A0A5K4F0L8_SCHMA Loading...

Beta-Casp domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F0L8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 500 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	32.3	Very low	26.3	Very low	242 Å²	242	178.5 Å²	178.5	100%	1.192	83%	0.832	S	S	*	*				0	112.5	0	-84.8	176.6	116.2	0	0	109
2	T	28.7	Very low	26.3	Very low	120 Å²	120	176.7 Å²	176.7	74%	0.736	83%	0.832	S	S	*	*			trans	-77.5	115.1	178.7	-34.8	0	0	0	0	108.8	F4	T2-F4 HydrophobicContact CG2-CD2 4.05Å; T2-F4 HydrophobicContact CG2-CE2 3.79Å; T2-F4 HydrophobicContact CG2-CZ 4.49Å
3	L	26.8	Very low	26.2	Very low	161 Å²	161	171.7 Å²	171.7	84%	0.843	82%	0.821	S	S	*	*			trans	-111.2	104.1	165.7	-124.9	92.2	0	0	0	108.4	R5	L3-R5 PolarHBondContact O-N 3.28Å
4	F	27.2	Very low	26.1	Very low	179 Å²	179	172.1 Å²	172.1	79%	0.785	83%	0.825	S	S	*	*			trans	-62.7	112.9	176.6	-85.1	-91.9	0	0	0	110.3	T2 F6	T2-F4 HydrophobicContact CG2-CD2 4.05Å; T2-F4 HydrophobicContact CG2-CE2 3.79Å; T2-F4 HydrophobicContact CG2-CZ 4.49Å; F4-F6 PolarHBondContact O-N 3.19Å
5	R	26	Very low	26	Very low	230 Å²	230	168.8 Å²	168.8	87%	0.868	81%	0.813	S	S	*	*			trans	-68.9	110.5	165.5	-76.7	-178.6	173.8	178.7	-1.5	108.6	L3 I7	L3-R5 PolarHBondContact O-N 3.28Å; R5-I7 VanDerWaalsContact C-N 3.35Å; R5-I7 PolarHBondContact O-N 2.95Å
6	F	24.4	Very low	25.9	Very low	204 Å²	204	166.4 Å²	166.4	90%	0.895	81%	0.805	S	S	*	*			trans	-63	94.7	163.1	-92.9	-93.5	0	0	0	109.3	F4 Q8	F4-F6 PolarHBondContact O-N 3.19Å; F6-Q8 VanDerWaalsContact C-N 3.33Å; F6-Q8 PolarHBondContact O-N 3.38Å
7	I	24.9	Very low	26	Very low	141 Å²	141	164.6 Å²	164.6	72%	0.723	79%	0.793	S	S	*	*			trans	-82.3	87.7	163.7	-60.8	174.5	0	0	0	106.1	R5 T9	R5-I7 VanDerWaalsContact C-N 3.35Å; R5-I7 PolarHBondContact O-N 2.95Å; I7-T9 HydrophobicContact CG2-CG2 4.29Å; I7-T9 PolarHBondContact O-N 2.85Å
8	Q	23.8	Very low	25.9	Very low	175 Å²	175	160.6 Å²	160.6	82%	0.818	79%	0.785	S	S	*	*			trans	-74.4	97.3	170	-157.4	163.1	8.9	0	0	107.7	F6 R10	F6-Q8 VanDerWaalsContact C-N 3.33Å; F6-Q8 PolarHBondContact O-N 3.38Å; Q8-R10 PolarHBondContact O-N 3.22Å; Q8-R10 VanDerWaalsContact O-N 3.15Å
9	T	25	Very low	25.8	Very low	110 Å²	110	157.9 Å²	157.9	68%	0.675	77%	0.774	S	S	*	*			trans	-60.3	112	174.7	40.2	0	0	0	0	109	I7 K11	I7-T9 HydrophobicContact CG2-CG2 4.29Å; I7-T9 PolarHBondContact O-N 2.85Å; T9-K11 VanDerWaalsContact C-N 3.31Å; T9-K11 PolarHBondContact O-N 3.05Å
10	R	26	Very low	25.6	Very low	222 Å²	222	157.5 Å²	157.5	84%	0.838	76%	0.764	S	S	*	*			trans	-61.9	93.1	169.3	-79.2	-175.8	175	179.8	-1.8	108.7	Q8 N12	Q8-R10 PolarHBondContact O-N 3.22Å; Q8-R10 VanDerWaalsContact O-N 3.15Å; R10-N12 PolarHBondContact O-N 3.15Å
11	K	24.7	Very low	25.6	Very low	180 Å²	180	151.5 Å²	151.5	78%	0.783	74%	0.736	S	S	*	*			trans	-67.5	110.3	158.8	-82.6	-177.3	175.5	178.8	0	106.9	T9 T13	T9-K11 VanDerWaalsContact C-N 3.31Å; T9-K11 PolarHBondContact O-N 3.05Å; K11-T13 PolarHBondContact O-N 3.46Å
12	N	25.8	Very low	25.3	Very low	156 Å²	156	140.7 Å²	140.7	83%	0.834	68%	0.682	S	S	*	*			trans	-63.9	86.2	168.2	-83.4	-25.2	0	0	0	108.9	R10 M14	R10-N12 PolarHBondContact O-N 3.15Å; N12-M14 PolarHBondContact O-N 2.95Å
13	T	24.4	Very low	25.1	Very low	112 Å²	112	135 Å²	135	69%	0.687	65%	0.647	S	S	*	*			trans	-78.1	97.3	163.1	38.5	0	0	0	0	107.6	K11 L15	K11-T13 PolarHBondContact O-N 3.46Å; T13-L15 VanDerWaalsContact C-N 3.26Å; T13-L15 PolarHBondContact O-N 2.84Å
14	M	25.4	Very low	25.3	Very low	178 Å²	178	128.3 Å²	128.3	88%	0.877	61%	0.611	S	S	*	*			trans	-65.4	90.1	166.6	-86	-156.3	157.8	0	0	108.9	N12	N12-M14 PolarHBondContact O-N 2.95Å
15	L	25.1	Very low	25.3	Very low	122 Å²	122	122.6 Å²	122.6	64%	0.639	59%	0.592	S	S	*	*			trans	-65.4	130.2	171.9	-81.4	153.4	0	0	0	109.7	T13 K17	T13-L15 VanDerWaalsContact C-N 3.26Å; T13-L15 PolarHBondContact O-N 2.84Å; L15-K17 PolarHBondContact O-N 3.39Å
16	N	24.4	Very low	25.5	Very low	130 Å²	130	114.6 Å²	114.6	70%	0.695	57%	0.566	S	S	*	*			trans	-50.7	106.5	177.7	-75.5	-36.5	0	0	0	111	K236	N16-K236 PolarHBondContact OD1-NZ 2.77Å
17	K	27.6	Very low	25.6	Very low	137 Å²	137	106.1 Å²	106.1	60%	0.596	53%	0.532	S	S	*	.			trans	-93.9	110.5	170.2	-73.2	-178.7	178.2	178.1	0	109.2	L15 L19	L15-K17 PolarHBondContact O-N 3.39Å; K17-L19 PolarHBondContact O-N 2.86Å
18	S	22.8	Very low	25.7	Very low	92 Å²	92	108.5 Å²	108.5	64%	0.643	53%	0.533	S	S	*	.			trans	-73.9	114.3	164.7	-47.4	0	0	0	0	107.9
19	L	24.4	Very low	25.9	Very low	110 Å²	110	102.1 Å²	102.1	58%	0.576	50%	0.504	S	S	*	.			trans	-95.2	111.1	-172.2	-147.4	122.8	0	0	0	109	K17 L21	K17-L19 PolarHBondContact O-N 2.86Å; L19-L21 HydrophobicContact CD2-CD1 4Å; L19-L21 HydrophobicContact CD2-CG 4.09Å
20	Y	23.2	Very low	25.8	Very low	148 Å²	148	99 Å²	99	58%	0.58	49%	0.486	S	S	*	.			trans	-105.2	115.7	173.8	-60.2	-80.8	0	0	0	108.9
21	L	24.1	Very low	25.9	Very low	32 Å²	32	95.4 Å²	95.4	17%	0.168	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	150	179	-79.1	133.8	0	0	0	109.7	L19 C424 N489	L19-L21 HydrophobicContact CD2-CD1 4Å; L19-L21 HydrophobicContact CD2-CG 4.09Å; L21-C424 WeakPolarHBondContact CA-O 3.39Å; L21-N489 VanDerWaalsContact CB-ND2 3.32Å; L21-N489 WeakPolarHBondContact CB-ND2 3.4Å; L21-N489 WeakPolarHBondContact O-CB 3.23Å; L21-N489 PolarHBondContact O-ND2 2.92Å; L21-N489 PolarHBondContact O-OD1 3.32Å
22	Y	26	Very low	26	Very low	15 Å²	15	89.2 Å²	89.2	6%	0.059	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	119	176.2	-63.9	-87.2	0	0	0	113.7	S423 C424 K426 N489 N492	Y22-S423 CarbonylContact O-C 3.59Å; Y22-S423 WeakPolarHBondContact O-CA 3.46Å; Y22-C424 HydrophobicContact CD2-CB 4.21Å; Y22-C424 HydrophobicContact CG-CB 4.45Å; Y22-C424 PolarHBondContact N-O 2.89Å; Y22-C424 VanDerWaalsContact N-O 3.14Å; Y22-C424 PolarHBondContact O-N 2.87Å; Y22-K426 HydrophobicContact CE2-CD 3.94Å; Y22-K426 HydrophobicContact CE2-CG 4.32Å; Y22-K426 PolarHBondContact OH-NZ 2.91Å; Y22-N489 CarbonylContact C-O 3.51Å; Y22-N489 WeakPolarHBondContact CA-O 3.46Å; Y22-N489 WeakPolarHBondContact CB-O 3.47Å; Y22-N489 WeakPolarHBondContact CD1-O 3.41Å; Y22-N492 HydrophobicContact CD1-CB 4.47Å; Y22-N492 HydrophobicContact CE1-CB 3.48Å; Y22-N492 VanDerWaalsContact CE1-CB 3.48Å; Y22-N492 PolarHBondContact OH-ND2 3.06Å; Y22-N492 VanDerWaalsContact OH-ND2 3.16Å
23	T	25.9	Very low	26.1	Very low	1 Å²	1	82.8 Å²	82.8	1%	0.006	43%	0.426	C	S	.	.			trans	-69.7	145.2	171.6	141.9	0	0	0	0	114.8	S421 L422 I486 N489 C490	T23-S421 WeakPolarHBondContact OG1-CB 3.45Å; T23-L422 CarbonylContact C-O 3.6Å; T23-L422 WeakPolarHBondContact CB-O 3.39Å; T23-I486 VanDerWaalsContact CA-O 3.29Å; T23-I486 WeakPolarHBondContact CA-O 3.47Å; T23-I486 VanDerWaalsContact CB-O 3.23Å; T23-I486 WeakPolarHBondContact CB-O 3.37Å; T23-I486 WeakPolarHBondContact CG2-O 3.44Å; T23-I486 WeakPolarHBondContact OG1-CG2 3.41Å; T23-I486 PolarHBondContact OG1-O 3.29Å; T23-N489 HydrophobicContact CG2-CB 4.28Å; T23-N489 VanDerWaalsContact N-C 3.28Å; T23-N489 PolarHBondContact N-O 3.12Å; T23-C490 VanDerWaalsContact C-SG 3.54Å; T23-C490 PolarHBondContact O-SG 3.01Å
24	F	31.1	Very low	26.2	Very low	21 Å²	21	83.1 Å²	83.1	9%	0.092	42%	0.424	C	S	.	.			trans	-134.7	111.4	160	-64.2	-83.9	0	0	0	110.5	L422 Y452	F24-L422 HydrophobicContact CB-CB 4.2Å; F24-L422 HydrophobicContact CD2-CB 3.85Å; F24-L422 HydrophobicContact CD2-CD2 3.88Å; F24-L422 HydrophobicContact CD2-CG 4.12Å; F24-L422 VanDerWaalsContact CD2-O 3.27Å; F24-L422 WeakPolarHBondContact CD2-O 3.4Å; F24-L422 HydrophobicContact CE2-CD2 4.28Å; F24-L422 HydrophobicContact CG-CB 4.47Å; F24-L422 PolarHBondContact N-O 3.11Å; F24-Y452 AromaticContact CE2-CD1 3.74Å; F24-Y452 HydrophobicContact CE2-CD1 3.74Å; F24-Y452 AromaticContact CE2-CE1 3.59Å; F24-Y452 HydrophobicContact CE2-CE1 3.59Å; F24-Y452 HydrophobicContact CZ-CD1 4.43Å; F24-Y452 AromaticContact CZ-CE1 3.84Å; F24-Y452 HydrophobicContact CZ-CE1 3.84Å
25	P	27.3	Very low	26.3	Very low	59 Å²	59	80 Å²	80	38%	0.383	41%	0.407	S	S	.	.	S	Bend	trans	-78.6	129.9	165.7	27.5	-28.3	0	0	0	110.3	C490	P25-C490 WeakPolarHBondContact CD-SG 3.46Å
26	N	28.6	Very low	26.5	Very low	61 Å²	61	77.7 Å²	77.7	33%	0.326	40%	0.395	S	S	.	.			trans	74.3	49.5	166.1	-57	-17.7	0	0	0	118.1	Y28 C411	N26-Y28 PolarHBondContact O-N 3.25Å; N26-C411 HydrophobicContact CB-CB 4.05Å
27	C	27.7	Very low	26.7	Very low	26 Å²	26	74.1 Å²	74.1	18%	0.176	38%	0.376	C	S	.	.			trans	-76.1	94.3	166.1	-83.4	0	0	0	0	112.5	I29 F399	C27-I29 PolarHBondContact O-N 3.25Å; C27-F399 HydrophobicContact CB-CE1 3.35Å; C27-F399 HydrophobicContact CB-CE2 4.2Å; C27-F399 HydrophobicContact CB-CZ 3.14Å; C27-F399 WeakPolarHBondContact SG-CZ 3.43Å
28	Y	25.5	Very low	26.8	Very low	191 Å²	191	71.3 Å²	71.3	75%	0.749	37%	0.366	S	S	*	.			trans	-66.7	93.5	170.4	-95.9	-90.3	0	0	0	111.2	N26 F399	N26-Y28 PolarHBondContact O-N 3.25Å; Y28-F399 WeakPolarHBondContact O-CD1 3.46Å
29	I	29.3	Very low	26.8	Very low	41 Å²	41	76.5 Å²	76.5	21%	0.21	37%	0.372	C	S	.	.			trans	-62.2	124.2	167.2	-59.6	171	0	0	0	107.2	C27 I33 F399	C27-I29 PolarHBondContact O-N 3.25Å; I29-I33 HydrophobicContact CB-CD1 4.19Å; I29-I33 HydrophobicContact CD1-CD1 4.15Å; I29-I33 HydrophobicContact CG2-CD1 3.77Å; I29-I33 HydrophobicContact CG2-CG1 4.37Å; I29-F399 HydrophobicContact CG1-CE1 4.19Å
30	P	22.8	Very low	26.9	Very low	46 Å²	46	76 Å²	76	30%	0.299	38%	0.377	S	S	.	.			trans	-59.5	147.5	-168.6	-14.4	20	0	0	0	112.7	V32 L398 K400	P30-V32 VanDerWaalsContact C-N 3.25Å; P30-V32 PolarHBondContact O-N 3.02Å; P30-L398 WeakPolarHBondContact CD-O 3.35Å; P30-K400 WeakPolarHBondContact CB-O 3.16Å; P30-K400 HydrophobicContact CG-CB 3.9Å; P30-K400 VanDerWaalsContact CG-O 3.23Å; P30-K400 WeakPolarHBondContact CG-O 3.29Å
31	N	28	Very low	26.9	Very low	145 Å²	145	77.1 Å²	77.1	78%	0.775	39%	0.385	S	S	*	.	S	Bend	trans	-33.1	68	178.8	-67.5	-2.7	0	0	0	117.3
32	V	25.7	Very low	27.1	Very low	51 Å²	51	82.3 Å²	82.3	31%	0.309	41%	0.407	S	S	.	.	S	Bend	trans	-139.8	7.9	142.2	-167.2	0	0	0	0	110.3	P30 Y380	P30-V32 VanDerWaalsContact C-N 3.25Å; P30-V32 PolarHBondContact O-N 3.02Å; V32-Y380 HydrophobicContact CB-CD2 4.17Å; V32-Y380 HydrophobicContact CB-CE2 4.18Å; V32-Y380 HydrophobicContact CG1-CD2 4.45Å; V32-Y380 HydrophobicContact CG1-CE1 4.39Å; V32-Y380 HydrophobicContact CG1-CE2 4.08Å
33	I	29.5	Very low	27.1	Very low	20 Å²	20	87.8 Å²	87.8	10%	0.103	44%	0.437	C	S	.	.	S	Bend	trans	-115.1	84.2	163.2	-54.2	-178	0	0	0	105.1	I29 Q35	I29-I33 HydrophobicContact CB-CD1 4.19Å; I29-I33 HydrophobicContact CD1-CD1 4.15Å; I29-I33 HydrophobicContact CG2-CD1 3.77Å; I29-I33 HydrophobicContact CG2-CG1 4.37Å; I33-Q35 PolarHBondContact O-N 2.77Å
34	D	26.8	Very low	27	Very low	120 Å²	120	95.4 Å²	95.4	64%	0.642	48%	0.478	S	S	*	.			trans	-47.3	124.5	168.2	-70.9	-49.1	0	0	0	108.4
35	Q	26.7	Very low	26.6	Very low	111 Å²	111	101.1 Å²	101.1	52%	0.519	51%	0.509	S	S	.	.			trans	38.2	98.2	167.3	-57.4	-177.7	16.9	0	0	114.3	I33 L37	I33-Q35 PolarHBondContact O-N 2.77Å; Q35-L37 HydrophobicContact CB-CG 4.34Å; Q35-L37 PolarHBondContact O-N 2.93Å
36	L	29.9	Very low	26.4	Very low	75 Å²	75	106.6 Å²	106.6	39%	0.393	53%	0.53	S	S	.	.			trans	-56.2	95.3	151.8	-84	163	0	0	0	107	I38 T98 L420	L36-I38 HydrophobicContact CB-CD1 4.5Å; L36-I38 HydrophobicContact CB-CG1 4.48Å; L36-I38 PolarHBondContact O-N 3.37Å; L36-T98 HydrophobicContact CD2-CG2 4.22Å; L36-L420 HydrophobicContact CD2-CD1 4.28Å
37	L	27.4	Very low	26.1	Very low	54 Å²	54	109.4 Å²	109.4	28%	0.283	55%	0.553	S	S	.	*			trans	-69.7	78.7	174.2	-76.3	160.9	0	0	0	108.3	Q35 E153 Q156	Q35-L37 HydrophobicContact CB-CG 4.34Å; Q35-L37 PolarHBondContact O-N 2.93Å; L37-E153 HydrophobicContact CD1-CG 4.32Å; L37-Q156 HydrophobicContact CD2-CB 4.48Å; L37-Q156 HydrophobicContact CD2-CG 4.49Å; L37-Q156 VanDerWaalsContact CG-OE1 3.3Å
38	I	29.3	Very low	25.9	Very low	79 Å²	79	117.7 Å²	117.7	41%	0.405	58%	0.582	S	S	.	*			trans	-105.2	76.5	164.7	-53.4	170.4	0	0	0	105.7	L36	L36-I38 HydrophobicContact CB-CD1 4.5Å; L36-I38 HydrophobicContact CB-CG1 4.48Å; L36-I38 PolarHBondContact O-N 3.37Å
39	R	23.5	Very low	25.8	Very low	201 Å²	201	116 Å²	116	76%	0.758	59%	0.585	S	S	*	*			trans	-130.9	105.3	156.8	-83.3	-169.3	172.7	-177.9	-1.8	108	K41	R39-K41 PolarHBondContact O-N 3.41Å
40	S	26.8	Very low	25.5	Very low	98 Å²	98	118.4 Å²	118.4	69%	0.685	60%	0.603	S	S	*	*			trans	-64.4	82	155.4	60.1	0	0	0	0	108
41	K	24.1	Very low	25.5	Very low	172 Å²	172	125.2 Å²	125.2	75%	0.748	63%	0.631	S	S	*	*			trans	-98.7	76.3	154.6	-93.5	-167.7	173.5	-173.6	0	106.5	R39	R39-K41 PolarHBondContact O-N 3.41Å
42	F	27.5	Very low	25.5	Very low	141 Å²	141	128.3 Å²	128.3	62%	0.618	63%	0.633	S	S	*	*			trans	-131.5	119.4	159.9	-80.5	-74.2	0	0	0	108.5
43	N	26.2	Very low	25.3	Very low	130 Å²	130	131.3 Å²	131.3	70%	0.695	66%	0.657	S	S	*	*			trans	77.7	72.2	169.8	-62.8	-7.2	0	0	0	119
44	N	23.4	Very low	25.3	Very low	162 Å²	162	136.6 Å²	136.6	87%	0.866	69%	0.69	S	S	*	*	S	Bend		-109.3	97.8	113	-87.8	-7.5	0	0	0	106.2
45	N	23.1	Very low	25.2	Very low	140 Å²	140	134.9 Å²	134.9	75%	0.749	69%	0.692	S	S	*	*	S	Bend	trans	175.7	137.1	141.2	-86.3	-10	0	0	0	109.8	C47	N45-C47 PolarHBondContact O-N 2.87Å
46	Q	22.7	Very low	25.3	Very low	174 Å²	174	135.2 Å²	135.2	81%	0.813	71%	0.705	S	S	*	*			trans	-55.1	101.2	179.1	-64.3	158.9	-27.3	0	0	110.2	Y48	Q46-Y48 PolarHBondContact O-N 2.9Å
47	C	23.1	Very low	25.3	Very low	120 Å²	120	136.5 Å²	136.5	81%	0.811	73%	0.726	S	S	*	*			trans	-82.4	103.4	160.3	-77.3	0	0	0	0	107.2	N45 L49	N45-C47 PolarHBondContact O-N 2.87Å; C47-L49 PolarHBondContact O-N 3.01Å
48	Y	21.9	Very low	25.1	Very low	201 Å²	201	142.2 Å²	142.2	79%	0.788	75%	0.751	S	S	*	*			trans	-45.1	120.4	166.4	-79.2	-96.9	0	0	0	109.7	Q46 P50	Q46-Y48 PolarHBondContact O-N 2.9Å; Y48-P50 WeakPolarHBondContact O-CD 3.33Å
49	L	23.2	Very low	25.1	Very low	154 Å²	154	146.4 Å²	146.4	81%	0.806	77%	0.774	S	S	*	*			trans	-52	122.4	161.5	-90.3	137.3	0	0	0	107.9	C47 Q51	C47-L49 PolarHBondContact O-N 3.01Å; L49-Q51 PolarHBondContact O-N 3.25Å
50	P	23.3	Very low	25.1	Very low	93 Å²	93	143 Å²	143	60%	0.604	78%	0.776	S	S	*	*			trans	-62.3	110.3	163	-13.1	27.6	0	0	0	106.7	Y48 Y52	Y48-P50 WeakPolarHBondContact O-CD 3.33Å; P50-Y52 VanDerWaalsContact C-N 3.32Å; P50-Y52 HydrophobicContact CB-CE2 4.22Å; P50-Y52 PolarHBondContact O-N 3.07Å
51	Q	23.2	Very low	25.3	Very low	189 Å²	189	145.2 Å²	145.2	88%	0.883	79%	0.785	S	S	*	*			trans	-62.6	97.7	167.2	-74.8	-179.1	-17.6	0	0	107.4	L49 S53	L49-Q51 PolarHBondContact O-N 3.25Å; Q51-S53 VanDerWaalsContact C-N 3.32Å; Q51-S53 PolarHBondContact O-N 2.86Å
52	Y	27.3	Very low	25.2	Very low	209 Å²	209	141.2 Å²	141.2	82%	0.82	78%	0.778	S	S	*	*			trans	-68.8	98.6	162.6	-76.1	-81.9	0	0	0	107.6	P50 T54	P50-Y52 VanDerWaalsContact C-N 3.32Å; P50-Y52 HydrophobicContact CB-CE2 4.22Å; P50-Y52 PolarHBondContact O-N 3.07Å; Y52-T54 PolarHBondContact O-N 2.68Å; Y52-T54 VanDerWaalsContact O-N 3.1Å
53	S	22.2	Very low	25.2	Very low	115 Å²	115	141.7 Å²	141.7	80%	0.804	79%	0.787	S	S	*	*			trans	-62.3	101.3	162.2	177.7	0	0	0	0	108.3	Q51	Q51-S53 VanDerWaalsContact C-N 3.32Å; Q51-S53 PolarHBondContact O-N 2.86Å
54	T	29	Very low	25.2	Very low	130 Å²	130	140.5 Å²	140.5	80%	0.798	79%	0.789	S	S	*	*			trans	-96.4	111.6	154.9	46.1	0	0	0	0	107.3	Y52	Y52-T54 PolarHBondContact O-N 2.68Å; Y52-T54 VanDerWaalsContact O-N 3.1Å
55	A	25.5	Very low	25.5	Very low	84 Å²	84	139.2 Å²	139.2	69%	0.694	79%	0.787	S	S	*	*			trans	-50.9	148.9	174.4	0	0	0	0	0	111.8	A57	A55-A57 PolarHBondContact O-N 3.12Å
56	P	27.9	Very low	25.6	Very low	119 Å²	119	141.5 Å²	141.5	77%	0.773	79%	0.793	S	S	*	*			trans	-72.8	119.7	-171	27.9	-32.3	0	0	0	111	Q58	P56-Q58 PolarHBondContact O-N 2.75Å; P56-Q58 VanDerWaalsContact O-N 3.08Å
57	A	30.9	Very low	25.9	Very low	102 Å²	102	141 Å²	141	84%	0.843	80%	0.795	S	S	*	*			trans	-68.3	102.8	157.5	0	0	0	0	0	107.7	A55 N59	A55-A57 PolarHBondContact O-N 3.12Å; A57-N59 PolarHBondContact O-N 3.08Å; A57-N59 VanDerWaalsContact O-N 3.15Å
58	Q	23.4	Very low	26.2	Very low	174 Å²	174	141 Å²	141	81%	0.813	79%	0.792	S	S	*	*			trans	-55	113.4	162.9	-70.1	173.7	-18.9	0	0	108.3	P56	P56-Q58 PolarHBondContact O-N 2.75Å; P56-Q58 VanDerWaalsContact O-N 3.08Å
59	N	29	Very low	26.8	Very low	166 Å²	166	138.2 Å²	138.2	89%	0.888	79%	0.789	S	S	*	*			trans	-152.6	107.7	144.6	-96.4	-25.8	0	0	0	109.2	A57 V61	A57-N59 PolarHBondContact O-N 3.08Å; A57-N59 VanDerWaalsContact O-N 3.15Å; N59-V61 PolarHBondContact O-N 3.01Å
60	V	23.3	Very low	27.6	Very low	131 Å²	131	134.9 Å²	134.9	79%	0.794	77%	0.772	S	S	*	*			trans	-64.7	115	169.6	174.3	0	0	0	0	108.6
61	V	30.3	Very low	29	Very low	144 Å²	144	138.9 Å²	138.9	87%	0.873	78%	0.78	S	S	*	*			trans	-145.2	117.9	139.1	-177.3	0	0	0	0	108.4	N59	N59-V61 PolarHBondContact O-N 3.01Å
62	S	23.7	Very low	30.9	Very low	88 Å²	88	131.3 Å²	131.3	62%	0.615	75%	0.748	S	S	*	*			trans	-71.9	140.6	175.7	-9	0	0	0	0	111.9
63	N	26	Very low	32.8	Very low	151 Å²	151	122.1 Å²	122.1	81%	0.807	71%	0.714	S	S	*	*			trans	129.2	118	145.5	-68.5	-12	0	0	0	115.4
64	S	26.4	Very low	35.1	Very low	104 Å²	104	117 Å²	117	73%	0.727	68%	0.677	S	S	*	*			trans	56.3	98.8	141.6	57	0	0	0	0	118.9
65	T	29.2	Very low	36.7	Very low	135 Å²	135	114.4 Å²	114.4	83%	0.828	66%	0.663	S	S	*	*				-178.6	138	113.8	20.8	0	0	0	0	108.5	L67	T65-L67 PolarHBondContact O-N 3.11Å
66	E	27	Very low	38.4	Very low	188 Å²	188	118.5 Å²	118.5	88%	0.879	67%	0.665	S	S	*	*			trans	-48.7	111.9	177.1	-72.1	170.3	141.2	0	0	110.4	T68	E66-T68 PolarHBondContact O-N 3.49Å
67	L	27.3	Very low	40	Very low	163 Å²	163	117 Å²	117	85%	0.853	64%	0.644	S	S	*	*			trans	-64.8	85.5	165.3	-88.7	144.8	0	0	0	107.4	T65 I69	T65-L67 PolarHBondContact O-N 3.11Å; L67-I69 VanDerWaalsContact C-N 3.31Å; L67-I69 PolarHBondContact O-N 2.74Å
68	T	30.1	Very low	41.7	Very low	121 Å²	121	116 Å²	116	74%	0.742	62%	0.624	S	S	*	*			trans	-54.9	105.6	153.7	45.8	0	0	0	0	105.6	E66 D70	E66-T68 PolarHBondContact O-N 3.49Å; T68-D70 PolarHBondContact O-N 2.94Å
69	I	34.7	Very low	44	Very low	143 Å²	143	110.7 Å²	110.7	73%	0.733	61%	0.607	S	S	*	*			trans	-62.7	91.2	175.5	-57.4	169.8	0	0	0	105.5	L67 K71	L67-I69 VanDerWaalsContact C-N 3.31Å; L67-I69 PolarHBondContact O-N 2.74Å; I69-K71 HydrophobicContact CG2-CG 4.06Å; I69-K71 PolarHBondContact O-N 3.01Å
70	D	40.2	Very low	46.4	Very low	83 Å²	83	103.4 Å²	103.4	44%	0.444	57%	0.567	S	S	.	*			trans	-66.2	84	174.4	-145.4	8.6	0	0	0	105.3	T68 S72 S357 N360	T68-D70 PolarHBondContact O-N 2.94Å; D70-S72 PolarHBondContact O-N 3.03Å; D70-S357 WeakPolarHBondContact OD2-CB 3.37Å; D70-S357 PolarHBondContact OD2-OG 3.37Å; D70-N360 PolarHBondContact OD2-ND2 3.05Å
71	K	53.3	Low	49.3	Very low	177 Å²	177	103.1 Å²	103.1	77%	0.77	57%	0.565	S	S	*	*			trans	-66.9	87.3	174.1	-76	-175	-179.5	178.3	0	105.8	I69	I69-K71 HydrophobicContact CG2-CG 4.06Å; I69-K71 PolarHBondContact O-N 3.01Å
72	S	61.6	Low	52	Low	30 Å²	30	99.9 Å²	99.9	21%	0.21	54%	0.543	C	S	.	.			trans	-51.5	130.3	172.9	178.5	0	0	0	0	108.7	D70 Y74 E362	D70-S72 PolarHBondContact O-N 3.03Å; S72-Y74 PolarHBondContact O-N 2.83Å; S72-Y74 PolarHBondContact OG-N 3Å; S72-E362 WeakPolarHBondContact CB-OE2 3.18Å; S72-E362 PolarHBondContact OG-OE2 3.44Å
73	P	68.1	Low	55.3	Low	17 Å²	17	97.1 Å²	97.1	11%	0.11	52%	0.523	C	S	.	.	S	Bend	trans	-72	-8.3	-178.5	28.1	-32.7	0	0	0	112.9	L354 N467	P73-L354 WeakPolarHBondContact CG-O 3.36Å; P73-N467 PolarHBondContact O-ND2 3.19Å
74	Y	69.7	Low	58.5	Low	7 Å²	7	93.7 Å²	93.7	3%	0.027	50%	0.502	C	S	.	.	S	Bend	trans	-106	132.3	-177.5	-60.2	-66.5	0	0	0	109.9	S72 L354 Q356 I364 P365 T468	S72-Y74 PolarHBondContact O-N 2.83Å; S72-Y74 PolarHBondContact OG-N 3Å; Y74-L354 HydrophobicContact CE2-CB 4.25Å; Y74-L354 WeakPolarHBondContact OH-CB 3.3Å; Y74-L354 WeakPolarHBondContact OH-CD2 3.38Å; Y74-Q356 HydrophobicContact CD2-CG 4.41Å; Y74-Q356 HydrophobicContact CE2-CG 4.34Å; Y74-I364 HydrophobicContact CD2-CG1 4.37Å; Y74-I364 HydrophobicContact CE1-CG2 4.36Å; Y74-I364 HydrophobicContact CE2-CG1 4.08Å; Y74-P365 HydrophobicContact CD1-CG 4.36Å; Y74-T468 WeakPolarHBondContact CE1-OG1 3.42Å; Y74-T468 PolarHBondContact OH-OG1 3.45Å
75	P	63.6	Low	61.6	Low	76 Å²	76	93.2 Å²	93.2	49%	0.494	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-63.8	140.4	175.4	26.5	-32.5	0	0	0	109.7
76	K	61.3	Low	64.6	Low	169 Å²	169	86.8 Å²	86.8	74%	0.735	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-54.4	149.8	166.8	-71.2	-176.3	179.2	179.8	0	109.4	L78	K76-L78 PolarHBondContact O-N 3.38Å
77	Y	61.6	Low	67.8	Low	87 Å²	87	77.8 Å²	77.8	34%	0.341	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-47.2	117.5	174.2	-77	-79.8	0	0	0	110.3	S79 N109 D363	Y77-S79 PolarHBondContact O-N 3.24Å; Y77-S79 VanDerWaalsContact O-N 3.1Å; Y77-N109 HydrophobicContact CD1-CB 4.28Å; Y77-N109 HydrophobicContact CE1-CB 4.3Å; Y77-N109 WeakPolarHBondContact CE1-ND2 3.3Å; Y77-D363 HydrophobicContact CE2-CB 3.74Å; Y77-D363 WeakPolarHBondContact OH-CB 3.49Å; Y77-D363 PolarHBondContact OH-OD2 2.76Å
78	L	66.3	Low	70.8	Confident	82 Å²	82	74.5 Å²	74.5	43%	0.429	39%	0.387	S	S	.	.			trans	-70.5	106.6	169.9	-65.1	169.3	0	0	0	106.6	K76 W80 P107	K76-L78 PolarHBondContact O-N 3.38Å; L78-W80 HydrophobicContact CB-CE3 4.35Å; L78-W80 HydrophobicContact CB-CH2 3.34Å; L78-W80 HydrophobicContact CB-CZ2 3.66Å; L78-W80 HydrophobicContact CB-CZ3 3.71Å; L78-W80 HydrophobicContact CD1-CH2 3.77Å; L78-W80 HydrophobicContact CD1-CZ2 3.92Å; L78-W80 HydrophobicContact CG-CH2 4.17Å; L78-W80 HydrophobicContact CG-CZ2 4.27Å; L78-W80 WeakPolarHBondContact O-CZ3 3.5Å; L78-P107 HydrophobicContact CD1-CB 4.47Å
79	S	71.1	Confident	73.7	Confident	63 Å²	63	71.3 Å²	71.3	44%	0.441	36%	0.362	S	S	.	.			trans	-109.4	123.1	173	59.8	0	0	0	0	108.6	Y77 S134	Y77-S79 PolarHBondContact O-N 3.24Å; Y77-S79 VanDerWaalsContact O-N 3.1Å; S79-S134 VanDerWaalsContact CA-OG 3.31Å; S79-S134 WeakPolarHBondContact CA-OG 3.26Å; S79-S134 WeakPolarHBondContact CB-OG 3.42Å
80	W	80.7	Confident	76.4	Confident	13 Å²	13	64.5 Å²	64.5	5%	0.049	33%	0.327	C	S	.	.			trans	-105.9	135.4	175.1	-62.2	-84.9	0	0	0	109.5	L78 L86 Y89 P107 L110 S134 L136	L78-W80 HydrophobicContact CB-CE3 4.35Å; L78-W80 HydrophobicContact CB-CH2 3.34Å; L78-W80 HydrophobicContact CB-CZ2 3.66Å; L78-W80 HydrophobicContact CB-CZ3 3.71Å; L78-W80 HydrophobicContact CD1-CH2 3.77Å; L78-W80 HydrophobicContact CD1-CZ2 3.92Å; L78-W80 HydrophobicContact CG-CH2 4.17Å; L78-W80 HydrophobicContact CG-CZ2 4.27Å; L78-W80 WeakPolarHBondContact O-CZ3 3.5Å; W80-L86 HydrophobicContact CB-CB 4.07Å; W80-L86 HydrophobicContact CD2-CB 4.35Å; W80-L86 HydrophobicContact CD2-CD1 3.62Å; W80-L86 HydrophobicContact CD2-CG 4.46Å; W80-L86 HydrophobicContact CE3-CD1 3.8Å; W80-L86 HydrophobicContact CG-CB 3.89Å; W80-L86 HydrophobicContact CG-CD1 4.1Å; W80-L86 HydrophobicContact CG-CG 4.49Å; W80-L86 HydrophobicContact CH2-CD1 4.17Å; W80-L86 HydrophobicContact CZ2-CD1 4.02Å; W80-L86 HydrophobicContact CZ3-CD1 4.09Å; W80-Y89 HydrophobicContact CH2-CD1 4.32Å; W80-Y89 HydrophobicContact CH2-CE1 4.21Å; W80-Y89 AromaticContact CZ2-CD1 3.58Å; W80-Y89 HydrophobicContact CZ2-CD1 3.58Å; W80-Y89 HydrophobicContact CZ2-CD2 4.47Å; W80-Y89 AromaticContact CZ2-CE1 3.77Å; W80-Y89 HydrophobicContact CZ2-CE1 3.77Å; W80-Y89 AromaticContact CZ2-CG 3.95Å; W80-Y89 HydrophobicContact CZ2-CG 3.95Å; W80-P107 HydrophobicContact CH2-CG 4.2Å; W80-L110 HydrophobicContact CE3-CD1 4.08Å; W80-L110 HydrophobicContact CH2-CD2 4.39Å; W80-L110 HydrophobicContact CZ3-CB 4.26Å; W80-L110 HydrophobicContact CZ3-CD1 3.71Å; W80-L110 HydrophobicContact CZ3-CD2 4.32Å; W80-L110 HydrophobicContact CZ3-CG 4.3Å; W80-S134 WeakPolarHBondContact O-CB 3.35Å; W80-L136 HydrophobicContact CB-CD1 4.28Å; W80-L136 WeakPolarHBondContact O-CD1 3.49Å
81	T	82.4	Confident	78.7	Confident	124 Å²	124	61.4 Å²	61.4	76%	0.761	31%	0.312	S	S	*	.	S	Bend	trans	-104.3	-23.3	173.6	51.8	0	0	0	0	112
82	D	88.8	Confident	80.4	Confident	76 Å²	76	59.5 Å²	59.5	41%	0.406	31%	0.306	S	S	.	.			trans	-109.2	123.6	177.7	-179.4	10.8	0	0	0	111.4	H84 E85 L86	D82-H84 PolarHBondContact O-N 2.91Å; D82-H84 PolarHBondContact OD1-N 2.85Å; D82-H84 WeakPolarHBondContact OD2-CB 3.38Å; D82-E85 HydrophobicContact CB-CB 4.13Å; D82-E85 PolarHBondContact O-N 2.99Å; D82-L86 PolarHBondContact O-N 3.15Å
83	P	91.6	Very high	81.7	Confident	30 Å²	30	61.8 Å²	61.8	20%	0.195	31%	0.31	C	S	.	.	H	α-helix	trans	-55.8	-30.4	171.4	-26.2	35.1	0	0	0	114	A87 L136 C141	P83-A87 WeakPolarHBondContact O-CB 3.24Å; P83-A87 PolarHBondContact O-N 2.8Å; P83-L136 HydrophobicContact CG-CD1 4.05Å; P83-L136 HydrophobicContact CG-CD2 4.03Å; P83-C141 HydrophobicContact CB-CB 4.13Å; P83-C141 WeakPolarHBondContact O-CB 3.42Å
84	H	93.1	Very high	82.5	Confident	80 Å²	80	62.9 Å²	62.9	37%	0.37	31%	0.314	S	S	.	.	H	α-helix	trans	-70.1	-42.4	178.6	-170.3	76.6	0	0	0	112	D82 A87 Q88 Q144	D82-H84 PolarHBondContact O-N 2.91Å; D82-H84 PolarHBondContact OD1-N 2.85Å; D82-H84 WeakPolarHBondContact OD2-CB 3.38Å; H84-A87 WeakPolarHBondContact O-CB 3.37Å; H84-A87 PolarHBondContact O-N 2.65Å; H84-Q88 PolarHBondContact CD2-NE2 3.05Å; H84-Q88 VanDerWaalsContact CD2-NE2 3.29Å; H84-Q88 PolarHBondContact NE2-NE2 2.96Å; H84-Q88 WeakPolarHBondContact O-CG 3.36Å; H84-Q88 PolarHBondContact O-N 3.09Å; H84-Q144 HydrophobicContact CB-CG 4.28Å
85	E	92.3	Very high	83.2	Confident	93 Å²	93	63.1 Å²	63.1	44%	0.435	32%	0.316	S	S	.	.	H	α-helix	trans	-59.8	-46	173.9	-171.8	-171.1	176.9	0	0	111.4	D82 A87 Q88 Y89	D82-E85 HydrophobicContact CB-CB 4.13Å; D82-E85 PolarHBondContact O-N 2.99Å; E85-A87 VanDerWaalsContact C-N 3.32Å; E85-A87 PolarHBondContact O-N 3.06Å; E85-Q88 PolarHBondContact O-N 2.94Å; E85-Y89 PolarHBondContact O-N 3.38Å
86	L	91.9	Very high	84	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-60.7	-42.1	175.2	176	58.6	0	0	0	111.5	W80 D82 Y89 L90 L110 L136 C141	W80-L86 HydrophobicContact CB-CB 4.07Å; W80-L86 HydrophobicContact CD2-CB 4.35Å; W80-L86 HydrophobicContact CD2-CD1 3.62Å; W80-L86 HydrophobicContact CD2-CG 4.46Å; W80-L86 HydrophobicContact CE3-CD1 3.8Å; W80-L86 HydrophobicContact CG-CB 3.89Å; W80-L86 HydrophobicContact CG-CD1 4.1Å; W80-L86 HydrophobicContact CG-CG 4.49Å; W80-L86 HydrophobicContact CH2-CD1 4.17Å; W80-L86 HydrophobicContact CZ2-CD1 4.02Å; W80-L86 HydrophobicContact CZ3-CD1 4.09Å; D82-L86 PolarHBondContact O-N 3.15Å; L86-Y89 PolarHBondContact O-N 3.04Å; L86-L90 HydrophobicContact CD1-CD1 3.98Å; L86-L90 HydrophobicContact CD1-CG 3.97Å; L86-L90 HydrophobicContact CG-CD1 4.02Å; L86-L90 HydrophobicContact CG-CG 4.4Å; L86-L90 WeakPolarHBondContact O-CB 3.36Å; L86-L90 VanDerWaalsContact O-CG 3.31Å; L86-L90 WeakPolarHBondContact O-CG 3.3Å; L86-L90 PolarHBondContact O-N 3.2Å; L86-L110 HydrophobicContact CD1-CD1 4.15Å; L86-L110 HydrophobicContact CD1-CD2 3.95Å; L86-L110 HydrophobicContact CD2-CD1 4.22Å; L86-L136 HydrophobicContact CD2-CB 4.34Å; L86-C141 HydrophobicContact CB-CB 4.26Å; L86-C141 HydrophobicContact CD2-CB 4.06Å; L86-C141 HydrophobicContact CG-CB 4.13Å
87	A	93.2	Very high	84.9	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-63.2	-41.3	177.1	0	0	0	0	0	112.6	P83 H84 E85 Y89 L90 S91 C141 Q144 L145 I148	P83-A87 WeakPolarHBondContact O-CB 3.24Å; P83-A87 PolarHBondContact O-N 2.8Å; H84-A87 WeakPolarHBondContact O-CB 3.37Å; H84-A87 PolarHBondContact O-N 2.65Å; E85-A87 VanDerWaalsContact C-N 3.32Å; E85-A87 PolarHBondContact O-N 3.06Å; A87-Y89 VanDerWaalsContact C-N 3.35Å; A87-L90 PolarHBondContact O-N 3.26Å; A87-S91 WeakPolarHBondContact O-CB 3.32Å; A87-S91 PolarHBondContact O-N 3.32Å; A87-C141 HydrophobicContact CB-CB 4.16Å; A87-Q144 HydrophobicContact CB-CB 3.65Å; A87-L145 HydrophobicContact CB-CB 3.95Å; A87-I148 HydrophobicContact CB-CD1 3.88Å
88	Q	92.1	Very high	85.6	Confident	93 Å²	93	49.7 Å²	49.7	44%	0.435	26%	0.256	S	S	.	.	H	α-helix	trans	-63.1	-41.2	174.1	-71.7	-178	-4	0	0	111.7	H84 E85 S91 I148	H84-Q88 PolarHBondContact CD2-NE2 3.05Å; H84-Q88 VanDerWaalsContact CD2-NE2 3.29Å; H84-Q88 PolarHBondContact NE2-NE2 2.96Å; H84-Q88 WeakPolarHBondContact O-CG 3.36Å; H84-Q88 PolarHBondContact O-N 3.09Å; E85-Q88 PolarHBondContact O-N 2.94Å; Q88-S91 PolarHBondContact O-N 3.13Å; Q88-S91 PolarHBondContact O-OG 3.25Å; Q88-I148 HydrophobicContact CG-CD1 3.85Å
89	Y	90.6	Very high	85.9	Confident	54 Å²	54	51 Å²	51	21%	0.212	26%	0.258	C	S	.	.	H	α-helix	trans	-64	-43.4	175.6	179.6	-93.8	0	0	0	112.1	W80 E85 L86 A87 Q92 R93 P107	W80-Y89 HydrophobicContact CH2-CD1 4.32Å; W80-Y89 HydrophobicContact CH2-CE1 4.21Å; W80-Y89 AromaticContact CZ2-CD1 3.58Å; W80-Y89 HydrophobicContact CZ2-CD1 3.58Å; W80-Y89 HydrophobicContact CZ2-CD2 4.47Å; W80-Y89 AromaticContact CZ2-CE1 3.77Å; W80-Y89 HydrophobicContact CZ2-CE1 3.77Å; W80-Y89 AromaticContact CZ2-CG 3.95Å; W80-Y89 HydrophobicContact CZ2-CG 3.95Å; E85-Y89 PolarHBondContact O-N 3.38Å; L86-Y89 PolarHBondContact O-N 3.04Å; A87-Y89 VanDerWaalsContact C-N 3.35Å; Y89-Q92 PolarHBondContact O-N 3.5Å; Y89-R93 VanDerWaalsContact OH-CZ 3.3Å; Y89-R93 PolarHBondContact OH-NE 3.41Å; Y89-R93 PolarHBondContact OH-NH2 2.78Å; Y89-P107 HydrophobicContact CE1-CB 4.4Å; Y89-P107 HydrophobicContact CE1-CG 3.89Å
90	L	90.9	Very high	86.5	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-71.1	-30	179.4	-68.7	175.9	0	0	0	113.1	L86 A87 Q92 R93 I94 I104 L110 I138 L145	L86-L90 HydrophobicContact CD1-CD1 3.98Å; L86-L90 HydrophobicContact CD1-CG 3.97Å; L86-L90 HydrophobicContact CG-CD1 4.02Å; L86-L90 HydrophobicContact CG-CG 4.4Å; L86-L90 WeakPolarHBondContact O-CB 3.36Å; L86-L90 VanDerWaalsContact O-CG 3.31Å; L86-L90 WeakPolarHBondContact O-CG 3.3Å; L86-L90 PolarHBondContact O-N 3.2Å; A87-L90 PolarHBondContact O-N 3.26Å; L90-Q92 VanDerWaalsContact C-N 3.26Å; L90-Q92 PolarHBondContact O-N 3.11Å; L90-R93 CarbonylContact O-C 3.51Å; L90-R93 PolarHBondContact O-N 2.84Å; L90-I94 PolarHBondContact O-N 2.7Å; L90-I104 HydrophobicContact CD2-CG2 4.08Å; L90-L110 HydrophobicContact CD2-CD2 3.9Å; L90-I138 HydrophobicContact CD1-CB 4.43Å; L90-I138 HydrophobicContact CD1-CG1 3.97Å; L90-I138 HydrophobicContact CD1-CG2 4.08Å; L90-L145 HydrophobicContact CB-CD1 4.33Å; L90-L145 HydrophobicContact CB-CD2 4.49Å
91	S	88.5	Confident	86.7	Confident	19 Å²	19	47.6 Å²	47.6	13%	0.133	24%	0.236	C	C	.	.	H	α-helix	trans	-63.6	-34.4	177.9	75	0	0	0	0	111.9	A87 Q88 R93 I94	A87-S91 WeakPolarHBondContact O-CB 3.32Å; A87-S91 PolarHBondContact O-N 3.32Å; Q88-S91 PolarHBondContact O-N 3.13Å; Q88-S91 PolarHBondContact O-OG 3.25Å; S91-R93 PolarHBondContact O-N 3.45Å; S91-I94 WeakPolarHBondContact O-CG1 3.19Å; S91-I94 PolarHBondContact O-N 3.3Å
92	Q	88.2	Confident	86.9	Confident	136 Å²	136	41.7 Å²	41.7	64%	0.636	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-15.9	174.2	-63.1	174.9	1.3	0	0	113.2	Y89 L90	Y89-Q92 PolarHBondContact O-N 3.5Å; L90-Q92 VanDerWaalsContact C-N 3.26Å; L90-Q92 PolarHBondContact O-N 3.11Å
93	R	88.7	Confident	86.9	Confident	79 Å²	79	38 Å²	38	30%	0.298	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106	12.9	-179.2	-69.4	-179.8	164.2	-92.8	-4.3	113.3	Y89 L90 S91 V95 I104 D105	Y89-R93 VanDerWaalsContact OH-CZ 3.3Å; Y89-R93 PolarHBondContact OH-NE 3.41Å; Y89-R93 PolarHBondContact OH-NH2 2.78Å; L90-R93 CarbonylContact O-C 3.51Å; L90-R93 PolarHBondContact O-N 2.84Å; S91-R93 PolarHBondContact O-N 3.45Å; R93-V95 PolarHBondContact O-N 2.91Å; R93-I104 HydrophobicContact CB-CG2 4.18Å; R93-I104 WeakPolarHBondContact O-CA 3.08Å; R93-D105 WeakPolarHBondContact CD-O 3.23Å; R93-D105 PolarHBondContact O-N 3.1Å
94	I	86.3	Confident	86.8	Confident	40 Å²	40	36.6 Å²	36.6	21%	0.205	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	116.8	172.4	-66.5	171	0	0	0	108.6	L90 S91 L97 V102 I104 I149	L90-I94 PolarHBondContact O-N 2.7Å; S91-I94 WeakPolarHBondContact O-CG1 3.19Å; S91-I94 PolarHBondContact O-N 3.3Å; I94-L97 HydrophobicContact CG2-CB 4.08Å; I94-V102 HydrophobicContact CD1-CG1 4.2Å; I94-V102 HydrophobicContact CG1-CG1 3.99Å; I94-V102 HydrophobicContact CG2-CG1 3.89Å; I94-I104 HydrophobicContact CG1-CG1 4.25Å; I94-I149 HydrophobicContact CD1-CD1 3.75Å; I94-I149 HydrophobicContact CD1-CG1 3.7Å
95	V	83.3	Confident	86.8	Confident	12 Å²	12	33.5 Å²	33.5	7%	0.073	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-40.6	177.4	175.5	0	0	0	0	110.4	R93 V103 D105 L189 P419 H457 Y459	R93-V95 PolarHBondContact O-N 2.91Å; V95-V103 HydrophobicContact CB-CG1 4.39Å; V95-V103 PolarHBondContact N-O 3.33Å; V95-D105 HydrophobicContact CG2-CB 3.71Å; V95-L189 HydrophobicContact CB-CD2 4.24Å; V95-L189 HydrophobicContact CG1-CD2 4.15Å; V95-L189 HydrophobicContact CG2-CD2 3.85Å; V95-P419 HydrophobicContact CG1-CB 3.46Å; V95-P419 VanDerWaalsContact CG1-CB 3.46Å; V95-P419 HydrophobicContact CG1-CG 3.92Å; V95-P419 VanDerWaalsContact O-CG 3.29Å; V95-P419 WeakPolarHBondContact O-CG 3.47Å; V95-H457 WeakPolarHBondContact CG1-O 3.33Å; V95-Y459 HydrophobicContact CB-CE2 4.43Å; V95-Y459 HydrophobicContact CG1-CD2 4.03Å; V95-Y459 HydrophobicContact CG1-CE2 3.89Å; V95-Y459 HydrophobicContact CG2-CD2 4.43Å
96	A	80.5	Confident	86.8	Confident	8 Å²	8	29 Å²	29	7%	0.066	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	136.9	179.7	0	0	0	0	0	111.2	V102 V103 L420	A96-V102 CarbonylContact O-C 3.57Å; A96-V102 WeakPolarHBondContact O-CA 3.44Å; A96-V103 HydrophobicContact CB-CB 4.07Å; A96-V103 HydrophobicContact CB-CG2 4.11Å; A96-V103 PolarHBondContact N-O 2.88Å; A96-V103 PolarHBondContact O-N 3.03Å; A96-L420 HydrophobicContact CB-CD1 3.82Å; A96-L420 HydrophobicContact CB-CD2 3.95Å; A96-L420 HydrophobicContact CB-CG 3.68Å
97	L	80.6	Confident	86.7	Confident	28 Å²	28	29.1 Å²	29.1	15%	0.147	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	130.4	177.5	177.6	60	0	0	0	109.5	I94 V102 I149 E153	I94-L97 HydrophobicContact CG2-CB 4.08Å; L97-V102 HydrophobicContact CD1-CG1 4.41Å; L97-V102 HydrophobicContact CD1-CG2 3.68Å; L97-I149 HydrophobicContact CD1-CG2 3.7Å; L97-I149 HydrophobicContact CD2-CG2 3.95Å; L97-I149 HydrophobicContact CG-CG2 4.5Å; L97-E153 HydrophobicContact CD2-CG 4.32Å
98	T	76.9	Confident	86.3	Confident	13 Å²	13	30.2 Å²	30.2	8%	0.08	14%	0.143	C	C	.	.			trans	-136.7	172.8	171.3	70.2	0	0	0	0	109.6	L36 H100 F101 R194 L420	L36-T98 HydrophobicContact CD2-CG2 4.22Å; T98-H100 PolarHBondContact O-N 2.98Å; T98-H100 VanDerWaalsContact O-N 3.16Å; T98-H100 PolarHBondContact OG1-N 2.75Å; T98-H100 VanDerWaalsContact OG1-N 3.11Å; T98-F101 HydrophobicContact CG2-CD1 4.46Å; T98-F101 HydrophobicContact CG2-CD2 4.44Å; T98-F101 HydrophobicContact CG2-CE1 3.88Å; T98-F101 HydrophobicContact CG2-CE2 3.84Å; T98-F101 HydrophobicContact CG2-CZ 3.52Å; T98-F101 PolarHBondContact N-O 3.32Å; T98-F101 VanDerWaalsContact OG1-CD1 3.3Å; T98-F101 WeakPolarHBondContact OG1-CD1 3.34Å; T98-F101 WeakPolarHBondContact OG1-CE1 3.43Å; T98-F101 WeakPolarHBondContact OG1-CG 3.39Å; T98-F101 PolarHBondContact OG1-N 3.15Å; T98-F101 PolarHBondContact OG1-O 2.78Å; T98-F101 VanDerWaalsContact OG1-O 3.13Å; T98-R194 WeakPolarHBondContact O-CD 3.42Å; T98-R194 PolarHBondContact O-NH1 3.42Å; T98-L420 HydrophobicContact CG2-CD1 4.39Å
99	K	73	Confident	85.9	Confident	110 Å²	110	28 Å²	28	48%	0.478	14%	0.135	S	C	.	.	S	Bend	trans	-57.4	-23.9	168.2	-176.2	173.1	-178.1	171.5	0	113.9
100	H	82	Confident	85.7	Confident	2 Å²	2	25.7 Å²	25.7	1%	0.009	13%	0.126	C	C	.	.	S	Bend	trans	-104.4	-29.3	-172	-59.7	-54.4	0	0	0	114.3	T98 R194 N195 Y198 P378 Y380	T98-H100 PolarHBondContact O-N 2.98Å; T98-H100 VanDerWaalsContact O-N 3.16Å; T98-H100 PolarHBondContact OG1-N 2.75Å; T98-H100 VanDerWaalsContact OG1-N 3.11Å; H100-R194 PolarHBondContact O-N 2.93Å; H100-N195 WeakPolarHBondContact CA-ND2 3.3Å; H100-N195 PolarHBondContact ND1-ND2 3.41Å; H100-Y198 HydrophobicContact CB-CD2 3.99Å; H100-Y198 HydrophobicContact CB-CG 3.97Å; H100-Y198 WeakPolarHBondContact O-CD1 3.48Å; H100-P378 HydrophobicContact CB-CB 4.45Å; H100-P378 HydrophobicContact CB-CG 4.36Å; H100-P378 VanDerWaalsContact CD2-CB 3.44Å; H100-P378 WeakPolarHBondContact CD2-CB 3.48Å; H100-Y380 PolarHBondContact CE1-OH 2.81Å; H100-Y380 AromaticContact NE2-CE2 3.85Å
101	F	86.2	Confident	85.5	Confident	2 Å²	2	26.2 Å²	26.2	1%	0.009	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	162	-173.4	65.5	-100.6	0	0	0	112.5	T98 V103 L191 L192 Y198 L375 P378 L420 L454	T98-F101 HydrophobicContact CG2-CD1 4.46Å; T98-F101 HydrophobicContact CG2-CD2 4.44Å; T98-F101 HydrophobicContact CG2-CE1 3.88Å; T98-F101 HydrophobicContact CG2-CE2 3.84Å; T98-F101 HydrophobicContact CG2-CZ 3.52Å; T98-F101 PolarHBondContact N-O 3.32Å; T98-F101 VanDerWaalsContact OG1-CD1 3.3Å; T98-F101 WeakPolarHBondContact OG1-CD1 3.34Å; T98-F101 WeakPolarHBondContact OG1-CE1 3.43Å; T98-F101 WeakPolarHBondContact OG1-CG 3.39Å; T98-F101 PolarHBondContact OG1-N 3.15Å; T98-F101 PolarHBondContact OG1-O 2.78Å; T98-F101 VanDerWaalsContact OG1-O 3.13Å; F101-V103 HydrophobicContact CD2-CG2 3.95Å; F101-V103 HydrophobicContact CE2-CG2 3.99Å; F101-L191 HydrophobicContact CB-CD1 3.8Å; F101-L191 HydrophobicContact CD2-CD1 3.84Å; F101-L191 HydrophobicContact CG-CD1 4Å; F101-L192 CarbonylContact C-O 3.21Å; F101-L192 WeakPolarHBondContact CA-O 3.22Å; F101-L192 VanDerWaalsContact CB-O 3.27Å; F101-L192 WeakPolarHBondContact CB-O 3.32Å; F101-Y198 HydrophobicContact CB-CD1 4.06Å; F101-Y198 HydrophobicContact CB-CE1 3.49Å; F101-Y198 VanDerWaalsContact CB-CE1 3.49Å; F101-Y198 AromaticContact CD1-CE1 3.99Å; F101-Y198 HydrophobicContact CD1-CE1 3.99Å; F101-Y198 AromaticContact CD1-CE2 3.97Å; F101-Y198 HydrophobicContact CD1-CE2 3.97Å; F101-Y198 AromaticContact CD1-CZ 3.54Å; F101-Y198 WeakPolarHBondContact CD1-OH 3.24Å; F101-Y198 HydrophobicContact CG-CE1 4.09Å; F101-L375 HydrophobicContact CD2-CD1 4.45Å; F101-L375 HydrophobicContact CE2-CD1 3.76Å; F101-L375 HydrophobicContact CZ-CD1 3.89Å; F101-P378 HydrophobicContact CE1-CG 4.27Å; F101-L420 HydrophobicContact CE2-CD1 4.44Å; F101-L420 HydrophobicContact CE2-CD2 4.31Å; F101-L420 HydrophobicContact CZ-CD1 4.27Å; F101-L420 HydrophobicContact CZ-CD2 4.34Å; F101-L454 HydrophobicContact CE1-CD2 4.09Å; F101-L454 HydrophobicContact CZ-CD2 3.9Å
102	V	85.8	Confident	85.5	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	135.1	171.8	-168	0	0	0	0	107.8	I94 A96 L97 I104 I149 L176 L192 R194	I94-V102 HydrophobicContact CD1-CG1 4.2Å; I94-V102 HydrophobicContact CG1-CG1 3.99Å; I94-V102 HydrophobicContact CG2-CG1 3.89Å; A96-V102 CarbonylContact O-C 3.57Å; A96-V102 WeakPolarHBondContact O-CA 3.44Å; L97-V102 HydrophobicContact CD1-CG1 4.41Å; L97-V102 HydrophobicContact CD1-CG2 3.68Å; V102-I104 HydrophobicContact CG1-CD1 4.47Å; V102-I104 HydrophobicContact CG1-CG1 4.01Å; V102-I149 HydrophobicContact CG1-CD1 4.16Å; V102-I149 HydrophobicContact CG2-CD1 3.99Å; V102-L176 HydrophobicContact CG2-CD2 3.78Å; V102-L192 HydrophobicContact CB-CB 4.35Å; V102-L192 PolarHBondContact N-O 2.93Å; V102-L192 PolarHBondContact O-N 3.48Å; V102-R194 HydrophobicContact CG2-CG 3.7Å
103	V	88.3	Confident	85.3	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	129.6	169.4	-172.8	0	0	0	0	108.3	V95 A96 F101 L189 I190 L191 L375 C456	V95-V103 HydrophobicContact CB-CG1 4.39Å; V95-V103 PolarHBondContact N-O 3.33Å; A96-V103 HydrophobicContact CB-CB 4.07Å; A96-V103 HydrophobicContact CB-CG2 4.11Å; A96-V103 PolarHBondContact N-O 2.88Å; A96-V103 PolarHBondContact O-N 3.03Å; F101-V103 HydrophobicContact CD2-CG2 3.95Å; F101-V103 HydrophobicContact CE2-CG2 3.99Å; V103-L189 HydrophobicContact CG1-CB 4.1Å; V103-L189 HydrophobicContact CG1-CD2 3.87Å; V103-L189 HydrophobicContact CG1-CG 4.44Å; V103-I190 VanDerWaalsContact CA-O 3.31Å; V103-I190 WeakPolarHBondContact CA-O 3.39Å; V103-I190 WeakPolarHBondContact CG1-O 3.38Å; V103-L191 HydrophobicContact CG2-CD1 3.86Å; V103-L375 HydrophobicContact CG2-CD1 4.02Å; V103-L375 HydrophobicContact CG2-CD2 4.49Å; V103-C456 HydrophobicContact CG1-CB 4.49Å; V103-C456 HydrophobicContact CG2-CB 4.49Å
104	I	91	Very high	84.1	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	138.9	-178.7	-57.9	175	0	0	0	108.6	L90 R93 I94 V102 K106 L145 L189 I190 L192	L90-I104 HydrophobicContact CD2-CG2 4.08Å; R93-I104 HydrophobicContact CB-CG2 4.18Å; R93-I104 WeakPolarHBondContact O-CA 3.08Å; I94-I104 HydrophobicContact CG1-CG1 4.25Å; V102-I104 HydrophobicContact CG1-CD1 4.47Å; V102-I104 HydrophobicContact CG1-CG1 4.01Å; I104-K106 PolarHBondContact O-N 2.83Å; I104-L145 HydrophobicContact CD1-CD2 3.69Å; I104-L189 CarbonylContact O-C 3.15Å; I104-L189 VanDerWaalsContact O-CA 3.3Å; I104-L189 WeakPolarHBondContact O-CA 3.38Å; I104-I190 HydrophobicContact CB-CD1 4.25Å; I104-I190 HydrophobicContact CB-CG1 3.86Å; I104-I190 PolarHBondContact N-O 3.46Å; I104-I190 VanDerWaalsContact N-O 3.14Å; I104-I190 WeakPolarHBondContact O-CG1 3.41Å; I104-I190 PolarHBondContact O-N 3.42Å; I104-L192 HydrophobicContact CD1-CD1 3.59Å; I104-L192 HydrophobicContact CD1-CG 4.42Å
105	D	92.3	Very high	82.7	Confident	14 Å²	14	25.2 Å²	25.2	8%	0.075	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	100.4	168.4	-162.5	-26.5	0	0	0	110.2	R93 V95 G188 H369 S458	R93-D105 WeakPolarHBondContact CD-O 3.23Å; R93-D105 PolarHBondContact O-N 3.1Å; V95-D105 HydrophobicContact CG2-CB 3.71Å; D105-G188 WeakPolarHBondContact OD1-CA 3.37Å; D105-G188 PolarHBondContact OD1-N 2.86Å; D105-H369 IonicContact OD1-CE1 3.93Å; D105-H369 IonicContact OD2-CE1 3.59Å; D105-S458 WeakPolarHBondContact OD2-CB 3.06Å; D105-S458 PolarHBondContact OD2-OG 3.42Å
106	K	92	Very high	81	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	130.6	-175.7	-166.3	-172.5	73.1	67.9	0	110.5	I104 L110 V112 I138 A184 Y186 S187 G188 I190	I104-K106 PolarHBondContact O-N 2.83Å; K106-L110 WeakPolarHBondContact CD-O 3.48Å; K106-L110 WeakPolarHBondContact CE-O 3.31Å; K106-L110 HydrophobicContact CG-CB 4.38Å; K106-L110 HydrophobicContact CG-CD2 4.23Å; K106-L110 PolarHBondContact NZ-O 3.26Å; K106-V112 HydrophobicContact CD-CG2 3.79Å; K106-I138 HydrophobicContact CD-CD1 3.81Å; K106-I138 HydrophobicContact CG-CD1 3.84Å; K106-A184 PolarHBondContact NZ-O 3.33Å; K106-Y186 WeakPolarHBondContact CE-O 3.48Å; K106-Y186 PolarHBondContact NZ-O 3.06Å; K106-S187 CarbonylContact O-C 3.58Å; K106-S187 VanDerWaalsContact O-CA 3.23Å; K106-S187 WeakPolarHBondContact O-CA 3.21Å; K106-S187 WeakPolarHBondContact O-CB 3.38Å; K106-G188 VanDerWaalsContact CB-O 3.3Å; K106-G188 WeakPolarHBondContact CB-O 3.47Å; K106-G188 PolarHBondContact N-O 3.46Å; K106-G188 PolarHBondContact O-N 2.59Å; K106-I190 HydrophobicContact CB-CG2 4.16Å; K106-I190 HydrophobicContact CD-CG2 4.3Å
107	P	89.4	Confident	79.4	Confident	2 Å²	2	31 Å²	31	1%	0.013	15%	0.15	C	C	.	.	P	Polyproline II helix	trans	-63.7	159.9	168.2	32.6	-40.2	0	0	0	111.3	L78 W80 Y89 L110	L78-P107 HydrophobicContact CD1-CB 4.47Å; W80-P107 HydrophobicContact CH2-CG 4.2Å; Y89-P107 HydrophobicContact CE1-CB 4.4Å; Y89-P107 HydrophobicContact CE1-CG 3.89Å; P107-L110 HydrophobicContact CG-CB 3.95Å; P107-L110 HydrophobicContact CG-CD2 3.84Å
108	P	86.3	Confident	78	Confident	22 Å²	22	31.6 Å²	31.6	14%	0.143	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	162.4	170.8	33.6	-39.3	0	0	0	110.6	L110 P365 Y464	P108-L110 PolarHBondContact O-N 3.46Å; P108-P365 HydrophobicContact CB-CB 4.22Å; P108-P365 HydrophobicContact CG-CB 4.36Å; P108-Y464 HydrophobicContact CB-CE1 4.16Å; P108-Y464 HydrophobicContact CG-CD1 4.15Å; P108-Y464 HydrophobicContact CG-CE1 3.47Å; P108-Y464 VanDerWaalsContact CG-CE1 3.47Å
109	N	83	Confident	76.8	Confident	48 Å²	48	33.3 Å²	33.3	26%	0.257	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	3.7	175.6	-61.1	-24	0	0	0	117	Y77 A184	Y77-N109 HydrophobicContact CD1-CB 4.28Å; Y77-N109 HydrophobicContact CE1-CB 4.3Å; Y77-N109 WeakPolarHBondContact CE1-ND2 3.3Å; N109-A184 VanDerWaalsContact CA-O 3.25Å; N109-A184 WeakPolarHBondContact CA-O 3.38Å; N109-A184 PolarHBondContact N-O 3.42Å
110	L	86.3	Confident	75.7	Confident	4 Å²	4	31.3 Å²	31.3	2%	0.021	16%	0.162	C	C	.	.			trans	-89.8	122.2	170.2	176.5	60.4	0	0	0	110.8	W80 L86 L90 K106 P107 P108 I138 A184	W80-L110 HydrophobicContact CE3-CD1 4.08Å; W80-L110 HydrophobicContact CH2-CD2 4.39Å; W80-L110 HydrophobicContact CZ3-CB 4.26Å; W80-L110 HydrophobicContact CZ3-CD1 3.71Å; W80-L110 HydrophobicContact CZ3-CD2 4.32Å; W80-L110 HydrophobicContact CZ3-CG 4.3Å; L86-L110 HydrophobicContact CD1-CD1 4.15Å; L86-L110 HydrophobicContact CD1-CD2 3.95Å; L86-L110 HydrophobicContact CD2-CD1 4.22Å; L90-L110 HydrophobicContact CD2-CD2 3.9Å; K106-L110 WeakPolarHBondContact CD-O 3.48Å; K106-L110 WeakPolarHBondContact CE-O 3.31Å; K106-L110 HydrophobicContact CG-CB 4.38Å; K106-L110 HydrophobicContact CG-CD2 4.23Å; K106-L110 PolarHBondContact NZ-O 3.26Å; P107-L110 HydrophobicContact CG-CB 3.95Å; P107-L110 HydrophobicContact CG-CD2 3.84Å; P108-L110 PolarHBondContact O-N 3.46Å; L110-I138 HydrophobicContact CD1-CG1 4.49Å; L110-I138 HydrophobicContact CD2-CD1 4.02Å; L110-I138 HydrophobicContact CD2-CG1 3.71Å; L110-I138 HydrophobicContact CG-CD1 4.38Å; L110-I138 HydrophobicContact CG-CG1 3.97Å; L110-A184 WeakPolarHBondContact O-CA 3.44Å
111	S	87	Confident	74.2	Confident	11 Å²	11	34.8 Å²	34.8	8%	0.077	18%	0.178	C	C	.	.			trans	-71.2	140.9	173.4	-175.4	0	0	0	0	111	W113 G114 H115 G137 I138	S111-W113 PolarHBondContact OG-N 3.38Å; S111-G114 PolarHBondContact OG-N 3.36Å; S111-G114 VanDerWaalsContact OG-N 3.15Å; S111-H115 PolarHBondContact OG-O 3.01Å; S111-G137 CarbonylContact O-C 3.47Å; S111-G137 WeakPolarHBondContact O-CA 3.45Å; S111-I138 PolarHBondContact O-N 2.95Å
112	V	88.2	Confident	72.7	Confident	2 Å²	2	35 Å²	35	1%	0.012	18%	0.18	C	C	.	.	S	Bend	trans	-78.7	-30.8	171.1	-179.3	0	0	0	0	111.1	K106 I138 N139 I178 L182 I190	K106-V112 HydrophobicContact CD-CG2 3.79Å; V112-I138 HydrophobicContact CG2-CD1 4.08Å; V112-N139 WeakPolarHBondContact O-CB 3.45Å; V112-N139 PolarHBondContact O-N 3.01Å; V112-I178 HydrophobicContact CG1-CD1 3.77Å; V112-I178 HydrophobicContact CG1-CG1 3.98Å; V112-I178 HydrophobicContact CG1-CG2 3.8Å; V112-L182 WeakPolarHBondContact CG2-O 3.28Å; V112-I190 HydrophobicContact CG2-CG2 4.47Å
113	W	83.3	Confident	71.2	Confident	126 Å²	126	37.5 Å²	37.5	48%	0.477	19%	0.193	S	C	.	.	S	Bend	trans	-112.5	8.8	-171	-64.8	106.6	0	0	0	114.3	S111 H115 I178	S111-W113 PolarHBondContact OG-N 3.38Å; W113-H115 PolarHBondContact O-N 3.04Å; W113-H115 VanDerWaalsContact O-N 3.09Å; W113-I178 HydrophobicContact CD2-CD1 4.08Å; W113-I178 HydrophobicContact CE3-CD1 3.76Å; W113-I178 HydrophobicContact CH2-CB 3.88Å; W113-I178 HydrophobicContact CH2-CD1 3.91Å; W113-I178 HydrophobicContact CH2-CG2 4.04Å; W113-I178 HydrophobicContact CZ2-CB 3.99Å; W113-I178 HydrophobicContact CZ2-CD1 4.21Å; W113-I178 HydrophobicContact CZ2-CG2 3.61Å; W113-I178 HydrophobicContact CZ3-CB 4.48Å; W113-I178 HydrophobicContact CZ3-CD1 3.67Å
114	G	63.9	Low	69.8	Low	3 Å²	3	39.6 Å²	39.6	3%	0.031	21%	0.207	C	C	.	.	S	Bend	trans	83.5	-40	-176	0	0	0	0	0	113.3	S111 D135	S111-G114 PolarHBondContact OG-N 3.36Å; S111-G114 VanDerWaalsContact OG-N 3.15Å; G114-D135 CarbonylContact C-O 3.54Å; G114-D135 VanDerWaalsContact CA-O 3.32Å; G114-D135 WeakPolarHBondContact CA-O 3.43Å
115	H	56.9	Low	68	Low	122 Å²	122	45.4 Å²	45.4	57%	0.565	24%	0.236	S	C	*	.			trans	-99.7	119.5	-179.4	-51.2	-65	0	0	0	112.2	S111 W113 L117	S111-H115 PolarHBondContact OG-O 3.01Å; W113-H115 PolarHBondContact O-N 3.04Å; W113-H115 VanDerWaalsContact O-N 3.09Å; H115-L117 VanDerWaalsContact C-N 3.28Å; H115-L117 HydrophobicContact CB-CD1 4.31Å; H115-L117 HydrophobicContact CB-CD2 3.95Å; H115-L117 HydrophobicContact CB-CG 3.7Å; H115-L117 PolarHBondContact O-N 3.16Å
116	S	49.1	Very low	66.3	Low	13 Å²	13	48.2 Å²	48.2	9%	0.091	25%	0.25	C	S	.	.			trans	-85.5	72.2	167.8	169.8	0	0	0	0	109.4	A118 R120	S116-A118 PolarHBondContact O-N 3.26Å; S116-R120 VanDerWaalsContact OG-CB 3.27Å; S116-R120 WeakPolarHBondContact OG-CB 3.44Å
117	L	46.2	Very low	64.5	Low	128 Å²	128	51.5 Å²	51.5	67%	0.67	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	25	-171.9	-68.5	171.5	0	0	0	116.8	H115 E121	H115-L117 VanDerWaalsContact C-N 3.28Å; H115-L117 HydrophobicContact CB-CD1 4.31Å; H115-L117 HydrophobicContact CB-CD2 3.95Å; H115-L117 HydrophobicContact CB-CG 3.7Å; H115-L117 PolarHBondContact O-N 3.16Å; L117-E121 WeakPolarHBondContact CD2-OE2 3.46Å
118	A	51.1	Low	62.7	Low	42 Å²	42	56 Å²	56	35%	0.347	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147.7	-60.2	174.8	0	0	0	0	0	115.1	S116 A122 L251	S116-A118 PolarHBondContact O-N 3.26Å; A118-A122 WeakPolarHBondContact O-CB 3.37Å; A118-L251 WeakPolarHBondContact O-CD1 3.4Å
119	S	52	Low	61	Low	49 Å²	49	64.2 Å²	64.2	34%	0.343	33%	0.331	S	S	.	.	H	α-helix	trans	-89.5	-51.2	-174	53.8	0	0	0	0	112.1	A122 I123	S119-A122 PolarHBondContact O-N 2.94Å; S119-I123 VanDerWaalsContact O-CB 3.3Å; S119-I123 WeakPolarHBondContact O-CB 3.28Å; S119-I123 WeakPolarHBondContact O-CD1 3.42Å; S119-I123 WeakPolarHBondContact O-CG1 3.43Å; S119-I123 PolarHBondContact O-N 3.15Å
120	R	49.8	Very low	59.4	Low	68 Å²	68	65.5 Å²	65.5	26%	0.257	34%	0.337	S	S	.	.	H	α-helix	trans	-66.6	-42.6	-176.8	-158.8	176	81.3	173	6.9	113	S116 I123 S124 S134 D135	S116-R120 VanDerWaalsContact OG-CB 3.27Å; S116-R120 WeakPolarHBondContact OG-CB 3.44Å; R120-I123 CarbonylContact O-C 3.48Å; R120-I123 PolarHBondContact O-N 2.91Å; R120-S124 WeakPolarHBondContact O-CB 3.36Å; R120-S124 PolarHBondContact O-N 3.15Å; R120-S134 PolarHBondContact NH2-O 2.98Å; R120-D135 IonicContact NH2-OD1 2.65Å
121	E	50.3	Low	57.6	Low	75 Å²	75	67.7 Å²	67.7	35%	0.35	35%	0.352	S	S	.	.	H	α-helix	trans	-69.2	-36.9	174.5	-75.8	172.4	-163.5	0	0	112.6	L117 S124 M125	L117-E121 WeakPolarHBondContact CD2-OE2 3.46Å; E121-S124 WeakPolarHBondContact CA-OG 3.48Å; E121-S124 PolarHBondContact O-N 3.41Å; E121-S124 PolarHBondContact O-OG 3.44Å; E121-M125 WeakPolarHBondContact O-CB 3.45Å; E121-M125 WeakPolarHBondContact O-CG 3.32Å; E121-M125 PolarHBondContact O-N 2.82Å
122	A	54.8	Low	55.8	Low	6 Å²	6	69.9 Å²	69.9	5%	0.05	37%	0.367	C	S	.	.	H	α-helix	trans	-65.4	-42.2	172.5	0	0	0	0	0	111.4	A118 S119 S124 M125 I126 L251	A118-A122 WeakPolarHBondContact O-CB 3.37Å; S119-A122 PolarHBondContact O-N 2.94Å; A122-S124 VanDerWaalsContact C-N 3.31Å; A122-S124 PolarHBondContact O-N 3.46Å; A122-M125 PolarHBondContact O-N 3.08Å; A122-I126 WeakPolarHBondContact O-CB 3.45Å; A122-I126 VanDerWaalsContact O-CD1 3.25Å; A122-I126 WeakPolarHBondContact O-CD1 3.34Å; A122-I126 WeakPolarHBondContact O-CG1 3.49Å; A122-I126 PolarHBondContact O-N 3.08Å; A122-L251 HydrophobicContact CB-CD1 3.77Å; A122-L251 HydrophobicContact CB-CD2 3.43Å; A122-L251 VanDerWaalsContact CB-CD2 3.43Å; A122-L251 HydrophobicContact CB-CG 4.14Å
123	I	53.8	Low	54	Low	53 Å²	53	74.1 Å²	74.1	27%	0.272	40%	0.403	S	S	.	.	H	α-helix	trans	-66.8	-33.9	175.1	-67	164.5	0	0	0	110.3	S119 R120 I126 N127 L130	S119-I123 VanDerWaalsContact O-CB 3.3Å; S119-I123 WeakPolarHBondContact O-CB 3.28Å; S119-I123 WeakPolarHBondContact O-CD1 3.42Å; S119-I123 WeakPolarHBondContact O-CG1 3.43Å; S119-I123 PolarHBondContact O-N 3.15Å; R120-I123 CarbonylContact O-C 3.48Å; R120-I123 PolarHBondContact O-N 2.91Å; I123-I126 PolarHBondContact O-N 3.08Å; I123-N127 CarbonylContact O-C 3.47Å; I123-N127 VanDerWaalsContact O-C 3.26Å; I123-N127 VanDerWaalsContact O-CA 3.31Å; I123-N127 WeakPolarHBondContact O-CA 3.22Å; I123-N127 PolarHBondContact O-N 3.19Å; I123-L130 HydrophobicContact CG2-CB 4.35Å; I123-L130 HydrophobicContact CG2-CD1 4.47Å
124	S	58.2	Low	52.7	Low	43 Å²	43	68.6 Å²	68.6	30%	0.301	38%	0.383	S	S	.	.	H	α-helix	trans	-67.4	-38	174.1	80.5	0	0	0	0	111.8	R120 E121 A122 I126 P128 C131	R120-S124 WeakPolarHBondContact O-CB 3.36Å; R120-S124 PolarHBondContact O-N 3.15Å; E121-S124 WeakPolarHBondContact CA-OG 3.48Å; E121-S124 PolarHBondContact O-N 3.41Å; E121-S124 PolarHBondContact O-OG 3.44Å; A122-S124 VanDerWaalsContact C-N 3.31Å; A122-S124 PolarHBondContact O-N 3.46Å; S124-I126 VanDerWaalsContact C-N 3.34Å; S124-P128 VanDerWaalsContact O-CA 3.32Å; S124-P128 WeakPolarHBondContact O-CA 3.38Å; S124-C131 VanDerWaalsContact CA-SG 3.58Å; S124-C131 WeakPolarHBondContact CB-SG 3.11Å
125	M	55.1	Low	52.9	Low	123 Å²	123	73.9 Å²	73.9	61%	0.606	41%	0.411	S	S	*	.	H	α-helix	trans	-66.5	-34.5	173.4	-75.9	-171.9	161.7	0	0	112.6	E121 A122	E121-M125 WeakPolarHBondContact O-CB 3.45Å; E121-M125 WeakPolarHBondContact O-CG 3.32Å; E121-M125 PolarHBondContact O-N 2.82Å; A122-M125 PolarHBondContact O-N 3.08Å
126	I	56	Low	54.2	Low	73 Å²	73	69.8 Å²	69.8	37%	0.374	39%	0.393	S	S	.	.	H	α-helix	trans	-94.4	-32	-173.5	-63.7	164.6	0	0	0	112.1	A122 I123 S124 L342	A122-I126 WeakPolarHBondContact O-CB 3.45Å; A122-I126 VanDerWaalsContact O-CD1 3.25Å; A122-I126 WeakPolarHBondContact O-CD1 3.34Å; A122-I126 WeakPolarHBondContact O-CG1 3.49Å; A122-I126 PolarHBondContact O-N 3.08Å; I123-I126 PolarHBondContact O-N 3.08Å; S124-I126 VanDerWaalsContact C-N 3.34Å; I126-L342 HydrophobicContact CD1-CB 3.57Å; I126-L342 HydrophobicContact CD1-CD1 3.39Å; I126-L342 HydrophobicContact CD1-CD2 4.34Å; I126-L342 HydrophobicContact CD1-CG 3.91Å; I126-L342 HydrophobicContact CG1-CD1 4.49Å; I126-L342 HydrophobicContact CG2-CB 4.34Å
127	N	53.1	Low	56	Low	68 Å²	68	69.1 Å²	69.1	36%	0.364	39%	0.388	S	S	.	.			trans	-145	81.8	179.2	-163.7	-11.8	0	0	0	110.9	I123 K129 L130	I123-N127 CarbonylContact O-C 3.47Å; I123-N127 VanDerWaalsContact O-C 3.26Å; I123-N127 VanDerWaalsContact O-CA 3.31Å; I123-N127 WeakPolarHBondContact O-CA 3.22Å; I123-N127 PolarHBondContact O-N 3.19Å; N127-K129 PolarHBondContact O-N 3.21Å; N127-L130 HydrophobicContact CB-CD1 4.14Å; N127-L130 VanDerWaalsContact ND2-CD1 3.32Å; N127-L130 WeakPolarHBondContact ND2-CD1 3.43Å; N127-L130 PolarHBondContact O-N 2.74Å
128	P	52.7	Low	58.2	Low	97 Å²	97	63 Å²	63	63%	0.63	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-61.5	-17.6	-175.3	21.5	-32.5	0	0	0	114	S124 L130	S124-P128 VanDerWaalsContact O-CA 3.32Å; S124-P128 WeakPolarHBondContact O-CA 3.38Å; P128-L130 PolarHBondContact O-N 3.47Å
129	K	50.7	Low	60.1	Low	195 Å²	195	64 Å²	64	85%	0.848	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-70	-16.1	-179.7	-63.4	-175.7	179.4	-178.2	0	114.2	N127	N127-K129 PolarHBondContact O-N 3.21Å
130	L	49.5	Very low	62	Low	75 Å²	75	64.6 Å²	64.6	39%	0.393	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-94.3	-5.6	-175	-90.1	147	0	0	0	114.6	I123 N127 P128	I123-L130 HydrophobicContact CG2-CB 4.35Å; I123-L130 HydrophobicContact CG2-CD1 4.47Å; N127-L130 HydrophobicContact CB-CD1 4.14Å; N127-L130 VanDerWaalsContact ND2-CD1 3.32Å; N127-L130 WeakPolarHBondContact ND2-CD1 3.43Å; N127-L130 PolarHBondContact O-N 2.74Å; P128-L130 PolarHBondContact O-N 3.47Å
131	C	48.2	Very low	64	Low	49 Å²	49	61.3 Å²	61.3	33%	0.331	34%	0.343	S	S	.	.			trans	-104	107.7	-173.2	-69.2	0	0	0	0	112	S124	S124-C131 VanDerWaalsContact CA-SG 3.58Å; S124-C131 WeakPolarHBondContact CB-SG 3.11Å
132	S	48.8	Very low	66.1	Low	57 Å²	57	58.5 Å²	58.5	40%	0.399	33%	0.33	S	S	.	.			trans	-83	134.7	162.9	55.6	0	0	0	0	110.7	S134	S132-S134 PolarHBondContact O-N 3.48Å; S132-S134 VanDerWaalsContact O-N 3.13Å
133	A	49.8	Very low	67.9	Low	92 Å²	92	62.2 Å²	62.2	76%	0.76	35%	0.354	S	S	*	.			trans	-85.5	63.2	-164.3	0	0	0	0	0	114.2
134	S	56.6	Low	69.8	Low	10 Å²	10	62.5 Å²	62.5	7%	0.07	35%	0.354	C	S	.	.			trans	-105.7	109	155.4	65.8	0	0	0	0	110.2	S79 W80 R120 S132 L136	S79-S134 VanDerWaalsContact CA-OG 3.31Å; S79-S134 WeakPolarHBondContact CA-OG 3.26Å; S79-S134 WeakPolarHBondContact CB-OG 3.42Å; W80-S134 WeakPolarHBondContact O-CB 3.35Å; R120-S134 PolarHBondContact NH2-O 2.98Å; S132-S134 PolarHBondContact O-N 3.48Å; S132-S134 VanDerWaalsContact O-N 3.13Å; S134-L136 VanDerWaalsContact C-N 3.29Å
135	D	69.2	Low	71.5	Confident	114 Å²	114	60.4 Å²	60.4	61%	0.61	34%	0.339	S	S	*	.			trans	-84.3	-5.1	173.8	-67	-28.9	0	0	0	112.5	G114 R120 G137	G114-D135 CarbonylContact C-O 3.54Å; G114-D135 VanDerWaalsContact CA-O 3.32Å; G114-D135 WeakPolarHBondContact CA-O 3.43Å; R120-D135 IonicContact NH2-OD1 2.65Å; D135-G137 PolarHBondContact O-N 3.38Å
136	L	82.8	Confident	73.2	Confident	35 Å²	35	54.9 Å²	54.9	18%	0.183	31%	0.312	C	S	.	.			trans	-66.4	121.6	177.6	-65.8	-174.1	0	0	0	110.8	W80 P83 L86 S134 D140	W80-L136 HydrophobicContact CB-CD1 4.28Å; W80-L136 WeakPolarHBondContact O-CD1 3.49Å; P83-L136 HydrophobicContact CG-CD1 4.05Å; P83-L136 HydrophobicContact CG-CD2 4.03Å; L86-L136 HydrophobicContact CD2-CB 4.34Å; S134-L136 VanDerWaalsContact C-N 3.29Å; L136-D140 HydrophobicContact CD2-CB 3.83Å
137	G	87.7	Confident	74.9	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	32%	0.319	C	S	.	.			trans	-108	176.3	163.6	0	0	0	0	0	111.8	S111 D135 N139 D140	S111-G137 CarbonylContact O-C 3.47Å; S111-G137 WeakPolarHBondContact O-CA 3.45Å; D135-G137 PolarHBondContact O-N 3.38Å; G137-N139 PolarHBondContact O-N 3.14Å; G137-D140 PolarHBondContact N-OD2 2.85Å; G137-D140 WeakPolarHBondContact O-CB 3.42Å; G137-D140 PolarHBondContact O-N 3.15Å
138	I	91.2	Very high	76.6	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-58	-35.1	179	-58.9	177.8	0	0	0	111.5	L90 K106 L110 S111 V112 D140 C141 L142 I190	L90-I138 HydrophobicContact CD1-CB 4.43Å; L90-I138 HydrophobicContact CD1-CG1 3.97Å; L90-I138 HydrophobicContact CD1-CG2 4.08Å; K106-I138 HydrophobicContact CD-CD1 3.81Å; K106-I138 HydrophobicContact CG-CD1 3.84Å; L110-I138 HydrophobicContact CD1-CG1 4.49Å; L110-I138 HydrophobicContact CD2-CD1 4.02Å; L110-I138 HydrophobicContact CD2-CG1 3.71Å; L110-I138 HydrophobicContact CG-CD1 4.38Å; L110-I138 HydrophobicContact CG-CG1 3.97Å; S111-I138 PolarHBondContact O-N 2.95Å; V112-I138 HydrophobicContact CG2-CD1 4.08Å; I138-D140 PolarHBondContact O-N 2.97Å; I138-C141 PolarHBondContact O-N 2.89Å; I138-C141 PolarHBondContact O-SG 3.4Å; I138-L142 HydrophobicContact CG2-CD2 4.03Å; I138-L142 WeakPolarHBondContact O-CG 3.29Å; I138-L142 PolarHBondContact O-N 3.33Å; I138-I190 HydrophobicContact CD1-CD1 3.38Å; I138-I190 HydrophobicContact CG2-CD1 4.4Å
139	N	91.9	Very high	78.1	Confident	63 Å²	63	48.9 Å²	48.9	34%	0.337	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-54	-36.4	175.9	-175	71.1	0	0	0	112.7	V112 G137 C141 I178	V112-N139 WeakPolarHBondContact O-CB 3.45Å; V112-N139 PolarHBondContact O-N 3.01Å; G137-N139 PolarHBondContact O-N 3.14Å; N139-C141 VanDerWaalsContact C-N 3.33Å; N139-C141 PolarHBondContact O-N 2.93Å; N139-I178 HydrophobicContact CB-CD1 3.9Å
140	D	90.9	Very high	79.6	Confident	60 Å²	60	40.8 Å²	40.8	32%	0.321	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-78.5	-20.7	-173.4	-51.3	-48.3	0	0	0	112.3	L136 G137 I138	L136-D140 HydrophobicContact CD2-CB 3.83Å; G137-D140 PolarHBondContact N-OD2 2.85Å; G137-D140 WeakPolarHBondContact O-CB 3.42Å; G137-D140 PolarHBondContact O-N 3.15Å; I138-D140 PolarHBondContact O-N 2.97Å
141	C	92.6	Very high	81.1	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-104.8	4.7	178.7	76.5	0	0	0	0	114.2	P83 L86 A87 I138 N139 P143 Q144 L145	P83-C141 HydrophobicContact CB-CB 4.13Å; P83-C141 WeakPolarHBondContact O-CB 3.42Å; L86-C141 HydrophobicContact CB-CB 4.26Å; L86-C141 HydrophobicContact CD2-CB 4.06Å; L86-C141 HydrophobicContact CG-CB 4.13Å; A87-C141 HydrophobicContact CB-CB 4.16Å; I138-C141 PolarHBondContact O-N 2.89Å; I138-C141 PolarHBondContact O-SG 3.4Å; N139-C141 VanDerWaalsContact C-N 3.33Å; N139-C141 PolarHBondContact O-N 2.93Å; C141-P143 VanDerWaalsContact C-CD 3.48Å; C141-Q144 PolarHBondContact O-N 3.28Å; C141-L145 VanDerWaalsContact O-CB 3.28Å; C141-L145 WeakPolarHBondContact O-CB 3.02Å; C141-L145 PolarHBondContact O-N 3Å
142	L	94.4	Very high	82.5	Confident	16 Å²	16	39.7 Å²	39.7	8%	0.084	24%	0.24	C	C	.	.	H	α-helix	trans	-56.2	-42	-178.5	-67	179.7	0	0	0	113.6	I138 N146 L176 I178 L192	I138-L142 HydrophobicContact CG2-CD2 4.03Å; I138-L142 WeakPolarHBondContact O-CG 3.29Å; I138-L142 PolarHBondContact O-N 3.33Å; L142-N146 WeakPolarHBondContact O-CB 3.42Å; L142-N146 PolarHBondContact O-N 3.47Å; L142-L176 HydrophobicContact CB-CB 4.29Å; L142-L176 HydrophobicContact CD2-CB 4.02Å; L142-I178 HydrophobicContact CD1-CD1 4.26Å; L142-I178 HydrophobicContact CD1-CG1 4.24Å; L142-L192 HydrophobicContact CD2-CD1 3.96Å; L142-L192 HydrophobicContact CD2-CD2 4.41Å
143	P	93.2	Very high	83.5	Confident	84 Å²	84	39 Å²	39	55%	0.545	23%	0.231	S	C	.	.	H	α-helix	trans	-62.1	-48	177.6	-23.1	34.9	0	0	0	112.5	C141 N146 T147	C141-P143 VanDerWaalsContact C-CD 3.48Å; P143-N146 PolarHBondContact O-N 3.27Å; P143-T147 PolarHBondContact O-N 2.9Å; P143-T147 PolarHBondContact O-OG1 3.03Å
144	Q	94	Very high	84.4	Confident	58 Å²	58	39.7 Å²	39.7	27%	0.271	22%	0.218	S	C	.	.	H	α-helix	trans	-65	-43.4	-179.1	-65.6	79.8	-3.5	0	0	110.9	H84 A87 C141 N146 T147 I148	H84-Q144 HydrophobicContact CB-CG 4.28Å; A87-Q144 HydrophobicContact CB-CB 3.65Å; C141-Q144 PolarHBondContact O-N 3.28Å; Q144-N146 VanDerWaalsContact C-N 3.29Å; Q144-N146 PolarHBondContact O-N 2.82Å; Q144-T147 PolarHBondContact O-N 3.09Å; Q144-I148 WeakPolarHBondContact O-CG1 3.17Å; Q144-I148 PolarHBondContact O-N 3.16Å
145	L	93.1	Very high	84.8	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.2	-40.6	176.7	179.1	61	0	0	0	111.3	A87 L90 I104 C141 I148 I149 L176 L192	A87-L145 HydrophobicContact CB-CB 3.95Å; L90-L145 HydrophobicContact CB-CD1 4.33Å; L90-L145 HydrophobicContact CB-CD2 4.49Å; I104-L145 HydrophobicContact CD1-CD2 3.69Å; C141-L145 VanDerWaalsContact O-CB 3.28Å; C141-L145 WeakPolarHBondContact O-CB 3.02Å; C141-L145 PolarHBondContact O-N 3Å; L145-I148 PolarHBondContact O-N 3.4Å; L145-I149 HydrophobicContact CD1-CD1 4.12Å; L145-I149 HydrophobicContact CD1-CG1 4.36Å; L145-I149 HydrophobicContact CG-CD1 4Å; L145-I149 VanDerWaalsContact O-CG1 3.28Å; L145-I149 WeakPolarHBondContact O-CG1 3.48Å; L145-I149 PolarHBondContact O-N 2.97Å; L145-L176 HydrophobicContact CB-CD1 4.1Å; L145-L176 HydrophobicContact CD2-CD1 3.89Å; L145-L176 HydrophobicContact CG-CD1 3.81Å; L145-L192 HydrophobicContact CD2-CD1 4.17Å
146	N	91.7	Very high	84.2	Confident	7 Å²	7	43.1 Å²	43.1	4%	0.037	23%	0.229	C	C	.	.	H	α-helix	trans	-65.1	-40.8	177	-175.2	76.3	0	0	0	112.7	L142 P143 Q144 I149 T150 I173 P174 L176	L142-N146 WeakPolarHBondContact O-CB 3.42Å; L142-N146 PolarHBondContact O-N 3.47Å; P143-N146 PolarHBondContact O-N 3.27Å; Q144-N146 VanDerWaalsContact C-N 3.29Å; Q144-N146 PolarHBondContact O-N 2.82Å; N146-I149 PolarHBondContact O-N 3.48Å; N146-T150 WeakPolarHBondContact O-CB 3.42Å; N146-T150 PolarHBondContact O-N 2.84Å; N146-T150 PolarHBondContact O-OG1 3.37Å; N146-I173 WeakPolarHBondContact ND2-CG2 3.46Å; N146-P174 PolarHBondContact ND2-O 2.92Å; N146-P174 PolarHBondContact OD1-O 3.15Å; N146-L176 HydrophobicContact CB-CD1 3.85Å; N146-L176 HydrophobicContact CB-CG 3.91Å
147	T	90.8	Very high	82.9	Confident	84 Å²	84	46.6 Å²	46.6	52%	0.515	25%	0.245	S	C	.	.	H	α-helix	trans	-59	-49.4	174.6	-58.2	0	0	0	0	110.5	P143 Q144 I149 T150 S151	P143-T147 PolarHBondContact O-N 2.9Å; P143-T147 PolarHBondContact O-OG1 3.03Å; Q144-T147 PolarHBondContact O-N 3.09Å; T147-I149 PolarHBondContact O-N 2.87Å; T147-T150 PolarHBondContact O-N 3Å; T147-S151 PolarHBondContact O-N 3.05Å; T147-S151 PolarHBondContact O-OG 3.39Å
148	I	88.2	Confident	81.1	Confident	28 Å²	28	52.9 Å²	52.9	14%	0.144	28%	0.278	C	S	.	.	H	α-helix	trans	-57.5	-47.8	177.9	-66.2	168.1	0	0	0	111	A87 Q88 Q144 L145 T150 S151 L152	A87-I148 HydrophobicContact CB-CD1 3.88Å; Q88-I148 HydrophobicContact CG-CD1 3.85Å; Q144-I148 WeakPolarHBondContact O-CG1 3.17Å; Q144-I148 PolarHBondContact O-N 3.16Å; L145-I148 PolarHBondContact O-N 3.4Å; I148-T150 VanDerWaalsContact C-N 3.33Å; I148-T150 PolarHBondContact O-N 3.47Å; I148-S151 PolarHBondContact O-N 2.83Å; I148-L152 HydrophobicContact CG2-CD1 3.92Å; I148-L152 HydrophobicContact CG2-CG 4.42Å; I148-L152 VanDerWaalsContact O-CG 3.26Å; I148-L152 WeakPolarHBondContact O-CG 3.46Å; I148-L152 PolarHBondContact O-N 3.27Å
149	I	84	Confident	79.1	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-61.1	-43.1	179	-69.7	171.6	0	0	0	111.3	I94 L97 V102 L145 N146 T147 L152 E153 L176	I94-I149 HydrophobicContact CD1-CD1 3.75Å; I94-I149 HydrophobicContact CD1-CG1 3.7Å; L97-I149 HydrophobicContact CD1-CG2 3.7Å; L97-I149 HydrophobicContact CD2-CG2 3.95Å; L97-I149 HydrophobicContact CG-CG2 4.5Å; V102-I149 HydrophobicContact CG1-CD1 4.16Å; V102-I149 HydrophobicContact CG2-CD1 3.99Å; L145-I149 HydrophobicContact CD1-CD1 4.12Å; L145-I149 HydrophobicContact CD1-CG1 4.36Å; L145-I149 HydrophobicContact CG-CD1 4Å; L145-I149 VanDerWaalsContact O-CG1 3.28Å; L145-I149 WeakPolarHBondContact O-CG1 3.48Å; L145-I149 PolarHBondContact O-N 2.97Å; N146-I149 PolarHBondContact O-N 3.48Å; T147-I149 PolarHBondContact O-N 2.87Å; I149-L152 PolarHBondContact O-N 2.91Å; I149-E153 WeakPolarHBondContact O-CG 3.35Å; I149-E153 PolarHBondContact O-N 3.17Å; I149-E153 VanDerWaalsContact O-N 3.08Å; I149-L176 HydrophobicContact CD1-CD1 4.24Å
150	T	83.4	Confident	76.9	Confident	24 Å²	24	58.5 Å²	58.5	15%	0.147	32%	0.317	C	S	.	.	H	α-helix	trans	-66.8	-40.9	-179.2	-53.7	0	0	0	0	111.2	N146 T147 I148 E153 Q154	N146-T150 WeakPolarHBondContact O-CB 3.42Å; N146-T150 PolarHBondContact O-N 2.84Å; N146-T150 PolarHBondContact O-OG1 3.37Å; T147-T150 PolarHBondContact O-N 3Å; I148-T150 VanDerWaalsContact C-N 3.33Å; I148-T150 PolarHBondContact O-N 3.47Å; T150-E153 PolarHBondContact O-N 3.06Å; T150-Q154 WeakPolarHBondContact O-CG 3.4Å; T150-Q154 PolarHBondContact O-N 2.93Å; T150-Q154 VanDerWaalsContact O-N 3.08Å
151	S	81.1	Confident	74.5	Confident	49 Å²	49	61.1 Å²	61.1	34%	0.343	33%	0.331	S	S	.	.	H	α-helix	trans	-61.8	-44.3	174	-62.4	0	0	0	0	111.9	T147 I148 E153 Q154 E155	T147-S151 PolarHBondContact O-N 3.05Å; T147-S151 PolarHBondContact O-OG 3.39Å; I148-S151 PolarHBondContact O-N 2.83Å; S151-E153 VanDerWaalsContact C-N 3.27Å; S151-E153 PolarHBondContact O-N 3.19Å; S151-Q154 PolarHBondContact O-N 2.75Å; S151-E155 WeakPolarHBondContact O-CG 3.32Å; S151-E155 PolarHBondContact O-N 3.36Å
152	L	76.2	Confident	71.9	Confident	53 Å²	53	69 Å²	69	28%	0.277	37%	0.374	S	S	.	.	H	α-helix	trans	-61.1	-34.6	176.8	-71.7	169.9	0	0	0	112.8	I148 I149 Q156	I148-L152 HydrophobicContact CG2-CD1 3.92Å; I148-L152 HydrophobicContact CG2-CG 4.42Å; I148-L152 VanDerWaalsContact O-CG 3.26Å; I148-L152 WeakPolarHBondContact O-CG 3.46Å; I148-L152 PolarHBondContact O-N 3.27Å; I149-L152 PolarHBondContact O-N 2.91Å; L152-Q156 WeakPolarHBondContact O-CG 3.46Å
153	E	71	Confident	69.2	Low	42 Å²	42	75 Å²	75	20%	0.196	41%	0.406	C	S	.	.	H	α-helix	trans	-72.3	-37.5	175.6	-72.9	-179.1	149.5	0	0	112.6	L37 L97 I149 T150 S151 Q156 Q157 R194	L37-E153 HydrophobicContact CD1-CG 4.32Å; L97-E153 HydrophobicContact CD2-CG 4.32Å; I149-E153 WeakPolarHBondContact O-CG 3.35Å; I149-E153 PolarHBondContact O-N 3.17Å; I149-E153 VanDerWaalsContact O-N 3.08Å; T150-E153 PolarHBondContact O-N 3.06Å; S151-E153 VanDerWaalsContact C-N 3.27Å; S151-E153 PolarHBondContact O-N 3.19Å; E153-Q156 PolarHBondContact O-N 2.76Å; E153-Q157 PolarHBondContact O-N 2.85Å; E153-Q157 VanDerWaalsContact O-N 3.16Å; E153-R194 IonicContact OE1-CZ 3.45Å; E153-R194 IonicContact OE1-NH1 3.34Å; E153-R194 PolarHBondContact OE1-NH1 2.86Å; E153-R194 IonicContact OE1-NH2 2.68Å; E153-R194 PolarHBondContact OE1-NH2 2.83Å; E153-R194 IonicContact OE2-CZ 2.75Å; E153-R194 IonicContact OE2-NH1 2.65Å; E153-R194 PolarHBondContact OE2-NH1 3.17Å; E153-R194 IonicContact OE2-NH2 2.8Å; E153-R194 PolarHBondContact OE2-NH2 2.97Å
154	Q	69	Low	66.4	Low	107 Å²	107	76.4 Å²	76.4	50%	0.5	42%	0.417	S	S	.	.	H	α-helix	trans	-66.5	-46.2	178.3	-73.7	174.1	-12.8	0	0	111.9	T150 S151 Q156 Q157 D158	T150-Q154 WeakPolarHBondContact O-CG 3.4Å; T150-Q154 PolarHBondContact O-N 2.93Å; T150-Q154 VanDerWaalsContact O-N 3.08Å; S151-Q154 PolarHBondContact O-N 2.75Å; Q154-Q156 PolarHBondContact O-N 2.81Å; Q154-Q156 VanDerWaalsContact O-N 3.11Å; Q154-Q157 PolarHBondContact O-N 3.14Å; Q154-D158 PolarHBondContact O-N 3.28Å
155	E	64.3	Low	63.7	Low	126 Å²	126	78.3 Å²	78.3	59%	0.589	44%	0.437	S	S	*	.	H	α-helix	trans	-57	-29.9	176.7	-71.3	175.5	-174.8	0	0	112.7	S151 T159	S151-E155 WeakPolarHBondContact O-CG 3.32Å; S151-E155 PolarHBondContact O-N 3.36Å; E155-T159 PolarHBondContact O-N 2.92Å; E155-T159 PolarHBondContact O-OG1 3.23Å; E155-T159 VanDerWaalsContact O-OG1 3.12Å
156	Q	57.4	Low	60.9	Low	70 Å²	70	86.2 Å²	86.2	33%	0.327	48%	0.48	S	S	.	.	H	α-helix	trans	-83.4	-28.2	178.1	-70.5	173.6	-11.9	0	0	113.5	L37 L152 E153 Q154 T159	L37-Q156 HydrophobicContact CD2-CB 4.48Å; L37-Q156 HydrophobicContact CD2-CG 4.49Å; L37-Q156 VanDerWaalsContact CG-OE1 3.3Å; L152-Q156 WeakPolarHBondContact O-CG 3.46Å; E153-Q156 PolarHBondContact O-N 2.76Å; Q154-Q156 PolarHBondContact O-N 2.81Å; Q154-Q156 VanDerWaalsContact O-N 3.11Å; Q156-T159 WeakPolarHBondContact CA-OG1 3.35Å; Q156-T159 PolarHBondContact O-OG1 3.08Å; Q156-T159 VanDerWaalsContact O-OG1 3.07Å
157	Q	53.9	Low	58.4	Low	108 Å²	108	91.6 Å²	91.6	51%	0.505	51%	0.508	S	S	.	.	H	α-helix	trans	-71.3	-42.7	172.2	-73.5	-176.5	-6.2	0	0	111.2	E153 Q154 T159 S160 N161	E153-Q157 PolarHBondContact O-N 2.85Å; E153-Q157 VanDerWaalsContact O-N 3.16Å; Q154-Q157 PolarHBondContact O-N 3.14Å; Q157-T159 VanDerWaalsContact C-N 3.26Å; Q157-T159 PolarHBondContact O-N 2.9Å; Q157-S160 PolarHBondContact O-N 3.39Å; Q157-S160 PolarHBondContact O-OG 2.8Å; Q157-N161 PolarHBondContact O-N 3.11Å
158	D	49.9	Very low	55.6	Low	132 Å²	132	93.2 Å²	93.2	71%	0.706	52%	0.522	S	S	*	.	H	α-helix	trans	-64.6	-29.7	-179.7	-68.6	-20.7	0	0	0	112.5	Q154 S160	Q154-D158 PolarHBondContact O-N 3.28Å; D158-S160 VanDerWaalsContact C-N 3.29Å; D158-S160 PolarHBondContact O-N 3.09Å
159	T	49.6	Very low	53.3	Low	122 Å²	122	101.1 Å²	101.1	75%	0.748	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-11.5	173.5	46	0	0	0	0	114	E155 Q156 Q157	E155-T159 PolarHBondContact O-N 2.92Å; E155-T159 PolarHBondContact O-OG1 3.23Å; E155-T159 VanDerWaalsContact O-OG1 3.12Å; Q156-T159 WeakPolarHBondContact CA-OG1 3.35Å; Q156-T159 PolarHBondContact O-OG1 3.08Å; Q156-T159 VanDerWaalsContact O-OG1 3.07Å; Q157-T159 VanDerWaalsContact C-N 3.26Å; Q157-T159 PolarHBondContact O-N 2.9Å
160	S	47.2	Very low	51	Low	58 Å²	58	106.9 Å²	106.9	41%	0.406	59%	0.591	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105.2	-19	-176.7	73.1	0	0	0	0	115.2	Q157 D158	Q157-S160 PolarHBondContact O-N 3.39Å; Q157-S160 PolarHBondContact O-OG 2.8Å; D158-S160 VanDerWaalsContact C-N 3.29Å; D158-S160 PolarHBondContact O-N 3.09Å
161	N	39	Very low	49.3	Very low	116 Å²	116	111 Å²	111	62%	0.62	62%	0.616	S	S	*	*			trans	-120.7	85.4	-175.1	-78.9	-14.9	0	0	0	112.6	Q157 D163	Q157-N161 PolarHBondContact O-N 3.11Å; N161-D163 PolarHBondContact O-N 3.46Å
162	N	38.5	Very low	47.8	Very low	166 Å²	166	117.1 Å²	117.1	89%	0.888	64%	0.639	S	S	*	*			trans	-78.6	81.7	138	-91.3	-8.9	0	0	0	106.3
163	D	38.3	Very low	46.8	Very low	141 Å²	141	120.6 Å²	120.6	75%	0.754	66%	0.656	S	S	*	*	S	Bend	trans	-178.7	129.1	146.5	-91.6	-22.4	0	0	0	110.5	N161	N161-D163 PolarHBondContact O-N 3.46Å
164	S	34.4	Very low	46.6	Very low	113 Å²	113	119.8 Å²	119.8	79%	0.79	66%	0.655	S	S	*	*			trans	-46.2	128.1	-178.6	52.5	0	0	0	0	115.3
165	S	37.7	Very low	47.3	Very low	99 Å²	99	121.2 Å²	121.2	69%	0.692	66%	0.659	S	S	*	*				-170.3	123.7	123.7	46.4	0	0	0	0	111	L167	S165-L167 PolarHBondContact O-N 3.46Å
166	N	33.8	Very low	48.6	Very low	166 Å²	166	115.9 Å²	115.9	89%	0.888	64%	0.635	S	S	*	*			trans	-56	92.9	173.3	-70.3	-30.5	0	0	0	111.1
167	L	39.1	Very low	50.3	Low	119 Å²	119	115.8 Å²	115.8	62%	0.623	63%	0.632	S	S	*	*			trans	-96.6	80.5	153.9	-88.3	105.8	0	0	0	108.4	S165 R169	S165-L167 PolarHBondContact O-N 3.46Å; L167-R169 HydrophobicContact CD2-CG 4.26Å; L167-R169 PolarHBondContact O-N 3.42Å
168	S	32.5	Very low	52.3	Low	118 Å²	118	110.9 Å²	110.9	83%	0.825	61%	0.609	S	S	*	*			trans	-67.4	59.2	155	51.1	0	0	0	0	109.7	S170	S168-S170 PolarHBondContact O-N 2.94Å
169	R	38.3	Very low	54.3	Low	194 Å²	194	105.4 Å²	105.4	73%	0.732	58%	0.579	S	S	*	*			trans	-69.2	131.3	158.6	-91.1	-179.6	176.5	168.5	1.4	105.9	L167 V171	L167-R169 HydrophobicContact CD2-CG 4.26Å; L167-R169 PolarHBondContact O-N 3.42Å; R169-V171 WeakPolarHBondContact O-CG2 3.32Å; R169-V171 PolarHBondContact O-N 3.25Å
170	S	35.7	Very low	56.4	Low	121 Å²	121	100.6 Å²	100.6	85%	0.846	55%	0.548	S	S	*	.			trans	-54.3	92.3	157.4	44.5	0	0	0	0	107.1	S168 E172	S168-S170 PolarHBondContact O-N 2.94Å; S170-E172 VanDerWaalsContact C-N 3.27Å; S170-E172 PolarHBondContact O-N 2.99Å
171	V	48.4	Very low	58.6	Low	111 Å²	111	99.8 Å²	99.8	67%	0.673	54%	0.543	S	S	*	.			trans	-71	97.3	173.7	-177.2	0	0	0	0	103.9	R169 I173	R169-V171 WeakPolarHBondContact O-CG2 3.32Å; R169-V171 PolarHBondContact O-N 3.25Å; V171-I173 PolarHBondContact O-N 2.98Å
172	E	49.8	Very low	61.1	Low	178 Å²	178	94.6 Å²	94.6	83%	0.832	52%	0.515	S	S	*	.			trans	-47.5	111.7	166.7	-172.8	178.6	-172.8	0	0	106.3	S170 P174	S170-E172 VanDerWaalsContact C-N 3.27Å; S170-E172 PolarHBondContact O-N 2.99Å; E172-P174 VanDerWaalsContact O-CD 3.23Å; E172-P174 WeakPolarHBondContact O-CD 3.02Å
173	I	54.2	Low	63.5	Low	126 Å²	126	88.9 Å²	88.9	65%	0.646	49%	0.487	S	S	*	.			trans	-57.5	115.4	-177.9	-62.4	170	0	0	0	105	N146 V171 K175	N146-I173 WeakPolarHBondContact ND2-CG2 3.46Å; V171-I173 PolarHBondContact O-N 2.98Å; I173-K175 PolarHBondContact O-N 3.29Å
174	P	67.2	Low	65.8	Low	24 Å²	24	83.1 Å²	83.1	16%	0.156	46%	0.459	C	S	.	.			trans	-54.8	140.1	-177.3	17.2	-26.7	0	0	0	108.1	N146 E172 R194	N146-P174 PolarHBondContact ND2-O 2.92Å; N146-P174 PolarHBondContact OD1-O 3.15Å; E172-P174 VanDerWaalsContact O-CD 3.23Å; E172-P174 WeakPolarHBondContact O-CD 3.02Å; P174-R194 HydrophobicContact CB-CB 4.29Å; P174-R194 WeakPolarHBondContact CB-O 3.36Å
175	K	84	Confident	68.2	Low	138 Å²	138	78.7 Å²	78.7	60%	0.6	43%	0.429	S	S	*	.			trans	-104.1	136.5	173.1	-76.5	-178.2	-179.7	177.3	0	107.8	I173 Y177 R194	I173-K175 PolarHBondContact O-N 3.29Å; K175-Y177 HydrophobicContact CB-CD2 4.39Å; K175-Y177 HydrophobicContact CB-CE2 3.55Å; K175-Y177 WeakPolarHBondContact O-CD2 3.43Å; K175-Y177 WeakPolarHBondContact O-CE2 3.41Å; K175-R194 PolarHBondContact N-O 3.08Å; K175-R194 CarbonylContact O-C 3.5Å; K175-R194 VanDerWaalsContact O-CA 3.3Å; K175-R194 WeakPolarHBondContact O-CA 3.25Å
176	L	92.4	Very high	70.8	Confident	14 Å²	14	74.2 Å²	74.2	7%	0.073	40%	0.397	C	S	.	.			trans	-83.5	134.1	172.8	-68.1	175.6	0	0	0	110.3	V102 L142 L145 N146 I149 L192 G193 R194	V102-L176 HydrophobicContact CG2-CD2 3.78Å; L142-L176 HydrophobicContact CB-CB 4.29Å; L142-L176 HydrophobicContact CD2-CB 4.02Å; L145-L176 HydrophobicContact CB-CD1 4.1Å; L145-L176 HydrophobicContact CD2-CD1 3.89Å; L145-L176 HydrophobicContact CG-CD1 3.81Å; N146-L176 HydrophobicContact CB-CD1 3.85Å; N146-L176 HydrophobicContact CB-CG 3.91Å; I149-L176 HydrophobicContact CD1-CD1 4.24Å; L176-L192 HydrophobicContact CD1-CD1 4.36Å; L176-L192 HydrophobicContact CD2-CB 4.32Å; L176-G193 CarbonylContact C-O 3.54Å; L176-G193 VanDerWaalsContact CA-O 3.29Å; L176-G193 WeakPolarHBondContact CA-O 3.31Å; L176-R194 HydrophobicContact CD2-CG 3.81Å
177	Y	93.5	Very high	73.6	Confident	67 Å²	67	66.3 Å²	66.3	26%	0.263	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	132	178.5	-58	-89.1	0	0	0	110.3	K175 I179 L192 G193 T199	K175-Y177 HydrophobicContact CB-CD2 4.39Å; K175-Y177 HydrophobicContact CB-CE2 3.55Å; K175-Y177 WeakPolarHBondContact O-CD2 3.43Å; K175-Y177 WeakPolarHBondContact O-CE2 3.41Å; Y177-I179 PolarHBondContact O-N 2.9Å; Y177-L192 CarbonylContact O-C 3.55Å; Y177-L192 VanDerWaalsContact O-CA 3.23Å; Y177-L192 WeakPolarHBondContact O-CA 3.42Å; Y177-G193 PolarHBondContact N-O 3.4Å; Y177-G193 PolarHBondContact O-N 3.04Å; Y177-T199 HydrophobicContact CG-CG2 4.03Å
178	I	94	Very high	76.3	Confident	6 Å²	6	60.6 Å²	60.6	3%	0.031	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	121.6	173.5	-62.9	154.7	0	0	0	109.4	V112 W113 N139 L142 L192 R203	V112-I178 HydrophobicContact CG1-CD1 3.77Å; V112-I178 HydrophobicContact CG1-CG1 3.98Å; V112-I178 HydrophobicContact CG1-CG2 3.8Å; W113-I178 HydrophobicContact CD2-CD1 4.08Å; W113-I178 HydrophobicContact CE3-CD1 3.76Å; W113-I178 HydrophobicContact CH2-CB 3.88Å; W113-I178 HydrophobicContact CH2-CD1 3.91Å; W113-I178 HydrophobicContact CH2-CG2 4.04Å; W113-I178 HydrophobicContact CZ2-CB 3.99Å; W113-I178 HydrophobicContact CZ2-CD1 4.21Å; W113-I178 HydrophobicContact CZ2-CG2 3.61Å; W113-I178 HydrophobicContact CZ3-CB 4.48Å; W113-I178 HydrophobicContact CZ3-CD1 3.67Å; N139-I178 HydrophobicContact CB-CD1 3.9Å; L142-I178 HydrophobicContact CD1-CD1 4.26Å; L142-I178 HydrophobicContact CD1-CG1 4.24Å; I178-L192 HydrophobicContact CB-CD2 4.36Å; I178-L192 HydrophobicContact CG1-CD2 3.86Å; I178-R203 PolarHBondContact O-NE 3.45Å; I178-R203 PolarHBondContact O-NH2 3.03Å
179	I	93.9	Very high	79.3	Confident	16 Å²	16	55 Å²	55	8%	0.082	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	-60.5	177.1	-65.3	168.1	0	0	0	110.2	Y177 L191 G193 Y198 T199 A202 R203 Y206	Y177-I179 PolarHBondContact O-N 2.9Å; I179-L191 HydrophobicContact CB-CB 4.4Å; I179-L191 HydrophobicContact CB-CD2 4.09Å; I179-L191 HydrophobicContact CB-CG 4.13Å; I179-L191 WeakPolarHBondContact CB-O 2.81Å; I179-L191 HydrophobicContact CD1-CD2 3.98Å; I179-L191 HydrophobicContact CD1-CG 3.99Å; I179-L191 HydrophobicContact CG2-CD2 3.83Å; I179-L191 HydrophobicContact CG2-CG 4.42Å; I179-L191 PolarHBondContact N-O 3.19Å; I179-G193 VanDerWaalsContact CD1-CA 3.43Å; I179-G193 VanDerWaalsContact CD1-N 3.29Å; I179-Y198 HydrophobicContact CD1-CD1 3.72Å; I179-Y198 HydrophobicContact CD1-CE1 3.53Å; I179-T199 HydrophobicContact CG1-CG2 3.96Å; I179-A202 HydrophobicContact CD1-CB 3.85Å; I179-A202 HydrophobicContact CG1-CB 4.36Å; I179-A202 HydrophobicContact CG2-CB 3.5Å; I179-A202 VanDerWaalsContact CG2-CB 3.5Å; I179-R203 HydrophobicContact CG2-CG 4.3Å; I179-Y206 HydrophobicContact CG2-CD2 3.76Å; I179-Y206 HydrophobicContact CG2-CE2 3.64Å
180	E	93.5	Very high	82.1	Confident	21 Å²	21	45.8 Å²	45.8	10%	0.098	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	99.8	-176.7	-178.7	64.4	-172.7	0	0	108.8	L191 Y206 Y219 R370 L373	E180-L191 HydrophobicContact CB-CB 4.1Å; E180-L191 PolarHBondContact N-O 3.01Å; E180-L191 PolarHBondContact O-N 3.36Å; E180-Y206 HydrophobicContact CB-CD2 4.02Å; E180-Y206 HydrophobicContact CB-CE1 4.26Å; E180-Y206 HydrophobicContact CB-CE2 3.71Å; E180-Y206 HydrophobicContact CB-CG 4.44Å; E180-Y206 HydrophobicContact CG-CD1 4.25Å; E180-Y206 HydrophobicContact CG-CE1 4Å; E180-Y206 HydrophobicContact CG-CE2 4.34Å; E180-Y206 HydrophobicContact CG-CG 4.49Å; E180-Y219 HydrophobicContact CG-CE2 4.42Å; E180-Y219 WeakPolarHBondContact OE1-CE2 3.41Å; E180-Y219 PolarHBondContact OE1-OH 2.76Å; E180-R370 PolarHBondContact O-NH2 3.25Å; E180-R370 IonicContact OE1-NH1 3.01Å; E180-R370 PolarHBondContact OE1-NH1 3.12Å; E180-L373 HydrophobicContact CG-CD1 4.2Å; E180-L373 HydrophobicContact CG-CD2 4.46Å
181	S	91.8	Very high	85	Confident	42 Å²	42	40 Å²	40	29%	0.294	21%	0.211	S	C	.	.			trans	-78.8	175.5	179.9	61.5	0	0	0	0	112.1	R370	S181-R370 PolarHBondContact O-NH1 3.29Å; S181-R370 PolarHBondContact O-NH2 3.36Å
182	L	91.6	Very high	87.2	Confident	6 Å²	6	34.8 Å²	34.8	3%	0.031	18%	0.179	C	C	.	.			trans	-135.4	144	174	-167.2	73.6	0	0	0	108.2	V112 Y186 S187 I190 L299 R370	V112-L182 WeakPolarHBondContact CG2-O 3.28Å; L182-Y186 HydrophobicContact CD1-CD2 4Å; L182-Y186 HydrophobicContact CG-CD2 4.2Å; L182-Y186 HydrophobicContact CG-CG 4.49Å; L182-S187 VanDerWaalsContact CD2-O 3.26Å; L182-S187 WeakPolarHBondContact CD2-O 3.43Å; L182-I190 HydrophobicContact CB-CG2 3.79Å; L182-L299 HydrophobicContact CD1-CD1 3.44Å; L182-L299 VanDerWaalsContact CD1-CD1 3.44Å; L182-R370 HydrophobicContact CD1-CB 4.06Å; L182-R370 HydrophobicContact CD2-CB 4.49Å
183	P	88.9	Confident	89.2	Confident	47 Å²	47	26.3 Å²	26.3	31%	0.305	14%	0.139	S	C	.	.			trans	-50.5	144.7	169.3	-29.5	38.1	0	0	0	111.7	A185 Y186 L299	P183-A185 VanDerWaalsContact C-N 3.25Å; P183-A185 PolarHBondContact O-N 3.11Å; P183-Y186 HydrophobicContact CB-CD1 4.33Å; P183-Y186 HydrophobicContact CB-CD2 4Å; P183-Y186 HydrophobicContact CB-CE1 4.28Å; P183-Y186 HydrophobicContact CB-CE2 3.98Å; P183-Y186 HydrophobicContact CB-CG 4.15Å; P183-Y186 HydrophobicContact CG-CD2 3.81Å; P183-Y186 HydrophobicContact CG-CE2 3.53Å; P183-Y186 HydrophobicContact CG-CG 4.46Å; P183-Y186 PolarHBondContact O-N 3.49Å; P183-Y186 VanDerWaalsContact O-N 3.12Å; P183-L299 HydrophobicContact CG-CB 4.2Å; P183-L299 HydrophobicContact CG-CD1 4.27Å
184	A	86.3	Confident	90.7	Very high	19 Å²	19	20.8 Å²	20.8	16%	0.157	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-43	-174.9	0	0	0	0	0	112	K106 N109 L110 Y186	K106-A184 PolarHBondContact NZ-O 3.33Å; N109-A184 VanDerWaalsContact CA-O 3.25Å; N109-A184 WeakPolarHBondContact CA-O 3.38Å; N109-A184 PolarHBondContact N-O 3.42Å; L110-A184 WeakPolarHBondContact O-CA 3.44Å; A184-Y186 VanDerWaalsContact C-N 3.26Å; A184-Y186 PolarHBondContact O-N 3.49Å
185	A	86.2	Confident	91.6	Very high	20 Å²	20	21.5 Å²	21.5	17%	0.165	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-27.2	-178	0	0	0	0	0	114.2	P183 V366	P183-A185 VanDerWaalsContact C-N 3.25Å; P183-A185 PolarHBondContact O-N 3.11Å; A185-V366 HydrophobicContact CB-CB 4.13Å; A185-V366 HydrophobicContact CB-CG2 3.9Å
186	Y	91.9	Very high	91.9	Very high	5 Å²	5	20.7 Å²	20.7	2%	0.02	11%	0.111	C	C	.	.			trans	-87.9	154	-174.9	-53.8	-7.5	0	0	0	110.6	K106 L182 P183 A184 L299 E305 V366 I368	K106-Y186 WeakPolarHBondContact CE-O 3.48Å; K106-Y186 PolarHBondContact NZ-O 3.06Å; L182-Y186 HydrophobicContact CD1-CD2 4Å; L182-Y186 HydrophobicContact CG-CD2 4.2Å; L182-Y186 HydrophobicContact CG-CG 4.49Å; P183-Y186 HydrophobicContact CB-CD1 4.33Å; P183-Y186 HydrophobicContact CB-CD2 4Å; P183-Y186 HydrophobicContact CB-CE1 4.28Å; P183-Y186 HydrophobicContact CB-CE2 3.98Å; P183-Y186 HydrophobicContact CB-CG 4.15Å; P183-Y186 HydrophobicContact CG-CD2 3.81Å; P183-Y186 HydrophobicContact CG-CE2 3.53Å; P183-Y186 HydrophobicContact CG-CG 4.46Å; P183-Y186 PolarHBondContact O-N 3.49Å; P183-Y186 VanDerWaalsContact O-N 3.12Å; A184-Y186 VanDerWaalsContact C-N 3.26Å; A184-Y186 PolarHBondContact O-N 3.49Å; Y186-L299 HydrophobicContact CD2-CD1 4.22Å; Y186-L299 HydrophobicContact CE2-CB 4.47Å; Y186-L299 HydrophobicContact CE2-CD1 4.16Å; Y186-L299 HydrophobicContact CE2-CD2 4.25Å; Y186-E305 WeakPolarHBondContact CE1-OE1 3.44Å; Y186-E305 PolarHBondContact OH-OE1 2.84Å; Y186-E305 PolarHBondContact OH-OE2 3.45Å; Y186-V366 HydrophobicContact CD1-CG1 4.15Å; Y186-V366 HydrophobicContact CE1-CG1 4.27Å; Y186-I368 HydrophobicContact CD1-CB 3.85Å; Y186-I368 HydrophobicContact CD1-CD1 3.97Å; Y186-I368 HydrophobicContact CD1-CG1 4.45Å; Y186-I368 HydrophobicContact CD1-CG2 4.07Å; Y186-I368 HydrophobicContact CD2-CB 4.43Å; Y186-I368 HydrophobicContact CD2-CG2 3.74Å; Y186-I368 HydrophobicContact CE1-CB 4.32Å; Y186-I368 HydrophobicContact CE1-CD1 3.54Å; Y186-I368 HydrophobicContact CE1-CG1 4.48Å; Y186-I368 HydrophobicContact CE1-CG2 4.47Å; Y186-I368 HydrophobicContact CE2-CD1 4.45Å; Y186-I368 HydrophobicContact CE2-CG2 4.14Å; Y186-I368 HydrophobicContact CG-CB 3.96Å; Y186-I368 HydrophobicContact CG-CG2 3.73Å
187	S	93.3	Very high	91.7	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	167.3	168.6	61.7	0	0	0	0	111.1	K106 L182 I368 H369 R370 Y464	K106-S187 CarbonylContact O-C 3.58Å; K106-S187 VanDerWaalsContact O-CA 3.23Å; K106-S187 WeakPolarHBondContact O-CA 3.21Å; K106-S187 WeakPolarHBondContact O-CB 3.38Å; L182-S187 VanDerWaalsContact CD2-O 3.26Å; L182-S187 WeakPolarHBondContact CD2-O 3.43Å; S187-I368 PolarHBondContact N-O 3.19Å; S187-I368 PolarHBondContact OG-O 2.77Å; S187-H369 CarbonylContact O-C 3.33Å; S187-H369 VanDerWaalsContact O-CA 3.32Å; S187-H369 WeakPolarHBondContact O-CA 3.3Å; S187-H369 PolarHBondContact OG-ND1 2.91Å; S187-R370 PolarHBondContact O-N 3.37Å; S187-Y464 PolarHBondContact OG-OH 3.41Å; S187-Y464 VanDerWaalsContact OG-OH 3.05Å
188	G	95.4	Very high	91.4	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	116.4	-171.8	173.2	0	0	0	0	0	114.6	D105 K106 H369 R370	D105-G188 WeakPolarHBondContact OD1-CA 3.37Å; D105-G188 PolarHBondContact OD1-N 2.86Å; K106-G188 VanDerWaalsContact CB-O 3.3Å; K106-G188 WeakPolarHBondContact CB-O 3.47Å; K106-G188 PolarHBondContact N-O 3.46Å; K106-G188 PolarHBondContact O-N 2.59Å; G188-H369 WeakPolarHBondContact CA-CE1 3.3Å; G188-R370 WeakPolarHBondContact CA-O 3.41Å
189	L	96.1	Very high	91.4	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	139.7	-167.7	-57.7	177.1	0	0	0	112	V95 V103 I104 R370 L373 C456	V95-L189 HydrophobicContact CB-CD2 4.24Å; V95-L189 HydrophobicContact CG1-CD2 4.15Å; V95-L189 HydrophobicContact CG2-CD2 3.85Å; V103-L189 HydrophobicContact CG1-CB 4.1Å; V103-L189 HydrophobicContact CG1-CD2 3.87Å; V103-L189 HydrophobicContact CG1-CG 4.44Å; I104-L189 CarbonylContact O-C 3.15Å; I104-L189 VanDerWaalsContact O-CA 3.3Å; I104-L189 WeakPolarHBondContact O-CA 3.38Å; L189-R370 WeakPolarHBondContact CG-O 3.23Å; L189-R370 PolarHBondContact N-O 3.15Å; L189-R370 PolarHBondContact O-NE 3.47Å; L189-R370 PolarHBondContact O-NH2 3.05Å; L189-L373 HydrophobicContact CB-CB 4.47Å; L189-L373 HydrophobicContact CD1-CB 4.08Å; L189-C456 HydrophobicContact CD1-CB 4.18Å; L189-C456 WeakPolarHBondContact CD1-O 3.04Å
190	I	95.8	Very high	91.3	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.005	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	155.8	163.5	59.3	165.8	0	0	0	109.6	V103 I104 K106 V112 I138 L182 L192	V103-I190 VanDerWaalsContact CA-O 3.31Å; V103-I190 WeakPolarHBondContact CA-O 3.39Å; V103-I190 WeakPolarHBondContact CG1-O 3.38Å; I104-I190 HydrophobicContact CB-CD1 4.25Å; I104-I190 HydrophobicContact CB-CG1 3.86Å; I104-I190 PolarHBondContact N-O 3.46Å; I104-I190 VanDerWaalsContact N-O 3.14Å; I104-I190 WeakPolarHBondContact O-CG1 3.41Å; I104-I190 PolarHBondContact O-N 3.42Å; K106-I190 HydrophobicContact CB-CG2 4.16Å; K106-I190 HydrophobicContact CD-CG2 4.3Å; V112-I190 HydrophobicContact CG2-CG2 4.47Å; I138-I190 HydrophobicContact CD1-CD1 3.38Å; I138-I190 HydrophobicContact CG2-CD1 4.4Å; L182-I190 HydrophobicContact CB-CG2 3.79Å; I190-L192 HydrophobicContact CD1-CD2 4.43Å
191	L	96.1	Very high	91.2	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	124.7	179.2	-176.9	67.6	0	0	0	111.5	F101 V103 I179 E180 Y198 Y206 L373 L375	F101-L191 HydrophobicContact CB-CD1 3.8Å; F101-L191 HydrophobicContact CD2-CD1 3.84Å; F101-L191 HydrophobicContact CG-CD1 4Å; V103-L191 HydrophobicContact CG2-CD1 3.86Å; I179-L191 HydrophobicContact CB-CB 4.4Å; I179-L191 HydrophobicContact CB-CD2 4.09Å; I179-L191 HydrophobicContact CB-CG 4.13Å; I179-L191 WeakPolarHBondContact CB-O 2.81Å; I179-L191 HydrophobicContact CD1-CD2 3.98Å; I179-L191 HydrophobicContact CD1-CG 3.99Å; I179-L191 HydrophobicContact CG2-CD2 3.83Å; I179-L191 HydrophobicContact CG2-CG 4.42Å; I179-L191 PolarHBondContact N-O 3.19Å; E180-L191 HydrophobicContact CB-CB 4.1Å; E180-L191 PolarHBondContact N-O 3.01Å; E180-L191 PolarHBondContact O-N 3.36Å; L191-Y198 HydrophobicContact CD2-CE1 4.37Å; L191-Y206 HydrophobicContact CD2-CE2 3.81Å; L191-Y206 WeakPolarHBondContact CD2-OH 3.49Å; L191-L373 HydrophobicContact CB-CD2 4.18Å; L191-L375 HydrophobicContact CD1-CD2 3.93Å; L191-L375 HydrophobicContact CD2-CD2 4Å; L191-L375 HydrophobicContact CG-CD2 4.42Å
192	L	94.9	Very high	91.2	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	138.3	170.1	-52.4	-178.1	0	0	0	110	F101 V102 I104 L142 L145 L176 Y177 I178 I190	F101-L192 CarbonylContact C-O 3.21Å; F101-L192 WeakPolarHBondContact CA-O 3.22Å; F101-L192 VanDerWaalsContact CB-O 3.27Å; F101-L192 WeakPolarHBondContact CB-O 3.32Å; V102-L192 HydrophobicContact CB-CB 4.35Å; V102-L192 PolarHBondContact N-O 2.93Å; V102-L192 PolarHBondContact O-N 3.48Å; I104-L192 HydrophobicContact CD1-CD1 3.59Å; I104-L192 HydrophobicContact CD1-CG 4.42Å; L142-L192 HydrophobicContact CD2-CD1 3.96Å; L142-L192 HydrophobicContact CD2-CD2 4.41Å; L145-L192 HydrophobicContact CD2-CD1 4.17Å; L176-L192 HydrophobicContact CD1-CD1 4.36Å; L176-L192 HydrophobicContact CD2-CB 4.32Å; Y177-L192 CarbonylContact O-C 3.55Å; Y177-L192 VanDerWaalsContact O-CA 3.23Å; Y177-L192 WeakPolarHBondContact O-CA 3.42Å; I178-L192 HydrophobicContact CB-CD2 4.36Å; I178-L192 HydrophobicContact CG1-CD2 3.86Å; I190-L192 HydrophobicContact CD1-CD2 4.43Å
193	G	92.1	Very high	91.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	144	172	0	0	0	0	0	111	L176 Y177 I179 T199	L176-G193 CarbonylContact C-O 3.54Å; L176-G193 VanDerWaalsContact CA-O 3.29Å; L176-G193 WeakPolarHBondContact CA-O 3.31Å; Y177-G193 PolarHBondContact N-O 3.4Å; Y177-G193 PolarHBondContact O-N 3.04Å; I179-G193 VanDerWaalsContact CD1-CA 3.43Å; I179-G193 VanDerWaalsContact CD1-N 3.29Å; G193-T199 WeakPolarHBondContact CA-OG1 3.37Å
194	R	85.9	Confident	91.4	Very high	10 Å²	10	32.8 Å²	32.8	4%	0.038	16%	0.16	C	C	.	.	S	Bend	trans	-100.2	-9.6	179	-62.5	-174	73.7	-165.7	0.2	114.1	T98 H100 V102 E153 P174 K175 L176	T98-R194 WeakPolarHBondContact O-CD 3.42Å; T98-R194 PolarHBondContact O-NH1 3.42Å; H100-R194 PolarHBondContact O-N 2.93Å; V102-R194 HydrophobicContact CG2-CG 3.7Å; E153-R194 IonicContact OE1-CZ 3.45Å; E153-R194 IonicContact OE1-NH1 3.34Å; E153-R194 PolarHBondContact OE1-NH1 2.86Å; E153-R194 IonicContact OE1-NH2 2.68Å; E153-R194 PolarHBondContact OE1-NH2 2.83Å; E153-R194 IonicContact OE2-CZ 2.75Å; E153-R194 IonicContact OE2-NH1 2.65Å; E153-R194 PolarHBondContact OE2-NH1 3.17Å; E153-R194 IonicContact OE2-NH2 2.8Å; E153-R194 PolarHBondContact OE2-NH2 2.97Å; P174-R194 HydrophobicContact CB-CB 4.29Å; P174-R194 WeakPolarHBondContact CB-O 3.36Å; K175-R194 PolarHBondContact N-O 3.08Å; K175-R194 CarbonylContact O-C 3.5Å; K175-R194 VanDerWaalsContact O-CA 3.3Å; K175-R194 WeakPolarHBondContact O-CA 3.25Å; L176-R194 HydrophobicContact CD2-CG 3.81Å
195	N	86	Confident	91.6	Very high	40 Å²	40	32.2 Å²	32.2	21%	0.214	15%	0.154	C	C	.	.	S	Bend	trans	-144.4	149.6	175.7	65.8	81.8	0	0	0	109.6	H100 K197 Y198 T199	H100-N195 WeakPolarHBondContact CA-ND2 3.3Å; H100-N195 PolarHBondContact ND1-ND2 3.41Å; N195-K197 VanDerWaalsContact C-N 3.31Å; N195-K197 PolarHBondContact O-N 2.8Å; N195-K197 PolarHBondContact OD1-N 2.85Å; N195-Y198 PolarHBondContact O-N 3.38Å; N195-Y198 WeakPolarHBondContact OD1-CB 3.28Å; N195-Y198 PolarHBondContact OD1-N 2.85Å; N195-T199 WeakPolarHBondContact O-CB 3.17Å; N195-T199 PolarHBondContact O-N 3.39Å; N195-T199 VanDerWaalsContact O-N 3.09Å; N195-T199 PolarHBondContact O-OG1 2.99Å
196	E	90.2	Very high	91.9	Very high	120 Å²	120	31.5 Å²	31.5	56%	0.561	15%	0.147	S	C	*	.	H	α-helix	trans	-61.3	-38.6	-175	-176.8	174.1	-173.7	0	0	112.9	Y198 T199 N200	E196-Y198 PolarHBondContact O-N 3.39Å; E196-T199 PolarHBondContact O-N 3.32Å; E196-N200 VanDerWaalsContact CG-ND2 3.34Å; E196-N200 WeakPolarHBondContact CG-ND2 3.48Å; E196-N200 WeakPolarHBondContact O-CB 3.4Å; E196-N200 PolarHBondContact O-N 2.7Å; E196-N200 PolarHBondContact O-ND2 2.76Å
197	K	88.1	Confident	91.7	Very high	108 Å²	108	38.3 Å²	38.3	47%	0.47	18%	0.177	S	C	.	.	H	α-helix	trans	-60.5	-47.7	-178.3	-178.4	170.1	174	177.3	0	112.2	N195 A201 L386 I388	N195-K197 VanDerWaalsContact C-N 3.31Å; N195-K197 PolarHBondContact O-N 2.8Å; N195-K197 PolarHBondContact OD1-N 2.85Å; K197-A201 PolarHBondContact O-N 3.49Å; K197-L386 HydrophobicContact CD-CB 4.48Å; K197-L386 HydrophobicContact CD-CD2 4.15Å; K197-L386 WeakPolarHBondContact CE-O 3.14Å; K197-L386 HydrophobicContact CG-CD2 4.41Å; K197-L386 PolarHBondContact NZ-O 3.13Å; K197-I388 HydrophobicContact CG-CD1 4.06Å
198	Y	87.7	Confident	91.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.7	-45.7	175.2	178.7	-93.2	0	0	0	111	H100 F101 I179 L191 N195 E196 N200 A201 A202 P376 P378 I388	H100-Y198 HydrophobicContact CB-CD2 3.99Å; H100-Y198 HydrophobicContact CB-CG 3.97Å; H100-Y198 WeakPolarHBondContact O-CD1 3.48Å; F101-Y198 HydrophobicContact CB-CD1 4.06Å; F101-Y198 HydrophobicContact CB-CE1 3.49Å; F101-Y198 VanDerWaalsContact CB-CE1 3.49Å; F101-Y198 AromaticContact CD1-CE1 3.99Å; F101-Y198 HydrophobicContact CD1-CE1 3.99Å; F101-Y198 AromaticContact CD1-CE2 3.97Å; F101-Y198 HydrophobicContact CD1-CE2 3.97Å; F101-Y198 AromaticContact CD1-CZ 3.54Å; F101-Y198 WeakPolarHBondContact CD1-OH 3.24Å; F101-Y198 HydrophobicContact CG-CE1 4.09Å; I179-Y198 HydrophobicContact CD1-CD1 3.72Å; I179-Y198 HydrophobicContact CD1-CE1 3.53Å; L191-Y198 HydrophobicContact CD2-CE1 4.37Å; N195-Y198 PolarHBondContact O-N 3.38Å; N195-Y198 WeakPolarHBondContact OD1-CB 3.28Å; N195-Y198 PolarHBondContact OD1-N 2.85Å; E196-Y198 PolarHBondContact O-N 3.39Å; Y198-N200 VanDerWaalsContact C-N 3.34Å; Y198-N200 PolarHBondContact O-N 2.99Å; Y198-A201 PolarHBondContact O-N 2.92Å; Y198-A202 HydrophobicContact CD1-CB 4.38Å; Y198-A202 HydrophobicContact CE1-CB 4.01Å; Y198-A202 VanDerWaalsContact O-CB 3.29Å; Y198-A202 WeakPolarHBondContact O-CB 3.37Å; Y198-A202 PolarHBondContact O-N 3.37Å; Y198-P376 HydrophobicContact CE2-CB 4.33Å; Y198-P376 PolarHBondContact OH-O 3.41Å; Y198-P378 HydrophobicContact CD2-CB 4.27Å; Y198-P378 HydrophobicContact CE2-CB 4.43Å; Y198-P378 HydrophobicContact CE2-CG 4.28Å; Y198-I388 HydrophobicContact CD2-CG1 4.02Å; Y198-I388 HydrophobicContact CD2-CG2 4.29Å; Y198-I388 HydrophobicContact CE2-CG2 4.33Å
199	T	93.1	Very high	91.1	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-53.6	-49.3	179	-62.1	0	0	0	0	112.1	Y177 I179 G193 N195 E196 A202 R203	Y177-T199 HydrophobicContact CG-CG2 4.03Å; I179-T199 HydrophobicContact CG1-CG2 3.96Å; G193-T199 WeakPolarHBondContact CA-OG1 3.37Å; N195-T199 WeakPolarHBondContact O-CB 3.17Å; N195-T199 PolarHBondContact O-N 3.39Å; N195-T199 VanDerWaalsContact O-N 3.09Å; N195-T199 PolarHBondContact O-OG1 2.99Å; E196-T199 PolarHBondContact O-N 3.32Å; T199-A202 PolarHBondContact O-N 3.08Å; T199-R203 WeakPolarHBondContact O-CB 3.13Å; T199-R203 WeakPolarHBondContact O-CG 3.41Å; T199-R203 PolarHBondContact O-N 3.2Å
200	N	93.1	Very high	90.6	Very high	77 Å²	77	44 Å²	44	41%	0.412	21%	0.208	S	C	.	.	H	α-helix	trans	-66	-41.5	-178.8	-72.5	-19.8	0	0	0	111.9	E196 Y198 K204	E196-N200 VanDerWaalsContact CG-ND2 3.34Å; E196-N200 WeakPolarHBondContact CG-ND2 3.48Å; E196-N200 WeakPolarHBondContact O-CB 3.4Å; E196-N200 PolarHBondContact O-N 2.7Å; E196-N200 PolarHBondContact O-ND2 2.76Å; Y198-N200 VanDerWaalsContact C-N 3.34Å; Y198-N200 PolarHBondContact O-N 2.99Å; N200-K204 PolarHBondContact O-N 3.06Å; N200-K204 VanDerWaalsContact O-N 3.13Å
201	A	90.3	Very high	89.9	Confident	31 Å²	31	50.4 Å²	50.4	26%	0.256	24%	0.242	S	C	.	.	H	α-helix	trans	-64.6	-41.1	175.7	0	0	0	0	0	112.2	K197 Y198 K204 F205 I388	K197-A201 PolarHBondContact O-N 3.49Å; Y198-A201 PolarHBondContact O-N 2.92Å; A201-K204 PolarHBondContact O-N 3.37Å; A201-F205 PolarHBondContact O-N 3.44Å; A201-I388 HydrophobicContact CB-CB 3.67Å; A201-I388 HydrophobicContact CB-CD1 4.03Å; A201-I388 HydrophobicContact CB-CG1 4.04Å; A201-I388 HydrophobicContact CB-CG2 3.76Å
202	A	92.5	Very high	88.8	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-70.5	-41.7	-179.4	0	0	0	0	0	112.6	I179 Y198 T199 K204 F205 Y206 P376	I179-A202 HydrophobicContact CD1-CB 3.85Å; I179-A202 HydrophobicContact CG1-CB 4.36Å; I179-A202 HydrophobicContact CG2-CB 3.5Å; I179-A202 VanDerWaalsContact CG2-CB 3.5Å; Y198-A202 HydrophobicContact CD1-CB 4.38Å; Y198-A202 HydrophobicContact CE1-CB 4.01Å; Y198-A202 VanDerWaalsContact O-CB 3.29Å; Y198-A202 WeakPolarHBondContact O-CB 3.37Å; Y198-A202 PolarHBondContact O-N 3.37Å; T199-A202 PolarHBondContact O-N 3.08Å; A202-K204 VanDerWaalsContact C-N 3.28Å; A202-K204 PolarHBondContact O-N 3.02Å; A202-F205 WeakPolarHBondContact O-CA 3.44Å; A202-F205 VanDerWaalsContact O-CB 3.31Å; A202-F205 WeakPolarHBondContact O-CB 3.48Å; A202-F205 PolarHBondContact O-N 3.1Å; A202-F205 VanDerWaalsContact O-N 3.08Å; A202-Y206 WeakPolarHBondContact O-CD2 3.24Å; A202-Y206 PolarHBondContact O-N 3.23Å; A202-P376 HydrophobicContact CB-CG 3.71Å
203	R	93.8	Very high	87.4	Confident	100 Å²	100	55.3 Å²	55.3	38%	0.377	29%	0.293	S	S	.	.	H	α-helix	trans	-58.6	-40.8	171.8	-74.6	175.1	176.4	166.3	-4.3	111.6	I178 I179 T199 F205 K207	I178-R203 PolarHBondContact O-NE 3.45Å; I178-R203 PolarHBondContact O-NH2 3.03Å; I179-R203 HydrophobicContact CG2-CG 4.3Å; T199-R203 WeakPolarHBondContact O-CB 3.13Å; T199-R203 WeakPolarHBondContact O-CG 3.41Å; T199-R203 PolarHBondContact O-N 3.2Å; R203-F205 VanDerWaalsContact C-N 3.34Å; R203-K207 VanDerWaalsContact O-CB 3.25Å; R203-K207 WeakPolarHBondContact O-CB 3.45Å; R203-K207 PolarHBondContact O-N 3.11Å
204	K	91.3	Very high	86	Confident	156 Å²	156	57 Å²	57	68%	0.678	30%	0.303	S	S	*	.	H	α-helix	trans	-63.8	-39.3	174.4	-173.8	176.9	-179.5	177.3	0	112	N200 A201 A202 T208	N200-K204 PolarHBondContact O-N 3.06Å; N200-K204 VanDerWaalsContact O-N 3.13Å; A201-K204 PolarHBondContact O-N 3.37Å; A202-K204 VanDerWaalsContact C-N 3.28Å; A202-K204 PolarHBondContact O-N 3.02Å; K204-T208 WeakPolarHBondContact O-CB 3.48Å; K204-T208 PolarHBondContact O-N 3.09Å; K204-T208 PolarHBondContact O-OG1 3.39Å
205	F	89.6	Confident	84.7	Confident	8 Å²	8	59.2 Å²	59.2	4%	0.035	32%	0.318	C	S	.	.	H	α-helix	trans	-59	-56.1	175	165.5	-98.8	0	0	0	111.8	A201 A202 R203 K207 T208 A209 W216 P376 S390	A201-F205 PolarHBondContact O-N 3.44Å; A202-F205 WeakPolarHBondContact O-CA 3.44Å; A202-F205 VanDerWaalsContact O-CB 3.31Å; A202-F205 WeakPolarHBondContact O-CB 3.48Å; A202-F205 PolarHBondContact O-N 3.1Å; A202-F205 VanDerWaalsContact O-N 3.08Å; R203-F205 VanDerWaalsContact C-N 3.34Å; F205-K207 PolarHBondContact O-N 2.96Å; F205-T208 WeakPolarHBondContact O-CB 3.32Å; F205-T208 PolarHBondContact O-N 3.13Å; F205-T208 VanDerWaalsContact O-N 3.11Å; F205-A209 PolarHBondContact O-N 3.48Å; F205-W216 AromaticContact CE2-CD1 3.56Å; F205-W216 HydrophobicContact CE2-CG 4.31Å; F205-W216 AromaticContact CE2-NE1 3.59Å; F205-W216 AromaticContact CZ-CD1 3.96Å; F205-P376 HydrophobicContact CB-CG 3.9Å; F205-P376 HydrophobicContact CD1-CG 3.69Å; F205-P376 HydrophobicContact CE1-CG 4.36Å; F205-P376 HydrophobicContact CG-CG 3.82Å; F205-S390 WeakPolarHBondContact CD2-OG 3.45Å
206	Y	91.9	Very high	83.8	Confident	4 Å²	4	58.6 Å²	58.6	2%	0.016	31%	0.312	C	S	.	.	H	α-helix	trans	-65.1	-39.6	-179.1	-67.5	-69.8	0	0	0	112.3	I179 E180 L191 A202 T208 A209 M210 Y219 L373 Y374	I179-Y206 HydrophobicContact CG2-CD2 3.76Å; I179-Y206 HydrophobicContact CG2-CE2 3.64Å; E180-Y206 HydrophobicContact CB-CD2 4.02Å; E180-Y206 HydrophobicContact CB-CE1 4.26Å; E180-Y206 HydrophobicContact CB-CE2 3.71Å; E180-Y206 HydrophobicContact CB-CG 4.44Å; E180-Y206 HydrophobicContact CG-CD1 4.25Å; E180-Y206 HydrophobicContact CG-CE1 4Å; E180-Y206 HydrophobicContact CG-CE2 4.34Å; E180-Y206 HydrophobicContact CG-CG 4.49Å; L191-Y206 HydrophobicContact CD2-CE2 3.81Å; L191-Y206 WeakPolarHBondContact CD2-OH 3.49Å; A202-Y206 WeakPolarHBondContact O-CD2 3.24Å; A202-Y206 PolarHBondContact O-N 3.23Å; Y206-T208 PolarHBondContact O-N 3.37Å; Y206-A209 PolarHBondContact O-N 3.35Å; Y206-M210 WeakPolarHBondContact O-CB 2.99Å; Y206-M210 VanDerWaalsContact O-CG 3.27Å; Y206-M210 WeakPolarHBondContact O-CG 2.91Å; Y206-M210 PolarHBondContact O-N 3.17Å; Y206-Y219 AromaticContact CD1-CD2 3.74Å; Y206-Y219 HydrophobicContact CD1-CD2 3.74Å; Y206-Y219 HydrophobicContact CD1-CE1 4.27Å; Y206-Y219 AromaticContact CD1-CE2 3.49Å; Y206-Y219 HydrophobicContact CD1-CE2 3.49Å; Y206-Y219 VanDerWaalsContact CD1-CE2 3.49Å; Y206-Y219 HydrophobicContact CD1-CG 4.24Å; Y206-Y219 AromaticContact CD1-CZ 3.77Å; Y206-Y219 AromaticContact CE1-CD2 3.54Å; Y206-Y219 HydrophobicContact CE1-CD2 3.54Å; Y206-Y219 AromaticContact CE1-CE2 3.57Å; Y206-Y219 HydrophobicContact CE1-CE2 3.57Å; Y206-Y219 HydrophobicContact CE1-CG 4.3Å; Y206-L373 HydrophobicContact CE1-CD1 4.12Å; Y206-Y374 PolarHBondContact OH-O 2.8Å
207	K	89.3	Confident	83.1	Confident	149 Å²	149	53.4 Å²	53.4	65%	0.648	29%	0.288	S	S	*	.	H	α-helix	trans	-56	-39.9	173.2	-175.6	175.2	-179.2	176.3	0	111.8	R203 F205 L211	R203-K207 VanDerWaalsContact O-CB 3.25Å; R203-K207 WeakPolarHBondContact O-CB 3.45Å; R203-K207 PolarHBondContact O-N 3.11Å; F205-K207 PolarHBondContact O-N 2.96Å; K207-L211 WeakPolarHBondContact O-CG 3.31Å; K207-L211 PolarHBondContact O-N 3.22Å
208	T	87.3	Confident	83	Confident	58 Å²	58	49.5 Å²	49.5	36%	0.356	27%	0.273	S	S	.	.	H	α-helix	trans	-71.6	-45.2	177.7	-52.8	0	0	0	0	111.4	K204 F205 Y206 M210 L211 G212	K204-T208 WeakPolarHBondContact O-CB 3.48Å; K204-T208 PolarHBondContact O-N 3.09Å; K204-T208 PolarHBondContact O-OG1 3.39Å; F205-T208 WeakPolarHBondContact O-CB 3.32Å; F205-T208 PolarHBondContact O-N 3.13Å; F205-T208 VanDerWaalsContact O-N 3.11Å; Y206-T208 PolarHBondContact O-N 3.37Å; T208-M210 VanDerWaalsContact C-N 3.28Å; T208-M210 PolarHBondContact O-N 2.55Å; T208-L211 PolarHBondContact O-N 2.91Å; T208-L211 VanDerWaalsContact O-N 3.11Å; T208-G212 PolarHBondContact O-N 3.31Å
209	A	87.3	Confident	83.1	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.1	-36.9	178	0	0	0	0	0	112.4	F205 Y206 L211 G212 Y219 N297	F205-A209 PolarHBondContact O-N 3.48Å; Y206-A209 PolarHBondContact O-N 3.35Å; A209-L211 VanDerWaalsContact C-N 3.31Å; A209-L211 PolarHBondContact O-N 2.76Å; A209-G212 PolarHBondContact O-N 2.78Å; A209-Y219 HydrophobicContact CB-CD1 3.72Å; A209-Y219 HydrophobicContact CB-CE1 4.16Å; A209-N297 PolarHBondContact O-ND2 2.96Å
210	M	86.3	Confident	83.1	Confident	62 Å²	62	49.6 Å²	49.6	31%	0.305	27%	0.273	S	S	.	.	H	α-helix	trans	-67.3	-26.3	175.6	-74	-178.9	78.9	0	0	113.9	Y206 T208 G212 Y219 K275 N297	Y206-M210 WeakPolarHBondContact O-CB 2.99Å; Y206-M210 VanDerWaalsContact O-CG 3.27Å; Y206-M210 WeakPolarHBondContact O-CG 2.91Å; Y206-M210 PolarHBondContact O-N 3.17Å; T208-M210 VanDerWaalsContact C-N 3.28Å; T208-M210 PolarHBondContact O-N 2.55Å; M210-G212 VanDerWaalsContact C-N 3.3Å; M210-Y219 HydrophobicContact CG-CE1 4.36Å; M210-K275 PolarHBondContact O-NZ 2.8Å; M210-N297 WeakPolarHBondContact CG-O 3.45Å; M210-N297 PolarHBondContact O-ND2 3.41Å
211	L	81.4	Confident	83.2	Confident	134 Å²	134	46.3 Å²	46.3	70%	0.702	26%	0.255	S	S	*	.	H	α-helix	trans	-77.3	-20.9	175.4	-69.6	170.3	0	0	0	111.9	K207 T208 A209	K207-L211 WeakPolarHBondContact O-CG 3.31Å; K207-L211 PolarHBondContact O-N 3.22Å; T208-L211 PolarHBondContact O-N 2.91Å; T208-L211 VanDerWaalsContact O-N 3.11Å; A209-L211 VanDerWaalsContact C-N 3.31Å; A209-L211 PolarHBondContact O-N 2.76Å
212	G	72.7	Confident	83.5	Confident	26 Å²	26	44.8 Å²	44.8	27%	0.268	24%	0.243	S	C	.	.			trans	79.1	175.6	-179.3	0	0	0	0	0	113.8	T208 A209 M210 D217	T208-G212 PolarHBondContact O-N 3.31Å; A209-G212 PolarHBondContact O-N 2.78Å; M210-G212 VanDerWaalsContact C-N 3.3Å; G212-D217 WeakPolarHBondContact CA-OD2 3.31Å
213	G	64.7	Low	83.8	Confident	78 Å²	78	44.8 Å²	44.8	80%	0.804	24%	0.243	S	C	*	.			trans	99.8	6.5	178.1	0	0	0	0	0	114.8	D217	G213-D217 PolarHBondContact N-OD1 3.14Å; G213-D217 PolarHBondContact N-OD2 2.84Å
214	T	64	Low	84	Confident	36 Å²	36	40 Å²	40	22%	0.221	23%	0.225	C	C	.	.	S	Bend	trans	-120.8	160	-178	70.3	0	0	0	0	112.2	W216 D217	T214-W216 HydrophobicContact CG2-CH2 4.07Å; T214-W216 HydrophobicContact CG2-CZ2 3.65Å; T214-W216 PolarHBondContact O-N 3.18Å; T214-W216 VanDerWaalsContact OG1-CE2 3.25Å; T214-W216 PolarHBondContact OG1-NE1 2.76Å; T214-D217 WeakPolarHBondContact CA-OD1 3.32Å; T214-D217 WeakPolarHBondContact CB-OD1 3.43Å; T214-D217 VanDerWaalsContact N-CG 3.32Å; T214-D217 PolarHBondContact N-OD1 3.34Å; T214-D217 PolarHBondContact N-OD2 2.9Å; T214-D217 PolarHBondContact O-N 2.83Å; T214-D217 PolarHBondContact OG1-OD1 3.42Å
215	T	58.9	Low	84.3	Confident	56 Å²	56	32.6 Å²	32.6	34%	0.344	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-14.7	-178.6	43.1	0	0	0	0	114.2
216	W	67.5	Low	84.7	Confident	27 Å²	27	32.2 Å²	32.2	10%	0.102	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	21.7	-179	57.9	83	0	0	0	112.7	F205 T214 L218 Y219 Y374 Y391 F453	F205-W216 AromaticContact CE2-CD1 3.56Å; F205-W216 HydrophobicContact CE2-CG 4.31Å; F205-W216 AromaticContact CE2-NE1 3.59Å; F205-W216 AromaticContact CZ-CD1 3.96Å; T214-W216 HydrophobicContact CG2-CH2 4.07Å; T214-W216 HydrophobicContact CG2-CZ2 3.65Å; T214-W216 PolarHBondContact O-N 3.18Å; T214-W216 VanDerWaalsContact OG1-CE2 3.25Å; T214-W216 PolarHBondContact OG1-NE1 2.76Å; W216-L218 PolarHBondContact O-N 2.83Å; W216-Y219 PolarHBondContact O-N 3.1Å; W216-Y374 HydrophobicContact CB-CD2 3.98Å; W216-Y374 HydrophobicContact CB-CE2 3.95Å; W216-Y391 AromaticContact CE3-CD1 3.94Å; W216-Y391 HydrophobicContact CE3-CD1 3.94Å; W216-Y391 HydrophobicContact CE3-CE1 4.26Å; W216-Y391 AromaticContact CH2-CD1 3.8Å; W216-Y391 HydrophobicContact CH2-CD1 3.8Å; W216-Y391 AromaticContact CH2-CE1 3.45Å; W216-Y391 HydrophobicContact CH2-CE1 3.45Å; W216-Y391 VanDerWaalsContact CH2-CE1 3.45Å; W216-Y391 HydrophobicContact CZ2-CE1 4.49Å; W216-Y391 AromaticContact CZ3-CD1 3.42Å; W216-Y391 HydrophobicContact CZ3-CD1 3.42Å; W216-Y391 VanDerWaalsContact CZ3-CD1 3.42Å; W216-Y391 AromaticContact CZ3-CE1 3.3Å; W216-Y391 HydrophobicContact CZ3-CE1 3.3Å; W216-F453 HydrophobicContact CB-CD1 4.18Å; W216-F453 HydrophobicContact CB-CE1 3.5Å; W216-F453 HydrophobicContact CB-CZ 3.93Å; W216-F453 AromaticContact CD2-CE1 3.84Å; W216-F453 HydrophobicContact CD2-CE1 3.84Å; W216-F453 HydrophobicContact CD2-CZ 4.36Å; W216-F453 AromaticContact CE3-CE1 3.64Å; W216-F453 HydrophobicContact CE3-CE1 3.64Å; W216-F453 AromaticContact CE3-CZ 3.77Å; W216-F453 HydrophobicContact CE3-CZ 3.77Å; W216-F453 AromaticContact CG-CE1 3.82Å; W216-F453 HydrophobicContact CG-CE1 3.82Å; W216-F453 HydrophobicContact CG-CZ 4.47Å
217	D	74.9	Confident	84.8	Confident	11 Å²	11	32.9 Å²	32.9	6%	0.059	19%	0.193	C	C	.	.			trans	-55.5	-40.5	-177.9	-70	-18.5	0	0	0	111.1	G212 G213 T214 Y219 L276 N297	G212-D217 WeakPolarHBondContact CA-OD2 3.31Å; G213-D217 PolarHBondContact N-OD1 3.14Å; G213-D217 PolarHBondContact N-OD2 2.84Å; T214-D217 WeakPolarHBondContact CA-OD1 3.32Å; T214-D217 WeakPolarHBondContact CB-OD1 3.43Å; T214-D217 VanDerWaalsContact N-CG 3.32Å; T214-D217 PolarHBondContact N-OD1 3.34Å; T214-D217 PolarHBondContact N-OD2 2.9Å; T214-D217 PolarHBondContact O-N 2.83Å; T214-D217 PolarHBondContact OG1-OD1 3.42Å; D217-Y219 WeakPolarHBondContact O-CD1 3.29Å; D217-Y219 PolarHBondContact O-N 3.17Å; D217-L276 HydrophobicContact CB-CD1 3.43Å; D217-L276 VanDerWaalsContact CB-CD1 3.43Å; D217-L276 WeakPolarHBondContact OD2-CD1 3.49Å; D217-N297 HydrophobicContact CB-CB 4.36Å; D217-N297 WeakPolarHBondContact O-CA 2.88Å; D217-N297 WeakPolarHBondContact O-CB 3.48Å
218	L	86.1	Confident	85	Confident	26 Å²	26	27 Å²	27	14%	0.136	17%	0.174	C	C	.	.			trans	-80.6	64	175.9	-56.3	-179.9	0	0	0	112.1	W216 Q220 P237 L276 H278 E295	W216-L218 PolarHBondContact O-N 2.83Å; L218-Q220 VanDerWaalsContact C-N 3.29Å; L218-Q220 PolarHBondContact O-N 2.89Å; L218-P237 HydrophobicContact CD1-CB 4.22Å; L218-P237 HydrophobicContact CD1-CG 4.16Å; L218-L276 HydrophobicContact CD2-CB 3.87Å; L218-L276 WeakPolarHBondContact CD2-O 3.32Å; L218-H278 HydrophobicContact CD1-CB 4.03Å; L218-E295 HydrophobicContact CB-CB 4.14Å; L218-E295 HydrophobicContact CD1-CB 4.07Å
219	Y	90	Very high	85.2	Confident	2 Å²	2	29.5 Å²	29.5	1%	0.008	18%	0.18	C	C	.	.			trans	-76.8	-11.1	-172.4	71	-99.3	0	0	0	114.6	E180 Y206 A209 M210 W216 D217 N297 L373 Y374	E180-Y219 HydrophobicContact CG-CE2 4.42Å; E180-Y219 WeakPolarHBondContact OE1-CE2 3.41Å; E180-Y219 PolarHBondContact OE1-OH 2.76Å; Y206-Y219 AromaticContact CD1-CD2 3.74Å; Y206-Y219 HydrophobicContact CD1-CD2 3.74Å; Y206-Y219 HydrophobicContact CD1-CE1 4.27Å; Y206-Y219 AromaticContact CD1-CE2 3.49Å; Y206-Y219 HydrophobicContact CD1-CE2 3.49Å; Y206-Y219 VanDerWaalsContact CD1-CE2 3.49Å; Y206-Y219 HydrophobicContact CD1-CG 4.24Å; Y206-Y219 AromaticContact CD1-CZ 3.77Å; Y206-Y219 AromaticContact CE1-CD2 3.54Å; Y206-Y219 HydrophobicContact CE1-CD2 3.54Å; Y206-Y219 AromaticContact CE1-CE2 3.57Å; Y206-Y219 HydrophobicContact CE1-CE2 3.57Å; Y206-Y219 HydrophobicContact CE1-CG 4.3Å; A209-Y219 HydrophobicContact CB-CD1 3.72Å; A209-Y219 HydrophobicContact CB-CE1 4.16Å; M210-Y219 HydrophobicContact CG-CE1 4.36Å; W216-Y219 PolarHBondContact O-N 3.1Å; D217-Y219 WeakPolarHBondContact O-CD1 3.29Å; D217-Y219 PolarHBondContact O-N 3.17Å; Y219-N297 HydrophobicContact CD1-CB 4.49Å; Y219-N297 HydrophobicContact CE1-CB 4.49Å; Y219-N297 VanDerWaalsContact CE1-O 3.22Å; Y219-N297 WeakPolarHBondContact CE1-O 3.19Å; Y219-L373 HydrophobicContact CD2-CD1 3.74Å; Y219-L373 HydrophobicContact CE2-CD1 3.88Å; Y219-L373 CarbonylContact O-C 3.4Å; Y219-Y374 PolarHBondContact O-N 2.94Å
220	Q	92.9	Very high	85.5	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	142.4	-178.8	54.6	-175.7	-36.4	0	0	111.2	L218 E295 T296 H372 L373	L218-Q220 VanDerWaalsContact C-N 3.29Å; L218-Q220 PolarHBondContact O-N 2.89Å; Q220-E295 WeakPolarHBondContact O-CA 3.44Å; Q220-T296 HydrophobicContact CG-CG2 3.87Å; Q220-T296 WeakPolarHBondContact CG-O 3.4Å; Q220-T296 PolarHBondContact O-N 2.71Å; Q220-T296 VanDerWaalsContact O-N 3.11Å; Q220-H372 WeakPolarHBondContact CA-O 3.25Å; Q220-L373 HydrophobicContact CB-CD1 4.16Å
221	K	94.9	Very high	85.8	Confident	8 Å²	8	33.3 Å²	33.3	4%	0.035	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	133.8	174.6	-43.1	177.3	175	164.7	0	109.2	L294 E295 S371 H372	K221-L294 CarbonylContact C-O 3.19Å; K221-L294 WeakPolarHBondContact CA-O 3.38Å; K221-E295 HydrophobicContact CB-CG 4.34Å; K221-E295 HydrophobicContact CD-CG 4.34Å; K221-E295 HydrophobicContact CG-CG 3.9Å; K221-S371 PolarHBondContact O-N 3.41Å; K221-S371 VanDerWaalsContact O-N 3.15Å; K221-H372 HydrophobicContact CB-CB 3.77Å; K221-H372 HydrophobicContact CD-CB 3.97Å; K221-H372 HydrophobicContact CG-CB 3.86Å; K221-H372 PolarHBondContact N-O 3.25Å; K221-H372 PolarHBondContact O-N 3.37Å
222	L	97.4	Very high	86.2	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	137.9	179.9	-50.6	178.7	0	0	0	108.6	I224 K293 L294 T296 L299 P304 I368 H369 R370	L222-I224 HydrophobicContact CB-CD1 4.05Å; L222-I224 HydrophobicContact CB-CG1 3.93Å; L222-I224 HydrophobicContact CD1-CD1 4.26Å; L222-K293 CarbonylContact O-C 3.53Å; L222-K293 WeakPolarHBondContact O-CA 3.29Å; L222-L294 HydrophobicContact CB-CB 4.44Å; L222-L294 HydrophobicContact CD1-CD2 4.09Å; L222-L294 PolarHBondContact N-O 3.47Å; L222-L294 PolarHBondContact O-N 2.87Å; L222-T296 HydrophobicContact CD1-CG2 4.31Å; L222-L299 HydrophobicContact CD1-CD2 3.69Å; L222-L299 HydrophobicContact CD2-CD2 4.44Å; L222-P304 HydrophobicContact CD1-CB 4Å; L222-P304 HydrophobicContact CD1-CG 3.49Å; L222-P304 VanDerWaalsContact CD1-CG 3.49Å; L222-I368 HydrophobicContact CB-CG2 4.32Å; L222-I368 HydrophobicContact CD1-CG2 3.98Å; L222-I368 HydrophobicContact CD2-CG2 4.38Å; L222-I368 HydrophobicContact CG-CG2 4.46Å; L222-H369 CarbonylContact C-O 3.48Å; L222-H369 VanDerWaalsContact CA-O 3.3Å; L222-H369 WeakPolarHBondContact CA-O 3.3Å; L222-R370 HydrophobicContact CD2-CB 3.64Å; L222-R370 HydrophobicContact CD2-CG 3.92Å
223	L	97.9	Very high	87	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	127.1	162.8	-67.4	176	0	0	0	107.8	L282 L291 K293 H369 L461 F465 F476 Y478 W481	L223-L282 HydrophobicContact CD2-CD1 3.52Å; L223-L291 HydrophobicContact CB-CD1 4.36Å; L223-K293 HydrophobicContact CD2-CB 4.4Å; L223-H369 PolarHBondContact N-O 2.77Å; L223-H369 PolarHBondContact O-N 2.77Å; L223-L461 HydrophobicContact CD1-CD2 3.86Å; L223-F465 HydrophobicContact CB-CZ 3.96Å; L223-F476 HydrophobicContact CD1-CE1 4.24Å; L223-F476 HydrophobicContact CD1-CZ 4.37Å; L223-Y478 HydrophobicContact CD1-CD2 3.85Å; L223-Y478 HydrophobicContact CD1-CE2 3.55Å; L223-W481 HydrophobicContact CD1-CZ3 4.31Å; L223-W481 HydrophobicContact CD2-CH2 4.39Å; L223-W481 HydrophobicContact CD2-CZ2 4.25Å
224	I	98.2	Very high	88.3	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	125.4	-171.5	-50.8	-177.8	0	0	0	109.6	L222 V292 L294 P304 L308 V315 H367 I368	L222-I224 HydrophobicContact CB-CD1 4.05Å; L222-I224 HydrophobicContact CB-CG1 3.93Å; L222-I224 HydrophobicContact CD1-CD1 4.26Å; I224-V292 PolarHBondContact N-O 3.43Å; I224-V292 PolarHBondContact O-N 3.38Å; I224-L294 HydrophobicContact CD1-CB 3.74Å; I224-L294 HydrophobicContact CD1-CD1 4Å; I224-L294 HydrophobicContact CD1-CG 4.36Å; I224-P304 HydrophobicContact CD1-CB 3.93Å; I224-L308 HydrophobicContact CB-CD1 4.25Å; I224-L308 HydrophobicContact CD1-CD1 3.74Å; I224-L308 HydrophobicContact CG2-CD1 3.7Å; I224-V315 HydrophobicContact CG2-CB 4.35Å; I224-V315 HydrophobicContact CG2-CG1 3.88Å; I224-V315 HydrophobicContact CG2-CG2 3.71Å; I224-H367 VanDerWaalsContact CA-O 3.31Å; I224-H367 WeakPolarHBondContact CA-O 3.45Å; I224-I368 HydrophobicContact CD1-CG1 4.25Å; I224-I368 HydrophobicContact CG1-CG1 4.06Å; I224-I368 HydrophobicContact CG1-CG2 4.37Å; I224-I368 HydrophobicContact CG2-CG1 3.91Å
225	V	97.7	Very high	89.6	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	127.5	171.6	-168.2	0	0	0	0	109	L291 V316 H367 F465 T468 L469 L472 I474	V225-L291 HydrophobicContact CG2-CD1 4.33Å; V225-V316 HydrophobicContact CB-CB 4.44Å; V225-V316 HydrophobicContact CB-CG2 4.13Å; V225-V316 HydrophobicContact CG1-CG2 3.77Å; V225-V316 PolarHBondContact O-N 3.31Å; V225-H367 HydrophobicContact CB-CB 3.74Å; V225-H367 HydrophobicContact CG2-CB 3.96Å; V225-H367 PolarHBondContact N-O 3.33Å; V225-H367 VanDerWaalsContact N-O 3.1Å; V225-F465 HydrophobicContact CG2-CD1 4.14Å; V225-F465 HydrophobicContact CG2-CE1 3.54Å; V225-F465 HydrophobicContact CG2-CE2 3.97Å; V225-F465 HydrophobicContact CG2-CZ 3.44Å; V225-F465 VanDerWaalsContact CG2-CZ 3.44Å; V225-T468 HydrophobicContact CG1-CG2 4.21Å; V225-L469 HydrophobicContact CG1-CD2 4.42Å; V225-L469 HydrophobicContact CG2-CD2 3.72Å; V225-L472 HydrophobicContact CG1-CD1 3.47Å; V225-L472 VanDerWaalsContact CG1-CD1 3.47Å; V225-I474 HydrophobicContact CG1-CD1 3.98Å
226	C	97	Very high	91.1	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	145.4	-175.4	-55.5	0	0	0	0	112.3	S289 S290 C313 T314	C226-S289 CarbonylContact O-C 3.34Å; C226-S289 VanDerWaalsContact O-CA 3.23Å; C226-S289 WeakPolarHBondContact O-CA 3.23Å; C226-S289 WeakPolarHBondContact O-CB 3.08Å; C226-S290 PolarHBondContact N-O 3.49Å; C226-S290 PolarHBondContact O-N 3.13Å; C226-C313 HydrophobicContact CB-CB 4.23Å; C226-T314 CarbonylContact C-O 3.43Å; C226-T314 WeakPolarHBondContact CA-O 3.48Å; C226-T314 WeakPolarHBondContact CB-O 3.34Å
227	W	94.8	Very high	92	Very high	17 Å²	17	43 Å²	43	6%	0.064	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	128.2	156.1	-64	117.2	0	0	0	109.5	C313 T314 V316 Q350 I353 L354 L472	W227-C313 WeakPolarHBondContact O-CA 3.42Å; W227-C313 WeakPolarHBondContact O-CB 3.13Å; W227-T314 PolarHBondContact N-O 3.02Å; W227-T314 PolarHBondContact O-N 2.97Å; W227-V316 HydrophobicContact CD2-CG2 4.22Å; W227-V316 HydrophobicContact CG-CG2 4.22Å; W227-Q350 HydrophobicContact CD2-CG 4.11Å; W227-Q350 HydrophobicContact CE3-CG 4.22Å; W227-Q350 HydrophobicContact CH2-CB 3.89Å; W227-Q350 HydrophobicContact CH2-CG 3.86Å; W227-Q350 HydrophobicContact CZ2-CB 3.56Å; W227-Q350 HydrophobicContact CZ2-CG 3.75Å; W227-Q350 HydrophobicContact CZ3-CG 4.1Å; W227-I353 HydrophobicContact CH2-CB 4.43Å; W227-I353 HydrophobicContact CH2-CG2 4.19Å; W227-L354 HydrophobicContact CH2-CD2 4.42Å; W227-L354 HydrophobicContact CH2-CG 4.33Å; W227-L354 HydrophobicContact CZ2-CD1 3.89Å; W227-L354 HydrophobicContact CZ2-CD2 4.31Å; W227-L354 HydrophobicContact CZ2-CG 4.04Å; W227-L472 HydrophobicContact CE3-CD2 4.31Å; W227-L472 HydrophobicContact CH2-CD2 3.4Å; W227-L472 VanDerWaalsContact CH2-CD2 3.4Å; W227-L472 HydrophobicContact CZ2-CD2 4.32Å; W227-L472 HydrophobicContact CZ3-CD2 3.39Å
228	G	92.9	Very high	92.6	Very high	25 Å²	25	45.5 Å²	45.5	26%	0.258	22%	0.224	S	C	.	.	S	Bend	trans	79.4	-173	-167.3	0	0	0	0	0	112.2	K288 S290	G228-K288 WeakPolarHBondContact CA-O 3.36Å; G228-K288 PolarHBondContact N-O 2.94Å; G228-S290 PolarHBondContact O-OG 2.77Å
229	K	92.6	Very high	92.8	Very high	111 Å²	111	47 Å²	47	48%	0.483	24%	0.237	S	C	.	.			trans	-129	145	172.7	65.9	179.7	178.6	-175.8	0	111	I281 E284	K229-I281 HydrophobicContact CB-CD1 4.3Å; K229-E284 WeakPolarHBondContact CD-OE1 3.01Å; K229-E284 IonicContact NZ-OE1 3.45Å; K229-E284 PolarHBondContact NZ-OE1 3.47Å; K229-E284 IonicContact NZ-OE2 2.76Å; K229-E284 PolarHBondContact NZ-OE2 2.92Å
230	P	93.5	Very high	93	Very high	4 Å²	4	47 Å²	47	3%	0.026	24%	0.237	C	C	.	.			trans	-50.6	143.3	168.5	-27.2	34.9	0	0	0	111.6	Q232 H279 I281 V292 L308 E311	P230-Q232 WeakPolarHBondContact CB-O 3Å; P230-Q232 PolarHBondContact O-N 3.06Å; P230-H279 WeakPolarHBondContact CB-NE2 3.37Å; P230-I281 HydrophobicContact CB-CD1 4.36Å; P230-I281 HydrophobicContact CG-CD1 4.29Å; P230-I281 HydrophobicContact CG-CG1 4.17Å; P230-V292 HydrophobicContact CG-CG2 3.85Å; P230-L308 HydrophobicContact CG-CD2 4.22Å; P230-E311 CarbonylContact C-O 3.57Å; P230-E311 WeakPolarHBondContact CA-O 3.03Å; P230-E311 HydrophobicContact CB-CB 3.92Å
231	Q	91.5	Very high	93	Very high	139 Å²	139	47.5 Å²	47.5	65%	0.65	24%	0.24	S	C	*	.	S	Bend	trans	-57.1	-34.3	176.2	-76.9	172.9	8.1	0	0	112.4	E311	Q231-E311 WeakPolarHBondContact CG-O 3.11Å; Q231-E311 PolarHBondContact N-O 3.15Å
232	Q	90.3	Very high	93	Very high	87 Å²	87	47.1 Å²	47.1	41%	0.407	24%	0.239	S	C	.	.	S	Bend	trans	-100.6	138.5	176.6	-57.8	-178.4	0.9	0	0	109.2	P230 Q234 H279	P230-Q232 WeakPolarHBondContact CB-O 3Å; P230-Q232 PolarHBondContact O-N 3.06Å; Q232-Q234 VanDerWaalsContact C-N 3.31Å; Q232-H279 PolarHBondContact O-NE2 2.95Å
233	I	90	Very high	92.8	Very high	126 Å²	126	47.2 Å²	47.2	65%	0.646	24%	0.239	S	C	*	.	S	Bend	trans	-67.7	-39.6	173.9	-62.7	170.4	0	0	0	110.3	I281	I233-I281 WeakPolarHBondContact O-CG1 3.22Å; I233-I281 PolarHBondContact O-N 3.14Å
234	Q	92.2	Very high	92.5	Very high	125 Å²	125	48.8 Å²	48.8	58%	0.584	25%	0.252	S	S	*	.	B	Isolated β-bridge	trans	-146	129.3	178.2	-175.4	178.2	16	0	0	108.2	Q232 T280	Q232-Q234 VanDerWaalsContact C-N 3.31Å; Q234-T280 HydrophobicContact CB-CG2 4.45Å; Q234-T280 HydrophobicContact CG-CG2 4.22Å
235	S	91.3	Very high	92.2	Very high	5 Å²	5	52.9 Å²	52.9	4%	0.035	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-90.4	169.3	174.5	65.3	0	0	0	0	111.2	H278 H279 Y307	S235-H278 PolarHBondContact O-CE1 3.05Å; S235-H278 PolarHBondContact O-ND1 3.27Å; S235-H278 PolarHBondContact OG-ND1 2.83Å; S235-H278 VanDerWaalsContact OG-ND1 3.15Å; S235-H279 PolarHBondContact N-O 2.86Å; S235-H279 PolarHBondContact OG-N 2.73Å; S235-H279 PolarHBondContact OG-ND1 3.38Å; S235-Y307 PolarHBondContact OG-OH 2.92Å
236	K	88.6	Confident	91.8	Very high	144 Å²	144	55.3 Å²	55.3	63%	0.626	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-92.7	153	160.3	-67.1	-174.1	-177.2	-176.3	0	108.8	N16 K238	N16-K236 PolarHBondContact OD1-NZ 2.77Å; K236-K238 PolarHBondContact O-N 3.42Å
237	P	86.7	Confident	91.2	Very high	74 Å²	74	57.4 Å²	57.4	48%	0.481	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-49.5	116.4	169.3	-27.6	35.5	0	0	0	110.7	L218 H278	L218-P237 HydrophobicContact CD1-CB 4.22Å; L218-P237 HydrophobicContact CD1-CG 4.16Å; P237-H278 HydrophobicContact CB-CB 4.49Å; P237-H278 HydrophobicContact CG-CB 4.23Å
238	K	88.9	Confident	90.4	Very high	62 Å²	62	59.6 Å²	59.6	27%	0.27	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	149	-176.7	66.8	-173.4	179.1	-168.8	0	110.9	K236 F240 V277 Y307 E311	K236-K238 PolarHBondContact O-N 3.42Å; K238-F240 PolarHBondContact O-N 3.19Å; K238-V277 PolarHBondContact N-O 2.54Å; K238-V277 VanDerWaalsContact N-O 3.08Å; K238-V277 PolarHBondContact O-N 3.28Å; K238-V277 VanDerWaalsContact O-N 3.08Å; K238-Y307 VanDerWaalsContact CE-CE2 3.46Å; K238-Y307 WeakPolarHBondContact CE-OH 3.32Å; K238-Y307 PolarHBondContact NZ-OH 3.24Å; K238-E311 IonicContact NZ-OE1 3.98Å; K238-E311 PolarHBondContact NZ-OE1 2.95Å
239	S	90.6	Very high	89.6	Confident	57 Å²	57	65.5 Å²	65.5	40%	0.399	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	120.4	169.7	179.9	0	0	0	0	109.1	E274 K275	S239-E274 VanDerWaalsContact OG-CB 3.28Å; S239-E274 WeakPolarHBondContact OG-CB 3.45Å; S239-E274 WeakPolarHBondContact OG-CG 3.4Å; S239-K275 CarbonylContact C-O 3.53Å
240	F	92.5	Very high	88.8	Confident	3 Å²	3	66.8 Å²	66.8	1%	0.013	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	117.5	177.3	-170.2	-89	0	0	0	109.5	K238 I242 R256 K275 V277 L303 V306 Y307 Y310	K238-F240 PolarHBondContact O-N 3.19Å; F240-I242 HydrophobicContact CD1-CB 4.39Å; F240-I242 PolarHBondContact O-N 3.42Å; F240-R256 HydrophobicContact CE1-CB 4Å; F240-R256 HydrophobicContact CE1-CG 4.12Å; F240-R256 HydrophobicContact CE2-CG 4.22Å; F240-R256 HydrophobicContact CZ-CB 3.73Å; F240-R256 HydrophobicContact CZ-CG 3.8Å; F240-K275 PolarHBondContact N-O 2.71Å; F240-K275 PolarHBondContact O-N 3.19Å; F240-V277 HydrophobicContact CB-CG1 3.58Å; F240-V277 HydrophobicContact CD2-CG1 4.5Å; F240-V277 HydrophobicContact CG-CG1 4.25Å; F240-L303 HydrophobicContact CD1-CD1 3.55Å; F240-L303 HydrophobicContact CE1-CD1 4.04Å; F240-L303 HydrophobicContact CG-CD1 4.31Å; F240-V306 HydrophobicContact CE1-CG1 3.97Å; F240-V306 HydrophobicContact CZ-CG1 4.08Å; F240-Y307 AromaticContact CD2-CD2 3.56Å; F240-Y307 HydrophobicContact CD2-CD2 3.56Å; F240-Y307 HydrophobicContact CD2-CE2 4.06Å; F240-Y307 AromaticContact CE2-CD2 3.72Å; F240-Y307 HydrophobicContact CE2-CD2 3.72Å; F240-Y307 HydrophobicContact CE2-CE2 4.38Å; F240-Y307 HydrophobicContact CG-CD2 4.16Å; F240-Y307 HydrophobicContact CZ-CD2 4.45Å; F240-Y310 HydrophobicContact CZ-CD2 4.09Å
241	P	93.9	Very high	88.1	Confident	11 Å²	11	66.7 Å²	66.7	7%	0.071	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	125.3	176	30.2	-32	0	0	0	109.5	R256 P257 I262 I272 L273	P241-R256 HydrophobicContact CG-CG 4.16Å; P241-R256 WeakPolarHBondContact O-CG 3.46Å; P241-P257 WeakPolarHBondContact O-CD 3.42Å; P241-I262 HydrophobicContact CB-CD1 3.81Å; P241-I262 HydrophobicContact CG-CD1 3.69Å; P241-I272 HydrophobicContact CB-CG2 4.1Å; P241-L273 WeakPolarHBondContact CA-O 3.47Å
242	I	94.1	Very high	87.9	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	138.3	175.7	-170.6	163.2	0	0	0	109.9	F240 L273 K275 Y300 R301 L303	F240-I242 HydrophobicContact CD1-CB 4.39Å; F240-I242 PolarHBondContact O-N 3.42Å; I242-L273 HydrophobicContact CG2-CB 4.17Å; I242-L273 PolarHBondContact N-O 2.95Å; I242-L273 PolarHBondContact O-N 2.99Å; I242-K275 HydrophobicContact CG2-CG 4.02Å; I242-Y300 WeakPolarHBondContact CD1-O 3.44Å; I242-Y300 HydrophobicContact CG2-CD1 4.08Å; I242-R301 HydrophobicContact CD1-CB 4.34Å; I242-L303 HydrophobicContact CB-CD1 4.33Å; I242-L303 HydrophobicContact CD1-CB 3.98Å; I242-L303 HydrophobicContact CD1-CD1 3.8Å; I242-L303 HydrophobicContact CG2-CD1 4.47Å
243	A	93.7	Very high	87.7	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.008	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	166.7	173.3	0	0	0	0	0	110.2	G254 Y255 P257 I272	A243-G254 WeakPolarHBondContact O-CA 3.35Å; A243-Y255 HydrophobicContact CB-CD1 4.27Å; A243-Y255 HydrophobicContact CB-CE1 3.65Å; A243-Y255 PolarHBondContact N-O 3.26Å; A243-Y255 WeakPolarHBondContact O-CD1 3.48Å; A243-Y255 PolarHBondContact O-N 2.94Å; A243-P257 HydrophobicContact CB-CG 3.56Å; A243-I272 HydrophobicContact CB-CG1 4.29Å
244	A	91.7	Very high	87.8	Confident	33 Å²	33	53.4 Å²	53.4	27%	0.273	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	135	173.4	0	0	0	0	0	110.1	V253 R301	A244-V253 CarbonylContact C-O 3.59Å; A244-V253 VanDerWaalsContact CA-O 3.31Å; A244-V253 WeakPolarHBondContact CA-O 3.1Å; A244-R301 HydrophobicContact CB-CG 4.42Å
245	Y	91.4	Very high	87.9	Confident	86 Å²	86	49.5 Å²	49.5	34%	0.337	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	126.5	170	-179.5	-87.7	0	0	0	108.4	L247 H252 V253 P337 S338	Y245-L247 HydrophobicContact CD1-CD2 4.02Å; Y245-L247 HydrophobicContact CD1-CG 4.38Å; Y245-L247 HydrophobicContact CE1-CD2 4Å; Y245-L247 PolarHBondContact O-N 3.19Å; Y245-H252 CarbonylContact O-C 3.59Å; Y245-H252 VanDerWaalsContact O-CA 3.25Å; Y245-H252 WeakPolarHBondContact O-CA 3.2Å; Y245-V253 HydrophobicContact CD1-CG2 4.16Å; Y245-V253 HydrophobicContact CG-CG2 4.48Å; Y245-V253 PolarHBondContact N-O 3.2Å; Y245-V253 PolarHBondContact O-N 2.87Å; Y245-P337 HydrophobicContact CD1-CB 3.84Å; Y245-P337 HydrophobicContact CD1-CG 4.08Å; Y245-P337 HydrophobicContact CD2-CB 4.32Å; Y245-P337 HydrophobicContact CD2-CG 3.65Å; Y245-P337 HydrophobicContact CE2-CG 4.28Å; Y245-P337 HydrophobicContact CG-CB 3.7Å; Y245-P337 HydrophobicContact CG-CG 3.55Å; Y245-S338 WeakPolarHBondContact OH-CB 3.37Å
246	A	89.6	Confident	88.1	Confident	51 Å²	51	54 Å²	54	42%	0.421	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	112.9	174.1	0	0	0	0	0	109.2
247	L	84.3	Confident	88.4	Confident	45 Å²	45	47.3 Å²	47.3	24%	0.236	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	-40.1	171.5	-73.4	175.8	0	0	0	110.8	Y245 L251 V253 F320 P337 I340 L342	Y245-L247 HydrophobicContact CD1-CD2 4.02Å; Y245-L247 HydrophobicContact CD1-CG 4.38Å; Y245-L247 HydrophobicContact CE1-CD2 4Å; Y245-L247 PolarHBondContact O-N 3.19Å; L247-L251 HydrophobicContact CB-CG 4.44Å; L247-L251 HydrophobicContact CD1-CD2 3.95Å; L247-L251 HydrophobicContact CD1-CG 4.08Å; L247-L251 PolarHBondContact N-O 3.4Å; L247-V253 HydrophobicContact CD1-CG1 3.51Å; L247-V253 HydrophobicContact CD1-CG2 4.31Å; L247-V253 HydrophobicContact CD2-CG2 4.36Å; L247-V253 HydrophobicContact CG-CG1 4.08Å; L247-V253 HydrophobicContact CG-CG2 4.01Å; L247-F320 HydrophobicContact CD1-CE1 4.13Å; L247-F320 HydrophobicContact CD1-CZ 3.79Å; L247-P337 VanDerWaalsContact CD2-O 3.31Å; L247-P337 WeakPolarHBondContact CD2-O 3.35Å; L247-I340 HydrophobicContact CD1-CD1 4.16Å; L247-I340 HydrophobicContact CD1-CG2 4.43Å; L247-I340 HydrophobicContact CD2-CB 4.43Å; L247-I340 HydrophobicContact CD2-CD1 4.37Å; L247-L342 HydrophobicContact CD1-CD2 3.98Å
248	H	79.1	Confident	88.6	Confident	62 Å²	62	45.9 Å²	45.9	29%	0.287	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	178.1	170.9	58.1	88.8	0	0	0	108.6	H250 L251	H248-H250 PolarHBondContact ND1-N 3.27Å; H248-H250 PolarHBondContact O-N 3.11Å; H248-L251 WeakPolarHBondContact CE1-CB 3.36Å; H248-L251 PolarHBondContact N-O 3.35Å; H248-L251 WeakPolarHBondContact NE2-CB 3.3Å; H248-L251 VanDerWaalsContact NE2-CD2 3.3Å; H248-L251 WeakPolarHBondContact NE2-CD2 3.25Å; H248-L251 PolarHBondContact O-N 3.42Å; H248-L251 VanDerWaalsContact O-O 3.12Å
249	D	76.2	Confident	88.6	Confident	150 Å²	150	48.2 Å²	48.2	80%	0.802	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-26.1	-172	-62.7	-23.1	0	0	0	114.6
250	H	74.6	Confident	88.6	Confident	138 Å²	138	53.1 Å²	53.1	64%	0.639	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	-8.5	-176.7	-52.8	-53.9	0	0	0	114	H248	H248-H250 PolarHBondContact ND1-N 3.27Å; H248-H250 PolarHBondContact O-N 3.11Å
251	L	79.8	Confident	88.5	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.01	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	125.3	-170.7	-174.4	55.3	0	0	0	112.4	A118 A122 L247 H248 F320 L342	A118-L251 WeakPolarHBondContact O-CD1 3.4Å; A122-L251 HydrophobicContact CB-CD1 3.77Å; A122-L251 HydrophobicContact CB-CD2 3.43Å; A122-L251 VanDerWaalsContact CB-CD2 3.43Å; A122-L251 HydrophobicContact CB-CG 4.14Å; L247-L251 HydrophobicContact CB-CG 4.44Å; L247-L251 HydrophobicContact CD1-CD2 3.95Å; L247-L251 HydrophobicContact CD1-CG 4.08Å; L247-L251 PolarHBondContact N-O 3.4Å; H248-L251 WeakPolarHBondContact CE1-CB 3.36Å; H248-L251 PolarHBondContact N-O 3.35Å; H248-L251 WeakPolarHBondContact NE2-CB 3.3Å; H248-L251 VanDerWaalsContact NE2-CD2 3.3Å; H248-L251 WeakPolarHBondContact NE2-CD2 3.25Å; H248-L251 PolarHBondContact O-N 3.42Å; H248-L251 VanDerWaalsContact O-O 3.12Å; L251-F320 HydrophobicContact CD1-CE1 4.24Å; L251-F320 HydrophobicContact CD1-CZ 4.13Å; L251-F320 HydrophobicContact CD2-CE1 4.38Å; L251-F320 HydrophobicContact CD2-CE2 4.33Å; L251-F320 HydrophobicContact CD2-CZ 3.54Å; L251-F320 HydrophobicContact CG-CE1 4.45Å; L251-F320 HydrophobicContact CG-CZ 4.07Å; L251-L342 HydrophobicContact CD2-CD2 4.27Å
252	H	85.4	Confident	88.3	Confident	68 Å²	68	58.9 Å²	58.9	32%	0.315	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	137.5	-177.9	-67.3	72.7	0	0	0	110.5	Y245	Y245-H252 CarbonylContact O-C 3.59Å; Y245-H252 VanDerWaalsContact O-CA 3.25Å; Y245-H252 WeakPolarHBondContact O-CA 3.2Å
253	V	87.9	Confident	88.1	Confident	3 Å²	3	61.1 Å²	61.1	2%	0.018	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	143.9	-178.4	-69.2	0	0	0	0	112.4	A244 Y245 L247 F320 P337 I340	A244-V253 CarbonylContact C-O 3.59Å; A244-V253 VanDerWaalsContact CA-O 3.31Å; A244-V253 WeakPolarHBondContact CA-O 3.1Å; Y245-V253 HydrophobicContact CD1-CG2 4.16Å; Y245-V253 HydrophobicContact CG-CG2 4.48Å; Y245-V253 PolarHBondContact N-O 3.2Å; Y245-V253 PolarHBondContact O-N 2.87Å; L247-V253 HydrophobicContact CD1-CG1 3.51Å; L247-V253 HydrophobicContact CD1-CG2 4.31Å; L247-V253 HydrophobicContact CD2-CG2 4.36Å; L247-V253 HydrophobicContact CG-CG1 4.08Å; L247-V253 HydrophobicContact CG-CG2 4.01Å; V253-F320 HydrophobicContact CG1-CD1 3.76Å; V253-F320 HydrophobicContact CG1-CE1 3.15Å; V253-F320 HydrophobicContact CG1-CZ 4.07Å; V253-P337 HydrophobicContact CG2-CB 3.77Å; V253-I340 HydrophobicContact CB-CD1 3.88Å; V253-I340 HydrophobicContact CG1-CD1 3.62Å; V253-I340 HydrophobicContact CG2-CD1 3.71Å
254	G	91.8	Very high	87.9	Confident	1 Å²	1	69.6 Å²	69.6	1%	0.01	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	138.6	167.9	0	0	0	0	0	111	A243 R301 V306 Q321 R324	A243-G254 WeakPolarHBondContact O-CA 3.35Å; G254-R301 WeakPolarHBondContact CA-O 3.35Å; G254-V306 WeakPolarHBondContact O-CG2 3.37Å; G254-Q321 PolarHBondContact O-NE2 3.49Å; G254-R324 PolarHBondContact O-NH1 2.88Å
255	Y	94.7	Very high	88	Confident	44 Å²	44	71 Å²	71	17%	0.173	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	159.3	165	75.5	-73.1	0	0	0	110	A243 P257 P337	A243-Y255 HydrophobicContact CB-CD1 4.27Å; A243-Y255 HydrophobicContact CB-CE1 3.65Å; A243-Y255 PolarHBondContact N-O 3.26Å; A243-Y255 WeakPolarHBondContact O-CD1 3.48Å; A243-Y255 PolarHBondContact O-N 2.94Å; Y255-P257 HydrophobicContact CE2-CB 4.23Å; Y255-P257 HydrophobicContact CE2-CG 4.16Å; Y255-P257 WeakPolarHBondContact O-CD 3.36Å; Y255-P337 HydrophobicContact CD1-CG 4.18Å; Y255-P337 HydrophobicContact CD2-CG 4.16Å; Y255-P337 HydrophobicContact CG-CB 4.41Å; Y255-P337 HydrophobicContact CG-CG 3.87Å
256	R	94.7	Very high	87.9	Confident	98 Å²	98	69.6 Å²	69.6	37%	0.37	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-86.2	116.8	169.2	-172.4	-173.4	179.6	171.4	-3.6	108.7	F240 P241 Y310	F240-R256 HydrophobicContact CE1-CB 4Å; F240-R256 HydrophobicContact CE1-CG 4.12Å; F240-R256 HydrophobicContact CE2-CG 4.22Å; F240-R256 HydrophobicContact CZ-CB 3.73Å; F240-R256 HydrophobicContact CZ-CG 3.8Å; P241-R256 HydrophobicContact CG-CG 4.16Å; P241-R256 WeakPolarHBondContact O-CG 3.46Å; R256-Y310 HydrophobicContact CB-CD2 3.75Å; R256-Y310 HydrophobicContact CB-CE1 4.2Å; R256-Y310 HydrophobicContact CB-CE2 3.29Å; R256-Y310 HydrophobicContact CB-CG 4.38Å; R256-Y310 HydrophobicContact CG-CE2 4.48Å; R256-Y310 PolarHBondContact O-OH 3.11Å
257	P	93.9	Very high	87.9	Confident	4 Å²	4	70.6 Å²	70.6	3%	0.026	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-63.1	149.6	174.6	-22.6	35.1	0	0	0	112.1	P241 A243 Y255 E261 I262 I272	P241-P257 WeakPolarHBondContact O-CD 3.42Å; A243-P257 HydrophobicContact CB-CG 3.56Å; Y255-P257 HydrophobicContact CE2-CB 4.23Å; Y255-P257 HydrophobicContact CE2-CG 4.16Å; Y255-P257 WeakPolarHBondContact O-CD 3.36Å; P257-E261 VanDerWaalsContact CA-OE2 3.24Å; P257-E261 WeakPolarHBondContact CA-OE2 3.23Å; P257-E261 HydrophobicContact CB-CB 3.95Å; P257-E261 WeakPolarHBondContact CB-OE2 3.45Å; P257-I262 HydrophobicContact CB-CG1 4.02Å; P257-I272 HydrophobicContact CB-CD1 4.34Å; P257-I272 HydrophobicContact CG-CD1 4.22Å; P257-I272 HydrophobicContact CG-CG1 4.21Å; P257-I272 HydrophobicContact CG-CG2 4.34Å
258	S	91.2	Very high	88	Confident	44 Å²	44	75.9 Å²	75.9	31%	0.308	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-68.5	154.4	171.7	69.7	0	0	0	0	110.6	N260 E261 I262	S258-N260 PolarHBondContact O-N 2.97Å; S258-E261 PolarHBondContact N-OE2 3.36Å; S258-E261 VanDerWaalsContact N-OE2 3.09Å; S258-E261 WeakPolarHBondContact O-CB 3.27Å; S258-E261 PolarHBondContact O-N 3.05Å; S258-E261 WeakPolarHBondContact OG-CG 3.3Å; S258-E261 PolarHBondContact OG-OE1 3.06Å; S258-I262 WeakPolarHBondContact O-CG1 3.41Å; S258-I262 PolarHBondContact O-N 3.43Å
259	P	89.8	Confident	88.5	Confident	111 Å²	111	80.2 Å²	80.2	72%	0.721	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-29.6	178.5	-28.2	36	0	0	0	114.2	I262	P259-I262 PolarHBondContact O-N 3.31Å
260	N	90.6	Very high	89	Confident	160 Å²	160	74.8 Å²	74.8	86%	0.856	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-26.8	179.2	-61.2	-15.5	0	0	0	113	S258 I262	S258-N260 PolarHBondContact O-N 2.97Å; N260-I262 VanDerWaalsContact C-N 3.34Å
261	E	89.4	Confident	89.7	Confident	83 Å²	83	71.8 Å²	71.8	39%	0.388	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-19.4	174.8	-71.6	153.8	-143.3	0	0	112.1	P257 S258 S263 L266 I272	P257-E261 VanDerWaalsContact CA-OE2 3.24Å; P257-E261 WeakPolarHBondContact CA-OE2 3.23Å; P257-E261 HydrophobicContact CB-CB 3.95Å; P257-E261 WeakPolarHBondContact CB-OE2 3.45Å; S258-E261 PolarHBondContact N-OE2 3.36Å; S258-E261 VanDerWaalsContact N-OE2 3.09Å; S258-E261 WeakPolarHBondContact O-CB 3.27Å; S258-E261 PolarHBondContact O-N 3.05Å; S258-E261 WeakPolarHBondContact OG-CG 3.3Å; S258-E261 PolarHBondContact OG-OE1 3.06Å; E261-S263 PolarHBondContact O-N 3.39Å; E261-L266 WeakPolarHBondContact O-CD1 3.07Å; E261-I272 WeakPolarHBondContact O-CD1 3.47Å
262	I	89.5	Confident	90.2	Very high	52 Å²	52	72 Å²	72	27%	0.267	38%	0.379	S	S	.	.			trans	-80.7	93.6	-176.1	-58.7	170.6	0	0	0	110	P241 P257 S258 P259 N260 K267 I272	P241-I262 HydrophobicContact CB-CD1 3.81Å; P241-I262 HydrophobicContact CG-CD1 3.69Å; P257-I262 HydrophobicContact CB-CG1 4.02Å; S258-I262 WeakPolarHBondContact O-CG1 3.41Å; S258-I262 PolarHBondContact O-N 3.43Å; P259-I262 PolarHBondContact O-N 3.31Å; N260-I262 VanDerWaalsContact C-N 3.34Å; I262-K267 VanDerWaalsContact CG2-CE 3.42Å; I262-I272 HydrophobicContact CB-CD1 4.49Å; I262-I272 HydrophobicContact CG1-CD1 4.29Å
263	S	91.3	Very high	90.5	Very high	47 Å²	47	70.8 Å²	70.8	33%	0.329	38%	0.375	S	S	.	.			trans	-105.6	151.6	171.7	76.4	0	0	0	0	112.6	E261 S265 L266 K267	E261-S263 PolarHBondContact O-N 3.39Å; S263-S265 PolarHBondContact O-N 3.31Å; S263-L266 PolarHBondContact O-N 2.9Å; S263-L266 VanDerWaalsContact OG-CG 3.32Å; S263-L266 WeakPolarHBondContact OG-CG 3.11Å; S263-L266 PolarHBondContact OG-N 2.95Å; S263-K267 PolarHBondContact O-N 2.79Å; S263-K267 VanDerWaalsContact O-N 3.13Å
264	K	90	Very high	90.6	Very high	179 Å²	179	75 Å²	75	78%	0.778	39%	0.394	S	S	*	.	H	α-helix	trans	-58.3	-36.4	173.5	-69.7	-177.9	-178.5	176	0	111.9	K267 L268	K264-K267 PolarHBondContact O-N 3.41Å; K264-L268 VanDerWaalsContact O-CG 3.3Å; K264-L268 WeakPolarHBondContact O-CG 3.37Å; K264-L268 PolarHBondContact O-N 3.09Å
265	S	92.2	Very high	90.6	Very high	64 Å²	64	75.6 Å²	75.6	45%	0.448	40%	0.396	S	S	.	.	H	α-helix	trans	-61.8	-46.1	177.6	-177.7	0	0	0	0	111.8	S263 K267 L268 K269	S263-S265 PolarHBondContact O-N 3.31Å; S265-K267 VanDerWaalsContact C-N 3.35Å; S265-K267 PolarHBondContact O-N 2.9Å; S265-L268 PolarHBondContact O-N 3.14Å; S265-K269 WeakPolarHBondContact O-CG 3.31Å; S265-K269 PolarHBondContact O-N 3.4Å
266	L	90.2	Very high	90.5	Very high	56 Å²	56	75.5 Å²	75.5	29%	0.293	40%	0.398	S	S	.	.	H	α-helix	trans	-68.1	-33.5	178.5	-69.9	174.3	0	0	0	112.9	E261 S263 G270 V271 I272	E261-L266 WeakPolarHBondContact O-CD1 3.07Å; S263-L266 PolarHBondContact O-N 2.9Å; S263-L266 VanDerWaalsContact OG-CG 3.32Å; S263-L266 WeakPolarHBondContact OG-CG 3.11Å; S263-L266 PolarHBondContact OG-N 2.95Å; L266-G270 PolarHBondContact O-N 3.48Å; L266-V271 HydrophobicContact CB-CB 4.37Å; L266-V271 HydrophobicContact CD2-CB 4.11Å; L266-V271 HydrophobicContact CD2-CG1 4.21Å; L266-V271 HydrophobicContact CD2-CG2 4.16Å; L266-V271 PolarHBondContact O-N 2.93Å; L266-I272 HydrophobicContact CB-CD1 3.92Å; L266-I272 HydrophobicContact CB-CG1 4.13Å; L266-I272 HydrophobicContact CD1-CD1 4.05Å; L266-I272 PolarHBondContact O-N 3.37Å
267	K	88.6	Confident	90.5	Very high	71 Å²	71	70.8 Å²	70.8	31%	0.309	38%	0.381	S	S	.	.	H	α-helix	trans	-63.7	-46.8	170.9	-70.1	-175.4	176.5	-168.2	0	111.9	I262 S263 K264 S265 K269 G270 I272 E274	I262-K267 VanDerWaalsContact CG2-CE 3.42Å; S263-K267 PolarHBondContact O-N 2.79Å; S263-K267 VanDerWaalsContact O-N 3.13Å; K264-K267 PolarHBondContact O-N 3.41Å; S265-K267 VanDerWaalsContact C-N 3.35Å; S265-K267 PolarHBondContact O-N 2.9Å; K267-K269 VanDerWaalsContact C-N 3.29Å; K267-K269 PolarHBondContact O-N 2.88Å; K267-G270 PolarHBondContact O-N 3.24Å; K267-I272 HydrophobicContact CG-CB 4.41Å; K267-E274 IonicContact NZ-OE1 3.49Å; K267-E274 PolarHBondContact NZ-OE1 3.03Å; K267-E274 IonicContact NZ-OE2 3.47Å; K267-E274 PolarHBondContact NZ-OE2 2.57Å
268	L	87.8	Confident	90.4	Very high	156 Å²	156	71.2 Å²	71.2	82%	0.817	38%	0.382	S	S	*	.	H	α-helix	trans	-63.7	-34.6	178.8	-72.3	170.9	0	0	0	112.4	K264 S265 G270	K264-L268 VanDerWaalsContact O-CG 3.3Å; K264-L268 WeakPolarHBondContact O-CG 3.37Å; K264-L268 PolarHBondContact O-N 3.09Å; S265-L268 PolarHBondContact O-N 3.14Å; L268-G270 PolarHBondContact O-N 3.27Å
269	K	88.9	Confident	90.7	Very high	153 Å²	153	69.1 Å²	69.1	67%	0.665	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-7.3	173.4	-69.7	-179.5	-179.1	-173	0	113.8	S265 K267 V271	S265-K269 WeakPolarHBondContact O-CG 3.31Å; S265-K269 PolarHBondContact O-N 3.4Å; K267-K269 VanDerWaalsContact C-N 3.29Å; K267-K269 PolarHBondContact O-N 2.88Å; K269-V271 VanDerWaalsContact C-N 3.25Å; K269-V271 HydrophobicContact CB-CG2 3.98Å; K269-V271 PolarHBondContact O-N 2.76Å
270	G	85.9	Confident	91	Very high	37 Å²	37	64.9 Å²	64.9	38%	0.381	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.8	13.1	-177.1	0	0	0	0	0	114.7	L266 K267 L268	L266-G270 PolarHBondContact O-N 3.48Å; K267-G270 PolarHBondContact O-N 3.24Å; L268-G270 PolarHBondContact O-N 3.27Å
271	V	89.4	Confident	91.3	Very high	75 Å²	75	58.3 Å²	58.3	46%	0.455	30%	0.304	S	S	.	.	S	Bend	trans	-73.3	-38.1	177.7	178.9	0	0	0	0	110.8	L266 K269	L266-V271 HydrophobicContact CB-CB 4.37Å; L266-V271 HydrophobicContact CD2-CB 4.11Å; L266-V271 HydrophobicContact CD2-CG1 4.21Å; L266-V271 HydrophobicContact CD2-CG2 4.16Å; L266-V271 PolarHBondContact O-N 2.93Å; K269-V271 VanDerWaalsContact C-N 3.25Å; K269-V271 HydrophobicContact CB-CG2 3.98Å; K269-V271 PolarHBondContact O-N 2.76Å
272	I	91.1	Very high	91.6	Very high	7 Å²	7	57 Å²	57	4%	0.036	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	120	173.4	-59.6	175.8	0	0	0	107.7	P241 A243 P257 E261 I262 L266 K267	P241-I272 HydrophobicContact CB-CG2 4.1Å; A243-I272 HydrophobicContact CB-CG1 4.29Å; P257-I272 HydrophobicContact CB-CD1 4.34Å; P257-I272 HydrophobicContact CG-CD1 4.22Å; P257-I272 HydrophobicContact CG-CG1 4.21Å; P257-I272 HydrophobicContact CG-CG2 4.34Å; E261-I272 WeakPolarHBondContact O-CD1 3.47Å; I262-I272 HydrophobicContact CB-CD1 4.49Å; I262-I272 HydrophobicContact CG1-CD1 4.29Å; L266-I272 HydrophobicContact CB-CD1 3.92Å; L266-I272 HydrophobicContact CB-CG1 4.13Å; L266-I272 HydrophobicContact CD1-CD1 4.05Å; L266-I272 PolarHBondContact O-N 3.37Å; K267-I272 HydrophobicContact CG-CB 4.41Å
273	L	91	Very high	91.8	Very high	42 Å²	42	55.7 Å²	55.7	22%	0.22	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	136.7	177.3	-57.8	-179	0	0	0	109.9	P241 I242 Y300	P241-L273 WeakPolarHBondContact CA-O 3.47Å; I242-L273 HydrophobicContact CG2-CB 4.17Å; I242-L273 PolarHBondContact N-O 2.95Å; I242-L273 PolarHBondContact O-N 2.99Å; L273-Y300 HydrophobicContact CD1-CD1 3.89Å; L273-Y300 HydrophobicContact CD1-CD2 4.32Å; L273-Y300 HydrophobicContact CD1-CE1 3.77Å; L273-Y300 HydrophobicContact CD1-CE2 4.22Å; L273-Y300 HydrophobicContact CD1-CG 4.16Å
274	E	90.5	Very high	92	Very high	91 Å²	91	57.8 Å²	57.8	43%	0.425	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	113.1	173.2	-82.2	-171.6	139.7	0	0	109.2	S239 K267	S239-E274 VanDerWaalsContact OG-CB 3.28Å; S239-E274 WeakPolarHBondContact OG-CB 3.45Å; S239-E274 WeakPolarHBondContact OG-CG 3.4Å; K267-E274 IonicContact NZ-OE1 3.49Å; K267-E274 PolarHBondContact NZ-OE1 3.03Å; K267-E274 IonicContact NZ-OE2 3.47Å; K267-E274 PolarHBondContact NZ-OE2 2.57Å
275	K	92.4	Very high	92.1	Very high	14 Å²	14	49.9 Å²	49.9	6%	0.061	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	141.1	-176.9	-61.4	-52.7	-173.4	-163	0	110.7	M210 S239 F240 I242 N297 L303	M210-K275 PolarHBondContact O-NZ 2.8Å; S239-K275 CarbonylContact C-O 3.53Å; F240-K275 PolarHBondContact N-O 2.71Å; F240-K275 PolarHBondContact O-N 3.19Å; I242-K275 HydrophobicContact CG2-CG 4.02Å; K275-N297 WeakPolarHBondContact CA-OD1 3.09Å; K275-N297 WeakPolarHBondContact CB-OD1 3.26Å; K275-L303 HydrophobicContact CB-CD2 3.49Å; K275-L303 VanDerWaalsContact CB-CD2 3.49Å; K275-L303 HydrophobicContact CG-CD2 4.07Å
276	L	92.5	Very high	91.9	Very high	41 Å²	41	51.4 Å²	51.4	22%	0.215	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	128.8	-180	-72.2	170.3	0	0	0	109.3	D217 L218 T296 N297	D217-L276 HydrophobicContact CB-CD1 3.43Å; D217-L276 VanDerWaalsContact CB-CD1 3.43Å; D217-L276 WeakPolarHBondContact OD2-CD1 3.49Å; L218-L276 HydrophobicContact CD2-CB 3.87Å; L218-L276 WeakPolarHBondContact CD2-O 3.32Å; L276-T296 WeakPolarHBondContact O-CA 3.18Å; L276-T296 PolarHBondContact O-OG1 2.75Å; L276-N297 HydrophobicContact CB-CB 4.46Å; L276-N297 PolarHBondContact N-OD1 3.05Å; L276-N297 PolarHBondContact O-N 2.83Å; L276-N297 VanDerWaalsContact O-N 3.08Å; L276-N297 PolarHBondContact O-OD1 2.82Å
277	V	93.8	Very high	91.7	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	146.3	-179.5	63.4	0	0	0	0	110.1	K238 F240 L294 E295 Y307	K238-V277 PolarHBondContact N-O 2.54Å; K238-V277 VanDerWaalsContact N-O 3.08Å; K238-V277 PolarHBondContact O-N 3.28Å; K238-V277 VanDerWaalsContact O-N 3.08Å; F240-V277 HydrophobicContact CB-CG1 3.58Å; F240-V277 HydrophobicContact CD2-CG1 4.5Å; F240-V277 HydrophobicContact CG-CG1 4.25Å; V277-L294 HydrophobicContact CG2-CD1 4.11Å; V277-L294 HydrophobicContact CG2-CD2 3.94Å; V277-L294 HydrophobicContact CG2-CG 4Å; V277-E295 WeakPolarHBondContact CA-O 3.34Å; V277-Y307 HydrophobicContact CB-CD2 4.31Å; V277-Y307 HydrophobicContact CB-CE2 4.49Å; V277-Y307 HydrophobicContact CG1-CD2 3.41Å; V277-Y307 VanDerWaalsContact CG1-CD2 3.41Å; V277-Y307 HydrophobicContact CG1-CE2 3.49Å; V277-Y307 VanDerWaalsContact CG1-CE2 3.49Å; V277-Y307 HydrophobicContact CG1-CG 4.1Å; V277-Y307 HydrophobicContact CG2-CD1 3.84Å; V277-Y307 HydrophobicContact CG2-CD2 3.94Å; V277-Y307 HydrophobicContact CG2-CE1 4.1Å; V277-Y307 HydrophobicContact CG2-CE2 4.2Å; V277-Y307 HydrophobicContact CG2-CG 3.76Å
278	H	93.1	Very high	91.8	Very high	13 Å²	13	59 Å²	59	6%	0.06	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	147.2	177.3	169.7	48	0	0	0	108.5	L218 S235 P237 T280 L294 E295	L218-H278 HydrophobicContact CD1-CB 4.03Å; S235-H278 PolarHBondContact O-CE1 3.05Å; S235-H278 PolarHBondContact O-ND1 3.27Å; S235-H278 PolarHBondContact OG-ND1 2.83Å; S235-H278 VanDerWaalsContact OG-ND1 3.15Å; P237-H278 HydrophobicContact CB-CB 4.49Å; P237-H278 HydrophobicContact CG-CB 4.23Å; H278-T280 PolarHBondContact NE2-OG1 2.83Å; H278-L294 CarbonylContact O-C 3.52Å; H278-L294 WeakPolarHBondContact O-CA 3.34Å; H278-E295 PolarHBondContact N-O 3.21Å; H278-E295 PolarHBondContact O-N 3Å
279	H	96.3	Very high	92.2	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	156.1	173	78.7	-93.6	0	0	0	111.8	P230 Q232 S235 V292 K293 Y307 E311	P230-H279 WeakPolarHBondContact CB-NE2 3.37Å; Q232-H279 PolarHBondContact O-NE2 2.95Å; S235-H279 PolarHBondContact N-O 2.86Å; S235-H279 PolarHBondContact OG-N 2.73Å; S235-H279 PolarHBondContact OG-ND1 3.38Å; H279-V292 HydrophobicContact CB-CG1 3.77Å; H279-K293 CarbonylContact C-O 3.54Å; H279-K293 VanDerWaalsContact CA-O 3.22Å; H279-K293 WeakPolarHBondContact CA-O 3.16Å; H279-Y307 HydrophobicContact CB-CE1 4.03Å; H279-Y307 PolarHBondContact CE1-OH 3.01Å; H279-Y307 AromaticContact CG-CE1 3.98Å; H279-Y307 AromaticContact ND1-CE1 3.34Å; H279-Y307 VanDerWaalsContact ND1-CE1 3.34Å; H279-Y307 WeakPolarHBondContact ND1-CE1 3.46Å; H279-Y307 AromaticContact ND1-CZ 3.52Å; H279-Y307 PolarHBondContact ND1-OH 3.23Å; H279-E311 IonicContact CE1-OE1 3.56Å; H279-E311 IonicContact CE1-OE2 3.62Å
280	T	96.1	Very high	92.6	Very high	22 Å²	22	44.4 Å²	44.4	14%	0.135	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	129.5	169.5	-52.4	0	0	0	0	108	Q234 H278 L282 K293	Q234-T280 HydrophobicContact CB-CG2 4.45Å; Q234-T280 HydrophobicContact CG-CG2 4.22Å; H278-T280 PolarHBondContact NE2-OG1 2.83Å; T280-L282 PolarHBondContact O-N 3.3Å; T280-K293 PolarHBondContact N-O 3.06Å; T280-K293 PolarHBondContact O-N 3.01Å
281	I	96.6	Very high	93.1	Very high	22 Å²	22	42.6 Å²	42.6	11%	0.113	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	125.2	169.7	-58.8	179.3	0	0	0	107.9	K229 P230 I233 E284	K229-I281 HydrophobicContact CB-CD1 4.3Å; P230-I281 HydrophobicContact CB-CD1 4.36Å; P230-I281 HydrophobicContact CG-CD1 4.29Å; P230-I281 HydrophobicContact CG-CG1 4.17Å; I233-I281 WeakPolarHBondContact O-CG1 3.22Å; I233-I281 PolarHBondContact O-N 3.14Å; I281-E284 HydrophobicContact CG2-CG 4.07Å
282	L	95.4	Very high	93.5	Very high	55 Å²	55	39 Å²	39	29%	0.288	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	-39.9	178	-64	-176.3	0	0	0	111.9	L223 T280 L291 K293 F476	L223-L282 HydrophobicContact CD2-CD1 3.52Å; T280-L282 PolarHBondContact O-N 3.3Å; L282-L291 HydrophobicContact CB-CD2 4.15Å; L282-L291 HydrophobicContact CB-CG 4.24Å; L282-L291 HydrophobicContact CD1-CD2 4.05Å; L282-L291 HydrophobicContact CD1-CG 4.25Å; L282-L291 PolarHBondContact N-O 3.06Å; L282-K293 HydrophobicContact CD1-CB 3.94Å; L282-K293 HydrophobicContact CD2-CB 3.99Å; L282-K293 HydrophobicContact CG-CB 3.88Å; L282-F476 HydrophobicContact CB-CE2 4.49Å; L282-F476 HydrophobicContact CD1-CE2 3.77Å; L282-F476 HydrophobicContact CD1-CZ 4.04Å
283	S	95.4	Very high	93.8	Very high	25 Å²	25	40.1 Å²	40.1	18%	0.175	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	150.8	-178	-173.3	0	0	0	0	110.1	S290 L291 E475	S283-S290 WeakPolarHBondContact O-CA 3.44Å; S283-L291 PolarHBondContact N-O 3.05Å; S283-L291 PolarHBondContact O-N 2.91Å; S283-E475 WeakPolarHBondContact CB-O 3.29Å; S283-E475 PolarHBondContact OG-O 3.08Å
284	E	95.1	Very high	94.1	Very high	91 Å²	91	38.1 Å²	38.1	43%	0.425	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	140.3	176.2	-66.7	-170.3	-162.2	0	0	109	K229 I281	K229-E284 WeakPolarHBondContact CD-OE1 3.01Å; K229-E284 IonicContact NZ-OE1 3.45Å; K229-E284 PolarHBondContact NZ-OE1 3.47Å; K229-E284 IonicContact NZ-OE2 2.76Å; K229-E284 PolarHBondContact NZ-OE2 2.92Å; I281-E284 HydrophobicContact CG2-CG 4.07Å
285	G	91.9	Very high	94.3	Very high	13 Å²	13	35 Å²	35	13%	0.134	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	158	179.4	0	0	0	0	0	113	K287 K288 S289 L472 G473	G285-K287 PolarHBondContact O-N 2.81Å; G285-K287 VanDerWaalsContact O-N 3.11Å; G285-K288 PolarHBondContact O-N 3.26Å; G285-S289 WeakPolarHBondContact CA-OG 3.36Å; G285-S289 PolarHBondContact N-O 3.19Å; G285-L472 WeakPolarHBondContact CA-O 3.34Å; G285-G473 WeakPolarHBondContact CA-O 3.3Å
286	S	88.5	Confident	94.4	Very high	95 Å²	95	34.3 Å²	34.3	66%	0.664	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-22.5	-180	65.8	0	0	0	0	114.3	K288 L472	S286-K288 PolarHBondContact O-N 3.27Å; S286-L472 PolarHBondContact N-O 3.29Å
287	K	86.4	Confident	94.5	Very high	105 Å²	105	32.4 Å²	32.4	46%	0.457	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	33.2	-174.5	-61	-61.1	-175.3	179.4	0	114	G285 S289 I353 L472	G285-K287 PolarHBondContact O-N 2.81Å; G285-K287 VanDerWaalsContact O-N 3.11Å; K287-S289 VanDerWaalsContact C-N 3.26Å; K287-S289 PolarHBondContact O-N 3.28Å; K287-I353 HydrophobicContact CB-CD1 4.34Å; K287-I353 HydrophobicContact CB-CG2 4.45Å; K287-I353 HydrophobicContact CD-CD1 4.12Å; K287-I353 HydrophobicContact CD-CG1 4.43Å; K287-I353 HydrophobicContact CG-CD1 4.3Å; K287-I353 HydrophobicContact CG-CG2 4.02Å; K287-L472 HydrophobicContact CB-CD2 4.28Å
288	K	90.3	Very high	94.4	Very high	181 Å²	181	32.4 Å²	32.4	79%	0.787	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.4	49.1	-172.6	-57.9	177	-179.2	173.4	0	110.4	G228 G285 S286	G228-K288 WeakPolarHBondContact CA-O 3.36Å; G228-K288 PolarHBondContact N-O 2.94Å; G285-K288 PolarHBondContact O-N 3.26Å; S286-K288 PolarHBondContact O-N 3.27Å
289	S	95.5	Very high	94.3	Very high	3 Å²	3	32.8 Å²	32.8	2%	0.021	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	161	-179.2	52.4	0	0	0	0	109.5	C226 G285 K287	C226-S289 CarbonylContact O-C 3.34Å; C226-S289 VanDerWaalsContact O-CA 3.23Å; C226-S289 WeakPolarHBondContact O-CA 3.23Å; C226-S289 WeakPolarHBondContact O-CB 3.08Å; G285-S289 WeakPolarHBondContact CA-OG 3.36Å; G285-S289 PolarHBondContact N-O 3.19Å; K287-S289 VanDerWaalsContact C-N 3.26Å; K287-S289 PolarHBondContact O-N 3.28Å
290	S	96.9	Very high	93.9	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	147.9	177.6	55.7	0	0	0	0	111.7	C226 G228 S283	C226-S290 PolarHBondContact N-O 3.49Å; C226-S290 PolarHBondContact O-N 3.13Å; G228-S290 PolarHBondContact O-OG 2.77Å; S283-S290 WeakPolarHBondContact O-CA 3.44Å
291	L	98	Very high	93.4	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	123.2	164.9	174.8	68.9	0	0	0	108.6	L223 V225 L282 S283 F465 L469 I474 F476	L223-L291 HydrophobicContact CB-CD1 4.36Å; V225-L291 HydrophobicContact CG2-CD1 4.33Å; L282-L291 HydrophobicContact CB-CD2 4.15Å; L282-L291 HydrophobicContact CB-CG 4.24Å; L282-L291 HydrophobicContact CD1-CD2 4.05Å; L282-L291 HydrophobicContact CD1-CG 4.25Å; L282-L291 PolarHBondContact N-O 3.06Å; S283-L291 PolarHBondContact N-O 3.05Å; S283-L291 PolarHBondContact O-N 2.91Å; L291-F465 HydrophobicContact CD1-CE1 4Å; L291-F465 HydrophobicContact CD1-CZ 4.04Å; L291-L469 HydrophobicContact CB-CD2 4.36Å; L291-L469 HydrophobicContact CD1-CD2 4.26Å; L291-I474 HydrophobicContact CB-CG2 3.9Å; L291-F476 HydrophobicContact CD2-CB 3.8Å; L291-F476 HydrophobicContact CD2-CD1 3.41Å; L291-F476 VanDerWaalsContact CD2-CD1 3.41Å; L291-F476 HydrophobicContact CD2-CD2 3.46Å; L291-F476 VanDerWaalsContact CD2-CD2 3.46Å; L291-F476 HydrophobicContact CD2-CE1 3.73Å; L291-F476 HydrophobicContact CD2-CE2 3.8Å; L291-F476 HydrophobicContact CD2-CG 3.25Å; L291-F476 HydrophobicContact CD2-CZ 3.92Å
292	V	97.7	Very high	93.1	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	130.2	-176.1	-178.2	0	0	0	0	109.7	I224 P230 H279 L308	I224-V292 PolarHBondContact N-O 3.43Å; I224-V292 PolarHBondContact O-N 3.38Å; P230-V292 HydrophobicContact CG-CG2 3.85Å; H279-V292 HydrophobicContact CB-CG1 3.77Å; V292-L308 HydrophobicContact CG1-CD2 4.18Å
293	K	97.1	Very high	93	Very high	30 Å²	30	36.8 Å²	36.8	13%	0.13	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	116.9	162.9	-177.5	-173.6	61.9	151.4	0	108.4	L222 L223 H279 T280 L282 E295 W481	L222-K293 CarbonylContact O-C 3.53Å; L222-K293 WeakPolarHBondContact O-CA 3.29Å; L223-K293 HydrophobicContact CD2-CB 4.4Å; H279-K293 CarbonylContact C-O 3.54Å; H279-K293 VanDerWaalsContact CA-O 3.22Å; H279-K293 WeakPolarHBondContact CA-O 3.16Å; T280-K293 PolarHBondContact N-O 3.06Å; T280-K293 PolarHBondContact O-N 3.01Å; L282-K293 HydrophobicContact CD1-CB 3.94Å; L282-K293 HydrophobicContact CD2-CB 3.99Å; L282-K293 HydrophobicContact CG-CB 3.88Å; K293-E295 WeakPolarHBondContact CE-OE1 3.22Å; K293-E295 HydrophobicContact CG-CG 4.5Å; K293-E295 IonicContact NZ-OE1 2.87Å; K293-E295 PolarHBondContact NZ-OE1 3.16Å; K293-W481 HydrophobicContact CD-CZ2 4Å
294	L	97.1	Very high	93.1	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	124.2	176.1	-172	148.9	0	0	0	110.1	K221 L222 I224 V277 H278 T296 P304 Y307 L308	K221-L294 CarbonylContact C-O 3.19Å; K221-L294 WeakPolarHBondContact CA-O 3.38Å; L222-L294 HydrophobicContact CB-CB 4.44Å; L222-L294 HydrophobicContact CD1-CD2 4.09Å; L222-L294 PolarHBondContact N-O 3.47Å; L222-L294 PolarHBondContact O-N 2.87Å; I224-L294 HydrophobicContact CD1-CB 3.74Å; I224-L294 HydrophobicContact CD1-CD1 4Å; I224-L294 HydrophobicContact CD1-CG 4.36Å; V277-L294 HydrophobicContact CG2-CD1 4.11Å; V277-L294 HydrophobicContact CG2-CD2 3.94Å; V277-L294 HydrophobicContact CG2-CG 4Å; H278-L294 CarbonylContact O-C 3.52Å; H278-L294 WeakPolarHBondContact O-CA 3.34Å; L294-T296 HydrophobicContact CD2-CG2 3.71Å; L294-P304 HydrophobicContact CD1-CB 4.25Å; L294-P304 HydrophobicContact CD2-CB 4.39Å; L294-P304 HydrophobicContact CD2-CG 4.46Å; L294-Y307 HydrophobicContact CD1-CD1 3.61Å; L294-Y307 HydrophobicContact CD1-CE1 4.27Å; L294-Y307 HydrophobicContact CD1-CG 4.44Å; L294-L308 HydrophobicContact CD1-CD1 4.34Å; L294-L308 HydrophobicContact CD1-CD2 4.39Å; L294-L308 HydrophobicContact CD1-CG 4.13Å
295	E	94.8	Very high	93.1	Very high	24 Å²	24	32 Å²	32	11%	0.112	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	129.6	175.4	-49.6	-168.3	-162.3	0	0	108.1	L218 Q220 K221 V277 H278 K293	L218-E295 HydrophobicContact CB-CB 4.14Å; L218-E295 HydrophobicContact CD1-CB 4.07Å; Q220-E295 WeakPolarHBondContact O-CA 3.44Å; K221-E295 HydrophobicContact CB-CG 4.34Å; K221-E295 HydrophobicContact CD-CG 4.34Å; K221-E295 HydrophobicContact CG-CG 3.9Å; V277-E295 WeakPolarHBondContact CA-O 3.34Å; H278-E295 PolarHBondContact N-O 3.21Å; H278-E295 PolarHBondContact O-N 3Å; K293-E295 WeakPolarHBondContact CE-OE1 3.22Å; K293-E295 HydrophobicContact CG-CG 4.5Å; K293-E295 IonicContact NZ-OE1 2.87Å; K293-E295 PolarHBondContact NZ-OE1 3.16Å
296	T	94.8	Very high	93.3	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	156.4	-174.1	-179.6	0	0	0	0	112.1	Q220 L222 L276 L294 S298 L299 L303	Q220-T296 HydrophobicContact CG-CG2 3.87Å; Q220-T296 WeakPolarHBondContact CG-O 3.4Å; Q220-T296 PolarHBondContact O-N 2.71Å; Q220-T296 VanDerWaalsContact O-N 3.11Å; L222-T296 HydrophobicContact CD1-CG2 4.31Å; L276-T296 WeakPolarHBondContact O-CA 3.18Å; L276-T296 PolarHBondContact O-OG1 2.75Å; L294-T296 HydrophobicContact CD2-CG2 3.71Å; T296-S298 WeakPolarHBondContact CG2-O 3.47Å; T296-S298 PolarHBondContact OG1-N 2.78Å; T296-S298 VanDerWaalsContact OG1-N 3.09Å; T296-S298 PolarHBondContact OG1-O 3.04Å; T296-L299 HydrophobicContact CG2-CD2 3.96Å; T296-L303 WeakPolarHBondContact OG1-CD2 3.27Å
297	N	93.5	Very high	93.7	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.005	12%	0.119	C	C	.	.	S	Bend	trans	-95.9	3	170.5	82.5	-27.5	0	0	0	113.7	A209 M210 D217 Y219 K275 L276	A209-N297 PolarHBondContact O-ND2 2.96Å; M210-N297 WeakPolarHBondContact CG-O 3.45Å; M210-N297 PolarHBondContact O-ND2 3.41Å; D217-N297 HydrophobicContact CB-CB 4.36Å; D217-N297 WeakPolarHBondContact O-CA 2.88Å; D217-N297 WeakPolarHBondContact O-CB 3.48Å; Y219-N297 HydrophobicContact CD1-CB 4.49Å; Y219-N297 HydrophobicContact CE1-CB 4.49Å; Y219-N297 VanDerWaalsContact CE1-O 3.22Å; Y219-N297 WeakPolarHBondContact CE1-O 3.19Å; K275-N297 WeakPolarHBondContact CA-OD1 3.09Å; K275-N297 WeakPolarHBondContact CB-OD1 3.26Å; L276-N297 HydrophobicContact CB-CB 4.46Å; L276-N297 PolarHBondContact N-OD1 3.05Å; L276-N297 PolarHBondContact O-N 2.83Å; L276-N297 VanDerWaalsContact O-N 3.08Å; L276-N297 PolarHBondContact O-OD1 2.82Å
298	S	91.7	Very high	94.2	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.097	C	C	.	.			trans	-161.8	152.7	-176.8	-163.6	0	0	0	0	112.5	T296 Y300 L303	T296-S298 WeakPolarHBondContact CG2-O 3.47Å; T296-S298 PolarHBondContact OG1-N 2.78Å; T296-S298 VanDerWaalsContact OG1-N 3.09Å; T296-S298 PolarHBondContact OG1-O 3.04Å; S298-Y300 VanDerWaalsContact OG-CB 3.3Å; S298-Y300 WeakPolarHBondContact OG-CB 3.41Å; S298-Y300 PolarHBondContact OG-N 3.01Å; S298-L303 WeakPolarHBondContact O-CD2 3.4Å
299	L	91.9	Very high	94.4	Very high	21 Å²	21	13.4 Å²	13.4	11%	0.11	6%	0.06	C	C	.	.			trans	-113	15.8	167.9	-53.5	177.5	0	0	0	111.4	L182 P183 Y186 L222 T296 R301 G302 P304	L182-L299 HydrophobicContact CD1-CD1 3.44Å; L182-L299 VanDerWaalsContact CD1-CD1 3.44Å; P183-L299 HydrophobicContact CG-CB 4.2Å; P183-L299 HydrophobicContact CG-CD1 4.27Å; Y186-L299 HydrophobicContact CD2-CD1 4.22Å; Y186-L299 HydrophobicContact CE2-CB 4.47Å; Y186-L299 HydrophobicContact CE2-CD1 4.16Å; Y186-L299 HydrophobicContact CE2-CD2 4.25Å; L222-L299 HydrophobicContact CD1-CD2 3.69Å; L222-L299 HydrophobicContact CD2-CD2 4.44Å; T296-L299 HydrophobicContact CG2-CD2 3.96Å; L299-R301 PolarHBondContact O-N 3.03Å; L299-G302 PolarHBondContact O-N 2.83Å; L299-P304 HydrophobicContact CD2-CG 3.75Å
300	Y	87.2	Confident	94.4	Very high	75 Å²	75	16.3 Å²	16.3	29%	0.294	7%	0.071	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	126.6	-174.8	179.3	-99.1	0	0	0	111.5	I242 L273 S298 G302 L303	I242-Y300 WeakPolarHBondContact CD1-O 3.44Å; I242-Y300 HydrophobicContact CG2-CD1 4.08Å; L273-Y300 HydrophobicContact CD1-CD1 3.89Å; L273-Y300 HydrophobicContact CD1-CD2 4.32Å; L273-Y300 HydrophobicContact CD1-CE1 3.77Å; L273-Y300 HydrophobicContact CD1-CE2 4.22Å; L273-Y300 HydrophobicContact CD1-CG 4.16Å; S298-Y300 VanDerWaalsContact OG-CB 3.3Å; S298-Y300 WeakPolarHBondContact OG-CB 3.41Å; S298-Y300 PolarHBondContact OG-N 3.01Å; Y300-G302 PolarHBondContact O-N 2.54Å; Y300-G302 VanDerWaalsContact O-N 3.17Å; Y300-L303 WeakPolarHBondContact O-CB 3.36Å; Y300-L303 PolarHBondContact O-N 2.87Å; Y300-L303 VanDerWaalsContact O-N 3.08Å
301	R	86.1	Confident	94.2	Very high	93 Å²	93	16.6 Å²	16.6	35%	0.351	7%	0.073	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	34.5	174.6	-65.5	-70.4	-172.7	-165	1.7	114.6	I242 A244 G254 L299	I242-R301 HydrophobicContact CD1-CB 4.34Å; A244-R301 HydrophobicContact CB-CG 4.42Å; G254-R301 WeakPolarHBondContact CA-O 3.35Å; L299-R301 PolarHBondContact O-N 3.03Å
302	G	90.2	Very high	94	Very high	15 Å²	15	17.3 Å²	17.3	16%	0.155	8%	0.08	C	C	.	.	S	Bend	trans	70.3	42.3	-179	0	0	0	0	0	112.1	L299 Y300 P304 E305 V306	L299-G302 PolarHBondContact O-N 2.83Å; Y300-G302 PolarHBondContact O-N 2.54Å; Y300-G302 VanDerWaalsContact O-N 3.17Å; G302-P304 VanDerWaalsContact C-CD 3.48Å; G302-P304 VanDerWaalsContact C-N 3.34Å; G302-E305 WeakPolarHBondContact CA-OE2 3.43Å; G302-E305 PolarHBondContact O-N 2.86Å; G302-V306 VanDerWaalsContact O-CG2 3.32Å; G302-V306 WeakPolarHBondContact O-CG2 3.35Å; G302-V306 PolarHBondContact O-N 3.32Å
303	L	94.1	Very high	93.9	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-52.2	-45.8	178.5	176.3	66.3	0	0	0	112.6	F240 I242 K275 T296 S298 Y300 E305 V306 Y307	F240-L303 HydrophobicContact CD1-CD1 3.55Å; F240-L303 HydrophobicContact CE1-CD1 4.04Å; F240-L303 HydrophobicContact CG-CD1 4.31Å; I242-L303 HydrophobicContact CB-CD1 4.33Å; I242-L303 HydrophobicContact CD1-CB 3.98Å; I242-L303 HydrophobicContact CD1-CD1 3.8Å; I242-L303 HydrophobicContact CG2-CD1 4.47Å; K275-L303 HydrophobicContact CB-CD2 3.49Å; K275-L303 VanDerWaalsContact CB-CD2 3.49Å; K275-L303 HydrophobicContact CG-CD2 4.07Å; T296-L303 WeakPolarHBondContact OG1-CD2 3.27Å; S298-L303 WeakPolarHBondContact O-CD2 3.4Å; Y300-L303 WeakPolarHBondContact O-CB 3.36Å; Y300-L303 PolarHBondContact O-N 2.87Å; Y300-L303 VanDerWaalsContact O-N 3.08Å; L303-E305 VanDerWaalsContact C-N 3.34Å; L303-E305 PolarHBondContact O-N 2.95Å; L303-V306 PolarHBondContact O-N 2.76Å; L303-Y307 WeakPolarHBondContact O-CB 3.45Å; L303-Y307 PolarHBondContact O-N 2.71Å
304	P	96	Very high	93.8	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-56.7	-45.7	177.9	-25.6	35.4	0	0	0	113.2	L222 I224 L294 L299 G302 Y307 L308 I368	L222-P304 HydrophobicContact CD1-CB 4Å; L222-P304 HydrophobicContact CD1-CG 3.49Å; L222-P304 VanDerWaalsContact CD1-CG 3.49Å; I224-P304 HydrophobicContact CD1-CB 3.93Å; L294-P304 HydrophobicContact CD1-CB 4.25Å; L294-P304 HydrophobicContact CD2-CB 4.39Å; L294-P304 HydrophobicContact CD2-CG 4.46Å; L299-P304 HydrophobicContact CD2-CG 3.75Å; G302-P304 VanDerWaalsContact C-CD 3.48Å; G302-P304 VanDerWaalsContact C-N 3.34Å; P304-Y307 PolarHBondContact O-N 3.12Å; P304-L308 WeakPolarHBondContact O-CB 3.26Å; P304-L308 VanDerWaalsContact O-CG 3.29Å; P304-L308 WeakPolarHBondContact O-CG 3.06Å; P304-L308 PolarHBondContact O-N 3.41Å; P304-I368 HydrophobicContact CB-CD1 4.32Å
305	E	95.6	Very high	93.8	Very high	17 Å²	17	16.9 Å²	16.9	8%	0.079	8%	0.08	C	C	.	.	H	α-helix	trans	-64.8	-51.1	179.8	-61.1	86	149.3	0	0	111.1	Y186 G302 L303 Y307 L308 L309 V315 E318 Q321 I368	Y186-E305 WeakPolarHBondContact CE1-OE1 3.44Å; Y186-E305 PolarHBondContact OH-OE1 2.84Å; Y186-E305 PolarHBondContact OH-OE2 3.45Å; G302-E305 WeakPolarHBondContact CA-OE2 3.43Å; G302-E305 PolarHBondContact O-N 2.86Å; L303-E305 VanDerWaalsContact C-N 3.34Å; L303-E305 PolarHBondContact O-N 2.95Å; E305-Y307 VanDerWaalsContact C-N 3.28Å; E305-Y307 PolarHBondContact O-N 3.27Å; E305-L308 PolarHBondContact O-N 2.64Å; E305-L309 WeakPolarHBondContact O-CB 3.38Å; E305-L309 PolarHBondContact O-N 3.37Å; E305-V315 HydrophobicContact CG-CG2 4.39Å; E305-E318 HydrophobicContact CG-CG 3.77Å; E305-Q321 HydrophobicContact CB-CB 4.16Å; E305-Q321 HydrophobicContact CB-CG 3.95Å; E305-I368 HydrophobicContact CG-CD1 4.21Å
306	V	95.7	Very high	93.7	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-61.6	-42.7	179.2	175	0	0	0	0	109.7	F240 G254 G302 L303 L309 Y310 Q321	F240-V306 HydrophobicContact CE1-CG1 3.97Å; F240-V306 HydrophobicContact CZ-CG1 4.08Å; G254-V306 WeakPolarHBondContact O-CG2 3.37Å; G302-V306 VanDerWaalsContact O-CG2 3.32Å; G302-V306 WeakPolarHBondContact O-CG2 3.35Å; G302-V306 PolarHBondContact O-N 3.32Å; L303-V306 PolarHBondContact O-N 2.76Å; V306-L309 WeakPolarHBondContact O-CB 3.34Å; V306-L309 PolarHBondContact O-N 3.29Å; V306-Y310 HydrophobicContact CG1-CD2 3.96Å; V306-Y310 HydrophobicContact CG1-CE2 3.98Å; V306-Y310 VanDerWaalsContact O-CD2 3.26Å; V306-Y310 WeakPolarHBondContact O-CD2 3.29Å; V306-Y310 PolarHBondContact O-N 3.29Å; V306-Y310 VanDerWaalsContact O-N 3.15Å; V306-Q321 HydrophobicContact CG2-CG 4.25Å; V306-Q321 VanDerWaalsContact CG2-NE2 3.35Å
307	Y	96.7	Very high	93.5	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-59	-52.2	178.5	176.6	-99.9	0	0	0	111.6	S235 K238 F240 V277 H279 L294 L303 P304 E305 L309 Y310 E311	S235-Y307 PolarHBondContact OG-OH 2.92Å; K238-Y307 VanDerWaalsContact CE-CE2 3.46Å; K238-Y307 WeakPolarHBondContact CE-OH 3.32Å; K238-Y307 PolarHBondContact NZ-OH 3.24Å; F240-Y307 AromaticContact CD2-CD2 3.56Å; F240-Y307 HydrophobicContact CD2-CD2 3.56Å; F240-Y307 HydrophobicContact CD2-CE2 4.06Å; F240-Y307 AromaticContact CE2-CD2 3.72Å; F240-Y307 HydrophobicContact CE2-CD2 3.72Å; F240-Y307 HydrophobicContact CE2-CE2 4.38Å; F240-Y307 HydrophobicContact CG-CD2 4.16Å; F240-Y307 HydrophobicContact CZ-CD2 4.45Å; V277-Y307 HydrophobicContact CB-CD2 4.31Å; V277-Y307 HydrophobicContact CB-CE2 4.49Å; V277-Y307 HydrophobicContact CG1-CD2 3.41Å; V277-Y307 VanDerWaalsContact CG1-CD2 3.41Å; V277-Y307 HydrophobicContact CG1-CE2 3.49Å; V277-Y307 VanDerWaalsContact CG1-CE2 3.49Å; V277-Y307 HydrophobicContact CG1-CG 4.1Å; V277-Y307 HydrophobicContact CG2-CD1 3.84Å; V277-Y307 HydrophobicContact CG2-CD2 3.94Å; V277-Y307 HydrophobicContact CG2-CE1 4.1Å; V277-Y307 HydrophobicContact CG2-CE2 4.2Å; V277-Y307 HydrophobicContact CG2-CG 3.76Å; H279-Y307 HydrophobicContact CB-CE1 4.03Å; H279-Y307 PolarHBondContact CE1-OH 3.01Å; H279-Y307 AromaticContact CG-CE1 3.98Å; H279-Y307 AromaticContact ND1-CE1 3.34Å; H279-Y307 VanDerWaalsContact ND1-CE1 3.34Å; H279-Y307 WeakPolarHBondContact ND1-CE1 3.46Å; H279-Y307 AromaticContact ND1-CZ 3.52Å; H279-Y307 PolarHBondContact ND1-OH 3.23Å; L294-Y307 HydrophobicContact CD1-CD1 3.61Å; L294-Y307 HydrophobicContact CD1-CE1 4.27Å; L294-Y307 HydrophobicContact CD1-CG 4.44Å; L303-Y307 WeakPolarHBondContact O-CB 3.45Å; L303-Y307 PolarHBondContact O-N 2.71Å; P304-Y307 PolarHBondContact O-N 3.12Å; E305-Y307 VanDerWaalsContact C-N 3.28Å; E305-Y307 PolarHBondContact O-N 3.27Å; Y307-L309 VanDerWaalsContact C-N 3.33Å; Y307-L309 PolarHBondContact O-N 2.89Å; Y307-Y310 PolarHBondContact O-N 2.75Å; Y307-E311 HydrophobicContact CD1-CG 4.37Å; Y307-E311 HydrophobicContact CE1-CG 3.81Å; Y307-E311 HydrophobicContact CE2-CG 4.37Å; Y307-E311 VanDerWaalsContact CZ-OE1 3.29Å; Y307-E311 PolarHBondContact O-N 2.68Å; Y307-E311 VanDerWaalsContact O-N 3.11Å; Y307-E311 PolarHBondContact OH-OE1 2.85Å
308	L	96.7	Very high	93.3	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-66.2	-34.9	-179.5	-70.7	170.7	0	0	0	112.7	I224 P230 V292 L294 P304 E305 Y310 E311 G312 C313 V315	I224-L308 HydrophobicContact CB-CD1 4.25Å; I224-L308 HydrophobicContact CD1-CD1 3.74Å; I224-L308 HydrophobicContact CG2-CD1 3.7Å; P230-L308 HydrophobicContact CG-CD2 4.22Å; V292-L308 HydrophobicContact CG1-CD2 4.18Å; L294-L308 HydrophobicContact CD1-CD1 4.34Å; L294-L308 HydrophobicContact CD1-CD2 4.39Å; L294-L308 HydrophobicContact CD1-CG 4.13Å; P304-L308 WeakPolarHBondContact O-CB 3.26Å; P304-L308 VanDerWaalsContact O-CG 3.29Å; P304-L308 WeakPolarHBondContact O-CG 3.06Å; P304-L308 PolarHBondContact O-N 3.41Å; E305-L308 PolarHBondContact O-N 2.64Å; L308-Y310 VanDerWaalsContact C-N 3.29Å; L308-Y310 PolarHBondContact O-N 2.8Å; L308-E311 CarbonylContact O-C 3.49Å; L308-E311 WeakPolarHBondContact O-CA 3.14Å; L308-E311 PolarHBondContact O-N 3.32Å; L308-G312 PolarHBondContact O-N 2.75Å; L308-G312 VanDerWaalsContact O-N 3.12Å; L308-C313 CarbonylContact C-O 3.45Å; L308-C313 PolarHBondContact O-N 3.08Å; L308-C313 VanDerWaalsContact O-N 3.1Å; L308-C313 PolarHBondContact O-SG 3.45Å; L308-C313 VanDerWaalsContact O-SG 3.32Å; L308-V315 HydrophobicContact CD1-CG2 3.83Å
309	L	95.4	Very high	93	Very high	2 Å²	2	18.8 Å²	18.8	1%	0.01	9%	0.093	C	C	.	.	H	α-helix	trans	-54.9	-46	171.9	-174.2	74	0	0	0	111.2	E305 V306 Y307 E311 G312 C313 T314 Q321 R324 L325 V334	E305-L309 WeakPolarHBondContact O-CB 3.38Å; E305-L309 PolarHBondContact O-N 3.37Å; V306-L309 WeakPolarHBondContact O-CB 3.34Å; V306-L309 PolarHBondContact O-N 3.29Å; Y307-L309 VanDerWaalsContact C-N 3.33Å; Y307-L309 PolarHBondContact O-N 2.89Å; L309-E311 VanDerWaalsContact C-N 3.31Å; L309-E311 PolarHBondContact O-N 3.42Å; L309-G312 PolarHBondContact O-N 2.98Å; L309-G312 VanDerWaalsContact O-N 3.08Å; L309-C313 VanDerWaalsContact CA-O 3.24Å; L309-C313 WeakPolarHBondContact CA-O 3.32Å; L309-C313 PolarHBondContact N-O 3.5Å; L309-T314 HydrophobicContact CD1-CG2 4.17Å; L309-Q321 WeakPolarHBondContact CD1-O 3.31Å; L309-Q321 HydrophobicContact CD2-CB 4.34Å; L309-R324 HydrophobicContact CD2-CB 4.2Å; L309-L325 HydrophobicContact CD1-CB 3.66Å; L309-L325 HydrophobicContact CD1-CD1 4.04Å; L309-L325 HydrophobicContact CD1-CG 4.32Å; L309-V334 HydrophobicContact CD2-CG1 3.58Å; L309-V334 HydrophobicContact CG-CG1 3.91Å; L309-V334 HydrophobicContact CG-CG2 4.02Å; L309-V334 WeakPolarHBondContact O-CG2 3.29Å
310	Y	94.5	Very high	92.7	Very high	64 Å²	64	19 Å²	19	25%	0.251	9%	0.093	S	C	.	.	H	α-helix	trans	-77	-13.2	176.9	-81.9	-80.3	0	0	0	114.2	F240 R256 V306 Y307 L308 G312 V334	F240-Y310 HydrophobicContact CZ-CD2 4.09Å; R256-Y310 HydrophobicContact CB-CD2 3.75Å; R256-Y310 HydrophobicContact CB-CE1 4.2Å; R256-Y310 HydrophobicContact CB-CE2 3.29Å; R256-Y310 HydrophobicContact CB-CG 4.38Å; R256-Y310 HydrophobicContact CG-CE2 4.48Å; R256-Y310 PolarHBondContact O-OH 3.11Å; V306-Y310 HydrophobicContact CG1-CD2 3.96Å; V306-Y310 HydrophobicContact CG1-CE2 3.98Å; V306-Y310 VanDerWaalsContact O-CD2 3.26Å; V306-Y310 WeakPolarHBondContact O-CD2 3.29Å; V306-Y310 PolarHBondContact O-N 3.29Å; V306-Y310 VanDerWaalsContact O-N 3.15Å; Y307-Y310 PolarHBondContact O-N 2.75Å; L308-Y310 VanDerWaalsContact C-N 3.29Å; L308-Y310 PolarHBondContact O-N 2.8Å; Y310-G312 VanDerWaalsContact C-N 3.28Å; Y310-V334 HydrophobicContact CD1-CB 4.38Å; Y310-V334 HydrophobicContact CD1-CG2 4.1Å; Y310-V334 HydrophobicContact CE1-CB 4.08Å; Y310-V334 HydrophobicContact CE1-CG1 4.09Å; Y310-V334 HydrophobicContact CE1-CG2 4.3Å; Y310-V334 HydrophobicContact CE2-CG1 4.11Å; Y310-V334 HydrophobicContact CG-CG2 4.38Å
311	E	94.5	Very high	92.8	Very high	7 Å²	7	15.9 Å²	15.9	3%	0.033	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	0.6	165.7	-62.9	-73.6	163.2	0	0	111.8	P230 Q231 K238 H279 Y307 L308 L309	P230-E311 CarbonylContact C-O 3.57Å; P230-E311 WeakPolarHBondContact CA-O 3.03Å; P230-E311 HydrophobicContact CB-CB 3.92Å; Q231-E311 WeakPolarHBondContact CG-O 3.11Å; Q231-E311 PolarHBondContact N-O 3.15Å; K238-E311 IonicContact NZ-OE1 3.98Å; K238-E311 PolarHBondContact NZ-OE1 2.95Å; H279-E311 IonicContact CE1-OE1 3.56Å; H279-E311 IonicContact CE1-OE2 3.62Å; Y307-E311 HydrophobicContact CD1-CG 4.37Å; Y307-E311 HydrophobicContact CE1-CG 3.81Å; Y307-E311 HydrophobicContact CE2-CG 4.37Å; Y307-E311 VanDerWaalsContact CZ-OE1 3.29Å; Y307-E311 PolarHBondContact O-N 2.68Å; Y307-E311 VanDerWaalsContact O-N 3.11Å; Y307-E311 PolarHBondContact OH-OE1 2.85Å; L308-E311 CarbonylContact O-C 3.49Å; L308-E311 WeakPolarHBondContact O-CA 3.14Å; L308-E311 PolarHBondContact O-N 3.32Å; L309-E311 VanDerWaalsContact C-N 3.31Å; L309-E311 PolarHBondContact O-N 3.42Å
312	G	93.5	Very high	93	Very high	14 Å²	14	11.7 Å²	11.7	14%	0.144	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.4	19.2	172.8	0	0	0	0	0	115.5	L308 L309 Y310	L308-G312 PolarHBondContact O-N 2.75Å; L308-G312 VanDerWaalsContact O-N 3.12Å; L309-G312 PolarHBondContact O-N 2.98Å; L309-G312 VanDerWaalsContact O-N 3.08Å; Y310-G312 VanDerWaalsContact C-N 3.28Å
313	C	94.6	Very high	93	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.062	C	C	.	.			trans	-135.3	161.1	179.6	62	0	0	0	0	111.6	C226 W227 L308 L309	C226-C313 HydrophobicContact CB-CB 4.23Å; W227-C313 WeakPolarHBondContact O-CA 3.42Å; W227-C313 WeakPolarHBondContact O-CB 3.13Å; L308-C313 CarbonylContact C-O 3.45Å; L308-C313 PolarHBondContact O-N 3.08Å; L308-C313 VanDerWaalsContact O-N 3.1Å; L308-C313 PolarHBondContact O-SG 3.45Å; L308-C313 VanDerWaalsContact O-SG 3.32Å; L309-C313 VanDerWaalsContact CA-O 3.24Å; L309-C313 WeakPolarHBondContact CA-O 3.32Å; L309-C313 PolarHBondContact N-O 3.5Å
314	T	95.1	Very high	93	Very high	18 Å²	18	11.3 Å²	11.3	11%	0.11	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	151.8	178.6	59.8	0	0	0	0	110.9	C226 W227 L309 A322 L325	C226-T314 CarbonylContact C-O 3.43Å; C226-T314 WeakPolarHBondContact CA-O 3.48Å; C226-T314 WeakPolarHBondContact CB-O 3.34Å; W227-T314 PolarHBondContact N-O 3.02Å; W227-T314 PolarHBondContact O-N 2.97Å; L309-T314 HydrophobicContact CD1-CG2 4.17Å; T314-A322 HydrophobicContact CG2-CB 3.73Å; T314-L325 HydrophobicContact CG2-CB 3.75Å; T314-L325 HydrophobicContact CG2-CD2 3.59Å; T314-L325 HydrophobicContact CG2-CG 4.31Å
315	V	96.3	Very high	92.9	Very high	3 Å²	3	13.2 Å²	13.2	2%	0.018	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	135.8	-179.5	177.6	0	0	0	0	110	I224 E305 L308 G317 E318 V366 I368	I224-V315 HydrophobicContact CG2-CB 4.35Å; I224-V315 HydrophobicContact CG2-CG1 3.88Å; I224-V315 HydrophobicContact CG2-CG2 3.71Å; E305-V315 HydrophobicContact CG-CG2 4.39Å; L308-V315 HydrophobicContact CD1-CG2 3.83Å; V315-G317 PolarHBondContact O-N 3.35Å; V315-E318 HydrophobicContact CB-CB 3.84Å; V315-E318 HydrophobicContact CG1-CB 4.18Å; V315-E318 PolarHBondContact O-N 2.75Å; V315-E318 VanDerWaalsContact O-N 3.14Å; V315-V366 HydrophobicContact CG1-CG1 3.93Å; V315-I368 HydrophobicContact CG1-CD1 4.02Å; V315-I368 HydrophobicContact CG1-CG1 3.77Å; V315-I368 HydrophobicContact CG2-CD1 4.37Å
316	V	94.2	Very high	92.7	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	131.5	177.5	-178.3	0	0	0	0	110.3	V225 W227 E318 L354 I364 H367 T468 L472	V225-V316 HydrophobicContact CB-CB 4.44Å; V225-V316 HydrophobicContact CB-CG2 4.13Å; V225-V316 HydrophobicContact CG1-CG2 3.77Å; V225-V316 PolarHBondContact O-N 3.31Å; W227-V316 HydrophobicContact CD2-CG2 4.22Å; W227-V316 HydrophobicContact CG-CG2 4.22Å; V316-E318 PolarHBondContact O-N 3.44Å; V316-L354 HydrophobicContact CG1-CD1 3.9Å; V316-I364 HydrophobicContact CG1-CG2 4.24Å; V316-H367 HydrophobicContact CB-CB 4.05Å; V316-H367 WeakPolarHBondContact CG1-ND1 3.35Å; V316-H367 PolarHBondContact O-N 2.82Å; V316-H367 PolarHBondContact O-ND1 3.3Å; V316-T468 HydrophobicContact CG1-CG2 4.24Å; V316-L472 HydrophobicContact CG2-CD1 4.33Å
317	G	89.8	Confident	92.2	Very high	7 Å²	7	21.2 Å²	21.2	7%	0.072	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.6	-13	-176.3	0	0	0	0	0	114.4	V315 I364	V315-G317 PolarHBondContact O-N 3.35Å; G317-I364 WeakPolarHBondContact CA-O 3.3Å
318	E	89.9	Confident	91.8	Very high	22 Å²	22	24.7 Å²	24.7	10%	0.103	14%	0.138	C	C	.	.			trans	-89.3	118.6	176.2	-156	-78.2	147.3	0	0	109.9	E305 V315 V316 F320 Q321 A322 V366	E305-E318 HydrophobicContact CG-CG 3.77Å; V315-E318 HydrophobicContact CB-CB 3.84Å; V315-E318 HydrophobicContact CG1-CB 4.18Å; V315-E318 PolarHBondContact O-N 2.75Å; V315-E318 VanDerWaalsContact O-N 3.14Å; V316-E318 PolarHBondContact O-N 3.44Å; E318-F320 WeakPolarHBondContact OE1-CA 3.31Å; E318-F320 WeakPolarHBondContact OE1-CB 3.31Å; E318-F320 PolarHBondContact OE1-N 2.92Å; E318-Q321 VanDerWaalsContact CD-N 3.35Å; E318-Q321 PolarHBondContact OE1-N 3.45Å; E318-Q321 WeakPolarHBondContact OE2-CA 3.48Å; E318-Q321 WeakPolarHBondContact OE2-CB 3.35Å; E318-Q321 PolarHBondContact OE2-N 3.22Å; E318-A322 WeakPolarHBondContact O-CB 3.41Å; E318-A322 PolarHBondContact OE2-N 2.81Å; E318-V366 HydrophobicContact CB-CG1 4.34Å; E318-V366 HydrophobicContact CB-CG2 4.22Å; E318-V366 HydrophobicContact CG-CG2 4.38Å
319	T	86	Confident	91.1	Very high	37 Å²	37	28 Å²	28	23%	0.227	17%	0.172	C	C	.	.			trans	-104.3	-22	-175.6	52.1	0	0	0	0	113	S323 Y344 I346	T319-S323 PolarHBondContact O-N 3.15Å; T319-Y344 HydrophobicContact CG2-CD1 4.28Å; T319-Y344 WeakPolarHBondContact O-CD1 3.41Å; T319-I346 HydrophobicContact CG2-CD1 4.45Å; T319-I346 HydrophobicContact CG2-CG1 4Å
320	F	83.8	Confident	90.6	Very high	26 Å²	26	35.6 Å²	35.6	11%	0.114	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-58.9	-167.9	-146.5	-124.2	0	0	0	111.4	L247 L251 V253 E318 S323 I340 L342	L247-F320 HydrophobicContact CD1-CE1 4.13Å; L247-F320 HydrophobicContact CD1-CZ 3.79Å; L251-F320 HydrophobicContact CD1-CE1 4.24Å; L251-F320 HydrophobicContact CD1-CZ 4.13Å; L251-F320 HydrophobicContact CD2-CE1 4.38Å; L251-F320 HydrophobicContact CD2-CE2 4.33Å; L251-F320 HydrophobicContact CD2-CZ 3.54Å; L251-F320 HydrophobicContact CG-CE1 4.45Å; L251-F320 HydrophobicContact CG-CZ 4.07Å; V253-F320 HydrophobicContact CG1-CD1 3.76Å; V253-F320 HydrophobicContact CG1-CE1 3.15Å; V253-F320 HydrophobicContact CG1-CZ 4.07Å; E318-F320 WeakPolarHBondContact OE1-CA 3.31Å; E318-F320 WeakPolarHBondContact OE1-CB 3.31Å; E318-F320 PolarHBondContact OE1-N 2.92Å; F320-S323 PolarHBondContact O-OG 3.45Å; F320-I340 HydrophobicContact CD2-CG2 4.47Å; F320-I340 HydrophobicContact CE2-CG2 4.33Å; F320-I340 HydrophobicContact CZ-CG2 4.41Å; F320-L342 HydrophobicContact CD2-CD2 4.25Å; F320-L342 HydrophobicContact CE2-CD2 3.18Å; F320-L342 HydrophobicContact CZ-CD2 3.43Å; F320-L342 VanDerWaalsContact CZ-CD2 3.43Å
321	Q	90	Very high	90.1	Very high	9 Å²	9	35.2 Å²	35.2	4%	0.042	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-34.3	176.1	-62.6	-69.6	-0.8	0	0	111.1	G254 E305 V306 L309 E318 S323 R324	G254-Q321 PolarHBondContact O-NE2 3.49Å; E305-Q321 HydrophobicContact CB-CB 4.16Å; E305-Q321 HydrophobicContact CB-CG 3.95Å; V306-Q321 HydrophobicContact CG2-CG 4.25Å; V306-Q321 VanDerWaalsContact CG2-NE2 3.35Å; L309-Q321 WeakPolarHBondContact CD1-O 3.31Å; L309-Q321 HydrophobicContact CD2-CB 4.34Å; E318-Q321 VanDerWaalsContact CD-N 3.35Å; E318-Q321 PolarHBondContact OE1-N 3.45Å; E318-Q321 WeakPolarHBondContact OE2-CA 3.48Å; E318-Q321 WeakPolarHBondContact OE2-CB 3.35Å; E318-Q321 PolarHBondContact OE2-N 3.22Å; Q321-S323 PolarHBondContact O-N 2.98Å; Q321-R324 WeakPolarHBondContact O-CB 3.14Å; Q321-R324 PolarHBondContact O-N 2.77Å; Q321-R324 VanDerWaalsContact O-N 3.08Å
322	A	90.5	Very high	89.9	Confident	5 Å²	5	37.1 Å²	37.1	4%	0.041	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-56.7	-34.8	179.6	0	0	0	0	0	113.9	T314 E318 R324 L325 Y344	T314-A322 HydrophobicContact CG2-CB 3.73Å; E318-A322 WeakPolarHBondContact O-CB 3.41Å; E318-A322 PolarHBondContact OE2-N 2.81Å; A322-R324 PolarHBondContact O-N 3.03Å; A322-L325 PolarHBondContact O-N 2.71Å; A322-Y344 HydrophobicContact CB-CE1 4.3Å
323	S	90.9	Very high	89.9	Confident	7 Å²	7	40.3 Å²	40.3	5%	0.049	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-58.5	-18.1	178.3	71.7	0	0	0	0	114.7	T319 F320 Q321 R341	T319-S323 PolarHBondContact O-N 3.15Å; F320-S323 PolarHBondContact O-OG 3.45Å; Q321-S323 PolarHBondContact O-N 2.98Å; S323-R341 PolarHBondContact OG-N 2.48Å; S323-R341 VanDerWaalsContact OG-N 3.15Å
324	R	93.5	Very high	89.9	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-88.9	-13.4	-179.3	-58.5	167.9	63.1	-169.2	-4.2	113.1	G254 L309 Q321 A322 L335 I340	G254-R324 PolarHBondContact O-NH1 2.88Å; L309-R324 HydrophobicContact CD2-CB 4.2Å; Q321-R324 WeakPolarHBondContact O-CB 3.14Å; Q321-R324 PolarHBondContact O-N 2.77Å; Q321-R324 VanDerWaalsContact O-N 3.08Å; A322-R324 PolarHBondContact O-N 3.03Å; R324-L335 HydrophobicContact CB-CB 4.26Å; R324-L335 PolarHBondContact NE-O 2.84Å; R324-L335 PolarHBondContact NH2-O 2.95Å; R324-L335 WeakPolarHBondContact O-CG 3.04Å; R324-L335 PolarHBondContact O-N 2.71Å; R324-I340 VanDerWaalsContact CD-CG1 3.43Å; R324-I340 HydrophobicContact CG-CD1 4.43Å; R324-I340 HydrophobicContact CG-CG1 3.49Å; R324-I340 VanDerWaalsContact CG-CG1 3.49Å
325	L	93.5	Very high	89.8	Confident	39 Å²	39	43.2 Å²	43.2	20%	0.204	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	114.7	178.2	-159.4	66.2	0	0	0	109.4	L309 T314 A322 P332 V334	L309-L325 HydrophobicContact CD1-CB 3.66Å; L309-L325 HydrophobicContact CD1-CD1 4.04Å; L309-L325 HydrophobicContact CD1-CG 4.32Å; T314-L325 HydrophobicContact CG2-CB 3.75Å; T314-L325 HydrophobicContact CG2-CD2 3.59Å; T314-L325 HydrophobicContact CG2-CG 4.31Å; A322-L325 PolarHBondContact O-N 2.71Å; L325-P332 HydrophobicContact CD1-CB 3.87Å; L325-P332 HydrophobicContact CD2-CB 4.42Å; L325-P332 HydrophobicContact CG-CB 4.19Å; L325-V334 HydrophobicContact CD1-CG2 3.88Å
326	V	91.3	Very high	89.6	Confident	59 Å²	59	46.5 Å²	46.5	36%	0.358	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	126	175.4	-179.6	0	0	0	0	109	I333 L335	V326-I333 PolarHBondContact N-O 2.91Å; V326-I333 PolarHBondContact O-N 2.84Å; V326-L335 HydrophobicContact CG2-CD1 3.68Å; V326-L335 HydrophobicContact CG2-CD2 4.39Å; V326-L335 HydrophobicContact CG2-CG 3.94Å
327	N	86.5	Confident	89.5	Confident	127 Å²	127	47 Å²	47	68%	0.679	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	113.4	170.8	-172.5	-0.8	0	0	0	109.4	G329	N327-G329 VanDerWaalsContact C-N 3.29Å; N327-G329 PolarHBondContact OD1-N 3.46Å
328	T	86.4	Confident	89.6	Confident	72 Å²	72	49.8 Å²	49.8	44%	0.442	30%	0.302	S	S	.	.			trans	-85.8	0.3	177	61	0	0	0	0	113.6	I330 S331 I333	T328-I330 PolarHBondContact O-N 2.57Å; T328-S331 PolarHBondContact OG1-N 3.34Å; T328-S331 PolarHBondContact OG1-O 2.78Å; T328-I333 HydrophobicContact CG2-CB 4.46Å; T328-I333 HydrophobicContact CG2-CD1 3.48Å; T328-I333 VanDerWaalsContact CG2-CD1 3.48Å; T328-I333 HydrophobicContact CG2-CG1 3.86Å
329	G	82.9	Confident	89.7	Confident	69 Å²	69	55 Å²	55	71%	0.711	33%	0.325	S	S	*	.	S	Bend	trans	87.2	-25.2	-172.2	0	0	0	0	0	113.7	N327	N327-G329 VanDerWaalsContact C-N 3.29Å; N327-G329 PolarHBondContact OD1-N 3.46Å
330	I	84.1	Confident	89.8	Confident	163 Å²	163	54.1 Å²	54.1	84%	0.836	32%	0.319	S	S	*	.	S	Bend	trans	-95.6	-50.1	176.5	-57.8	171.5	0	0	0	110.4	T328	T328-I330 PolarHBondContact O-N 2.57Å
331	S	85.9	Confident	89.8	Confident	56 Å²	56	60 Å²	60	39%	0.392	34%	0.34	S	S	.	.	S	Bend	trans	-157.4	149.9	179.7	60.8	0	0	0	0	110.7	T328 I333	T328-S331 PolarHBondContact OG1-N 3.34Å; T328-S331 PolarHBondContact OG1-O 2.78Å; S331-I333 PolarHBondContact O-N 2.92Å
332	P	90.1	Very high	89.3	Confident	47 Å²	47	62.5 Å²	62.5	31%	0.305	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	132.4	172.1	26.8	-33	0	0	0	110.6	L325	L325-P332 HydrophobicContact CD1-CB 3.87Å; L325-P332 HydrophobicContact CD2-CB 4.42Å; L325-P332 HydrophobicContact CG-CB 4.19Å
333	I	92.5	Very high	88.8	Confident	80 Å²	80	68.8 Å²	68.8	41%	0.41	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	132.2	175.5	-60.7	-174.7	0	0	0	108.8	V326 T328 S331	V326-I333 PolarHBondContact N-O 2.91Å; V326-I333 PolarHBondContact O-N 2.84Å; T328-I333 HydrophobicContact CG2-CB 4.46Å; T328-I333 HydrophobicContact CG2-CD1 3.48Å; T328-I333 VanDerWaalsContact CG2-CD1 3.48Å; T328-I333 HydrophobicContact CG2-CG1 3.86Å; S331-I333 PolarHBondContact O-N 2.92Å
334	V	94.4	Very high	88.4	Confident	32 Å²	32	71.6 Å²	71.6	19%	0.194	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	116	174.3	-176.8	0	0	0	0	109.3	L309 Y310 L325	L309-V334 HydrophobicContact CD2-CG1 3.58Å; L309-V334 HydrophobicContact CG-CG1 3.91Å; L309-V334 HydrophobicContact CG-CG2 4.02Å; L309-V334 WeakPolarHBondContact O-CG2 3.29Å; Y310-V334 HydrophobicContact CD1-CB 4.38Å; Y310-V334 HydrophobicContact CD1-CG2 4.1Å; Y310-V334 HydrophobicContact CE1-CB 4.08Å; Y310-V334 HydrophobicContact CE1-CG1 4.09Å; Y310-V334 HydrophobicContact CE1-CG2 4.3Å; Y310-V334 HydrophobicContact CE2-CG1 4.11Å; Y310-V334 HydrophobicContact CG-CG2 4.38Å; L325-V334 HydrophobicContact CD1-CG2 3.88Å
335	L	93.8	Very high	87.8	Confident	48 Å²	48	74.9 Å²	74.9	25%	0.251	42%	0.419	S	S	.	.			trans	-70.3	153.6	175.7	-61.1	-179.4	0	0	0	111.7	R324 V326 K339	R324-L335 HydrophobicContact CB-CB 4.26Å; R324-L335 PolarHBondContact NE-O 2.84Å; R324-L335 PolarHBondContact NH2-O 2.95Å; R324-L335 WeakPolarHBondContact O-CG 3.04Å; R324-L335 PolarHBondContact O-N 2.71Å; V326-L335 HydrophobicContact CG2-CD1 3.68Å; V326-L335 HydrophobicContact CG2-CD2 4.39Å; V326-L335 HydrophobicContact CG2-CG 3.94Å; L335-K339 HydrophobicContact CB-CB 4.02Å; L335-K339 HydrophobicContact CD1-CB 4.23Å
336	P	92.7	Very high	87.4	Confident	71 Å²	71	73.6 Å²	73.6	46%	0.461	41%	0.412	S	S	.	.			trans	-55.3	153.2	172.3	-25.1	34.5	0	0	0	112.6	S338 K339	P336-S338 PolarHBondContact O-N 3.42Å; P336-S338 VanDerWaalsContact O-N 3.15Å; P336-K339 WeakPolarHBondContact O-CB 3.31Å; P336-K339 PolarHBondContact O-N 2.81Å
337	P	91.7	Very high	87.2	Confident	12 Å²	12	73.3 Å²	73.3	8%	0.078	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-59.5	-27.6	-179.9	24.8	-34.8	0	0	0	113.2	Y245 L247 V253 Y255 K339 I340	Y245-P337 HydrophobicContact CD1-CB 3.84Å; Y245-P337 HydrophobicContact CD1-CG 4.08Å; Y245-P337 HydrophobicContact CD2-CB 4.32Å; Y245-P337 HydrophobicContact CD2-CG 3.65Å; Y245-P337 HydrophobicContact CE2-CG 4.28Å; Y245-P337 HydrophobicContact CG-CB 3.7Å; Y245-P337 HydrophobicContact CG-CG 3.55Å; L247-P337 VanDerWaalsContact CD2-O 3.31Å; L247-P337 WeakPolarHBondContact CD2-O 3.35Å; V253-P337 HydrophobicContact CG2-CB 3.77Å; Y255-P337 HydrophobicContact CD1-CG 4.18Å; Y255-P337 HydrophobicContact CD2-CG 4.16Å; Y255-P337 HydrophobicContact CG-CB 4.41Å; Y255-P337 HydrophobicContact CG-CG 3.87Å; P337-K339 PolarHBondContact O-N 3.09Å; P337-K339 VanDerWaalsContact O-N 3.14Å; P337-I340 WeakPolarHBondContact O-CD1 3.47Å; P337-I340 VanDerWaalsContact O-CG1 3.3Å; P337-I340 WeakPolarHBondContact O-CG1 3.49Å; P337-I340 PolarHBondContact O-N 3.22Å
338	S	91.2	Very high	87.2	Confident	65 Å²	65	71.5 Å²	71.5	46%	0.455	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-65.4	-10.9	174.5	60	0	0	0	0	114.8	Y245 P336	Y245-S338 WeakPolarHBondContact OH-CB 3.37Å; P336-S338 PolarHBondContact O-N 3.42Å; P336-S338 VanDerWaalsContact O-N 3.15Å
339	K	91.2	Very high	87.3	Confident	131 Å²	131	74.9 Å²	74.9	57%	0.57	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-105.3	13.1	-178.7	-62.4	-65.9	-176.2	-179.9	0	113.3	L335 P336 P337 R341	L335-K339 HydrophobicContact CB-CB 4.02Å; L335-K339 HydrophobicContact CD1-CB 4.23Å; P336-K339 WeakPolarHBondContact O-CB 3.31Å; P336-K339 PolarHBondContact O-N 2.81Å; P337-K339 PolarHBondContact O-N 3.09Å; P337-K339 VanDerWaalsContact O-N 3.14Å; K339-R341 PolarHBondContact O-N 3.31Å
340	I	88.2	Confident	87.7	Confident	19 Å²	19	73.7 Å²	73.7	10%	0.097	39%	0.388	C	S	.	.			trans	-59.1	135.4	172.9	-73	172.1	0	0	0	110.1	L247 V253 F320 R324 P337 L342	L247-I340 HydrophobicContact CD1-CD1 4.16Å; L247-I340 HydrophobicContact CD1-CG2 4.43Å; L247-I340 HydrophobicContact CD2-CB 4.43Å; L247-I340 HydrophobicContact CD2-CD1 4.37Å; V253-I340 HydrophobicContact CB-CD1 3.88Å; V253-I340 HydrophobicContact CG1-CD1 3.62Å; V253-I340 HydrophobicContact CG2-CD1 3.71Å; F320-I340 HydrophobicContact CD2-CG2 4.47Å; F320-I340 HydrophobicContact CE2-CG2 4.33Å; F320-I340 HydrophobicContact CZ-CG2 4.41Å; R324-I340 VanDerWaalsContact CD-CG1 3.43Å; R324-I340 HydrophobicContact CG-CD1 4.43Å; R324-I340 HydrophobicContact CG-CG1 3.49Å; R324-I340 VanDerWaalsContact CG-CG1 3.49Å; P337-I340 WeakPolarHBondContact O-CD1 3.47Å; P337-I340 VanDerWaalsContact O-CG1 3.3Å; P337-I340 WeakPolarHBondContact O-CG1 3.49Å; P337-I340 PolarHBondContact O-N 3.22Å; I340-L342 HydrophobicContact CG2-CD2 3.67Å; I340-L342 HydrophobicContact CG2-CG 4.49Å
341	R	85.3	Confident	87.9	Confident	150 Å²	150	68.4 Å²	68.4	57%	0.566	36%	0.358	S	S	*	.			trans	-101	104.4	174.2	-61.8	178.3	-177	-178.7	0.4	109.1	S323 K339 N343 Y344	S323-R341 PolarHBondContact OG-N 2.48Å; S323-R341 VanDerWaalsContact OG-N 3.15Å; K339-R341 PolarHBondContact O-N 3.31Å; R341-N343 PolarHBondContact O-N 3.29Å; R341-Y344 WeakPolarHBondContact O-CB 3.25Å; R341-Y344 PolarHBondContact O-N 3.3Å; R341-Y344 VanDerWaalsContact O-N 3.11Å
342	L	79.7	Confident	88	Confident	61 Å²	61	70.8 Å²	70.8	32%	0.319	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-21.2	-175.4	-51	170.5	0	0	0	113.1	I126 L247 L251 F320 I340	I126-L342 HydrophobicContact CD1-CB 3.57Å; I126-L342 HydrophobicContact CD1-CD1 3.39Å; I126-L342 HydrophobicContact CD1-CD2 4.34Å; I126-L342 HydrophobicContact CD1-CG 3.91Å; I126-L342 HydrophobicContact CG1-CD1 4.49Å; I126-L342 HydrophobicContact CG2-CB 4.34Å; L247-L342 HydrophobicContact CD1-CD2 3.98Å; L251-L342 HydrophobicContact CD2-CD2 4.27Å; F320-L342 HydrophobicContact CD2-CD2 4.25Å; F320-L342 HydrophobicContact CE2-CD2 3.18Å; F320-L342 HydrophobicContact CZ-CD2 3.43Å; F320-L342 VanDerWaalsContact CZ-CD2 3.43Å; I340-L342 HydrophobicContact CG2-CD2 3.67Å; I340-L342 HydrophobicContact CG2-CG 4.49Å
343	N	78.6	Confident	88	Confident	137 Å²	137	70.3 Å²	70.3	73%	0.733	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	13.2	173.9	67.1	-22.7	0	0	0	113.1	R341 S345	R341-N343 PolarHBondContact O-N 3.29Å; N343-S345 PolarHBondContact O-N 3.38Å
344	Y	82.3	Confident	87.9	Confident	66 Å²	66	66.5 Å²	66.5	26%	0.259	34%	0.338	S	S	.	.			trans	-62.9	124.8	179.4	179.7	-101.7	0	0	0	110.9	T319 A322 R341 P347	T319-Y344 HydrophobicContact CG2-CD1 4.28Å; T319-Y344 WeakPolarHBondContact O-CD1 3.41Å; A322-Y344 HydrophobicContact CB-CE1 4.3Å; R341-Y344 WeakPolarHBondContact O-CB 3.25Å; R341-Y344 PolarHBondContact O-N 3.3Å; R341-Y344 VanDerWaalsContact O-N 3.11Å; Y344-P347 WeakPolarHBondContact OH-CD 3.44Å
345	S	82.3	Confident	87.5	Confident	68 Å²	68	66 Å²	66	48%	0.476	34%	0.339	S	S	.	.			trans	-105.3	150.2	169.7	54.5	0	0	0	0	110	N343	N343-S345 PolarHBondContact O-N 3.38Å
346	I	84.4	Confident	86.9	Confident	12 Å²	12	64 Å²	64	6%	0.062	33%	0.328	C	S	.	.			trans	-58.8	130.6	173.1	-64	168.5	0	0	0	108.3	T319 Q350 R351 I364	T319-I346 HydrophobicContact CG2-CD1 4.45Å; T319-I346 HydrophobicContact CG2-CG1 4Å; I346-Q350 HydrophobicContact CG2-CB 3.6Å; I346-R351 HydrophobicContact CB-CG 4.05Å; I346-R351 HydrophobicContact CG2-CG 3.89Å; I346-R351 PolarHBondContact O-NE 2.63Å; I346-I364 HydrophobicContact CD1-CB 4.02Å; I346-I364 HydrophobicContact CD1-CD1 3.5Å; I346-I364 HydrophobicContact CD1-CG1 4.24Å
347	P	87.3	Confident	86	Confident	53 Å²	53	62.7 Å²	62.7	34%	0.344	32%	0.32	S	S	.	.			trans	-49.7	145.2	177.5	-29.9	34.2	0	0	0	112.8	Y344 E349 Q350 R351	Y344-P347 WeakPolarHBondContact OH-CD 3.44Å; P347-E349 VanDerWaalsContact C-N 3.3Å; P347-E349 PolarHBondContact O-N 2.97Å; P347-Q350 HydrophobicContact CB-CG 4.48Å; P347-Q350 WeakPolarHBondContact O-CB 3.08Å; P347-Q350 PolarHBondContact O-N 2.82Å; P347-R351 PolarHBondContact O-N 3.36Å
348	L	86	Confident	84.8	Confident	89 Å²	89	67.2 Å²	67.2	47%	0.466	34%	0.344	S	S	.	.	H	α-helix	trans	-58.1	-42.2	-174.2	-177.7	62.1	0	0	0	112.8	Q350 R351 Q352 N358	L348-Q350 VanDerWaalsContact C-N 3.3Å; L348-Q350 PolarHBondContact O-N 3.09Å; L348-R351 WeakPolarHBondContact O-CB 3.33Å; L348-R351 PolarHBondContact O-N 3.17Å; L348-Q352 HydrophobicContact CD1-CG 4.43Å; L348-Q352 HydrophobicContact CG-CG 4.44Å; L348-Q352 WeakPolarHBondContact O-CG 3.15Å; L348-Q352 PolarHBondContact O-N 3.22Å; L348-N358 VanDerWaalsContact CD1-OD1 3.32Å; L348-N358 WeakPolarHBondContact CD1-OD1 3.14Å
349	E	89	Confident	83.4	Confident	144 Å²	144	71.2 Å²	71.2	67%	0.673	36%	0.36	S	S	*	.	H	α-helix	trans	-57.6	-42.9	177	-173.8	-175.5	176.3	0	0	111.9	P347 Q352 I353	P347-E349 VanDerWaalsContact C-N 3.3Å; P347-E349 PolarHBondContact O-N 2.97Å; E349-Q352 PolarHBondContact O-N 2.87Å; E349-I353 HydrophobicContact CG-CD1 4.35Å; E349-I353 VanDerWaalsContact O-CG1 3.28Å; E349-I353 WeakPolarHBondContact O-CG1 3.42Å; E349-I353 PolarHBondContact O-N 3.3Å
350	Q	90.7	Very high	82	Confident	44 Å²	44	67.3 Å²	67.3	21%	0.206	35%	0.346	C	S	.	.	H	α-helix	trans	-66.9	-40.2	177.6	-73	-178.2	-6.8	0	0	111.6	W227 I346 P347 L348 I353 L354	W227-Q350 HydrophobicContact CD2-CG 4.11Å; W227-Q350 HydrophobicContact CE3-CG 4.22Å; W227-Q350 HydrophobicContact CH2-CB 3.89Å; W227-Q350 HydrophobicContact CH2-CG 3.86Å; W227-Q350 HydrophobicContact CZ2-CB 3.56Å; W227-Q350 HydrophobicContact CZ2-CG 3.75Å; W227-Q350 HydrophobicContact CZ3-CG 4.1Å; I346-Q350 HydrophobicContact CG2-CB 3.6Å; P347-Q350 HydrophobicContact CB-CG 4.48Å; P347-Q350 WeakPolarHBondContact O-CB 3.08Å; P347-Q350 PolarHBondContact O-N 2.82Å; L348-Q350 VanDerWaalsContact C-N 3.3Å; L348-Q350 PolarHBondContact O-N 3.09Å; Q350-I353 PolarHBondContact O-N 3.43Å; Q350-L354 VanDerWaalsContact O-CG 3.31Å; Q350-L354 WeakPolarHBondContact O-CG 3.39Å; Q350-L354 PolarHBondContact O-N 3.26Å; Q350-L354 VanDerWaalsContact O-N 3.09Å
351	R	88	Confident	80.8	Confident	51 Å²	51	72.1 Å²	72.1	19%	0.192	37%	0.371	C	S	.	.	H	α-helix	trans	-62.3	-43	174.6	-73.8	-175.2	172.3	177.6	-5.6	112.4	I346 P347 L348 L354 G355 Q356 I364	I346-R351 HydrophobicContact CB-CG 4.05Å; I346-R351 HydrophobicContact CG2-CG 3.89Å; I346-R351 PolarHBondContact O-NE 2.63Å; P347-R351 PolarHBondContact O-N 3.36Å; L348-R351 WeakPolarHBondContact O-CB 3.33Å; L348-R351 PolarHBondContact O-N 3.17Å; R351-L354 CarbonylContact O-C 3.26Å; R351-L354 WeakPolarHBondContact O-CA 3.23Å; R351-L354 PolarHBondContact O-N 3.46Å; R351-L354 VanDerWaalsContact O-N 3.13Å; R351-G355 PolarHBondContact O-N 3.15Å; R351-G355 VanDerWaalsContact O-N 3.11Å; R351-Q356 HydrophobicContact CB-CB 4.2Å; R351-Q356 PolarHBondContact O-N 2.84Å; R351-I364 HydrophobicContact CG-CD1 4.38Å
352	Q	89	Confident	79.9	Confident	107 Å²	107	67.4 Å²	67.4	50%	0.5	36%	0.355	S	S	.	.	H	α-helix	trans	-62.9	-41.9	177.1	-73	175.1	-10.2	0	0	111.9	L348 E349 L354 G355	L348-Q352 HydrophobicContact CD1-CG 4.43Å; L348-Q352 HydrophobicContact CG-CG 4.44Å; L348-Q352 WeakPolarHBondContact O-CG 3.15Å; L348-Q352 PolarHBondContact O-N 3.22Å; E349-Q352 PolarHBondContact O-N 2.87Å; Q352-L354 PolarHBondContact O-N 3.17Å; Q352-G355 PolarHBondContact O-N 3.23Å
353	I	90.7	Very high	79.6	Confident	37 Å²	37	67.5 Å²	67.5	19%	0.19	36%	0.356	C	S	.	.	H	α-helix	trans	-57.8	-42	173.2	-69.7	163.7	0	0	0	110.7	W227 K287 E349 Q350 G355 L472	W227-I353 HydrophobicContact CH2-CB 4.43Å; W227-I353 HydrophobicContact CH2-CG2 4.19Å; K287-I353 HydrophobicContact CB-CD1 4.34Å; K287-I353 HydrophobicContact CB-CG2 4.45Å; K287-I353 HydrophobicContact CD-CD1 4.12Å; K287-I353 HydrophobicContact CD-CG1 4.43Å; K287-I353 HydrophobicContact CG-CD1 4.3Å; K287-I353 HydrophobicContact CG-CG2 4.02Å; E349-I353 HydrophobicContact CG-CD1 4.35Å; E349-I353 VanDerWaalsContact O-CG1 3.28Å; E349-I353 WeakPolarHBondContact O-CG1 3.42Å; E349-I353 PolarHBondContact O-N 3.3Å; Q350-I353 PolarHBondContact O-N 3.43Å; I353-G355 PolarHBondContact O-N 2.84Å; I353-L472 HydrophobicContact CG2-CD2 3.76Å
354	L	89.9	Confident	79.9	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	2.2	177	-63.8	-179.5	0	0	0	113.8	P73 Y74 W227 V316 Q350 R351 Q352 I364 T468 R471 L472	P73-L354 WeakPolarHBondContact CG-O 3.36Å; Y74-L354 HydrophobicContact CE2-CB 4.25Å; Y74-L354 WeakPolarHBondContact OH-CB 3.3Å; Y74-L354 WeakPolarHBondContact OH-CD2 3.38Å; W227-L354 HydrophobicContact CH2-CD2 4.42Å; W227-L354 HydrophobicContact CH2-CG 4.33Å; W227-L354 HydrophobicContact CZ2-CD1 3.89Å; W227-L354 HydrophobicContact CZ2-CD2 4.31Å; W227-L354 HydrophobicContact CZ2-CG 4.04Å; V316-L354 HydrophobicContact CG1-CD1 3.9Å; Q350-L354 VanDerWaalsContact O-CG 3.31Å; Q350-L354 WeakPolarHBondContact O-CG 3.39Å; Q350-L354 PolarHBondContact O-N 3.26Å; Q350-L354 VanDerWaalsContact O-N 3.09Å; R351-L354 CarbonylContact O-C 3.26Å; R351-L354 WeakPolarHBondContact O-CA 3.23Å; R351-L354 PolarHBondContact O-N 3.46Å; R351-L354 VanDerWaalsContact O-N 3.13Å; Q352-L354 PolarHBondContact O-N 3.17Å; L354-I364 HydrophobicContact CD1-CD1 3.55Å; L354-I364 HydrophobicContact CD1-CG1 4.45Å; L354-I364 HydrophobicContact CD1-CG2 4.21Å; L354-T468 HydrophobicContact CD2-CG2 3.82Å; L354-R471 WeakPolarHBondContact O-CD 3.46Å; L354-R471 PolarHBondContact O-NE 3.08Å; L354-L472 HydrophobicContact CD2-CD2 4.22Å; L354-L472 HydrophobicContact CD2-CG 4.31Å
355	G	86	Confident	80	Confident	21 Å²	21	58.2 Å²	58.2	22%	0.216	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	16.8	176.7	0	0	0	0	0	115.2	R351 Q352 I353	R351-G355 PolarHBondContact O-N 3.15Å; R351-G355 VanDerWaalsContact O-N 3.11Å; Q352-G355 PolarHBondContact O-N 3.23Å; I353-G355 PolarHBondContact O-N 2.84Å
356	Q	81.9	Confident	80.4	Confident	6 Å²	6	55.7 Å²	55.7	3%	0.028	29%	0.293	C	S	.	.			trans	-86.4	128.5	171.5	-69.2	-170.5	-26.5	0	0	110.3	Y74 R351 E362 I364	Y74-Q356 HydrophobicContact CD2-CG 4.41Å; Y74-Q356 HydrophobicContact CE2-CG 4.34Å; R351-Q356 HydrophobicContact CB-CB 4.2Å; R351-Q356 PolarHBondContact O-N 2.84Å; Q356-E362 PolarHBondContact NE2-O 3.33Å; Q356-I364 VanDerWaalsContact NE2-CG1 3.33Å
357	S	72	Confident	80.9	Confident	43 Å²	43	55.1 Å²	55.1	30%	0.301	29%	0.29	S	S	.	.			trans	-76.8	160.9	172.6	59.7	0	0	0	0	111.4	D70 N359 N360	D70-S357 WeakPolarHBondContact OD2-CB 3.37Å; D70-S357 PolarHBondContact OD2-OG 3.37Å; S357-N359 PolarHBondContact O-N 3.28Å; S357-N360 PolarHBondContact O-N 3.13Å; S357-N360 VanDerWaalsContact O-N 3.14Å; S357-N360 PolarHBondContact OG-ND2 3.22Å
358	N	66.3	Low	81.4	Confident	108 Å²	108	52.6 Å²	52.6	58%	0.578	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-26.2	179.7	-69.9	0	0	0	0	113.3	L348	L348-N358 VanDerWaalsContact CD1-OD1 3.32Å; L348-N358 WeakPolarHBondContact CD1-OD1 3.14Å
359	N	63.7	Low	81.9	Confident	148 Å²	148	48.3 Å²	48.3	79%	0.791	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-25.6	-176.4	-62.9	-12.1	0	0	0	112.5	S357 L361	S357-N359 PolarHBondContact O-N 3.28Å; N359-L361 PolarHBondContact O-N 3.36Å
360	N	60.6	Low	82.3	Confident	49 Å²	49	41.5 Å²	41.5	26%	0.262	22%	0.219	S	C	.	.			trans	-91.1	89.1	-178.2	-77.8	-19.1	0	0	0	110.7	D70 S357 E362	D70-N360 PolarHBondContact OD2-ND2 3.05Å; S357-N360 PolarHBondContact O-N 3.13Å; S357-N360 VanDerWaalsContact O-N 3.14Å; S357-N360 PolarHBondContact OG-ND2 3.22Å; N360-E362 PolarHBondContact O-N 2.9Å
361	L	63.9	Low	82.5	Confident	121 Å²	121	39.4 Å²	39.4	63%	0.634	21%	0.21	S	C	*	.			trans	-79.1	38.1	171.7	-67.3	170.9	0	0	0	112.4	N359	N359-L361 PolarHBondContact O-N 3.36Å
362	E	66.3	Low	82.7	Confident	50 Å²	50	37 Å²	37	23%	0.234	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-65.3	142.7	176.4	-68	-168.1	174.4	0	0	110.7	S72 Q356 N360 I364	S72-E362 WeakPolarHBondContact CB-OE2 3.18Å; S72-E362 PolarHBondContact OG-OE2 3.44Å; Q356-E362 PolarHBondContact NE2-O 3.33Å; N360-E362 PolarHBondContact O-N 2.9Å; E362-I364 PolarHBondContact O-N 2.93Å
363	D	73.5	Confident	82.8	Confident	63 Å²	63	32 Å²	32	34%	0.337	18%	0.177	S	C	.	.	P	Polyproline II helix	trans	-70.5	130.8	177.8	-170.5	34.4	0	0	0	110.2	Y77 P365	Y77-D363 HydrophobicContact CE2-CB 3.74Å; Y77-D363 WeakPolarHBondContact OH-CB 3.49Å; Y77-D363 PolarHBondContact OH-OD2 2.76Å; D363-P365 WeakPolarHBondContact O-CD 3.36Å
364	I	83.8	Confident	82.8	Confident	3 Å²	3	30.8 Å²	30.8	2%	0.015	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-87.1	117.2	176.2	-65.7	166.8	0	0	0	106.5	Y74 V316 G317 I346 R351 L354 Q356 E362	Y74-I364 HydrophobicContact CD2-CG1 4.37Å; Y74-I364 HydrophobicContact CE1-CG2 4.36Å; Y74-I364 HydrophobicContact CE2-CG1 4.08Å; V316-I364 HydrophobicContact CG1-CG2 4.24Å; G317-I364 WeakPolarHBondContact CA-O 3.3Å; I346-I364 HydrophobicContact CD1-CB 4.02Å; I346-I364 HydrophobicContact CD1-CD1 3.5Å; I346-I364 HydrophobicContact CD1-CG1 4.24Å; R351-I364 HydrophobicContact CG-CD1 4.38Å; L354-I364 HydrophobicContact CD1-CD1 3.55Å; L354-I364 HydrophobicContact CD1-CG1 4.45Å; L354-I364 HydrophobicContact CD1-CG2 4.21Å; Q356-I364 VanDerWaalsContact NE2-CG1 3.33Å; E362-I364 PolarHBondContact O-N 2.93Å
365	P	85.8	Confident	82.8	Confident	5 Å²	5	30.9 Å²	30.9	3%	0.032	17%	0.171	C	C	.	.	P	Polyproline II helix	trans	-58.5	150.3	179.8	-22	32.3	0	0	0	111.5	Y74 P108 D363 H367 Y464	Y74-P365 HydrophobicContact CD1-CG 4.36Å; P108-P365 HydrophobicContact CB-CB 4.22Å; P108-P365 HydrophobicContact CG-CB 4.36Å; D363-P365 WeakPolarHBondContact O-CD 3.36Å; P365-H367 PolarHBondContact O-CE1 3.1Å; P365-H367 PolarHBondContact O-N 3.02Å; P365-H367 PolarHBondContact O-ND1 3.49Å; P365-Y464 HydrophobicContact CB-CD2 4Å; P365-Y464 HydrophobicContact CB-CE2 3.77Å; P365-Y464 HydrophobicContact CG-CD2 4.11Å; P365-Y464 HydrophobicContact CG-CE2 4.38Å; P365-Y464 HydrophobicContact CG-CG 4.35Å
366	V	90.2	Very high	82.8	Confident	15 Å²	15	29.9 Å²	29.9	9%	0.091	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-65.8	124.2	173.2	177.2	0	0	0	0	109.3	A185 Y186 V315 E318 I368 Y464	A185-V366 HydrophobicContact CB-CB 4.13Å; A185-V366 HydrophobicContact CB-CG2 3.9Å; Y186-V366 HydrophobicContact CD1-CG1 4.15Å; Y186-V366 HydrophobicContact CE1-CG1 4.27Å; V315-V366 HydrophobicContact CG1-CG1 3.93Å; E318-V366 HydrophobicContact CB-CG1 4.34Å; E318-V366 HydrophobicContact CB-CG2 4.22Å; E318-V366 HydrophobicContact CG-CG2 4.38Å; V366-I368 HydrophobicContact CG1-CB 4.19Å; V366-I368 HydrophobicContact CG1-CD1 3.77Å; V366-I368 HydrophobicContact CG1-CG1 3.84Å; V366-I368 PolarHBondContact O-N 3.22Å; V366-Y464 PolarHBondContact O-OH 3.27Å
367	H	95	Very high	82.9	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.16	C	C	.	.			trans	-84.9	58.7	-177.6	-69.5	65.9	0	0	0	111.3	I224 V225 V316 P365 Y464 F465 T468	I224-H367 VanDerWaalsContact CA-O 3.31Å; I224-H367 WeakPolarHBondContact CA-O 3.45Å; V225-H367 HydrophobicContact CB-CB 3.74Å; V225-H367 HydrophobicContact CG2-CB 3.96Å; V225-H367 PolarHBondContact N-O 3.33Å; V225-H367 VanDerWaalsContact N-O 3.1Å; V316-H367 HydrophobicContact CB-CB 4.05Å; V316-H367 WeakPolarHBondContact CG1-ND1 3.35Å; V316-H367 PolarHBondContact O-N 2.82Å; V316-H367 PolarHBondContact O-ND1 3.3Å; P365-H367 PolarHBondContact O-CE1 3.1Å; P365-H367 PolarHBondContact O-N 3.02Å; P365-H367 PolarHBondContact O-ND1 3.49Å; H367-Y464 AromaticContact CD2-CE2 3.98Å; H367-Y464 AromaticContact CE1-CD2 3.95Å; H367-Y464 AromaticContact NE2-CD2 3.55Å; H367-Y464 AromaticContact NE2-CE2 3.88Å; H367-F465 HydrophobicContact CB-CD2 4.37Å; H367-F465 HydrophobicContact CB-CE2 4.25Å; H367-T468 WeakPolarHBondContact NE2-CB 3.49Å; H367-T468 WeakPolarHBondContact NE2-CG2 3.23Å; H367-T468 PolarHBondContact NE2-OG1 2.87Å
368	I	96.4	Very high	83.2	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	119.3	170.3	-65.1	171.2	0	0	0	107.4	Y186 S187 L222 I224 P304 E305 V315 V366	Y186-I368 HydrophobicContact CD1-CB 3.85Å; Y186-I368 HydrophobicContact CD1-CD1 3.97Å; Y186-I368 HydrophobicContact CD1-CG1 4.45Å; Y186-I368 HydrophobicContact CD1-CG2 4.07Å; Y186-I368 HydrophobicContact CD2-CB 4.43Å; Y186-I368 HydrophobicContact CD2-CG2 3.74Å; Y186-I368 HydrophobicContact CE1-CB 4.32Å; Y186-I368 HydrophobicContact CE1-CD1 3.54Å; Y186-I368 HydrophobicContact CE1-CG1 4.48Å; Y186-I368 HydrophobicContact CE1-CG2 4.47Å; Y186-I368 HydrophobicContact CE2-CD1 4.45Å; Y186-I368 HydrophobicContact CE2-CG2 4.14Å; Y186-I368 HydrophobicContact CG-CB 3.96Å; Y186-I368 HydrophobicContact CG-CG2 3.73Å; S187-I368 PolarHBondContact N-O 3.19Å; S187-I368 PolarHBondContact OG-O 2.77Å; L222-I368 HydrophobicContact CB-CG2 4.32Å; L222-I368 HydrophobicContact CD1-CG2 3.98Å; L222-I368 HydrophobicContact CD2-CG2 4.38Å; L222-I368 HydrophobicContact CG-CG2 4.46Å; I224-I368 HydrophobicContact CD1-CG1 4.25Å; I224-I368 HydrophobicContact CG1-CG1 4.06Å; I224-I368 HydrophobicContact CG1-CG2 4.37Å; I224-I368 HydrophobicContact CG2-CG1 3.91Å; P304-I368 HydrophobicContact CB-CD1 4.32Å; E305-I368 HydrophobicContact CG-CD1 4.21Å; V315-I368 HydrophobicContact CG1-CD1 4.02Å; V315-I368 HydrophobicContact CG1-CG1 3.77Å; V315-I368 HydrophobicContact CG2-CD1 4.37Å; V366-I368 HydrophobicContact CG1-CB 4.19Å; V366-I368 HydrophobicContact CG1-CD1 3.77Å; V366-I368 HydrophobicContact CG1-CG1 3.84Å; V366-I368 PolarHBondContact O-N 3.22Å
369	H	96.9	Very high	83.5	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	119.9	177.8	-178.5	75.9	0	0	0	110.9	D105 S187 G188 L222 L223 S371 S458 L461 F465	D105-H369 IonicContact OD1-CE1 3.93Å; D105-H369 IonicContact OD2-CE1 3.59Å; S187-H369 CarbonylContact O-C 3.33Å; S187-H369 VanDerWaalsContact O-CA 3.32Å; S187-H369 WeakPolarHBondContact O-CA 3.3Å; S187-H369 PolarHBondContact OG-ND1 2.91Å; G188-H369 WeakPolarHBondContact CA-CE1 3.3Å; L222-H369 CarbonylContact C-O 3.48Å; L222-H369 VanDerWaalsContact CA-O 3.3Å; L222-H369 WeakPolarHBondContact CA-O 3.3Å; L223-H369 PolarHBondContact N-O 2.77Å; L223-H369 PolarHBondContact O-N 2.77Å; H369-S371 PolarHBondContact O-N 2.95Å; H369-S458 WeakPolarHBondContact NE2-CB 3.5Å; H369-S458 PolarHBondContact NE2-OG 3.49Å; H369-L461 HydrophobicContact CB-CD2 4.49Å; H369-F465 HydrophobicContact CB-CD2 4.08Å; H369-F465 HydrophobicContact CB-CE2 3.87Å
370	R	96.9	Very high	83.6	Confident	0 Å²	0	18 Å²	18	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	90.2	173.3	-176.3	160.3	70.2	-175.2	-0.5	110.1	E180 S181 L182 S187 G188 L189 L222	E180-R370 PolarHBondContact O-NH2 3.25Å; E180-R370 IonicContact OE1-NH1 3.01Å; E180-R370 PolarHBondContact OE1-NH1 3.12Å; S181-R370 PolarHBondContact O-NH1 3.29Å; S181-R370 PolarHBondContact O-NH2 3.36Å; L182-R370 HydrophobicContact CD1-CB 4.06Å; L182-R370 HydrophobicContact CD2-CB 4.49Å; S187-R370 PolarHBondContact O-N 3.37Å; G188-R370 WeakPolarHBondContact CA-O 3.41Å; L189-R370 WeakPolarHBondContact CG-O 3.23Å; L189-R370 PolarHBondContact N-O 3.15Å; L189-R370 PolarHBondContact O-NE 3.47Å; L189-R370 PolarHBondContact O-NH2 3.05Å; L222-R370 HydrophobicContact CD2-CB 3.64Å; L222-R370 HydrophobicContact CD2-CG 3.92Å
371	S	94.7	Very high	83.7	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	-20.1	-178.3	60.5	0	0	0	0	113.8	K221 H369 H457 S458	K221-S371 PolarHBondContact O-N 3.41Å; K221-S371 VanDerWaalsContact O-N 3.15Å; H369-S371 PolarHBondContact O-N 2.95Å; S371-H457 CarbonylContact O-C 3.57Å; S371-H457 VanDerWaalsContact O-CA 3.26Å; S371-H457 WeakPolarHBondContact O-CA 3.19Å; S371-S458 PolarHBondContact O-N 3.01Å
372	H	92.6	Very high	83.5	Confident	2 Å²	2	18.1 Å²	18.1	1%	0.009	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	140.7	-174.2	-172.5	82.7	0	0	0	113.2	Q220 K221 Y374 T455 C456 H457	Q220-H372 WeakPolarHBondContact CA-O 3.25Å; K221-H372 HydrophobicContact CB-CB 3.77Å; K221-H372 HydrophobicContact CD-CB 3.97Å; K221-H372 HydrophobicContact CG-CB 3.86Å; K221-H372 PolarHBondContact N-O 3.25Å; K221-H372 PolarHBondContact O-N 3.37Å; H372-Y374 AromaticContact CD2-CD1 3.89Å; H372-Y374 AromaticContact CD2-CE1 3.84Å; H372-Y374 AromaticContact NE2-CD1 3.43Å; H372-Y374 WeakPolarHBondContact NE2-CD1 3.41Å; H372-Y374 AromaticContact NE2-CE1 3.19Å; H372-Y374 WeakPolarHBondContact NE2-CE1 3.48Å; H372-T455 VanDerWaalsContact CE1-CB 3.4Å; H372-T455 WeakPolarHBondContact CE1-CB 3.4Å; H372-C456 WeakPolarHBondContact CA-O 3.5Å; H372-C456 PolarHBondContact ND1-O 3.21Å; H372-H457 AromaticContact CE1-CE1 3.27Å; H372-H457 PolarHBondContact CE1-CE1 2.92Å; H372-H457 AromaticContact CE1-ND1 3.92Å; H372-H457 AromaticContact CE1-NE2 3.29Å; H372-H457 PolarHBondContact CE1-NE2 3.28Å; H372-H457 VanDerWaalsContact CE1-NE2 3.29Å; H372-H457 AromaticContact ND1-CD2 3.71Å; H372-H457 AromaticContact ND1-CE1 2.94Å; H372-H457 PolarHBondContact ND1-CE1 3.47Å; H372-H457 AromaticContact ND1-CG 3.63Å; H372-H457 AromaticContact ND1-ND1 3.13Å; H372-H457 PolarHBondContact ND1-ND1 2.86Å; H372-H457 VanDerWaalsContact ND1-ND1 3.13Å; H372-H457 AromaticContact ND1-NE2 3.28Å; H372-H457 PolarHBondContact ND1-NE2 2.96Å
373	L	92.3	Very high	83.3	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	131.8	179.5	-171.8	67.9	0	0	0	112.1	E180 L189 L191 Y206 Y219 Q220 L375 T455 C456	E180-L373 HydrophobicContact CG-CD1 4.2Å; E180-L373 HydrophobicContact CG-CD2 4.46Å; L189-L373 HydrophobicContact CB-CB 4.47Å; L189-L373 HydrophobicContact CD1-CB 4.08Å; L191-L373 HydrophobicContact CB-CD2 4.18Å; Y206-L373 HydrophobicContact CE1-CD1 4.12Å; Y219-L373 HydrophobicContact CD2-CD1 3.74Å; Y219-L373 HydrophobicContact CE2-CD1 3.88Å; Y219-L373 CarbonylContact O-C 3.4Å; Q220-L373 HydrophobicContact CB-CD1 4.16Å; L373-L375 HydrophobicContact CD2-CD2 3.91Å; L373-L375 HydrophobicContact CG-CD2 4.1Å; L373-T455 WeakPolarHBondContact O-CA 3.27Å; L373-C456 PolarHBondContact N-O 3.02Å; L373-C456 PolarHBondContact O-N 3.28Å
374	Y	90.9	Very high	82.6	Confident	13 Å²	13	22 Å²	22	5%	0.051	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	136.4	169.9	-68.5	8.3	0	0	0	110.5	Y206 W216 Y219 H372 F453 T455	Y206-Y374 PolarHBondContact OH-O 2.8Å; W216-Y374 HydrophobicContact CB-CD2 3.98Å; W216-Y374 HydrophobicContact CB-CE2 3.95Å; Y219-Y374 PolarHBondContact O-N 2.94Å; H372-Y374 AromaticContact CD2-CD1 3.89Å; H372-Y374 AromaticContact CD2-CE1 3.84Å; H372-Y374 AromaticContact NE2-CD1 3.43Å; H372-Y374 WeakPolarHBondContact NE2-CD1 3.41Å; H372-Y374 AromaticContact NE2-CE1 3.19Å; H372-Y374 WeakPolarHBondContact NE2-CE1 3.48Å; Y374-F453 HydrophobicContact CD2-CD1 4.21Å; Y374-F453 HydrophobicContact CD2-CG 4.38Å; Y374-F453 HydrophobicContact CE2-CD1 4.4Å; Y374-F453 HydrophobicContact CE2-CG 4.31Å; Y374-T455 HydrophobicContact CD1-CG2 3.32Å; Y374-T455 HydrophobicContact CE1-CG2 3.55Å; Y374-T455 HydrophobicContact CG-CG2 4.09Å
375	L	88.5	Confident	82	Confident	1 Å²	1	26.1 Å²	26.1	1%	0.005	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	138.4	-179.2	-52.7	-176.3	0	0	0	110	F101 V103 L191 L373 L420 L454 C456	F101-L375 HydrophobicContact CD2-CD1 4.45Å; F101-L375 HydrophobicContact CE2-CD1 3.76Å; F101-L375 HydrophobicContact CZ-CD1 3.89Å; V103-L375 HydrophobicContact CG2-CD1 4.02Å; V103-L375 HydrophobicContact CG2-CD2 4.49Å; L191-L375 HydrophobicContact CD1-CD2 3.93Å; L191-L375 HydrophobicContact CD2-CD2 4Å; L191-L375 HydrophobicContact CG-CD2 4.42Å; L373-L375 HydrophobicContact CD2-CD2 3.91Å; L373-L375 HydrophobicContact CG-CD2 4.1Å; L375-L420 HydrophobicContact CD1-CD2 3.65Å; L375-L454 HydrophobicContact CB-CB 4.2Å; L375-L454 HydrophobicContact CB-CD2 3.94Å; L375-L454 HydrophobicContact CB-CG 4Å; L375-L454 HydrophobicContact CD1-CD2 4.14Å; L375-L454 HydrophobicContact CD1-CG 4.25Å; L375-L454 PolarHBondContact N-O 3.15Å; L375-C456 HydrophobicContact CD1-CB 3.91Å; L375-C456 HydrophobicContact CG-CB 4.28Å
376	P	87.4	Confident	81.4	Confident	1 Å²	1	26.6 Å²	26.6	1%	0.006	15%	0.153	C	C	.	.			trans	-57.7	140.6	165.3	-18.3	27.7	0	0	0	110.7	Y198 A202 F205 P378 I388	Y198-P376 HydrophobicContact CE2-CB 4.33Å; Y198-P376 PolarHBondContact OH-O 3.41Å; A202-P376 HydrophobicContact CB-CG 3.71Å; F205-P376 HydrophobicContact CB-CG 3.9Å; F205-P376 HydrophobicContact CD1-CG 3.69Å; F205-P376 HydrophobicContact CE1-CG 4.36Å; F205-P376 HydrophobicContact CG-CG 3.82Å; P376-P378 WeakPolarHBondContact O-CD 3.29Å; P376-I388 HydrophobicContact CB-CG2 3.52Å
377	I	83.2	Confident	80.7	Confident	3 Å²	3	27.7 Å²	27.7	2%	0.015	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	113.2	-176.9	-44.5	-172.9	0	0	0	109.6	I388 K389 V392 L398 L422 Y452 L454	I377-I388 WeakPolarHBondContact O-CA 3.47Å; I377-K389 PolarHBondContact N-O 2.88Å; I377-K389 PolarHBondContact O-N 2.77Å; I377-K389 VanDerWaalsContact O-N 3.09Å; I377-V392 HydrophobicContact CD1-CG1 4.4Å; I377-V392 HydrophobicContact CD1-CG2 4.27Å; I377-L398 HydrophobicContact CG2-CD1 4.28Å; I377-L398 HydrophobicContact CG2-CD2 3.51Å; I377-L422 HydrophobicContact CD1-CD1 3.93Å; I377-Y452 VanDerWaalsContact CD1-O 3.31Å; I377-Y452 WeakPolarHBondContact CD1-O 3.42Å; I377-L454 HydrophobicContact CD1-CB 4.35Å; I377-L454 HydrophobicContact CG1-CB 3.79Å
378	P	77.7	Confident	80.1	Confident	4 Å²	4	29.4 Å²	29.4	3%	0.026	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	131.8	165.6	31.9	-30.9	0	0	0	109.9	H100 F101 Y198 P376 L386 C387	H100-P378 HydrophobicContact CB-CB 4.45Å; H100-P378 HydrophobicContact CB-CG 4.36Å; H100-P378 VanDerWaalsContact CD2-CB 3.44Å; H100-P378 WeakPolarHBondContact CD2-CB 3.48Å; F101-P378 HydrophobicContact CE1-CG 4.27Å; Y198-P378 HydrophobicContact CD2-CB 4.27Å; Y198-P378 HydrophobicContact CE2-CB 4.43Å; Y198-P378 HydrophobicContact CE2-CG 4.28Å; P376-P378 WeakPolarHBondContact O-CD 3.29Å; P378-L386 HydrophobicContact CB-CD1 3.9Å; P378-C387 WeakPolarHBondContact CA-O 3.29Å
379	F	73.3	Confident	79.4	Confident	2 Å²	2	34.1 Å²	34.1	1%	0.009	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	156.9	172.9	65.7	-83.3	0	0	0	110.7	M381 C387 K389 V392 L398	F379-M381 HydrophobicContact CE2-CE 3.69Å; F379-M381 HydrophobicContact CE2-CG 3.89Å; F379-M381 HydrophobicContact CE2-SD 3.81Å; F379-M381 HydrophobicContact CZ-CE 4.18Å; F379-C387 HydrophobicContact CD1-CB 4.4Å; F379-C387 HydrophobicContact CD2-CB 4.21Å; F379-C387 HydrophobicContact CE1-CB 3.86Å; F379-C387 HydrophobicContact CE2-CB 3.65Å; F379-C387 HydrophobicContact CZ-CB 3.44Å; F379-C387 VanDerWaalsContact CZ-CB 3.44Å; F379-C387 PolarHBondContact N-O 3.15Å; F379-C387 WeakPolarHBondContact O-CA 3.38Å; F379-C387 PolarHBondContact O-N 3.14Å; F379-C387 VanDerWaalsContact O-O 3.05Å; F379-K389 HydrophobicContact CE1-CB 3.85Å; F379-K389 HydrophobicContact CE1-CD 3.71Å; F379-K389 HydrophobicContact CE1-CG 3.61Å; F379-K389 HydrophobicContact CZ-CD 3.57Å; F379-K389 HydrophobicContact CZ-CG 3.86Å; F379-V392 HydrophobicContact CD1-CG1 4.46Å; F379-V392 HydrophobicContact CE1-CG1 4.36Å; F379-L398 HydrophobicContact CB-CD2 3.76Å; F379-L398 HydrophobicContact CD1-CD2 4.32Å; F379-L398 HydrophobicContact CG-CD2 4.16Å
380	Y	65.5	Low	78.6	Confident	46 Å²	46	35.8 Å²	35.8	18%	0.18	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	117.4	-178.1	-73.7	-88.9	0	0	0	110.5	V32 H100 N385 L386	V32-Y380 HydrophobicContact CB-CD2 4.17Å; V32-Y380 HydrophobicContact CB-CE2 4.18Å; V32-Y380 HydrophobicContact CG1-CD2 4.45Å; V32-Y380 HydrophobicContact CG1-CE1 4.39Å; V32-Y380 HydrophobicContact CG1-CE2 4.08Å; H100-Y380 PolarHBondContact CE1-OH 2.81Å; H100-Y380 AromaticContact NE2-CE2 3.85Å; Y380-N385 WeakPolarHBondContact CA-O 3.46Å; Y380-L386 HydrophobicContact CD1-CB 4.18Å; Y380-L386 HydrophobicContact CD2-CD1 4.41Å; Y380-L386 HydrophobicContact CE1-CB 3.67Å; Y380-L386 HydrophobicContact CE1-CD1 4.28Å; Y380-L386 HydrophobicContact CE2-CD1 3.95Å
381	M	62.4	Low	77.7	Confident	73 Å²	73	38.5 Å²	38.5	36%	0.36	21%	0.212	S	C	.	.	S	Bend	trans	-68.5	-43.3	172.8	-77.3	-66.9	-162	0	0	110.5	F379 N385 C387 K400	F379-M381 HydrophobicContact CE2-CE 3.69Å; F379-M381 HydrophobicContact CE2-CG 3.89Å; F379-M381 HydrophobicContact CE2-SD 3.81Å; F379-M381 HydrophobicContact CZ-CE 4.18Å; M381-N385 PolarHBondContact N-O 3.2Å; M381-N385 VanDerWaalsContact N-O 3.15Å; M381-C387 HydrophobicContact CG-CB 4.5Å; M381-C387 VanDerWaalsContact CG-SG 3.54Å; M381-K400 WeakPolarHBondContact O-CE 3.42Å; M381-K400 PolarHBondContact O-NZ 3.46Å
382	N	59.6	Low	76.6	Confident	100 Å²	100	38.8 Å²	38.8	54%	0.535	21%	0.214	S	C	.	.	S	Bend	trans	-133.1	170.9	172.8	-65.4	6.3	0	0	0	108.3	S384 N385	N382-S384 PolarHBondContact O-N 3.1Å; N382-N385 PolarHBondContact O-N 2.86Å; N382-N385 VanDerWaalsContact O-N 3.11Å
383	S	61.7	Low	75.6	Confident	105 Å²	105	44 Å²	44	73%	0.734	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.7	-27.2	-174.4	50.3	0	0	0	0	115.4
384	S	60.1	Low	74.3	Confident	89 Å²	89	49.8 Å²	49.8	62%	0.622	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	-19.4	-179.8	54.1	0	0	0	0	115.1	N382 L386	N382-S384 PolarHBondContact O-N 3.1Å; S384-L386 PolarHBondContact O-N 2.97Å
385	N	70.5	Confident	72.9	Confident	90 Å²	90	50.1 Å²	50.1	48%	0.481	27%	0.265	S	S	.	.			trans	-93.5	84.7	-170.1	-82.4	-16.2	0	0	0	112.1	Y380 M381 N382 C387	Y380-N385 WeakPolarHBondContact CA-O 3.46Å; M381-N385 PolarHBondContact N-O 3.2Å; M381-N385 VanDerWaalsContact N-O 3.15Å; N382-N385 PolarHBondContact O-N 2.86Å; N382-N385 VanDerWaalsContact O-N 3.11Å; N385-C387 PolarHBondContact O-N 2.65Å
386	L	73.3	Confident	71.4	Confident	15 Å²	15	53.5 Å²	53.5	8%	0.079	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	119.5	167.2	178.5	64.8	0	0	0	109.6	K197 P378 Y380 S384 I388	K197-L386 HydrophobicContact CD-CB 4.48Å; K197-L386 HydrophobicContact CD-CD2 4.15Å; K197-L386 WeakPolarHBondContact CE-O 3.14Å; K197-L386 HydrophobicContact CG-CD2 4.41Å; K197-L386 PolarHBondContact NZ-O 3.13Å; P378-L386 HydrophobicContact CB-CD1 3.9Å; Y380-L386 HydrophobicContact CD1-CB 4.18Å; Y380-L386 HydrophobicContact CD2-CD1 4.41Å; Y380-L386 HydrophobicContact CE1-CB 3.67Å; Y380-L386 HydrophobicContact CE1-CD1 4.28Å; Y380-L386 HydrophobicContact CE2-CD1 3.95Å; S384-L386 PolarHBondContact O-N 2.97Å; L386-I388 HydrophobicContact CD2-CD1 4.12Å; L386-I388 HydrophobicContact CG-CD1 3.97Å
387	C	76.7	Confident	69.8	Low	37 Å²	37	57.7 Å²	57.7	25%	0.25	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	143.9	169.9	-65.8	0	0	0	0	109.1	P378 F379 M381 N385	P378-C387 WeakPolarHBondContact CA-O 3.29Å; F379-C387 HydrophobicContact CD1-CB 4.4Å; F379-C387 HydrophobicContact CD2-CB 4.21Å; F379-C387 HydrophobicContact CE1-CB 3.86Å; F379-C387 HydrophobicContact CE2-CB 3.65Å; F379-C387 HydrophobicContact CZ-CB 3.44Å; F379-C387 VanDerWaalsContact CZ-CB 3.44Å; F379-C387 PolarHBondContact N-O 3.15Å; F379-C387 WeakPolarHBondContact O-CA 3.38Å; F379-C387 PolarHBondContact O-N 3.14Å; F379-C387 VanDerWaalsContact O-O 3.05Å; M381-C387 HydrophobicContact CG-CB 4.5Å; M381-C387 VanDerWaalsContact CG-SG 3.54Å; N385-C387 PolarHBondContact O-N 2.65Å
388	I	80.9	Confident	68.5	Low	37 Å²	37	57.9 Å²	57.9	19%	0.19	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	122.8	173.5	-56.1	93.4	0	0	0	107.2	K197 Y198 A201 P376 I377 L386	K197-I388 HydrophobicContact CG-CD1 4.06Å; Y198-I388 HydrophobicContact CD2-CG1 4.02Å; Y198-I388 HydrophobicContact CD2-CG2 4.29Å; Y198-I388 HydrophobicContact CE2-CG2 4.33Å; A201-I388 HydrophobicContact CB-CB 3.67Å; A201-I388 HydrophobicContact CB-CD1 4.03Å; A201-I388 HydrophobicContact CB-CG1 4.04Å; A201-I388 HydrophobicContact CB-CG2 3.76Å; P376-I388 HydrophobicContact CB-CG2 3.52Å; I377-I388 WeakPolarHBondContact O-CA 3.47Å; L386-I388 HydrophobicContact CD2-CD1 4.12Å; L386-I388 HydrophobicContact CG-CD1 3.97Å
389	K	82.2	Confident	67.1	Low	98 Å²	98	59.1 Å²	59.1	43%	0.426	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	151.8	176.5	-71.7	-177.9	177.2	174.4	0	111.1	I377 F379 Y391	I377-K389 PolarHBondContact N-O 2.88Å; I377-K389 PolarHBondContact O-N 2.77Å; I377-K389 VanDerWaalsContact O-N 3.09Å; F379-K389 HydrophobicContact CE1-CB 3.85Å; F379-K389 HydrophobicContact CE1-CD 3.71Å; F379-K389 HydrophobicContact CE1-CG 3.61Å; F379-K389 HydrophobicContact CZ-CD 3.57Å; F379-K389 HydrophobicContact CZ-CG 3.86Å; K389-Y391 VanDerWaalsContact CB-O 3.31Å; K389-Y391 WeakPolarHBondContact CB-O 3.46Å; K389-Y391 PolarHBondContact O-N 2.79Å
390	S	79.6	Confident	65.7	Low	36 Å²	36	65.1 Å²	65.1	25%	0.252	34%	0.34	S	S	.	.	S	Bend	trans	-61	-34.8	171.8	-46.3	0	0	0	0	112.1	F205 F453	F205-S390 WeakPolarHBondContact CD2-OG 3.45Å; S390-F453 VanDerWaalsContact O-CD1 3.29Å; S390-F453 WeakPolarHBondContact O-CD1 3.45Å
391	Y	77.6	Confident	64.2	Low	57 Å²	57	67 Å²	67	22%	0.224	36%	0.357	C	S	.	.			trans	-156.2	166.5	178.6	63.9	-91.3	0	0	0	110.3	W216 K389 K393 Y451 Y452 F453	W216-Y391 AromaticContact CE3-CD1 3.94Å; W216-Y391 HydrophobicContact CE3-CD1 3.94Å; W216-Y391 HydrophobicContact CE3-CE1 4.26Å; W216-Y391 AromaticContact CH2-CD1 3.8Å; W216-Y391 HydrophobicContact CH2-CD1 3.8Å; W216-Y391 AromaticContact CH2-CE1 3.45Å; W216-Y391 HydrophobicContact CH2-CE1 3.45Å; W216-Y391 VanDerWaalsContact CH2-CE1 3.45Å; W216-Y391 HydrophobicContact CZ2-CE1 4.49Å; W216-Y391 AromaticContact CZ3-CD1 3.42Å; W216-Y391 HydrophobicContact CZ3-CD1 3.42Å; W216-Y391 VanDerWaalsContact CZ3-CD1 3.42Å; W216-Y391 AromaticContact CZ3-CE1 3.3Å; W216-Y391 HydrophobicContact CZ3-CE1 3.3Å; K389-Y391 VanDerWaalsContact CB-O 3.31Å; K389-Y391 WeakPolarHBondContact CB-O 3.46Å; K389-Y391 PolarHBondContact O-N 2.79Å; Y391-K393 HydrophobicContact CD2-CG 4.32Å; Y391-K393 HydrophobicContact CE2-CG 3.83Å; Y391-Y451 HydrophobicContact CD1-CD1 4.01Å; Y391-Y451 AromaticContact CD2-CD1 3.31Å; Y391-Y451 HydrophobicContact CD2-CD1 3.31Å; Y391-Y451 AromaticContact CD2-CE1 3.97Å; Y391-Y451 HydrophobicContact CD2-CE1 3.97Å; Y391-Y451 HydrophobicContact CD2-CG 4.25Å; Y391-Y451 AromaticContact CE1-CD1 3.98Å; Y391-Y451 HydrophobicContact CE1-CD1 3.98Å; Y391-Y451 HydrophobicContact CE1-CE1 4.07Å; Y391-Y451 AromaticContact CE2-CD1 3.24Å; Y391-Y451 HydrophobicContact CE2-CD1 3.24Å; Y391-Y451 AromaticContact CE2-CE1 3.38Å; Y391-Y451 HydrophobicContact CE2-CE1 3.38Å; Y391-Y451 HydrophobicContact CE2-CG 4.44Å; Y391-Y451 AromaticContact CG-CD1 3.7Å; Y391-Y451 HydrophobicContact CG-CD1 3.7Å; Y391-Y451 AromaticContact CZ-CD1 3.6Å; Y391-Y451 AromaticContact CZ-CE1 3.43Å; Y391-Y451 VanDerWaalsContact CZ-CE1 3.43Å; Y391-Y452 CarbonylContact C-O 3.51Å; Y391-Y452 WeakPolarHBondContact CA-O 3.49Å; Y391-Y452 VanDerWaalsContact CB-O 3.29Å; Y391-Y452 WeakPolarHBondContact CB-O 3.27Å; Y391-F453 HydrophobicContact CD1-CE1 4.32Å; Y391-F453 HydrophobicContact CG-CE1 4.33Å; Y391-F453 HydrophobicContact CG-CZ 4.48Å
392	V	72.4	Confident	62.8	Low	5 Å²	5	73.3 Å²	73.3	3%	0.03	38%	0.382	C	S	.	.	B	Isolated β-bridge	trans	-117.9	148.4	165.3	-62.7	0	0	0	0	110.3	I377 F379 L398 Y452	I377-V392 HydrophobicContact CD1-CG1 4.4Å; I377-V392 HydrophobicContact CD1-CG2 4.27Å; F379-V392 HydrophobicContact CD1-CG1 4.46Å; F379-V392 HydrophobicContact CE1-CG1 4.36Å; V392-L398 HydrophobicContact CG1-CD2 3.99Å; V392-L398 HydrophobicContact CG1-CG 4.43Å; V392-L398 HydrophobicContact CG2-CD1 3.84Å; V392-L398 HydrophobicContact CG2-CD2 4.43Å; V392-L398 HydrophobicContact CG2-CG 4.03Å; V392-Y452 HydrophobicContact CG2-CG 4.49Å; V392-Y452 PolarHBondContact N-O 2.98Å; V392-Y452 WeakPolarHBondContact O-CD2 3.31Å; V392-Y452 PolarHBondContact O-N 3.45Å
393	K	71	Confident	61.5	Low	112 Å²	112	74.6 Å²	74.6	49%	0.487	40%	0.399	S	S	.	.	S	Bend	trans	-88.3	-23.3	176	-65.3	-173.2	178.1	-176.8	0	113	Y391 I449	Y391-K393 HydrophobicContact CD2-CG 4.32Å; Y391-K393 HydrophobicContact CE2-CG 3.83Å; K393-I449 HydrophobicContact CD-CG2 4.35Å
394	K	66.8	Low	60	Low	121 Å²	121	71.7 Å²	71.7	53%	0.526	39%	0.386	S	S	.	.			trans	-129.1	125.2	176.6	-56.7	-176.5	176.3	-175.6	0	108.8	S396 H397	K394-S396 PolarHBondContact O-N 2.91Å; K394-H397 PolarHBondContact O-CD2 3.28Å; K394-H397 PolarHBondContact O-N 2.78Å
395	P	60.8	Low	58.5	Low	20 Å²	20	72.9 Å²	72.9	13%	0.13	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-63.3	-26.9	176.4	-19.1	31.4	0	0	0	112.1	H397 L398 F399 Y452	P395-H397 PolarHBondContact O-N 3.35Å; P395-H397 VanDerWaalsContact O-N 3.09Å; P395-L398 WeakPolarHBondContact O-CA 3.27Å; P395-L398 VanDerWaalsContact O-CB 3.27Å; P395-L398 WeakPolarHBondContact O-CB 3.32Å; P395-L398 PolarHBondContact O-N 2.84Å; P395-F399 HydrophobicContact CB-CD2 4.3Å; P395-F399 HydrophobicContact CB-CE2 3.97Å; P395-F399 WeakPolarHBondContact O-CD2 3.48Å; P395-F399 WeakPolarHBondContact O-CE2 3.06Å; P395-F399 PolarHBondContact O-N 2.93Å; P395-Y452 VanDerWaalsContact CD-CE2 3.47Å; P395-Y452 HydrophobicContact CG-CD1 3.93Å; P395-Y452 HydrophobicContact CG-CD2 3.92Å; P395-Y452 HydrophobicContact CG-CE1 3.57Å; P395-Y452 HydrophobicContact CG-CE2 3.58Å; P395-Y452 HydrophobicContact CG-CG 4.1Å
396	S	57.2	Low	56.7	Low	72 Å²	72	73.8 Å²	73.8	50%	0.503	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-59	-21.2	176.6	55.8	0	0	0	0	113.9	K394 L398 F399	K394-S396 PolarHBondContact O-N 2.91Å; S396-L398 PolarHBondContact O-N 3.43Å; S396-F399 CarbonylContact O-C 3.41Å; S396-F399 PolarHBondContact O-N 3.27Å; S396-F399 VanDerWaalsContact O-O 3.13Å
397	H	53.4	Low	54.6	Low	90 Å²	90	76 Å²	76	42%	0.417	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-68.4	-23.8	170.5	-65.2	-52	0	0	0	113.2	K394 P395	K394-H397 PolarHBondContact O-CD2 3.28Å; K394-H397 PolarHBondContact O-N 2.78Å; P395-H397 PolarHBondContact O-N 3.35Å; P395-H397 VanDerWaalsContact O-N 3.09Å
398	L	55.2	Low	52.5	Low	7 Å²	7	78.2 Å²	78.2	4%	0.037	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-27.8	174.3	-54.8	177.7	0	0	0	111.3	P30 I377 F379 V392 P395 S396 L422	P30-L398 WeakPolarHBondContact CD-O 3.35Å; I377-L398 HydrophobicContact CG2-CD1 4.28Å; I377-L398 HydrophobicContact CG2-CD2 3.51Å; F379-L398 HydrophobicContact CB-CD2 3.76Å; F379-L398 HydrophobicContact CD1-CD2 4.32Å; F379-L398 HydrophobicContact CG-CD2 4.16Å; V392-L398 HydrophobicContact CG1-CD2 3.99Å; V392-L398 HydrophobicContact CG1-CG 4.43Å; V392-L398 HydrophobicContact CG2-CD1 3.84Å; V392-L398 HydrophobicContact CG2-CD2 4.43Å; V392-L398 HydrophobicContact CG2-CG 4.03Å; P395-L398 WeakPolarHBondContact O-CA 3.27Å; P395-L398 VanDerWaalsContact O-CB 3.27Å; P395-L398 WeakPolarHBondContact O-CB 3.32Å; P395-L398 PolarHBondContact O-N 2.84Å; S396-L398 PolarHBondContact O-N 3.43Å; L398-L422 HydrophobicContact CD1-CD1 3.81Å; L398-L422 HydrophobicContact CD1-CD2 4.03Å
399	F	49.6	Very low	50.1	Low	30 Å²	30	85.9 Å²	85.9	13%	0.132	45%	0.451	C	S	.	.			trans	-116.7	83.1	-176.7	-45.4	-57.8	0	0	0	111.4	C27 Y28 I29 P395 S396 T401	C27-F399 HydrophobicContact CB-CE1 3.35Å; C27-F399 HydrophobicContact CB-CE2 4.2Å; C27-F399 HydrophobicContact CB-CZ 3.14Å; C27-F399 WeakPolarHBondContact SG-CZ 3.43Å; Y28-F399 WeakPolarHBondContact O-CD1 3.46Å; I29-F399 HydrophobicContact CG1-CE1 4.19Å; P395-F399 HydrophobicContact CB-CD2 4.3Å; P395-F399 HydrophobicContact CB-CE2 3.97Å; P395-F399 WeakPolarHBondContact O-CD2 3.48Å; P395-F399 WeakPolarHBondContact O-CE2 3.06Å; P395-F399 PolarHBondContact O-N 2.93Å; S396-F399 CarbonylContact O-C 3.41Å; S396-F399 PolarHBondContact O-N 3.27Å; S396-F399 VanDerWaalsContact O-O 3.13Å; F399-T401 PolarHBondContact O-N 2.88Å
400	K	42.5	Very low	47.5	Very low	128 Å²	128	85.9 Å²	85.9	56%	0.557	46%	0.464	S	S	*	.			trans	-76.6	90.8	158.8	-71.5	-170.9	-178.9	-176	0	109.7	P30 M381	P30-K400 WeakPolarHBondContact CB-O 3.16Å; P30-K400 HydrophobicContact CG-CB 3.9Å; P30-K400 VanDerWaalsContact CG-O 3.23Å; P30-K400 WeakPolarHBondContact CG-O 3.29Å; M381-K400 WeakPolarHBondContact O-CE 3.42Å; M381-K400 PolarHBondContact O-NZ 3.46Å
401	T	34.2	Very low	45.1	Very low	86 Å²	86	85.6 Å²	85.6	53%	0.528	46%	0.461	S	S	.	.			trans	-83.2	123.7	156.3	49.1	0	0	0	0	108.1	F399 S403 G404	F399-T401 PolarHBondContact O-N 2.88Å; T401-S403 PolarHBondContact O-N 2.93Å; T401-G404 PolarHBondContact OG1-O 3.26Å
402	K	34	Very low	42.7	Very low	205 Å²	205	90.4 Å²	90.4	89%	0.891	49%	0.491	S	S	*	.	S	Bend	trans	-65.7	113.7	156.4	-79.5	-176.1	176.4	-178.8	0	105.2
403	S	32.8	Very low	40.7	Very low	127 Å²	127	97.7 Å²	97.7	89%	0.888	53%	0.528	S	S	*	.	S	Bend	trans	48.2	76.7	168.4	59.5	0	0	0	0	116	T401	T401-S403 PolarHBondContact O-N 2.93Å
404	G	30.1	Very low	39	Very low	44 Å²	44	96.4 Å²	96.4	45%	0.454	53%	0.534	S	S	.	.			trans	-166.1	119.2	165.8	0	0	0	0	0	110.5	T401 F406	T401-G404 PolarHBondContact OG1-O 3.26Å; G404-F406 PolarHBondContact O-N 3.09Å; G404-F406 VanDerWaalsContact O-N 3.12Å
405	S	27.7	Very low	37.8	Very low	114 Å²	114	96.2 Å²	96.2	80%	0.797	55%	0.547	S	S	*	.			trans	-61	112.4	173.2	51.7	0	0	0	0	109.2	S407	S405-S407 PolarHBondContact O-N 3.48Å
406	F	33	Very low	37.3	Very low	108 Å²	108	101 Å²	101	47%	0.474	57%	0.566	S	S	.	*			trans	-69.3	121.8	178.5	-174.4	-99.9	0	0	0	110	G404 L408	G404-F406 PolarHBondContact O-N 3.09Å; G404-F406 VanDerWaalsContact O-N 3.12Å; F406-L408 HydrophobicContact CD1-CD1 4.34Å; F406-L408 HydrophobicContact CE1-CD1 3.66Å; F406-L408 HydrophobicContact CE1-CG 4.11Å
407	S	29.6	Very low	37.3	Very low	62 Å²	62	99.5 Å²	99.5	43%	0.434	56%	0.555	S	S	.	*			trans	-120.9	119.9	171.3	169.3	0	0	0	0	107.8	S405 K409 S410	S405-S407 PolarHBondContact O-N 3.48Å; S407-K409 PolarHBondContact O-N 3.2Å; S407-K409 PolarHBondContact OG-N 2.8Å; S407-S410 PolarHBondContact O-N 2.8Å; S407-S410 PolarHBondContact O-OG 3.3Å
408	L	32.9	Very low	37.8	Very low	84 Å²	84	96.1 Å²	96.1	44%	0.44	54%	0.541	S	S	.	.	G	3₁₀ helix	trans	-57	-16.2	177.2	-104	101.8	0	0	0	113.6	F406 S410	F406-L408 HydrophobicContact CD1-CD1 4.34Å; F406-L408 HydrophobicContact CE1-CD1 3.66Å; F406-L408 HydrophobicContact CE1-CG 4.11Å; L408-S410 VanDerWaalsContact C-N 3.25Å; L408-S410 PolarHBondContact O-N 3.01Å
409	K	29.5	Very low	38.5	Very low	197 Å²	197	96 Å²	96	86%	0.857	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-70.2	-15.9	-178.4	-70.1	-173	176	-175.8	0	114	S407 C411	S407-K409 PolarHBondContact O-N 3.2Å; S407-K409 PolarHBondContact OG-N 2.8Å; K409-C411 VanDerWaalsContact C-N 3.32Å; K409-C411 PolarHBondContact O-N 3.09Å
410	S	26.8	Very low	39.8	Very low	98 Å²	98	95.5 Å²	95.5	69%	0.685	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-87.7	5.8	-176.7	61.7	0	0	0	0	114.5	S407 L408	S407-S410 PolarHBondContact O-N 2.8Å; S407-S410 PolarHBondContact O-OG 3.3Å; L408-S410 VanDerWaalsContact C-N 3.25Å; L408-S410 PolarHBondContact O-N 3.01Å
411	C	30	Very low	41.2	Very low	30 Å²	30	89.6 Å²	89.6	20%	0.203	51%	0.514	C	S	.	.			trans	-90.6	103.1	178.7	-65.5	0	0	0	0	110.2	N26 K409 I413	N26-C411 HydrophobicContact CB-CB 4.05Å; K409-C411 VanDerWaalsContact C-N 3.32Å; K409-C411 PolarHBondContact O-N 3.09Å; C411-I413 PolarHBondContact O-N 3.19Å; C411-I413 VanDerWaalsContact O-N 3.1Å
412	N	27.7	Very low	42.8	Very low	158 Å²	158	85.9 Å²	85.9	85%	0.845	49%	0.491	S	S	*	.			trans	-54.6	117.2	168.7	-80.9	-15.7	0	0	0	109.5	S414	N412-S414 PolarHBondContact O-N 2.8Å
413	I	29.4	Very low	44.5	Very low	159 Å²	159	76.2 Å²	76.2	82%	0.815	45%	0.449	S	S	*	.			trans	-75.5	107.3	-175.7	-58.6	167	0	0	0	107.7	C411	C411-I413 PolarHBondContact O-N 3.19Å; C411-I413 VanDerWaalsContact O-N 3.1Å
414	S	36.5	Very low	46.1	Very low	85 Å²	85	70.2 Å²	70.2	59%	0.594	41%	0.407	S	S	*	.			trans	-60.4	138.2	156.4	176.6	0	0	0	0	108.1	N412 K416	N412-S414 PolarHBondContact O-N 2.8Å; S414-K416 PolarHBondContact O-N 3.39Å
415	S	41.8	Very low	47.9	Very low	116 Å²	116	68.6 Å²	68.6	81%	0.811	39%	0.388	S	S	*	.	S	Bend	trans	-64.3	-19.9	-177.3	55.9	0	0	0	0	113.7
416	K	49.9	Very low	49.7	Very low	120 Å²	120	66.6 Å²	66.6	52%	0.522	37%	0.365	S	S	.	.	S	Bend	trans	-95.1	130.5	174.8	-67	-168	177.6	-167.6	0	110.7	S414 S418	S414-K416 PolarHBondContact O-N 3.39Å; K416-S418 PolarHBondContact O-N 3.4Å
417	P	56.7	Low	51.1	Low	41 Å²	41	63.5 Å²	63.5	27%	0.266	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-61.4	137.2	174.9	26.1	-32.4	0	0	0	110.1	I486	P417-I486 HydrophobicContact CB-CD1 3.86Å; P417-I486 HydrophobicContact CB-CG2 4.31Å; P417-I486 HydrophobicContact CG-CD1 4.21Å
418	S	63.8	Low	52.5	Low	19 Å²	19	66 Å²	66	13%	0.133	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-60.9	134.9	170.6	171.4	0	0	0	0	109.3	K416 L420	K416-S418 PolarHBondContact O-N 3.4Å; S418-L420 VanDerWaalsContact C-N 3.28Å; S418-L420 WeakPolarHBondContact CB-O 3.49Å; S418-L420 PolarHBondContact OG-N 2.9Å; S418-L420 PolarHBondContact OG-O 3.29Å
419	P	70.9	Confident	53.6	Low	4 Å²	4	64 Å²	64	3%	0.026	35%	0.347	C	S	.	.	S	Bend	trans	-72.3	-30.8	178.3	32	-35.8	0	0	0	110.3	V95 C456 H457 Y459	V95-P419 HydrophobicContact CG1-CB 3.46Å; V95-P419 VanDerWaalsContact CG1-CB 3.46Å; V95-P419 HydrophobicContact CG1-CG 3.92Å; V95-P419 VanDerWaalsContact O-CG 3.29Å; V95-P419 WeakPolarHBondContact O-CG 3.47Å; P419-C456 CarbonylContact O-C 3.54Å; P419-C456 VanDerWaalsContact O-CA 3.23Å; P419-C456 WeakPolarHBondContact O-CA 3.18Å; P419-H457 VanDerWaalsContact CB-O 3.3Å; P419-H457 WeakPolarHBondContact CB-O 3.32Å; P419-H457 PolarHBondContact O-CD2 2.75Å; P419-H457 PolarHBondContact O-N 3.38Å; P419-Y459 HydrophobicContact CB-CE1 3.98Å; P419-Y459 HydrophobicContact CB-CE2 4.03Å; P419-Y459 VanDerWaalsContact CD-CZ 3.45Å; P419-Y459 WeakPolarHBondContact CD-OH 3.34Å; P419-Y459 HydrophobicContact CG-CE1 3.94Å; P419-Y459 HydrophobicContact CG-CE2 3.84Å; P419-Y459 WeakPolarHBondContact CG-OH 3.42Å
420	L	74.9	Confident	54.8	Low	21 Å²	21	57.9 Å²	57.9	11%	0.11	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	125.4	169.4	-70.4	179.7	0	0	0	109.4	L36 A96 T98 F101 L375 S418 L454 T455 C456	L36-L420 HydrophobicContact CD2-CD1 4.28Å; A96-L420 HydrophobicContact CB-CD1 3.82Å; A96-L420 HydrophobicContact CB-CD2 3.95Å; A96-L420 HydrophobicContact CB-CG 3.68Å; T98-L420 HydrophobicContact CG2-CD1 4.39Å; F101-L420 HydrophobicContact CE2-CD1 4.44Å; F101-L420 HydrophobicContact CE2-CD2 4.31Å; F101-L420 HydrophobicContact CZ-CD1 4.27Å; F101-L420 HydrophobicContact CZ-CD2 4.34Å; L375-L420 HydrophobicContact CD1-CD2 3.65Å; S418-L420 VanDerWaalsContact C-N 3.28Å; S418-L420 WeakPolarHBondContact CB-O 3.49Å; S418-L420 PolarHBondContact OG-N 2.9Å; S418-L420 PolarHBondContact OG-O 3.29Å; L420-L454 HydrophobicContact CB-CD1 4.48Å; L420-L454 HydrophobicContact CD2-CD1 4.31Å; L420-L454 HydrophobicContact CD2-CG 4.48Å; L420-T455 WeakPolarHBondContact CA-O 3.45Å; L420-C456 HydrophobicContact CD2-CB 4.01Å
421	S	72.2	Confident	55.8	Low	3 Å²	3	56.1 Å²	56.1	2%	0.021	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	147.7	177.5	59	0	0	0	0	109.7	T23 T455 H457	T23-S421 WeakPolarHBondContact OG1-CB 3.45Å; S421-T455 PolarHBondContact N-O 2.68Å; S421-T455 PolarHBondContact O-N 3.39Å; S421-T455 PolarHBondContact O-OG1 3.49Å; S421-T455 PolarHBondContact OG-OG1 2.99Å; S421-H457 PolarHBondContact OG-NE2 2.92Å
422	L	68.4	Low	56.5	Low	9 Å²	9	61.3 Å²	61.3	5%	0.047	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	116.3	168.1	-172.2	77.5	0	0	0	107.2	T23 F24 I377 L398 Y452 F453	T23-L422 CarbonylContact C-O 3.6Å; T23-L422 WeakPolarHBondContact CB-O 3.39Å; F24-L422 HydrophobicContact CB-CB 4.2Å; F24-L422 HydrophobicContact CD2-CB 3.85Å; F24-L422 HydrophobicContact CD2-CD2 3.88Å; F24-L422 HydrophobicContact CD2-CG 4.12Å; F24-L422 VanDerWaalsContact CD2-O 3.27Å; F24-L422 WeakPolarHBondContact CD2-O 3.4Å; F24-L422 HydrophobicContact CE2-CD2 4.28Å; F24-L422 HydrophobicContact CG-CB 4.47Å; F24-L422 PolarHBondContact N-O 3.11Å; I377-L422 HydrophobicContact CD1-CD1 3.93Å; L398-L422 HydrophobicContact CD1-CD1 3.81Å; L398-L422 HydrophobicContact CD1-CD2 4.03Å; L422-Y452 HydrophobicContact CD2-CD1 3.93Å; L422-Y452 HydrophobicContact CD2-CG 4.28Å; L422-Y452 HydrophobicContact CG-CD1 4.33Å; L422-F453 CarbonylContact C-O 3.41Å; L422-F453 WeakPolarHBondContact CA-O 3.49Å; L422-F453 WeakPolarHBondContact CD1-O 3.48Å
423	S	69.4	Low	57.1	Low	2 Å²	2	58.8 Å²	58.8	1%	0.014	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	126.2	177.8	-73.1	0	0	0	0	111.2	Y22 Y452 F453 T455	Y22-S423 CarbonylContact O-C 3.59Å; Y22-S423 WeakPolarHBondContact O-CA 3.46Å; S423-Y452 CarbonylContact O-C 3.57Å; S423-Y452 WeakPolarHBondContact O-CA 3.39Å; S423-F453 PolarHBondContact N-O 2.86Å; S423-F453 PolarHBondContact O-N 3.13Å; S423-T455 WeakPolarHBondContact OG-CG2 3.23Å; S423-T455 PolarHBondContact OG-OG1 3.2Å
424	C	66.5	Low	57.3	Low	1 Å²	1	56.3 Å²	56.3	1%	0.007	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	137.6	170.3	-166.7	0	0	0	0	111.8	L21 Y22 Y451 Y452	L21-C424 WeakPolarHBondContact CA-O 3.39Å; Y22-C424 HydrophobicContact CD2-CB 4.21Å; Y22-C424 HydrophobicContact CG-CB 4.45Å; Y22-C424 PolarHBondContact N-O 2.89Å; Y22-C424 VanDerWaalsContact N-O 3.14Å; Y22-C424 PolarHBondContact O-N 2.87Å; C424-Y451 CarbonylContact C-O 3.58Å; C424-Y451 VanDerWaalsContact CA-O 3.29Å; C424-Y451 WeakPolarHBondContact CA-O 2.81Å; C424-Y452 HydrophobicContact CB-CD1 3.75Å; C424-Y452 HydrophobicContact CB-CE1 3.71Å; C424-Y452 VanDerWaalsContact SG-CE1 3.6Å
425	V	67.3	Low	57.1	Low	9 Å²	9	57.7 Å²	57.7	6%	0.055	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.9	166.6	-178.4	0	0	0	0	108.5	Y451 F453	V425-Y451 PolarHBondContact N-O 3.16Å; V425-Y451 PolarHBondContact O-N 2.92Å; V425-F453 HydrophobicContact CB-CD2 4.49Å; V425-F453 HydrophobicContact CB-CE2 3.87Å; V425-F453 HydrophobicContact CG2-CD2 3.86Å; V425-F453 HydrophobicContact CG2-CE2 3.58Å
426	K	66	Low	56.7	Low	73 Å²	73	61.1 Å²	61.1	32%	0.317	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	125.1	173.5	-60.2	-171.8	171.4	167.5	0	109.2	Y22 I448 N450	Y22-K426 HydrophobicContact CE2-CD 3.94Å; Y22-K426 HydrophobicContact CE2-CG 4.32Å; Y22-K426 PolarHBondContact OH-NZ 2.91Å; K426-I448 HydrophobicContact CB-CG2 4.07Å; K426-I448 HydrophobicContact CG-CG2 4.49Å; K426-N450 WeakPolarHBondContact CG-OD1 3.2Å
427	Q	63.5	Low	56	Low	42 Å²	42	62.9 Å²	62.9	20%	0.196	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	117.4	171.8	-175.7	177.2	-1.8	0	0	109.6	I448 I449 Y451	Q427-I448 WeakPolarHBondContact O-CA 3.5Å; Q427-I449 PolarHBondContact N-O 3.39Å; Q427-I449 PolarHBondContact O-N 3.19Å; Q427-Y451 HydrophobicContact CB-CD2 4.15Å; Q427-Y451 HydrophobicContact CB-CE2 3.74Å; Q427-Y451 PolarHBondContact OE1-OH 3.33Å
428	E	59	Low	54.8	Low	114 Å²	114	70.6 Å²	70.6	53%	0.533	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	125.2	163.8	-76.2	175.5	-163.4	0	0	109.7	I448	E428-I448 HydrophobicContact CG-CG1 3.91Å
429	I	55.8	Low	53.4	Low	43 Å²	43	75.9 Å²	75.9	22%	0.221	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	115.6	169.1	-58.7	179.8	0	0	0	107.3	N431 H447 I449	I429-N431 PolarHBondContact O-N 2.84Å; I429-H447 PolarHBondContact N-O 3.11Å; I429-H447 VanDerWaalsContact N-O 3.15Å; I429-I449 HydrophobicContact CD1-CD1 3.38Å; I429-I449 HydrophobicContact CD1-CG1 3.83Å
430	N	53.9	Low	51.4	Low	68 Å²	68	82.1 Å²	82.1	36%	0.364	43%	0.429	S	S	.	.			trans	-73.6	121	165.4	-72.3	-3.4	0	0	0	108	D432 T433	N430-D432 PolarHBondContact O-N 3.38Å; N430-T433 PolarHBondContact O-OG1 3.24Å
431	N	47.5	Very low	49.5	Very low	62 Å²	62	87.5 Å²	87.5	33%	0.332	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-61.6	-9.9	-179	-74.3	-20.9	0	0	0	113.9	I429 T433 I434 N445	I429-N431 PolarHBondContact O-N 2.84Å; N431-T433 PolarHBondContact O-N 3.25Å; N431-I434 PolarHBondContact O-N 2.88Å; N431-I434 VanDerWaalsContact O-N 3.15Å; N431-N445 PolarHBondContact ND2-O 3.31Å
432	D	45.2	Very low	47.7	Very low	139 Å²	139	94.9 Å²	94.9	74%	0.743	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-66.6	-4.1	179.2	-74.1	-27.5	0	0	0	115.2	N430	N430-D432 PolarHBondContact O-N 3.38Å
433	T	39.6	Very low	46.3	Very low	105 Å²	105	100.1 Å²	100.1	64%	0.644	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-101.8	-0.3	173.7	45.7	0	0	0	0	114.8	N430 N431	N430-T433 PolarHBondContact O-OG1 3.24Å; N431-T433 PolarHBondContact O-N 3.25Å
434	I	35.4	Very low	45.1	Very low	106 Å²	106	107.6 Å²	107.6	54%	0.544	57%	0.57	S	S	.	*	S	Bend	trans	-95.6	125.1	173.3	-55.7	176.1	0	0	0	108.2	N431 K436	N431-I434 PolarHBondContact O-N 2.88Å; N431-I434 VanDerWaalsContact O-N 3.15Å; I434-K436 PolarHBondContact O-N 2.84Å
435	P	32	Very low	44.2	Very low	114 Å²	114	111.9 Å²	111.9	74%	0.74	59%	0.593	S	S	*	*			trans	-57.5	117.3	175.3	-17.9	29.1	0	0	0	109.6	I437	P435-I437 PolarHBondContact O-N 3.49Å
436	K	33.2	Very low	43.5	Very low	188 Å²	188	115.1 Å²	115.1	82%	0.817	61%	0.61	S	S	*	*			trans	-58.4	100.8	177.7	-71.2	178.4	178.5	176.9	0	109.9	I434	I434-K436 PolarHBondContact O-N 2.84Å
437	I	35.4	Very low	43.3	Very low	158 Å²	158	117 Å²	117	81%	0.81	62%	0.62	S	S	*	*			trans	-78	120.7	153.8	-60.8	177	0	0	0	105.4	P435 T439	P435-I437 PolarHBondContact O-N 3.49Å; I437-T439 PolarHBondContact O-N 3.23Å
438	K	31.4	Very low	43.4	Very low	203 Å²	203	119.4 Å²	119.4	88%	0.883	63%	0.633	S	S	*	*			trans	-57.9	101.3	-177.6	-71.9	175.1	174.6	178.1	0	110.8
439	T	33.2	Very low	44	Very low	129 Å²	129	116 Å²	116	79%	0.791	62%	0.619	S	S	*	*			trans	-145.7	128.8	151.2	26.8	0	0	0	0	110.4	I437 T441	I437-T439 PolarHBondContact O-N 3.23Å; T439-T441 PolarHBondContact O-N 3.23Å
440	T	30.7	Very low	44.8	Very low	135 Å²	135	116 Å²	116	83%	0.828	62%	0.619	S	S	*	*			trans	-45.9	111.1	176.6	15.5	0	0	0	0	114.5
441	T	34.3	Very low	45.7	Very low	134 Å²	134	113.8 Å²	113.8	82%	0.822	61%	0.606	S	S	*	*				176.3	120.1	119.6	14.7	0	0	0	0	108.7	T439 N443	T439-T441 PolarHBondContact O-N 3.23Å; T441-N443 PolarHBondContact O-N 2.99Å
442	N	33.7	Very low	47	Very low	159 Å²	159	111.2 Å²	111.2	85%	0.85	59%	0.591	S	S	*	*			trans	-64.9	97.9	173.1	-87.3	-16.7	0	0	0	109.5
443	N	39.8	Very low	48.6	Very low	118 Å²	118	104.7 Å²	104.7	63%	0.631	56%	0.556	S	S	*	*			trans	-123.3	113.9	149.5	-87.6	-21.9	0	0	0	106.2	T441 N445	T441-N443 PolarHBondContact O-N 2.99Å; N443-N445 PolarHBondContact O-N 3.2Å
444	N	44.7	Very low	50.6	Low	159 Å²	159	100.9 Å²	100.9	85%	0.85	53%	0.532	S	S	*	.			trans	-67.6	54.4	168.1	-85.5	-9.9	0	0	0	109.9	N446	N444-N446 VanDerWaalsContact C-N 3.35Å; N444-N446 PolarHBondContact O-N 3.24Å
445	N	47	Very low	53	Low	91 Å²	91	95.8 Å²	95.8	49%	0.487	51%	0.506	S	S	.	.			trans	-79.6	93.1	172.9	-72.3	-1.7	0	0	0	106.1	N431 N443 H447	N431-N445 PolarHBondContact ND2-O 3.31Å; N443-N445 PolarHBondContact O-N 3.2Å; N445-H447 PolarHBondContact O-N 2.76Å
446	N	52.6	Low	55.6	Low	77 Å²	77	90.4 Å²	90.4	41%	0.412	47%	0.47	S	S	.	.			trans	-51.8	108.9	158.7	-84.6	-0.1	0	0	0	106.8	N444 I448	N444-N446 VanDerWaalsContact C-N 3.35Å; N444-N446 PolarHBondContact O-N 3.24Å; N446-I448 PolarHBondContact O-N 2.93Å; N446-I448 VanDerWaalsContact O-N 3.16Å
447	H	61.3	Low	58.3	Low	114 Å²	114	81.7 Å²	81.7	53%	0.528	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	109.7	176.4	-84.8	-61.1	0	0	0	107.9	I429 N445	I429-H447 PolarHBondContact N-O 3.11Å; I429-H447 VanDerWaalsContact N-O 3.15Å; N445-H447 PolarHBondContact O-N 2.76Å
448	I	66.4	Low	60.8	Low	92 Å²	92	74.2 Å²	74.2	47%	0.472	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	118.4	171.6	-59.6	171.6	0	0	0	107.5	K426 Q427 E428 N446	K426-I448 HydrophobicContact CB-CG2 4.07Å; K426-I448 HydrophobicContact CG-CG2 4.49Å; Q427-I448 WeakPolarHBondContact O-CA 3.5Å; E428-I448 HydrophobicContact CG-CG1 3.91Å; N446-I448 PolarHBondContact O-N 2.93Å; N446-I448 VanDerWaalsContact O-N 3.16Å
449	I	70.4	Confident	63.3	Low	43 Å²	43	68.6 Å²	68.6	22%	0.221	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	127.1	170.7	-57.1	-169.2	0	0	0	108.8	K393 Q427 I429 Y451	K393-I449 HydrophobicContact CD-CG2 4.35Å; Q427-I449 PolarHBondContact N-O 3.39Å; Q427-I449 PolarHBondContact O-N 3.19Å; I429-I449 HydrophobicContact CD1-CD1 3.38Å; I429-I449 HydrophobicContact CD1-CG1 3.83Å; I449-Y451 HydrophobicContact CB-CE2 3.75Å; I449-Y451 HydrophobicContact CG2-CD2 4.08Å; I449-Y451 HydrophobicContact CG2-CE2 3.47Å; I449-Y451 VanDerWaalsContact CG2-CE2 3.47Å; I449-Y451 WeakPolarHBondContact O-CD2 3.3Å
450	N	72.5	Confident	65.8	Low	42 Å²	42	68.5 Å²	68.5	23%	0.225	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	131	173.4	-66.8	-16.5	0	0	0	110.2	K426 Y452	K426-N450 WeakPolarHBondContact CG-OD1 3.2Å; N450-Y452 HydrophobicContact CB-CE2 3.73Å
451	Y	73.6	Confident	68.7	Low	22 Å²	22	62.7 Å²	62.7	9%	0.086	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	119.3	175.8	-65.3	-100.4	0	0	0	108.4	Y391 C424 V425 Q427 I449 F453	Y391-Y451 HydrophobicContact CD1-CD1 4.01Å; Y391-Y451 AromaticContact CD2-CD1 3.31Å; Y391-Y451 HydrophobicContact CD2-CD1 3.31Å; Y391-Y451 AromaticContact CD2-CE1 3.97Å; Y391-Y451 HydrophobicContact CD2-CE1 3.97Å; Y391-Y451 HydrophobicContact CD2-CG 4.25Å; Y391-Y451 AromaticContact CE1-CD1 3.98Å; Y391-Y451 HydrophobicContact CE1-CD1 3.98Å; Y391-Y451 HydrophobicContact CE1-CE1 4.07Å; Y391-Y451 AromaticContact CE2-CD1 3.24Å; Y391-Y451 HydrophobicContact CE2-CD1 3.24Å; Y391-Y451 AromaticContact CE2-CE1 3.38Å; Y391-Y451 HydrophobicContact CE2-CE1 3.38Å; Y391-Y451 HydrophobicContact CE2-CG 4.44Å; Y391-Y451 AromaticContact CG-CD1 3.7Å; Y391-Y451 HydrophobicContact CG-CD1 3.7Å; Y391-Y451 AromaticContact CZ-CD1 3.6Å; Y391-Y451 AromaticContact CZ-CE1 3.43Å; Y391-Y451 VanDerWaalsContact CZ-CE1 3.43Å; C424-Y451 CarbonylContact C-O 3.58Å; C424-Y451 VanDerWaalsContact CA-O 3.29Å; C424-Y451 WeakPolarHBondContact CA-O 2.81Å; V425-Y451 PolarHBondContact N-O 3.16Å; V425-Y451 PolarHBondContact O-N 2.92Å; Q427-Y451 HydrophobicContact CB-CD2 4.15Å; Q427-Y451 HydrophobicContact CB-CE2 3.74Å; Q427-Y451 PolarHBondContact OE1-OH 3.33Å; I449-Y451 HydrophobicContact CB-CE2 3.75Å; I449-Y451 HydrophobicContact CG2-CD2 4.08Å; I449-Y451 HydrophobicContact CG2-CE2 3.47Å; I449-Y451 VanDerWaalsContact CG2-CE2 3.47Å; I449-Y451 WeakPolarHBondContact O-CD2 3.3Å; Y451-F453 VanDerWaalsContact CB-CE2 3.46Å; Y451-F453 WeakPolarHBondContact O-CD2 3.44Å; Y451-F453 WeakPolarHBondContact O-CE2 3.39Å
452	Y	74.8	Confident	71.4	Confident	8 Å²	8	57.1 Å²	57.1	3%	0.031	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	127.2	178.7	-58.5	-93.7	0	0	0	110	F24 I377 Y391 V392 P395 L422 S423 C424 N450	F24-Y452 AromaticContact CE2-CD1 3.74Å; F24-Y452 HydrophobicContact CE2-CD1 3.74Å; F24-Y452 AromaticContact CE2-CE1 3.59Å; F24-Y452 HydrophobicContact CE2-CE1 3.59Å; F24-Y452 HydrophobicContact CZ-CD1 4.43Å; F24-Y452 AromaticContact CZ-CE1 3.84Å; F24-Y452 HydrophobicContact CZ-CE1 3.84Å; I377-Y452 VanDerWaalsContact CD1-O 3.31Å; I377-Y452 WeakPolarHBondContact CD1-O 3.42Å; Y391-Y452 CarbonylContact C-O 3.51Å; Y391-Y452 WeakPolarHBondContact CA-O 3.49Å; Y391-Y452 VanDerWaalsContact CB-O 3.29Å; Y391-Y452 WeakPolarHBondContact CB-O 3.27Å; V392-Y452 HydrophobicContact CG2-CG 4.49Å; V392-Y452 PolarHBondContact N-O 2.98Å; V392-Y452 WeakPolarHBondContact O-CD2 3.31Å; V392-Y452 PolarHBondContact O-N 3.45Å; P395-Y452 VanDerWaalsContact CD-CE2 3.47Å; P395-Y452 HydrophobicContact CG-CD1 3.93Å; P395-Y452 HydrophobicContact CG-CD2 3.92Å; P395-Y452 HydrophobicContact CG-CE1 3.57Å; P395-Y452 HydrophobicContact CG-CE2 3.58Å; P395-Y452 HydrophobicContact CG-CG 4.1Å; L422-Y452 HydrophobicContact CD2-CD1 3.93Å; L422-Y452 HydrophobicContact CD2-CG 4.28Å; L422-Y452 HydrophobicContact CG-CD1 4.33Å; S423-Y452 CarbonylContact O-C 3.57Å; S423-Y452 WeakPolarHBondContact O-CA 3.39Å; C424-Y452 HydrophobicContact CB-CD1 3.75Å; C424-Y452 HydrophobicContact CB-CE1 3.71Å; C424-Y452 VanDerWaalsContact SG-CE1 3.6Å; N450-Y452 HydrophobicContact CB-CE2 3.73Å
453	F	78.7	Confident	74.1	Confident	1 Å²	1	55.6 Å²	55.6	0%	0.004	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	142	-177.5	-59.9	-87.3	0	0	0	109.4	W216 Y374 S390 Y391 L422 S423 V425 Y451 T455	W216-F453 HydrophobicContact CB-CD1 4.18Å; W216-F453 HydrophobicContact CB-CE1 3.5Å; W216-F453 HydrophobicContact CB-CZ 3.93Å; W216-F453 AromaticContact CD2-CE1 3.84Å; W216-F453 HydrophobicContact CD2-CE1 3.84Å; W216-F453 HydrophobicContact CD2-CZ 4.36Å; W216-F453 AromaticContact CE3-CE1 3.64Å; W216-F453 HydrophobicContact CE3-CE1 3.64Å; W216-F453 AromaticContact CE3-CZ 3.77Å; W216-F453 HydrophobicContact CE3-CZ 3.77Å; W216-F453 AromaticContact CG-CE1 3.82Å; W216-F453 HydrophobicContact CG-CE1 3.82Å; W216-F453 HydrophobicContact CG-CZ 4.47Å; Y374-F453 HydrophobicContact CD2-CD1 4.21Å; Y374-F453 HydrophobicContact CD2-CG 4.38Å; Y374-F453 HydrophobicContact CE2-CD1 4.4Å; Y374-F453 HydrophobicContact CE2-CG 4.31Å; S390-F453 VanDerWaalsContact O-CD1 3.29Å; S390-F453 WeakPolarHBondContact O-CD1 3.45Å; Y391-F453 HydrophobicContact CD1-CE1 4.32Å; Y391-F453 HydrophobicContact CG-CE1 4.33Å; Y391-F453 HydrophobicContact CG-CZ 4.48Å; L422-F453 CarbonylContact C-O 3.41Å; L422-F453 WeakPolarHBondContact CA-O 3.49Å; L422-F453 WeakPolarHBondContact CD1-O 3.48Å; S423-F453 PolarHBondContact N-O 2.86Å; S423-F453 PolarHBondContact O-N 3.13Å; V425-F453 HydrophobicContact CB-CD2 4.49Å; V425-F453 HydrophobicContact CB-CE2 3.87Å; V425-F453 HydrophobicContact CG2-CD2 3.86Å; V425-F453 HydrophobicContact CG2-CE2 3.58Å; Y451-F453 VanDerWaalsContact CB-CE2 3.46Å; Y451-F453 WeakPolarHBondContact O-CD2 3.44Å; Y451-F453 WeakPolarHBondContact O-CE2 3.39Å; F453-T455 HydrophobicContact CB-CG2 4.38Å
454	L	82.1	Confident	76.5	Confident	25 Å²	25	50.3 Å²	50.3	13%	0.131	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	134.4	166.5	179.7	65.9	0	0	0	107.8	F101 L375 I377 L420	F101-L454 HydrophobicContact CE1-CD2 4.09Å; F101-L454 HydrophobicContact CZ-CD2 3.9Å; L375-L454 HydrophobicContact CB-CB 4.2Å; L375-L454 HydrophobicContact CB-CD2 3.94Å; L375-L454 HydrophobicContact CB-CG 4Å; L375-L454 HydrophobicContact CD1-CD2 4.14Å; L375-L454 HydrophobicContact CD1-CG 4.25Å; L375-L454 PolarHBondContact N-O 3.15Å; I377-L454 HydrophobicContact CD1-CB 4.35Å; I377-L454 HydrophobicContact CG1-CB 3.79Å; L420-L454 HydrophobicContact CB-CD1 4.48Å; L420-L454 HydrophobicContact CD2-CD1 4.31Å; L420-L454 HydrophobicContact CD2-CG 4.48Å
455	T	85.1	Confident	78.8	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	145.9	-178.7	50.5	0	0	0	0	110.6	H372 L373 Y374 L420 S421 S423 F453	H372-T455 VanDerWaalsContact CE1-CB 3.4Å; H372-T455 WeakPolarHBondContact CE1-CB 3.4Å; L373-T455 WeakPolarHBondContact O-CA 3.27Å; Y374-T455 HydrophobicContact CD1-CG2 3.32Å; Y374-T455 HydrophobicContact CE1-CG2 3.55Å; Y374-T455 HydrophobicContact CG-CG2 4.09Å; L420-T455 WeakPolarHBondContact CA-O 3.45Å; S421-T455 PolarHBondContact N-O 2.68Å; S421-T455 PolarHBondContact O-N 3.39Å; S421-T455 PolarHBondContact O-OG1 3.49Å; S421-T455 PolarHBondContact OG-OG1 2.99Å; S423-T455 WeakPolarHBondContact OG-CG2 3.23Å; S423-T455 PolarHBondContact OG-OG1 3.2Å; F453-T455 HydrophobicContact CB-CG2 4.38Å
456	C	86.5	Confident	80.9	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	142.1	175.5	-164.6	0	0	0	0	110	V103 L189 H372 L373 L375 P419 L420	V103-C456 HydrophobicContact CG1-CB 4.49Å; V103-C456 HydrophobicContact CG2-CB 4.49Å; L189-C456 HydrophobicContact CD1-CB 4.18Å; L189-C456 WeakPolarHBondContact CD1-O 3.04Å; H372-C456 WeakPolarHBondContact CA-O 3.5Å; H372-C456 PolarHBondContact ND1-O 3.21Å; L373-C456 PolarHBondContact N-O 3.02Å; L373-C456 PolarHBondContact O-N 3.28Å; L375-C456 HydrophobicContact CD1-CB 3.91Å; L375-C456 HydrophobicContact CG-CB 4.28Å; P419-C456 CarbonylContact O-C 3.54Å; P419-C456 VanDerWaalsContact O-CA 3.23Å; P419-C456 WeakPolarHBondContact O-CA 3.18Å; L420-C456 HydrophobicContact CD2-CB 4.01Å
457	H	89.6	Confident	82.8	Confident	6 Å²	6	39.6 Å²	39.6	3%	0.028	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	142.2	177.1	-60.3	-105.3	0	0	0	110.3	V95 S371 H372 P419 S421 L482 I486	V95-H457 WeakPolarHBondContact CG1-O 3.33Å; S371-H457 CarbonylContact O-C 3.57Å; S371-H457 VanDerWaalsContact O-CA 3.26Å; S371-H457 WeakPolarHBondContact O-CA 3.19Å; H372-H457 AromaticContact CE1-CE1 3.27Å; H372-H457 PolarHBondContact CE1-CE1 2.92Å; H372-H457 AromaticContact CE1-ND1 3.92Å; H372-H457 AromaticContact CE1-NE2 3.29Å; H372-H457 PolarHBondContact CE1-NE2 3.28Å; H372-H457 VanDerWaalsContact CE1-NE2 3.29Å; H372-H457 AromaticContact ND1-CD2 3.71Å; H372-H457 AromaticContact ND1-CE1 2.94Å; H372-H457 PolarHBondContact ND1-CE1 3.47Å; H372-H457 AromaticContact ND1-CG 3.63Å; H372-H457 AromaticContact ND1-ND1 3.13Å; H372-H457 PolarHBondContact ND1-ND1 2.86Å; H372-H457 VanDerWaalsContact ND1-ND1 3.13Å; H372-H457 AromaticContact ND1-NE2 3.28Å; H372-H457 PolarHBondContact ND1-NE2 2.96Å; P419-H457 VanDerWaalsContact CB-O 3.3Å; P419-H457 WeakPolarHBondContact CB-O 3.32Å; P419-H457 PolarHBondContact O-CD2 2.75Å; P419-H457 PolarHBondContact O-N 3.38Å; S421-H457 PolarHBondContact OG-NE2 2.92Å; H457-L482 HydrophobicContact CB-CD2 4.06Å; H457-I486 HydrophobicContact CB-CD1 4.42Å
458	S	89.5	Confident	84.3	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.173	C	C	.	.			trans	-69.4	141.2	167.3	171.9	0	0	0	0	109.6	D105 H369 S371 E460 Y478 L482	D105-S458 WeakPolarHBondContact OD2-CB 3.06Å; D105-S458 PolarHBondContact OD2-OG 3.42Å; H369-S458 WeakPolarHBondContact NE2-CB 3.5Å; H369-S458 PolarHBondContact NE2-OG 3.49Å; S371-S458 PolarHBondContact O-N 3.01Å; S458-E460 PolarHBondContact OG-N 2.65Å; S458-E460 PolarHBondContact OG-O 2.68Å; S458-Y478 PolarHBondContact O-OH 3.37Å; S458-L482 WeakPolarHBondContact O-CD1 3.28Å
459	Y	82.5	Confident	85.7	Confident	85 Å²	85	30.1 Å²	30.1	33%	0.333	15%	0.152	S	C	.	.	S	Bend	trans	-72	-39.2	180	-73.4	-71.2	0	0	0	113.1	V95 P419 Y478 L482	V95-Y459 HydrophobicContact CB-CE2 4.43Å; V95-Y459 HydrophobicContact CG1-CD2 4.03Å; V95-Y459 HydrophobicContact CG1-CE2 3.89Å; V95-Y459 HydrophobicContact CG2-CD2 4.43Å; P419-Y459 HydrophobicContact CB-CE1 3.98Å; P419-Y459 HydrophobicContact CB-CE2 4.03Å; P419-Y459 VanDerWaalsContact CD-CZ 3.45Å; P419-Y459 WeakPolarHBondContact CD-OH 3.34Å; P419-Y459 HydrophobicContact CG-CE1 3.94Å; P419-Y459 HydrophobicContact CG-CE2 3.84Å; P419-Y459 WeakPolarHBondContact CG-OH 3.42Å; Y459-Y478 WeakPolarHBondContact O-CE1 3.19Å; Y459-L482 WeakPolarHBondContact O-CD1 3.2Å
460	E	87.2	Confident	86.8	Confident	128 Å²	128	33.8 Å²	33.8	60%	0.598	17%	0.172	S	C	*	.	S	Bend	trans	-145	149.1	-168.7	-69.2	173.7	-168.6	0	0	109.6	S458	S458-E460 PolarHBondContact OG-N 2.65Å; S458-E460 PolarHBondContact OG-O 2.68Å
461	L	90.9	Very high	87.7	Confident	13 Å²	13	36.6 Å²	36.6	7%	0.068	18%	0.179	C	C	.	.			trans	-74.4	147.2	169.3	-71.1	173.4	0	0	0	109.4	L223 H369 F465 L469 F476 Y478	L223-L461 HydrophobicContact CD1-CD2 3.86Å; H369-L461 HydrophobicContact CB-CD2 4.49Å; L461-F465 HydrophobicContact CB-CB 4.49Å; L461-F465 HydrophobicContact CB-CD1 4.49Å; L461-F465 HydrophobicContact CD1-CD1 3.85Å; L461-F465 HydrophobicContact CD1-CE1 4.1Å; L461-F465 HydrophobicContact CD2-CD1 4.1Å; L461-F465 HydrophobicContact CD2-CE1 4.2Å; L461-F465 HydrophobicContact CD2-CG 4.45Å; L461-F465 HydrophobicContact CG-CD1 4.38Å; L461-L469 HydrophobicContact CD1-CD1 4.16Å; L461-F476 HydrophobicContact CD1-CD1 4.26Å; L461-F476 HydrophobicContact CD1-CE1 4.11Å; L461-Y478 HydrophobicContact CD1-CD2 4.11Å; L461-Y478 HydrophobicContact CD1-CG 3.96Å; L461-Y478 HydrophobicContact CD2-CD2 4.23Å; L461-Y478 HydrophobicContact CD2-CE2 4.17Å; L461-Y478 HydrophobicContact CG-CD1 3.95Å; L461-Y478 HydrophobicContact CG-CD2 3.91Å; L461-Y478 HydrophobicContact CG-CE1 4.27Å; L461-Y478 HydrophobicContact CG-CE2 4.25Å; L461-Y478 HydrophobicContact CG-CG 3.73Å
462	P	90.8	Very high	88.8	Confident	17 Å²	17	35.5 Å²	35.5	11%	0.11	18%	0.175	C	C	.	.			trans	-57.1	142.5	169.8	-22.4	32.5	0	0	0	111.5	Y464 F465 S466	P462-Y464 VanDerWaalsContact C-N 3.26Å; P462-Y464 HydrophobicContact CB-CD1 3.43Å; P462-Y464 VanDerWaalsContact CB-CD1 3.43Å; P462-Y464 HydrophobicContact CB-CE1 3.21Å; P462-Y464 HydrophobicContact CB-CG 4.48Å; P462-Y464 HydrophobicContact CG-CD1 4.44Å; P462-Y464 HydrophobicContact CG-CE1 3.75Å; P462-Y464 PolarHBondContact O-N 3.34Å; P462-Y464 VanDerWaalsContact O-N 3.15Å; P462-F465 HydrophobicContact CB-CB 4.34Å; P462-F465 WeakPolarHBondContact O-CA 3.39Å; P462-F465 WeakPolarHBondContact O-CB 3.39Å; P462-F465 PolarHBondContact O-N 2.99Å; P462-S466 PolarHBondContact O-N 3.4Å
463	D	90	Very high	89.7	Confident	126 Å²	126	36.9 Å²	36.9	67%	0.674	19%	0.191	S	C	*	.	H	α-helix	trans	-52.9	-41.7	-177.3	-58	-29	0	0	0	113.3	F465 S466 N467	D463-F465 PolarHBondContact O-N 2.98Å; D463-S466 PolarHBondContact O-N 2.9Å; D463-N467 WeakPolarHBondContact O-CB 3.31Å; D463-N467 PolarHBondContact O-N 2.96Å; D463-N467 PolarHBondContact O-ND2 3.26Å
464	Y	89.8	Confident	90.5	Very high	7 Å²	7	37 Å²	37	3%	0.027	19%	0.192	C	C	.	.	H	α-helix	trans	-60.9	-32.8	177.5	79.5	-92.3	0	0	0	112.7	P108 S187 P365 V366 H367 P462 T468	P108-Y464 HydrophobicContact CB-CE1 4.16Å; P108-Y464 HydrophobicContact CG-CD1 4.15Å; P108-Y464 HydrophobicContact CG-CE1 3.47Å; P108-Y464 VanDerWaalsContact CG-CE1 3.47Å; S187-Y464 PolarHBondContact OG-OH 3.41Å; S187-Y464 VanDerWaalsContact OG-OH 3.05Å; P365-Y464 HydrophobicContact CB-CD2 4Å; P365-Y464 HydrophobicContact CB-CE2 3.77Å; P365-Y464 HydrophobicContact CG-CD2 4.11Å; P365-Y464 HydrophobicContact CG-CE2 4.38Å; P365-Y464 HydrophobicContact CG-CG 4.35Å; V366-Y464 PolarHBondContact O-OH 3.27Å; H367-Y464 AromaticContact CD2-CE2 3.98Å; H367-Y464 AromaticContact CE1-CD2 3.95Å; H367-Y464 AromaticContact NE2-CD2 3.55Å; H367-Y464 AromaticContact NE2-CE2 3.88Å; P462-Y464 VanDerWaalsContact C-N 3.26Å; P462-Y464 HydrophobicContact CB-CD1 3.43Å; P462-Y464 VanDerWaalsContact CB-CD1 3.43Å; P462-Y464 HydrophobicContact CB-CE1 3.21Å; P462-Y464 HydrophobicContact CB-CG 4.48Å; P462-Y464 HydrophobicContact CG-CD1 4.44Å; P462-Y464 HydrophobicContact CG-CE1 3.75Å; P462-Y464 PolarHBondContact O-N 3.34Å; P462-Y464 VanDerWaalsContact O-N 3.15Å; Y464-T468 WeakPolarHBondContact O-CB 3.45Å; Y464-T468 PolarHBondContact O-N 2.91Å; Y464-T468 VanDerWaalsContact O-N 3.14Å; Y464-T468 PolarHBondContact O-OG1 2.69Å; Y464-T468 VanDerWaalsContact O-OG1 3.05Å
465	F	93.5	Very high	91	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-71.1	-48.5	-179.7	-163.8	-71.4	0	0	0	109.1	L223 V225 L291 H367 H369 L461 P462 D463 T468 L469	L223-F465 HydrophobicContact CB-CZ 3.96Å; V225-F465 HydrophobicContact CG2-CD1 4.14Å; V225-F465 HydrophobicContact CG2-CE1 3.54Å; V225-F465 HydrophobicContact CG2-CE2 3.97Å; V225-F465 HydrophobicContact CG2-CZ 3.44Å; V225-F465 VanDerWaalsContact CG2-CZ 3.44Å; L291-F465 HydrophobicContact CD1-CE1 4Å; L291-F465 HydrophobicContact CD1-CZ 4.04Å; H367-F465 HydrophobicContact CB-CD2 4.37Å; H367-F465 HydrophobicContact CB-CE2 4.25Å; H369-F465 HydrophobicContact CB-CD2 4.08Å; H369-F465 HydrophobicContact CB-CE2 3.87Å; L461-F465 HydrophobicContact CB-CB 4.49Å; L461-F465 HydrophobicContact CB-CD1 4.49Å; L461-F465 HydrophobicContact CD1-CD1 3.85Å; L461-F465 HydrophobicContact CD1-CE1 4.1Å; L461-F465 HydrophobicContact CD2-CD1 4.1Å; L461-F465 HydrophobicContact CD2-CE1 4.2Å; L461-F465 HydrophobicContact CD2-CG 4.45Å; L461-F465 HydrophobicContact CG-CD1 4.38Å; P462-F465 HydrophobicContact CB-CB 4.34Å; P462-F465 WeakPolarHBondContact O-CA 3.39Å; P462-F465 WeakPolarHBondContact O-CB 3.39Å; P462-F465 PolarHBondContact O-N 2.99Å; D463-F465 PolarHBondContact O-N 2.98Å; F465-T468 PolarHBondContact O-N 3.23Å; F465-L469 HydrophobicContact CD1-CD1 4Å; F465-L469 HydrophobicContact CD1-CG 4.15Å; F465-L469 HydrophobicContact CE1-CD1 4.03Å; F465-L469 HydrophobicContact CE1-CD2 4.26Å; F465-L469 HydrophobicContact CE1-CG 4.23Å; F465-L469 WeakPolarHBondContact O-CG 3.18Å; F465-L469 PolarHBondContact O-N 3.31Å
466	S	91.8	Very high	91.5	Very high	41 Å²	41	46.2 Å²	46.2	29%	0.287	23%	0.234	S	C	.	.	H	α-helix	trans	-60.6	-47.3	176.2	-55.8	0	0	0	0	111.8	P462 D463 T468 L469 D470	P462-S466 PolarHBondContact O-N 3.4Å; D463-S466 PolarHBondContact O-N 2.9Å; S466-T468 PolarHBondContact O-N 3.21Å; S466-L469 WeakPolarHBondContact O-CB 3.05Å; S466-L469 PolarHBondContact O-N 3.34Å; S466-D470 PolarHBondContact O-N 3.21Å; S466-D470 VanDerWaalsContact O-N 3.08Å
467	N	91.6	Very high	91.8	Very high	62 Å²	62	50.9 Å²	50.9	33%	0.332	26%	0.259	S	S	.	.	H	α-helix	trans	-57.1	-38.6	176.5	-70.8	-19.1	0	0	0	112.4	P73 D463 R471	P73-N467 PolarHBondContact O-ND2 3.19Å; D463-N467 WeakPolarHBondContact O-CB 3.31Å; D463-N467 PolarHBondContact O-N 2.96Å; D463-N467 PolarHBondContact O-ND2 3.26Å; N467-R471 WeakPolarHBondContact O-CB 3.13Å; N467-R471 VanDerWaalsContact O-CG 3.28Å; N467-R471 WeakPolarHBondContact O-CG 3.45Å; N467-R471 PolarHBondContact O-N 3.1Å; N467-R471 VanDerWaalsContact O-N 3.1Å
468	T	93.5	Very high	91.9	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-69.6	-38.4	176.4	-69.1	0	0	0	0	112	Y74 V225 V316 L354 H367 Y464 F465 S466 D470 R471 L472	Y74-T468 WeakPolarHBondContact CE1-OG1 3.42Å; Y74-T468 PolarHBondContact OH-OG1 3.45Å; V225-T468 HydrophobicContact CG1-CG2 4.21Å; V316-T468 HydrophobicContact CG1-CG2 4.24Å; L354-T468 HydrophobicContact CD2-CG2 3.82Å; H367-T468 WeakPolarHBondContact NE2-CB 3.49Å; H367-T468 WeakPolarHBondContact NE2-CG2 3.23Å; H367-T468 PolarHBondContact NE2-OG1 2.87Å; Y464-T468 WeakPolarHBondContact O-CB 3.45Å; Y464-T468 PolarHBondContact O-N 2.91Å; Y464-T468 VanDerWaalsContact O-N 3.14Å; Y464-T468 PolarHBondContact O-OG1 2.69Å; Y464-T468 VanDerWaalsContact O-OG1 3.05Å; F465-T468 PolarHBondContact O-N 3.23Å; S466-T468 PolarHBondContact O-N 3.21Å; T468-D470 VanDerWaalsContact C-N 3.35Å; T468-R471 PolarHBondContact O-N 3.29Å; T468-L472 HydrophobicContact CG2-CD1 3.62Å; T468-L472 HydrophobicContact CG2-CG 4.2Å; T468-L472 WeakPolarHBondContact O-CB 3.44Å; T468-L472 WeakPolarHBondContact O-CG 3.31Å; T468-L472 PolarHBondContact O-N 3.16Å
469	L	95.4	Very high	91.8	Very high	7 Å²	7	54 Å²	54	4%	0.037	28%	0.282	C	S	.	.	H	α-helix	trans	-58.7	-48.3	174.6	-66.1	176.5	0	0	0	110.9	V225 L291 L461 F465 S466 R471 L472 G473 I474 F476	V225-L469 HydrophobicContact CG1-CD2 4.42Å; V225-L469 HydrophobicContact CG2-CD2 3.72Å; L291-L469 HydrophobicContact CB-CD2 4.36Å; L291-L469 HydrophobicContact CD1-CD2 4.26Å; L461-L469 HydrophobicContact CD1-CD1 4.16Å; F465-L469 HydrophobicContact CD1-CD1 4Å; F465-L469 HydrophobicContact CD1-CG 4.15Å; F465-L469 HydrophobicContact CE1-CD1 4.03Å; F465-L469 HydrophobicContact CE1-CD2 4.26Å; F465-L469 HydrophobicContact CE1-CG 4.23Å; F465-L469 WeakPolarHBondContact O-CG 3.18Å; F465-L469 PolarHBondContact O-N 3.31Å; S466-L469 WeakPolarHBondContact O-CB 3.05Å; S466-L469 PolarHBondContact O-N 3.34Å; L469-R471 PolarHBondContact O-N 3.02Å; L469-L472 CarbonylContact O-C 3.51Å; L469-L472 PolarHBondContact O-N 3.34Å; L469-G473 PolarHBondContact O-N 3.39Å; L469-G473 VanDerWaalsContact O-N 3.09Å; L469-I474 HydrophobicContact CB-CB 4.35Å; L469-I474 HydrophobicContact CD2-CB 3.99Å; L469-I474 HydrophobicContact CD2-CD1 3.93Å; L469-I474 HydrophobicContact CD2-CG2 3.93Å; L469-I474 PolarHBondContact O-N 3.18Å; L469-F476 HydrophobicContact CD1-CB 4.33Å; L469-F476 HydrophobicContact CD1-CD1 4.07Å
470	D	93.1	Very high	92	Very high	119 Å²	119	53.2 Å²	53.2	64%	0.636	28%	0.283	S	S	*	.	H	α-helix	trans	-60	-46.8	179.5	-66.7	-21.8	0	0	0	111.7	S466 T468 L472 G473	S466-D470 PolarHBondContact O-N 3.21Å; S466-D470 VanDerWaalsContact O-N 3.08Å; T468-D470 VanDerWaalsContact C-N 3.35Å; D470-L472 VanDerWaalsContact C-N 3.26Å; D470-L472 PolarHBondContact O-N 3.01Å; D470-G473 PolarHBondContact O-N 2.91Å
471	R	92.8	Very high	92	Very high	101 Å²	101	48.1 Å²	48.1	38%	0.381	26%	0.259	S	S	.	.	H	α-helix	trans	-64.1	-31.1	178.9	-74.7	179.3	178.1	-82.7	4.4	113.5	L354 N467 T468 L469 G473	L354-R471 WeakPolarHBondContact O-CD 3.46Å; L354-R471 PolarHBondContact O-NE 3.08Å; N467-R471 WeakPolarHBondContact O-CB 3.13Å; N467-R471 VanDerWaalsContact O-CG 3.28Å; N467-R471 WeakPolarHBondContact O-CG 3.45Å; N467-R471 PolarHBondContact O-N 3.1Å; N467-R471 VanDerWaalsContact O-N 3.1Å; T468-R471 PolarHBondContact O-N 3.29Å; L469-R471 PolarHBondContact O-N 3.02Å; R471-G473 VanDerWaalsContact C-N 3.26Å
472	L	94.8	Very high	91.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-83.4	-5.5	176	-68	177.5	0	0	0	112.9	V225 W227 G285 S286 K287 V316 I353 L354 T468 L469 D470 I474	V225-L472 HydrophobicContact CG1-CD1 3.47Å; V225-L472 VanDerWaalsContact CG1-CD1 3.47Å; W227-L472 HydrophobicContact CE3-CD2 4.31Å; W227-L472 HydrophobicContact CH2-CD2 3.4Å; W227-L472 VanDerWaalsContact CH2-CD2 3.4Å; W227-L472 HydrophobicContact CZ2-CD2 4.32Å; W227-L472 HydrophobicContact CZ3-CD2 3.39Å; G285-L472 WeakPolarHBondContact CA-O 3.34Å; S286-L472 PolarHBondContact N-O 3.29Å; K287-L472 HydrophobicContact CB-CD2 4.28Å; V316-L472 HydrophobicContact CG2-CD1 4.33Å; I353-L472 HydrophobicContact CG2-CD2 3.76Å; L354-L472 HydrophobicContact CD2-CD2 4.22Å; L354-L472 HydrophobicContact CD2-CG 4.31Å; T468-L472 HydrophobicContact CG2-CD1 3.62Å; T468-L472 HydrophobicContact CG2-CG 4.2Å; T468-L472 WeakPolarHBondContact O-CB 3.44Å; T468-L472 WeakPolarHBondContact O-CG 3.31Å; T468-L472 PolarHBondContact O-N 3.16Å; L469-L472 CarbonylContact O-C 3.51Å; L469-L472 PolarHBondContact O-N 3.34Å; D470-L472 VanDerWaalsContact C-N 3.26Å; D470-L472 PolarHBondContact O-N 3.01Å; L472-I474 VanDerWaalsContact C-N 3.29Å; L472-I474 HydrophobicContact CB-CD1 3.88Å; L472-I474 HydrophobicContact CB-CG1 3.92Å; L472-I474 HydrophobicContact CD1-CD1 4.02Å
473	G	94.2	Very high	91.1	Very high	36 Å²	36	52.4 Å²	52.4	37%	0.371	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.2	37.5	-173.8	0	0	0	0	0	112.1	G285 L469 D470 R471	G285-G473 WeakPolarHBondContact CA-O 3.3Å; L469-G473 PolarHBondContact O-N 3.39Å; L469-G473 VanDerWaalsContact O-N 3.09Å; D470-G473 PolarHBondContact O-N 2.91Å; R471-G473 VanDerWaalsContact C-N 3.26Å
474	I	95.8	Very high	90.3	Very high	3 Å²	3	50.9 Å²	50.9	2%	0.015	26%	0.264	C	S	.	.			trans	-94.4	105.3	174.4	-60.4	170.2	0	0	0	107.6	V225 L291 L469 L472 F476	V225-I474 HydrophobicContact CG1-CD1 3.98Å; L291-I474 HydrophobicContact CB-CG2 3.9Å; L469-I474 HydrophobicContact CB-CB 4.35Å; L469-I474 HydrophobicContact CD2-CB 3.99Å; L469-I474 HydrophobicContact CD2-CD1 3.93Å; L469-I474 HydrophobicContact CD2-CG2 3.93Å; L469-I474 PolarHBondContact O-N 3.18Å; L472-I474 VanDerWaalsContact C-N 3.29Å; L472-I474 HydrophobicContact CB-CD1 3.88Å; L472-I474 HydrophobicContact CB-CG1 3.92Å; L472-I474 HydrophobicContact CD1-CD1 4.02Å; I474-F476 PolarHBondContact O-N 3.33Å
475	E	93.6	Very high	89.4	Confident	174 Å²	174	52.1 Å²	52.1	81%	0.813	27%	0.271	S	S	*	.			trans	-74.5	118.7	173.7	-65.8	-178.1	179.2	0	0	109.8	S283	S283-E475 WeakPolarHBondContact CB-O 3.29Å; S283-E475 PolarHBondContact OG-O 3.08Å
476	F	94.5	Very high	88	Confident	45 Å²	45	52.5 Å²	52.5	20%	0.197	27%	0.273	C	S	.	.			trans	-154.1	111.5	178.6	179.2	-112.9	0	0	0	111.9	L223 L282 L291 L461 L469 I474 Y478 W481	L223-F476 HydrophobicContact CD1-CE1 4.24Å; L223-F476 HydrophobicContact CD1-CZ 4.37Å; L282-F476 HydrophobicContact CB-CE2 4.49Å; L282-F476 HydrophobicContact CD1-CE2 3.77Å; L282-F476 HydrophobicContact CD1-CZ 4.04Å; L291-F476 HydrophobicContact CD2-CB 3.8Å; L291-F476 HydrophobicContact CD2-CD1 3.41Å; L291-F476 VanDerWaalsContact CD2-CD1 3.41Å; L291-F476 HydrophobicContact CD2-CD2 3.46Å; L291-F476 VanDerWaalsContact CD2-CD2 3.46Å; L291-F476 HydrophobicContact CD2-CE1 3.73Å; L291-F476 HydrophobicContact CD2-CE2 3.8Å; L291-F476 HydrophobicContact CD2-CG 3.25Å; L291-F476 HydrophobicContact CD2-CZ 3.92Å; L461-F476 HydrophobicContact CD1-CD1 4.26Å; L461-F476 HydrophobicContact CD1-CE1 4.11Å; L469-F476 HydrophobicContact CD1-CB 4.33Å; L469-F476 HydrophobicContact CD1-CD1 4.07Å; I474-F476 PolarHBondContact O-N 3.33Å; F476-Y478 AromaticContact CE1-CD2 3.75Å; F476-Y478 HydrophobicContact CE1-CD2 3.75Å; F476-Y478 HydrophobicContact CE1-CG 4.29Å; F476-Y478 HydrophobicContact CZ-CD2 4.1Å; F476-Y478 PolarHBondContact O-N 3.3Å; F476-W481 HydrophobicContact CE2-CB 3.81Å; F476-W481 AromaticContact CE2-CD1 3.8Å; F476-W481 HydrophobicContact CE2-CD2 4.5Å; F476-W481 AromaticContact CE2-CG 3.77Å; F476-W481 HydrophobicContact CE2-CG 3.77Å; F476-W481 HydrophobicContact CZ-CB 3.73Å; F476-W481 AromaticContact CZ-CD2 3.98Å; F476-W481 HydrophobicContact CZ-CD2 3.98Å; F476-W481 HydrophobicContact CZ-CE3 4.47Å; F476-W481 AromaticContact CZ-CG 3.64Å; F476-W481 HydrophobicContact CZ-CG 3.64Å
477	D	92.1	Very high	85.8	Confident	99 Å²	99	54.1 Å²	54.1	53%	0.529	28%	0.281	S	S	.	.			trans	-85.9	101	171.4	-174.3	-17.9	0	0	0	110	A479 D480 W481	D477-A479 VanDerWaalsContact C-N 3.33Å; D477-A479 PolarHBondContact O-N 3.08Å; D477-A479 WeakPolarHBondContact OD1-CA 3.14Å; D477-A479 WeakPolarHBondContact OD1-CB 3.35Å; D477-A479 PolarHBondContact OD1-N 3.36Å; D477-D480 HydrophobicContact CB-CB 3.95Å; D477-D480 VanDerWaalsContact CG-CB 3.48Å; D477-D480 PolarHBondContact OD1-N 3.29Å; D477-D480 WeakPolarHBondContact OD2-CB 3.47Å; D477-W481 VanDerWaalsContact O-CB 3.3Å; D477-W481 WeakPolarHBondContact O-CB 3.48Å; D477-W481 PolarHBondContact O-N 2.97Å
478	Y	92	Very high	83.3	Confident	19 Å²	19	55.3 Å²	55.3	8%	0.075	29%	0.291	C	S	.	.	H	α-helix	trans	-65.8	-34.9	177.8	-176.5	-116.8	0	0	0	112.9	L223 S458 Y459 L461 F476 W481 L482	L223-Y478 HydrophobicContact CD1-CD2 3.85Å; L223-Y478 HydrophobicContact CD1-CE2 3.55Å; S458-Y478 PolarHBondContact O-OH 3.37Å; Y459-Y478 WeakPolarHBondContact O-CE1 3.19Å; L461-Y478 HydrophobicContact CD1-CD2 4.11Å; L461-Y478 HydrophobicContact CD1-CG 3.96Å; L461-Y478 HydrophobicContact CD2-CD2 4.23Å; L461-Y478 HydrophobicContact CD2-CE2 4.17Å; L461-Y478 HydrophobicContact CG-CD1 3.95Å; L461-Y478 HydrophobicContact CG-CD2 3.91Å; L461-Y478 HydrophobicContact CG-CE1 4.27Å; L461-Y478 HydrophobicContact CG-CE2 4.25Å; L461-Y478 HydrophobicContact CG-CG 3.73Å; F476-Y478 AromaticContact CE1-CD2 3.75Å; F476-Y478 HydrophobicContact CE1-CD2 3.75Å; F476-Y478 HydrophobicContact CE1-CG 4.29Å; F476-Y478 HydrophobicContact CZ-CD2 4.1Å; F476-Y478 PolarHBondContact O-N 3.3Å; Y478-W481 AromaticContact CD2-CE3 3.83Å; Y478-W481 HydrophobicContact CD2-CE3 3.83Å; Y478-W481 HydrophobicContact CD2-CZ3 4.34Å; Y478-W481 AromaticContact CE2-CE3 3.62Å; Y478-W481 HydrophobicContact CE2-CE3 3.62Å; Y478-W481 AromaticContact CE2-CZ3 3.68Å; Y478-W481 HydrophobicContact CE2-CZ3 3.68Å; Y478-W481 PolarHBondContact O-N 3.19Å; Y478-L482 HydrophobicContact CD1-CD1 3.83Å; Y478-L482 HydrophobicContact CD1-CG 4.22Å; Y478-L482 HydrophobicContact CD2-CG 4.39Å; Y478-L482 HydrophobicContact CE1-CD1 3.35Å; Y478-L482 HydrophobicContact CE1-CD2 4.36Å; Y478-L482 HydrophobicContact CE1-CG 3.82Å; Y478-L482 HydrophobicContact CE2-CD1 4.46Å; Y478-L482 HydrophobicContact CE2-CD2 4.18Å; Y478-L482 HydrophobicContact CE2-CG 4.02Å; Y478-L482 WeakPolarHBondContact O-CB 3.45Å; Y478-L482 WeakPolarHBondContact O-CG 3.28Å; Y478-L482 PolarHBondContact O-N 2.93Å
479	A	87.6	Confident	80.9	Confident	53 Å²	53	56.5 Å²	56.5	44%	0.438	30%	0.297	S	S	.	.	H	α-helix	trans	-70	-41.4	-178.6	0	0	0	0	0	110.8	D477 L482 K483	D477-A479 VanDerWaalsContact C-N 3.33Å; D477-A479 PolarHBondContact O-N 3.08Å; D477-A479 WeakPolarHBondContact OD1-CA 3.14Å; D477-A479 WeakPolarHBondContact OD1-CB 3.35Å; D477-A479 PolarHBondContact OD1-N 3.36Å; A479-L482 PolarHBondContact O-N 3.43Å; A479-K483 VanDerWaalsContact O-CG 3.31Å; A479-K483 WeakPolarHBondContact O-CG 3.33Å; A479-K483 PolarHBondContact O-N 2.92Å
480	D	87.2	Confident	77.9	Confident	67 Å²	67	57.5 Å²	57.5	36%	0.358	30%	0.304	S	S	.	.	H	α-helix	trans	-66.8	-43.9	172	-171.2	54.8	0	0	0	111.4	D477 L482 K483 Q484	D477-D480 HydrophobicContact CB-CB 3.95Å; D477-D480 VanDerWaalsContact CG-CB 3.48Å; D477-D480 PolarHBondContact OD1-N 3.29Å; D477-D480 WeakPolarHBondContact OD2-CB 3.47Å; D480-L482 VanDerWaalsContact C-N 3.29Å; D480-L482 PolarHBondContact O-N 2.78Å; D480-K483 CarbonylContact O-C 3.52Å; D480-K483 WeakPolarHBondContact O-CB 3.47Å; D480-K483 PolarHBondContact O-N 2.92Å; D480-K483 VanDerWaalsContact O-N 3.09Å; D480-Q484 WeakPolarHBondContact O-CG 3.41Å; D480-Q484 PolarHBondContact O-N 3.4Å; D480-Q484 PolarHBondContact OD2-NE2 3.06Å
481	W	87.1	Confident	74.8	Confident	21 Å²	21	57.9 Å²	57.9	8%	0.08	31%	0.306	C	S	.	.	H	α-helix	trans	-57	-43	174.4	-178.4	86.1	0	0	0	112	L223 K293 F476 D477 Y478 Q484 N485	L223-W481 HydrophobicContact CD1-CZ3 4.31Å; L223-W481 HydrophobicContact CD2-CH2 4.39Å; L223-W481 HydrophobicContact CD2-CZ2 4.25Å; K293-W481 HydrophobicContact CD-CZ2 4Å; F476-W481 HydrophobicContact CE2-CB 3.81Å; F476-W481 AromaticContact CE2-CD1 3.8Å; F476-W481 HydrophobicContact CE2-CD2 4.5Å; F476-W481 AromaticContact CE2-CG 3.77Å; F476-W481 HydrophobicContact CE2-CG 3.77Å; F476-W481 HydrophobicContact CZ-CB 3.73Å; F476-W481 AromaticContact CZ-CD2 3.98Å; F476-W481 HydrophobicContact CZ-CD2 3.98Å; F476-W481 HydrophobicContact CZ-CE3 4.47Å; F476-W481 AromaticContact CZ-CG 3.64Å; F476-W481 HydrophobicContact CZ-CG 3.64Å; D477-W481 VanDerWaalsContact O-CB 3.3Å; D477-W481 WeakPolarHBondContact O-CB 3.48Å; D477-W481 PolarHBondContact O-N 2.97Å; Y478-W481 AromaticContact CD2-CE3 3.83Å; Y478-W481 HydrophobicContact CD2-CE3 3.83Å; Y478-W481 HydrophobicContact CD2-CZ3 4.34Å; Y478-W481 AromaticContact CE2-CE3 3.62Å; Y478-W481 HydrophobicContact CE2-CE3 3.62Å; Y478-W481 AromaticContact CE2-CZ3 3.68Å; Y478-W481 HydrophobicContact CE2-CZ3 3.68Å; Y478-W481 PolarHBondContact O-N 3.19Å; W481-Q484 PolarHBondContact O-N 3.39Å; W481-N485 PolarHBondContact NE1-ND2 2.91Å; W481-N485 VanDerWaalsContact NE1-ND2 3.18Å; W481-N485 WeakPolarHBondContact O-CB 3.33Å; W481-N485 PolarHBondContact O-N 3.24Å; W481-N485 PolarHBondContact O-ND2 2.92Å
482	L	82.9	Confident	71.9	Confident	9 Å²	9	58.1 Å²	58.1	5%	0.047	32%	0.315	C	S	.	.	H	α-helix	trans	-61.9	-48.4	173.3	-80.2	179.4	0	0	0	111.6	H457 S458 Y459 Y478 A479 D480 Q484 N485 I486	H457-L482 HydrophobicContact CB-CD2 4.06Å; S458-L482 WeakPolarHBondContact O-CD1 3.28Å; Y459-L482 WeakPolarHBondContact O-CD1 3.2Å; Y478-L482 HydrophobicContact CD1-CD1 3.83Å; Y478-L482 HydrophobicContact CD1-CG 4.22Å; Y478-L482 HydrophobicContact CD2-CG 4.39Å; Y478-L482 HydrophobicContact CE1-CD1 3.35Å; Y478-L482 HydrophobicContact CE1-CD2 4.36Å; Y478-L482 HydrophobicContact CE1-CG 3.82Å; Y478-L482 HydrophobicContact CE2-CD1 4.46Å; Y478-L482 HydrophobicContact CE2-CD2 4.18Å; Y478-L482 HydrophobicContact CE2-CG 4.02Å; Y478-L482 WeakPolarHBondContact O-CB 3.45Å; Y478-L482 WeakPolarHBondContact O-CG 3.28Å; Y478-L482 PolarHBondContact O-N 2.93Å; A479-L482 PolarHBondContact O-N 3.43Å; D480-L482 VanDerWaalsContact C-N 3.29Å; D480-L482 PolarHBondContact O-N 2.78Å; L482-Q484 VanDerWaalsContact C-N 3.28Å; L482-Q484 PolarHBondContact O-N 3.03Å; L482-N485 PolarHBondContact O-N 3.18Å; L482-I486 HydrophobicContact CB-CD1 4.27Å; L482-I486 HydrophobicContact CD2-CD1 4.31Å; L482-I486 WeakPolarHBondContact O-CB 3.35Å; L482-I486 WeakPolarHBondContact O-CG1 3.26Å; L482-I486 PolarHBondContact O-N 2.99Å
483	K	78.9	Confident	68.9	Low	111 Å²	111	60.7 Å²	60.7	48%	0.483	33%	0.329	S	S	.	.	H	α-helix	trans	-57.9	-42	176.7	-75.5	171.6	-174.6	171.1	0	111.3	A479 D480 V487	A479-K483 VanDerWaalsContact O-CG 3.31Å; A479-K483 WeakPolarHBondContact O-CG 3.33Å; A479-K483 PolarHBondContact O-N 2.92Å; D480-K483 CarbonylContact O-C 3.52Å; D480-K483 WeakPolarHBondContact O-CB 3.47Å; D480-K483 PolarHBondContact O-N 2.92Å; D480-K483 VanDerWaalsContact O-N 3.09Å; K483-V487 WeakPolarHBondContact O-CA 3.4Å; K483-V487 WeakPolarHBondContact O-CB 3.41Å; K483-V487 WeakPolarHBondContact O-CG2 3.39Å; K483-V487 PolarHBondContact O-N 2.88Å
484	Q	74.6	Confident	65.8	Low	94 Å²	94	67.9 Å²	67.9	44%	0.439	35%	0.35	S	S	.	.	H	α-helix	trans	-64.6	-49.9	176.6	-67.8	-178.5	17	0	0	110.6	D480 W481 L482 I486 T488	D480-Q484 WeakPolarHBondContact O-CG 3.41Å; D480-Q484 PolarHBondContact O-N 3.4Å; D480-Q484 PolarHBondContact OD2-NE2 3.06Å; W481-Q484 PolarHBondContact O-N 3.39Å; L482-Q484 VanDerWaalsContact C-N 3.28Å; L482-Q484 PolarHBondContact O-N 3.03Å; Q484-I486 VanDerWaalsContact C-N 3.28Å; Q484-I486 PolarHBondContact O-N 3.15Å; Q484-T488 HydrophobicContact CB-CG2 4.38Å; Q484-T488 WeakPolarHBondContact O-CB 3.47Å; Q484-T488 PolarHBondContact O-N 2.96Å; Q484-T488 PolarHBondContact O-OG1 3.46Å
485	N	71.2	Confident	62.4	Low	34 Å²	34	73.5 Å²	73.5	18%	0.182	38%	0.379	C	S	.	.	H	α-helix	trans	-71.2	-22	-176.6	-75.1	-83.8	0	0	0	113.8	W481 L482 N489	W481-N485 PolarHBondContact NE1-ND2 2.91Å; W481-N485 VanDerWaalsContact NE1-ND2 3.18Å; W481-N485 WeakPolarHBondContact O-CB 3.33Å; W481-N485 PolarHBondContact O-N 3.24Å; W481-N485 PolarHBondContact O-ND2 2.92Å; L482-N485 PolarHBondContact O-N 3.18Å; N485-N489 PolarHBondContact O-ND2 3.46Å
486	I	64	Low	59.3	Low	8 Å²	8	71.1 Å²	71.1	4%	0.041	37%	0.37	C	S	.	.	H	α-helix	trans	-92.2	-51.4	175.6	-61.9	169.1	0	0	0	111	T23 P417 H457 L482 Q484	T23-I486 VanDerWaalsContact CA-O 3.29Å; T23-I486 WeakPolarHBondContact CA-O 3.47Å; T23-I486 VanDerWaalsContact CB-O 3.23Å; T23-I486 WeakPolarHBondContact CB-O 3.37Å; T23-I486 WeakPolarHBondContact CG2-O 3.44Å; T23-I486 WeakPolarHBondContact OG1-CG2 3.41Å; T23-I486 PolarHBondContact OG1-O 3.29Å; P417-I486 HydrophobicContact CB-CD1 3.86Å; P417-I486 HydrophobicContact CB-CG2 4.31Å; P417-I486 HydrophobicContact CG-CD1 4.21Å; H457-I486 HydrophobicContact CB-CD1 4.42Å; L482-I486 HydrophobicContact CB-CD1 4.27Å; L482-I486 HydrophobicContact CD2-CD1 4.31Å; L482-I486 WeakPolarHBondContact O-CB 3.35Å; L482-I486 WeakPolarHBondContact O-CG1 3.26Å; L482-I486 PolarHBondContact O-N 2.99Å; Q484-I486 VanDerWaalsContact C-N 3.28Å; Q484-I486 PolarHBondContact O-N 3.15Å
487	V	45.5	Very low	55.9	Low	74 Å²	74	74.6 Å²	74.6	45%	0.448	39%	0.391	S	S	.	.	H	α-helix	trans	-94.3	-33.9	-165.9	-174.5	0	0	0	0	115.4	K483 N489 C490	K483-V487 WeakPolarHBondContact O-CA 3.4Å; K483-V487 WeakPolarHBondContact O-CB 3.41Å; K483-V487 WeakPolarHBondContact O-CG2 3.39Å; K483-V487 PolarHBondContact O-N 2.88Å; V487-N489 PolarHBondContact O-N 3.07Å; V487-C490 PolarHBondContact O-N 3.02Å
488	T	38.7	Very low	52.5	Low	87 Å²	87	78.6 Å²	78.6	53%	0.534	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-4.8	-178.7	55.8	0	0	0	0	114.2	Q484	Q484-T488 HydrophobicContact CB-CG2 4.38Å; Q484-T488 WeakPolarHBondContact O-CB 3.47Å; Q484-T488 PolarHBondContact O-N 2.96Å; Q484-T488 PolarHBondContact O-OG1 3.46Å
489	N	42.3	Very low	49.2	Very low	26 Å²	26	85.4 Å²	85.4	14%	0.139	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	9.6	-169.4	-77.5	-5	0	0	0	108.7	L21 Y22 T23 N485 V487	L21-N489 VanDerWaalsContact CB-ND2 3.32Å; L21-N489 WeakPolarHBondContact CB-ND2 3.4Å; L21-N489 WeakPolarHBondContact O-CB 3.23Å; L21-N489 PolarHBondContact O-ND2 2.92Å; L21-N489 PolarHBondContact O-OD1 3.32Å; Y22-N489 CarbonylContact C-O 3.51Å; Y22-N489 WeakPolarHBondContact CA-O 3.46Å; Y22-N489 WeakPolarHBondContact CB-O 3.47Å; Y22-N489 WeakPolarHBondContact CD1-O 3.41Å; T23-N489 HydrophobicContact CG2-CB 4.28Å; T23-N489 VanDerWaalsContact N-C 3.28Å; T23-N489 PolarHBondContact N-O 3.12Å; N485-N489 PolarHBondContact O-ND2 3.46Å; V487-N489 PolarHBondContact O-N 3.07Å
490	C	33.2	Very low	46.2	Very low	27 Å²	27	91.9 Å²	91.9	18%	0.182	47%	0.474	C	S	.	.	S	Bend	trans	-97.4	-24.3	171	-62.9	0	0	0	0	113.8	T23 P25 V487 N492	T23-C490 VanDerWaalsContact C-SG 3.54Å; T23-C490 PolarHBondContact O-SG 3.01Å; P25-C490 WeakPolarHBondContact CD-SG 3.46Å; V487-C490 PolarHBondContact O-N 3.02Å; C490-N492 PolarHBondContact O-N 3.11Å
491	N	28.3	Very low	44.1	Very low	127 Å²	127	93.1 Å²	93.1	68%	0.679	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-9	-158	-82.4	-13.6	0	0	0	116.5
492	N	31.3	Very low	41.9	Very low	107 Å²	107	96.9 Å²	96.9	57%	0.572	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-1.2	-179.1	-66.2	-43.4	0	0	0	116.1	Y22 C490 K494	Y22-N492 HydrophobicContact CD1-CB 4.47Å; Y22-N492 HydrophobicContact CE1-CB 3.48Å; Y22-N492 VanDerWaalsContact CE1-CB 3.48Å; Y22-N492 PolarHBondContact OH-ND2 3.06Å; Y22-N492 VanDerWaalsContact OH-ND2 3.16Å; C490-N492 PolarHBondContact O-N 3.11Å; N492-K494 PolarHBondContact O-N 2.73Å
493	D	32	Very low	39.6	Very low	54 Å²	54	101.8 Å²	101.8	29%	0.289	53%	0.526	S	S	.	.			trans	-103	62.4	169.2	-75.2	-4.9	0	0	0	109.6	I495	D493-I495 VanDerWaalsContact C-N 3.31Å; D493-I495 PolarHBondContact O-N 3.5Å
494	K	28.4	Very low	37.3	Very low	186 Å²	186	101.2 Å²	101.2	81%	0.809	53%	0.529	S	S	*	.			trans	-60.9	104.8	151.4	-80.7	-177.7	180	175.8	0	105.9	N492	N492-K494 PolarHBondContact O-N 2.73Å
495	I	25.5	Very low	34.9	Very low	122 Å²	122	101.7 Å²	101.7	63%	0.626	53%	0.534	S	S	*	.			trans	80.7	86.6	162.4	-43.8	157.3	0	0	0	113.4	D493 N497	D493-I495 VanDerWaalsContact C-N 3.31Å; D493-I495 PolarHBondContact O-N 3.5Å; I495-N497 HydrophobicContact CG2-CB 4.27Å; I495-N497 VanDerWaalsContact CG2-CG 3.48Å; I495-N497 WeakPolarHBondContact CG2-OD1 3.46Å; I495-N497 PolarHBondContact O-N 3.31Å
496	I	27.4	Very low	32.5	Very low	123 Å²	123	106.2 Å²	106.2	63%	0.631	56%	0.558	S	S	*	*			trans	-68.3	90.9	148	-61.7	177.3	0	0	0	105.4	K498	I496-K498 PolarHBondContact O-N 2.89Å
497	N	23.3	Very low	30.3	Very low	119 Å²	119	113.2 Å²	113.2	64%	0.636	60%	0.595	S	S	*	*			trans	-53.1	137.1	176.5	-87.6	-46.2	0	0	0	109.6	I495 I499	I495-N497 HydrophobicContact CG2-CB 4.27Å; I495-N497 VanDerWaalsContact CG2-CG 3.48Å; I495-N497 WeakPolarHBondContact CG2-OD1 3.46Å; I495-N497 PolarHBondContact O-N 3.31Å; N497-I499 PolarHBondContact O-N 2.81Å
498	K	21.4	Very low	29.1	Very low	183 Å²	183	116.2 Å²	116.2	80%	0.796	61%	0.606	S	S	*	*			trans	-36.8	111.6	162.1	-93.6	175.6	166.9	177.2	0	109	I496	I496-K498 PolarHBondContact O-N 2.89Å
499	I	22.2	Very low	28.3	Very low	162 Å²	162	118.7 Å²	118.7	83%	0.831	61%	0.612	S	S	*	*			trans	-94.5	98.3	150.3	-58.2	177.9	0	0	0	103.6	N497	N497-I499 PolarHBondContact O-N 2.81Å
500	T	24.1	Very low	27	Very low	188 Å²	188	127.1 Å²	127.1	100%	1.153	66%	0.655	S	S	*	*			trans	-51.2	0	164.6	34.2	0	0	0	0	111.5

Retrieved 500 of 500 residues in 796.7 ms (Link to these results)

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