD2 4.45Å; V527-F529 HydrophobicContact CG1-CE2 3.81Å; V527-F529 HydrophobicContact CG1-CZ 4.25Å
530	I	94.8	Very high	85	Confident	42 Å²	42	76.6 Å²	76.6	22%	0.215	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	119.5	170.7	-50.2	-176.8	0	0	0	108.3	E484 I485 Q486 Y487 V532	E484-I530 HydrophobicContact CG-CD1 3.64Å; E484-I530 HydrophobicContact CG-CG1 4.02Å; I485-I530 PolarHBondContact O-N 2.99Å; Q486-I530 WeakPolarHBondContact CA-O 3.26Å; Q486-I530 HydrophobicContact CG-CB 4.33Å; Q486-I530 HydrophobicContact CG-CD1 4.41Å; Y487-I530 VanDerWaalsContact CD1-O 3.26Å; Y487-I530 WeakPolarHBondContact CD1-O 3.47Å; Y487-I530 PolarHBondContact N-O 3.23Å; I530-V532 HydrophobicContact CB-CG1 4.28Å; I530-V532 HydrophobicContact CG2-CG1 3.67Å; I530-V532 PolarHBondContact O-N 3.2Å
531	D	93	Very high	84.2	Confident	60 Å²	60	82.4 Å²	82.4	32%	0.321	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	108.6	165.5	-162.8	-26.8	0	0	0	108.6	Y487 R489 T533	Y487-D531 HydrophobicContact CE1-CB 3.94Å; Y487-D531 HydrophobicContact CE2-CB 4.09Å; R489-D531 IonicContact CZ-OD2 2.76Å; R489-D531 IonicContact NE-OD2 3.18Å; R489-D531 PolarHBondContact NE-OD2 3.13Å; R489-D531 IonicContact NH2-OD2 3.88Å; R489-D531 PolarHBondContact NH2-OD2 3.23Å; D531-T533 WeakPolarHBondContact OD1-CB 3.45Å; D531-T533 PolarHBondContact OD1-N 2.77Å; D531-T533 PolarHBondContact OD1-OG1 3.06Å
532	V	93.3	Very high	83.6	Confident	58 Å²	58	88.6 Å²	88.6	35%	0.352	45%	0.445	S	S	.	.			trans	-105.8	26.1	175.1	-59.4	0	0	0	0	111.4	Q486 Y487 A488 V501 I530	Q486-V532 HydrophobicContact CB-CG1 4.21Å; Q486-V532 HydrophobicContact CB-CG2 4.11Å; Q486-V532 HydrophobicContact CG-CG1 4.43Å; Y487-V532 WeakPolarHBondContact O-CG2 3.31Å; Y487-V532 PolarHBondContact O-N 3.3Å; A488-V532 HydrophobicContact CB-CG2 4.21Å; V501-V532 HydrophobicContact CB-CG2 4.43Å; I530-V532 HydrophobicContact CB-CG1 4.28Å; I530-V532 HydrophobicContact CG2-CG1 3.67Å; I530-V532 PolarHBondContact O-N 3.2Å
533	T	87.8	Confident	83.1	Confident	54 Å²	54	94.3 Å²	94.3	33%	0.331	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-55	123.6	176.3	-66.1	0	0	0	0	111.4	A488 R489 D531	A488-T533 WeakPolarHBondContact CA-OG1 3.02Å; R489-T533 HydrophobicContact CB-CG2 3.83Å; R489-T533 WeakPolarHBondContact CB-OG1 3.36Å; R489-T533 HydrophobicContact CG-CG2 4.45Å; R489-T533 WeakPolarHBondContact CG-OG1 3.45Å; R489-T533 PolarHBondContact N-OG1 3.24Å; D531-T533 WeakPolarHBondContact OD1-CB 3.45Å; D531-T533 PolarHBondContact OD1-N 2.77Å; D531-T533 PolarHBondContact OD1-OG1 3.06Å
534	P	81.1	Confident	82.2	Confident	84 Å²	84	99.2 Å²	99.2	55%	0.545	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-70	156.3	174.9	30.6	-35.3	0	0	0	111.2	A536	P534-A536 PolarHBondContact O-N 3.16Å
535	V	80.1	Confident	81.4	Confident	141 Å²	141	107.3 Å²	107.3	86%	0.855	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-59.8	132.3	172.7	-176.1	0	0	0	0	109.4	E537	V535-E537 PolarHBondContact O-N 3.34Å
536	A	74.4	Confident	80.5	Confident	56 Å²	56	115.7 Å²	115.7	46%	0.463	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-67.7	120.8	-175.6	0	0	0	0	0	112.4	M493 P534	M493-A536 HydrophobicContact CE-CB 4.15Å; M493-A536 HydrophobicContact CG-CB 3.72Å; M493-A536 HydrophobicContact SD-CB 3.37Å; M493-A536 WeakPolarHBondContact SD-CB 3.34Å; P534-A536 PolarHBondContact O-N 3.16Å
537	E	72	Confident	79.3	Confident	136 Å²	136	119 Å²	119	64%	0.636	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-81.6	132.5	172.6	-66.5	-178.9	-178.4	0	0	111.7	V535 R539	V535-E537 PolarHBondContact O-N 3.34Å; E537-R539 HydrophobicContact CB-CG 4.39Å; E537-R539 PolarHBondContact O-N 3.34Å; E537-R539 IonicContact OE1-NH2 2.66Å; E537-R539 IonicContact OE2-CZ 2.68Å; E537-R539 IonicContact OE2-NE 2.77Å; E537-R539 PolarHBondContact OE2-NE 3.26Å; E537-R539 IonicContact OE2-NH2 2.64Å; E537-R539 PolarHBondContact OE2-NH2 3.46Å
538	T	70.3	Confident	78.5	Confident	149 Å²	149	124 Å²	124	91%	0.914	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-76.2	117.7	166.3	-52.2	0	0	0	0	109.7
539	R	69.3	Low	77.7	Confident	199 Å²	199	130.6 Å²	130.6	75%	0.751	64%	0.641	S	S	*	*			trans	-126	130.8	174.2	-62.2	-175.2	178.7	-164.2	1.4	109.7	E537	E537-R539 HydrophobicContact CB-CG 4.39Å; E537-R539 PolarHBondContact O-N 3.34Å; E537-R539 IonicContact OE1-NH2 2.66Å; E537-R539 IonicContact OE2-CZ 2.68Å; E537-R539 IonicContact OE2-NE 2.77Å; E537-R539 PolarHBondContact OE2-NE 3.26Å; E537-R539 IonicContact OE2-NH2 2.64Å; E537-R539 PolarHBondContact OE2-NH2 3.46Å
540	E	69.9	Low	76.9	Confident	194 Å²	194	133.5 Å²	133.5	91%	0.907	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-65.8	143.6	169	-68.3	-163.8	137.3	0	0	110.5
541	K	65.5	Low	76.2	Confident	202 Å²	202	135.1 Å²	135.1	88%	0.878	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-72.1	130.4	167.3	-70.8	-176.8	179.1	178.1	0	108.6	R543	K541-R543 PolarHBondContact O-N 3.29Å
542	L	72.9	Confident	75.8	Confident	141 Å²	141	138.7 Å²	138.7	74%	0.738	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-53	135.7	169.6	-67.2	171.3	0	0	0	109.7
543	R	76.1	Confident	75.3	Confident	221 Å²	221	141 Å²	141	83%	0.834	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-60.1	133.5	176.1	-63.3	-175.4	-172.8	179.9	3	109.1	K541 Y545	K541-R543 PolarHBondContact O-N 3.29Å; R543-Y545 PolarHBondContact O-N 3.18Å
544	P	70.4	Confident	75	Confident	103 Å²	103	144.1 Å²	144.1	67%	0.669	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-64	125.1	-179	25.8	-33.8	0	0	0	110.7	F546	P544-F546 PolarHBondContact O-N 3.15Å
545	Y	72	Confident	75	Confident	183 Å²	183	146.3 Å²	146.3	72%	0.718	72%	0.721	S	S	*	*			trans	-78.8	114	174.7	-38.9	-75.7	0	0	0	109.3	R543 L547	R543-Y545 PolarHBondContact O-N 3.18Å; Y545-L547 PolarHBondContact O-N 3.24Å
546	F	71.7	Confident	74.7	Confident	179 Å²	179	148.7 Å²	148.7	79%	0.785	72%	0.716	S	S	*	*			trans	-75.4	106.7	170.3	-72.6	-87.5	0	0	0	109.5	P544 V548	P544-F546 PolarHBondContact O-N 3.15Å; F546-V548 HydrophobicContact CB-CG2 4.04Å; F546-V548 PolarHBondContact O-N 3.39Å
547	L	67.3	Low	74.9	Confident	171 Å²	171	150.2 Å²	150.2	90%	0.895	72%	0.721	S	S	*	*			trans	-72.1	75.4	168.3	-83.9	167.2	0	0	0	109.8	Y545 R549	Y545-L547 PolarHBondContact O-N 3.24Å; L547-R549 PolarHBondContact O-N 2.89Å
548	V	75.9	Confident	75	Confident	109 Å²	109	152.5 Å²	152.5	66%	0.661	73%	0.729	S	S	*	*			trans	-69.7	90.7	176	-176.5	0	0	0	0	109.1	F546 L550	F546-V548 HydrophobicContact CB-CG2 4.04Å; F546-V548 PolarHBondContact O-N 3.39Å; V548-L550 HydrophobicContact CG1-CD2 3.7Å; V548-L550 HydrophobicContact CG1-CG 4.16Å; V548-L550 PolarHBondContact O-N 3.02Å
549	R	78.2	Confident	74.3	Confident	241 Å²	241	152.5 Å²	152.5	91%	0.909	74%	0.744	S	S	*	*			trans	-84.6	89.9	173.8	-164.8	177.2	-166.7	176.6	3.9	109.1	L547	L547-R549 PolarHBondContact O-N 2.89Å
550	L	79.5	Confident	74.6	Confident	80 Å²	80	150.2 Å²	150.2	42%	0.419	74%	0.744	S	S	.	*			trans	-60.8	145.7	177.8	-62.4	174.8	0	0	0	111.2	V548 F554 F555	V548-L550 HydrophobicContact CG1-CD2 3.7Å; V548-L550 HydrophobicContact CG1-CG 4.16Å; V548-L550 PolarHBondContact O-N 3.02Å; L550-F554 HydrophobicContact CB-CB 4.18Å; L550-F554 HydrophobicContact CB-CG 4.24Å; L550-F554 HydrophobicContact CD1-CD1 3.83Å; L550-F554 HydrophobicContact CD1-CE1 4.08Å; L550-F554 HydrophobicContact CD1-CG 4.28Å; L550-F554 HydrophobicContact CD2-CD1 4.18Å; L550-F554 HydrophobicContact CD2-CD2 3.92Å; L550-F554 HydrophobicContact CD2-CE1 4.17Å; L550-F554 HydrophobicContact CD2-CE2 3.9Å; L550-F554 HydrophobicContact CD2-CG 4.06Å; L550-F554 HydrophobicContact CD2-CZ 4.03Å; L550-F554 HydrophobicContact CG-CD1 4.44Å; L550-F554 HydrophobicContact CG-CG 4.43Å; L550-F555 HydrophobicContact CD1-CE2 4.34Å; L550-F555 HydrophobicContact CD1-CZ 4.49Å
551	P	80.7	Confident	74.8	Confident	76 Å²	76	147.8 Å²	147.8	49%	0.494	74%	0.735	S	S	.	*			trans	-55.7	149.8	165.8	-25	34.9	0	0	0	112.2	D553 F554	P551-D553 WeakPolarHBondContact CB-OD1 3.33Å; P551-D553 PolarHBondContact O-N 3.35Å; P551-F554 VanDerWaalsContact O-CB 3.27Å; P551-F554 WeakPolarHBondContact O-CB 3.31Å; P551-F554 PolarHBondContact O-N 3.36Å; P551-F554 VanDerWaalsContact O-N 3.15Å
552	S	82.7	Confident	75.3	Confident	136 Å²	136	144.8 Å²	144.8	95%	0.951	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-21.2	179.8	43.3	0	0	0	0	114
553	D	83.2	Confident	75.5	Confident	107 Å²	107	145.1 Å²	145.1	57%	0.572	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	6.5	-178.8	58.8	-34	0	0	0	113.2	P551 F555 Y556	P551-D553 WeakPolarHBondContact CB-OD1 3.33Å; P551-D553 PolarHBondContact O-N 3.35Å; D553-F555 PolarHBondContact O-N 2.98Å; D553-Y556 WeakPolarHBondContact O-CB 3.37Å; D553-Y556 PolarHBondContact O-N 2.63Å
554	F	83	Confident	75.4	Confident	118 Å²	118	140.3 Å²	140.3	52%	0.518	72%	0.72	S	S	.	*	T	Hydrogen-bonded Turn	trans	-55.1	-25.8	-176.9	-178.5	-96.4	0	0	0	114.6	L550 P551	L550-F554 HydrophobicContact CB-CB 4.18Å; L550-F554 HydrophobicContact CB-CG 4.24Å; L550-F554 HydrophobicContact CD1-CD1 3.83Å; L550-F554 HydrophobicContact CD1-CE1 4.08Å; L550-F554 HydrophobicContact CD1-CG 4.28Å; L550-F554 HydrophobicContact CD2-CD1 4.18Å; L550-F554 HydrophobicContact CD2-CD2 3.92Å; L550-F554 HydrophobicContact CD2-CE1 4.17Å; L550-F554 HydrophobicContact CD2-CE2 3.9Å; L550-F554 HydrophobicContact CD2-CG 4.06Å; L550-F554 HydrophobicContact CD2-CZ 4.03Å; L550-F554 HydrophobicContact CG-CD1 4.44Å; L550-F554 HydrophobicContact CG-CG 4.43Å; P551-F554 VanDerWaalsContact O-CB 3.27Å; P551-F554 WeakPolarHBondContact O-CB 3.31Å; P551-F554 PolarHBondContact O-N 3.36Å; P551-F554 VanDerWaalsContact O-N 3.15Å
555	F	80.5	Confident	75.8	Confident	130 Å²	130	142.8 Å²	142.8	57%	0.57	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	4.6	177.4	-65.4	-73.3	0	0	0	114.1	L550 D553 F558 A559	L550-F555 HydrophobicContact CD1-CE2 4.34Å; L550-F555 HydrophobicContact CD1-CZ 4.49Å; D553-F555 PolarHBondContact O-N 2.98Å; F555-F558 CarbonylContact O-C 3.55Å; F555-F558 WeakPolarHBondContact O-CA 3.47Å; F555-F558 PolarHBondContact O-N 2.7Å; F555-A559 HydrophobicContact CB-CB 4.34Å; F555-A559 PolarHBondContact O-N 3.03Å
556	Y	72.5	Confident	76	Confident	192 Å²	192	139.9 Å²	139.9	75%	0.753	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	134.7	178.9	-175.9	-96	0	0	0	111.5	D553	D553-Y556 WeakPolarHBondContact O-CB 3.37Å; D553-Y556 PolarHBondContact O-N 2.63Å
557	P	78.5	Confident	76.4	Confident	87 Å²	87	136.9 Å²	136.9	57%	0.565	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	cis	-101.6	32.7	-0.8	41.5	-35.4	0	0	0	113.1
558	F	75.1	Confident	77.1	Confident	184 Å²	184	134.1 Å²	134.1	81%	0.807	70%	0.704	S	S	*	*			trans	-97	23.2	-175.9	-57.3	-73.6	0	0	0	113.8	F555	F555-F558 CarbonylContact O-C 3.55Å; F555-F558 WeakPolarHBondContact O-CA 3.47Å; F555-F558 PolarHBondContact O-N 2.7Å
559	A	55.9	Low	77.3	Confident	149 Å²	149	136.4 Å²	136.4	100%	1.231	71%	0.708	S	S	*	*			trans	-112.9	0	179.3	0	0	0	0	0	111	F555	F555-A559 HydrophobicContact CB-CB 4.34Å; F555-A559 PolarHBondContact O-N 3.03Å

Retrieved 559 of 559 residues in 190.7 ms (Link to these results)

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