A0A077ZA33_TRITR Loading...

Pkinase and DUF3635 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZA33, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 403 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	27.4	Very low	31.1	Very low	247 Å²	247	145 Å²	145	100%	1.217	81%	0.805	S	S	*	*				0	110.9	0	-75.6	-164.8	-158.6	0	0	107.8
2	L	28.7	Very low	31.8	Very low	187 Å²	187	144.8 Å²	144.8	98%	0.979	79%	0.793	S	S	*	*			trans	-1.7	135.6	165.3	-61.9	160.9	0	0	0	120.4
3	G	27.5	Very low	32	Very low	72 Å²	72	137 Å²	137	74%	0.742	77%	0.766	S	S	*	*			trans	136.8	70.1	131.3	0	0	0	0	0	117.3
4	S	25.1	Very low	32.9	Very low	115 Å²	115	133.7 Å²	133.7	80%	0.804	75%	0.746	S	S	*	*			trans	-71.7	124.1	160	45.5	0	0	0	0	110.6
5	N	32.1	Very low	33.8	Very low	149 Å²	149	129.7 Å²	129.7	80%	0.797	72%	0.722	S	S	*	*			trans	-103.8	98.4	166.6	-85.2	4.1	0	0	0	109.4
6	E	26.3	Very low	34.3	Very low	192 Å²	192	128.6 Å²	128.6	90%	0.897	71%	0.71	S	S	*	*			trans	-82.5	104.1	150	-74.7	178.6	160.3	0	0	106.9
7	E	30.6	Very low	34.7	Very low	171 Å²	171	127.8 Å²	127.8	80%	0.799	70%	0.699	S	S	*	*			trans	-138.4	134.7	164	-89.6	-172.1	162.8	0	0	110.2
8	S	34.1	Very low	35.3	Very low	77 Å²	77	123.2 Å²	123.2	54%	0.538	68%	0.675	S	S	.	*			trans	88.9	66.6	158.5	87.4	0	0	0	0	120.1
9	E	34.8	Very low	35.7	Very low	194 Å²	194	122.7 Å²	122.7	91%	0.907	67%	0.668	S	S	*	*	S	Bend	trans	-77	-2.6	138.8	-79.3	-176.1	159.4	0	0	112
10	S	36.4	Very low	35.9	Very low	91 Å²	91	123.5 Å²	123.5	64%	0.636	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-10.2	-177.5	56.4	0	0	0	0	115.6
11	D	39.5	Very low	36	Very low	100 Å²	100	122.9 Å²	122.9	54%	0.535	65%	0.654	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.4	-18.6	-174.8	-93.5	-5.6	0	0	0	114.4
12	E	39	Very low	36.6	Very low	143 Å²	143	114.4 Å²	114.4	67%	0.668	61%	0.611	S	S	*	*	H	α-helix	trans	-71.5	-39.1	176.2	-72.5	-166.7	153	0	0	112.1	N14	E12-N14 VanDerWaalsContact C-N 3.26Å; E12-N14 PolarHBondContact O-N 2.85Å
13	G	34.7	Very low	37.1	Very low	43 Å²	43	110.6 Å²	110.6	44%	0.443	59%	0.589	S	S	.	*	H	α-helix	trans	-66.8	-25.2	178.5	0	0	0	0	0	114.1	Q17	G13-Q17 VanDerWaalsContact O-CB 3.31Å; G13-Q17 WeakPolarHBondContact O-CB 3.48Å; G13-Q17 WeakPolarHBondContact O-CG 3.35Å; G13-Q17 PolarHBondContact O-N 3.32Å
14	N	44.9	Very low	37.5	Very low	91 Å²	91	112.1 Å²	112.1	49%	0.487	58%	0.584	S	S	.	*	H	α-helix	trans	-81.7	-31.4	-173.2	-142.3	-4	0	0	0	112.4	E12 V18	E12-N14 VanDerWaalsContact C-N 3.26Å; E12-N14 PolarHBondContact O-N 2.85Å; N14-V18 WeakPolarHBondContact O-CB 3.48Å; N14-V18 WeakPolarHBondContact O-CG2 3.19Å; N14-V18 PolarHBondContact O-N 3.17Å; N14-V18 VanDerWaalsContact O-N 3.08Å
15	I	45.5	Very low	38.1	Very low	74 Å²	74	117.6 Å²	117.6	38%	0.379	59%	0.587	S	S	.	*	H	α-helix	trans	-77.9	-42.2	178	-69.1	169.6	0	0	0	111.3	Q17 V18 E19	I15-Q17 VanDerWaalsContact C-N 3.29Å; I15-Q17 PolarHBondContact O-N 2.67Å; I15-V18 PolarHBondContact O-N 3.23Å; I15-E19 HydrophobicContact CG2-CG 4.48Å; I15-E19 WeakPolarHBondContact O-CG 3.4Å; I15-E19 PolarHBondContact O-N 3.44Å
16	E	42.3	Very low	38.2	Very low	112 Å²	112	112.5 Å²	112.5	52%	0.523	57%	0.569	S	S	.	*	H	α-helix	trans	-66.1	-31	173.7	-80	-166.4	174.9	0	0	112.7	R20	E16-R20 WeakPolarHBondContact O-CB 3.48Å; E16-R20 PolarHBondContact O-N 3.47Å; E16-R20 PolarHBondContact O-NE 3.13Å; E16-R20 IonicContact OE2-NH2 3.35Å; E16-R20 PolarHBondContact OE2-NH2 3.13Å
17	Q	40.7	Very low	38.5	Very low	115 Å²	115	111 Å²	111	54%	0.537	56%	0.56	S	S	.	*	H	α-helix	trans	-70.8	-35.8	172.4	-86.8	-172.5	-10.8	0	0	112.2	G13 I15 Q21	G13-Q17 VanDerWaalsContact O-CB 3.31Å; G13-Q17 WeakPolarHBondContact O-CB 3.48Å; G13-Q17 WeakPolarHBondContact O-CG 3.35Å; G13-Q17 PolarHBondContact O-N 3.32Å; I15-Q17 VanDerWaalsContact C-N 3.29Å; I15-Q17 PolarHBondContact O-N 2.67Å; Q17-Q21 VanDerWaalsContact O-CB 3.26Å; Q17-Q21 WeakPolarHBondContact O-CB 3.47Å; Q17-Q21 VanDerWaalsContact O-CG 3.23Å; Q17-Q21 WeakPolarHBondContact O-CG 3.31Å; Q17-Q21 PolarHBondContact O-N 3.46Å
18	V	45.1	Very low	38.9	Very low	44 Å²	44	105.8 Å²	105.8	27%	0.267	54%	0.535	S	S	.	.	H	α-helix	trans	-74.9	-38.2	177.1	171.2	0	0	0	0	111.6	N14 I15 Q21 E22	N14-V18 WeakPolarHBondContact O-CB 3.48Å; N14-V18 WeakPolarHBondContact O-CG2 3.19Å; N14-V18 PolarHBondContact O-N 3.17Å; N14-V18 VanDerWaalsContact O-N 3.08Å; I15-V18 PolarHBondContact O-N 3.23Å; V18-Q21 PolarHBondContact O-N 3.28Å; V18-E22 WeakPolarHBondContact O-CB 3.36Å; V18-E22 PolarHBondContact O-N 3.39Å
19	E	43.2	Very low	38.9	Very low	114 Å²	114	104.5 Å²	104.5	53%	0.533	52%	0.524	S	S	.	.	H	α-helix	trans	-62.5	-41.8	171.1	-74.5	179.4	172.1	0	0	110.9	I15 E22 E23	I15-E19 HydrophobicContact CG2-CG 4.48Å; I15-E19 WeakPolarHBondContact O-CG 3.4Å; I15-E19 PolarHBondContact O-N 3.44Å; E19-E22 PolarHBondContact O-N 3.1Å; E19-E23 WeakPolarHBondContact O-CB 3.41Å; E19-E23 WeakPolarHBondContact O-CG 3.4Å; E19-E23 PolarHBondContact O-N 3.42Å
20	R	39.4	Very low	38.8	Very low	138 Å²	138	98.7 Å²	98.7	52%	0.521	49%	0.494	S	S	.	.	H	α-helix	trans	-67.5	-36.2	171.6	-90.2	-178.3	-88.8	-128.2	-3.7	113.6	E16 T24	E16-R20 WeakPolarHBondContact O-CB 3.48Å; E16-R20 PolarHBondContact O-N 3.47Å; E16-R20 PolarHBondContact O-NE 3.13Å; E16-R20 IonicContact OE2-NH2 3.35Å; E16-R20 PolarHBondContact OE2-NH2 3.13Å; R20-T24 WeakPolarHBondContact O-CB 3.02Å; R20-T24 WeakPolarHBondContact O-CG2 3.26Å; R20-T24 PolarHBondContact O-N 3.38Å; R20-T24 PolarHBondContact O-OG1 3.43Å
21	Q	38.5	Very low	38.8	Very low	111 Å²	111	98.1 Å²	98.1	52%	0.519	48%	0.484	S	S	.	.	H	α-helix	trans	-69.5	-34.2	176	-82.1	-179.8	14.3	0	0	111.5	Q17 V18 T24 R25	Q17-Q21 VanDerWaalsContact O-CB 3.26Å; Q17-Q21 WeakPolarHBondContact O-CB 3.47Å; Q17-Q21 VanDerWaalsContact O-CG 3.23Å; Q17-Q21 WeakPolarHBondContact O-CG 3.31Å; Q17-Q21 PolarHBondContact O-N 3.46Å; V18-Q21 PolarHBondContact O-N 3.28Å; Q21-T24 WeakPolarHBondContact CA-OG1 3.48Å; Q21-T24 PolarHBondContact O-OG1 3.49Å; Q21-R25 WeakPolarHBondContact O-CB 3.42Å; Q21-R25 PolarHBondContact O-N 3.02Å
22	E	40.9	Very low	38.5	Very low	69 Å²	69	93.8 Å²	93.8	32%	0.322	46%	0.462	S	S	.	.	H	α-helix	trans	-79.6	-31.9	173.4	-71.9	-175.8	179.3	0	0	111.9	V18 E19 T24 R25 G26 R211	V18-E22 WeakPolarHBondContact O-CB 3.36Å; V18-E22 PolarHBondContact O-N 3.39Å; E19-E22 PolarHBondContact O-N 3.1Å; E22-T24 VanDerWaalsContact C-N 3.34Å; E22-R25 PolarHBondContact O-N 3.43Å; E22-G26 VanDerWaalsContact O-CA 3.22Å; E22-G26 WeakPolarHBondContact O-CA 3.45Å; E22-G26 PolarHBondContact O-N 2.95Å; E22-R211 IonicContact OE1-CZ 2.72Å; E22-R211 IonicContact OE1-NE 3.22Å; E22-R211 IonicContact OE1-NH2 3.88Å; E22-R211 PolarHBondContact OE1-NH2 3Å
23	E	38.5	Very low	38.1	Very low	108 Å²	108	96.6 Å²	96.6	51%	0.505	47%	0.466	S	S	.	.	H	α-helix	trans	-63.4	-37.9	167.8	-83.1	-177.9	154.9	0	0	111.7	E19 K120	E19-E23 WeakPolarHBondContact O-CB 3.41Å; E19-E23 WeakPolarHBondContact O-CG 3.4Å; E19-E23 PolarHBondContact O-N 3.42Å; E23-K120 IonicContact OE1-NZ 2.8Å
24	T	36.1	Very low	38	Very low	104 Å²	104	97.5 Å²	97.5	64%	0.638	46%	0.459	S	S	*	.	H	α-helix	trans	-81.8	-27.7	178.2	46.1	0	0	0	0	113.7	R20 Q21 E22	R20-T24 WeakPolarHBondContact O-CB 3.02Å; R20-T24 WeakPolarHBondContact O-CG2 3.26Å; R20-T24 PolarHBondContact O-N 3.38Å; R20-T24 PolarHBondContact O-OG1 3.43Å; Q21-T24 WeakPolarHBondContact CA-OG1 3.48Å; Q21-T24 PolarHBondContact O-OG1 3.49Å; E22-T24 VanDerWaalsContact C-N 3.34Å
25	R	37.1	Very low	37	Very low	230 Å²	230	95.4 Å²	95.4	87%	0.868	45%	0.451	S	S	*	.	H	α-helix	trans	-96.9	-17	-179.2	-152.4	173.4	-166.6	179.7	3.3	113.2	Q21 E22	Q21-R25 WeakPolarHBondContact O-CB 3.42Å; Q21-R25 PolarHBondContact O-N 3.02Å; E22-R25 PolarHBondContact O-N 3.43Å
26	G	35.6	Very low	36	Very low	41 Å²	41	94.3 Å²	94.3	42%	0.423	45%	0.448	S	S	.	.	S	Bend	trans	-114.9	46.2	173.4	0	0	0	0	0	111.6	E22 H28	E22-G26 VanDerWaalsContact O-CA 3.22Å; E22-G26 WeakPolarHBondContact O-CA 3.45Å; E22-G26 PolarHBondContact O-N 2.95Å; G26-H28 PolarHBondContact O-N 2.85Å
27	K	32	Very low	35.1	Very low	162 Å²	162	93.5 Å²	93.5	70%	0.704	45%	0.453	S	S	*	.			trans	-42.3	109	168.2	-85.1	-174.7	174.1	-175.2	0	109.1	T29	K27-T29 PolarHBondContact O-N 3.3Å
28	H	39.1	Very low	34.3	Very low	60 Å²	60	93.8 Å²	93.8	28%	0.278	46%	0.459	S	S	.	.	S	Bend	trans	14.7	73.6	163	-64.4	-82.6	0	0	0	115.9	G26 E101 I103 Y176	G26-H28 PolarHBondContact O-N 2.85Å; H28-E101 WeakPolarHBondContact CB-OE1 3.46Å; H28-E101 IonicContact CD2-OE1 3.77Å; H28-E101 PolarHBondContact CD2-OE1 3.09Å; H28-E101 IonicContact CD2-OE2 2.94Å; H28-E101 PolarHBondContact CD2-OE2 2.66Å; H28-E101 VanDerWaalsContact CD2-OE2 3.29Å; H28-E101 VanDerWaalsContact CE1-CD 3.47Å; H28-E101 IonicContact CE1-OE1 3.88Å; H28-E101 IonicContact CE1-OE2 3.49Å; H28-E101 PolarHBondContact CE1-OE2 2.85Å; H28-E101 IonicContact CG-OE1 3.47Å; H28-E101 IonicContact CG-OE2 2.85Å; H28-E101 IonicContact ND1-OE1 2.87Å; H28-E101 PolarHBondContact ND1-OE1 3.04Å; H28-E101 IonicContact ND1-OE2 3.5Å; H28-E101 PolarHBondContact ND1-OE2 2.69Å; H28-E101 IonicContact NE2-OE1 3.18Å; H28-E101 IonicContact NE2-OE2 2.9Å; H28-E101 PolarHBondContact NE2-OE2 3.46Å; H28-I103 WeakPolarHBondContact ND1-CG2 3.5Å; H28-Y176 VanDerWaalsContact O-CE2 3.3Å; H28-Y176 WeakPolarHBondContact O-CE2 3.29Å; H28-Y176 PolarHBondContact O-OH 3.2Å
29	T	32.7	Very low	33.2	Very low	51 Å²	51	95.8 Å²	95.8	31%	0.313	49%	0.488	S	S	.	.			trans	-111.4	98.2	164.3	34.8	0	0	0	0	107.2	K27 Y176 R206	K27-T29 PolarHBondContact O-N 3.3Å; T29-Y176 HydrophobicContact CG2-CE1 3.54Å; T29-Y176 WeakPolarHBondContact CG2-OH 3.44Å; T29-R206 PolarHBondContact O-NE 3.27Å; T29-R206 PolarHBondContact O-NH1 3.25Å; T29-R206 PolarHBondContact O-NH2 3.43Å; T29-R206 VanDerWaalsContact OG1-CZ 3.28Å; T29-R206 PolarHBondContact OG1-NH1 3.02Å; T29-R206 PolarHBondContact OG1-NH2 2.8Å
30	Y	33.3	Very low	32.3	Very low	71 Å²	71	99 Å²	99	28%	0.278	50%	0.501	S	S	.	.			trans	-56.4	131.2	132.5	-126.9	-126.4	0	0	0	104.6	S32 I103 E105	Y30-S32 VanDerWaalsContact C-N 3.31Å; Y30-S32 PolarHBondContact O-N 2.95Å; Y30-I103 WeakPolarHBondContact CB-O 3.33Å; Y30-I103 WeakPolarHBondContact CD2-O 3.44Å; Y30-I103 PolarHBondContact N-O 2.77Å; Y30-E105 WeakPolarHBondContact CE1-O 3.35Å
31	D	36.3	Very low	31.4	Very low	79 Å²	79	100.2 Å²	100.2	42%	0.422	52%	0.517	S	S	.	.			trans	-83	91.1	162	-159.6	-5.4	0	0	0	107.2	R33	D31-R33 PolarHBondContact O-N 2.93Å; D31-R33 WeakPolarHBondContact OD1-CB 3.13Å; D31-R33 VanDerWaalsContact OD1-CD 3.31Å; D31-R33 WeakPolarHBondContact OD1-CD 3.26Å; D31-R33 WeakPolarHBondContact OD1-CG 3.46Å; D31-R33 PolarHBondContact OD1-N 3.28Å; D31-R33 VanDerWaalsContact OD1-N 3.07Å
32	S	33.6	Very low	30.6	Very low	9 Å²	9	104.9 Å²	104.9	6%	0.063	54%	0.536	C	S	.	.	G	3₁₀ helix	trans	-67.7	1.8	168.1	57.4	0	0	0	0	112.2	Y30 Q34 S35	Y30-S32 VanDerWaalsContact C-N 3.31Å; Y30-S32 PolarHBondContact O-N 2.95Å; S32-Q34 PolarHBondContact O-N 3.2Å; S32-S35 CarbonylContact O-C 3.42Å; S32-S35 PolarHBondContact O-N 2.96Å; S32-S35 PolarHBondContact O-OG 3.45Å
33	R	30.7	Very low	29.6	Very low	202 Å²	202	109.9 Å²	109.9	76%	0.762	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-71.2	-1.2	173.4	-59.8	173.2	-176	171.3	2	114.1	D31 S35	D31-R33 PolarHBondContact O-N 2.93Å; D31-R33 WeakPolarHBondContact OD1-CB 3.13Å; D31-R33 VanDerWaalsContact OD1-CD 3.31Å; D31-R33 WeakPolarHBondContact OD1-CD 3.26Å; D31-R33 WeakPolarHBondContact OD1-CG 3.46Å; D31-R33 PolarHBondContact OD1-N 3.28Å; D31-R33 VanDerWaalsContact OD1-N 3.07Å; R33-S35 VanDerWaalsContact C-N 3.28Å
34	Q	32.2	Very low	28.7	Very low	62 Å²	62	114 Å²	114	29%	0.29	58%	0.579	S	S	.	*	G	3₁₀ helix	trans	-85.6	6.8	160.7	-74.2	-171.4	-31.9	0	0	113	S32 G303 D306	S32-Q34 PolarHBondContact O-N 3.2Å; Q34-G303 CarbonylContact O-C 3.57Å; Q34-G303 WeakPolarHBondContact O-CA 3.41Å; Q34-D306 PolarHBondContact NE2-OD2 3.43Å
35	S	25.2	Very low	28.1	Very low	47 Å²	47	116.1 Å²	116.1	33%	0.329	59%	0.585	S	S	.	*	S	Bend	trans	-138.6	54.7	167.5	78.9	0	0	0	0	111.7	S32 R33	S32-S35 CarbonylContact O-C 3.42Å; S32-S35 PolarHBondContact O-N 2.96Å; S32-S35 PolarHBondContact O-OG 3.45Å; R33-S35 VanDerWaalsContact C-N 3.28Å
36	V	23	Very low	27.4	Very low	51 Å²	51	114.1 Å²	114.1	31%	0.309	59%	0.585	S	S	.	*			trans	-128.3	101.5	175.9	177.9	0	0	0	0	109.1	F179	V36-F179 HydrophobicContact CB-CE2 4.23Å; V36-F179 HydrophobicContact CG1-CE2 4Å; V36-F179 HydrophobicContact CG1-CZ 4.01Å; V36-F179 HydrophobicContact CG2-CE2 4.03Å
37	C	24.2	Very low	26.9	Very low	95 Å²	95	120.5 Å²	120.5	64%	0.642	60%	0.604	S	S	*	*			trans	-156	88.3	158.5	-83.2	0	0	0	0	111.1
38	D	24.4	Very low	26.6	Very low	122 Å²	122	121.6 Å²	121.6	65%	0.652	61%	0.612	S	S	*	*			trans	32.8	108.4	146.2	-63.2	-23.1	0	0	0	120.2	K40	D38-K40 PolarHBondContact O-N 3.09Å
39	G	22.2	Very low	25.8	Very low	86 Å²	86	127.6 Å²	127.6	89%	0.887	64%	0.64	S	S	*	*			trans	-56.9	118.5	157.3	0	0	0	0	0	111.6
40	K	23.1	Very low	25.5	Very low	181 Å²	181	131 Å²	131	79%	0.787	66%	0.663	S	S	*	*			trans	-114.9	122.4	162	-75.2	-175.3	-179.3	172.6	0	109.3	D38 F42	D38-K40 PolarHBondContact O-N 3.09Å; K40-F42 PolarHBondContact O-N 2.87Å
41	N	21.7	Very low	25	Very low	163 Å²	163	134 Å²	134	87%	0.872	69%	0.688	S	S	*	*			trans	-14	119	164.4	-75	-26.9	0	0	0	115
42	F	20.5	Very low	24.4	Very low	209 Å²	209	136 Å²	136	92%	0.917	71%	0.708	S	S	*	*			trans	-110.4	115.3	151.6	-94.7	-88.9	0	0	0	109.1	K40	K40-F42 PolarHBondContact O-N 2.87Å
43	Q	20.9	Very low	23.9	Very low	175 Å²	175	140.7 Å²	140.7	82%	0.818	74%	0.741	S	S	*	*			trans	-68.3	142	163	-72.9	-179.7	-47.5	0	0	108.6	I45	Q43-I45 PolarHBondContact O-N 3.32Å
44	E	19.6	Very low	23.9	Very low	194 Å²	194	138.6 Å²	138.6	91%	0.907	74%	0.744	S	S	*	*			trans	-45.7	121.5	167.1	-72.5	170.1	139.5	0	0	110.8
45	I	23.5	Very low	23.6	Very low	148 Å²	148	144.8 Å²	144.8	76%	0.759	77%	0.773	S	S	*	*			trans	-130.5	110	154.9	-59.8	-179.4	0	0	0	105.9	Q43	Q43-I45 PolarHBondContact O-N 3.32Å
46	E	22.6	Very low	23.7	Very low	188 Å²	188	150.6 Å²	150.6	88%	0.879	80%	0.8	S	S	*	*			trans	-59.9	125.6	165.1	-67.5	177.2	138.9	0	0	108.9
47	E	24.3	Very low	24	Very low	175 Å²	175	153.6 Å²	153.6	82%	0.818	82%	0.823	S	S	*	*			trans	-153.3	110.8	155.8	-115.8	170.7	-155.4	0	0	112.3
48	E	25.4	Very low	24.1	Very low	185 Å²	185	156.5 Å²	156.5	86%	0.864	83%	0.832	S	S	*	*			trans	29.6	121.3	146.6	-60.1	-172.1	158.6	0	0	121.7
49	Q	21.9	Very low	24.3	Very low	187 Å²	187	156.4 Å²	156.4	87%	0.874	84%	0.841	S	S	*	*			trans	-66.2	131.5	165.6	-65	-163.3	-23.3	0	0	112.3
50	P	26	Very low	24.8	Very low	121 Å²	121	155.3 Å²	155.3	79%	0.786	83%	0.83	S	S	*	*			trans	-88.4	112.5	160.5	30.8	-23.9	0	0	0	109.6	C52	P50-C52 PolarHBondContact O-N 3.16Å
51	T	23.8	Very low	24.9	Very low	134 Å²	134	156 Å²	156	82%	0.822	84%	0.836	S	S	*	*			trans	-57.4	120.1	162.2	48.2	0	0	0	0	109.9
52	C	24.5	Very low	25.3	Very low	122 Å²	122	153.9 Å²	153.9	82%	0.824	83%	0.831	S	S	*	*			trans	-126	107.3	162.3	-120.9	0	0	0	0	110.4	P50 N54	P50-C52 PolarHBondContact O-N 3.16Å; C52-N54 PolarHBondContact O-N 3.4Å
53	S	23.2	Very low	25.8	Very low	108 Å²	108	150.3 Å²	150.3	76%	0.755	83%	0.826	S	S	*	*			trans	-67	114.4	170.3	47.2	0	0	0	0	110.7
54	N	29.6	Very low	26.2	Very low	158 Å²	158	151.9 Å²	151.9	85%	0.845	83%	0.834	S	S	*	*			trans	-97.4	112.9	160.1	-85.9	-22.3	0	0	0	109.2	C52 L56	C52-N54 PolarHBondContact O-N 3.4Å; N54-L56 PolarHBondContact O-N 2.76Å
55	Q	25.6	Very low	26.8	Very low	191 Å²	191	145.4 Å²	145.4	89%	0.893	82%	0.819	S	S	*	*			trans	-66.8	114.2	168.4	-67.2	-177.3	-6.4	0	0	108.7
56	L	27.9	Very low	27.1	Very low	169 Å²	169	148.8 Å²	148.8	89%	0.885	82%	0.823	S	S	*	*			trans	-80.5	111.6	161.4	-87.3	149.6	0	0	0	107.7	N54 D58	N54-L56 PolarHBondContact O-N 2.76Å; L56-D58 PolarHBondContact O-N 2.97Å
57	S	29.8	Very low	27.6	Very low	115 Å²	115	147.5 Å²	147.5	80%	0.804	82%	0.821	S	S	*	*			trans	-71	110.8	165.2	53.7	0	0	0	0	109.2
58	D	26.6	Very low	28.3	Very low	156 Å²	156	149.2 Å²	149.2	83%	0.834	82%	0.821	S	S	*	*			trans	-83.1	111.5	172.2	-175.7	17.4	0	0	0	109.9	L56	L56-D58 PolarHBondContact O-N 2.97Å
59	S	27.4	Very low	29.5	Very low	120 Å²	120	145.8 Å²	145.8	84%	0.839	82%	0.817	S	S	*	*			trans	-167.9	90.3	153.3	63	0	0	0	0	110.5
60	G	32.2	Very low	31.3	Very low	63 Å²	63	139.3 Å²	139.3	65%	0.649	80%	0.795	S	S	*	*			trans	-178.5	102.5	170	0	0	0	0	0	111.5
61	Q	25.9	Very low	33.4	Very low	194 Å²	194	137.2 Å²	137.2	91%	0.907	78%	0.78	S	S	*	*			trans	-51	124.7	177.8	-68.4	179.2	-48.7	0	0	111.5	T63	Q61-T63 PolarHBondContact O-N 3.01Å
62	P	30	Very low	35.7	Very low	120 Å²	120	133.7 Å²	133.7	78%	0.779	75%	0.752	S	S	*	*			trans	-82.1	114	171.7	29.8	-26.8	0	0	0	108.9	E64	P62-E64 PolarHBondContact O-N 3.09Å
63	T	31.9	Very low	38.3	Very low	133 Å²	133	129.8 Å²	129.8	82%	0.816	72%	0.723	S	S	*	*			trans	-52.3	126.9	161.3	47.8	0	0	0	0	109.2	Q61 G65	Q61-T63 PolarHBondContact O-N 3.01Å; T63-G65 VanDerWaalsContact C-N 3.27Å; T63-G65 PolarHBondContact O-N 2.63Å
64	E	29.3	Very low	41.1	Very low	208 Å²	208	129.6 Å²	129.6	97%	0.972	71%	0.711	S	S	*	*	S	Bend	trans	-61.8	84.5	176.6	-69.2	-177.6	148.6	0	0	111.2	P62	P62-E64 PolarHBondContact O-N 3.09Å
65	G	31.2	Very low	43.4	Very low	58 Å²	58	125 Å²	125	60%	0.598	68%	0.684	S	S	*	*			trans	-141.2	78.3	167	0	0	0	0	0	106.7	T63 N67	T63-G65 VanDerWaalsContact C-N 3.27Å; T63-G65 PolarHBondContact O-N 2.63Å; G65-N67 PolarHBondContact O-N 3.18Å
66	R	30.8	Very low	46.1	Very low	220 Å²	220	115.9 Å²	115.9	83%	0.83	64%	0.641	S	S	*	*			trans	-66.1	81.7	-178.4	-170.4	176.5	-174.7	170.2	2.8	109.9	R68	R66-R68 VanDerWaalsContact C-N 3.34Å; R66-R68 HydrophobicContact CG-CG 4.49Å; R66-R68 PolarHBondContact O-N 2.8Å
67	N	32.8	Very low	48.9	Very low	160 Å²	160	108.6 Å²	108.6	86%	0.856	60%	0.603	S	S	*	*			trans	-63.7	99.4	157	-99	-11.7	0	0	0	106.3	G65 S69	G65-N67 PolarHBondContact O-N 3.18Å; N67-S69 PolarHBondContact O-N 2.86Å; N67-S69 VanDerWaalsContact O-N 3.16Å
68	R	38.6	Very low	51.5	Low	212 Å²	212	108.7 Å²	108.7	80%	0.8	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-60	118.3	166	-69.8	-176.5	-178.8	-176.7	-0.1	106.1	R66 A70	R66-R68 VanDerWaalsContact C-N 3.34Å; R66-R68 HydrophobicContact CG-CG 4.49Å; R66-R68 PolarHBondContact O-N 2.8Å; R68-A70 PolarHBondContact O-N 3.38Å
69	S	51	Low	54.2	Low	113 Å²	113	103.3 Å²	103.3	79%	0.79	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-59	128.6	170.8	66.6	0	0	0	0	107.3	N67 T71	N67-S69 PolarHBondContact O-N 2.86Å; N67-S69 VanDerWaalsContact O-N 3.16Å; S69-T71 PolarHBondContact O-N 2.83Å
70	A	59.9	Low	57	Low	50 Å²	50	98 Å²	98	41%	0.413	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-53.5	141.9	176	0	0	0	0	0	109.6	R68 E74	R68-A70 PolarHBondContact O-N 3.38Å; A70-E74 WeakPolarHBondContact CA-OE2 3.38Å; A70-E74 HydrophobicContact CB-CB 4.04Å
71	T	69.9	Low	59.7	Low	78 Å²	78	98.3 Å²	98.3	48%	0.479	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-65	154.6	171.3	62.4	0	0	0	0	109.9	S69 L73 E74 E75	S69-T71 PolarHBondContact O-N 2.83Å; T71-L73 PolarHBondContact O-N 2.85Å; T71-L73 VanDerWaalsContact O-N 3.1Å; T71-E74 PolarHBondContact N-OE2 2.75Å; T71-E74 WeakPolarHBondContact O-CB 3.37Å; T71-E74 PolarHBondContact O-N 2.79Å; T71-E74 WeakPolarHBondContact OG1-CG 3.28Å; T71-E74 PolarHBondContact OG1-OE2 2.82Å; T71-E75 PolarHBondContact O-N 3.1Å
72	Y	71.6	Confident	62.8	Low	59 Å²	59	90.2 Å²	90.2	23%	0.231	49%	0.489	C	S	.	.	H	α-helix	trans	-41.4	-47.9	176.4	172.8	-89.8	0	0	0	113.5	I76 N129 I142	Y72-I76 HydrophobicContact CD1-CD1 4.14Å; Y72-I76 HydrophobicContact CE1-CD1 3.54Å; Y72-I76 PolarHBondContact O-N 2.97Å; Y72-N129 WeakPolarHBondContact CE1-O 3.36Å; Y72-I142 HydrophobicContact CD2-CB 4.1Å; Y72-I142 HydrophobicContact CD2-CD1 3.94Å; Y72-I142 HydrophobicContact CD2-CG2 3.96Å; Y72-I142 HydrophobicContact CE2-CB 3.39Å; Y72-I142 HydrophobicContact CE2-CD1 3.82Å; Y72-I142 HydrophobicContact CE2-CG1 4.14Å; Y72-I142 HydrophobicContact CE2-CG2 3.66Å
73	L	79.2	Confident	65.7	Low	41 Å²	41	91 Å²	91	22%	0.215	49%	0.492	C	S	.	.	H	α-helix	trans	-72.2	-35.2	-178.4	-176.3	59.8	0	0	0	112.4	T71 E75 I76 L77 V85 L191	T71-L73 PolarHBondContact O-N 2.85Å; T71-L73 VanDerWaalsContact O-N 3.1Å; L73-E75 VanDerWaalsContact C-N 3.31Å; L73-E75 PolarHBondContact O-N 3.41Å; L73-I76 PolarHBondContact O-N 3.42Å; L73-L77 HydrophobicContact CD1-CD1 4.49Å; L73-L77 HydrophobicContact CD1-CG 4.31Å; L73-L77 HydrophobicContact CG-CD1 4.03Å; L73-L77 HydrophobicContact CG-CG 4.3Å; L73-L77 WeakPolarHBondContact O-CB 3.47Å; L73-L77 VanDerWaalsContact O-CG 3.23Å; L73-L77 WeakPolarHBondContact O-CG 3.33Å; L73-L77 PolarHBondContact O-N 2.97Å; L73-V85 HydrophobicContact CD1-CG2 3.81Å; L73-V85 HydrophobicContact CD2-CG2 3.77Å; L73-V85 HydrophobicContact CG-CG2 4.13Å; L73-L191 HydrophobicContact CD1-CD1 4.15Å
74	E	82.3	Confident	68.6	Low	104 Å²	104	91 Å²	91	49%	0.486	48%	0.482	S	S	.	.	H	α-helix	trans	-64.3	-36.6	178.1	-75	166.1	158.5	0	0	111.7	A70 T71 L77 Q78	A70-E74 WeakPolarHBondContact CA-OE2 3.38Å; A70-E74 HydrophobicContact CB-CB 4.04Å; T71-E74 PolarHBondContact N-OE2 2.75Å; T71-E74 WeakPolarHBondContact O-CB 3.37Å; T71-E74 PolarHBondContact O-N 2.79Å; T71-E74 WeakPolarHBondContact OG1-CG 3.28Å; T71-E74 PolarHBondContact OG1-OE2 2.82Å; E74-L77 PolarHBondContact O-N 3.48Å; E74-Q78 WeakPolarHBondContact O-CB 3.39Å; E74-Q78 PolarHBondContact O-N 3.36Å
75	E	78.7	Confident	71.6	Confident	61 Å²	61	82.7 Å²	82.7	29%	0.285	45%	0.446	S	S	.	.	H	α-helix	trans	-67.7	-43	175.7	-177.1	156.5	-148.6	0	0	112.1	T71 L73 L77 Q78 H79 R288	T71-E75 PolarHBondContact O-N 3.1Å; L73-E75 VanDerWaalsContact C-N 3.31Å; L73-E75 PolarHBondContact O-N 3.41Å; E75-L77 VanDerWaalsContact C-N 3.34Å; E75-L77 PolarHBondContact O-N 3.49Å; E75-Q78 WeakPolarHBondContact O-CB 3.35Å; E75-Q78 PolarHBondContact O-N 3.15Å; E75-H79 PolarHBondContact O-CD2 2.95Å; E75-H79 VanDerWaalsContact O-CD2 3.24Å; E75-H79 PolarHBondContact O-N 3.02Å; E75-R288 IonicContact OE1-CZ 2.57Å; E75-R288 IonicContact OE1-NH1 3.76Å; E75-R288 PolarHBondContact OE1-NH1 3.35Å
76	I	80.7	Confident	74.6	Confident	0 Å²	0	81.7 Å²	81.7	0%	0	43%	0.426	C	S	.	.	H	α-helix	trans	-58.4	-48.7	173.1	-68.2	179.8	0	0	0	110.5	Y72 L73 Q78 H79 C80 I128 I142 I149 C156 L193	Y72-I76 HydrophobicContact CD1-CD1 4.14Å; Y72-I76 HydrophobicContact CE1-CD1 3.54Å; Y72-I76 PolarHBondContact O-N 2.97Å; L73-I76 PolarHBondContact O-N 3.42Å; I76-Q78 VanDerWaalsContact C-N 3.3Å; I76-Q78 PolarHBondContact O-N 3.45Å; I76-H79 PolarHBondContact O-N 3.37Å; I76-C80 PolarHBondContact O-N 2.99Å; I76-C80 PolarHBondContact O-SG 2.71Å; I76-I128 HydrophobicContact CD1-CD1 3.56Å; I76-I142 HydrophobicContact CD1-CD1 3.77Å; I76-I142 HydrophobicContact CG1-CD1 3.43Å; I76-I142 VanDerWaalsContact CG1-CD1 3.43Å; I76-I142 HydrophobicContact CG1-CG1 4.41Å; I76-I149 HydrophobicContact CG1-CD1 4.5Å; I76-C156 HydrophobicContact CG2-CB 3.76Å; I76-L193 HydrophobicContact CG2-CD2 3.59Å
77	L	86.5	Confident	77.6	Confident	16 Å²	16	74.2 Å²	74.2	8%	0.084	41%	0.405	C	S	.	.	H	α-helix	trans	-63	-39.5	-179.4	-71.6	176.7	0	0	0	111.3	L73 E74 E75 H79 C80 G81 Q82 E84 V85 C156	L73-L77 HydrophobicContact CD1-CD1 4.49Å; L73-L77 HydrophobicContact CD1-CG 4.31Å; L73-L77 HydrophobicContact CG-CD1 4.03Å; L73-L77 HydrophobicContact CG-CG 4.3Å; L73-L77 WeakPolarHBondContact O-CB 3.47Å; L73-L77 VanDerWaalsContact O-CG 3.23Å; L73-L77 WeakPolarHBondContact O-CG 3.33Å; L73-L77 PolarHBondContact O-N 2.97Å; E74-L77 PolarHBondContact O-N 3.48Å; E75-L77 VanDerWaalsContact C-N 3.34Å; E75-L77 PolarHBondContact O-N 3.49Å; L77-H79 PolarHBondContact O-N 3.32Å; L77-C80 PolarHBondContact O-N 3.12Å; L77-G81 PolarHBondContact O-N 3.1Å; L77-Q82 CarbonylContact C-O 3.55Å; L77-Q82 HydrophobicContact CB-CB 4.43Å; L77-Q82 HydrophobicContact CD2-CB 3.75Å; L77-Q82 PolarHBondContact O-N 3.41Å; L77-E84 WeakPolarHBondContact CD2-O 3.46Å; L77-V85 HydrophobicContact CD1-CG2 4.23Å; L77-V85 HydrophobicContact CD2-CG2 4.1Å; L77-C156 HydrophobicContact CD2-CB 4.13Å
78	Q	85.9	Confident	80.4	Confident	117 Å²	117	67.5 Å²	67.5	55%	0.547	37%	0.368	S	S	.	.	H	α-helix	trans	-58.4	-46.7	173.4	-174.6	179.6	12	0	0	111.4	E74 E75 I76 C80 G81	E74-Q78 WeakPolarHBondContact O-CB 3.39Å; E74-Q78 PolarHBondContact O-N 3.36Å; E75-Q78 WeakPolarHBondContact O-CB 3.35Å; E75-Q78 PolarHBondContact O-N 3.15Å; I76-Q78 VanDerWaalsContact C-N 3.3Å; I76-Q78 PolarHBondContact O-N 3.45Å; Q78-C80 VanDerWaalsContact C-N 3.35Å; Q78-C80 PolarHBondContact O-N 3.26Å; Q78-G81 PolarHBondContact O-N 3.31Å; Q78-G81 VanDerWaalsContact O-N 3.12Å
79	H	82.3	Confident	82.8	Confident	43 Å²	43	65.2 Å²	65.2	20%	0.199	36%	0.364	C	S	.	.	H	α-helix	trans	-64.4	-36.8	176.4	-81	-60.4	0	0	0	113.1	E75 I76 L77 G81 I149 Y290	E75-H79 PolarHBondContact O-CD2 2.95Å; E75-H79 VanDerWaalsContact O-CD2 3.24Å; E75-H79 PolarHBondContact O-N 3.02Å; I76-H79 PolarHBondContact O-N 3.37Å; L77-H79 PolarHBondContact O-N 3.32Å; H79-G81 PolarHBondContact O-N 3.07Å; H79-I149 HydrophobicContact CB-CD1 4.4Å; H79-Y290 AromaticContact CE1-CE1 3.55Å; H79-Y290 AromaticContact CE1-CZ 3.62Å; H79-Y290 PolarHBondContact CE1-OH 3.4Å; H79-Y290 AromaticContact NE2-CE1 3.58Å; H79-Y290 AromaticContact NE2-CZ 3.88Å; H79-Y290 PolarHBondContact NE2-OH 3.45Å
80	C	86.6	Confident	84.7	Confident	8 Å²	8	63.9 Å²	63.9	5%	0.054	35%	0.348	C	S	.	.	H	α-helix	trans	-71.7	-12.4	174.9	-60.4	0	0	0	0	113.5	I76 L77 Q78 Q82 R155	I76-C80 PolarHBondContact O-N 2.99Å; I76-C80 PolarHBondContact O-SG 2.71Å; L77-C80 PolarHBondContact O-N 3.12Å; Q78-C80 VanDerWaalsContact C-N 3.35Å; Q78-C80 PolarHBondContact O-N 3.26Å; C80-Q82 VanDerWaalsContact C-N 3.28Å; C80-Q82 HydrophobicContact CB-CB 4.11Å; C80-Q82 HydrophobicContact CB-CG 3.8Å; C80-R155 PolarHBondContact O-NH1 3.17Å
81	G	88.2	Confident	86	Confident	69 Å²	69	61.7 Å²	61.7	71%	0.711	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	35.5	-168.3	0	0	0	0	0	112.2	L77 Q78 H79	L77-G81 PolarHBondContact O-N 3.1Å; Q78-G81 PolarHBondContact O-N 3.31Å; Q78-G81 VanDerWaalsContact O-N 3.12Å; H79-G81 PolarHBondContact O-N 3.07Å
82	Q	92	Very high	86.4	Confident	25 Å²	25	59.9 Å²	59.9	12%	0.117	32%	0.319	C	S	.	.			trans	-112.4	147.5	-178.6	-74.1	175.9	-128	0	0	110.8	L77 C80 E84 R155 C156	L77-Q82 CarbonylContact C-O 3.55Å; L77-Q82 HydrophobicContact CB-CB 4.43Å; L77-Q82 HydrophobicContact CD2-CB 3.75Å; L77-Q82 PolarHBondContact O-N 3.41Å; C80-Q82 VanDerWaalsContact C-N 3.28Å; C80-Q82 HydrophobicContact CB-CB 4.11Å; C80-Q82 HydrophobicContact CB-CG 3.8Å; Q82-E84 PolarHBondContact NE2-O 3.44Å; Q82-R155 VanDerWaalsContact OE1-CD 3.32Å; Q82-C156 PolarHBondContact NE2-O 3.18Å
83	T	91.1	Very high	86.3	Confident	137 Å²	137	60.9 Å²	60.9	84%	0.84	34%	0.34	S	S	*	.	S	Bend	trans	-96	-18.5	170.3	50	0	0	0	0	112.5
84	E	92.9	Very high	85.3	Confident	132 Å²	132	61.8 Å²	61.8	62%	0.617	36%	0.359	S	S	*	.	S	Bend	trans	-146.5	158.6	-177.5	65.8	-169.6	142.7	0	0	111	L77 Q82	L77-E84 WeakPolarHBondContact CD2-O 3.46Å; Q82-E84 PolarHBondContact NE2-O 3.44Å
85	V	92	Very high	84.4	Confident	34 Å²	34	57.1 Å²	57.1	21%	0.206	34%	0.338	C	S	.	.			trans	-73.1	129.8	173.1	-175.1	0	0	0	0	108.8	L73 L77 L157 Q158 L191	L73-V85 HydrophobicContact CD1-CG2 3.81Å; L73-V85 HydrophobicContact CD2-CG2 3.77Å; L73-V85 HydrophobicContact CG-CG2 4.13Å; L77-V85 HydrophobicContact CD1-CG2 4.23Å; L77-V85 HydrophobicContact CD2-CG2 4.1Å; V85-L157 VanDerWaalsContact CG1-C 3.47Å; V85-Q158 HydrophobicContact CG1-CB 3.7Å; V85-L191 HydrophobicContact CG1-CD2 3.73Å; V85-L191 HydrophobicContact CG2-CD2 4.45Å
86	L	93.9	Very high	84.3	Confident	36 Å²	36	59.6 Å²	59.6	19%	0.188	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	171.5	179.3	-64.6	172	0	0	0	111.2	D90 I91 R155 C156 L157 Q158	L86-D90 HydrophobicContact CB-CB 4.19Å; L86-D90 HydrophobicContact CD2-CB 4.05Å; L86-I91 HydrophobicContact CD1-CD1 3.98Å; L86-R155 HydrophobicContact CD1-CB 4.38Å; L86-R155 HydrophobicContact CD1-CG 4.42Å; L86-C156 PolarHBondContact N-O 2.98Å; L86-C156 VanDerWaalsContact N-O 3.08Å; L86-L157 HydrophobicContact CB-CB 3.95Å; L86-L157 CarbonylContact O-C 3.49Å; L86-L157 WeakPolarHBondContact O-CA 3.27Å; L86-L157 WeakPolarHBondContact O-CB 3.47Å; L86-Q158 PolarHBondContact O-N 2.65Å
87	T	93.5	Very high	84.5	Confident	63 Å²	63	60.3 Å²	60.3	39%	0.387	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	164.1	167.1	69.1	0	0	0	0	110.9	K89 D90 I91	T87-K89 PolarHBondContact O-N 3.37Å; T87-K89 VanDerWaalsContact O-N 3.14Å; T87-K89 PolarHBondContact OG1-N 3.05Å; T87-D90 WeakPolarHBondContact CB-OD2 3.39Å; T87-D90 PolarHBondContact N-OD2 2.85Å; T87-D90 WeakPolarHBondContact O-CB 3.26Å; T87-D90 PolarHBondContact O-N 2.74Å; T87-D90 VanDerWaalsContact OG1-CG 3.27Å; T87-D90 PolarHBondContact OG1-N 2.87Å; T87-D90 PolarHBondContact OG1-OD2 3.28Å; T87-I91 PolarHBondContact O-N 3.4Å
88	W	92.1	Very high	84.3	Confident	20 Å²	20	66 Å²	66	8%	0.076	38%	0.379	C	S	.	.	H	α-helix	trans	-55.2	-29	169.2	-70.1	107.1	0	0	0	113.1	I91 S92 F97 I125 L157 G159 K160 Y161 P162 L165 Y192 L194	W88-I91 PolarHBondContact O-N 2.84Å; W88-S92 WeakPolarHBondContact O-CB 3.47Å; W88-S92 PolarHBondContact O-N 2.63Å; W88-S92 PolarHBondContact O-OG 2.87Å; W88-F97 HydrophobicContact CB-CE2 4.31Å; W88-F97 HydrophobicContact CE3-CE2 4.21Å; W88-F97 AromaticContact CE3-CZ 3.87Å; W88-F97 HydrophobicContact CE3-CZ 3.87Å; W88-F97 WeakPolarHBondContact O-CZ 3.34Å; W88-I125 HydrophobicContact CH2-CD1 4.15Å; W88-I125 HydrophobicContact CH2-CG2 4.27Å; W88-I125 HydrophobicContact CZ3-CD1 4.42Å; W88-L157 HydrophobicContact CB-CD1 4.48Å; W88-L157 HydrophobicContact CD2-CD1 3.21Å; W88-L157 HydrophobicContact CE3-CD1 3.57Å; W88-L157 HydrophobicContact CG-CD1 3.66Å; W88-L157 HydrophobicContact CH2-CD1 4.03Å; W88-L157 HydrophobicContact CZ2-CD1 3.72Å; W88-L157 HydrophobicContact CZ3-CD1 3.97Å; W88-G159 PolarHBondContact NE1-O 3.14Å; W88-G159 VanDerWaalsContact NE1-O 3.08Å; W88-K160 PolarHBondContact NE1-O 3.12Å; W88-K160 VanDerWaalsContact NE1-O 3.08Å; W88-Y161 HydrophobicContact CH2-CD2 4.49Å; W88-Y161 HydrophobicContact CH2-CE2 4.34Å; W88-Y161 HydrophobicContact CZ2-CD2 4.1Å; W88-Y161 HydrophobicContact CZ2-CE2 4.36Å; W88-P162 HydrophobicContact CB-CG 4.08Å; W88-P162 HydrophobicContact CD2-CG 3.38Å; W88-P162 VanDerWaalsContact CE2-CD 3.45Å; W88-P162 HydrophobicContact CE3-CG 3.49Å; W88-P162 VanDerWaalsContact CE3-CG 3.49Å; W88-P162 HydrophobicContact CG-CG 3.66Å; W88-P162 HydrophobicContact CZ2-CG 4.42Å; W88-P162 HydrophobicContact CZ3-CG 4.07Å; W88-L165 HydrophobicContact CH2-CD1 4.23Å; W88-L165 HydrophobicContact CZ3-CD1 3.86Å; W88-Y192 HydrophobicContact CH2-CG 4.39Å; W88-Y192 HydrophobicContact CZ2-CD1 4.27Å; W88-Y192 AromaticContact CZ2-CD2 3.52Å; W88-Y192 HydrophobicContact CZ2-CD2 3.52Å; W88-Y192 AromaticContact CZ2-CE2 3.8Å; W88-Y192 HydrophobicContact CZ2-CE2 3.8Å; W88-Y192 AromaticContact CZ2-CG 3.77Å; W88-Y192 HydrophobicContact CZ2-CG 3.77Å; W88-L194 HydrophobicContact CH2-CD1 4.03Å; W88-L194 HydrophobicContact CZ3-CD1 4.25Å; W88-L194 HydrophobicContact CZ3-CD2 4.1Å
89	K	89	Confident	84.4	Confident	164 Å²	164	66.6 Å²	66.6	71%	0.713	38%	0.379	S	S	*	.	H	α-helix	trans	-70.2	-34.5	176.9	-171.5	179.2	176.2	-176.3	0	112.4	T87 I91 S92 A93	T87-K89 PolarHBondContact O-N 3.37Å; T87-K89 VanDerWaalsContact O-N 3.14Å; T87-K89 PolarHBondContact OG1-N 3.05Å; K89-I91 VanDerWaalsContact C-N 3.27Å; K89-I91 PolarHBondContact O-N 2.91Å; K89-S92 WeakPolarHBondContact CA-OG 3.49Å; K89-S92 PolarHBondContact O-N 3.47Å; K89-S92 PolarHBondContact O-OG 3.3Å; K89-A93 PolarHBondContact O-N 3.49Å
90	D	90	Very high	84.9	Confident	85 Å²	85	65 Å²	65	46%	0.455	37%	0.372	S	S	.	.	H	α-helix	trans	-69.3	-30.8	177	-56.7	-49.7	0	0	0	111.4	L86 T87	L86-D90 HydrophobicContact CB-CB 4.19Å; L86-D90 HydrophobicContact CD2-CB 4.05Å; T87-D90 WeakPolarHBondContact CB-OD2 3.39Å; T87-D90 PolarHBondContact N-OD2 2.85Å; T87-D90 WeakPolarHBondContact O-CB 3.26Å; T87-D90 PolarHBondContact O-N 2.74Å; T87-D90 VanDerWaalsContact OG1-CG 3.27Å; T87-D90 PolarHBondContact OG1-N 2.87Å; T87-D90 PolarHBondContact OG1-OD2 3.28Å
91	I	88.2	Confident	85.2	Confident	4 Å²	4	68 Å²	68	2%	0.021	39%	0.385	C	S	.	.	H	α-helix	trans	-75.8	-37.9	173.5	-56	-57.9	0	0	0	111.6	L86 T87 W88 K89 A93 S95 F97 F116 R155 L157 L194	L86-I91 HydrophobicContact CD1-CD1 3.98Å; T87-I91 PolarHBondContact O-N 3.4Å; W88-I91 PolarHBondContact O-N 2.84Å; K89-I91 VanDerWaalsContact C-N 3.27Å; K89-I91 PolarHBondContact O-N 2.91Å; I91-A93 VanDerWaalsContact C-N 3.29Å; I91-A93 PolarHBondContact O-N 3.06Å; I91-S95 PolarHBondContact O-OG 3.23Å; I91-F97 HydrophobicContact CB-CZ 4.2Å; I91-F97 HydrophobicContact CG2-CE1 4.07Å; I91-F97 HydrophobicContact CG2-CZ 4.07Å; I91-F116 HydrophobicContact CD1-CE2 4.31Å; I91-F116 HydrophobicContact CG2-CD2 4.29Å; I91-F116 HydrophobicContact CG2-CE2 4.42Å; I91-R155 HydrophobicContact CD1-CB 4.05Å; I91-R155 HydrophobicContact CD1-CG 4.19Å; I91-L157 HydrophobicContact CD1-CD2 4.36Å; I91-L157 HydrophobicContact CG1-CD2 3.98Å; I91-L194 HydrophobicContact CG1-CD2 4.4Å; I91-L194 HydrophobicContact CG2-CD2 4.02Å
92	S	78.7	Confident	85.4	Confident	39 Å²	39	64.9 Å²	64.9	27%	0.273	35%	0.352	S	S	.	.	H	α-helix	trans	-79.8	-5.3	-177.5	72.5	0	0	0	0	114.7	W88 K89 G94 S95	W88-S92 WeakPolarHBondContact O-CB 3.47Å; W88-S92 PolarHBondContact O-N 2.63Å; W88-S92 PolarHBondContact O-OG 2.87Å; K89-S92 WeakPolarHBondContact CA-OG 3.49Å; K89-S92 PolarHBondContact O-N 3.47Å; K89-S92 PolarHBondContact O-OG 3.3Å; S92-G94 VanDerWaalsContact C-N 3.28Å; S92-G94 PolarHBondContact O-N 3.12Å; S92-S95 WeakPolarHBondContact CA-O 3.41Å; S92-S95 WeakPolarHBondContact CB-O 3.32Å; S92-S95 PolarHBondContact O-N 2.57Å; S92-S95 VanDerWaalsContact O-O 3.04Å
93	A	68	Low	85.2	Confident	81 Å²	81	64.8 Å²	64.8	67%	0.669	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	85.5	175.6	0	0	0	0	0	111.2	K89 I91	K89-A93 PolarHBondContact O-N 3.49Å; I91-A93 VanDerWaalsContact C-N 3.29Å; I91-A93 PolarHBondContact O-N 3.06Å
94	G	59.6	Low	84.9	Confident	59 Å²	59	58.3 Å²	58.3	61%	0.608	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	103	5	-171.8	0	0	0	0	0	115.3	S92	S92-G94 VanDerWaalsContact C-N 3.28Å; S92-G94 PolarHBondContact O-N 3.12Å
95	S	62	Low	84.4	Confident	7 Å²	7	52.5 Å²	52.5	5%	0.049	29%	0.285	C	S	.	.			trans	-126.6	113.7	-178.2	-29.2	0	0	0	0	109	I91 S92 F97 Y115	I91-S95 PolarHBondContact O-OG 3.23Å; S92-S95 WeakPolarHBondContact CA-O 3.41Å; S92-S95 WeakPolarHBondContact CB-O 3.32Å; S92-S95 PolarHBondContact O-N 2.57Å; S92-S95 VanDerWaalsContact O-O 3.04Å; S95-F97 PolarHBondContact O-N 2.73Å; S95-Y115 VanDerWaalsContact CB-O 3.28Å; S95-Y115 WeakPolarHBondContact CB-O 3.47Å; S95-Y115 PolarHBondContact OG-O 3.05Å
96	Q	76.2	Confident	83.5	Confident	112 Å²	112	51.9 Å²	51.9	52%	0.523	29%	0.285	S	S	.	.			trans	-83.8	103.8	172.2	-75.1	176.6	-38.2	0	0	108.1	E98 K99	Q96-E98 VanDerWaalsContact C-OE2 3.25Å; Q96-E98 VanDerWaalsContact CA-OE2 3.25Å; Q96-E98 WeakPolarHBondContact CA-OE2 3.45Å; Q96-E98 VanDerWaalsContact CB-OE2 3.27Å; Q96-E98 WeakPolarHBondContact CB-OE2 2.75Å; Q96-E98 PolarHBondContact O-N 2.74Å; Q96-E98 VanDerWaalsContact O-N 3.15Å; Q96-K99 HydrophobicContact CB-CD 4.18Å; Q96-K99 HydrophobicContact CB-CG 4.18Å; Q96-K99 WeakPolarHBondContact O-CB 3.14Å; Q96-K99 PolarHBondContact O-N 3.31Å
97	F	85.1	Confident	82.2	Confident	15 Å²	15	53.1 Å²	53.1	7%	0.066	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-58.6	-22.6	176.3	-66.9	-41	0	0	0	111.9	W88 I91 S95 K99 W100 P162 P164 L165	W88-F97 HydrophobicContact CB-CE2 4.31Å; W88-F97 HydrophobicContact CE3-CE2 4.21Å; W88-F97 AromaticContact CE3-CZ 3.87Å; W88-F97 HydrophobicContact CE3-CZ 3.87Å; W88-F97 WeakPolarHBondContact O-CZ 3.34Å; I91-F97 HydrophobicContact CB-CZ 4.2Å; I91-F97 HydrophobicContact CG2-CE1 4.07Å; I91-F97 HydrophobicContact CG2-CZ 4.07Å; S95-F97 PolarHBondContact O-N 2.73Å; F97-K99 PolarHBondContact O-N 3.16Å; F97-K99 VanDerWaalsContact O-N 3.13Å; F97-W100 AromaticContact CD1-CD2 3.99Å; F97-W100 HydrophobicContact CD1-CD2 3.99Å; F97-W100 AromaticContact CD1-CE2 3.77Å; F97-W100 HydrophobicContact CD1-CE3 4.36Å; F97-W100 HydrophobicContact CD1-CG 4.42Å; F97-W100 HydrophobicContact CD1-CH2 4.36Å; F97-W100 AromaticContact CD1-CZ2 3.98Å; F97-W100 HydrophobicContact CD1-CZ2 3.98Å; F97-W100 HydrophobicContact CE1-CH2 4.01Å; F97-W100 AromaticContact CE1-CZ2 3.84Å; F97-W100 HydrophobicContact CE1-CZ2 3.84Å; F97-W100 HydrophobicContact CE1-CZ3 4.44Å; F97-W100 WeakPolarHBondContact O-CB 3.48Å; F97-W100 PolarHBondContact O-N 2.91Å; F97-P162 HydrophobicContact CD2-CB 3.97Å; F97-P162 HydrophobicContact CD2-CG 4.12Å; F97-P162 HydrophobicContact CE2-CB 4.3Å; F97-P162 HydrophobicContact CE2-CG 3.96Å; F97-P164 HydrophobicContact CB-CB 3.89Å; F97-P164 HydrophobicContact CB-CG 4.27Å; F97-L165 HydrophobicContact CB-CD2 4.18Å; F97-L165 HydrophobicContact CB-CG 4.4Å; F97-L165 HydrophobicContact CD1-CD2 4.39Å; F97-L165 HydrophobicContact CG-CD2 4.48Å; F97-L165 HydrophobicContact CG-CG 4.49Å
98	E	83.1	Confident	81.3	Confident	136 Å²	136	54.7 Å²	54.7	64%	0.636	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-62.3	-15.4	172.8	-53.8	82.9	177.5	0	0	113.4	Q96 P164	Q96-E98 VanDerWaalsContact C-OE2 3.25Å; Q96-E98 VanDerWaalsContact CA-OE2 3.25Å; Q96-E98 WeakPolarHBondContact CA-OE2 3.45Å; Q96-E98 VanDerWaalsContact CB-OE2 3.27Å; Q96-E98 WeakPolarHBondContact CB-OE2 2.75Å; Q96-E98 PolarHBondContact O-N 2.74Å; Q96-E98 VanDerWaalsContact O-N 3.15Å; E98-P164 HydrophobicContact CG-CB 4.16Å; E98-P164 HydrophobicContact CG-CG 4.07Å
99	K	87.8	Confident	80.9	Confident	129 Å²	129	53.9 Å²	53.9	56%	0.561	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-100.4	1.4	175.1	-66.1	-179.7	171.3	163.3	0	113	Q96 F97	Q96-K99 HydrophobicContact CB-CD 4.18Å; Q96-K99 HydrophobicContact CB-CG 4.18Å; Q96-K99 WeakPolarHBondContact O-CB 3.14Å; Q96-K99 PolarHBondContact O-N 3.31Å; F97-K99 PolarHBondContact O-N 3.16Å; F97-K99 VanDerWaalsContact O-N 3.13Å
100	W	92.6	Very high	81	Confident	9 Å²	9	47 Å²	47	3%	0.034	27%	0.27	C	S	.	.			trans	-85.1	141.5	177.3	-70.7	33.2	0	0	0	109	F97 F112 L113 Y115 I123 I125 L165	F97-W100 AromaticContact CD1-CD2 3.99Å; F97-W100 HydrophobicContact CD1-CD2 3.99Å; F97-W100 AromaticContact CD1-CE2 3.77Å; F97-W100 HydrophobicContact CD1-CE3 4.36Å; F97-W100 HydrophobicContact CD1-CG 4.42Å; F97-W100 HydrophobicContact CD1-CH2 4.36Å; F97-W100 AromaticContact CD1-CZ2 3.98Å; F97-W100 HydrophobicContact CD1-CZ2 3.98Å; F97-W100 HydrophobicContact CE1-CH2 4.01Å; F97-W100 AromaticContact CE1-CZ2 3.84Å; F97-W100 HydrophobicContact CE1-CZ2 3.84Å; F97-W100 HydrophobicContact CE1-CZ3 4.44Å; F97-W100 WeakPolarHBondContact O-CB 3.48Å; F97-W100 PolarHBondContact O-N 2.91Å; W100-F112 HydrophobicContact CE3-CB 3.86Å; W100-F112 HydrophobicContact CE3-CG 4.28Å; W100-F112 HydrophobicContact CZ3-CB 4.49Å; W100-L113 CarbonylContact C-O 3.52Å; W100-L113 VanDerWaalsContact CA-O 3.25Å; W100-L113 WeakPolarHBondContact CA-O 3.47Å; W100-Y115 WeakPolarHBondContact CZ2-O 3.31Å; W100-Y115 PolarHBondContact NE1-O 3.17Å; W100-I123 HydrophobicContact CD2-CD1 4.31Å; W100-I123 HydrophobicContact CE3-CD1 4.09Å; W100-I123 HydrophobicContact CH2-CB 4.13Å; W100-I123 HydrophobicContact CH2-CD1 3.79Å; W100-I123 HydrophobicContact CH2-CG1 3.69Å; W100-I123 HydrophobicContact CH2-CG2 4.01Å; W100-I123 HydrophobicContact CZ2-CD1 4Å; W100-I123 HydrophobicContact CZ2-CG1 4.29Å; W100-I123 HydrophobicContact CZ3-CB 3.85Å; W100-I123 HydrophobicContact CZ3-CD1 3.83Å; W100-I123 HydrophobicContact CZ3-CG1 3.86Å; W100-I123 HydrophobicContact CZ3-CG2 3.85Å; W100-I125 HydrophobicContact CZ3-CD1 4.4Å; W100-L165 HydrophobicContact CB-CD2 3.7Å; W100-L165 HydrophobicContact CD2-CD2 4.07Å; W100-L165 HydrophobicContact CE3-CD1 4.46Å; W100-L165 HydrophobicContact CE3-CD2 3.69Å; W100-L165 HydrophobicContact CG-CD2 4.13Å
101	E	93	Very high	81	Confident	72 Å²	72	43.4 Å²	43.4	34%	0.336	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	129.7	-179.9	176.5	170	-166.8	0	0	108.7	H28 I103 F112 L113	H28-E101 WeakPolarHBondContact CB-OE1 3.46Å; H28-E101 IonicContact CD2-OE1 3.77Å; H28-E101 PolarHBondContact CD2-OE1 3.09Å; H28-E101 IonicContact CD2-OE2 2.94Å; H28-E101 PolarHBondContact CD2-OE2 2.66Å; H28-E101 VanDerWaalsContact CD2-OE2 3.29Å; H28-E101 VanDerWaalsContact CE1-CD 3.47Å; H28-E101 IonicContact CE1-OE1 3.88Å; H28-E101 IonicContact CE1-OE2 3.49Å; H28-E101 PolarHBondContact CE1-OE2 2.85Å; H28-E101 IonicContact CG-OE1 3.47Å; H28-E101 IonicContact CG-OE2 2.85Å; H28-E101 IonicContact ND1-OE1 2.87Å; H28-E101 PolarHBondContact ND1-OE1 3.04Å; H28-E101 IonicContact ND1-OE2 3.5Å; H28-E101 PolarHBondContact ND1-OE2 2.69Å; H28-E101 IonicContact NE2-OE1 3.18Å; H28-E101 IonicContact NE2-OE2 2.9Å; H28-E101 PolarHBondContact NE2-OE2 3.46Å; E101-I103 HydrophobicContact CB-CG2 4.49Å; E101-I103 HydrophobicContact CG-CG2 4.18Å; E101-I103 PolarHBondContact O-N 3.47Å; E101-F112 CarbonylContact O-C 3.59Å; E101-F112 WeakPolarHBondContact O-CA 3.25Å; E101-L113 PolarHBondContact N-O 3.05Å; E101-L113 PolarHBondContact O-N 2.91Å
102	K	93.1	Very high	81.2	Confident	3 Å²	3	43.2 Å²	43.2	1%	0.013	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	121.4	170.4	-177.2	174.4	171.2	-171.7	0	107.3	G104 E105 F112 W169 Y172	K102-G104 WeakPolarHBondContact CE-O 3.11Å; K102-E105 IonicContact NZ-OE2 3.16Å; K102-E105 PolarHBondContact NZ-OE2 3.41Å; K102-F112 HydrophobicContact CB-CD1 3.92Å; K102-F112 HydrophobicContact CB-CE1 3.65Å; K102-F112 HydrophobicContact CB-CZ 4.21Å; K102-F112 HydrophobicContact CG-CE1 4.32Å; K102-F112 HydrophobicContact CG-CZ 4.4Å; K102-W169 HydrophobicContact CD-CB 4.31Å; K102-W169 HydrophobicContact CD-CG 4.08Å; K102-W169 VanDerWaalsContact NZ-CD1 3.27Å; K102-Y172 HydrophobicContact CB-CD2 4.29Å; K102-Y172 HydrophobicContact CB-CG 4.22Å; K102-Y172 HydrophobicContact CD-CD1 3.94Å; K102-Y172 HydrophobicContact CD-CD2 4.39Å; K102-Y172 HydrophobicContact CD-CG 3.8Å; K102-Y172 HydrophobicContact CG-CD1 4.37Å; K102-Y172 HydrophobicContact CG-CD2 3.93Å; K102-Y172 HydrophobicContact CG-CG 3.83Å; K102-Y172 VanDerWaalsContact O-CD2 3.31Å; K102-Y172 WeakPolarHBondContact O-CD2 3.33Å
103	I	88.4	Confident	81.8	Confident	24 Å²	24	42.1 Å²	42.1	12%	0.123	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	-0.7	-176.7	61.4	162.8	0	0	0	113	H28 Y30 E101 V111 L113	H28-I103 WeakPolarHBondContact ND1-CG2 3.5Å; Y30-I103 WeakPolarHBondContact CB-O 3.33Å; Y30-I103 WeakPolarHBondContact CD2-O 3.44Å; Y30-I103 PolarHBondContact N-O 2.77Å; E101-I103 HydrophobicContact CB-CG2 4.49Å; E101-I103 HydrophobicContact CG-CG2 4.18Å; E101-I103 PolarHBondContact O-N 3.47Å; I103-V111 HydrophobicContact CD1-CG1 4.04Å; I103-V111 HydrophobicContact CG1-CB 4.34Å; I103-V111 HydrophobicContact CG1-CG1 3.9Å; I103-V111 WeakPolarHBondContact CG1-O 3.45Å; I103-V111 PolarHBondContact N-O 2.87Å; I103-L113 HydrophobicContact CD1-CB 4.18Å; I103-L113 HydrophobicContact CG1-CB 4.43Å; I103-L113 HydrophobicContact CG2-CB 3.51Å
104	G	84.2	Confident	82.9	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.4	176	-178.7	0	0	0	0	0	113.7	K102 V111	K102-G104 WeakPolarHBondContact CE-O 3.11Å; G104-V111 PolarHBondContact N-O 3.46Å; G104-V111 PolarHBondContact O-N 3.21Å
105	E	82.1	Confident	84.3	Confident	11 Å²	11	39.8 Å²	39.8	5%	0.051	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	142.6	172.7	55.4	-163.5	-147.6	0	0	109.2	Y30 K102 T178 K180	Y30-E105 WeakPolarHBondContact CE1-O 3.35Å; K102-E105 IonicContact NZ-OE2 3.16Å; K102-E105 PolarHBondContact NZ-OE2 3.41Å; E105-T178 WeakPolarHBondContact OE1-CB 3.3Å; E105-T178 PolarHBondContact OE1-OG1 2.94Å; E105-T178 PolarHBondContact OE2-OG1 3.27Å; E105-K180 HydrophobicContact CB-CD 4.27Å
106	G	72.4	Confident	85.4	Confident	20 Å²	20	40.4 Å²	40.4	21%	0.206	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	178.4	166.9	0	0	0	0	0	109	F108 S109 K180	G106-F108 VanDerWaalsContact C-N 3.26Å; G106-F108 PolarHBondContact O-N 2.97Å; G106-F108 VanDerWaalsContact O-N 3.15Å; G106-S109 PolarHBondContact N-O 2.86Å; G106-S109 PolarHBondContact O-N 3.14Å; G106-K180 WeakPolarHBondContact O-CE 3.3Å; G106-K180 PolarHBondContact O-NZ 2.79Å
107	A	68.3	Low	85.8	Confident	63 Å²	63	42.8 Å²	42.8	52%	0.521	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49	-48.9	-178	0	0	0	0	0	112.2	K180	A107-K180 WeakPolarHBondContact O-CE 3.36Å; A107-K180 PolarHBondContact O-NZ 3.4Å
108	F	72.9	Confident	85.6	Confident	96 Å²	96	52.7 Å²	52.7	42%	0.421	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.6	6.2	-173.3	-41	-50.3	0	0	0	114.1	G106 P127 H140	G106-F108 VanDerWaalsContact C-N 3.26Å; G106-F108 PolarHBondContact O-N 2.97Å; G106-F108 VanDerWaalsContact O-N 3.15Å; F108-P127 WeakPolarHBondContact O-CD 3.47Å; F108-H140 AromaticContact CD1-CD2 3.19Å; F108-H140 WeakPolarHBondContact CD1-CD2 3.36Å; F108-H140 AromaticContact CD1-CE1 3.67Å; F108-H140 AromaticContact CD1-NE2 2.95Å; F108-H140 WeakPolarHBondContact CD1-NE2 3.42Å; F108-H140 AromaticContact CD2-CD2 3.94Å; F108-H140 AromaticContact CE1-CD2 3.58Å; F108-H140 AromaticContact CE1-CE1 3.17Å; F108-H140 WeakPolarHBondContact CE1-CE1 3.34Å; F108-H140 AromaticContact CE1-NE2 2.8Å; F108-H140 WeakPolarHBondContact CE1-NE2 3.5Å; F108-H140 AromaticContact CE2-CE1 3.59Å; F108-H140 AromaticContact CE2-ND1 3.8Å; F108-H140 AromaticContact CE2-NE2 3.9Å; F108-H140 AromaticContact CG-CD2 3.42Å; F108-H140 VanDerWaalsContact CG-CD2 3.42Å; F108-H140 WeakPolarHBondContact CG-CD2 3.46Å; F108-H140 AromaticContact CG-CG 3.93Å; F108-H140 AromaticContact CG-NE2 3.61Å; F108-H140 AromaticContact CZ-CE1 3.1Å; F108-H140 WeakPolarHBondContact CZ-CE1 3.32Å; F108-H140 AromaticContact CZ-ND1 3.8Å; F108-H140 AromaticContact CZ-NE2 3.31Å; F108-H140 VanDerWaalsContact CZ-NE2 3.31Å; F108-H140 WeakPolarHBondContact CZ-NE2 3.46Å
109	S	85.5	Confident	85.7	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.021	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	158.8	-170.8	67.6	0	0	0	0	113.4	G106 K124 I125 K180	G106-S109 PolarHBondContact N-O 2.86Å; G106-S109 PolarHBondContact O-N 3.14Å; S109-K124 WeakPolarHBondContact OG-CE 3.47Å; S109-K124 WeakPolarHBondContact OG-CG 3.31Å; S109-I125 CarbonylContact C-O 3.49Å; S109-I125 VanDerWaalsContact CA-O 3.24Å; S109-I125 WeakPolarHBondContact CA-O 3.23Å; S109-I125 WeakPolarHBondContact CB-O 3.39Å; S109-K180 VanDerWaalsContact N-NZ 3.13Å; S109-K180 PolarHBondContact O-NZ 2.91Å
110	E	89.9	Confident	85.6	Confident	18 Å²	18	50 Å²	50	8%	0.084	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	144.6	164.4	-59.6	-172.4	170.2	0	0	109.1	F112 K124 I125 Y161 W169	E110-F112 HydrophobicContact CB-CD2 4.32Å; E110-F112 HydrophobicContact CB-CE2 3.55Å; E110-F112 HydrophobicContact CB-CZ 4.3Å; E110-F112 WeakPolarHBondContact OE2-CE2 3.16Å; E110-F112 WeakPolarHBondContact OE2-CZ 3.39Å; E110-K124 CarbonylContact O-C 3.36Å; E110-K124 WeakPolarHBondContact O-CA 3.46Å; E110-I125 PolarHBondContact N-O 3.25Å; E110-I125 PolarHBondContact O-N 3.04Å; E110-Y161 PolarHBondContact OE2-OH 3.27Å; E110-W169 PolarHBondContact OE1-NE1 2.64Å
111	V	90.1	Very high	85.4	Confident	10 Å²	10	50 Å²	50	6%	0.061	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	124.1	-178.2	-170	0	0	0	0	109.4	I103 G104 I123 K124	I103-V111 HydrophobicContact CD1-CG1 4.04Å; I103-V111 HydrophobicContact CG1-CB 4.34Å; I103-V111 HydrophobicContact CG1-CG1 3.9Å; I103-V111 WeakPolarHBondContact CG1-O 3.45Å; I103-V111 PolarHBondContact N-O 2.87Å; G104-V111 PolarHBondContact N-O 3.46Å; G104-V111 PolarHBondContact O-N 3.21Å; V111-I123 WeakPolarHBondContact CA-O 3.25Å; V111-K124 HydrophobicContact CG2-CG 4.32Å
112	F	92.7	Very high	85.3	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	146.2	179.7	-65.5	-97.5	0	0	0	111.3	W100 E101 K102 E110 C122 I123 I125 Y161 L165 A168	W100-F112 HydrophobicContact CE3-CB 3.86Å; W100-F112 HydrophobicContact CE3-CG 4.28Å; W100-F112 HydrophobicContact CZ3-CB 4.49Å; E101-F112 CarbonylContact O-C 3.59Å; E101-F112 WeakPolarHBondContact O-CA 3.25Å; K102-F112 HydrophobicContact CB-CD1 3.92Å; K102-F112 HydrophobicContact CB-CE1 3.65Å; K102-F112 HydrophobicContact CB-CZ 4.21Å; K102-F112 HydrophobicContact CG-CE1 4.32Å; K102-F112 HydrophobicContact CG-CZ 4.4Å; E110-F112 HydrophobicContact CB-CD2 4.32Å; E110-F112 HydrophobicContact CB-CE2 3.55Å; E110-F112 HydrophobicContact CB-CZ 4.3Å; E110-F112 WeakPolarHBondContact OE2-CE2 3.16Å; E110-F112 WeakPolarHBondContact OE2-CZ 3.39Å; F112-C122 CarbonylContact O-C 3.44Å; F112-C122 VanDerWaalsContact O-CA 3.32Å; F112-C122 WeakPolarHBondContact O-CA 3.45Å; F112-I123 PolarHBondContact N-O 3.27Å; F112-I123 PolarHBondContact O-N 2.9Å; F112-I125 HydrophobicContact CD2-CD1 3.56Å; F112-I125 HydrophobicContact CD2-CG1 4Å; F112-I125 HydrophobicContact CE2-CD1 3.63Å; F112-I125 HydrophobicContact CE2-CG1 4.24Å; F112-I125 HydrophobicContact CG-CD1 4.49Å; F112-Y161 WeakPolarHBondContact CE2-OH 3.3Å; F112-Y161 HydrophobicContact CZ-CE1 4.42Å; F112-Y161 WeakPolarHBondContact CZ-OH 3.2Å; F112-L165 HydrophobicContact CD1-CD2 4.12Å; F112-L165 HydrophobicContact CE1-CB 4.27Å; F112-L165 HydrophobicContact CE1-CD2 4.14Å; F112-L165 HydrophobicContact CZ-CB 4.34Å; F112-A168 HydrophobicContact CD1-CB 4.49Å; F112-A168 HydrophobicContact CE1-CB 4.05Å
113	L	91.5	Very high	85.1	Confident	17 Å²	17	47.1 Å²	47.1	9%	0.089	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	125.9	160.2	-179.6	59.9	0	0	0	108	W100 E101 I103 K120 H199	W100-L113 CarbonylContact C-O 3.52Å; W100-L113 VanDerWaalsContact CA-O 3.25Å; W100-L113 WeakPolarHBondContact CA-O 3.47Å; E101-L113 PolarHBondContact N-O 3.05Å; E101-L113 PolarHBondContact O-N 2.91Å; I103-L113 HydrophobicContact CD1-CB 4.18Å; I103-L113 HydrophobicContact CG1-CB 4.43Å; I103-L113 HydrophobicContact CG2-CB 3.51Å; L113-K120 HydrophobicContact CD1-CG 4.08Å; L113-H199 HydrophobicContact CD1-CB 4.46Å; L113-H199 WeakPolarHBondContact CD1-CD2 3.36Å
114	G	91.2	Very high	85.2	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	-158.4	-175.7	0	0	0	0	0	113	K120 C121	G114-K120 VanDerWaalsContact O-CA 3.31Å; G114-K120 WeakPolarHBondContact O-CA 3.37Å; G114-C121 PolarHBondContact N-O 3.1Å; G114-C121 PolarHBondContact O-N 2.88Å
115	Y	88.3	Confident	85.6	Confident	89 Å²	89	46.9 Å²	46.9	35%	0.349	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	135.1	178.7	-67.3	-94.8	0	0	0	110.5	S95 W100 H119 K120	S95-Y115 VanDerWaalsContact CB-O 3.28Å; S95-Y115 WeakPolarHBondContact CB-O 3.47Å; S95-Y115 PolarHBondContact OG-O 3.05Å; W100-Y115 WeakPolarHBondContact CZ2-O 3.31Å; W100-Y115 PolarHBondContact NE1-O 3.17Å; Y115-H119 CarbonylContact C-O 3.46Å; Y115-H119 VanDerWaalsContact CA-O 3.26Å; Y115-H119 WeakPolarHBondContact CA-O 3.37Å; Y115-K120 HydrophobicContact CD1-CB 4.09Å; Y115-K120 HydrophobicContact CE1-CB 3.7Å; Y115-K120 HydrophobicContact CE1-CG 4.19Å
116	F	86	Confident	85.9	Confident	21 Å²	21	46.6 Å²	46.6	9%	0.092	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	125.6	168.6	-179.3	-111.1	0	0	0	109.4	I91 R118 H119 F153 F196	I91-F116 HydrophobicContact CD1-CE2 4.31Å; I91-F116 HydrophobicContact CG2-CD2 4.29Å; I91-F116 HydrophobicContact CG2-CE2 4.42Å; F116-R118 PolarHBondContact O-N 3.07Å; F116-R118 VanDerWaalsContact O-N 3.14Å; F116-H119 PolarHBondContact N-O 3.2Å; F116-H119 PolarHBondContact O-N 2.91Å; F116-F153 HydrophobicContact CD1-CE1 4.11Å; F116-F153 AromaticContact CE1-CE1 3.55Å; F116-F153 HydrophobicContact CE1-CE1 3.55Å; F116-F153 AromaticContact CE1-CZ 3.88Å; F116-F153 HydrophobicContact CE1-CZ 3.88Å; F116-F153 HydrophobicContact CZ-CE1 4.32Å; F116-F196 HydrophobicContact CB-CD1 3.62Å; F116-F196 HydrophobicContact CB-CE1 3.46Å; F116-F196 VanDerWaalsContact CB-CE1 3.46Å; F116-F196 HydrophobicContact CB-CZ 4.44Å; F116-F196 HydrophobicContact CD1-CD1 4.07Å; F116-F196 HydrophobicContact CD1-CE1 4Å; F116-F196 HydrophobicContact CD1-CG 4.5Å; F116-F196 HydrophobicContact CD1-CZ 4.34Å; F116-F196 HydrophobicContact CD2-CD1 4.4Å; F116-F196 AromaticContact CD2-CE1 3.56Å; F116-F196 HydrophobicContact CD2-CE1 3.56Å; F116-F196 AromaticContact CD2-CZ 3.73Å; F116-F196 HydrophobicContact CD2-CZ 3.73Å; F116-F196 HydrophobicContact CE2-CE1 4.28Å; F116-F196 AromaticContact CE2-CZ 4Å; F116-F196 HydrophobicContact CE2-CZ 4Å; F116-F196 AromaticContact CG-CD1 3.78Å; F116-F196 HydrophobicContact CG-CD1 3.78Å; F116-F196 AromaticContact CG-CE1 3.39Å; F116-F196 HydrophobicContact CG-CE1 3.39Å; F116-F196 AromaticContact CG-CZ 3.91Å; F116-F196 HydrophobicContact CG-CZ 3.91Å; F116-F196 HydrophobicContact CZ-CZ 4.41Å
117	R	83.7	Confident	86.7	Confident	161 Å²	161	49 Å²	49	61%	0.608	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.7	41.5	-176.3	-62.9	-179.4	168.9	174.6	-5.8	112.9	H119	R117-H119 VanDerWaalsContact C-N 3.26Å; R117-H119 PolarHBondContact O-CD2 3.41Å; R117-H119 VanDerWaalsContact O-CD2 3.26Å; R117-H119 PolarHBondContact O-N 3.49Å
118	R	82	Confident	87.3	Confident	223 Å²	223	46.5 Å²	46.5	84%	0.842	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.8	5.3	-177.5	-49.9	177.3	178	178.1	-1.2	116.3	F116	F116-R118 PolarHBondContact O-N 3.07Å; F116-R118 VanDerWaalsContact O-N 3.14Å
119	H	83.9	Confident	87.2	Confident	140 Å²	140	43.8 Å²	43.8	65%	0.648	20%	0.195	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	129.1	172.9	-64.3	-81.5	0	0	0	110.2	Y115 F116 R117	Y115-H119 CarbonylContact C-O 3.46Å; Y115-H119 VanDerWaalsContact CA-O 3.26Å; Y115-H119 WeakPolarHBondContact CA-O 3.37Å; F116-H119 PolarHBondContact N-O 3.2Å; F116-H119 PolarHBondContact O-N 2.91Å; R117-H119 VanDerWaalsContact C-N 3.26Å; R117-H119 PolarHBondContact O-CD2 3.41Å; R117-H119 VanDerWaalsContact O-CD2 3.26Å; R117-H119 PolarHBondContact O-N 3.49Å
120	K	87	Confident	85.8	Confident	68 Å²	68	45 Å²	45	30%	0.296	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	127.1	171.7	-168.6	175.8	179.7	-179.6	0	108.4	E23 L113 G114 Y115 H199	E23-K120 IonicContact OE1-NZ 2.8Å; L113-K120 HydrophobicContact CD1-CG 4.08Å; G114-K120 VanDerWaalsContact O-CA 3.31Å; G114-K120 WeakPolarHBondContact O-CA 3.37Å; Y115-K120 HydrophobicContact CD1-CB 4.09Å; Y115-K120 HydrophobicContact CE1-CB 3.7Å; Y115-K120 HydrophobicContact CE1-CG 4.19Å; K120-H199 HydrophobicContact CG-CB 4.28Å; K120-H199 WeakPolarHBondContact O-CB 3.33Å
121	C	88.2	Confident	83.8	Confident	11 Å²	11	47.9 Å²	47.9	7%	0.074	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	159.8	-174.5	54.2	0	0	0	0	111.2	G114 I123 M197	G114-C121 PolarHBondContact N-O 3.1Å; G114-C121 PolarHBondContact O-N 2.88Å; C121-I123 VanDerWaalsContact O-CD1 3.25Å; C121-I123 WeakPolarHBondContact O-CD1 3.38Å; C121-M197 WeakPolarHBondContact CA-O 3.35Å; C121-M197 WeakPolarHBondContact CB-O 3.31Å
122	C	89.1	Confident	81.5	Confident	13 Å²	13	56 Å²	56	9%	0.088	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	138.6	164.5	-65.7	0	0	0	0	108.6	F112 M197	F112-C122 CarbonylContact O-C 3.44Å; F112-C122 VanDerWaalsContact O-CA 3.32Å; F112-C122 WeakPolarHBondContact O-CA 3.45Å; C122-M197 HydrophobicContact CB-CB 4.21Å; C122-M197 HydrophobicContact CB-CE 4.15Å; C122-M197 PolarHBondContact N-O 3.36Å; C122-M197 PolarHBondContact O-N 3.44Å
123	I	90.8	Very high	79	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	111.6	-177.1	-52.4	94.9	0	0	0	108.3	W100 V111 F112 C121 I125 L194 I195 F196	W100-I123 HydrophobicContact CD2-CD1 4.31Å; W100-I123 HydrophobicContact CE3-CD1 4.09Å; W100-I123 HydrophobicContact CH2-CB 4.13Å; W100-I123 HydrophobicContact CH2-CD1 3.79Å; W100-I123 HydrophobicContact CH2-CG1 3.69Å; W100-I123 HydrophobicContact CH2-CG2 4.01Å; W100-I123 HydrophobicContact CZ2-CD1 4Å; W100-I123 HydrophobicContact CZ2-CG1 4.29Å; W100-I123 HydrophobicContact CZ3-CB 3.85Å; W100-I123 HydrophobicContact CZ3-CD1 3.83Å; W100-I123 HydrophobicContact CZ3-CG1 3.86Å; W100-I123 HydrophobicContact CZ3-CG2 3.85Å; V111-I123 WeakPolarHBondContact CA-O 3.25Å; F112-I123 PolarHBondContact N-O 3.27Å; F112-I123 PolarHBondContact O-N 2.9Å; C121-I123 VanDerWaalsContact O-CD1 3.25Å; C121-I123 WeakPolarHBondContact O-CD1 3.38Å; I123-I125 HydrophobicContact CG2-CG1 4.14Å; I123-L194 HydrophobicContact CG2-CB 4.11Å; I123-L194 HydrophobicContact CG2-CD2 4.18Å; I123-L194 HydrophobicContact CG2-CG 3.81Å; I123-I195 WeakPolarHBondContact CA-O 3.36Å; I123-F196 HydrophobicContact CG1-CD1 3.7Å; I123-F196 HydrophobicContact CG1-CE1 3.93Å; I123-F196 HydrophobicContact CG2-CD1 4.35Å; I123-F196 HydrophobicContact CG2-CE1 4.2Å
124	K	89.9	Confident	76.2	Confident	17 Å²	17	71.2 Å²	71.2	7%	0.074	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	119.7	171.1	-172.7	-178.9	-170.4	-176	0	107.8	S109 E110 V111 I126 E148 L194 I195 M197 D277	S109-K124 WeakPolarHBondContact OG-CE 3.47Å; S109-K124 WeakPolarHBondContact OG-CG 3.31Å; E110-K124 CarbonylContact O-C 3.36Å; E110-K124 WeakPolarHBondContact O-CA 3.46Å; V111-K124 HydrophobicContact CG2-CG 4.32Å; K124-I126 HydrophobicContact CD-CD1 4.36Å; K124-I126 HydrophobicContact CG-CD1 4.5Å; K124-I126 HydrophobicContact CG-CG1 4.2Å; K124-E148 VanDerWaalsContact CD-OE1 3.29Å; K124-E148 WeakPolarHBondContact CD-OE1 3.44Å; K124-E148 IonicContact NZ-OE1 3.75Å; K124-E148 PolarHBondContact NZ-OE1 3.4Å; K124-E148 IonicContact NZ-OE2 3.02Å; K124-E148 PolarHBondContact NZ-OE2 2.93Å; K124-L194 WeakPolarHBondContact O-CA 3.45Å; K124-I195 HydrophobicContact CB-CB 4.2Å; K124-I195 PolarHBondContact N-O 3.29Å; K124-I195 PolarHBondContact O-N 3.38Å; K124-M197 HydrophobicContact CB-CE 3.7Å; K124-D277 IonicContact NZ-OD1 3.66Å; K124-D277 IonicContact NZ-OD2 3.5Å; K124-D277 PolarHBondContact NZ-OD2 3.41Å
125	I	92.2	Very high	73.5	Confident	2 Å²	2	79 Å²	79	1%	0.01	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	118.9	179.1	-56.4	-175.9	0	0	0	107.6	W88 W100 S109 E110 F112 I123 Y161 L165 Y192 L193 L194	W88-I125 HydrophobicContact CH2-CD1 4.15Å; W88-I125 HydrophobicContact CH2-CG2 4.27Å; W88-I125 HydrophobicContact CZ3-CD1 4.42Å; W100-I125 HydrophobicContact CZ3-CD1 4.4Å; S109-I125 CarbonylContact C-O 3.49Å; S109-I125 VanDerWaalsContact CA-O 3.24Å; S109-I125 WeakPolarHBondContact CA-O 3.23Å; S109-I125 WeakPolarHBondContact CB-O 3.39Å; E110-I125 PolarHBondContact N-O 3.25Å; E110-I125 PolarHBondContact O-N 3.04Å; F112-I125 HydrophobicContact CD2-CD1 3.56Å; F112-I125 HydrophobicContact CD2-CG1 4Å; F112-I125 HydrophobicContact CE2-CD1 3.63Å; F112-I125 HydrophobicContact CE2-CG1 4.24Å; F112-I125 HydrophobicContact CG-CD1 4.49Å; I123-I125 HydrophobicContact CG2-CG1 4.14Å; I125-Y161 HydrophobicContact CG2-CE2 3.93Å; I125-L165 HydrophobicContact CD1-CD1 3.88Å; I125-Y192 HydrophobicContact CG2-CD1 3.74Å; I125-Y192 HydrophobicContact CG2-CE1 4.45Å; I125-Y192 HydrophobicContact CG2-CG 4.41Å; I125-L193 WeakPolarHBondContact CA-O 3.38Å; I125-L194 HydrophobicContact CB-CD1 4.32Å; I125-L194 HydrophobicContact CD1-CD1 4.5Å; I125-L194 HydrophobicContact CG1-CD1 3.96Å; I125-L194 HydrophobicContact CG1-CG 4.11Å; I125-L194 HydrophobicContact CG2-CD1 3.94Å
126	I	88.9	Confident	70.8	Confident	5 Å²	5	80 Å²	80	3%	0.026	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	112.9	-179.5	-48.9	-178.8	0	0	0	107.7	K124 I128 V145 Y192 L193 I195	K124-I126 HydrophobicContact CD-CD1 4.36Å; K124-I126 HydrophobicContact CG-CD1 4.5Å; K124-I126 HydrophobicContact CG-CG1 4.2Å; I126-I128 HydrophobicContact CG2-CG2 4.27Å; I126-I128 PolarHBondContact O-N 3.35Å; I126-V145 HydrophobicContact CD1-CG1 4.42Å; I126-V145 HydrophobicContact CG2-CG1 4.37Å; I126-Y192 CarbonylContact O-C 3.55Å; I126-Y192 WeakPolarHBondContact O-CA 3.3Å; I126-L193 HydrophobicContact CB-CB 4.33Å; I126-L193 PolarHBondContact N-O 2.92Å; I126-L193 PolarHBondContact O-N 3.35Å; I126-I195 HydrophobicContact CD1-CD1 3.73Å; I126-I195 HydrophobicContact CD1-CG1 4.38Å
127	P	87.9	Confident	68.2	Low	71 Å²	71	87.6 Å²	87.6	46%	0.461	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	132.6	168.2	28.8	-31.4	0	0	0	109	F108 Y192	F108-P127 WeakPolarHBondContact O-CD 3.47Å; P127-Y192 HydrophobicContact CB-CD1 4.11Å; P127-Y192 HydrophobicContact CB-CE1 3.97Å
128	I	81.9	Confident	66.1	Low	11 Å²	11	86.4 Å²	86.4	6%	0.056	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	148.5	173.5	55.3	160.4	0	0	0	109.1	I76 I126 Q190 L191 L193	I76-I128 HydrophobicContact CD1-CD1 3.56Å; I126-I128 HydrophobicContact CG2-CG2 4.27Å; I126-I128 PolarHBondContact O-N 3.35Å; I128-Q190 PolarHBondContact O-NE2 3.21Å; I128-L191 HydrophobicContact CD1-CB 4.1Å; I128-L191 HydrophobicContact CG1-CB 3.67Å; I128-L191 PolarHBondContact N-O 3.15Å; I128-L191 WeakPolarHBondContact O-CB 3.29Å; I128-L193 HydrophobicContact CD1-CD1 4.11Å; I128-L193 HydrophobicContact CD1-CD2 3.67Å; I128-L193 HydrophobicContact CD1-CG 3.66Å; I128-L193 HydrophobicContact CG1-CD2 4.48Å; I128-L193 HydrophobicContact CG1-CG 4.05Å; I128-L193 HydrophobicContact CG2-CD1 3.88Å; I128-L193 HydrophobicContact CG2-CG 4Å
129	N	69.7	Low	64.2	Low	39 Å²	39	79.6 Å²	79.6	21%	0.209	40%	0.399	C	S	.	.			trans	-82.6	142.9	177.2	-80.3	-15.9	0	0	0	112.5	Y72 E139	Y72-N129 WeakPolarHBondContact CE1-O 3.36Å; N129-E139 PolarHBondContact ND2-OE1 3.21Å; N129-E139 PolarHBondContact ND2-OE2 3.38Å
130	G	56.6	Low	62.6	Low	27 Å²	27	76.2 Å²	76.2	28%	0.278	38%	0.383	S	S	.	.			trans	-70.3	153.6	164.4	0	0	0	0	0	110.3	H132	G130-H132 PolarHBondContact O-N 2.82Å
131	P	48.4	Very low	60.9	Low	79 Å²	79	74.5 Å²	74.5	51%	0.513	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	10.7	-169.8	25.5	-35.3	0	0	0	116.3
132	H	41.5	Very low	59.3	Low	182 Å²	182	75 Å²	75	84%	0.843	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.2	16.1	-170.8	-68.3	-38.9	0	0	0	115.4	G130	G130-H132 PolarHBondContact O-N 2.82Å
133	R	39.9	Very low	57.9	Low	153 Å²	153	79.1 Å²	79.1	58%	0.577	40%	0.402	S	S	*	.	S	Bend	trans	-108.1	133.9	167.4	-79	-173.4	172.6	-176.1	-5.2	110.9
134	Q	32.9	Very low	56.6	Low	183 Å²	183	81.7 Å²	81.7	86%	0.855	42%	0.416	S	S	*	.			trans	-67.8	127.4	176.6	-76.7	177.4	-30.3	0	0	109.1	T136	Q134-T136 PolarHBondContact O-N 2.74Å; Q134-T136 VanDerWaalsContact O-N 3.13Å
135	Y	34.6	Very low	55.5	Low	165 Å²	165	81.3 Å²	81.3	65%	0.647	42%	0.415	S	S	*	.			trans	-59.3	104.2	177	-77	-95.3	0	0	0	110.9
136	T	31.7	Very low	54.5	Low	110 Å²	110	82 Å²	82	68%	0.675	42%	0.42	S	S	*	.			trans	-144.9	117.4	161.3	53.4	0	0	0	0	108.9	Q134	Q134-T136 PolarHBondContact O-N 2.74Å; Q134-T136 VanDerWaalsContact O-N 3.13Å
137	E	31.8	Very low	53.7	Low	180 Å²	180	81.8 Å²	81.8	84%	0.841	42%	0.418	S	S	*	.	S	Bend	trans	85.8	88.9	169.4	-56.9	-178.5	-173.3	0	0	116.2
138	V	38.3	Very low	53.1	Low	136 Å²	136	78.9 Å²	78.9	82%	0.824	40%	0.399	S	S	*	.	S	Bend	trans	52.9	73.4	167	-159	0	0	0	0	114.9
139	E	43.7	Very low	52.6	Low	80 Å²	80	78.4 Å²	78.4	37%	0.374	40%	0.396	S	S	.	.			trans	-131.1	123.5	179	-64.2	-179.2	142.5	0	0	111.1	N129	N129-E139 PolarHBondContact ND2-OE1 3.21Å; N129-E139 PolarHBondContact ND2-OE2 3.38Å
140	H	49.8	Very low	52.3	Low	68 Å²	68	77.4 Å²	77.4	32%	0.315	39%	0.393	S	S	.	.			trans	-71.1	137.2	-172.6	-71.7	-71.4	0	0	0	113.2	F108 D144	F108-H140 AromaticContact CD1-CD2 3.19Å; F108-H140 WeakPolarHBondContact CD1-CD2 3.36Å; F108-H140 AromaticContact CD1-CE1 3.67Å; F108-H140 AromaticContact CD1-NE2 2.95Å; F108-H140 WeakPolarHBondContact CD1-NE2 3.42Å; F108-H140 AromaticContact CD2-CD2 3.94Å; F108-H140 AromaticContact CE1-CD2 3.58Å; F108-H140 AromaticContact CE1-CE1 3.17Å; F108-H140 WeakPolarHBondContact CE1-CE1 3.34Å; F108-H140 AromaticContact CE1-NE2 2.8Å; F108-H140 WeakPolarHBondContact CE1-NE2 3.5Å; F108-H140 AromaticContact CE2-CE1 3.59Å; F108-H140 AromaticContact CE2-ND1 3.8Å; F108-H140 AromaticContact CE2-NE2 3.9Å; F108-H140 AromaticContact CG-CD2 3.42Å; F108-H140 VanDerWaalsContact CG-CD2 3.42Å; F108-H140 WeakPolarHBondContact CG-CD2 3.46Å; F108-H140 AromaticContact CG-CG 3.93Å; F108-H140 AromaticContact CG-NE2 3.61Å; F108-H140 AromaticContact CZ-CE1 3.1Å; F108-H140 WeakPolarHBondContact CZ-CE1 3.32Å; F108-H140 AromaticContact CZ-ND1 3.8Å; F108-H140 AromaticContact CZ-NE2 3.31Å; F108-H140 VanDerWaalsContact CZ-NE2 3.31Å; F108-H140 WeakPolarHBondContact CZ-NE2 3.46Å; H140-D144 VanDerWaalsContact CA-OD2 3.28Å; H140-D144 WeakPolarHBondContact CA-OD2 2.99Å; H140-D144 HydrophobicContact CB-CB 4.05Å; H140-D144 VanDerWaalsContact CB-OD2 3.26Å; H140-D144 WeakPolarHBondContact CB-OD2 3.41Å; H140-D144 IonicContact CG-OD2 4Å; H140-D144 IonicContact ND1-OD2 2.89Å; H140-D144 PolarHBondContact ND1-OD2 3.03Å
141	S	51	Low	53.2	Low	33 Å²	33	79.1 Å²	79.1	23%	0.231	40%	0.396	C	S	.	.			trans	-65.4	151.9	170.3	176.4	0	0	0	0	109.3	D143 D144	S141-D143 PolarHBondContact O-N 3.46Å; S141-D143 VanDerWaalsContact O-N 3.12Å; S141-D143 WeakPolarHBondContact OG-CB 3.34Å; S141-D143 VanDerWaalsContact OG-CG 3.28Å; S141-D143 PolarHBondContact OG-N 2.89Å; S141-D143 VanDerWaalsContact OG-N 3.11Å; S141-D143 PolarHBondContact OG-OD2 3.49Å; S141-D144 PolarHBondContact N-OD2 3.2Å; S141-D144 VanDerWaalsContact O-CB 3.28Å; S141-D144 WeakPolarHBondContact O-CB 3.37Å; S141-D144 PolarHBondContact O-N 3.06Å
142	I	54.1	Low	54.6	Low	20 Å²	20	76.6 Å²	76.6	10%	0.103	38%	0.38	C	S	.	.	H	α-helix	trans	-50.9	-33.4	165.3	-173.9	161.3	0	0	0	111.1	Y72 I76 D144 V145 V146	Y72-I142 HydrophobicContact CD2-CB 4.1Å; Y72-I142 HydrophobicContact CD2-CD1 3.94Å; Y72-I142 HydrophobicContact CD2-CG2 3.96Å; Y72-I142 HydrophobicContact CE2-CB 3.39Å; Y72-I142 HydrophobicContact CE2-CD1 3.82Å; Y72-I142 HydrophobicContact CE2-CG1 4.14Å; Y72-I142 HydrophobicContact CE2-CG2 3.66Å; I76-I142 HydrophobicContact CD1-CD1 3.77Å; I76-I142 HydrophobicContact CG1-CD1 3.43Å; I76-I142 VanDerWaalsContact CG1-CD1 3.43Å; I76-I142 HydrophobicContact CG1-CG1 4.41Å; I142-D144 PolarHBondContact O-N 3.36Å; I142-D144 VanDerWaalsContact O-N 3.1Å; I142-V145 CarbonylContact O-C 3.52Å; I142-V145 WeakPolarHBondContact O-CG2 3.48Å; I142-V145 PolarHBondContact O-N 2.96Å; I142-V146 HydrophobicContact CB-CG2 4.29Å; I142-V146 HydrophobicContact CD1-CG2 4.22Å; I142-V146 HydrophobicContact CG1-CG2 3.33Å; I142-V146 VanDerWaalsContact O-CB 3.28Å; I142-V146 WeakPolarHBondContact O-CB 3.5Å; I142-V146 WeakPolarHBondContact O-CG2 3.46Å; I142-V146 PolarHBondContact O-N 3.3Å
143	D	59.6	Low	56.6	Low	101 Å²	101	72.2 Å²	72.2	54%	0.54	36%	0.359	S	S	.	.	H	α-helix	trans	-56.1	-28.8	176.7	-56.8	-44.6	0	0	0	112.4	S141	S141-D143 PolarHBondContact O-N 3.46Å; S141-D143 VanDerWaalsContact O-N 3.12Å; S141-D143 WeakPolarHBondContact OG-CB 3.34Å; S141-D143 VanDerWaalsContact OG-CG 3.28Å; S141-D143 PolarHBondContact OG-N 2.89Å; S141-D143 VanDerWaalsContact OG-N 3.11Å; S141-D143 PolarHBondContact OG-OD2 3.49Å
144	D	63.5	Low	58.9	Low	54 Å²	54	65 Å²	65	29%	0.289	33%	0.332	S	S	.	.	H	α-helix	trans	-76.2	-23.6	179.8	-58	-26.8	0	0	0	112.6	H140 S141 I142	H140-D144 VanDerWaalsContact CA-OD2 3.28Å; H140-D144 WeakPolarHBondContact CA-OD2 2.99Å; H140-D144 HydrophobicContact CB-CB 4.05Å; H140-D144 VanDerWaalsContact CB-OD2 3.26Å; H140-D144 WeakPolarHBondContact CB-OD2 3.41Å; H140-D144 IonicContact CG-OD2 4Å; H140-D144 IonicContact ND1-OD2 2.89Å; H140-D144 PolarHBondContact ND1-OD2 3.03Å; S141-D144 PolarHBondContact N-OD2 3.2Å; S141-D144 VanDerWaalsContact O-CB 3.28Å; S141-D144 WeakPolarHBondContact O-CB 3.37Å; S141-D144 PolarHBondContact O-N 3.06Å; I142-D144 PolarHBondContact O-N 3.36Å; I142-D144 VanDerWaalsContact O-N 3.1Å
145	V	68.4	Low	61.7	Low	8 Å²	8	58 Å²	58	5%	0.048	30%	0.297	C	S	.	.	H	α-helix	trans	-116.5	-11.5	-176.9	-60.5	0	0	0	0	113.6	I126 I142 E148 I149 L193	I126-V145 HydrophobicContact CD1-CG1 4.42Å; I126-V145 HydrophobicContact CG2-CG1 4.37Å; I142-V145 CarbonylContact O-C 3.52Å; I142-V145 WeakPolarHBondContact O-CG2 3.48Å; I142-V145 PolarHBondContact O-N 2.96Å; V145-E148 WeakPolarHBondContact O-CB 3.32Å; V145-E148 PolarHBondContact O-N 3.49Å; V145-I149 WeakPolarHBondContact O-CG2 3.38Å; V145-I149 PolarHBondContact O-N 2.72Å; V145-L193 HydrophobicContact CG2-CD1 4.32Å
146	V	71.2	Confident	64.4	Low	18 Å²	18	50.1 Å²	50.1	11%	0.109	27%	0.266	C	S	.	.	H	α-helix	trans	-53.7	-47.2	-178.7	153.5	0	0	0	0	112.9	I142 E148 I149 A150 Y290	I142-V146 HydrophobicContact CB-CG2 4.29Å; I142-V146 HydrophobicContact CD1-CG2 4.22Å; I142-V146 HydrophobicContact CG1-CG2 3.33Å; I142-V146 VanDerWaalsContact O-CB 3.28Å; I142-V146 WeakPolarHBondContact O-CB 3.5Å; I142-V146 WeakPolarHBondContact O-CG2 3.46Å; I142-V146 PolarHBondContact O-N 3.3Å; V146-E148 VanDerWaalsContact C-N 3.28Å; V146-E148 PolarHBondContact O-N 2.83Å; V146-I149 HydrophobicContact CG2-CD1 4.38Å; V146-I149 WeakPolarHBondContact O-CG1 3.21Å; V146-I149 PolarHBondContact O-N 3.22Å; V146-A150 VanDerWaalsContact O-CB 3.3Å; V146-A150 WeakPolarHBondContact O-CB 3.3Å; V146-A150 PolarHBondContact O-N 3.11Å; V146-A150 VanDerWaalsContact O-N 3.08Å; V146-Y290 HydrophobicContact CG1-CD1 3.35Å; V146-Y290 HydrophobicContact CG1-CE1 3.82Å; V146-Y290 HydrophobicContact CG1-CG 4.43Å
147	P	70.6	Confident	67.4	Low	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59	-39.5	175.3	-28.2	39.3	0	0	0	112.7	Y278 F283	P147-Y278 WeakPolarHBondContact CB-O 3.21Å; P147-F283 HydrophobicContact CB-CE1 3.92Å; P147-F283 HydrophobicContact CB-CZ 4.47Å; P147-F283 WeakPolarHBondContact O-CE1 3.25Å; P147-F283 WeakPolarHBondContact O-CZ 3.32Å
148	E	75.6	Confident	70.2	Confident	9 Å²	9	40.4 Å²	40.4	4%	0.042	21%	0.213	C	C	.	.	H	α-helix	trans	-69.2	-42.5	-179.3	-159	179.3	178.9	0	0	112.4	K124 V145 V146 S152 I195 Y278	K124-E148 VanDerWaalsContact CD-OE1 3.29Å; K124-E148 WeakPolarHBondContact CD-OE1 3.44Å; K124-E148 IonicContact NZ-OE1 3.75Å; K124-E148 PolarHBondContact NZ-OE1 3.4Å; K124-E148 IonicContact NZ-OE2 3.02Å; K124-E148 PolarHBondContact NZ-OE2 2.93Å; V145-E148 WeakPolarHBondContact O-CB 3.32Å; V145-E148 PolarHBondContact O-N 3.49Å; V146-E148 VanDerWaalsContact C-N 3.28Å; V146-E148 PolarHBondContact O-N 2.83Å; E148-S152 WeakPolarHBondContact O-CB 3.31Å; E148-S152 PolarHBondContact O-N 3.49Å; E148-S152 PolarHBondContact O-OG 3.46Å; E148-I195 HydrophobicContact CB-CD1 4.34Å; E148-I195 HydrophobicContact CG-CD1 3.7Å; E148-Y278 HydrophobicContact CG-CD2 4.45Å
149	I	72.7	Confident	72.8	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-76.1	-28.9	-175.9	67.3	173.3	0	0	0	112.8	I76 H79 V145 V146 I151 V154 L193 I195	I76-I149 HydrophobicContact CG1-CD1 4.5Å; H79-I149 HydrophobicContact CB-CD1 4.4Å; V145-I149 WeakPolarHBondContact O-CG2 3.38Å; V145-I149 PolarHBondContact O-N 2.72Å; V146-I149 HydrophobicContact CG2-CD1 4.38Å; V146-I149 WeakPolarHBondContact O-CG1 3.21Å; V146-I149 PolarHBondContact O-N 3.22Å; I149-I151 VanDerWaalsContact C-N 3.26Å; I149-I151 PolarHBondContact O-N 3.27Å; I149-V154 HydrophobicContact CB-CG2 4.02Å; I149-V154 HydrophobicContact CG2-CG1 4.35Å; I149-V154 HydrophobicContact CG2-CG2 4.22Å; I149-L193 HydrophobicContact CG2-CD1 3.72Å; I149-I195 HydrophobicContact CG2-CD1 4.35Å
150	A	63.3	Low	75.1	Confident	18 Å²	18	36.1 Å²	36.1	15%	0.149	18%	0.184	C	C	.	.	H	α-helix	trans	-72.9	-18	-174.7	0	0	0	0	0	113.5	V146 F283 Y290	V146-A150 VanDerWaalsContact O-CB 3.3Å; V146-A150 WeakPolarHBondContact O-CB 3.3Å; V146-A150 PolarHBondContact O-N 3.11Å; V146-A150 VanDerWaalsContact O-N 3.08Å; A150-F283 HydrophobicContact CB-CE2 4.11Å; A150-F283 HydrophobicContact CB-CZ 3.9Å; A150-Y290 HydrophobicContact CB-CD1 3.63Å; A150-Y290 HydrophobicContact CB-CE1 3.61Å; A150-Y290 HydrophobicContact CB-CG 4.35Å
151	I	73.7	Confident	77.1	Confident	64 Å²	64	33.2 Å²	33.2	33%	0.328	17%	0.17	S	C	.	.	H	α-helix	trans	-118.3	-7	178.7	59.4	172.5	0	0	0	114.3	I149 F235 Y278 F283 I285	I149-I151 VanDerWaalsContact C-N 3.26Å; I149-I151 PolarHBondContact O-N 3.27Å; I151-F235 HydrophobicContact CD1-CE2 4.11Å; I151-Y278 HydrophobicContact CD1-CD1 3.57Å; I151-Y278 HydrophobicContact CD1-CD2 3.26Å; I151-Y278 HydrophobicContact CD1-CE1 3.91Å; I151-Y278 HydrophobicContact CD1-CE2 3.62Å; I151-Y278 HydrophobicContact CD1-CG 3.22Å; I151-Y278 HydrophobicContact CG1-CD2 3.55Å; I151-Y278 HydrophobicContact CG1-CE2 3.93Å; I151-Y278 HydrophobicContact CG1-CG 3.98Å; I151-F283 HydrophobicContact CD1-CE1 4.31Å; I151-F283 HydrophobicContact CG1-CZ 4.49Å; I151-F283 HydrophobicContact CG2-CD2 4.32Å; I151-F283 HydrophobicContact CG2-CE1 4.16Å; I151-F283 HydrophobicContact CG2-CE2 3.68Å; I151-F283 HydrophobicContact CG2-CZ 3.59Å; I151-I285 HydrophobicContact CG2-CD1 4.37Å
152	S	78.3	Confident	79.1	Confident	26 Å²	26	32.5 Å²	32.5	18%	0.182	17%	0.165	C	C	.	.	S	Bend	trans	-98.8	160.5	180	-54.7	0	0	0	0	112.1	E148 V154 I195	E148-S152 WeakPolarHBondContact O-CB 3.31Å; E148-S152 PolarHBondContact O-N 3.49Å; E148-S152 PolarHBondContact O-OG 3.46Å; S152-V154 PolarHBondContact O-N 3.21Å; S152-I195 VanDerWaalsContact CB-CG2 3.41Å
153	F	83.3	Confident	81	Confident	90 Å²	90	40.1 Å²	40.1	40%	0.395	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	105.7	167.9	-178.8	-100.1	0	0	0	109	F116 R155 F196	F116-F153 HydrophobicContact CD1-CE1 4.11Å; F116-F153 AromaticContact CE1-CE1 3.55Å; F116-F153 HydrophobicContact CE1-CE1 3.55Å; F116-F153 AromaticContact CE1-CZ 3.88Å; F116-F153 HydrophobicContact CE1-CZ 3.88Å; F116-F153 HydrophobicContact CZ-CE1 4.32Å; F153-R155 VanDerWaalsContact CZ-NH2 3.3Å; F153-F196 HydrophobicContact CD1-CB 3.87Å; F153-F196 AromaticContact CD1-CD2 3.52Å; F153-F196 HydrophobicContact CD1-CD2 3.52Å; F153-F196 HydrophobicContact CD1-CE2 4.4Å; F153-F196 AromaticContact CD1-CG 3.93Å; F153-F196 HydrophobicContact CD1-CG 3.93Å; F153-F196 AromaticContact CE1-CD2 3.72Å; F153-F196 HydrophobicContact CE1-CD2 3.72Å; F153-F196 HydrophobicContact CE1-CE2 4.21Å; F153-F196 HydrophobicContact CE1-CG 4.21Å; F153-F196 PolarHBondContact O-N 3.09Å
154	V	88.2	Confident	82.6	Confident	2 Å²	2	36.7 Å²	36.7	1%	0.012	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	147.4	-172.9	-172.1	0	0	0	0	111.9	I149 S152 L193 L194 I195	I149-V154 HydrophobicContact CB-CG2 4.02Å; I149-V154 HydrophobicContact CG2-CG1 4.35Å; I149-V154 HydrophobicContact CG2-CG2 4.22Å; S152-V154 PolarHBondContact O-N 3.21Å; V154-L193 HydrophobicContact CG1-CB 4.06Å; V154-L193 HydrophobicContact CG1-CD2 4.28Å; V154-L194 CarbonylContact C-O 3.58Å; V154-L194 VanDerWaalsContact CA-O 3.26Å; V154-L194 WeakPolarHBondContact CA-O 3.44Å; V154-I195 HydrophobicContact CG1-CG1 4.29Å; V154-I195 HydrophobicContact CG2-CB 4.41Å; V154-I195 HydrophobicContact CG2-CD1 4.44Å; V154-I195 HydrophobicContact CG2-CG1 3.88Å; V154-I195 HydrophobicContact CG2-CG2 4.31Å
155	R	92.1	Very high	84.1	Confident	35 Å²	35	34.1 Å²	34.1	13%	0.132	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	130	164.8	-65.4	-67.9	176.3	-109.7	17.1	111.2	C80 Q82 L86 I91 F153 L193 L194 F196	C80-R155 PolarHBondContact O-NH1 3.17Å; Q82-R155 VanDerWaalsContact OE1-CD 3.32Å; L86-R155 HydrophobicContact CD1-CB 4.38Å; L86-R155 HydrophobicContact CD1-CG 4.42Å; I91-R155 HydrophobicContact CD1-CB 4.05Å; I91-R155 HydrophobicContact CD1-CG 4.19Å; F153-R155 VanDerWaalsContact CZ-NH2 3.3Å; R155-L193 CarbonylContact O-C 3.56Å; R155-L193 WeakPolarHBondContact O-CA 3.37Å; R155-L194 HydrophobicContact CB-CB 4.45Å; R155-L194 PolarHBondContact N-O 2.98Å; R155-L194 PolarHBondContact O-N 3.29Å; R155-F196 HydrophobicContact CB-CE2 3.96Å; R155-F196 HydrophobicContact CG-CE2 3.63Å; R155-F196 HydrophobicContact CG-CZ 4.34Å
156	C	92.1	Very high	85.4	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	128.5	169.5	-177.3	0	0	0	0	109.6	I76 L77 Q82 L86 Y192 L193	I76-C156 HydrophobicContact CG2-CB 3.76Å; L77-C156 HydrophobicContact CD2-CB 4.13Å; Q82-C156 PolarHBondContact NE2-O 3.18Å; L86-C156 PolarHBondContact N-O 2.98Å; L86-C156 VanDerWaalsContact N-O 3.08Å; C156-Y192 WeakPolarHBondContact CA-O 3.48Å; C156-L193 HydrophobicContact CB-CD2 3.79Å
157	L	93.2	Very high	86.5	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	167.4	178.4	64.9	126.3	0	0	0	112.8	V85 L86 W88 I91 L191 Y192 L194	V85-L157 VanDerWaalsContact CG1-C 3.47Å; L86-L157 HydrophobicContact CB-CB 3.95Å; L86-L157 CarbonylContact O-C 3.49Å; L86-L157 WeakPolarHBondContact O-CA 3.27Å; L86-L157 WeakPolarHBondContact O-CB 3.47Å; W88-L157 HydrophobicContact CB-CD1 4.48Å; W88-L157 HydrophobicContact CD2-CD1 3.21Å; W88-L157 HydrophobicContact CE3-CD1 3.57Å; W88-L157 HydrophobicContact CG-CD1 3.66Å; W88-L157 HydrophobicContact CH2-CD1 4.03Å; W88-L157 HydrophobicContact CZ2-CD1 3.72Å; W88-L157 HydrophobicContact CZ3-CD1 3.97Å; I91-L157 HydrophobicContact CD1-CD2 4.36Å; I91-L157 HydrophobicContact CG1-CD2 3.98Å; L157-L191 CarbonylContact O-C 3.57Å; L157-L191 WeakPolarHBondContact O-CA 3.31Å; L157-Y192 PolarHBondContact N-O 3.32Å; L157-Y192 PolarHBondContact O-N 3.18Å; L157-L194 HydrophobicContact CD2-CB 4.25Å; L157-L194 HydrophobicContact CD2-CD1 3.45Å; L157-L194 VanDerWaalsContact CD2-CD1 3.45Å; L157-L194 HydrophobicContact CD2-CD2 3.68Å; L157-L194 HydrophobicContact CD2-CG 3.95Å; L157-L194 HydrophobicContact CG-CD1 4.43Å
158	Q	92.4	Very high	87.7	Confident	85 Å²	85	39.9 Å²	39.9	40%	0.397	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	148.3	-179.4	-167.5	179.2	-25.8	0	0	111.2	V85 L86 Q190 L191	V85-Q158 HydrophobicContact CG1-CB 3.7Å; L86-Q158 PolarHBondContact O-N 2.65Å; Q158-Q190 VanDerWaalsContact CA-O 3.29Å; Q158-Q190 WeakPolarHBondContact CA-O 3.46Å; Q158-Q190 WeakPolarHBondContact CG-O 3.28Å; Q158-L191 HydrophobicContact CB-CD2 3.78Å; Q158-L191 HydrophobicContact CG-CD2 3.97Å
159	G	92	Very high	88.6	Confident	6 Å²	6	40.3 Å²	40.3	6%	0.062	19%	0.19	C	C	.	.	S	Bend	trans	136.4	171.6	168.6	0	0	0	0	0	112.5	W88 E188 Q190 Y192	W88-G159 PolarHBondContact NE1-O 3.14Å; W88-G159 VanDerWaalsContact NE1-O 3.08Å; G159-E188 WeakPolarHBondContact CA-O 3.43Å; G159-Q190 PolarHBondContact N-O 3.41Å; G159-Y192 VanDerWaalsContact O-CE2 3.26Å; G159-Y192 WeakPolarHBondContact O-CE2 3.43Å
160	K	91.8	Very high	89.7	Confident	120 Å²	120	44.1 Å²	44.1	52%	0.522	21%	0.211	S	C	.	.	S	Bend	trans	-60.4	145.9	176.9	-77.4	-178	-178	-179.7	0	113	W88 P162 E188	W88-K160 PolarHBondContact NE1-O 3.12Å; W88-K160 VanDerWaalsContact NE1-O 3.08Å; K160-P162 WeakPolarHBondContact O-CD 3.4Å; K160-E188 VanDerWaalsContact CD-OE2 3.23Å; K160-E188 WeakPolarHBondContact CD-OE2 3.47Å; K160-E188 VanDerWaalsContact CE-OE2 3.23Å; K160-E188 WeakPolarHBondContact CE-OE2 3.05Å; K160-E188 VanDerWaalsContact CG-OE2 3.28Å; K160-E188 WeakPolarHBondContact CG-OE2 3.48Å; K160-E188 IonicContact NZ-OE2 3.11Å
161	Y	92.5	Very high	91.2	Very high	8 Å²	8	49 Å²	49	3%	0.031	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-56.3	124.2	175.5	-146.9	-106.5	0	0	0	110.7	W88 E110 F112 I125 R163 L165 Q166 P183 Y192	W88-Y161 HydrophobicContact CH2-CD2 4.49Å; W88-Y161 HydrophobicContact CH2-CE2 4.34Å; W88-Y161 HydrophobicContact CZ2-CD2 4.1Å; W88-Y161 HydrophobicContact CZ2-CE2 4.36Å; E110-Y161 PolarHBondContact OE2-OH 3.27Å; F112-Y161 WeakPolarHBondContact CE2-OH 3.3Å; F112-Y161 HydrophobicContact CZ-CE1 4.42Å; F112-Y161 WeakPolarHBondContact CZ-OH 3.2Å; I125-Y161 HydrophobicContact CG2-CE2 3.93Å; Y161-R163 PolarHBondContact O-N 3.33Å; Y161-L165 HydrophobicContact CD1-CB 4.04Å; Y161-L165 HydrophobicContact CE1-CB 3.61Å; Y161-Q166 HydrophobicContact CD1-CG 3.79Å; Y161-Q166 PolarHBondContact O-NE2 3.24Å; Y161-P183 WeakPolarHBondContact CB-O 3.48Å; Y161-P183 HydrophobicContact CD1-CB 3.68Å; Y161-P183 HydrophobicContact CD1-CG 3.52Å; Y161-P183 HydrophobicContact CD2-CB 4.1Å; Y161-P183 HydrophobicContact CE1-CB 3.91Å; Y161-P183 HydrophobicContact CE1-CG 3.52Å; Y161-P183 HydrophobicContact CE2-CB 4.31Å; Y161-P183 HydrophobicContact CG-CB 3.75Å; Y161-P183 HydrophobicContact CG-CG 4.14Å; Y161-Y192 HydrophobicContact CD2-CD1 4.46Å; Y161-Y192 AromaticContact CD2-CE1 3.6Å; Y161-Y192 HydrophobicContact CD2-CE1 3.6Å; Y161-Y192 HydrophobicContact CD2-CE2 4.43Å; Y161-Y192 AromaticContact CD2-CZ 3.57Å; Y161-Y192 WeakPolarHBondContact CD2-OH 3.5Å; Y161-Y192 HydrophobicContact CE2-CD1 4.34Å; Y161-Y192 AromaticContact CE2-CE1 3.77Å; Y161-Y192 HydrophobicContact CE2-CE1 3.77Å
162	P	93.3	Very high	92.1	Very high	17 Å²	17	46.3 Å²	46.3	11%	0.11	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-61.7	135	-175.6	-25.2	33	0	0	0	112.3	W88 F97 K160 P164 L165 Q166	W88-P162 HydrophobicContact CB-CG 4.08Å; W88-P162 HydrophobicContact CD2-CG 3.38Å; W88-P162 VanDerWaalsContact CE2-CD 3.45Å; W88-P162 HydrophobicContact CE3-CG 3.49Å; W88-P162 VanDerWaalsContact CE3-CG 3.49Å; W88-P162 HydrophobicContact CG-CG 3.66Å; W88-P162 HydrophobicContact CZ2-CG 4.42Å; W88-P162 HydrophobicContact CZ3-CG 4.07Å; F97-P162 HydrophobicContact CD2-CB 3.97Å; F97-P162 HydrophobicContact CD2-CG 4.12Å; F97-P162 HydrophobicContact CE2-CB 4.3Å; F97-P162 HydrophobicContact CE2-CG 3.96Å; K160-P162 WeakPolarHBondContact O-CD 3.4Å; P162-P164 VanDerWaalsContact C-N 3.35Å; P162-L165 HydrophobicContact CB-CB 4.5Å; P162-L165 HydrophobicContact CB-CD1 4.37Å; P162-L165 HydrophobicContact CB-CG 4.17Å; P162-L165 HydrophobicContact CG-CD1 4.03Å; P162-L165 HydrophobicContact CG-CG 4.38Å; P162-L165 WeakPolarHBondContact O-CB 3.43Å; P162-L165 PolarHBondContact O-N 3.19Å; P162-Q166 PolarHBondContact O-N 3.37Å
163	R	93.2	Very high	92.8	Very high	181 Å²	181	46.6 Å²	46.6	68%	0.683	22%	0.221	S	C	*	.	H	α-helix	trans	-51.8	-43.5	177.9	178.6	178.9	173.8	162.6	6.7	113.7	Y161 L165 Q166 E167	Y161-R163 PolarHBondContact O-N 3.33Å; R163-L165 PolarHBondContact O-N 3.43Å; R163-Q166 WeakPolarHBondContact O-CB 3.37Å; R163-Q166 PolarHBondContact O-N 3.34Å; R163-Q166 VanDerWaalsContact O-N 3.12Å; R163-E167 HydrophobicContact CG-CG 4.39Å; R163-E167 WeakPolarHBondContact CG-OE1 3.42Å; R163-E167 IonicContact CZ-OE1 3.66Å; R163-E167 IonicContact NE-OE1 2.84Å; R163-E167 PolarHBondContact NE-OE1 3.13Å; R163-E167 IonicContact NH2-OE1 3.63Å; R163-E167 WeakPolarHBondContact O-CG 3.32Å; R163-E167 PolarHBondContact O-N 3.02Å
164	P	93.9	Very high	93.3	Very high	29 Å²	29	46.9 Å²	46.9	19%	0.188	24%	0.235	C	C	.	.	H	α-helix	trans	-61.7	-31.4	176.8	-25	35.6	0	0	0	113.9	F97 E98 P162 E167 A168	F97-P164 HydrophobicContact CB-CB 3.89Å; F97-P164 HydrophobicContact CB-CG 4.27Å; E98-P164 HydrophobicContact CG-CB 4.16Å; E98-P164 HydrophobicContact CG-CG 4.07Å; P162-P164 VanDerWaalsContact C-N 3.35Å; P164-E167 PolarHBondContact O-N 3.04Å; P164-A168 PolarHBondContact O-N 2.88Å
165	L	94.8	Very high	93.5	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-75.4	-33.1	175.6	-60.5	-173.6	0	0	0	111.8	W88 F97 W100 F112 I125 Y161 P162 R163 A168 W169	W88-L165 HydrophobicContact CH2-CD1 4.23Å; W88-L165 HydrophobicContact CZ3-CD1 3.86Å; F97-L165 HydrophobicContact CB-CD2 4.18Å; F97-L165 HydrophobicContact CB-CG 4.4Å; F97-L165 HydrophobicContact CD1-CD2 4.39Å; F97-L165 HydrophobicContact CG-CD2 4.48Å; F97-L165 HydrophobicContact CG-CG 4.49Å; W100-L165 HydrophobicContact CB-CD2 3.7Å; W100-L165 HydrophobicContact CD2-CD2 4.07Å; W100-L165 HydrophobicContact CE3-CD1 4.46Å; W100-L165 HydrophobicContact CE3-CD2 3.69Å; W100-L165 HydrophobicContact CG-CD2 4.13Å; F112-L165 HydrophobicContact CD1-CD2 4.12Å; F112-L165 HydrophobicContact CE1-CB 4.27Å; F112-L165 HydrophobicContact CE1-CD2 4.14Å; F112-L165 HydrophobicContact CZ-CB 4.34Å; I125-L165 HydrophobicContact CD1-CD1 3.88Å; Y161-L165 HydrophobicContact CD1-CB 4.04Å; Y161-L165 HydrophobicContact CE1-CB 3.61Å; P162-L165 HydrophobicContact CB-CB 4.5Å; P162-L165 HydrophobicContact CB-CD1 4.37Å; P162-L165 HydrophobicContact CB-CG 4.17Å; P162-L165 HydrophobicContact CG-CD1 4.03Å; P162-L165 HydrophobicContact CG-CG 4.38Å; P162-L165 WeakPolarHBondContact O-CB 3.43Å; P162-L165 PolarHBondContact O-N 3.19Å; R163-L165 PolarHBondContact O-N 3.43Å; L165-A168 PolarHBondContact O-N 3.1Å; L165-W169 WeakPolarHBondContact O-CB 3.39Å; L165-W169 PolarHBondContact O-N 3.13Å
166	Q	95	Very high	93.2	Very high	43 Å²	43	52.3 Å²	52.3	20%	0.201	26%	0.262	C	S	.	.	H	α-helix	trans	-62.4	-45.4	169.4	-61.3	179.2	40.7	0	0	110.9	Y161 P162 R163 A168 W169 D170	Y161-Q166 HydrophobicContact CD1-CG 3.79Å; Y161-Q166 PolarHBondContact O-NE2 3.24Å; P162-Q166 PolarHBondContact O-N 3.37Å; R163-Q166 WeakPolarHBondContact O-CB 3.37Å; R163-Q166 PolarHBondContact O-N 3.34Å; R163-Q166 VanDerWaalsContact O-N 3.12Å; Q166-A168 VanDerWaalsContact C-N 3.31Å; Q166-A168 PolarHBondContact O-N 2.96Å; Q166-W169 CarbonylContact O-C 3.59Å; Q166-W169 WeakPolarHBondContact O-CA 3.31Å; Q166-W169 VanDerWaalsContact O-CB 3.24Å; Q166-W169 WeakPolarHBondContact O-CB 3.48Å; Q166-W169 PolarHBondContact O-N 3.14Å; Q166-D170 PolarHBondContact O-N 2.95Å
167	E	95.3	Very high	92.7	Very high	91 Å²	91	56.2 Å²	56.2	43%	0.425	29%	0.29	S	S	.	.	H	α-helix	trans	-62.8	-38.1	177.4	-69.7	168.7	179.7	0	0	111.8	R163 P164 W169 D170 M171	R163-E167 HydrophobicContact CG-CG 4.39Å; R163-E167 WeakPolarHBondContact CG-OE1 3.42Å; R163-E167 IonicContact CZ-OE1 3.66Å; R163-E167 IonicContact NE-OE1 2.84Å; R163-E167 PolarHBondContact NE-OE1 3.13Å; R163-E167 IonicContact NH2-OE1 3.63Å; R163-E167 WeakPolarHBondContact O-CG 3.32Å; R163-E167 PolarHBondContact O-N 3.02Å; P164-E167 PolarHBondContact O-N 3.04Å; E167-W169 VanDerWaalsContact C-N 3.33Å; E167-D170 PolarHBondContact O-N 3.34Å; E167-M171 PolarHBondContact O-N 2.93Å
168	A	95	Very high	92.2	Very high	13 Å²	13	57.8 Å²	57.8	11%	0.107	30%	0.299	C	S	.	.	H	α-helix	trans	-66.2	-35	171.9	0	0	0	0	0	112.5	F112 P164 L165 Q166 Y172	F112-A168 HydrophobicContact CD1-CB 4.49Å; F112-A168 HydrophobicContact CE1-CB 4.05Å; P164-A168 PolarHBondContact O-N 2.88Å; L165-A168 PolarHBondContact O-N 3.1Å; Q166-A168 VanDerWaalsContact C-N 3.31Å; Q166-A168 PolarHBondContact O-N 2.96Å; A168-Y172 PolarHBondContact O-N 2.82Å; A168-Y172 VanDerWaalsContact O-N 3.13Å
169	W	95.1	Very high	91.4	Very high	18 Å²	18	59.8 Å²	59.8	7%	0.068	31%	0.307	C	S	.	.	H	α-helix	trans	-64.9	-47.8	173.3	-169.9	107.5	0	0	0	111.7	K102 E110 L165 Q166 E167 M171 Y172 A173 T178 K180 H182 P183	K102-W169 HydrophobicContact CD-CB 4.31Å; K102-W169 HydrophobicContact CD-CG 4.08Å; K102-W169 VanDerWaalsContact NZ-CD1 3.27Å; E110-W169 PolarHBondContact OE1-NE1 2.64Å; L165-W169 WeakPolarHBondContact O-CB 3.39Å; L165-W169 PolarHBondContact O-N 3.13Å; Q166-W169 CarbonylContact O-C 3.59Å; Q166-W169 WeakPolarHBondContact O-CA 3.31Å; Q166-W169 VanDerWaalsContact O-CB 3.24Å; Q166-W169 WeakPolarHBondContact O-CB 3.48Å; Q166-W169 PolarHBondContact O-N 3.14Å; E167-W169 VanDerWaalsContact C-N 3.33Å; W169-M171 VanDerWaalsContact C-N 3.28Å; W169-M171 PolarHBondContact O-N 3.13Å; W169-Y172 WeakPolarHBondContact O-CB 3.25Å; W169-Y172 PolarHBondContact O-N 2.72Å; W169-Y172 VanDerWaalsContact O-N 3.16Å; W169-A173 HydrophobicContact CE3-CB 3.83Å; W169-A173 HydrophobicContact CH2-CB 4.03Å; W169-A173 HydrophobicContact CZ3-CB 3.52Å; W169-A173 WeakPolarHBondContact O-CB 3.44Å; W169-A173 PolarHBondContact O-N 3.39Å; W169-T178 HydrophobicContact CH2-CG2 3.72Å; W169-T178 HydrophobicContact CZ2-CG2 3.8Å; W169-K180 HydrophobicContact CZ2-CB 4.31Å; W169-K180 WeakPolarHBondContact CZ2-O 3.43Å; W169-H182 HydrophobicContact CE3-CB 4.37Å; W169-H182 AromaticContact CE3-CD2 3.31Å; W169-H182 HydrophobicContact CH2-CB 4.02Å; W169-H182 HydrophobicContact CZ2-CB 4.46Å; W169-H182 HydrophobicContact CZ3-CB 3.96Å; W169-H182 AromaticContact CZ3-CD2 3.55Å; W169-P183 HydrophobicContact CG-CG 4.31Å
170	D	95.1	Very high	90.9	Very high	80 Å²	80	62 Å²	62	43%	0.428	32%	0.315	S	S	.	.	H	α-helix	trans	-57.1	-43.6	176.7	-74.9	-33.9	0	0	0	111.1	Q166 E167 Y172 A173 S174 H182	Q166-D170 PolarHBondContact O-N 2.95Å; E167-D170 PolarHBondContact O-N 3.34Å; D170-Y172 PolarHBondContact O-N 2.86Å; D170-A173 PolarHBondContact O-N 3.22Å; D170-S174 WeakPolarHBondContact O-CB 3.28Å; D170-S174 PolarHBondContact O-N 2.98Å; D170-H182 IonicContact OD1-CD2 3.43Å; D170-H182 PolarHBondContact OD1-CD2 3.12Å; D170-H182 IonicContact OD1-NE2 2.91Å; D170-H182 PolarHBondContact OD1-NE2 3.44Å; D170-H182 IonicContact OD2-NE2 2.74Å
171	M	94.5	Very high	90.6	Very high	121 Å²	121	65 Å²	65	60%	0.596	33%	0.331	S	S	*	.	H	α-helix	trans	-61.6	-45.3	177.7	-170.2	172.4	-61.3	0	0	111.5	E167 W169 S174 I175	E167-M171 PolarHBondContact O-N 2.93Å; W169-M171 VanDerWaalsContact C-N 3.28Å; W169-M171 PolarHBondContact O-N 3.13Å; M171-S174 PolarHBondContact O-N 3.05Å; M171-S174 PolarHBondContact O-OG 2.76Å; M171-I175 WeakPolarHBondContact O-CG1 2.94Å; M171-I175 PolarHBondContact O-N 2.77Å
172	Y	94.1	Very high	90.5	Very high	7 Å²	7	66.7 Å²	66.7	3%	0.027	34%	0.339	C	S	.	.	H	α-helix	trans	-61.8	-48.3	175.3	-178.8	-84	0	0	0	111.6	K102 A168 W169 D170 S174 I175 Y176	K102-Y172 HydrophobicContact CB-CD2 4.29Å; K102-Y172 HydrophobicContact CB-CG 4.22Å; K102-Y172 HydrophobicContact CD-CD1 3.94Å; K102-Y172 HydrophobicContact CD-CD2 4.39Å; K102-Y172 HydrophobicContact CD-CG 3.8Å; K102-Y172 HydrophobicContact CG-CD1 4.37Å; K102-Y172 HydrophobicContact CG-CD2 3.93Å; K102-Y172 HydrophobicContact CG-CG 3.83Å; K102-Y172 VanDerWaalsContact O-CD2 3.31Å; K102-Y172 WeakPolarHBondContact O-CD2 3.33Å; A168-Y172 PolarHBondContact O-N 2.82Å; A168-Y172 VanDerWaalsContact O-N 3.13Å; W169-Y172 WeakPolarHBondContact O-CB 3.25Å; W169-Y172 PolarHBondContact O-N 2.72Å; W169-Y172 VanDerWaalsContact O-N 3.16Å; D170-Y172 PolarHBondContact O-N 2.86Å; Y172-S174 PolarHBondContact O-N 3.16Å; Y172-I175 PolarHBondContact O-N 2.85Å; Y172-Y176 HydrophobicContact CD1-CD2 4.07Å; Y172-Y176 AromaticContact CD2-CD2 3.43Å; Y172-Y176 HydrophobicContact CD2-CD2 3.43Å; Y172-Y176 VanDerWaalsContact CD2-CD2 3.43Å; Y172-Y176 AromaticContact CD2-CE2 3.89Å; Y172-Y176 HydrophobicContact CD2-CE2 3.89Å; Y172-Y176 HydrophobicContact CD2-CG 4.5Å; Y172-Y176 HydrophobicContact CE1-CD2 4Å; Y172-Y176 HydrophobicContact CE1-CG 4.22Å; Y172-Y176 AromaticContact CE2-CD2 3.37Å; Y172-Y176 HydrophobicContact CE2-CD2 3.37Å; Y172-Y176 AromaticContact CE2-CE2 3.86Å; Y172-Y176 HydrophobicContact CE2-CE2 3.86Å; Y172-Y176 HydrophobicContact CE2-CG 4.14Å; Y172-Y176 AromaticContact CG-CD2 3.79Å; Y172-Y176 HydrophobicContact CG-CD2 3.79Å; Y172-Y176 AromaticContact CZ-CD2 3.66Å; Y172-Y176 AromaticContact CZ-CG 3.98Å; Y172-Y176 WeakPolarHBondContact O-CD2 3.25Å; Y172-Y176 PolarHBondContact O-N 3.05Å
173	A	92.7	Very high	90.3	Very high	32 Å²	32	66.8 Å²	66.8	26%	0.264	34%	0.339	S	S	.	.	H	α-helix	trans	-63.2	-26.6	179.7	0	0	0	0	0	113.2	W169 D170 I175 Y176 T178	W169-A173 HydrophobicContact CE3-CB 3.83Å; W169-A173 HydrophobicContact CH2-CB 4.03Å; W169-A173 HydrophobicContact CZ3-CB 3.52Å; W169-A173 WeakPolarHBondContact O-CB 3.44Å; W169-A173 PolarHBondContact O-N 3.39Å; D170-A173 PolarHBondContact O-N 3.22Å; A173-I175 VanDerWaalsContact C-N 3.3Å; A173-Y176 CarbonylContact C-O 3.56Å; A173-Y176 WeakPolarHBondContact CA-O 3.26Å; A173-T178 HydrophobicContact CB-CG2 3.77Å
174	S	93.4	Very high	90.1	Very high	96 Å²	96	63.2 Å²	63.2	67%	0.671	33%	0.334	S	S	*	.	H	α-helix	trans	-72.3	-23.3	174.6	78.2	0	0	0	0	113.7	D170 M171 Y172	D170-S174 WeakPolarHBondContact O-CB 3.28Å; D170-S174 PolarHBondContact O-N 2.98Å; M171-S174 PolarHBondContact O-N 3.05Å; M171-S174 PolarHBondContact O-OG 2.76Å; Y172-S174 PolarHBondContact O-N 3.16Å
175	I	92	Very high	89.7	Confident	109 Å²	109	65 Å²	65	56%	0.559	36%	0.358	S	S	*	.	H	α-helix	trans	-101.5	-37	-178.1	-58.8	169.6	0	0	0	110.6	M171 Y172 A173	M171-I175 WeakPolarHBondContact O-CG1 2.94Å; M171-I175 PolarHBondContact O-N 2.77Å; Y172-I175 PolarHBondContact O-N 2.85Å; A173-I175 VanDerWaalsContact C-N 3.3Å
176	Y	87	Confident	89.2	Confident	43 Å²	43	66 Å²	66	17%	0.169	37%	0.366	C	S	.	.	S	Bend	trans	-119.4	135	-174.9	-55.2	-63.3	0	0	0	110.3	H28 T29 Y172 A173 T178	H28-Y176 VanDerWaalsContact O-CE2 3.3Å; H28-Y176 WeakPolarHBondContact O-CE2 3.29Å; H28-Y176 PolarHBondContact O-OH 3.2Å; T29-Y176 HydrophobicContact CG2-CE1 3.54Å; T29-Y176 WeakPolarHBondContact CG2-OH 3.44Å; Y172-Y176 HydrophobicContact CD1-CD2 4.07Å; Y172-Y176 AromaticContact CD2-CD2 3.43Å; Y172-Y176 HydrophobicContact CD2-CD2 3.43Å; Y172-Y176 VanDerWaalsContact CD2-CD2 3.43Å; Y172-Y176 AromaticContact CD2-CE2 3.89Å; Y172-Y176 HydrophobicContact CD2-CE2 3.89Å; Y172-Y176 HydrophobicContact CD2-CG 4.5Å; Y172-Y176 HydrophobicContact CE1-CD2 4Å; Y172-Y176 HydrophobicContact CE1-CG 4.22Å; Y172-Y176 AromaticContact CE2-CD2 3.37Å; Y172-Y176 HydrophobicContact CE2-CD2 3.37Å; Y172-Y176 AromaticContact CE2-CE2 3.86Å; Y172-Y176 HydrophobicContact CE2-CE2 3.86Å; Y172-Y176 HydrophobicContact CE2-CG 4.14Å; Y172-Y176 AromaticContact CG-CD2 3.79Å; Y172-Y176 HydrophobicContact CG-CD2 3.79Å; Y172-Y176 AromaticContact CZ-CD2 3.66Å; Y172-Y176 AromaticContact CZ-CG 3.98Å; Y172-Y176 WeakPolarHBondContact O-CD2 3.25Å; Y172-Y176 PolarHBondContact O-N 3.05Å; A173-Y176 CarbonylContact C-O 3.56Å; A173-Y176 WeakPolarHBondContact CA-O 3.26Å; Y176-T178 PolarHBondContact O-N 3.09Å
177	S	81.3	Confident	88.9	Confident	82 Å²	82	65.7 Å²	65.7	57%	0.573	37%	0.368	S	S	*	.			trans	-62.5	127.2	167.3	54.6	0	0	0	0	109.4
178	T	81.3	Confident	88.5	Confident	32 Å²	32	67 Å²	67	20%	0.196	37%	0.374	C	S	.	.			trans	-125.7	143.4	171.9	-179.3	0	0	0	0	109.3	E105 W169 A173 Y176 K180	E105-T178 WeakPolarHBondContact OE1-CB 3.3Å; E105-T178 PolarHBondContact OE1-OG1 2.94Å; E105-T178 PolarHBondContact OE2-OG1 3.27Å; W169-T178 HydrophobicContact CH2-CG2 3.72Å; W169-T178 HydrophobicContact CZ2-CG2 3.8Å; A173-T178 HydrophobicContact CB-CG2 3.77Å; Y176-T178 PolarHBondContact O-N 3.09Å; T178-K180 PolarHBondContact OG1-N 3.31Å
179	F	76.5	Confident	88.1	Confident	128 Å²	128	68.4 Å²	68.4	56%	0.561	39%	0.39	S	S	*	.			trans	-96.1	-2.6	173.2	-58.2	-76.2	0	0	0	112.2	V36	V36-F179 HydrophobicContact CB-CE2 4.23Å; V36-F179 HydrophobicContact CG1-CE2 4Å; V36-F179 HydrophobicContact CG1-CZ 4.01Å; V36-F179 HydrophobicContact CG2-CE2 4.03Å
180	K	81	Confident	87.9	Confident	52 Å²	52	68.6 Å²	68.6	23%	0.226	39%	0.391	C	S	.	.	S	Bend	trans	-77.8	144.2	-177.5	-66.1	-159.9	167.8	-156.6	0	111.5	E105 G106 A107 S109 W169 T178	E105-K180 HydrophobicContact CB-CD 4.27Å; G106-K180 WeakPolarHBondContact O-CE 3.3Å; G106-K180 PolarHBondContact O-NZ 2.79Å; A107-K180 WeakPolarHBondContact O-CE 3.36Å; A107-K180 PolarHBondContact O-NZ 3.4Å; S109-K180 VanDerWaalsContact N-NZ 3.13Å; S109-K180 PolarHBondContact O-NZ 2.91Å; W169-K180 HydrophobicContact CZ2-CB 4.31Å; W169-K180 WeakPolarHBondContact CZ2-O 3.43Å; T178-K180 PolarHBondContact OG1-N 3.31Å
181	E	85.2	Confident	87.7	Confident	183 Å²	183	65 Å²	65	86%	0.855	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-65.9	143.7	167.3	-64.3	-167.9	161.6	0	0	110.7
182	H	90.6	Very high	87.5	Confident	43 Å²	43	59.6 Å²	59.6	20%	0.199	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-65.4	135.1	176.7	-177.6	-67.9	0	0	0	110.2	W169 D170 N184	W169-H182 HydrophobicContact CE3-CB 4.37Å; W169-H182 AromaticContact CE3-CD2 3.31Å; W169-H182 HydrophobicContact CH2-CB 4.02Å; W169-H182 HydrophobicContact CZ2-CB 4.46Å; W169-H182 HydrophobicContact CZ3-CB 3.96Å; W169-H182 AromaticContact CZ3-CD2 3.55Å; D170-H182 IonicContact OD1-CD2 3.43Å; D170-H182 PolarHBondContact OD1-CD2 3.12Å; D170-H182 IonicContact OD1-NE2 2.91Å; D170-H182 PolarHBondContact OD1-NE2 3.44Å; D170-H182 IonicContact OD2-NE2 2.74Å; H182-N184 WeakPolarHBondContact ND1-CB 3.5Å; H182-N184 PolarHBondContact ND1-N 2.93Å; H182-N184 PolarHBondContact ND1-ND2 3.45Å; H182-N184 PolarHBondContact O-N 3.3Å; H182-N184 PolarHBondContact O-OD1 2.96Å
183	P	89.4	Confident	87.4	Confident	19 Å²	19	59.3 Å²	59.3	12%	0.123	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-75.4	20	-172.9	30.9	-37.4	0	0	0	115.4	Y161 W169	Y161-P183 WeakPolarHBondContact CB-O 3.48Å; Y161-P183 HydrophobicContact CD1-CB 3.68Å; Y161-P183 HydrophobicContact CD1-CG 3.52Å; Y161-P183 HydrophobicContact CD2-CB 4.1Å; Y161-P183 HydrophobicContact CE1-CB 3.91Å; Y161-P183 HydrophobicContact CE1-CG 3.52Å; Y161-P183 HydrophobicContact CE2-CB 4.31Å; Y161-P183 HydrophobicContact CG-CB 3.75Å; Y161-P183 HydrophobicContact CG-CG 4.14Å; W169-P183 HydrophobicContact CG-CG 4.31Å
184	N	88.6	Confident	87.4	Confident	106 Å²	106	57.8 Å²	57.8	57%	0.567	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-80.4	-20.9	-176	59.5	5.4	0	0	0	113.2	H182 A186	H182-N184 WeakPolarHBondContact ND1-CB 3.5Å; H182-N184 PolarHBondContact ND1-N 2.93Å; H182-N184 PolarHBondContact ND1-ND2 3.45Å; H182-N184 PolarHBondContact O-N 3.3Å; H182-N184 PolarHBondContact O-OD1 2.96Å; N184-A186 VanDerWaalsContact C-N 3.28Å; N184-A186 PolarHBondContact O-N 3.4Å
185	G	85.7	Confident	87.2	Confident	68 Å²	68	53.2 Å²	53.2	70%	0.701	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-77.9	-8.5	-179.1	0	0	0	0	0	114.3
186	A	85.4	Confident	87	Confident	19 Å²	19	49 Å²	49	16%	0.157	28%	0.277	C	S	.	.			trans	-61.7	131	-175.4	0	0	0	0	0	112.3	N184 Q190 Y192	N184-A186 VanDerWaalsContact C-N 3.28Å; N184-A186 PolarHBondContact O-N 3.4Å; A186-Q190 HydrophobicContact CB-CB 4.17Å; A186-Q190 HydrophobicContact CB-CG 4.15Å; A186-Y192 WeakPolarHBondContact CB-OH 3.33Å
187	P	87.3	Confident	86.9	Confident	38 Å²	38	48.6 Å²	48.6	25%	0.247	28%	0.277	C	S	.	.			trans	-72.5	166.1	178.7	32.5	-38.8	0	0	0	112.1	G189 Q190	P187-G189 PolarHBondContact O-N 3.27Å; P187-G189 VanDerWaalsContact O-N 3.14Å; P187-Q190 HydrophobicContact CG-CB 4.18Å; P187-Q190 VanDerWaalsContact O-CB 3.26Å; P187-Q190 WeakPolarHBondContact O-CB 3.41Å; P187-Q190 PolarHBondContact O-N 2.95Å
188	E	86.8	Confident	86.8	Confident	118 Å²	118	49.3 Å²	49.3	55%	0.551	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-23.8	173.7	-157.3	66.1	-130.9	0	0	112.9	G159 K160 Q190	G159-E188 WeakPolarHBondContact CA-O 3.43Å; K160-E188 VanDerWaalsContact CD-OE2 3.23Å; K160-E188 WeakPolarHBondContact CD-OE2 3.47Å; K160-E188 VanDerWaalsContact CE-OE2 3.23Å; K160-E188 WeakPolarHBondContact CE-OE2 3.05Å; K160-E188 VanDerWaalsContact CG-OE2 3.28Å; K160-E188 WeakPolarHBondContact CG-OE2 3.48Å; K160-E188 IonicContact NZ-OE2 3.11Å; E188-Q190 VanDerWaalsContact C-N 3.32Å
189	G	87.6	Confident	86.7	Confident	43 Å²	43	50.3 Å²	50.3	44%	0.443	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-3.5	176.1	0	0	0	0	0	115.2	P187 L191	P187-G189 PolarHBondContact O-N 3.27Å; P187-G189 VanDerWaalsContact O-N 3.14Å; G189-L191 PolarHBondContact O-N 3.12Å
190	Q	89.7	Confident	86.4	Confident	21 Å²	21	45 Å²	45	10%	0.098	25%	0.251	C	S	.	.			trans	-64.8	130.9	-174.3	-174.1	61.2	51.5	0	0	110.9	I128 Q158 G159 A186 P187 E188 Y192	I128-Q190 PolarHBondContact O-NE2 3.21Å; Q158-Q190 VanDerWaalsContact CA-O 3.29Å; Q158-Q190 WeakPolarHBondContact CA-O 3.46Å; Q158-Q190 WeakPolarHBondContact CG-O 3.28Å; G159-Q190 PolarHBondContact N-O 3.41Å; A186-Q190 HydrophobicContact CB-CB 4.17Å; A186-Q190 HydrophobicContact CB-CG 4.15Å; P187-Q190 HydrophobicContact CG-CB 4.18Å; P187-Q190 VanDerWaalsContact O-CB 3.26Å; P187-Q190 WeakPolarHBondContact O-CB 3.41Å; P187-Q190 PolarHBondContact O-N 2.95Å; E188-Q190 VanDerWaalsContact C-N 3.32Å; Q190-Y192 HydrophobicContact CB-CE2 3.76Å; Q190-Y192 HydrophobicContact CG-CD2 4.1Å; Q190-Y192 HydrophobicContact CG-CE1 4.02Å; Q190-Y192 HydrophobicContact CG-CE2 3.34Å; Q190-Y192 WeakPolarHBondContact CG-OH 3.23Å
191	L	91.1	Very high	85.7	Confident	6 Å²	6	45.7 Å²	45.7	3%	0.031	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	147.8	171.7	-66.3	173.8	0	0	0	110.4	L73 V85 I128 L157 Q158 G189	L73-L191 HydrophobicContact CD1-CD1 4.15Å; V85-L191 HydrophobicContact CG1-CD2 3.73Å; V85-L191 HydrophobicContact CG2-CD2 4.45Å; I128-L191 HydrophobicContact CD1-CB 4.1Å; I128-L191 HydrophobicContact CG1-CB 3.67Å; I128-L191 PolarHBondContact N-O 3.15Å; I128-L191 WeakPolarHBondContact O-CB 3.29Å; L157-L191 CarbonylContact O-C 3.57Å; L157-L191 WeakPolarHBondContact O-CA 3.31Å; Q158-L191 HydrophobicContact CB-CD2 3.78Å; Q158-L191 HydrophobicContact CG-CD2 3.97Å; G189-L191 PolarHBondContact O-N 3.12Å
192	Y	91.5	Very high	85.5	Confident	7 Å²	7	38.5 Å²	38.5	3%	0.027	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	146	175.5	-61	-89.1	0	0	0	110.8	W88 I125 I126 P127 C156 L157 G159 Y161 A186 Q190	W88-Y192 HydrophobicContact CH2-CG 4.39Å; W88-Y192 HydrophobicContact CZ2-CD1 4.27Å; W88-Y192 AromaticContact CZ2-CD2 3.52Å; W88-Y192 HydrophobicContact CZ2-CD2 3.52Å; W88-Y192 AromaticContact CZ2-CE2 3.8Å; W88-Y192 HydrophobicContact CZ2-CE2 3.8Å; W88-Y192 AromaticContact CZ2-CG 3.77Å; W88-Y192 HydrophobicContact CZ2-CG 3.77Å; I125-Y192 HydrophobicContact CG2-CD1 3.74Å; I125-Y192 HydrophobicContact CG2-CE1 4.45Å; I125-Y192 HydrophobicContact CG2-CG 4.41Å; I126-Y192 CarbonylContact O-C 3.55Å; I126-Y192 WeakPolarHBondContact O-CA 3.3Å; P127-Y192 HydrophobicContact CB-CD1 4.11Å; P127-Y192 HydrophobicContact CB-CE1 3.97Å; C156-Y192 WeakPolarHBondContact CA-O 3.48Å; L157-Y192 PolarHBondContact N-O 3.32Å; L157-Y192 PolarHBondContact O-N 3.18Å; G159-Y192 VanDerWaalsContact O-CE2 3.26Å; G159-Y192 WeakPolarHBondContact O-CE2 3.43Å; Y161-Y192 HydrophobicContact CD2-CD1 4.46Å; Y161-Y192 AromaticContact CD2-CE1 3.6Å; Y161-Y192 HydrophobicContact CD2-CE1 3.6Å; Y161-Y192 HydrophobicContact CD2-CE2 4.43Å; Y161-Y192 AromaticContact CD2-CZ 3.57Å; Y161-Y192 WeakPolarHBondContact CD2-OH 3.5Å; Y161-Y192 HydrophobicContact CE2-CD1 4.34Å; Y161-Y192 AromaticContact CE2-CE1 3.77Å; Y161-Y192 HydrophobicContact CE2-CE1 3.77Å; A186-Y192 WeakPolarHBondContact CB-OH 3.33Å; Q190-Y192 HydrophobicContact CB-CE2 3.76Å; Q190-Y192 HydrophobicContact CG-CD2 4.1Å; Q190-Y192 HydrophobicContact CG-CE1 4.02Å; Q190-Y192 HydrophobicContact CG-CE2 3.34Å; Q190-Y192 WeakPolarHBondContact CG-OH 3.23Å
193	L	91.1	Very high	84.9	Confident	0 Å²	0	38 Å²	38	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	127.7	163.4	-57.1	-179.7	0	0	0	109.1	I76 I125 I126 I128 V145 I149 V154 R155 C156	I76-L193 HydrophobicContact CG2-CD2 3.59Å; I125-L193 WeakPolarHBondContact CA-O 3.38Å; I126-L193 HydrophobicContact CB-CB 4.33Å; I126-L193 PolarHBondContact N-O 2.92Å; I126-L193 PolarHBondContact O-N 3.35Å; I128-L193 HydrophobicContact CD1-CD1 4.11Å; I128-L193 HydrophobicContact CD1-CD2 3.67Å; I128-L193 HydrophobicContact CD1-CG 3.66Å; I128-L193 HydrophobicContact CG1-CD2 4.48Å; I128-L193 HydrophobicContact CG1-CG 4.05Å; I128-L193 HydrophobicContact CG2-CD1 3.88Å; I128-L193 HydrophobicContact CG2-CG 4Å; V145-L193 HydrophobicContact CG2-CD1 4.32Å; I149-L193 HydrophobicContact CG2-CD1 3.72Å; V154-L193 HydrophobicContact CG1-CB 4.06Å; V154-L193 HydrophobicContact CG1-CD2 4.28Å; R155-L193 CarbonylContact O-C 3.56Å; R155-L193 WeakPolarHBondContact O-CA 3.37Å; C156-L193 HydrophobicContact CB-CD2 3.79Å
194	L	92.7	Very high	84.4	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	110.1	173	-91.3	54.8	0	0	0	108.4	W88 I91 I123 K124 I125 V154 R155 L157 F196	W88-L194 HydrophobicContact CH2-CD1 4.03Å; W88-L194 HydrophobicContact CZ3-CD1 4.25Å; W88-L194 HydrophobicContact CZ3-CD2 4.1Å; I91-L194 HydrophobicContact CG1-CD2 4.4Å; I91-L194 HydrophobicContact CG2-CD2 4.02Å; I123-L194 HydrophobicContact CG2-CB 4.11Å; I123-L194 HydrophobicContact CG2-CD2 4.18Å; I123-L194 HydrophobicContact CG2-CG 3.81Å; K124-L194 WeakPolarHBondContact O-CA 3.45Å; I125-L194 HydrophobicContact CB-CD1 4.32Å; I125-L194 HydrophobicContact CD1-CD1 4.5Å; I125-L194 HydrophobicContact CG1-CD1 3.96Å; I125-L194 HydrophobicContact CG1-CG 4.11Å; I125-L194 HydrophobicContact CG2-CD1 3.94Å; V154-L194 CarbonylContact C-O 3.58Å; V154-L194 VanDerWaalsContact CA-O 3.26Å; V154-L194 WeakPolarHBondContact CA-O 3.44Å; R155-L194 HydrophobicContact CB-CB 4.45Å; R155-L194 PolarHBondContact N-O 2.98Å; R155-L194 PolarHBondContact O-N 3.29Å; L157-L194 HydrophobicContact CD2-CB 4.25Å; L157-L194 HydrophobicContact CD2-CD1 3.45Å; L157-L194 VanDerWaalsContact CD2-CD1 3.45Å; L157-L194 HydrophobicContact CD2-CD2 3.68Å; L157-L194 HydrophobicContact CD2-CG 3.95Å; L157-L194 HydrophobicContact CG-CD1 4.43Å; L194-F196 HydrophobicContact CB-CE2 3.76Å; L194-F196 HydrophobicContact CB-CZ 3.91Å; L194-F196 HydrophobicContact CD2-CZ 4.03Å; L194-F196 WeakPolarHBondContact O-CD2 3.37Å; L194-F196 WeakPolarHBondContact O-CE2 3.48Å
195	I	89.6	Confident	83.8	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	115.7	174.8	-50.7	-171.9	0	0	0	108	I123 K124 I126 E148 I149 S152 V154 M197	I123-I195 WeakPolarHBondContact CA-O 3.36Å; K124-I195 HydrophobicContact CB-CB 4.2Å; K124-I195 PolarHBondContact N-O 3.29Å; K124-I195 PolarHBondContact O-N 3.38Å; I126-I195 HydrophobicContact CD1-CD1 3.73Å; I126-I195 HydrophobicContact CD1-CG1 4.38Å; E148-I195 HydrophobicContact CB-CD1 4.34Å; E148-I195 HydrophobicContact CG-CD1 3.7Å; I149-I195 HydrophobicContact CG2-CD1 4.35Å; S152-I195 VanDerWaalsContact CB-CG2 3.41Å; V154-I195 HydrophobicContact CG1-CG1 4.29Å; V154-I195 HydrophobicContact CG2-CB 4.41Å; V154-I195 HydrophobicContact CG2-CD1 4.44Å; V154-I195 HydrophobicContact CG2-CG1 3.88Å; V154-I195 HydrophobicContact CG2-CG2 4.31Å; I195-M197 HydrophobicContact CG2-CG 4.36Å
196	F	88	Confident	83.5	Confident	20 Å²	20	34.5 Å²	34.5	9%	0.088	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	130	178.5	-52	-101.1	0	0	0	110.1	F116 I123 F153 R155 L194	F116-F196 HydrophobicContact CB-CD1 3.62Å; F116-F196 HydrophobicContact CB-CE1 3.46Å; F116-F196 VanDerWaalsContact CB-CE1 3.46Å; F116-F196 HydrophobicContact CB-CZ 4.44Å; F116-F196 HydrophobicContact CD1-CD1 4.07Å; F116-F196 HydrophobicContact CD1-CE1 4Å; F116-F196 HydrophobicContact CD1-CG 4.5Å; F116-F196 HydrophobicContact CD1-CZ 4.34Å; F116-F196 HydrophobicContact CD2-CD1 4.4Å; F116-F196 AromaticContact CD2-CE1 3.56Å; F116-F196 HydrophobicContact CD2-CE1 3.56Å; F116-F196 AromaticContact CD2-CZ 3.73Å; F116-F196 HydrophobicContact CD2-CZ 3.73Å; F116-F196 HydrophobicContact CE2-CE1 4.28Å; F116-F196 AromaticContact CE2-CZ 4Å; F116-F196 HydrophobicContact CE2-CZ 4Å; F116-F196 AromaticContact CG-CD1 3.78Å; F116-F196 HydrophobicContact CG-CD1 3.78Å; F116-F196 AromaticContact CG-CE1 3.39Å; F116-F196 HydrophobicContact CG-CE1 3.39Å; F116-F196 AromaticContact CG-CZ 3.91Å; F116-F196 HydrophobicContact CG-CZ 3.91Å; F116-F196 HydrophobicContact CZ-CZ 4.41Å; I123-F196 HydrophobicContact CG1-CD1 3.7Å; I123-F196 HydrophobicContact CG1-CE1 3.93Å; I123-F196 HydrophobicContact CG2-CD1 4.35Å; I123-F196 HydrophobicContact CG2-CE1 4.2Å; F153-F196 HydrophobicContact CD1-CB 3.87Å; F153-F196 AromaticContact CD1-CD2 3.52Å; F153-F196 HydrophobicContact CD1-CD2 3.52Å; F153-F196 HydrophobicContact CD1-CE2 4.4Å; F153-F196 AromaticContact CD1-CG 3.93Å; F153-F196 HydrophobicContact CD1-CG 3.93Å; F153-F196 AromaticContact CE1-CD2 3.72Å; F153-F196 HydrophobicContact CE1-CD2 3.72Å; F153-F196 HydrophobicContact CE1-CE2 4.21Å; F153-F196 HydrophobicContact CE1-CG 4.21Å; F153-F196 PolarHBondContact O-N 3.09Å; R155-F196 HydrophobicContact CB-CE2 3.96Å; R155-F196 HydrophobicContact CG-CE2 3.63Å; R155-F196 HydrophobicContact CG-CZ 4.34Å; L194-F196 HydrophobicContact CB-CE2 3.76Å; L194-F196 HydrophobicContact CB-CZ 3.91Å; L194-F196 HydrophobicContact CD2-CZ 4.03Å; L194-F196 WeakPolarHBondContact O-CD2 3.37Å; L194-F196 WeakPolarHBondContact O-CE2 3.48Å
197	M	84.8	Confident	83.4	Confident	35 Å²	35	33.6 Å²	33.6	17%	0.172	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	153.6	-177.8	-61.7	170.2	-75.1	0	0	109.4	C121 C122 K124 I195 H199 M276	C121-M197 WeakPolarHBondContact CA-O 3.35Å; C121-M197 WeakPolarHBondContact CB-O 3.31Å; C122-M197 HydrophobicContact CB-CB 4.21Å; C122-M197 HydrophobicContact CB-CE 4.15Å; C122-M197 PolarHBondContact N-O 3.36Å; C122-M197 PolarHBondContact O-N 3.44Å; K124-M197 HydrophobicContact CB-CE 3.7Å; I195-M197 HydrophobicContact CG2-CG 4.36Å; M197-H199 PolarHBondContact O-N 3.01Å; M197-M276 HydrophobicContact SD-CE 4.32Å
198	E	79.3	Confident	83.3	Confident	98 Å²	98	32 Å²	32	46%	0.458	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-52	137.7	173.3	-179.2	67.1	-170.5	0	0	109.5	V200 K248	E198-V200 HydrophobicContact CB-CG2 4.1Å; E198-V200 HydrophobicContact CG-CG2 4.19Å; E198-V200 WeakPolarHBondContact O-CG2 3.43Å; E198-V200 PolarHBondContact O-N 3.39Å; E198-V200 VanDerWaalsContact O-N 3.13Å; E198-K248 IonicContact OE1-NZ 2.75Å; E198-K248 PolarHBondContact OE1-NZ 2.93Å
199	H	78.5	Confident	83.3	Confident	53 Å²	53	27.8 Å²	27.8	25%	0.245	16%	0.164	C	C	.	.			trans	-70.1	110.5	168.4	171.4	-122.8	0	0	0	108.6	L113 K120 M197	L113-H199 HydrophobicContact CD1-CB 4.46Å; L113-H199 WeakPolarHBondContact CD1-CD2 3.36Å; K120-H199 HydrophobicContact CG-CB 4.28Å; K120-H199 WeakPolarHBondContact O-CB 3.33Å; M197-H199 PolarHBondContact O-N 3.01Å
200	V	70.2	Confident	83	Confident	15 Å²	15	34.6 Å²	34.6	9%	0.091	18%	0.182	C	C	.	.			trans	-120	138.7	-178.1	-137	0	0	0	0	109.6	E198 L246 M247 K248 Y274	E198-V200 HydrophobicContact CB-CG2 4.1Å; E198-V200 HydrophobicContact CG-CG2 4.19Å; E198-V200 WeakPolarHBondContact O-CG2 3.43Å; E198-V200 PolarHBondContact O-N 3.39Å; E198-V200 VanDerWaalsContact O-N 3.13Å; V200-L246 HydrophobicContact CB-CB 3.8Å; V200-L246 HydrophobicContact CB-CD1 4.03Å; V200-L246 HydrophobicContact CB-CG 4.38Å; V200-L246 HydrophobicContact CG1-CB 3.91Å; V200-L246 HydrophobicContact CG2-CB 3.76Å; V200-L246 HydrophobicContact CG2-CD1 3.36Å; V200-L246 HydrophobicContact CG2-CG 4.14Å; V200-M247 WeakPolarHBondContact CG1-O 3.22Å; V200-K248 HydrophobicContact CG1-CB 3.7Å; V200-K248 HydrophobicContact CG1-CG 4.42Å; V200-Y274 HydrophobicContact CG1-CD2 3.87Å; V200-Y274 HydrophobicContact CG1-CE2 4.11Å
201	A	67.5	Low	82.7	Confident	67 Å²	67	38.9 Å²	38.9	55%	0.554	20%	0.197	S	C	*	.	S	Bend	trans	-74.8	-35.5	-162.8	0	0	0	0	0	113.7
202	I	79.6	Confident	82.4	Confident	33 Å²	33	39 Å²	39	17%	0.169	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	149.4	-173.4	52.5	170.3	0	0	0	112	R206 L207 M247 Y249	I202-R206 HydrophobicContact CB-CB 4.15Å; I202-R206 HydrophobicContact CG2-CB 4.39Å; I202-L207 HydrophobicContact CD1-CD2 3.72Å; I202-L207 HydrophobicContact CD1-CG 4.29Å; I202-M247 HydrophobicContact CG1-CB 4.04Å; I202-M247 PolarHBondContact N-O 3.4Å; I202-M247 PolarHBondContact O-N 3Å; I202-Y249 HydrophobicContact CD1-CE2 3.65Å
203	T	78	Confident	82.2	Confident	32 Å²	32	46 Å²	46	20%	0.196	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	161.8	167.3	54.9	0	0	0	0	110.5	G205 R206 I245 L246	T203-G205 VanDerWaalsContact C-N 3.27Å; T203-G205 PolarHBondContact O-N 2.88Å; T203-R206 WeakPolarHBondContact O-CA 3.31Å; T203-R206 PolarHBondContact O-N 2.96Å; T203-I245 CarbonylContact C-O 3.6Å; T203-L246 HydrophobicContact CG2-CD2 3.94Å
204	F	79.4	Confident	82.1	Confident	9 Å²	9	48 Å²	48	4%	0.039	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-56.3	-40.4	177.4	177.8	-78.6	0	0	0	112.7	R206 L207 L218 F219 V242 I245 M247 L337 F341	F204-R206 PolarHBondContact O-N 2.83Å; F204-R206 VanDerWaalsContact O-N 3.09Å; F204-L207 HydrophobicContact CD2-CD1 4.15Å; F204-L207 HydrophobicContact CG-CD1 4.29Å; F204-L207 WeakPolarHBondContact O-CB 3.37Å; F204-L207 PolarHBondContact O-N 2.95Å; F204-L207 VanDerWaalsContact O-N 3.14Å; F204-L218 HydrophobicContact CD2-CD2 3.67Å; F204-L218 HydrophobicContact CE2-CD2 3.41Å; F204-L218 VanDerWaalsContact CE2-CD2 3.41Å; F204-L218 HydrophobicContact CE2-CG 4.28Å; F204-F219 HydrophobicContact CE2-CE1 4.2Å; F204-F219 HydrophobicContact CE2-CZ 4.44Å; F204-F219 HydrophobicContact CZ-CE1 4.34Å; F204-F219 HydrophobicContact CZ-CZ 4.39Å; F204-V242 WeakPolarHBondContact CB-O 3.27Å; F204-V242 HydrophobicContact CD1-CB 3.77Å; F204-V242 HydrophobicContact CD1-CG1 3.56Å; F204-V242 HydrophobicContact CE1-CB 4.35Å; F204-V242 HydrophobicContact CE1-CG1 3.61Å; F204-V242 HydrophobicContact CG-CB 4.49Å; F204-I245 HydrophobicContact CB-CB 3.87Å; F204-I245 HydrophobicContact CB-CG2 4.05Å; F204-I245 HydrophobicContact CD2-CB 4.44Å; F204-I245 HydrophobicContact CD2-CG2 4.09Å; F204-I245 PolarHBondContact N-O 3.14Å; F204-M247 HydrophobicContact CB-CG 4.48Å; F204-L337 HydrophobicContact CZ-CD2 4.5Å; F204-F341 HydrophobicContact CE1-CB 4.25Å; F204-F341 AromaticContact CE1-CD2 3.87Å; F204-F341 HydrophobicContact CE1-CD2 3.87Å; F204-F341 AromaticContact CE2-CD2 3.89Å; F204-F341 HydrophobicContact CE2-CD2 3.89Å; F204-F341 HydrophobicContact CZ-CB 3.74Å; F204-F341 AromaticContact CZ-CD2 3.46Å; F204-F341 HydrophobicContact CZ-CD2 3.46Å; F204-F341 VanDerWaalsContact CZ-CD2 3.46Å; F204-F341 HydrophobicContact CZ-CG 4.04Å
205	G	76.1	Confident	82	Confident	41 Å²	41	48.3 Å²	48.3	42%	0.423	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-61.2	-16.2	175.3	0	0	0	0	0	114.1	T203	T203-G205 VanDerWaalsContact C-N 3.27Å; T203-G205 PolarHBondContact O-N 2.88Å
206	R	79.5	Confident	82.2	Confident	70 Å²	70	49 Å²	49	26%	0.264	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-105.4	10.5	179.8	-68.4	-177.5	170.7	-129.9	-9	114.3	T29 I202 T203 F204 Y347	T29-R206 PolarHBondContact O-NE 3.27Å; T29-R206 PolarHBondContact O-NH1 3.25Å; T29-R206 PolarHBondContact O-NH2 3.43Å; T29-R206 VanDerWaalsContact OG1-CZ 3.28Å; T29-R206 PolarHBondContact OG1-NH1 3.02Å; T29-R206 PolarHBondContact OG1-NH2 2.8Å; I202-R206 HydrophobicContact CB-CB 4.15Å; I202-R206 HydrophobicContact CG2-CB 4.39Å; T203-R206 WeakPolarHBondContact O-CA 3.31Å; T203-R206 PolarHBondContact O-N 2.96Å; F204-R206 PolarHBondContact O-N 2.83Å; F204-R206 VanDerWaalsContact O-N 3.09Å; R206-Y347 WeakPolarHBondContact O-CD1 3.42Å; R206-Y347 WeakPolarHBondContact O-CE1 3.47Å
207	L	82.8	Confident	82.3	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.242	C	C	.	.			trans	-68	136.7	173.4	-79.1	166.3	0	0	0	110.9	I202 F204 V212 L218 M247 L271 F341 D346	I202-L207 HydrophobicContact CD1-CD2 3.72Å; I202-L207 HydrophobicContact CD1-CG 4.29Å; F204-L207 HydrophobicContact CD2-CD1 4.15Å; F204-L207 HydrophobicContact CG-CD1 4.29Å; F204-L207 WeakPolarHBondContact O-CB 3.37Å; F204-L207 PolarHBondContact O-N 2.95Å; F204-L207 VanDerWaalsContact O-N 3.14Å; L207-V212 HydrophobicContact CB-CG2 4.49Å; L207-V212 HydrophobicContact CD2-CG2 4.23Å; L207-L218 HydrophobicContact CD1-CD2 4.13Å; L207-M247 HydrophobicContact CD1-CE 3.85Å; L207-M247 HydrophobicContact CD1-CG 3.9Å; L207-M247 HydrophobicContact CD1-SD 4.49Å; L207-M247 HydrophobicContact CD2-CB 4.05Å; L207-M247 HydrophobicContact CD2-CE 4.22Å; L207-M247 HydrophobicContact CD2-CG 4.21Å; L207-M247 HydrophobicContact CG-CB 4.39Å; L207-M247 HydrophobicContact CG-CG 4.12Å; L207-L271 HydrophobicContact CD2-CD1 3.97Å; L207-L271 HydrophobicContact CD2-CD2 3.9Å; L207-F341 HydrophobicContact CD1-CE2 4.17Å; L207-D346 WeakPolarHBondContact O-CB 3.17Å
208	S	85.9	Confident	82.6	Confident	4 Å²	4	46.9 Å²	46.9	3%	0.028	24%	0.235	C	C	.	.			trans	-84.5	124.4	163.1	178.5	0	0	0	0	109.6	K210 R211 V212 D346	S208-K210 PolarHBondContact O-N 2.83Å; S208-K210 PolarHBondContact OG-N 3.29Å; S208-R211 PolarHBondContact O-N 3.33Å; S208-V212 PolarHBondContact O-N 3.33Å; S208-D346 WeakPolarHBondContact CA-OD2 3.19Å; S208-D346 PolarHBondContact OG-OD2 2.99Å
209	Y	85.6	Confident	83.3	Confident	29 Å²	29	42.2 Å²	42.2	11%	0.114	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-26.8	177.9	-72.1	3.4	0	0	0	112	R211 V212 F341 D346 A350 L352	Y209-R211 VanDerWaalsContact C-N 3.27Å; Y209-R211 PolarHBondContact O-N 3.38Å; Y209-V212 PolarHBondContact O-N 3.2Å; Y209-F341 HydrophobicContact CD1-CE1 4.31Å; Y209-F341 AromaticContact CD1-CE2 3.95Å; Y209-F341 HydrophobicContact CD1-CE2 3.95Å; Y209-F341 AromaticContact CD1-CZ 3.68Å; Y209-F341 HydrophobicContact CD1-CZ 3.68Å; Y209-F341 AromaticContact CE1-CD2 3.93Å; Y209-F341 HydrophobicContact CE1-CD2 3.93Å; Y209-F341 HydrophobicContact CE1-CE1 4.15Å; Y209-F341 AromaticContact CE1-CE2 3.52Å; Y209-F341 HydrophobicContact CE1-CE2 3.52Å; Y209-F341 HydrophobicContact CE1-CG 4.42Å; Y209-F341 AromaticContact CE1-CZ 3.63Å; Y209-F341 HydrophobicContact CE1-CZ 3.63Å; Y209-F341 HydrophobicContact CG-CZ 4.47Å; Y209-F341 PolarHBondContact OH-O 2.76Å; Y209-D346 HydrophobicContact CD1-CB 3.41Å; Y209-D346 VanDerWaalsContact CD1-CB 3.41Å; Y209-D346 HydrophobicContact CD2-CB 3.87Å; Y209-D346 HydrophobicContact CE1-CB 3.74Å; Y209-D346 HydrophobicContact CE2-CB 4.19Å; Y209-D346 HydrophobicContact CG-CB 3.49Å; Y209-D346 VanDerWaalsContact CG-CB 3.49Å; Y209-D346 PolarHBondContact N-OD2 3.41Å; Y209-A350 WeakPolarHBondContact CD2-O 3.19Å; Y209-L352 HydrophobicContact CD2-CD1 3.97Å; Y209-L352 HydrophobicContact CD2-CG 3.78Å; Y209-L352 HydrophobicContact CE2-CD1 3.64Å; Y209-L352 HydrophobicContact CE2-CG 3.96Å; Y209-L352 HydrophobicContact CG-CG 4.46Å
210	K	83.1	Confident	83.9	Confident	187 Å²	187	40.9 Å²	40.9	81%	0.813	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-32	174	-73	-173.7	177.4	176.7	0	112.9	S208	S208-K210 PolarHBondContact O-N 2.83Å; S208-K210 PolarHBondContact OG-N 3.29Å
211	R	83.1	Confident	85	Confident	111 Å²	111	40.3 Å²	40.3	42%	0.419	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-19.4	179.7	-66.2	-177.5	178.9	-93.6	11.1	112.3	E22 S208 Y209 K213 Y249	E22-R211 IonicContact OE1-CZ 2.72Å; E22-R211 IonicContact OE1-NE 3.22Å; E22-R211 IonicContact OE1-NH2 3.88Å; E22-R211 PolarHBondContact OE1-NH2 3Å; S208-R211 PolarHBondContact O-N 3.33Å; Y209-R211 VanDerWaalsContact C-N 3.27Å; Y209-R211 PolarHBondContact O-N 3.38Å; R211-K213 PolarHBondContact O-N 3.2Å; R211-K213 VanDerWaalsContact O-N 3.14Å; R211-Y249 HydrophobicContact CB-CE1 3.83Å; R211-Y249 WeakPolarHBondContact CD-OH 3.5Å
212	V	85.2	Confident	86.3	Confident	9 Å²	9	37.2 Å²	37.2	6%	0.055	18%	0.177	C	C	.	.			trans	-79.7	96.4	177	-177.5	0	0	0	0	110.5	L207 S208 Y209 P215 L271 F341	L207-V212 HydrophobicContact CB-CG2 4.49Å; L207-V212 HydrophobicContact CD2-CG2 4.23Å; S208-V212 PolarHBondContact O-N 3.33Å; Y209-V212 PolarHBondContact O-N 3.2Å; V212-P215 HydrophobicContact CG1-CB 4.01Å; V212-L271 HydrophobicContact CG2-CD2 4.2Å; V212-F341 HydrophobicContact CB-CZ 4.31Å; V212-F341 HydrophobicContact CG1-CZ 4.04Å; V212-F341 HydrophobicContact CG2-CZ 4.19Å
213	K	86.4	Confident	87	Confident	152 Å²	152	35.7 Å²	35.7	66%	0.661	17%	0.169	S	C	*	.	S	Bend	trans	-62.4	-49.7	179.7	-62.9	-178.1	-178.8	-178.9	0	111.8	R211 H269 K356	R211-K213 PolarHBondContact O-N 3.2Å; R211-K213 VanDerWaalsContact O-N 3.14Å; K213-H269 HydrophobicContact CB-CB 4.28Å; K213-K356 PolarHBondContact O-NZ 3.32Å; K213-K356 VanDerWaalsContact O-NZ 3.13Å
214	N	89.6	Confident	87.7	Confident	44 Å²	44	34.1 Å²	34.1	24%	0.235	16%	0.159	C	C	.	.			trans	-136.2	106.4	178.1	-172.3	7.8	0	0	0	111.4	E216 D217	N214-E216 VanDerWaalsContact C-N 3.28Å; N214-E216 PolarHBondContact O-N 3.33Å; N214-E216 PolarHBondContact OD1-N 3.37Å; N214-D217 VanDerWaalsContact CB-OD2 3.3Å; N214-D217 WeakPolarHBondContact CB-OD2 3.21Å; N214-D217 VanDerWaalsContact CG-OD2 3.25Å; N214-D217 PolarHBondContact ND2-OD2 3.08Å; N214-D217 PolarHBondContact O-N 2.77Å
215	P	90	Very high	88.3	Confident	5 Å²	5	35.6 Å²	35.6	3%	0.032	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-24	-178.4	28.4	-35	0	0	0	113.5	V212 D217 L218 F219 F341 L352 L360	V212-P215 HydrophobicContact CG1-CB 4.01Å; P215-D217 PolarHBondContact O-N 3.03Å; P215-L218 VanDerWaalsContact O-CB 3.31Å; P215-L218 WeakPolarHBondContact O-CB 3.23Å; P215-L218 PolarHBondContact O-N 3.31Å; P215-F219 WeakPolarHBondContact O-CD2 3.49Å; P215-F341 HydrophobicContact CB-CD1 3.93Å; P215-F341 HydrophobicContact CB-CE1 3.37Å; P215-F341 HydrophobicContact CB-CZ 3.99Å; P215-F341 HydrophobicContact CG-CE1 4.2Å; P215-L352 HydrophobicContact CG-CD2 4.42Å; P215-L360 HydrophobicContact CB-CD1 4.09Å; P215-L360 HydrophobicContact CG-CD1 3.95Å; P215-L360 HydrophobicContact CG-CD2 4.33Å; P215-L360 HydrophobicContact CG-CG 4.4Å
216	E	92.9	Very high	89.3	Confident	14 Å²	14	33.6 Å²	33.6	7%	0.065	15%	0.149	C	C	.	.	H	α-helix	trans	-60.4	-33.4	176.1	-69.7	175.6	-157.1	0	0	112.6	N214 L218 F219 K220 R359 L360 I363 L382	N214-E216 VanDerWaalsContact C-N 3.28Å; N214-E216 PolarHBondContact O-N 3.33Å; N214-E216 PolarHBondContact OD1-N 3.37Å; E216-L218 PolarHBondContact O-N 2.95Å; E216-F219 PolarHBondContact O-N 3.21Å; E216-K220 WeakPolarHBondContact O-CG 3.48Å; E216-K220 PolarHBondContact O-N 2.95Å; E216-K220 IonicContact OE2-NZ 2.71Å; E216-K220 PolarHBondContact OE2-NZ 2.96Å; E216-R359 IonicContact OE1-CZ 2.85Å; E216-R359 IonicContact OE1-NE 3.77Å; E216-R359 PolarHBondContact OE1-NE 2.96Å; E216-R359 IonicContact OE1-NH2 3.28Å; E216-R359 PolarHBondContact OE1-NH2 3.29Å; E216-R359 IonicContact OE2-NH2 2.83Å; E216-L360 HydrophobicContact CG-CD2 4.31Å; E216-I363 HydrophobicContact CG-CD1 3.94Å; E216-L382 HydrophobicContact CB-CD1 4Å; E216-L382 HydrophobicContact CG-CD1 4.34Å
217	D	90.7	Very high	90	Very high	8 Å²	8	30.3 Å²	30.3	4%	0.043	14%	0.136	C	C	.	.	H	α-helix	trans	-72.6	-18.4	-176.6	-62.1	-49.2	0	0	0	112.5	N214 P215 K220 Q221 R267 H269	N214-D217 VanDerWaalsContact CB-OD2 3.3Å; N214-D217 WeakPolarHBondContact CB-OD2 3.21Å; N214-D217 VanDerWaalsContact CG-OD2 3.25Å; N214-D217 PolarHBondContact ND2-OD2 3.08Å; N214-D217 PolarHBondContact O-N 2.77Å; P215-D217 PolarHBondContact O-N 3.03Å; D217-K220 WeakPolarHBondContact OD1-CD 3.46Å; D217-K220 IonicContact OD1-NZ 3.5Å; D217-K220 PolarHBondContact OD1-NZ 2.93Å; D217-Q221 WeakPolarHBondContact O-CG 3.46Å; D217-Q221 PolarHBondContact O-N 3.33Å; D217-Q221 PolarHBondContact O-NE2 2.77Å; D217-Q221 VanDerWaalsContact O-NE2 3.14Å; D217-R267 WeakPolarHBondContact CB-O 3.47Å; D217-H269 IonicContact OD2-CE1 3.15Å; D217-H269 PolarHBondContact OD2-CE1 3.08Å; D217-H269 IonicContact OD2-CG 2.83Å; D217-H269 IonicContact OD2-ND1 2.84Å; D217-H269 PolarHBondContact OD2-ND1 3.26Å
218	L	90.3	Very high	90.4	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.021	15%	0.146	C	C	.	.	H	α-helix	trans	-66.6	-54.1	166	170.8	51.8	0	0	0	110.3	F204 L207 P215 E216 K220 Q221 L222 M247 C273 F341	F204-L218 HydrophobicContact CD2-CD2 3.67Å; F204-L218 HydrophobicContact CE2-CD2 3.41Å; F204-L218 VanDerWaalsContact CE2-CD2 3.41Å; F204-L218 HydrophobicContact CE2-CG 4.28Å; L207-L218 HydrophobicContact CD1-CD2 4.13Å; P215-L218 VanDerWaalsContact O-CB 3.31Å; P215-L218 WeakPolarHBondContact O-CB 3.23Å; P215-L218 PolarHBondContact O-N 3.31Å; E216-L218 PolarHBondContact O-N 2.95Å; L218-K220 VanDerWaalsContact C-N 3.26Å; L218-K220 PolarHBondContact O-N 2.65Å; L218-Q221 WeakPolarHBondContact O-CB 3.31Å; L218-Q221 PolarHBondContact O-N 3.47Å; L218-Q221 VanDerWaalsContact O-N 3.09Å; L218-L222 HydrophobicContact CD1-CD1 4.17Å; L218-L222 HydrophobicContact CD1-CG 4.44Å; L218-L222 HydrophobicContact CG-CD1 4.38Å; L218-L222 PolarHBondContact O-N 2.79Å; L218-M247 HydrophobicContact CD1-CE 3.32Å; L218-M247 HydrophobicContact CD1-SD 3.53Å; L218-M247 VanDerWaalsContact CD1-SD 3.53Å; L218-M247 HydrophobicContact CD2-CE 3.87Å; L218-M247 HydrophobicContact CG-CE 4.13Å; L218-C273 HydrophobicContact CD1-CB 3.51Å; L218-C273 WeakPolarHBondContact CD1-SG 3.18Å; L218-F341 HydrophobicContact CD2-CE2 4.43Å
219	F	94	Very high	90.8	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-65.7	-29.7	-179.8	-56.5	-61.4	0	0	0	112.7	F204 P215 E216 L222 T223 L337 I338 F341 L360 L382	F204-F219 HydrophobicContact CE2-CE1 4.2Å; F204-F219 HydrophobicContact CE2-CZ 4.44Å; F204-F219 HydrophobicContact CZ-CE1 4.34Å; F204-F219 HydrophobicContact CZ-CZ 4.39Å; P215-F219 WeakPolarHBondContact O-CD2 3.49Å; E216-F219 PolarHBondContact O-N 3.21Å; F219-L222 HydrophobicContact CD1-CD1 4.15Å; F219-L222 PolarHBondContact O-N 3.27Å; F219-T223 WeakPolarHBondContact O-CB 3.33Å; F219-T223 PolarHBondContact O-N 3.41Å; F219-T223 PolarHBondContact O-OG1 3.21Å; F219-L337 HydrophobicContact CE1-CB 3.99Å; F219-I338 HydrophobicContact CB-CG1 4.36Å; F219-I338 HydrophobicContact CD1-CD1 4.49Å; F219-I338 HydrophobicContact CD1-CG1 3.53Å; F219-I338 HydrophobicContact CD2-CG1 3.87Å; F219-I338 HydrophobicContact CE1-CB 4.34Å; F219-I338 HydrophobicContact CE1-CG1 3.69Å; F219-I338 HydrophobicContact CE2-CG1 4.01Å; F219-I338 HydrophobicContact CG-CD1 4.33Å; F219-I338 HydrophobicContact CG-CG1 3.64Å; F219-I338 HydrophobicContact CZ-CB 4.3Å; F219-I338 HydrophobicContact CZ-CG1 3.92Å; F219-F341 HydrophobicContact CE2-CB 4.41Å; F219-F341 HydrophobicContact CE2-CG 4.48Å; F219-F341 HydrophobicContact CZ-CB 3.68Å; F219-F341 HydrophobicContact CZ-CG 4.03Å; F219-L360 HydrophobicContact CD2-CD2 4.04Å; F219-L360 HydrophobicContact CE2-CD1 4.29Å; F219-L360 HydrophobicContact CE2-CD2 3.87Å; F219-L382 HydrophobicContact CB-CD1 3.96Å; F219-L382 HydrophobicContact CB-CD2 3.9Å
220	K	92.5	Very high	91.3	Very high	24 Å²	24	32.9 Å²	32.9	10%	0.104	15%	0.151	C	C	.	.	H	α-helix	trans	-63.8	-45.8	170.8	-72	172.5	-165.6	143.8	0	111.8	E216 D217 L218 L222 T223 V224 L382 F383	E216-K220 WeakPolarHBondContact O-CG 3.48Å; E216-K220 PolarHBondContact O-N 2.95Å; E216-K220 IonicContact OE2-NZ 2.71Å; E216-K220 PolarHBondContact OE2-NZ 2.96Å; D217-K220 WeakPolarHBondContact OD1-CD 3.46Å; D217-K220 IonicContact OD1-NZ 3.5Å; D217-K220 PolarHBondContact OD1-NZ 2.93Å; L218-K220 VanDerWaalsContact C-N 3.26Å; L218-K220 PolarHBondContact O-N 2.65Å; K220-L222 VanDerWaalsContact C-N 3.32Å; K220-L222 PolarHBondContact O-N 2.87Å; K220-T223 PolarHBondContact O-N 3.29Å; K220-V224 WeakPolarHBondContact O-CB 3.3Å; K220-V224 WeakPolarHBondContact O-CG2 3.43Å; K220-V224 PolarHBondContact O-N 3.29Å; K220-L382 WeakPolarHBondContact CE-O 3.38Å; K220-L382 HydrophobicContact CG-CD1 3.88Å; K220-L382 HydrophobicContact CG-CG 3.85Å; K220-L382 WeakPolarHBondContact CG-O 3.42Å; K220-F383 HydrophobicContact CB-CE1 3.82Å; K220-F383 HydrophobicContact CB-CZ 3.76Å; K220-F383 HydrophobicContact CD-CE1 4.35Å; K220-F383 HydrophobicContact CG-CD1 4.19Å; K220-F383 HydrophobicContact CG-CE1 3.68Å; K220-F383 HydrophobicContact CG-CE2 4.25Å; K220-F383 HydrophobicContact CG-CZ 3.72Å
221	Q	92.7	Very high	91.6	Very high	4 Å²	4	27.5 Å²	27.5	2%	0.019	13%	0.127	C	C	.	.	H	α-helix	trans	-61.1	-43.2	177.6	-72.9	176	72	0	0	111.3	D217 L218 T225 T255 Y257 L271 C273	D217-Q221 WeakPolarHBondContact O-CG 3.46Å; D217-Q221 PolarHBondContact O-N 3.33Å; D217-Q221 PolarHBondContact O-NE2 2.77Å; D217-Q221 VanDerWaalsContact O-NE2 3.14Å; L218-Q221 WeakPolarHBondContact O-CB 3.31Å; L218-Q221 PolarHBondContact O-N 3.47Å; L218-Q221 VanDerWaalsContact O-N 3.09Å; Q221-T225 WeakPolarHBondContact O-CB 3.37Å; Q221-T225 PolarHBondContact O-N 3.16Å; Q221-T225 PolarHBondContact O-OG1 2.98Å; Q221-T255 HydrophobicContact CG-CG2 4.27Å; Q221-Y257 WeakPolarHBondContact CA-OH 3.34Å; Q221-Y257 WeakPolarHBondContact CB-OH 3.33Å; Q221-Y257 WeakPolarHBondContact CG-OH 3.35Å; Q221-L271 PolarHBondContact NE2-O 2.83Å; Q221-C273 HydrophobicContact CB-CB 4.18Å
222	L	94	Very high	92	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.01	14%	0.138	C	C	.	.	H	α-helix	trans	-61.3	-53.5	175.5	-73.8	169.3	0	0	0	111.9	L218 F219 K220 V224 T225 L226 I245 C273 I275 L337	L218-L222 HydrophobicContact CD1-CD1 4.17Å; L218-L222 HydrophobicContact CD1-CG 4.44Å; L218-L222 HydrophobicContact CG-CD1 4.38Å; L218-L222 PolarHBondContact O-N 2.79Å; F219-L222 HydrophobicContact CD1-CD1 4.15Å; F219-L222 PolarHBondContact O-N 3.27Å; K220-L222 VanDerWaalsContact C-N 3.32Å; K220-L222 PolarHBondContact O-N 2.87Å; L222-V224 VanDerWaalsContact C-N 3.33Å; L222-V224 PolarHBondContact O-N 3.07Å; L222-T225 PolarHBondContact O-N 2.91Å; L222-L226 WeakPolarHBondContact O-CG 3.23Å; L222-L226 PolarHBondContact O-N 3.18Å; L222-I245 HydrophobicContact CD2-CD1 3.51Å; L222-I245 HydrophobicContact CD2-CG1 4.38Å; L222-I245 HydrophobicContact CD2-CG2 4.46Å; L222-C273 WeakPolarHBondContact CD2-SG 3.46Å; L222-C273 VanDerWaalsContact CG-SG 3.57Å; L222-I275 HydrophobicContact CD2-CD1 4.13Å; L222-I275 HydrophobicContact CD2-CG1 3.81Å; L222-L337 HydrophobicContact CD1-CD1 3.87Å
223	T	95	Very high	92.4	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-61.8	-41.2	-176.9	-53.1	0	0	0	0	111.7	F219 K220 L226 Y227 I334 T376 L377 F383	F219-T223 WeakPolarHBondContact O-CB 3.33Å; F219-T223 PolarHBondContact O-N 3.41Å; F219-T223 PolarHBondContact O-OG1 3.21Å; K220-T223 PolarHBondContact O-N 3.29Å; T223-L226 PolarHBondContact O-N 3.47Å; T223-Y227 VanDerWaalsContact O-CB 3.26Å; T223-Y227 WeakPolarHBondContact O-CB 3.27Å; T223-Y227 PolarHBondContact O-N 3.24Å; T223-I334 HydrophobicContact CG2-CD1 4.24Å; T223-T376 HydrophobicContact CG2-CG2 3.65Å; T223-L377 HydrophobicContact CG2-CD1 4.43Å; T223-L377 HydrophobicContact CG2-CG 4.02Å; T223-F383 HydrophobicContact CG2-CE2 3.86Å; T223-F383 HydrophobicContact CG2-CZ 4.27Å
224	V	92.3	Very high	92.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-66.4	-42	178.3	171.2	0	0	0	0	111.1	K220 L222 Y227 I228 Y257 I259 Y264 L377 F383	K220-V224 WeakPolarHBondContact O-CB 3.3Å; K220-V224 WeakPolarHBondContact O-CG2 3.43Å; K220-V224 PolarHBondContact O-N 3.29Å; L222-V224 VanDerWaalsContact C-N 3.33Å; L222-V224 PolarHBondContact O-N 3.07Å; V224-Y227 PolarHBondContact O-N 2.87Å; V224-I228 HydrophobicContact CG1-CD1 4.01Å; V224-I228 WeakPolarHBondContact O-CD1 3.35Å; V224-I228 VanDerWaalsContact O-CG1 3.27Å; V224-I228 WeakPolarHBondContact O-CG1 3.23Å; V224-I228 PolarHBondContact O-N 2.93Å; V224-Y257 HydrophobicContact CB-CE2 4.5Å; V224-Y257 HydrophobicContact CG1-CD1 3.73Å; V224-Y257 HydrophobicContact CG1-CD2 3.73Å; V224-Y257 HydrophobicContact CG1-CE1 3.99Å; V224-Y257 HydrophobicContact CG1-CE2 3.97Å; V224-Y257 HydrophobicContact CG1-CG 3.59Å; V224-I259 HydrophobicContact CG1-CD1 3.84Å; V224-Y264 HydrophobicContact CB-CE1 4.48Å; V224-Y264 HydrophobicContact CG1-CD1 3.97Å; V224-Y264 HydrophobicContact CG1-CE1 4.27Å; V224-Y264 HydrophobicContact CG2-CD1 4.04Å; V224-Y264 HydrophobicContact CG2-CE1 3.57Å; V224-L377 HydrophobicContact CG2-CD2 3.93Å; V224-F383 HydrophobicContact CG2-CE1 3.71Å; V224-F383 HydrophobicContact CG2-CZ 3.76Å
225	T	93.4	Very high	93.2	Very high	39 Å²	39	26.3 Å²	26.3	24%	0.239	12%	0.122	C	C	.	.	H	α-helix	trans	-60.7	-50.8	176.2	-57.8	0	0	0	0	110.5	Q221 L222 Y227 I228 L229 I275	Q221-T225 WeakPolarHBondContact O-CB 3.37Å; Q221-T225 PolarHBondContact O-N 3.16Å; Q221-T225 PolarHBondContact O-OG1 2.98Å; L222-T225 PolarHBondContact O-N 2.91Å; T225-Y227 VanDerWaalsContact C-N 3.35Å; T225-Y227 PolarHBondContact O-N 2.66Å; T225-I228 PolarHBondContact O-N 3.41Å; T225-L229 HydrophobicContact CG2-CD1 4.16Å; T225-L229 WeakPolarHBondContact O-CG 3.4Å; T225-L229 PolarHBondContact O-N 2.85Å; T225-I275 HydrophobicContact CG2-CD1 4.01Å
226	L	95.9	Very high	93.5	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-61.7	-40.5	178.5	-71	167.8	0	0	0	112.3	L222 T223 I228 L229 E230 F235 L240 I275 N330 I334 S373	L222-L226 WeakPolarHBondContact O-CG 3.23Å; L222-L226 PolarHBondContact O-N 3.18Å; T223-L226 PolarHBondContact O-N 3.47Å; L226-I228 VanDerWaalsContact C-N 3.35Å; L226-I228 PolarHBondContact O-N 3.12Å; L226-L229 PolarHBondContact O-N 3.12Å; L226-E230 WeakPolarHBondContact O-CB 3.21Å; L226-E230 VanDerWaalsContact O-CG 3.31Å; L226-E230 WeakPolarHBondContact O-CG 3.46Å; L226-E230 PolarHBondContact O-N 3.3Å; L226-F235 HydrophobicContact CD2-CD1 4.25Å; L226-F235 HydrophobicContact CD2-CE1 4.04Å; L226-L240 HydrophobicContact CD1-CD2 3.88Å; L226-L240 HydrophobicContact CD2-CD2 4.46Å; L226-I275 HydrophobicContact CD2-CD1 3.88Å; L226-I275 HydrophobicContact CG-CD1 3.95Å; L226-N330 HydrophobicContact CD1-CB 4.34Å; L226-I334 HydrophobicContact CD1-CD1 3.79Å; L226-I334 HydrophobicContact CD1-CG1 3.75Å; L226-S373 WeakPolarHBondContact CB-OG 3.4Å
227	Y	94.4	Very high	93.6	Very high	1 Å²	1	25.4 Å²	25.4	0%	0.004	12%	0.118	C	C	.	.	H	α-helix	trans	-58.4	-43.7	174.1	165	-116.2	0	0	0	113.1	T223 V224 T225 L229 E230 K231 I259 E374 L377 I393	T223-Y227 VanDerWaalsContact O-CB 3.26Å; T223-Y227 WeakPolarHBondContact O-CB 3.27Å; T223-Y227 PolarHBondContact O-N 3.24Å; V224-Y227 PolarHBondContact O-N 2.87Å; T225-Y227 VanDerWaalsContact C-N 3.35Å; T225-Y227 PolarHBondContact O-N 2.66Å; Y227-L229 VanDerWaalsContact C-N 3.32Å; Y227-L229 PolarHBondContact O-N 2.83Å; Y227-E230 PolarHBondContact O-N 3.37Å; Y227-K231 HydrophobicContact CD2-CG 3.95Å; Y227-K231 HydrophobicContact CE2-CD 4.16Å; Y227-K231 VanDerWaalsContact CE2-CE 3.42Å; Y227-K231 HydrophobicContact CE2-CG 3.56Å; Y227-K231 WeakPolarHBondContact O-CB 3.5Å; Y227-K231 WeakPolarHBondContact O-CG 3.46Å; Y227-K231 PolarHBondContact O-N 3.04Å; Y227-I259 HydrophobicContact CD1-CD1 4.37Å; Y227-I259 HydrophobicContact CD1-CG2 4.22Å; Y227-I259 HydrophobicContact CE1-CD1 4.33Å; Y227-I259 HydrophobicContact CE1-CG2 3.43Å; Y227-I259 VanDerWaalsContact CE1-CG2 3.43Å; Y227-E374 HydrophobicContact CD2-CB 3.62Å; Y227-E374 HydrophobicContact CD2-CG 4.25Å; Y227-E374 HydrophobicContact CE2-CB 3.64Å; Y227-E374 HydrophobicContact CE2-CG 3.76Å; Y227-L377 HydrophobicContact CD1-CD1 3.45Å; Y227-L377 VanDerWaalsContact CD1-CD1 3.45Å; Y227-L377 HydrophobicContact CD2-CD1 3.96Å; Y227-L377 HydrophobicContact CE1-CD1 4.17Å; Y227-L377 HydrophobicContact CG-CD1 3.31Å; Y227-I393 HydrophobicContact CE1-CD1 3.7Å
228	I	91.4	Very high	93.8	Very high	41 Å²	41	25 Å²	25	21%	0.21	12%	0.116	C	C	.	.	H	α-helix	trans	-62.3	-44.3	176.9	-67.9	163.2	0	0	0	110.3	V224 T225 L226 K231 K232 Y257 I259	V224-I228 HydrophobicContact CG1-CD1 4.01Å; V224-I228 WeakPolarHBondContact O-CD1 3.35Å; V224-I228 VanDerWaalsContact O-CG1 3.27Å; V224-I228 WeakPolarHBondContact O-CG1 3.23Å; V224-I228 PolarHBondContact O-N 2.93Å; T225-I228 PolarHBondContact O-N 3.41Å; L226-I228 VanDerWaalsContact C-N 3.35Å; L226-I228 PolarHBondContact O-N 3.12Å; I228-K231 PolarHBondContact O-N 2.89Å; I228-K232 VanDerWaalsContact O-CB 3.31Å; I228-K232 WeakPolarHBondContact O-CB 3.4Å; I228-K232 PolarHBondContact O-N 2.71Å; I228-Y257 HydrophobicContact CD1-CD1 3.79Å; I228-Y257 HydrophobicContact CD1-CG 4.25Å; I228-I259 HydrophobicContact CD1-CD1 3.95Å; I228-I259 HydrophobicContact CD1-CG1 3.76Å; I228-I259 HydrophobicContact CG1-CD1 4.01Å; I228-I259 HydrophobicContact CG1-CG1 3.79Å; I228-I259 HydrophobicContact CG1-CG2 4.45Å
229	L	93.8	Very high	93.9	Very high	38 Å²	38	25.8 Å²	25.8	20%	0.199	12%	0.12	C	C	.	.	H	α-helix	trans	-67.9	-42	179.9	-63.3	175.1	0	0	0	111.8	T225 L226 Y227 K231 K232 F233 K234 F235	T225-L229 HydrophobicContact CG2-CD1 4.16Å; T225-L229 WeakPolarHBondContact O-CG 3.4Å; T225-L229 PolarHBondContact O-N 2.85Å; L226-L229 PolarHBondContact O-N 3.12Å; Y227-L229 VanDerWaalsContact C-N 3.32Å; Y227-L229 PolarHBondContact O-N 2.83Å; L229-K231 VanDerWaalsContact C-N 3.35Å; L229-K231 PolarHBondContact O-N 3.32Å; L229-K232 PolarHBondContact O-N 3.39Å; L229-F233 HydrophobicContact CD2-CD2 3.97Å; L229-F233 HydrophobicContact CD2-CE2 4.1Å; L229-F233 WeakPolarHBondContact O-CA 3.47Å; L229-F233 PolarHBondContact O-N 3.28Å; L229-K234 PolarHBondContact O-N 2.96Å; L229-F235 VanDerWaalsContact C-CB 3.47Å; L229-F235 HydrophobicContact CB-CB 3.55Å; L229-F235 HydrophobicContact CB-CD1 3.77Å; L229-F235 HydrophobicContact CB-CG 3.71Å; L229-F235 HydrophobicContact CD1-CD1 3.88Å; L229-F235 HydrophobicContact CD1-CE1 3.94Å; L229-F235 HydrophobicContact CD1-CG 4.25Å; L229-F235 HydrophobicContact CD1-CZ 4.39Å; L229-F235 HydrophobicContact CG-CD1 4.47Å; L229-F235 WeakPolarHBondContact O-CB 3.46Å; L229-F235 PolarHBondContact O-N 3.05Å
230	E	95.5	Very high	93.9	Very high	8 Å²	8	25.8 Å²	25.8	4%	0.037	12%	0.12	C	C	.	.	H	α-helix	trans	-55.4	-49.6	172.1	-79.7	172.8	-167.1	0	0	110.8	L226 Y227 K234 F235 P327 N330 S373	L226-E230 WeakPolarHBondContact O-CB 3.21Å; L226-E230 VanDerWaalsContact O-CG 3.31Å; L226-E230 WeakPolarHBondContact O-CG 3.46Å; L226-E230 PolarHBondContact O-N 3.3Å; Y227-E230 PolarHBondContact O-N 3.37Å; E230-K234 WeakPolarHBondContact O-CA 3.39Å; E230-K234 PolarHBondContact O-N 3.26Å; E230-F235 WeakPolarHBondContact CG-O 3.35Å; E230-P327 HydrophobicContact CG-CB 4.12Å; E230-N330 WeakPolarHBondContact CG-ND2 3.24Å; E230-N330 WeakPolarHBondContact OE1-CB 3.31Å; E230-N330 PolarHBondContact OE1-ND2 3.49Å; E230-S373 VanDerWaalsContact OE1-CB 3.25Å; E230-S373 WeakPolarHBondContact OE1-CB 3.49Å; E230-S373 PolarHBondContact OE1-N 2.56Å; E230-S373 VanDerWaalsContact OE1-N 3.14Å; E230-S373 PolarHBondContact OE1-OG 3.22Å; E230-S373 WeakPolarHBondContact OE2-CB 3.36Å; E230-S373 PolarHBondContact OE2-N 2.89Å
231	K	90.7	Very high	93.9	Very high	73 Å²	73	25.7 Å²	25.7	32%	0.317	12%	0.12	S	C	.	.	H	α-helix	trans	-67.3	-39.5	-178	-75.4	-67.4	-178.9	-174.8	0	113.3	Y227 I228 L229 E374	Y227-K231 HydrophobicContact CD2-CG 3.95Å; Y227-K231 HydrophobicContact CE2-CD 4.16Å; Y227-K231 VanDerWaalsContact CE2-CE 3.42Å; Y227-K231 HydrophobicContact CE2-CG 3.56Å; Y227-K231 WeakPolarHBondContact O-CB 3.5Å; Y227-K231 WeakPolarHBondContact O-CG 3.46Å; Y227-K231 PolarHBondContact O-N 3.04Å; I228-K231 PolarHBondContact O-N 2.89Å; L229-K231 VanDerWaalsContact C-N 3.35Å; L229-K231 PolarHBondContact O-N 3.32Å; K231-E374 WeakPolarHBondContact CE-OE1 3.39Å; K231-E374 WeakPolarHBondContact CE-OE2 3.33Å; K231-E374 IonicContact NZ-OE1 2.73Å; K231-E374 PolarHBondContact NZ-OE1 3.2Å; K231-E374 IonicContact NZ-OE2 2.8Å; K231-E374 PolarHBondContact NZ-OE2 3.33Å
232	K	90.6	Very high	93.7	Very high	149 Å²	149	26.5 Å²	26.5	65%	0.648	13%	0.125	S	C	*	.	H	α-helix	trans	-85.4	-34.1	-173.3	-168.2	173.2	174.2	-173.7	0	112.8	I228 L229	I228-K232 VanDerWaalsContact O-CB 3.31Å; I228-K232 WeakPolarHBondContact O-CB 3.4Å; I228-K232 PolarHBondContact O-N 2.71Å; L229-K232 PolarHBondContact O-N 3.39Å
233	F	93.5	Very high	93.3	Very high	50 Å²	50	27 Å²	27	22%	0.219	13%	0.131	C	C	.	.	H	α-helix	trans	-133.6	7.5	-168.1	-52.5	-65.2	0	0	0	113.6	L229 F235 F283 E284 I285	L229-F233 HydrophobicContact CD2-CD2 3.97Å; L229-F233 HydrophobicContact CD2-CE2 4.1Å; L229-F233 WeakPolarHBondContact O-CA 3.47Å; L229-F233 PolarHBondContact O-N 3.28Å; F233-F235 HydrophobicContact CB-CB 4.39Å; F233-F235 PolarHBondContact O-N 2.97Å; F233-F235 VanDerWaalsContact O-N 3.16Å; F233-F283 HydrophobicContact CB-CB 4.11Å; F233-F283 CarbonylContact O-C 3.29Å; F233-F283 WeakPolarHBondContact O-CA 3.28Å; F233-F283 WeakPolarHBondContact O-CB 3.45Å; F233-E284 WeakPolarHBondContact CA-O 3.19Å; F233-E284 PolarHBondContact O-N 3.34Å; F233-I285 HydrophobicContact CD1-CG1 4.14Å; F233-I285 HydrophobicContact CE1-CG1 4.4Å
234	K	96.3	Very high	93	Very high	89 Å²	89	27.2 Å²	27.2	39%	0.387	13%	0.132	S	C	.	.			trans	46.6	46.1	-170.3	-62.6	-173.4	-164	153.1	0	111.3	L229 E230 R282 E284 Y325	L229-K234 PolarHBondContact O-N 2.96Å; E230-K234 WeakPolarHBondContact O-CA 3.39Å; E230-K234 PolarHBondContact O-N 3.26Å; K234-R282 PolarHBondContact O-NH1 3.26Å; K234-E284 WeakPolarHBondContact CD-OE1 3.36Å; K234-E284 WeakPolarHBondContact CD-OE2 3.03Å; K234-E284 WeakPolarHBondContact CE-OE2 3.33Å; K234-E284 IonicContact NZ-OE1 2.63Å; K234-E284 PolarHBondContact NZ-OE1 3.41Å; K234-E284 IonicContact NZ-OE2 3.57Å; K234-E284 PolarHBondContact NZ-OE2 3.42Å; K234-Y325 HydrophobicContact CB-CD1 4.1Å; K234-Y325 HydrophobicContact CB-CD2 3.81Å; K234-Y325 HydrophobicContact CB-CE1 4.01Å; K234-Y325 HydrophobicContact CB-CE2 3.75Å; K234-Y325 HydrophobicContact CB-CG 3.99Å; K234-Y325 HydrophobicContact CD-CD1 3.9Å; K234-Y325 HydrophobicContact CD-CE1 4.22Å; K234-Y325 HydrophobicContact CD-CG 4.23Å; K234-Y325 HydrophobicContact CG-CD1 4.14Å; K234-Y325 HydrophobicContact CG-CE1 3.98Å; K234-Y325 HydrophobicContact CG-CG 4.49Å; K234-Y325 VanDerWaalsContact O-CD2 3.28Å; K234-Y325 WeakPolarHBondContact O-CD2 3.39Å; K234-Y325 VanDerWaalsContact O-CE2 3.25Å; K234-Y325 WeakPolarHBondContact O-CE2 3.35Å
235	F	96.8	Very high	92.8	Very high	3 Å²	3	27.2 Å²	27.2	1%	0.013	13%	0.132	C	C	.	.			trans	-76.7	141	-171.4	-178.8	-91.8	0	0	0	112.5	I151 L226 L229 E230 F233 H237 Y278 R282 F283 N330	I151-F235 HydrophobicContact CD1-CE2 4.11Å; L226-F235 HydrophobicContact CD2-CD1 4.25Å; L226-F235 HydrophobicContact CD2-CE1 4.04Å; L229-F235 VanDerWaalsContact C-CB 3.47Å; L229-F235 HydrophobicContact CB-CB 3.55Å; L229-F235 HydrophobicContact CB-CD1 3.77Å; L229-F235 HydrophobicContact CB-CG 3.71Å; L229-F235 HydrophobicContact CD1-CD1 3.88Å; L229-F235 HydrophobicContact CD1-CE1 3.94Å; L229-F235 HydrophobicContact CD1-CG 4.25Å; L229-F235 HydrophobicContact CD1-CZ 4.39Å; L229-F235 HydrophobicContact CG-CD1 4.47Å; L229-F235 WeakPolarHBondContact O-CB 3.46Å; L229-F235 PolarHBondContact O-N 3.05Å; E230-F235 WeakPolarHBondContact CG-O 3.35Å; F233-F235 HydrophobicContact CB-CB 4.39Å; F233-F235 PolarHBondContact O-N 2.97Å; F233-F235 VanDerWaalsContact O-N 3.16Å; F235-H237 HydrophobicContact CE1-CB 3.85Å; F235-H237 HydrophobicContact CZ-CB 4.19Å; F235-H237 AromaticContact CZ-CD2 3.87Å; F235-Y278 HydrophobicContact CE2-CD1 4.46Å; F235-Y278 HydrophobicContact CZ-CD1 4.07Å; F235-Y278 HydrophobicContact CZ-CE1 4.46Å; F235-R282 CarbonylContact C-O 3.46Å; F235-R282 VanDerWaalsContact CA-O 3.29Å; F235-R282 WeakPolarHBondContact CA-O 3.36Å; F235-F283 HydrophobicContact CB-CB 4.28Å; F235-F283 HydrophobicContact CD2-CB 3.82Å; F235-F283 AromaticContact CD2-CD1 3.89Å; F235-F283 HydrophobicContact CD2-CD1 3.89Å; F235-F283 HydrophobicContact CD2-CG 4.13Å; F235-F283 HydrophobicContact CE2-CD1 4.01Å; F235-F283 HydrophobicContact CG-CB 4.5Å; F235-N330 PolarHBondContact O-ND2 3.26Å
236	E	97.6	Very high	92.4	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.126	C	C	.	.	B	Isolated β-bridge	trans	-132.7	131.2	165.3	-63	173.1	-124.9	0	0	108.7	R238 S281 R282 Y325 N326 T329 N330	E236-R238 HydrophobicContact CB-CG 3.87Å; E236-R238 IonicContact OE1-NH2 3.58Å; E236-R238 PolarHBondContact OE1-NH2 3.36Å; E236-R238 IonicContact OE2-CZ 2.74Å; E236-R238 IonicContact OE2-NE 3.37Å; E236-R238 PolarHBondContact OE2-NE 3.06Å; E236-R238 IonicContact OE2-NH2 3.31Å; E236-R238 PolarHBondContact OE2-NH2 2.9Å; E236-R238 VanDerWaalsContact OE2-NH2 3.16Å; E236-S281 CarbonylContact O-C 3.56Å; E236-S281 VanDerWaalsContact O-CA 3.23Å; E236-S281 WeakPolarHBondContact O-CA 3.48Å; E236-S281 WeakPolarHBondContact O-CB 3.38Å; E236-R282 HydrophobicContact CB-CB 4.38Å; E236-R282 PolarHBondContact N-O 3.18Å; E236-R282 PolarHBondContact O-N 2.94Å; E236-R282 IonicContact OE1-NE 3.12Å; E236-Y325 HydrophobicContact CG-CD2 4.18Å; E236-Y325 HydrophobicContact CG-CE2 4.19Å; E236-Y325 WeakPolarHBondContact OE1-CA 3.41Å; E236-Y325 WeakPolarHBondContact OE1-CD2 3.5Å; E236-N326 VanDerWaalsContact CD-O 3.31Å; E236-N326 PolarHBondContact OE1-N 3.37Å; E236-T329 WeakPolarHBondContact CB-OG1 3.47Å; E236-T329 VanDerWaalsContact CD-OG1 3.26Å; E236-T329 VanDerWaalsContact CG-OG1 3.25Å; E236-T329 WeakPolarHBondContact CG-OG1 3.24Å; E236-T329 WeakPolarHBondContact OE2-CB 3.38Å; E236-T329 WeakPolarHBondContact OE2-CG2 3.19Å; E236-T329 PolarHBondContact OE2-OG1 2.93Å; E236-N330 VanDerWaalsContact CA-OD1 3.3Å; E236-N330 WeakPolarHBondContact CA-OD1 2.97Å
237	H	95.1	Very high	91.9	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.126	C	C	.	.			trans	-75.8	-43.3	179.4	-164.2	-86.5	0	0	0	112.8	F235 D239 L240 I275 M276 D277 Y278 S281 N330	F235-H237 HydrophobicContact CE1-CB 3.85Å; F235-H237 HydrophobicContact CZ-CB 4.19Å; F235-H237 AromaticContact CZ-CD2 3.87Å; H237-D239 PolarHBondContact CE1-O 2.93Å; H237-D239 PolarHBondContact ND1-N 2.96Å; H237-D239 PolarHBondContact ND1-O 3.25Å; H237-D239 PolarHBondContact O-N 3.32Å; H237-L240 HydrophobicContact CB-CB 4.01Å; H237-L240 HydrophobicContact CB-CD1 4.34Å; H237-L240 WeakPolarHBondContact ND1-CA 3.48Å; H237-L240 PolarHBondContact ND1-N 3.27Å; H237-I275 WeakPolarHBondContact CD2-CG2 3.48Å; H237-I275 WeakPolarHBondContact NE2-CG2 3.31Å; H237-M276 PolarHBondContact CE1-O 2.75Å; H237-M276 VanDerWaalsContact CE1-O 3.26Å; H237-M276 PolarHBondContact NE2-O 2.82Å; H237-D277 PolarHBondContact CE1-O 3.03Å; H237-D277 PolarHBondContact NE2-O 3.13Å; H237-Y278 AromaticContact CD2-CD1 3.78Å; H237-Y278 AromaticContact NE2-CD1 3.58Å; H237-Y278 AromaticContact NE2-CE1 3.93Å; H237-S281 WeakPolarHBondContact CA-OG 3.25Å; H237-S281 VanDerWaalsContact O-CA 3.27Å; H237-S281 WeakPolarHBondContact O-CA 3.29Å; H237-S281 PolarHBondContact O-N 2.88Å; H237-S281 PolarHBondContact O-OG 2.74Å; H237-N330 PolarHBondContact N-OD1 3.11Å
238	R	94.6	Very high	91.5	Very high	1 Å²	1	29.6 Å²	29.6	0%	0.004	14%	0.14	C	C	.	.	S	Bend	trans	60.7	-7.1	-179.3	-56.8	-174.7	173.7	169.4	-0.9	117.5	E236 L280 M314 W322 G324 W333	E236-R238 HydrophobicContact CB-CG 3.87Å; E236-R238 IonicContact OE1-NH2 3.58Å; E236-R238 PolarHBondContact OE1-NH2 3.36Å; E236-R238 IonicContact OE2-CZ 2.74Å; E236-R238 IonicContact OE2-NE 3.37Å; E236-R238 PolarHBondContact OE2-NE 3.06Å; E236-R238 IonicContact OE2-NH2 3.31Å; E236-R238 PolarHBondContact OE2-NH2 2.9Å; E236-R238 VanDerWaalsContact OE2-NH2 3.16Å; R238-L280 HydrophobicContact CB-CB 4.39Å; R238-L280 WeakPolarHBondContact CB-O 3.08Å; R238-L280 WeakPolarHBondContact CD-O 3.09Å; R238-M314 HydrophobicContact CB-SD 4.07Å; R238-M314 HydrophobicContact CG-SD 4.47Å; R238-M314 WeakPolarHBondContact O-CE 3.2Å; R238-W322 PolarHBondContact NH1-O 2.87Å; R238-W322 PolarHBondContact NH2-O 2.72Å; R238-G324 PolarHBondContact NH2-O 2.8Å; R238-W333 WeakPolarHBondContact O-CZ2 3.46Å; R238-W333 PolarHBondContact O-NE1 2.82Å; R238-W333 VanDerWaalsContact O-NE1 3.12Å
239	D	92.7	Very high	91.2	Very high	20 Å²	20	30.8 Å²	30.8	11%	0.107	14%	0.142	C	C	.	.			trans	-140.7	48.5	171.1	-163.9	30.3	0	0	0	113.8	H237 H241 N244 L280 H307 W333	H237-D239 PolarHBondContact CE1-O 2.93Å; H237-D239 PolarHBondContact ND1-N 2.96Å; H237-D239 PolarHBondContact ND1-O 3.25Å; H237-D239 PolarHBondContact O-N 3.32Å; D239-H241 VanDerWaalsContact C-N 3.26Å; D239-H241 PolarHBondContact O-CD2 3.1Å; D239-H241 PolarHBondContact O-N 2.95Å; D239-H241 VanDerWaalsContact O-N 3.09Å; D239-H241 IonicContact OD1-CD2 2.98Å; D239-H241 PolarHBondContact OD1-CD2 3.11Å; D239-H241 IonicContact OD2-CD2 3.29Å; D239-H241 IonicContact OD2-NE2 2.96Å; D239-N244 PolarHBondContact O-ND2 2.81Å; D239-L280 HydrophobicContact CB-CB 4.05Å; D239-L280 HydrophobicContact CB-CD1 3.93Å; D239-L280 HydrophobicContact CB-CG 4.26Å; D239-H307 IonicContact OD1-CD2 3.6Å; D239-H307 IonicContact OD1-NE2 3.44Å; D239-W333 VanDerWaalsContact CA-CZ2 3.49Å
240	L	93.3	Very high	90.8	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	14%	0.142	C	C	.	.			trans	-90.2	53.7	-170.1	-164.9	71.1	0	0	0	112.2	L226 H237 I245 I275 W333 L337	L226-L240 HydrophobicContact CD1-CD2 3.88Å; L226-L240 HydrophobicContact CD2-CD2 4.46Å; H237-L240 HydrophobicContact CB-CB 4.01Å; H237-L240 HydrophobicContact CB-CD1 4.34Å; H237-L240 WeakPolarHBondContact ND1-CA 3.48Å; H237-L240 PolarHBondContact ND1-N 3.27Å; L240-I245 HydrophobicContact CD1-CD1 3.42Å; L240-I245 VanDerWaalsContact CD1-CD1 3.42Å; L240-I245 HydrophobicContact CD2-CD1 4.33Å; L240-I245 HydrophobicContact CG-CD1 3.77Å; L240-I275 HydrophobicContact CD1-CB 4.26Å; L240-I275 HydrophobicContact CD1-CD1 4.31Å; L240-I275 HydrophobicContact CD1-CG1 4.09Å; L240-I275 HydrophobicContact CD1-CG2 3.37Å; L240-I275 HydrophobicContact CD2-CD1 4.49Å; L240-W333 HydrophobicContact CB-CB 3.81Å; L240-W333 HydrophobicContact CB-CD2 3.9Å; L240-W333 HydrophobicContact CB-CE3 4.17Å; L240-W333 HydrophobicContact CB-CG 3.73Å; L240-W333 HydrophobicContact CD2-CB 4.3Å; L240-W333 VanDerWaalsContact N-CD2 3.31Å; L240-W333 VanDerWaalsContact N-CE2 3.33Å; L240-L337 HydrophobicContact CD2-CD1 4.05Å; L240-L337 HydrophobicContact CG-CD1 4.09Å
241	H	91.3	Very high	90.4	Very high	21 Å²	21	38.1 Å²	38.1	10%	0.097	17%	0.17	C	C	.	.			trans	-74.7	174.4	177.8	66.6	96	0	0	0	112.1	D239 G243 N244 H307 W333 Y336	D239-H241 VanDerWaalsContact C-N 3.26Å; D239-H241 PolarHBondContact O-CD2 3.1Å; D239-H241 PolarHBondContact O-N 2.95Å; D239-H241 VanDerWaalsContact O-N 3.09Å; D239-H241 IonicContact OD1-CD2 2.98Å; D239-H241 PolarHBondContact OD1-CD2 3.11Å; D239-H241 IonicContact OD2-CD2 3.29Å; D239-H241 IonicContact OD2-NE2 2.96Å; H241-G243 PolarHBondContact ND1-N 2.88Å; H241-G243 VanDerWaalsContact ND1-N 3.13Å; H241-G243 PolarHBondContact O-N 2.84Å; H241-G243 VanDerWaalsContact O-N 3.1Å; H241-N244 PolarHBondContact CD2-ND2 2.93Å; H241-N244 VanDerWaalsContact CD2-ND2 3.3Å; H241-N244 PolarHBondContact NE2-ND2 2.83Å; H241-N244 PolarHBondContact O-N 3.33Å; H241-H307 HydrophobicContact CB-CB 4.49Å; H241-H307 AromaticContact CD2-CE1 3.61Å; H241-H307 AromaticContact CD2-NE2 3.38Å; H241-H307 PolarHBondContact CD2-NE2 2.83Å; H241-H307 AromaticContact CG-CE1 3.38Å; H241-H307 AromaticContact CG-ND1 3.88Å; H241-H307 AromaticContact CG-NE2 3.53Å; H241-H307 AromaticContact ND1-CE1 3.62Å; H241-W333 HydrophobicContact CB-CH2 4.15Å; H241-W333 HydrophobicContact CB-CZ3 3.76Å; H241-Y336 HydrophobicContact CB-CE1 4.15Å
242	V	89.8	Confident	90.2	Very high	21 Å²	21	39.3 Å²	39.3	13%	0.127	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-60.3	-22.7	-176.9	-63.9	0	0	0	0	113.9	F204 Y336 L337 A340	F204-V242 WeakPolarHBondContact CB-O 3.27Å; F204-V242 HydrophobicContact CD1-CB 3.77Å; F204-V242 HydrophobicContact CD1-CG1 3.56Å; F204-V242 HydrophobicContact CE1-CB 4.35Å; F204-V242 HydrophobicContact CE1-CG1 3.61Å; F204-V242 HydrophobicContact CG-CB 4.49Å; V242-Y336 HydrophobicContact CG1-CE1 4.17Å; V242-L337 HydrophobicContact CG1-CD2 3.99Å; V242-A340 HydrophobicContact CG1-CB 3.83Å
243	G	85.1	Confident	90.2	Very high	13 Å²	13	41 Å²	41	13%	0.134	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-72.5	-31.8	174.9	0	0	0	0	0	112.5	H241 I245	H241-G243 PolarHBondContact ND1-N 2.88Å; H241-G243 VanDerWaalsContact ND1-N 3.13Å; H241-G243 PolarHBondContact O-N 2.84Å; H241-G243 VanDerWaalsContact O-N 3.1Å; G243-I245 VanDerWaalsContact C-N 3.27Å; G243-I245 PolarHBondContact O-N 2.92Å
244	N	88	Confident	90	Very high	5 Å²	5	44.9 Å²	44.9	3%	0.027	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-90.2	14.6	-175.4	-71.3	-12.3	0	0	0	113.9	D239 H241 M276 D277	D239-N244 PolarHBondContact O-ND2 2.81Å; H241-N244 PolarHBondContact CD2-ND2 2.93Å; H241-N244 VanDerWaalsContact CD2-ND2 3.3Å; H241-N244 PolarHBondContact NE2-ND2 2.83Å; H241-N244 PolarHBondContact O-N 3.33Å; N244-M276 HydrophobicContact CB-CG 4.23Å; N244-M276 WeakPolarHBondContact CB-O 3.28Å; N244-M276 WeakPolarHBondContact O-CG 3.47Å; N244-M276 PolarHBondContact O-N 3.28Å; N244-D277 WeakPolarHBondContact OD1-CB 3.26Å
245	I	88.3	Confident	89.5	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	113.6	172.4	-57.7	-53.4	0	0	0	110	T203 F204 L222 L240 G243 M247 C273 I275 L337	T203-I245 CarbonylContact C-O 3.6Å; F204-I245 HydrophobicContact CB-CB 3.87Å; F204-I245 HydrophobicContact CB-CG2 4.05Å; F204-I245 HydrophobicContact CD2-CB 4.44Å; F204-I245 HydrophobicContact CD2-CG2 4.09Å; F204-I245 PolarHBondContact N-O 3.14Å; L222-I245 HydrophobicContact CD2-CD1 3.51Å; L222-I245 HydrophobicContact CD2-CG1 4.38Å; L222-I245 HydrophobicContact CD2-CG2 4.46Å; L240-I245 HydrophobicContact CD1-CD1 3.42Å; L240-I245 VanDerWaalsContact CD1-CD1 3.42Å; L240-I245 HydrophobicContact CD2-CD1 4.33Å; L240-I245 HydrophobicContact CG-CD1 3.77Å; G243-I245 VanDerWaalsContact C-N 3.27Å; G243-I245 PolarHBondContact O-N 2.92Å; I245-M247 HydrophobicContact CG2-CG 4.37Å; I245-M247 HydrophobicContact CG2-SD 3.78Å; I245-C273 WeakPolarHBondContact CG2-SG 3.38Å; I245-I275 HydrophobicContact CD1-CG1 4.07Å; I245-L337 HydrophobicContact CD1-CD1 4.23Å; I245-L337 HydrophobicContact CG1-CD1 3.97Å; I245-L337 HydrophobicContact CG1-CD2 4.15Å
246	L	86	Confident	88.9	Confident	22 Å²	22	44.5 Å²	44.5	12%	0.115	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	145.6	175	-61.4	178.2	0	0	0	111.9	V200 T203 C273 Y274 M276	V200-L246 HydrophobicContact CB-CB 3.8Å; V200-L246 HydrophobicContact CB-CD1 4.03Å; V200-L246 HydrophobicContact CB-CG 4.38Å; V200-L246 HydrophobicContact CG1-CB 3.91Å; V200-L246 HydrophobicContact CG2-CB 3.76Å; V200-L246 HydrophobicContact CG2-CD1 3.36Å; V200-L246 HydrophobicContact CG2-CG 4.14Å; T203-L246 HydrophobicContact CG2-CD2 3.94Å; L246-C273 CarbonylContact O-C 3.43Å; L246-C273 WeakPolarHBondContact O-CA 3.33Å; L246-Y274 PolarHBondContact N-O 3.5Å; L246-Y274 PolarHBondContact O-N 3.06Å; L246-M276 HydrophobicContact CD1-CB 4.36Å; L246-M276 HydrophobicContact CD1-CE 4.31Å; L246-M276 HydrophobicContact CD1-CG 4.34Å; L246-M276 HydrophobicContact CD1-SD 3.47Å; L246-M276 WeakPolarHBondContact CD1-SD 3.34Å; L246-M276 HydrophobicContact CD2-SD 3.42Å; L246-M276 WeakPolarHBondContact CD2-SD 3.41Å; L246-M276 HydrophobicContact CG-CG 4.12Å; L246-M276 HydrophobicContact CG-SD 3.24Å; L246-M276 WeakPolarHBondContact CG-SD 3.43Å
247	M	85.9	Confident	88.2	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	131.6	-170.1	-60.1	-60.8	-69.6	0	0	110.8	V200 I202 F204 L207 L218 I245 L271 L272 C273	V200-M247 WeakPolarHBondContact CG1-O 3.22Å; I202-M247 HydrophobicContact CG1-CB 4.04Å; I202-M247 PolarHBondContact N-O 3.4Å; I202-M247 PolarHBondContact O-N 3Å; F204-M247 HydrophobicContact CB-CG 4.48Å; L207-M247 HydrophobicContact CD1-CE 3.85Å; L207-M247 HydrophobicContact CD1-CG 3.9Å; L207-M247 HydrophobicContact CD1-SD 4.49Å; L207-M247 HydrophobicContact CD2-CB 4.05Å; L207-M247 HydrophobicContact CD2-CE 4.22Å; L207-M247 HydrophobicContact CD2-CG 4.21Å; L207-M247 HydrophobicContact CG-CB 4.39Å; L207-M247 HydrophobicContact CG-CG 4.12Å; L218-M247 HydrophobicContact CD1-CE 3.32Å; L218-M247 HydrophobicContact CD1-SD 3.53Å; L218-M247 VanDerWaalsContact CD1-SD 3.53Å; L218-M247 HydrophobicContact CD2-CE 3.87Å; L218-M247 HydrophobicContact CG-CE 4.13Å; I245-M247 HydrophobicContact CG2-CG 4.37Å; I245-M247 HydrophobicContact CG2-SD 3.78Å; M247-L271 HydrophobicContact CB-CD1 4.42Å; M247-L271 HydrophobicContact CE-CD1 3.98Å; M247-L271 HydrophobicContact CE-CD2 3.08Å; M247-L271 HydrophobicContact CE-CG 3.29Å; M247-L272 WeakPolarHBondContact CA-O 3.49Å; M247-C273 HydrophobicContact CE-CB 4.35Å; M247-C273 HydrophobicContact SD-CB 3.77Å
248	K	84.4	Confident	87.4	Confident	68 Å²	68	50 Å²	50	30%	0.296	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	121.8	179	-165.2	172.1	-176.8	169.5	0	110.2	E198 V200 L271 L272 Y274	E198-K248 IonicContact OE1-NZ 2.75Å; E198-K248 PolarHBondContact OE1-NZ 2.93Å; V200-K248 HydrophobicContact CG1-CB 3.7Å; V200-K248 HydrophobicContact CG1-CG 4.42Å; K248-L271 WeakPolarHBondContact O-CA 3.45Å; K248-L272 HydrophobicContact CB-CB 4.33Å; K248-L272 PolarHBondContact N-O 3.16Å; K248-L272 PolarHBondContact O-N 3.32Å; K248-Y274 HydrophobicContact CB-CE2 3.95Å; K248-Y274 HydrophobicContact CD-CE2 4.5Å
249	Y	85	Confident	86.7	Confident	66 Å²	66	50.6 Å²	50.6	26%	0.259	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	138.9	167.7	-64.4	-66.4	0	0	0	109.7	I202 R211 G270 L271	I202-Y249 HydrophobicContact CD1-CE2 3.65Å; R211-Y249 HydrophobicContact CB-CE1 3.83Å; R211-Y249 WeakPolarHBondContact CD-OH 3.5Å; Y249-G270 CarbonylContact C-O 3.58Å; Y249-G270 VanDerWaalsContact CA-O 3.3Å; Y249-G270 WeakPolarHBondContact CA-O 3.28Å; Y249-L271 HydrophobicContact CD1-CD1 3.67Å; Y249-L271 HydrophobicContact CE1-CD1 3.78Å; Y249-L271 HydrophobicContact CG-CD1 4.4Å
250	T	86.1	Confident	85.9	Confident	33 Å²	33	53.4 Å²	53.4	20%	0.202	26%	0.26	C	S	.	.			trans	-142.8	151.4	-175	-171.1	0	0	0	0	112.2	L252 A268 G270 L272	T250-L252 VanDerWaalsContact C-N 3.32Å; T250-L252 HydrophobicContact CG2-CB 4.01Å; T250-L252 WeakPolarHBondContact OG1-CB 3.34Å; T250-L252 WeakPolarHBondContact OG1-CG 3.26Å; T250-L252 PolarHBondContact OG1-N 3.13Å; T250-A268 HydrophobicContact CG2-CB 4.27Å; T250-G270 PolarHBondContact N-O 2.79Å; T250-G270 CarbonylContact O-C 3.47Å; T250-G270 WeakPolarHBondContact O-CA 3.35Å; T250-L272 HydrophobicContact CG2-CD1 4.25Å; T250-L272 HydrophobicContact CG2-CD2 3.98Å; T250-L272 HydrophobicContact CG2-CG 3.64Å
251	R	87.5	Confident	85	Confident	166 Å²	166	57.2 Å²	57.2	63%	0.626	30%	0.299	S	S	*	.			trans	-86.2	-7.6	166.7	-63.1	-178.3	-178	149	0.4	112.3	K253	R251-K253 PolarHBondContact O-N 3.36Å
252	L	86.7	Confident	84.3	Confident	98 Å²	98	61 Å²	61	51%	0.513	32%	0.317	S	S	.	.			trans	-59.4	126.2	177.4	-68.9	176.3	0	0	0	109.7	T250 R254 A268 L272	T250-L252 VanDerWaalsContact C-N 3.32Å; T250-L252 HydrophobicContact CG2-CB 4.01Å; T250-L252 WeakPolarHBondContact OG1-CB 3.34Å; T250-L252 WeakPolarHBondContact OG1-CG 3.26Å; T250-L252 PolarHBondContact OG1-N 3.13Å; L252-R254 VanDerWaalsContact C-N 3.3Å; L252-A268 WeakPolarHBondContact O-CB 3.06Å; L252-L272 HydrophobicContact CD1-CD1 4.2Å
253	K	89.7	Confident	83.8	Confident	185 Å²	185	69.8 Å²	69.8	80%	0.804	35%	0.347	S	S	*	.	S	Bend	trans	-71	-31.9	177.5	-65.4	-175.9	179.1	178.4	0	111.4	R251 A268	R251-K253 PolarHBondContact O-N 3.36Å; K253-A268 PolarHBondContact O-N 3.42Å
254	R	89	Confident	83.6	Confident	132 Å²	132	69.9 Å²	69.9	50%	0.498	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	145.6	-172.7	-56.7	-177.1	73.2	114.3	0.3	111.8	L252 S265 S266	L252-R254 VanDerWaalsContact C-N 3.3Å; R254-S265 WeakPolarHBondContact CB-OG 3.44Å; R254-S265 PolarHBondContact NE-OG 2.73Å; R254-S265 PolarHBondContact NH2-O 3.25Å; R254-S266 CarbonylContact C-O 3.49Å; R254-S266 WeakPolarHBondContact CA-O 3.4Å; R254-S266 VanDerWaalsContact CB-O 3.28Å; R254-S266 WeakPolarHBondContact CB-O 3.4Å
255	T	85.9	Confident	83.4	Confident	12 Å²	12	71 Å²	71	7%	0.074	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	147.8	160.4	50.9	0	0	0	0	109.3	Q221 Y257 S265 S266 A268 L272	Q221-T255 HydrophobicContact CG-CG2 4.27Å; T255-Y257 WeakPolarHBondContact OG1-CE2 3.31Å; T255-S265 CarbonylContact O-C 3.58Å; T255-S265 WeakPolarHBondContact O-CA 3.43Å; T255-S265 WeakPolarHBondContact O-CB 3.37Å; T255-S265 PolarHBondContact O-OG 2.93Å; T255-S266 PolarHBondContact N-O 2.82Å; T255-S266 PolarHBondContact O-N 3.03Å; T255-S266 VanDerWaalsContact O-N 3.1Å; T255-S266 PolarHBondContact OG1-OG 3.42Å; T255-A268 HydrophobicContact CG2-CB 4.06Å; T255-L272 HydrophobicContact CG2-CD2 3.36Å
256	T	84.6	Confident	83.1	Confident	71 Å²	71	71.3 Å²	71.3	44%	0.436	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	134.9	178.1	-55.8	0	0	0	0	109.5	Y264	T256-Y264 CarbonylContact C-O 3.6Å; T256-Y264 VanDerWaalsContact CA-O 3.26Å; T256-Y264 WeakPolarHBondContact CA-O 3.26Å; T256-Y264 WeakPolarHBondContact CG2-O 3.23Å
257	Y	84.2	Confident	83.1	Confident	35 Å²	35	77.7 Å²	77.7	14%	0.137	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	144.8	-179.9	-55.2	-94.1	0	0	0	109.3	Q221 V224 I228 T255 R263 Y264	Q221-Y257 WeakPolarHBondContact CA-OH 3.34Å; Q221-Y257 WeakPolarHBondContact CB-OH 3.33Å; Q221-Y257 WeakPolarHBondContact CG-OH 3.35Å; V224-Y257 HydrophobicContact CB-CE2 4.5Å; V224-Y257 HydrophobicContact CG1-CD1 3.73Å; V224-Y257 HydrophobicContact CG1-CD2 3.73Å; V224-Y257 HydrophobicContact CG1-CE1 3.99Å; V224-Y257 HydrophobicContact CG1-CE2 3.97Å; V224-Y257 HydrophobicContact CG1-CG 3.59Å; I228-Y257 HydrophobicContact CD1-CD1 3.79Å; I228-Y257 HydrophobicContact CD1-CG 4.25Å; T255-Y257 WeakPolarHBondContact OG1-CE2 3.31Å; Y257-R263 CarbonylContact O-C 3.58Å; Y257-R263 WeakPolarHBondContact O-CA 3.43Å; Y257-Y264 AromaticContact CD2-CD1 3.62Å; Y257-Y264 HydrophobicContact CD2-CD1 3.62Å; Y257-Y264 HydrophobicContact CD2-CE1 4.22Å; Y257-Y264 HydrophobicContact CE2-CD1 4.26Å; Y257-Y264 HydrophobicContact CE2-CE1 4.42Å; Y257-Y264 HydrophobicContact CG-CD1 4.4Å; Y257-Y264 PolarHBondContact N-O 2.84Å; Y257-Y264 PolarHBondContact O-N 3.35Å
258	A	78.4	Confident	83.2	Confident	81 Å²	81	77.8 Å²	77.8	67%	0.669	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.3	117.5	169.1	0	0	0	0	0	108.4	Q262	A258-Q262 WeakPolarHBondContact CA-O 3.15Å
259	I	78.9	Confident	83.3	Confident	13 Å²	13	77.3 Å²	77.3	7%	0.067	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	113.5	-173.3	-48.3	177.4	0	0	0	107.7	V224 Y227 I228 G261 Q262 F389	V224-I259 HydrophobicContact CG1-CD1 3.84Å; Y227-I259 HydrophobicContact CD1-CD1 4.37Å; Y227-I259 HydrophobicContact CD1-CG2 4.22Å; Y227-I259 HydrophobicContact CE1-CD1 4.33Å; Y227-I259 HydrophobicContact CE1-CG2 3.43Å; Y227-I259 VanDerWaalsContact CE1-CG2 3.43Å; I228-I259 HydrophobicContact CD1-CD1 3.95Å; I228-I259 HydrophobicContact CD1-CG1 3.76Å; I228-I259 HydrophobicContact CG1-CD1 4.01Å; I228-I259 HydrophobicContact CG1-CG1 3.79Å; I228-I259 HydrophobicContact CG1-CG2 4.45Å; I259-G261 PolarHBondContact O-N 2.83Å; I259-Q262 PolarHBondContact N-O 3.26Å; I259-Q262 WeakPolarHBondContact O-CA 3.47Å; I259-Q262 WeakPolarHBondContact O-CB 3.33Å; I259-Q262 PolarHBondContact O-N 3.14Å; I259-F389 HydrophobicContact CD1-CE2 3.54Å; I259-F389 HydrophobicContact CD1-CZ 3.46Å; I259-F389 VanDerWaalsContact CD1-CZ 3.46Å
260	E	75.9	Confident	83.4	Confident	80 Å²	80	75.3 Å²	75.3	37%	0.374	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	42	-179.1	-54.7	-170.3	153.7	0	0	113	Q262 N396 R400	E260-Q262 PolarHBondContact O-N 3.09Å; E260-N396 PolarHBondContact OE2-ND2 3.49Å; E260-R400 IonicContact OE1-CZ 3.53Å; E260-R400 IonicContact OE1-NH1 3.75Å; E260-R400 IonicContact OE1-NH2 2.63Å; E260-R400 PolarHBondContact OE1-NH2 3.32Å; E260-R400 IonicContact OE2-NH2 3.61Å
261	G	75	Confident	83.5	Confident	79 Å²	79	74.3 Å²	74.3	81%	0.814	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	-2.7	-178.3	0	0	0	0	0	115.1	I259	I259-G261 PolarHBondContact O-N 2.83Å
262	Q	75.9	Confident	83.5	Confident	102 Å²	102	67.3 Å²	67.3	48%	0.477	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	144.5	177.1	-61.6	-62.6	-19.8	0	0	111.6	A258 I259 E260	A258-Q262 WeakPolarHBondContact CA-O 3.15Å; I259-Q262 PolarHBondContact N-O 3.26Å; I259-Q262 WeakPolarHBondContact O-CA 3.47Å; I259-Q262 WeakPolarHBondContact O-CB 3.33Å; I259-Q262 PolarHBondContact O-N 3.14Å; E260-Q262 PolarHBondContact O-N 3.09Å
263	R	79.4	Confident	83.6	Confident	204 Å²	204	63.3 Å²	63.3	77%	0.77	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89	117.2	173.2	-71.9	-178.7	67.3	162.9	0.2	110	Y257	Y257-R263 CarbonylContact O-C 3.58Å; Y257-R263 WeakPolarHBondContact O-CA 3.43Å
264	Y	80.8	Confident	83.4	Confident	16 Å²	16	58.4 Å²	58.4	6%	0.063	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	143.3	164.5	176.1	-120.1	0	0	0	110.1	V224 T256 Y257 F389	V224-Y264 HydrophobicContact CB-CE1 4.48Å; V224-Y264 HydrophobicContact CG1-CD1 3.97Å; V224-Y264 HydrophobicContact CG1-CE1 4.27Å; V224-Y264 HydrophobicContact CG2-CD1 4.04Å; V224-Y264 HydrophobicContact CG2-CE1 3.57Å; T256-Y264 CarbonylContact C-O 3.6Å; T256-Y264 VanDerWaalsContact CA-O 3.26Å; T256-Y264 WeakPolarHBondContact CA-O 3.26Å; T256-Y264 WeakPolarHBondContact CG2-O 3.23Å; Y257-Y264 AromaticContact CD2-CD1 3.62Å; Y257-Y264 HydrophobicContact CD2-CD1 3.62Å; Y257-Y264 HydrophobicContact CD2-CE1 4.22Å; Y257-Y264 HydrophobicContact CE2-CD1 4.26Å; Y257-Y264 HydrophobicContact CE2-CE1 4.42Å; Y257-Y264 HydrophobicContact CG-CD1 4.4Å; Y257-Y264 PolarHBondContact N-O 2.84Å; Y257-Y264 PolarHBondContact O-N 3.35Å; Y264-F389 HydrophobicContact CD1-CD1 4.28Å; Y264-F389 AromaticContact CD1-CE1 3.88Å; Y264-F389 HydrophobicContact CD1-CE1 3.88Å; Y264-F389 HydrophobicContact CD1-CE2 4.47Å; Y264-F389 AromaticContact CD1-CZ 3.99Å; Y264-F389 HydrophobicContact CD1-CZ 3.99Å; Y264-F389 HydrophobicContact CD2-CB 3.41Å; Y264-F389 VanDerWaalsContact CD2-CB 3.41Å; Y264-F389 AromaticContact CD2-CD1 3.13Å; Y264-F389 HydrophobicContact CD2-CD1 3.13Å; Y264-F389 AromaticContact CD2-CD2 3.56Å; Y264-F389 HydrophobicContact CD2-CD2 3.56Å; Y264-F389 AromaticContact CD2-CE1 3.59Å; Y264-F389 HydrophobicContact CD2-CE1 3.59Å; Y264-F389 HydrophobicContact CD2-CE2 4.04Å; Y264-F389 AromaticContact CD2-CG 3.06Å; Y264-F389 HydrophobicContact CD2-CG 3.06Å; Y264-F389 HydrophobicContact CD2-CZ 4.01Å; Y264-F389 HydrophobicContact CE1-CD1 4.35Å; Y264-F389 HydrophobicContact CE1-CE1 4.02Å; Y264-F389 HydrophobicContact CE2-CB 3.8Å; Y264-F389 AromaticContact CE2-CD1 3.16Å; Y264-F389 HydrophobicContact CE2-CD1 3.16Å; Y264-F389 HydrophobicContact CE2-CD2 4.43Å; Y264-F389 AromaticContact CE2-CE1 3.68Å; Y264-F389 HydrophobicContact CE2-CE1 3.68Å; Y264-F389 AromaticContact CE2-CG 3.56Å; Y264-F389 HydrophobicContact CE2-CG 3.56Å; Y264-F389 HydrophobicContact CG-CB 4.41Å; Y264-F389 AromaticContact CG-CD1 3.7Å; Y264-F389 HydrophobicContact CG-CD1 3.7Å; Y264-F389 AromaticContact CG-CD2 3.72Å; Y264-F389 HydrophobicContact CG-CD2 3.72Å; Y264-F389 AromaticContact CG-CE1 3.64Å; Y264-F389 HydrophobicContact CG-CE1 3.64Å; Y264-F389 AromaticContact CG-CE2 3.75Å; Y264-F389 HydrophobicContact CG-CE2 3.75Å; Y264-F389 AromaticContact CG-CG 3.68Å; Y264-F389 HydrophobicContact CG-CG 3.68Å; Y264-F389 AromaticContact CG-CZ 3.67Å; Y264-F389 HydrophobicContact CG-CZ 3.67Å; Y264-F389 AromaticContact CZ-CD1 3.79Å; Y264-F389 AromaticContact CZ-CE1 3.87Å
265	S	83.4	Confident	83.5	Confident	29 Å²	29	52.9 Å²	52.9	20%	0.203	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	131.8	171.9	-177.5	0	0	0	0	111.3	R254 T255	R254-S265 WeakPolarHBondContact CB-OG 3.44Å; R254-S265 PolarHBondContact NE-OG 2.73Å; R254-S265 PolarHBondContact NH2-O 3.25Å; T255-S265 CarbonylContact O-C 3.58Å; T255-S265 WeakPolarHBondContact O-CA 3.43Å; T255-S265 WeakPolarHBondContact O-CB 3.37Å; T255-S265 PolarHBondContact O-OG 2.93Å
266	S	81.6	Confident	83.4	Confident	6 Å²	6	53.3 Å²	53.3	4%	0.042	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	157.9	175.2	44.7	0	0	0	0	110.8	R254 T255 A268	R254-S266 CarbonylContact C-O 3.49Å; R254-S266 WeakPolarHBondContact CA-O 3.4Å; R254-S266 VanDerWaalsContact CB-O 3.28Å; R254-S266 WeakPolarHBondContact CB-O 3.4Å; T255-S266 PolarHBondContact N-O 2.82Å; T255-S266 PolarHBondContact O-N 3.03Å; T255-S266 VanDerWaalsContact O-N 3.1Å; T255-S266 PolarHBondContact OG1-OG 3.42Å; S266-A268 PolarHBondContact O-N 2.84Å
267	R	87.7	Confident	83.4	Confident	156 Å²	156	51.9 Å²	51.9	59%	0.589	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.3	135.4	172.3	-67.8	-176.5	-178.8	151.8	0.7	109	D217 H269	D217-R267 WeakPolarHBondContact CB-O 3.47Å; R267-H269 WeakPolarHBondContact CD-CE1 3.23Å; R267-H269 WeakPolarHBondContact CD-NE2 3.41Å
268	A	86.9	Confident	83.5	Confident	2 Å²	2	52.3 Å²	52.3	2%	0.017	27%	0.274	C	S	.	.			trans	-85.5	-22.7	174	0	0	0	0	0	111.8	T250 L252 K253 T255 S266 G270 L271 L272	T250-A268 HydrophobicContact CG2-CB 4.27Å; L252-A268 WeakPolarHBondContact O-CB 3.06Å; K253-A268 PolarHBondContact O-N 3.42Å; T255-A268 HydrophobicContact CG2-CB 4.06Å; S266-A268 PolarHBondContact O-N 2.84Å; A268-G270 PolarHBondContact O-N 3.2Å; A268-L271 PolarHBondContact O-N 2.82Å; A268-L272 HydrophobicContact CB-CD2 4.3Å
269	H	87.9	Confident	83.7	Confident	57 Å²	57	49 Å²	49	26%	0.264	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.4	35.8	-176	-75.6	120.7	0	0	0	115.2	K213 D217 R267	K213-H269 HydrophobicContact CB-CB 4.28Å; D217-H269 IonicContact OD2-CE1 3.15Å; D217-H269 PolarHBondContact OD2-CE1 3.08Å; D217-H269 IonicContact OD2-CG 2.83Å; D217-H269 IonicContact OD2-ND1 2.84Å; D217-H269 PolarHBondContact OD2-ND1 3.26Å; R267-H269 WeakPolarHBondContact CD-CE1 3.23Å; R267-H269 WeakPolarHBondContact CD-NE2 3.41Å
270	G	85.8	Confident	84.2	Confident	25 Å²	25	49.6 Å²	49.6	26%	0.258	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.6	9.7	176.5	0	0	0	0	0	114.4	Y249 T250 A268	Y249-G270 CarbonylContact C-O 3.58Å; Y249-G270 VanDerWaalsContact CA-O 3.3Å; Y249-G270 WeakPolarHBondContact CA-O 3.28Å; T250-G270 PolarHBondContact N-O 2.79Å; T250-G270 CarbonylContact O-C 3.47Å; T250-G270 WeakPolarHBondContact O-CA 3.35Å; A268-G270 PolarHBondContact O-N 3.2Å
271	L	88.5	Confident	85.1	Confident	12 Å²	12	45.8 Å²	45.8	6%	0.063	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	129.6	-173.1	-159.1	65.8	0	0	0	112	L207 V212 Q221 M247 K248 Y249 A268	L207-L271 HydrophobicContact CD2-CD1 3.97Å; L207-L271 HydrophobicContact CD2-CD2 3.9Å; V212-L271 HydrophobicContact CG2-CD2 4.2Å; Q221-L271 PolarHBondContact NE2-O 2.83Å; M247-L271 HydrophobicContact CB-CD1 4.42Å; M247-L271 HydrophobicContact CE-CD1 3.98Å; M247-L271 HydrophobicContact CE-CD2 3.08Å; M247-L271 HydrophobicContact CE-CG 3.29Å; K248-L271 WeakPolarHBondContact O-CA 3.45Å; Y249-L271 HydrophobicContact CD1-CD1 3.67Å; Y249-L271 HydrophobicContact CE1-CD1 3.78Å; Y249-L271 HydrophobicContact CG-CD1 4.4Å; A268-L271 PolarHBondContact O-N 2.82Å
272	L	88.4	Confident	86	Confident	19 Å²	19	42.4 Å²	42.4	10%	0.099	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	145.1	169.9	-58.5	176.2	0	0	0	109.8	M247 K248 T250 L252 T255 A268 Y274	M247-L272 WeakPolarHBondContact CA-O 3.49Å; K248-L272 HydrophobicContact CB-CB 4.33Å; K248-L272 PolarHBondContact N-O 3.16Å; K248-L272 PolarHBondContact O-N 3.32Å; T250-L272 HydrophobicContact CG2-CD1 4.25Å; T250-L272 HydrophobicContact CG2-CD2 3.98Å; T250-L272 HydrophobicContact CG2-CG 3.64Å; L252-L272 HydrophobicContact CD1-CD1 4.2Å; T255-L272 HydrophobicContact CG2-CD2 3.36Å; A268-L272 HydrophobicContact CB-CD2 4.3Å; L272-Y274 HydrophobicContact CB-CE2 3.68Å; L272-Y274 VanDerWaalsContact CD1-OH 3.28Å; L272-Y274 WeakPolarHBondContact CD1-OH 3.34Å
273	C	87.6	Confident	86.9	Confident	14 Å²	14	37.6 Å²	37.6	10%	0.095	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	136	178.8	-178.7	0	0	0	0	110.8	L218 Q221 L222 I245 L246 M247	L218-C273 HydrophobicContact CD1-CB 3.51Å; L218-C273 WeakPolarHBondContact CD1-SG 3.18Å; Q221-C273 HydrophobicContact CB-CB 4.18Å; L222-C273 WeakPolarHBondContact CD2-SG 3.46Å; L222-C273 VanDerWaalsContact CG-SG 3.57Å; I245-C273 WeakPolarHBondContact CG2-SG 3.38Å; L246-C273 CarbonylContact O-C 3.43Å; L246-C273 WeakPolarHBondContact O-CA 3.33Å; M247-C273 HydrophobicContact CE-CB 4.35Å; M247-C273 HydrophobicContact SD-CB 3.77Å
274	Y	86.7	Confident	87.6	Confident	81 Å²	81	30.3 Å²	30.3	32%	0.318	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	136.1	178.1	-56	-95.3	0	0	0	109.4	V200 L246 K248 L272	V200-Y274 HydrophobicContact CG1-CD2 3.87Å; V200-Y274 HydrophobicContact CG1-CE2 4.11Å; L246-Y274 PolarHBondContact N-O 3.5Å; L246-Y274 PolarHBondContact O-N 3.06Å; K248-Y274 HydrophobicContact CB-CE2 3.95Å; K248-Y274 HydrophobicContact CD-CE2 4.5Å; L272-Y274 HydrophobicContact CB-CE2 3.68Å; L272-Y274 VanDerWaalsContact CD1-OH 3.28Å; L272-Y274 WeakPolarHBondContact CD1-OH 3.34Å
275	I	89.3	Confident	87.9	Confident	17 Å²	17	32.5 Å²	32.5	9%	0.087	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	138.1	174.6	-61.8	177.4	0	0	0	108.2	L222 T225 L226 H237 L240 I245 Y278	L222-I275 HydrophobicContact CD2-CD1 4.13Å; L222-I275 HydrophobicContact CD2-CG1 3.81Å; T225-I275 HydrophobicContact CG2-CD1 4.01Å; L226-I275 HydrophobicContact CD2-CD1 3.88Å; L226-I275 HydrophobicContact CG-CD1 3.95Å; H237-I275 WeakPolarHBondContact CD2-CG2 3.48Å; H237-I275 WeakPolarHBondContact NE2-CG2 3.31Å; L240-I275 HydrophobicContact CD1-CB 4.26Å; L240-I275 HydrophobicContact CD1-CD1 4.31Å; L240-I275 HydrophobicContact CD1-CG1 4.09Å; L240-I275 HydrophobicContact CD1-CG2 3.37Å; L240-I275 HydrophobicContact CD2-CD1 4.49Å; I245-I275 HydrophobicContact CD1-CG1 4.07Å; I275-Y278 HydrophobicContact CG2-CE1 3.8Å; I275-Y278 PolarHBondContact O-OH 3.25Å
276	M	85	Confident	88.1	Confident	21 Å²	21	34.9 Å²	34.9	10%	0.103	19%	0.19	C	C	.	.			trans	-136.2	175.4	178	65.5	178.6	-62.7	0	0	111.4	M197 H237 N244 L246	M197-M276 HydrophobicContact SD-CE 4.32Å; H237-M276 PolarHBondContact CE1-O 2.75Å; H237-M276 VanDerWaalsContact CE1-O 3.26Å; H237-M276 PolarHBondContact NE2-O 2.82Å; N244-M276 HydrophobicContact CB-CG 4.23Å; N244-M276 WeakPolarHBondContact CB-O 3.28Å; N244-M276 WeakPolarHBondContact O-CG 3.47Å; N244-M276 PolarHBondContact O-N 3.28Å; L246-M276 HydrophobicContact CD1-CB 4.36Å; L246-M276 HydrophobicContact CD1-CE 4.31Å; L246-M276 HydrophobicContact CD1-CG 4.34Å; L246-M276 HydrophobicContact CD1-SD 3.47Å; L246-M276 WeakPolarHBondContact CD1-SD 3.34Å; L246-M276 HydrophobicContact CD2-SD 3.42Å; L246-M276 WeakPolarHBondContact CD2-SD 3.41Å; L246-M276 HydrophobicContact CG-CG 4.12Å; L246-M276 HydrophobicContact CG-SD 3.24Å; L246-M276 WeakPolarHBondContact CG-SD 3.43Å
277	D	83.6	Confident	88.3	Confident	40 Å²	40	42.2 Å²	42.2	21%	0.214	23%	0.228	C	C	.	.			trans	55	86.3	178.1	-150.8	-34.2	0	0	0	114.5	K124 H237 N244 G279	K124-D277 IonicContact NZ-OD1 3.66Å; K124-D277 IonicContact NZ-OD2 3.5Å; K124-D277 PolarHBondContact NZ-OD2 3.41Å; H237-D277 PolarHBondContact CE1-O 3.03Å; H237-D277 PolarHBondContact NE2-O 3.13Å; N244-D277 WeakPolarHBondContact OD1-CB 3.26Å; D277-G279 VanDerWaalsContact C-N 3.31Å; D277-G279 PolarHBondContact OD1-N 3.24Å
278	Y	87.2	Confident	88.3	Confident	45 Å²	45	39.3 Å²	39.3	18%	0.176	22%	0.217	C	C	.	.			trans	-96	16.3	-176.4	-44	-71.2	0	0	0	112.6	P147 E148 I151 F235 H237 I275 L280 S281	P147-Y278 WeakPolarHBondContact CB-O 3.21Å; E148-Y278 HydrophobicContact CG-CD2 4.45Å; I151-Y278 HydrophobicContact CD1-CD1 3.57Å; I151-Y278 HydrophobicContact CD1-CD2 3.26Å; I151-Y278 HydrophobicContact CD1-CE1 3.91Å; I151-Y278 HydrophobicContact CD1-CE2 3.62Å; I151-Y278 HydrophobicContact CD1-CG 3.22Å; I151-Y278 HydrophobicContact CG1-CD2 3.55Å; I151-Y278 HydrophobicContact CG1-CE2 3.93Å; I151-Y278 HydrophobicContact CG1-CG 3.98Å; F235-Y278 HydrophobicContact CE2-CD1 4.46Å; F235-Y278 HydrophobicContact CZ-CD1 4.07Å; F235-Y278 HydrophobicContact CZ-CE1 4.46Å; H237-Y278 AromaticContact CD2-CD1 3.78Å; H237-Y278 AromaticContact NE2-CD1 3.58Å; H237-Y278 AromaticContact NE2-CE1 3.93Å; I275-Y278 HydrophobicContact CG2-CE1 3.8Å; I275-Y278 PolarHBondContact O-OH 3.25Å; Y278-L280 PolarHBondContact O-N 2.95Å; Y278-L280 VanDerWaalsContact O-N 3.1Å; Y278-S281 WeakPolarHBondContact CA-OG 3.42Å; Y278-S281 WeakPolarHBondContact CB-OG 3.43Å; Y278-S281 VanDerWaalsContact O-CB 3.23Å; Y278-S281 WeakPolarHBondContact O-CB 3.38Å; Y278-S281 PolarHBondContact O-N 2.72Å; Y278-S281 PolarHBondContact O-OG 2.93Å
279	G	82.9	Confident	88.5	Confident	11 Å²	11	42.6 Å²	42.6	11%	0.113	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-28.7	-174.2	0	0	0	0	0	114.1	D277 T292	D277-G279 VanDerWaalsContact C-N 3.31Å; D277-G279 PolarHBondContact OD1-N 3.24Å; G279-T292 WeakPolarHBondContact O-CB 3.49Å; G279-T292 PolarHBondContact O-OG1 3.41Å
280	L	88.9	Confident	88.6	Confident	26 Å²	26	40.5 Å²	40.5	14%	0.136	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	3.8	176	-59.3	-172.8	0	0	0	114.3	R238 D239 Y278 T292 L294 I301	R238-L280 HydrophobicContact CB-CB 4.39Å; R238-L280 WeakPolarHBondContact CB-O 3.08Å; R238-L280 WeakPolarHBondContact CD-O 3.09Å; D239-L280 HydrophobicContact CB-CB 4.05Å; D239-L280 HydrophobicContact CB-CD1 3.93Å; D239-L280 HydrophobicContact CB-CG 4.26Å; Y278-L280 PolarHBondContact O-N 2.95Å; Y278-L280 VanDerWaalsContact O-N 3.1Å; L280-T292 HydrophobicContact CD2-CG2 3.73Å; L280-L294 HydrophobicContact CD1-CD1 4.39Å; L280-L294 HydrophobicContact CD2-CD2 3.89Å; L280-L294 HydrophobicContact CD2-CG 4.44Å; L280-I301 HydrophobicContact CD1-CD1 3.4Å; L280-I301 HydrophobicContact CD1-CG1 4.31Å
281	S	93.7	Very high	88.8	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.226	C	C	.	.			trans	-66.8	158.3	-174.4	-68.7	0	0	0	0	112.8	E236 H237 Y278 Y291	E236-S281 CarbonylContact O-C 3.56Å; E236-S281 VanDerWaalsContact O-CA 3.23Å; E236-S281 WeakPolarHBondContact O-CA 3.48Å; E236-S281 WeakPolarHBondContact O-CB 3.38Å; H237-S281 WeakPolarHBondContact CA-OG 3.25Å; H237-S281 VanDerWaalsContact O-CA 3.27Å; H237-S281 WeakPolarHBondContact O-CA 3.29Å; H237-S281 PolarHBondContact O-N 2.88Å; H237-S281 PolarHBondContact O-OG 2.74Å; Y278-S281 WeakPolarHBondContact CA-OG 3.42Å; Y278-S281 WeakPolarHBondContact CB-OG 3.43Å; Y278-S281 VanDerWaalsContact O-CB 3.23Å; Y278-S281 WeakPolarHBondContact O-CB 3.38Å; Y278-S281 PolarHBondContact O-N 2.72Å; Y278-S281 PolarHBondContact O-OG 2.93Å; S281-Y291 WeakPolarHBondContact O-CA 3.22Å
282	R	95.1	Very high	88.8	Confident	7 Å²	7	42.8 Å²	42.8	3%	0.026	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	131.2	173.1	172.7	-87.8	-170.3	-123	-17.7	110.5	K234 F235 E236 E284 L289 Y290 A323 G324	K234-R282 PolarHBondContact O-NH1 3.26Å; F235-R282 CarbonylContact C-O 3.46Å; F235-R282 VanDerWaalsContact CA-O 3.29Å; F235-R282 WeakPolarHBondContact CA-O 3.36Å; E236-R282 HydrophobicContact CB-CB 4.38Å; E236-R282 PolarHBondContact N-O 3.18Å; E236-R282 PolarHBondContact O-N 2.94Å; E236-R282 IonicContact OE1-NE 3.12Å; R282-E284 IonicContact CZ-OE1 3.83Å; R282-E284 IonicContact NH1-OE1 3.7Å; R282-E284 PolarHBondContact NH1-OE1 3.29Å; R282-E284 VanDerWaalsContact NH1-OE1 3.13Å; R282-E284 IonicContact NH2-OE1 3.47Å; R282-E284 PolarHBondContact NH2-OE1 2.88Å; R282-L289 HydrophobicContact CG-CD1 4.31Å; R282-Y290 CarbonylContact C-O 3.44Å; R282-Y290 VanDerWaalsContact CA-O 3.23Å; R282-Y290 WeakPolarHBondContact CA-O 3.43Å; R282-A323 PolarHBondContact NH2-O 3.04Å; R282-G324 PolarHBondContact NE-O 2.73Å; R282-G324 VanDerWaalsContact NE-O 3.08Å
283	F	95.3	Very high	88.6	Confident	1 Å²	1	46.8 Å²	46.8	0%	0.004	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	166.5	176.9	56.5	-89.9	0	0	0	113.1	P147 A150 I151 F233 F235 I285 Y290	P147-F283 HydrophobicContact CB-CE1 3.92Å; P147-F283 HydrophobicContact CB-CZ 4.47Å; P147-F283 WeakPolarHBondContact O-CE1 3.25Å; P147-F283 WeakPolarHBondContact O-CZ 3.32Å; A150-F283 HydrophobicContact CB-CE2 4.11Å; A150-F283 HydrophobicContact CB-CZ 3.9Å; I151-F283 HydrophobicContact CD1-CE1 4.31Å; I151-F283 HydrophobicContact CG1-CZ 4.49Å; I151-F283 HydrophobicContact CG2-CD2 4.32Å; I151-F283 HydrophobicContact CG2-CE1 4.16Å; I151-F283 HydrophobicContact CG2-CE2 3.68Å; I151-F283 HydrophobicContact CG2-CZ 3.59Å; F233-F283 HydrophobicContact CB-CB 4.11Å; F233-F283 CarbonylContact O-C 3.29Å; F233-F283 WeakPolarHBondContact O-CA 3.28Å; F233-F283 WeakPolarHBondContact O-CB 3.45Å; F235-F283 HydrophobicContact CB-CB 4.28Å; F235-F283 HydrophobicContact CD2-CB 3.82Å; F235-F283 AromaticContact CD2-CD1 3.89Å; F235-F283 HydrophobicContact CD2-CD1 3.89Å; F235-F283 HydrophobicContact CD2-CG 4.13Å; F235-F283 HydrophobicContact CE2-CD1 4.01Å; F235-F283 HydrophobicContact CG-CB 4.5Å; F283-I285 HydrophobicContact CD2-CD1 4.05Å; F283-I285 HydrophobicContact CD2-CG1 3.87Å; F283-I285 HydrophobicContact CE2-CD1 3.69Å; F283-I285 HydrophobicContact CE2-CG1 4Å; F283-Y290 AromaticContact CD2-CD2 3.89Å; F283-Y290 HydrophobicContact CD2-CD2 3.89Å; F283-Y290 HydrophobicContact CD2-CG 4.07Å; F283-Y290 VanDerWaalsContact CE2-CB 3.49Å; F283-Y290 HydrophobicContact CE2-CD1 4.17Å; F283-Y290 AromaticContact CE2-CD2 3.53Å; F283-Y290 HydrophobicContact CE2-CD2 3.53Å; F283-Y290 HydrophobicContact CE2-CE2 4.39Å; F283-Y290 AromaticContact CE2-CG 3.44Å; F283-Y290 HydrophobicContact CE2-CG 3.44Å; F283-Y290 VanDerWaalsContact CE2-CG 3.44Å; F283-Y290 HydrophobicContact CZ-CD1 4.25Å; F283-Y290 HydrophobicContact CZ-CD2 4.33Å; F283-Y290 AromaticContact CZ-CG 3.77Å; F283-Y290 HydrophobicContact CZ-CG 3.77Å; F283-Y290 PolarHBondContact N-O 3.39Å; F283-Y290 PolarHBondContact O-N 3.39Å
284	E	93.3	Very high	88.5	Confident	51 Å²	51	47.2 Å²	47.2	24%	0.238	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	130.6	178.8	-71.4	169.1	-146.2	0	0	110.3	F233 K234 R282 R288 L289	F233-E284 WeakPolarHBondContact CA-O 3.19Å; F233-E284 PolarHBondContact O-N 3.34Å; K234-E284 WeakPolarHBondContact CD-OE1 3.36Å; K234-E284 WeakPolarHBondContact CD-OE2 3.03Å; K234-E284 WeakPolarHBondContact CE-OE2 3.33Å; K234-E284 IonicContact NZ-OE1 2.63Å; K234-E284 PolarHBondContact NZ-OE1 3.41Å; K234-E284 IonicContact NZ-OE2 3.57Å; K234-E284 PolarHBondContact NZ-OE2 3.42Å; R282-E284 IonicContact CZ-OE1 3.83Å; R282-E284 IonicContact NH1-OE1 3.7Å; R282-E284 PolarHBondContact NH1-OE1 3.29Å; R282-E284 VanDerWaalsContact NH1-OE1 3.13Å; R282-E284 IonicContact NH2-OE1 3.47Å; R282-E284 PolarHBondContact NH2-OE1 2.88Å; E284-R288 VanDerWaalsContact CA-O 3.31Å; E284-R288 WeakPolarHBondContact CA-O 3.29Å; E284-L289 HydrophobicContact CG-CD1 3.81Å
285	I	87.4	Confident	88.1	Confident	63 Å²	63	46.7 Å²	46.7	32%	0.323	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	115.1	170.2	-57.2	179.1	0	0	0	108.1	I151 F233 F283 N287 R288 Y290	I151-I285 HydrophobicContact CG2-CD1 4.37Å; F233-I285 HydrophobicContact CD1-CG1 4.14Å; F233-I285 HydrophobicContact CE1-CG1 4.4Å; F283-I285 HydrophobicContact CD2-CD1 4.05Å; F283-I285 HydrophobicContact CD2-CG1 3.87Å; F283-I285 HydrophobicContact CE2-CD1 3.69Å; F283-I285 HydrophobicContact CE2-CG1 4Å; I285-N287 PolarHBondContact O-N 3.47Å; I285-N287 VanDerWaalsContact O-N 3.16Å; I285-R288 PolarHBondContact N-O 2.91Å; I285-R288 PolarHBondContact O-N 3.45Å; I285-Y290 HydrophobicContact CB-CE2 4.09Å; I285-Y290 HydrophobicContact CD1-CE2 4.46Å; I285-Y290 HydrophobicContact CG1-CD2 4.47Å; I285-Y290 HydrophobicContact CG1-CE2 4.33Å
286	G	86.9	Confident	87.4	Confident	79 Å²	79	50.5 Å²	50.5	81%	0.814	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.9	-115.9	-174.5	0	0	0	0	0	110.8
287	N	85.5	Confident	87	Confident	160 Å²	160	55.8 Å²	55.8	86%	0.856	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	8.4	176.5	66.5	-20.7	0	0	0	113.5	I285	I285-N287 PolarHBondContact O-N 3.47Å; I285-N287 VanDerWaalsContact O-N 3.16Å
288	R	88.2	Confident	86.5	Confident	94 Å²	94	55.3 Å²	55.3	36%	0.355	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	137.8	179.1	-68	-170.7	-179.1	-173.8	7.9	111	E75 E284 I285 Y290	E75-R288 IonicContact OE1-CZ 2.57Å; E75-R288 IonicContact OE1-NH1 3.76Å; E75-R288 PolarHBondContact OE1-NH1 3.35Å; E284-R288 VanDerWaalsContact CA-O 3.31Å; E284-R288 WeakPolarHBondContact CA-O 3.29Å; I285-R288 PolarHBondContact N-O 2.91Å; I285-R288 PolarHBondContact O-N 3.45Å; R288-Y290 HydrophobicContact CB-CD2 4.44Å; R288-Y290 HydrophobicContact CB-CE2 3.57Å; R288-Y290 VanDerWaalsContact CD-OH 3.27Å; R288-Y290 WeakPolarHBondContact CD-OH 3.37Å
289	L	90.3	Very high	85.6	Confident	71 Å²	71	60.8 Å²	60.8	37%	0.372	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	129.8	174.2	175.5	65.7	0	0	0	108.9	R282 E284 Y291 A323	R282-L289 HydrophobicContact CG-CD1 4.31Å; E284-L289 HydrophobicContact CG-CD1 3.81Å; L289-Y291 HydrophobicContact CD2-CD1 3.89Å; L289-Y291 HydrophobicContact CD2-CE1 4.01Å; L289-Y291 HydrophobicContact CG-CD1 3.84Å; L289-Y291 HydrophobicContact CG-CE1 4.35Å; L289-A323 HydrophobicContact CD2-CB 3.95Å
290	Y	90.4	Very high	84.8	Confident	13 Å²	13	64.6 Å²	64.6	5%	0.051	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	124.6	177.2	-63.4	-95	0	0	0	107.4	H79 V146 A150 R282 F283 I285 R288	H79-Y290 AromaticContact CE1-CE1 3.55Å; H79-Y290 AromaticContact CE1-CZ 3.62Å; H79-Y290 PolarHBondContact CE1-OH 3.4Å; H79-Y290 AromaticContact NE2-CE1 3.58Å; H79-Y290 AromaticContact NE2-CZ 3.88Å; H79-Y290 PolarHBondContact NE2-OH 3.45Å; V146-Y290 HydrophobicContact CG1-CD1 3.35Å; V146-Y290 HydrophobicContact CG1-CE1 3.82Å; V146-Y290 HydrophobicContact CG1-CG 4.43Å; A150-Y290 HydrophobicContact CB-CD1 3.63Å; A150-Y290 HydrophobicContact CB-CE1 3.61Å; A150-Y290 HydrophobicContact CB-CG 4.35Å; R282-Y290 CarbonylContact C-O 3.44Å; R282-Y290 VanDerWaalsContact CA-O 3.23Å; R282-Y290 WeakPolarHBondContact CA-O 3.43Å; F283-Y290 AromaticContact CD2-CD2 3.89Å; F283-Y290 HydrophobicContact CD2-CD2 3.89Å; F283-Y290 HydrophobicContact CD2-CG 4.07Å; F283-Y290 VanDerWaalsContact CE2-CB 3.49Å; F283-Y290 HydrophobicContact CE2-CD1 4.17Å; F283-Y290 AromaticContact CE2-CD2 3.53Å; F283-Y290 HydrophobicContact CE2-CD2 3.53Å; F283-Y290 HydrophobicContact CE2-CE2 4.39Å; F283-Y290 AromaticContact CE2-CG 3.44Å; F283-Y290 HydrophobicContact CE2-CG 3.44Å; F283-Y290 VanDerWaalsContact CE2-CG 3.44Å; F283-Y290 HydrophobicContact CZ-CD1 4.25Å; F283-Y290 HydrophobicContact CZ-CD2 4.33Å; F283-Y290 AromaticContact CZ-CG 3.77Å; F283-Y290 HydrophobicContact CZ-CG 3.77Å; F283-Y290 PolarHBondContact N-O 3.39Å; F283-Y290 PolarHBondContact O-N 3.39Å; I285-Y290 HydrophobicContact CB-CE2 4.09Å; I285-Y290 HydrophobicContact CD1-CE2 4.46Å; I285-Y290 HydrophobicContact CG1-CD2 4.47Å; I285-Y290 HydrophobicContact CG1-CE2 4.33Å; R288-Y290 HydrophobicContact CB-CD2 4.44Å; R288-Y290 HydrophobicContact CB-CE2 3.57Å; R288-Y290 VanDerWaalsContact CD-OH 3.27Å; R288-Y290 WeakPolarHBondContact CD-OH 3.37Å
291	Y	91.3	Very high	83.9	Confident	78 Å²	78	65.2 Å²	65.2	31%	0.306	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	155.3	174.6	72.1	-72	0	0	0	110.8	S281 L289 N293 W322 A323	S281-Y291 WeakPolarHBondContact O-CA 3.22Å; L289-Y291 HydrophobicContact CD2-CD1 3.89Å; L289-Y291 HydrophobicContact CD2-CE1 4.01Å; L289-Y291 HydrophobicContact CG-CD1 3.84Å; L289-Y291 HydrophobicContact CG-CE1 4.35Å; Y291-N293 HydrophobicContact CD2-CB 4.48Å; Y291-N293 HydrophobicContact CE2-CB 3.94Å; Y291-W322 HydrophobicContact CD2-CB 3.95Å; Y291-W322 HydrophobicContact CE2-CB 4.29Å; Y291-A323 HydrophobicContact CD1-CB 4.4Å; Y291-A323 HydrophobicContact CD2-CB 4.32Å; Y291-A323 HydrophobicContact CE1-CB 3.99Å; Y291-A323 HydrophobicContact CE2-CB 3.91Å
292	T	87.2	Confident	82.4	Confident	8 Å²	8	73.5 Å²	73.5	5%	0.049	40%	0.397	C	S	.	.			trans	-98.4	132.2	169.6	-56.9	0	0	0	0	109.7	G279 L280	G279-T292 WeakPolarHBondContact O-CB 3.49Å; G279-T292 PolarHBondContact O-OG1 3.41Å; L280-T292 HydrophobicContact CD2-CG2 3.73Å
293	N	85.6	Confident	81	Confident	103 Å²	103	74 Å²	74	55%	0.551	41%	0.405	S	S	*	.			trans	-96.8	110.1	178.2	-164.3	22.6	0	0	0	109.2	Y291 W322	Y291-N293 HydrophobicContact CD2-CB 4.48Å; Y291-N293 HydrophobicContact CE2-CB 3.94Å; N293-W322 VanDerWaalsContact OD1-CD1 3.26Å
294	L	83.7	Confident	79.9	Confident	23 Å²	23	74.2 Å²	74.2	12%	0.12	41%	0.406	C	S	.	.			trans	-83.4	137	176	-66.3	173.7	0	0	0	110.1	L280 I301 L311 W322	L280-L294 HydrophobicContact CD1-CD1 4.39Å; L280-L294 HydrophobicContact CD2-CD2 3.89Å; L280-L294 HydrophobicContact CD2-CG 4.44Å; L294-I301 HydrophobicContact CD1-CD1 4.04Å; L294-I301 HydrophobicContact CD1-CG1 4.34Å; L294-L311 HydrophobicContact CD1-CD1 3.63Å; L294-W322 HydrophobicContact CB-CD2 4.5Å; L294-W322 HydrophobicContact CB-CZ2 3.91Å; L294-W322 HydrophobicContact CD1-CH2 3.76Å; L294-W322 HydrophobicContact CD1-CZ2 3.76Å; L294-W322 HydrophobicContact CD1-CZ3 4.21Å; L294-W322 HydrophobicContact CG-CZ2 4.31Å; L294-W322 PolarHBondContact O-NE1 2.85Å
295	P	79	Confident	79.2	Confident	69 Å²	69	75.5 Å²	75.5	45%	0.448	41%	0.412	S	S	.	.			trans	-53.5	151.3	173.7	-21.9	30.7	0	0	0	111.9	D297 S298 R315	P295-D297 WeakPolarHBondContact CB-OD1 2.97Å; P295-D297 PolarHBondContact O-N 3.08Å; P295-S298 WeakPolarHBondContact CB-OG 3.42Å; P295-S298 WeakPolarHBondContact CD-OG 3.38Å; P295-R315 PolarHBondContact O-NH2 3.36Å
296	S	75.2	Confident	78.9	Confident	97 Å²	97	77.5 Å²	77.5	68%	0.678	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-25.6	-173.8	-57.7	0	0	0	0	112.5
297	D	76.5	Confident	78.9	Confident	132 Å²	132	74.1 Å²	74.1	71%	0.706	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-9.1	-174.4	55.4	-28.7	0	0	0	113.9	P295 E299	P295-D297 WeakPolarHBondContact CB-OD1 2.97Å; P295-D297 PolarHBondContact O-N 3.08Å; D297-E299 PolarHBondContact O-N 2.77Å
298	S	73	Confident	78.9	Confident	31 Å²	31	67.3 Å²	67.3	22%	0.217	35%	0.353	C	S	.	.			trans	-67.2	102.3	179.3	-47.4	0	0	0	0	111.2	P295 I300 L311 R315	P295-S298 WeakPolarHBondContact CB-OG 3.42Å; P295-S298 WeakPolarHBondContact CD-OG 3.38Å; S298-I300 VanDerWaalsContact C-N 3.33Å; S298-L311 VanDerWaalsContact O-CD2 3.3Å; S298-L311 WeakPolarHBondContact O-CD2 3.28Å; S298-R315 PolarHBondContact O-NH1 3.3Å; S298-R315 PolarHBondContact O-NH2 2.97Å
299	E	67.3	Low	79	Confident	160 Å²	160	68 Å²	68	75%	0.748	36%	0.359	S	S	*	.	S	Bend	trans	-73.1	-28.9	179.4	-67.2	-167.6	161.6	0	0	113.1	D297	D297-E299 PolarHBondContact O-N 2.77Å
300	I	66.5	Low	79.1	Confident	90 Å²	90	64.9 Å²	64.9	46%	0.462	34%	0.343	S	S	.	.	S	Bend	trans	-141.3	142.2	-176.5	-55.7	-179.1	0	0	0	107.3	S298 A308	S298-I300 VanDerWaalsContact C-N 3.33Å; I300-A308 HydrophobicContact CB-CB 4.48Å; I300-A308 HydrophobicContact CD1-CB 4.33Å; I300-A308 HydrophobicContact CG1-CB 4.06Å; I300-A308 HydrophobicContact CG2-CB 3.92Å
301	I	69.5	Low	79.1	Confident	39 Å²	39	64.4 Å²	64.4	20%	0.2	34%	0.342	C	S	.	.			trans	-82.7	129.2	166.3	-63.6	148	0	0	0	106.6	L280 L294 G303 S304 L311	L280-I301 HydrophobicContact CD1-CD1 3.4Å; L280-I301 HydrophobicContact CD1-CG1 4.31Å; L294-I301 HydrophobicContact CD1-CD1 4.04Å; L294-I301 HydrophobicContact CD1-CG1 4.34Å; I301-G303 PolarHBondContact O-N 2.56Å; I301-S304 WeakPolarHBondContact CA-OG 3.34Å; I301-S304 WeakPolarHBondContact CB-OG 3.16Å; I301-S304 PolarHBondContact N-OG 3Å; I301-S304 WeakPolarHBondContact O-CB 3.3Å; I301-S304 PolarHBondContact O-N 3.01Å; I301-S304 PolarHBondContact O-OG 2.92Å; I301-L311 HydrophobicContact CD1-CD1 4.21Å; I301-L311 HydrophobicContact CD1-CD2 4.47Å; I301-L311 HydrophobicContact CG1-CD2 4.28Å
302	E	63.3	Low	79.1	Confident	175 Å²	175	63.6 Å²	63.6	82%	0.818	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	129.4	-178.1	-161.1	173.4	-174.4	0	0	111.3	S304	E302-S304 VanDerWaalsContact C-N 3.35Å
303	G	64.7	Low	79.4	Confident	18 Å²	18	67.2 Å²	67.2	19%	0.186	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.7	10.2	-173	0	0	0	0	0	115.4	Q34 I301 E305	Q34-G303 CarbonylContact O-C 3.57Å; Q34-G303 WeakPolarHBondContact O-CA 3.41Å; I301-G303 PolarHBondContact O-N 2.56Å; G303-E305 VanDerWaalsContact CA-OE2 3.26Å; G303-E305 WeakPolarHBondContact CA-OE2 3.43Å; G303-E305 PolarHBondContact N-OE1 2.92Å
304	S	72.8	Confident	79.8	Confident	5 Å²	5	62.5 Å²	62.5	4%	0.035	34%	0.339	C	S	.	.			trans	-106.8	17.7	176.8	74.6	0	0	0	0	113.7	I301 E302 D306 H307 A308	I301-S304 WeakPolarHBondContact CA-OG 3.34Å; I301-S304 WeakPolarHBondContact CB-OG 3.16Å; I301-S304 PolarHBondContact N-OG 3Å; I301-S304 WeakPolarHBondContact O-CB 3.3Å; I301-S304 PolarHBondContact O-N 3.01Å; I301-S304 PolarHBondContact O-OG 2.92Å; E302-S304 VanDerWaalsContact C-N 3.35Å; S304-D306 VanDerWaalsContact C-N 3.27Å; S304-D306 PolarHBondContact O-N 3.1Å; S304-D306 VanDerWaalsContact O-N 3.14Å; S304-H307 VanDerWaalsContact CB-NE2 3.28Å; S304-H307 WeakPolarHBondContact CB-NE2 3.21Å; S304-H307 CarbonylContact O-C 3.56Å; S304-H307 VanDerWaalsContact O-C 3.29Å; S304-H307 PolarHBondContact O-N 3.2Å; S304-A308 PolarHBondContact O-N 3.11Å
305	E	78.8	Confident	80.2	Confident	78 Å²	78	62.7 Å²	62.7	36%	0.364	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-55.7	-41.3	-167.6	-62.3	77.7	-168.7	0	0	112.4	G303 H307 A308	G303-E305 VanDerWaalsContact CA-OE2 3.26Å; G303-E305 WeakPolarHBondContact CA-OE2 3.43Å; G303-E305 PolarHBondContact N-OE1 2.92Å; E305-H307 PolarHBondContact O-N 3.1Å; E305-H307 VanDerWaalsContact O-N 3.12Å; E305-A308 PolarHBondContact O-N 3.26Å
306	D	80.7	Confident	80.8	Confident	105 Å²	105	65.6 Å²	65.6	56%	0.561	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-63.5	-17.8	179.4	-75.1	-21.5	0	0	0	114.1	Q34 S304	Q34-D306 PolarHBondContact NE2-OD2 3.43Å; S304-D306 VanDerWaalsContact C-N 3.27Å; S304-D306 PolarHBondContact O-N 3.1Å; S304-D306 VanDerWaalsContact O-N 3.14Å
307	H	87	Confident	81.7	Confident	7 Å²	7	63.2 Å²	63.2	3%	0.032	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-136.9	19.6	-177	53.4	-82.8	0	0	0	112.9	D239 H241 S304 E305 H309 M310 W333 Y336	D239-H307 IonicContact OD1-CD2 3.6Å; D239-H307 IonicContact OD1-NE2 3.44Å; H241-H307 HydrophobicContact CB-CB 4.49Å; H241-H307 AromaticContact CD2-CE1 3.61Å; H241-H307 AromaticContact CD2-NE2 3.38Å; H241-H307 PolarHBondContact CD2-NE2 2.83Å; H241-H307 AromaticContact CG-CE1 3.38Å; H241-H307 AromaticContact CG-ND1 3.88Å; H241-H307 AromaticContact CG-NE2 3.53Å; H241-H307 AromaticContact ND1-CE1 3.62Å; S304-H307 VanDerWaalsContact CB-NE2 3.28Å; S304-H307 WeakPolarHBondContact CB-NE2 3.21Å; S304-H307 CarbonylContact O-C 3.56Å; S304-H307 VanDerWaalsContact O-C 3.29Å; S304-H307 PolarHBondContact O-N 3.2Å; E305-H307 PolarHBondContact O-N 3.1Å; E305-H307 VanDerWaalsContact O-N 3.12Å; H307-H309 PolarHBondContact O-N 3.09Å; H307-M310 HydrophobicContact CB-CG 4.28Å; H307-M310 VanDerWaalsContact O-CB 3.28Å; H307-M310 WeakPolarHBondContact O-CB 3.41Å; H307-M310 WeakPolarHBondContact O-CG 3.47Å; H307-M310 PolarHBondContact O-N 3.47Å; H307-W333 HydrophobicContact CB-CH2 4.5Å; H307-W333 AromaticContact CD2-CH2 3.79Å; H307-Y336 HydrophobicContact CB-CE2 3.91Å
308	A	86.2	Confident	82.6	Confident	18 Å²	18	57.5 Å²	57.5	15%	0.149	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-29.8	-179.6	0	0	0	0	0	112.8	I300 S304 E305 M310 L311 P312	I300-A308 HydrophobicContact CB-CB 4.48Å; I300-A308 HydrophobicContact CD1-CB 4.33Å; I300-A308 HydrophobicContact CG1-CB 4.06Å; I300-A308 HydrophobicContact CG2-CB 3.92Å; S304-A308 PolarHBondContact O-N 3.11Å; E305-A308 PolarHBondContact O-N 3.26Å; A308-M310 PolarHBondContact O-N 2.77Å; A308-M310 VanDerWaalsContact O-N 3.11Å; A308-L311 PolarHBondContact O-N 3.46Å; A308-P312 WeakPolarHBondContact O-CD 3.4Å
309	H	90.5	Very high	83.5	Confident	107 Å²	107	66.7 Å²	66.7	50%	0.495	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-17.3	175.8	71.8	-85.6	0	0	0	114.3	H307 L313 Y336	H307-H309 PolarHBondContact O-N 3.09Å; H309-L313 WeakPolarHBondContact O-CG 3.28Å; H309-Y336 AromaticContact CE1-CD2 3.97Å; H309-Y336 AromaticContact CE1-CE2 3.94Å; H309-Y336 AromaticContact NE2-CD2 3.97Å
310	M	92.7	Very high	84.4	Confident	6 Å²	6	63.2 Å²	63.2	3%	0.03	32%	0.315	C	S	.	.	H	α-helix	trans	-74	-31.6	178.2	-65	-63.3	-71.3	0	0	112.3	H307 A308 L313 M314 L332 W333 Y336	H307-M310 HydrophobicContact CB-CG 4.28Å; H307-M310 VanDerWaalsContact O-CB 3.28Å; H307-M310 WeakPolarHBondContact O-CB 3.41Å; H307-M310 WeakPolarHBondContact O-CG 3.47Å; H307-M310 PolarHBondContact O-N 3.47Å; A308-M310 PolarHBondContact O-N 2.77Å; A308-M310 VanDerWaalsContact O-N 3.11Å; M310-L313 PolarHBondContact O-N 2.87Å; M310-L313 HydrophobicContact SD-CD1 4.41Å; M310-M314 WeakPolarHBondContact O-CG 3.19Å; M310-M314 PolarHBondContact O-N 2.85Å; M310-L332 HydrophobicContact CE-CB 3.98Å; M310-W333 HydrophobicContact CB-CH2 3.9Å; M310-W333 HydrophobicContact CB-CZ2 3.9Å; M310-W333 HydrophobicContact CE-CD2 3.7Å; M310-W333 HydrophobicContact CE-CE3 3.78Å; M310-W333 HydrophobicContact CE-CG 4.17Å; M310-W333 HydrophobicContact CE-CH2 4.41Å; M310-W333 HydrophobicContact CE-CZ2 4.3Å; M310-W333 HydrophobicContact CE-CZ3 4.14Å; M310-W333 HydrophobicContact CG-CH2 3.82Å; M310-W333 HydrophobicContact CG-CZ2 4.23Å; M310-W333 HydrophobicContact CG-CZ3 3.97Å; M310-Y336 HydrophobicContact CE-CG 4.4Å; M310-Y336 HydrophobicContact CG-CD2 4.27Å; M310-Y336 HydrophobicContact SD-CD2 4.06Å; M310-Y336 HydrophobicContact SD-CG 4.24Å
311	L	90.6	Very high	85.6	Confident	4 Å²	4	61.9 Å²	61.9	2%	0.021	31%	0.314	C	S	.	.	H	α-helix	trans	-64.3	-48.7	-175.7	178.5	67.1	0	0	0	112.6	L294 S298 I301 A308 L313 M314 R315 W322	L294-L311 HydrophobicContact CD1-CD1 3.63Å; S298-L311 VanDerWaalsContact O-CD2 3.3Å; S298-L311 WeakPolarHBondContact O-CD2 3.28Å; I301-L311 HydrophobicContact CD1-CD1 4.21Å; I301-L311 HydrophobicContact CD1-CD2 4.47Å; I301-L311 HydrophobicContact CG1-CD2 4.28Å; A308-L311 PolarHBondContact O-N 3.46Å; L311-L313 VanDerWaalsContact C-N 3.33Å; L311-L313 PolarHBondContact O-N 2.89Å; L311-M314 HydrophobicContact CD1-CE 4.47Å; L311-M314 PolarHBondContact O-N 2.85Å; L311-R315 PolarHBondContact O-N 3.02Å; L311-W322 HydrophobicContact CD1-CH2 3.61Å; L311-W322 HydrophobicContact CD1-CZ2 3.92Å
312	P	90.4	Very high	86.7	Confident	61 Å²	61	60.4 Å²	60.4	40%	0.396	31%	0.306	S	S	.	.	H	α-helix	trans	-58	-42	173.9	-25.5	34.5	0	0	0	113.2	A308 M314 R315 D316	A308-P312 WeakPolarHBondContact O-CD 3.4Å; P312-M314 VanDerWaalsContact C-N 3.32Å; P312-M314 PolarHBondContact O-N 2.75Å; P312-R315 PolarHBondContact O-N 3.03Å; P312-D316 PolarHBondContact O-N 3.13Å
313	L	93.4	Very high	88.2	Confident	83 Å²	83	53.6 Å²	53.6	44%	0.435	28%	0.279	S	S	.	.	H	α-helix	trans	-61	-41.8	178.8	-64.5	176.5	0	0	0	111.9	H309 M310 L311 L317 L332	H309-L313 WeakPolarHBondContact O-CG 3.28Å; M310-L313 PolarHBondContact O-N 2.87Å; M310-L313 HydrophobicContact SD-CD1 4.41Å; L311-L313 VanDerWaalsContact C-N 3.33Å; L311-L313 PolarHBondContact O-N 2.89Å; L313-L317 VanDerWaalsContact O-CB 3.31Å; L313-L317 WeakPolarHBondContact O-CB 3.21Å; L313-L317 PolarHBondContact O-N 3.1Å; L313-L332 HydrophobicContact CB-CD1 4.19Å
314	M	93.7	Very high	89.6	Confident	4 Å²	4	53.9 Å²	53.9	2%	0.02	28%	0.283	C	S	.	.	H	α-helix	trans	-69	-40.1	175.5	-69.5	-173.3	-64.3	0	0	112	R238 M310 L311 P312 L317 L318 W322 T329 L332 W333	R238-M314 HydrophobicContact CB-SD 4.07Å; R238-M314 HydrophobicContact CG-SD 4.47Å; R238-M314 WeakPolarHBondContact O-CE 3.2Å; M310-M314 WeakPolarHBondContact O-CG 3.19Å; M310-M314 PolarHBondContact O-N 2.85Å; L311-M314 HydrophobicContact CD1-CE 4.47Å; L311-M314 PolarHBondContact O-N 2.85Å; P312-M314 VanDerWaalsContact C-N 3.32Å; P312-M314 PolarHBondContact O-N 2.75Å; M314-L317 WeakPolarHBondContact O-CB 3.09Å; M314-L317 PolarHBondContact O-N 2.81Å; M314-L318 VanDerWaalsContact O-CB 3.31Å; M314-L318 WeakPolarHBondContact O-CB 3.43Å; M314-L318 VanDerWaalsContact O-CG 3.22Å; M314-L318 WeakPolarHBondContact O-CG 3.43Å; M314-L318 PolarHBondContact O-N 3.32Å; M314-W322 HydrophobicContact CB-CH2 4.34Å; M314-W322 HydrophobicContact CB-CZ3 4.42Å; M314-T329 HydrophobicContact CG-CG2 4.22Å; M314-L332 HydrophobicContact CG-CD1 4.45Å; M314-W333 HydrophobicContact CE-CZ2 4.17Å; M314-W333 HydrophobicContact SD-CZ2 4.48Å; M314-W333 PolarHBondContact SD-NE1 2.89Å; M314-W333 VanDerWaalsContact SD-NE1 3.41Å
315	R	91.9	Very high	90.7	Very high	28 Å²	28	57.8 Å²	57.8	11%	0.106	30%	0.297	C	S	.	.	H	α-helix	trans	-60.9	-46.3	177.1	-83.1	-170.9	175.8	138.2	4.2	112.7	P295 S298 L311 P312 L317 L318 R319 N320 W322	P295-R315 PolarHBondContact O-NH2 3.36Å; S298-R315 PolarHBondContact O-NH1 3.3Å; S298-R315 PolarHBondContact O-NH2 2.97Å; L311-R315 PolarHBondContact O-N 3.02Å; P312-R315 PolarHBondContact O-N 3.03Å; R315-L317 VanDerWaalsContact C-N 3.27Å; R315-L317 PolarHBondContact O-N 2.91Å; R315-L318 CarbonylContact O-C 3.6Å; R315-L318 PolarHBondContact O-N 2.73Å; R315-R319 WeakPolarHBondContact O-CA 3.44Å; R315-R319 PolarHBondContact O-N 3.39Å; R315-N320 WeakPolarHBondContact CD-OD1 3Å; R315-N320 WeakPolarHBondContact CG-OD1 3.45Å; R315-N320 PolarHBondContact O-N 2.96Å; R315-W322 HydrophobicContact CG-CH2 4.11Å; R315-W322 HydrophobicContact CG-CZ2 3.6Å
316	D	92.3	Very high	91.6	Very high	130 Å²	130	56.3 Å²	56.3	70%	0.695	29%	0.292	S	S	*	.	H	α-helix	trans	-59.3	-43.9	176.9	-76.6	-9.1	0	0	0	110.9	P312 R319	P312-D316 PolarHBondContact O-N 3.13Å; D316-R319 PolarHBondContact O-N 2.75Å
317	L	94.7	Very high	92.5	Very high	47 Å²	47	52.3 Å²	52.3	25%	0.246	27%	0.272	C	S	.	.	H	α-helix	trans	-64.9	-39.9	179.2	-171	105.5	0	0	0	112.8	L313 M314 R315 N326 K328 T329	L313-L317 VanDerWaalsContact O-CB 3.31Å; L313-L317 WeakPolarHBondContact O-CB 3.21Å; L313-L317 PolarHBondContact O-N 3.1Å; M314-L317 WeakPolarHBondContact O-CB 3.09Å; M314-L317 PolarHBondContact O-N 2.81Å; R315-L317 VanDerWaalsContact C-N 3.27Å; R315-L317 PolarHBondContact O-N 2.91Å; L317-N326 HydrophobicContact CD2-CB 3.83Å; L317-N326 WeakPolarHBondContact CD2-ND2 3.48Å; L317-N326 WeakPolarHBondContact CG-ND2 3.46Å; L317-N326 PolarHBondContact O-ND2 3.42Å; L317-K328 HydrophobicContact CD1-CB 3.7Å; L317-K328 HydrophobicContact CD1-CG 3.33Å; L317-K328 HydrophobicContact CD2-CB 3.96Å; L317-K328 HydrophobicContact CD2-CG 4.39Å; L317-K328 HydrophobicContact CG-CB 4.39Å; L317-K328 HydrophobicContact CG-CG 4.46Å; L317-T329 HydrophobicContact CD2-CG2 3.41Å; L317-T329 VanDerWaalsContact CD2-CG2 3.41Å
318	L	94	Very high	93	Very high	12 Å²	12	53.4 Å²	53.4	6%	0.063	28%	0.277	C	S	.	.	H	α-helix	trans	-90.1	-8.3	-177.3	-64	173.3	0	0	0	113.1	M314 R315 N320 S321 W322 N326 T329	M314-L318 VanDerWaalsContact O-CB 3.31Å; M314-L318 WeakPolarHBondContact O-CB 3.43Å; M314-L318 VanDerWaalsContact O-CG 3.22Å; M314-L318 WeakPolarHBondContact O-CG 3.43Å; M314-L318 PolarHBondContact O-N 3.32Å; R315-L318 CarbonylContact O-C 3.6Å; R315-L318 PolarHBondContact O-N 2.73Å; L318-N320 PolarHBondContact O-N 3.42Å; L318-S321 WeakPolarHBondContact O-CB 3.36Å; L318-S321 PolarHBondContact O-N 2.94Å; L318-W322 HydrophobicContact CD1-CD2 4.31Å; L318-W322 HydrophobicContact CD1-CE3 3.54Å; L318-W322 HydrophobicContact CD1-CH2 4.47Å; L318-W322 HydrophobicContact CD1-CZ3 3.64Å; L318-N326 HydrophobicContact CD2-CB 3.71Å; L318-T329 HydrophobicContact CD1-CG2 4.24Å; L318-T329 HydrophobicContact CD2-CG2 4.17Å; L318-T329 HydrophobicContact CG-CG2 4.23Å
319	R	92	Very high	93.5	Very high	224 Å²	224	52.6 Å²	52.6	85%	0.845	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	43.9	-173.1	-54.2	-178.6	-178.9	-156.4	-1.1	112	R315 D316 S321	R315-R319 WeakPolarHBondContact O-CA 3.44Å; R315-R319 PolarHBondContact O-N 3.39Å; D316-R319 PolarHBondContact O-N 2.75Å; R319-S321 PolarHBondContact O-N 2.97Å
320	N	86.2	Confident	93.9	Very high	86 Å²	86	47.5 Å²	47.5	46%	0.46	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	11.2	-173.6	-67.3	-35.2	0	0	0	116	R315 L318 W322	R315-N320 WeakPolarHBondContact CD-OD1 3Å; R315-N320 WeakPolarHBondContact CG-OD1 3.45Å; R315-N320 PolarHBondContact O-N 2.96Å; L318-N320 PolarHBondContact O-N 3.42Å; N320-W322 PolarHBondContact O-N 3.04Å
321	S	92.2	Very high	94.2	Very high	62 Å²	62	47.2 Å²	47.2	43%	0.434	25%	0.245	S	C	.	.			trans	-96.2	82.6	175.4	174.3	0	0	0	0	110.7	L318 R319 A323 G324	L318-S321 WeakPolarHBondContact O-CB 3.36Å; L318-S321 PolarHBondContact O-N 2.94Å; R319-S321 PolarHBondContact O-N 2.97Å; S321-A323 PolarHBondContact O-N 2.87Å; S321-G324 PolarHBondContact O-N 2.82Å
322	W	92.9	Very high	94.5	Very high	8 Å²	8	48.8 Å²	48.8	3%	0.03	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-26.2	178.5	-61.3	103	0	0	0	113.3	R238 Y291 N293 L294 L311 M314 R315 L318 N320 G324	R238-W322 PolarHBondContact NH1-O 2.87Å; R238-W322 PolarHBondContact NH2-O 2.72Å; Y291-W322 HydrophobicContact CD2-CB 3.95Å; Y291-W322 HydrophobicContact CE2-CB 4.29Å; N293-W322 VanDerWaalsContact OD1-CD1 3.26Å; L294-W322 HydrophobicContact CB-CD2 4.5Å; L294-W322 HydrophobicContact CB-CZ2 3.91Å; L294-W322 HydrophobicContact CD1-CH2 3.76Å; L294-W322 HydrophobicContact CD1-CZ2 3.76Å; L294-W322 HydrophobicContact CD1-CZ3 4.21Å; L294-W322 HydrophobicContact CG-CZ2 4.31Å; L294-W322 PolarHBondContact O-NE1 2.85Å; L311-W322 HydrophobicContact CD1-CH2 3.61Å; L311-W322 HydrophobicContact CD1-CZ2 3.92Å; M314-W322 HydrophobicContact CB-CH2 4.34Å; M314-W322 HydrophobicContact CB-CZ3 4.42Å; R315-W322 HydrophobicContact CG-CH2 4.11Å; R315-W322 HydrophobicContact CG-CZ2 3.6Å; L318-W322 HydrophobicContact CD1-CD2 4.31Å; L318-W322 HydrophobicContact CD1-CE3 3.54Å; L318-W322 HydrophobicContact CD1-CH2 4.47Å; L318-W322 HydrophobicContact CD1-CZ3 3.64Å; N320-W322 PolarHBondContact O-N 3.04Å; W322-G324 PolarHBondContact O-N 3.15Å
323	A	94	Very high	94.8	Very high	32 Å²	32	46 Å²	46	26%	0.264	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-23	173.3	0	0	0	0	0	113.6	R282 L289 Y291 S321	R282-A323 PolarHBondContact NH2-O 3.04Å; L289-A323 HydrophobicContact CD2-CB 3.95Å; Y291-A323 HydrophobicContact CD1-CB 4.4Å; Y291-A323 HydrophobicContact CD2-CB 4.32Å; Y291-A323 HydrophobicContact CE1-CB 3.99Å; Y291-A323 HydrophobicContact CE2-CB 3.91Å; S321-A323 PolarHBondContact O-N 2.87Å
324	G	94.8	Very high	95	Very high	25 Å²	25	42 Å²	42	26%	0.258	21%	0.214	S	C	.	.	S	Bend	trans	-62.5	156.4	-177.3	0	0	0	0	0	112.6	R238 R282 S321 W322	R238-G324 PolarHBondContact NH2-O 2.8Å; R282-G324 PolarHBondContact NE-O 2.73Å; R282-G324 VanDerWaalsContact NE-O 3.08Å; S321-G324 PolarHBondContact O-N 2.82Å; W322-G324 PolarHBondContact O-N 3.15Å
325	Y	96.7	Very high	95.2	Very high	86 Å²	86	42 Å²	42	34%	0.337	21%	0.214	S	C	.	.			trans	-102.1	117.3	171.7	-179.2	-132.2	0	0	0	110.6	K234 E236 P327	K234-Y325 HydrophobicContact CB-CD1 4.1Å; K234-Y325 HydrophobicContact CB-CD2 3.81Å; K234-Y325 HydrophobicContact CB-CE1 4.01Å; K234-Y325 HydrophobicContact CB-CE2 3.75Å; K234-Y325 HydrophobicContact CB-CG 3.99Å; K234-Y325 HydrophobicContact CD-CD1 3.9Å; K234-Y325 HydrophobicContact CD-CE1 4.22Å; K234-Y325 HydrophobicContact CD-CG 4.23Å; K234-Y325 HydrophobicContact CG-CD1 4.14Å; K234-Y325 HydrophobicContact CG-CE1 3.98Å; K234-Y325 HydrophobicContact CG-CG 4.49Å; K234-Y325 VanDerWaalsContact O-CD2 3.28Å; K234-Y325 WeakPolarHBondContact O-CD2 3.39Å; K234-Y325 VanDerWaalsContact O-CE2 3.25Å; K234-Y325 WeakPolarHBondContact O-CE2 3.35Å; E236-Y325 HydrophobicContact CG-CD2 4.18Å; E236-Y325 HydrophobicContact CG-CE2 4.19Å; E236-Y325 WeakPolarHBondContact OE1-CA 3.41Å; E236-Y325 WeakPolarHBondContact OE1-CD2 3.5Å; Y325-P327 HydrophobicContact CE1-CG 4.19Å; Y325-P327 HydrophobicContact CE2-CB 4.06Å; Y325-P327 HydrophobicContact CE2-CG 4.25Å
326	N	97.6	Very high	95.4	Very high	48 Å²	48	42 Å²	42	26%	0.257	22%	0.215	S	C	.	.			trans	-143.4	94.2	171.8	-163.7	-23.4	0	0	0	111.3	E236 L317 L318 K328 T329	E236-N326 VanDerWaalsContact CD-O 3.31Å; E236-N326 PolarHBondContact OE1-N 3.37Å; L317-N326 HydrophobicContact CD2-CB 3.83Å; L317-N326 WeakPolarHBondContact CD2-ND2 3.48Å; L317-N326 WeakPolarHBondContact CG-ND2 3.46Å; L317-N326 PolarHBondContact O-ND2 3.42Å; L318-N326 HydrophobicContact CD2-CB 3.71Å; N326-K328 PolarHBondContact O-N 3.5Å; N326-K328 VanDerWaalsContact OD1-CB 3.26Å; N326-K328 WeakPolarHBondContact OD1-CB 3.44Å; N326-K328 PolarHBondContact OD1-N 3.22Å; N326-T329 PolarHBondContact O-N 2.89Å; N326-T329 VanDerWaalsContact O-N 3.09Å; N326-T329 PolarHBondContact O-OG1 2.65Å; N326-T329 VanDerWaalsContact O-OG1 3.05Å
327	P	97.9	Very high	95.6	Very high	21 Å²	21	35.9 Å²	35.9	14%	0.136	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-6.1	-175.8	26.3	-33.1	0	0	0	114.2	E230 Y325 T329 N330 V331 N371	E230-P327 HydrophobicContact CG-CB 4.12Å; Y325-P327 HydrophobicContact CE1-CG 4.19Å; Y325-P327 HydrophobicContact CE2-CB 4.06Å; Y325-P327 HydrophobicContact CE2-CG 4.25Å; P327-T329 PolarHBondContact O-N 2.75Å; P327-N330 WeakPolarHBondContact O-CB 3.45Å; P327-N330 PolarHBondContact O-N 3.18Å; P327-N330 VanDerWaalsContact O-N 3.12Å; P327-V331 PolarHBondContact O-N 2.91Å; P327-N371 CarbonylContact C-O 3.57Å
328	K	98.1	Very high	95.6	Very high	30 Å²	30	33.6 Å²	33.6	13%	0.13	17%	0.17	C	C	.	.	H	α-helix	trans	-61.3	-24.4	170.2	-176.1	76.4	-179.3	-160.6	0	111.7	L317 N326 N330 V331 L332 E368 C370 N371	L317-K328 HydrophobicContact CD1-CB 3.7Å; L317-K328 HydrophobicContact CD1-CG 3.33Å; L317-K328 HydrophobicContact CD2-CB 3.96Å; L317-K328 HydrophobicContact CD2-CG 4.39Å; L317-K328 HydrophobicContact CG-CB 4.39Å; L317-K328 HydrophobicContact CG-CG 4.46Å; N326-K328 PolarHBondContact O-N 3.5Å; N326-K328 VanDerWaalsContact OD1-CB 3.26Å; N326-K328 WeakPolarHBondContact OD1-CB 3.44Å; N326-K328 PolarHBondContact OD1-N 3.22Å; K328-N330 VanDerWaalsContact C-N 3.33Å; K328-N330 PolarHBondContact O-N 2.91Å; K328-V331 HydrophobicContact CD-CB 4.25Å; K328-V331 HydrophobicContact CD-CG1 4.46Å; K328-V331 WeakPolarHBondContact O-CB 3.33Å; K328-V331 PolarHBondContact O-N 3.12Å; K328-V331 VanDerWaalsContact O-N 3.12Å; K328-L332 WeakPolarHBondContact O-CG 3.48Å; K328-L332 PolarHBondContact O-N 2.9Å; K328-E368 PolarHBondContact NZ-O 3.31Å; K328-C370 WeakPolarHBondContact CD-O 3.47Å; K328-C370 VanDerWaalsContact CE-O 3.25Å; K328-C370 WeakPolarHBondContact CE-O 3.47Å; K328-C370 PolarHBondContact NZ-O 3.36Å; K328-N371 WeakPolarHBondContact CA-O 3.36Å; K328-N371 PolarHBondContact N-O 3.43Å; K328-N371 VanDerWaalsContact N-O 3.09Å
329	T	97.8	Very high	95.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-58.2	-43.4	171.2	56.2	0	0	0	0	111.7	E236 M314 L317 L318 N326 P327 V331 L332 W333	E236-T329 WeakPolarHBondContact CB-OG1 3.47Å; E236-T329 VanDerWaalsContact CD-OG1 3.26Å; E236-T329 VanDerWaalsContact CG-OG1 3.25Å; E236-T329 WeakPolarHBondContact CG-OG1 3.24Å; E236-T329 WeakPolarHBondContact OE2-CB 3.38Å; E236-T329 WeakPolarHBondContact OE2-CG2 3.19Å; E236-T329 PolarHBondContact OE2-OG1 2.93Å; M314-T329 HydrophobicContact CG-CG2 4.22Å; L317-T329 HydrophobicContact CD2-CG2 3.41Å; L317-T329 VanDerWaalsContact CD2-CG2 3.41Å; L318-T329 HydrophobicContact CD1-CG2 4.24Å; L318-T329 HydrophobicContact CD2-CG2 4.17Å; L318-T329 HydrophobicContact CG-CG2 4.23Å; N326-T329 PolarHBondContact O-N 2.89Å; N326-T329 VanDerWaalsContact O-N 3.09Å; N326-T329 PolarHBondContact O-OG1 2.65Å; N326-T329 VanDerWaalsContact O-OG1 3.05Å; P327-T329 PolarHBondContact O-N 2.75Å; T329-V331 VanDerWaalsContact C-N 3.31Å; T329-V331 PolarHBondContact O-N 2.67Å; T329-L332 WeakPolarHBondContact O-CB 3.5Å; T329-L332 PolarHBondContact O-N 3.06Å; T329-W333 PolarHBondContact O-N 3.1Å; T329-W333 VanDerWaalsContact O-N 3.15Å
330	N	98.2	Very high	95.7	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.4	-39.1	174.4	-68.6	-26.6	0	0	0	111.8	L226 E230 F235 E236 H237 P327 K328 W333 I334	L226-N330 HydrophobicContact CD1-CB 4.34Å; E230-N330 WeakPolarHBondContact CG-ND2 3.24Å; E230-N330 WeakPolarHBondContact OE1-CB 3.31Å; E230-N330 PolarHBondContact OE1-ND2 3.49Å; F235-N330 PolarHBondContact O-ND2 3.26Å; E236-N330 VanDerWaalsContact CA-OD1 3.3Å; E236-N330 WeakPolarHBondContact CA-OD1 2.97Å; H237-N330 PolarHBondContact N-OD1 3.11Å; P327-N330 WeakPolarHBondContact O-CB 3.45Å; P327-N330 PolarHBondContact O-N 3.18Å; P327-N330 VanDerWaalsContact O-N 3.12Å; K328-N330 VanDerWaalsContact C-N 3.33Å; K328-N330 PolarHBondContact O-N 2.91Å; N330-W333 PolarHBondContact O-N 2.81Å; N330-I334 VanDerWaalsContact O-CG1 3.31Å; N330-I334 WeakPolarHBondContact O-CG1 3.25Å; N330-I334 PolarHBondContact O-N 3.14Å
331	V	98.2	Very high	96.1	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.006	13%	0.128	C	C	.	.	H	α-helix	trans	-63.9	-42.8	177.3	178.3	0	0	0	0	111.6	P327 K328 T329 W333 I334 A335 V367 C370 S372	P327-V331 PolarHBondContact O-N 2.91Å; K328-V331 HydrophobicContact CD-CB 4.25Å; K328-V331 HydrophobicContact CD-CG1 4.46Å; K328-V331 WeakPolarHBondContact O-CB 3.33Å; K328-V331 PolarHBondContact O-N 3.12Å; K328-V331 VanDerWaalsContact O-N 3.12Å; T329-V331 VanDerWaalsContact C-N 3.31Å; T329-V331 PolarHBondContact O-N 2.67Å; V331-W333 VanDerWaalsContact C-N 3.27Å; V331-W333 PolarHBondContact O-N 2.68Å; V331-I334 PolarHBondContact O-N 2.98Å; V331-A335 WeakPolarHBondContact O-CB 2.98Å; V331-A335 PolarHBondContact O-N 3.1Å; V331-V367 HydrophobicContact CG1-CG1 3.75Å; V331-V367 WeakPolarHBondContact CG1-O 3.31Å; V331-C370 HydrophobicContact CG1-CB 4.15Å; V331-C370 WeakPolarHBondContact CG1-O 3.26Å; V331-C370 HydrophobicContact CG2-CB 4.37Å; V331-S372 VanDerWaalsContact CG2-C 3.45Å
332	L	97.4	Very high	96.2	Very high	37 Å²	37	19 Å²	19	19%	0.194	11%	0.108	C	C	.	.	H	α-helix	trans	-55.9	-45.9	174.6	-71.3	173.9	0	0	0	110.5	M310 L313 M314 K328 T329 A335 Y336	M310-L332 HydrophobicContact CE-CB 3.98Å; L313-L332 HydrophobicContact CB-CD1 4.19Å; M314-L332 HydrophobicContact CG-CD1 4.45Å; K328-L332 WeakPolarHBondContact O-CG 3.48Å; K328-L332 PolarHBondContact O-N 2.9Å; T329-L332 WeakPolarHBondContact O-CB 3.5Å; T329-L332 PolarHBondContact O-N 3.06Å; L332-A335 PolarHBondContact O-N 2.81Å; L332-Y336 WeakPolarHBondContact O-CB 3.36Å; L332-Y336 PolarHBondContact O-N 2.84Å
333	W	97.7	Very high	96.2	Very high	1 Å²	1	22.1 Å²	22.1	0%	0.004	13%	0.125	C	C	.	.	H	α-helix	trans	-66.2	-40.6	177.9	-80.3	114.1	0	0	0	114.1	R238 D239 L240 H241 H307 M310 M314 T329 N330 V331 A335 Y336 L337	R238-W333 WeakPolarHBondContact O-CZ2 3.46Å; R238-W333 PolarHBondContact O-NE1 2.82Å; R238-W333 VanDerWaalsContact O-NE1 3.12Å; D239-W333 VanDerWaalsContact CA-CZ2 3.49Å; L240-W333 HydrophobicContact CB-CB 3.81Å; L240-W333 HydrophobicContact CB-CD2 3.9Å; L240-W333 HydrophobicContact CB-CE3 4.17Å; L240-W333 HydrophobicContact CB-CG 3.73Å; L240-W333 HydrophobicContact CD2-CB 4.3Å; L240-W333 VanDerWaalsContact N-CD2 3.31Å; L240-W333 VanDerWaalsContact N-CE2 3.33Å; H241-W333 HydrophobicContact CB-CH2 4.15Å; H241-W333 HydrophobicContact CB-CZ3 3.76Å; H307-W333 HydrophobicContact CB-CH2 4.5Å; H307-W333 AromaticContact CD2-CH2 3.79Å; M310-W333 HydrophobicContact CB-CH2 3.9Å; M310-W333 HydrophobicContact CB-CZ2 3.9Å; M310-W333 HydrophobicContact CE-CD2 3.7Å; M310-W333 HydrophobicContact CE-CE3 3.78Å; M310-W333 HydrophobicContact CE-CG 4.17Å; M310-W333 HydrophobicContact CE-CH2 4.41Å; M310-W333 HydrophobicContact CE-CZ2 4.3Å; M310-W333 HydrophobicContact CE-CZ3 4.14Å; M310-W333 HydrophobicContact CG-CH2 3.82Å; M310-W333 HydrophobicContact CG-CZ2 4.23Å; M310-W333 HydrophobicContact CG-CZ3 3.97Å; M314-W333 HydrophobicContact CE-CZ2 4.17Å; M314-W333 HydrophobicContact SD-CZ2 4.48Å; M314-W333 PolarHBondContact SD-NE1 2.89Å; M314-W333 VanDerWaalsContact SD-NE1 3.41Å; T329-W333 PolarHBondContact O-N 3.1Å; T329-W333 VanDerWaalsContact O-N 3.15Å; N330-W333 PolarHBondContact O-N 2.81Å; V331-W333 VanDerWaalsContact C-N 3.27Å; V331-W333 PolarHBondContact O-N 2.68Å; W333-A335 VanDerWaalsContact C-N 3.3Å; W333-A335 PolarHBondContact O-N 3.08Å; W333-Y336 AromaticContact CE3-CD1 3.73Å; W333-Y336 HydrophobicContact CE3-CD1 3.73Å; W333-Y336 HydrophobicContact CE3-CE1 4.37Å; W333-Y336 HydrophobicContact CE3-CG 4.14Å; W333-Y336 AromaticContact CZ3-CD1 3.79Å; W333-Y336 HydrophobicContact CZ3-CD1 3.79Å; W333-Y336 HydrophobicContact CZ3-CE1 4.02Å; W333-Y336 HydrophobicContact CZ3-CG 4.2Å; W333-Y336 PolarHBondContact O-N 3.38Å; W333-L337 WeakPolarHBondContact O-CG 3.25Å; W333-L337 PolarHBondContact O-N 2.53Å
334	I	97.5	Very high	96	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-60.2	-44	173.6	-65.1	163	0	0	0	109.9	T223 L226 N330 V331 L337 I338 V367	T223-I334 HydrophobicContact CG2-CD1 4.24Å; L226-I334 HydrophobicContact CD1-CD1 3.79Å; L226-I334 HydrophobicContact CD1-CG1 3.75Å; N330-I334 VanDerWaalsContact O-CG1 3.31Å; N330-I334 WeakPolarHBondContact O-CG1 3.25Å; N330-I334 PolarHBondContact O-N 3.14Å; V331-I334 PolarHBondContact O-N 2.98Å; I334-L337 PolarHBondContact O-N 3.42Å; I334-I338 HydrophobicContact CG2-CD1 3.91Å; I334-I338 VanDerWaalsContact O-CG1 3.29Å; I334-I338 WeakPolarHBondContact O-CG1 3.45Å; I334-I338 PolarHBondContact O-N 3.12Å; I334-V367 HydrophobicContact CB-CG1 4.18Å; I334-V367 HydrophobicContact CG2-CG1 3.91Å
335	A	97.4	Very high	95.7	Very high	4 Å²	4	24.8 Å²	24.8	3%	0.033	14%	0.139	C	C	.	.	H	α-helix	trans	-64.1	-42	178	0	0	0	0	0	112.2	V331 L332 W333 I338 D339 K364 V367 E368	V331-A335 WeakPolarHBondContact O-CB 2.98Å; V331-A335 PolarHBondContact O-N 3.1Å; L332-A335 PolarHBondContact O-N 2.81Å; W333-A335 VanDerWaalsContact C-N 3.3Å; W333-A335 PolarHBondContact O-N 3.08Å; A335-I338 PolarHBondContact O-N 2.95Å; A335-D339 PolarHBondContact O-N 2.82Å; A335-K364 HydrophobicContact CB-CG 4.2Å; A335-V367 HydrophobicContact CB-CG1 4.19Å; A335-E368 HydrophobicContact CB-CG 3.8Å
336	Y	96.5	Very high	95.2	Very high	28 Å²	28	21 Å²	21	11%	0.11	12%	0.124	C	C	.	.	H	α-helix	trans	-56.8	-50	172.7	165	-91	0	0	0	111.3	H241 V242 H307 H309 M310 L332 W333 I338 D339 A340	H241-Y336 HydrophobicContact CB-CE1 4.15Å; V242-Y336 HydrophobicContact CG1-CE1 4.17Å; H307-Y336 HydrophobicContact CB-CE2 3.91Å; H309-Y336 AromaticContact CE1-CD2 3.97Å; H309-Y336 AromaticContact CE1-CE2 3.94Å; H309-Y336 AromaticContact NE2-CD2 3.97Å; M310-Y336 HydrophobicContact CE-CG 4.4Å; M310-Y336 HydrophobicContact CG-CD2 4.27Å; M310-Y336 HydrophobicContact SD-CD2 4.06Å; M310-Y336 HydrophobicContact SD-CG 4.24Å; L332-Y336 WeakPolarHBondContact O-CB 3.36Å; L332-Y336 PolarHBondContact O-N 2.84Å; W333-Y336 AromaticContact CE3-CD1 3.73Å; W333-Y336 HydrophobicContact CE3-CD1 3.73Å; W333-Y336 HydrophobicContact CE3-CE1 4.37Å; W333-Y336 HydrophobicContact CE3-CG 4.14Å; W333-Y336 AromaticContact CZ3-CD1 3.79Å; W333-Y336 HydrophobicContact CZ3-CD1 3.79Å; W333-Y336 HydrophobicContact CZ3-CE1 4.02Å; W333-Y336 HydrophobicContact CZ3-CG 4.2Å; W333-Y336 PolarHBondContact O-N 3.38Å; Y336-I338 VanDerWaalsContact C-N 3.33Å; Y336-I338 PolarHBondContact O-N 2.75Å; Y336-D339 WeakPolarHBondContact O-CB 3.4Å; Y336-D339 PolarHBondContact O-N 2.76Å; Y336-D339 VanDerWaalsContact O-N 3.13Å; Y336-A340 HydrophobicContact CE1-CB 4.5Å; Y336-A340 WeakPolarHBondContact O-CB 3.42Å; Y336-A340 PolarHBondContact O-N 3.14Å
337	L	95.2	Very high	94.5	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-64	-37.9	-179.1	-70.8	172.2	0	0	0	112.3	F204 F219 L222 L240 V242 I245 W333 I334 D339 F341	F204-L337 HydrophobicContact CZ-CD2 4.5Å; F219-L337 HydrophobicContact CE1-CB 3.99Å; L222-L337 HydrophobicContact CD1-CD1 3.87Å; L240-L337 HydrophobicContact CD2-CD1 4.05Å; L240-L337 HydrophobicContact CG-CD1 4.09Å; V242-L337 HydrophobicContact CG1-CD2 3.99Å; I245-L337 HydrophobicContact CD1-CD1 4.23Å; I245-L337 HydrophobicContact CG1-CD1 3.97Å; I245-L337 HydrophobicContact CG1-CD2 4.15Å; W333-L337 WeakPolarHBondContact O-CG 3.25Å; W333-L337 PolarHBondContact O-N 2.53Å; I334-L337 PolarHBondContact O-N 3.42Å; L337-D339 VanDerWaalsContact C-N 3.34Å; L337-F341 WeakPolarHBondContact O-CB 3.1Å; L337-F341 PolarHBondContact O-N 2.87Å
338	I	96.3	Very high	94	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.4	-43.4	174.4	-67	167.1	0	0	0	110.4	F219 I334 A335 Y336 A342 L360 I363 K364 V367	F219-I338 HydrophobicContact CB-CG1 4.36Å; F219-I338 HydrophobicContact CD1-CD1 4.49Å; F219-I338 HydrophobicContact CD1-CG1 3.53Å; F219-I338 HydrophobicContact CD2-CG1 3.87Å; F219-I338 HydrophobicContact CE1-CB 4.34Å; F219-I338 HydrophobicContact CE1-CG1 3.69Å; F219-I338 HydrophobicContact CE2-CG1 4.01Å; F219-I338 HydrophobicContact CG-CD1 4.33Å; F219-I338 HydrophobicContact CG-CG1 3.64Å; F219-I338 HydrophobicContact CZ-CB 4.3Å; F219-I338 HydrophobicContact CZ-CG1 3.92Å; I334-I338 HydrophobicContact CG2-CD1 3.91Å; I334-I338 VanDerWaalsContact O-CG1 3.29Å; I334-I338 WeakPolarHBondContact O-CG1 3.45Å; I334-I338 PolarHBondContact O-N 3.12Å; A335-I338 PolarHBondContact O-N 2.95Å; Y336-I338 VanDerWaalsContact C-N 3.33Å; Y336-I338 PolarHBondContact O-N 2.75Å; I338-A342 VanDerWaalsContact O-CB 3.23Å; I338-A342 WeakPolarHBondContact O-CB 3.38Å; I338-A342 PolarHBondContact O-N 2.66Å; I338-L360 HydrophobicContact CG2-CB 4.05Å; I338-L360 WeakPolarHBondContact CG2-O 3.41Å; I338-I363 HydrophobicContact CD1-CG2 4.17Å; I338-K364 HydrophobicContact CB-CB 4.37Å; I338-K364 HydrophobicContact CB-CG 4.48Å; I338-K364 HydrophobicContact CG2-CB 3.77Å; I338-K364 HydrophobicContact CG2-CG 4.35Å; I338-V367 HydrophobicContact CD1-CG2 3.94Å
339	D	95.3	Very high	93.6	Very high	46 Å²	46	29.4 Å²	29.4	25%	0.246	17%	0.174	C	C	.	.	H	α-helix	trans	-63.9	-49.9	178	-160.5	91	0	0	0	111.8	A335 Y336 L337 F341 A342 N343 K364	A335-D339 PolarHBondContact O-N 2.82Å; Y336-D339 WeakPolarHBondContact O-CB 3.4Å; Y336-D339 PolarHBondContact O-N 2.76Å; Y336-D339 VanDerWaalsContact O-N 3.13Å; L337-D339 VanDerWaalsContact C-N 3.34Å; D339-F341 VanDerWaalsContact C-N 3.26Å; D339-F341 PolarHBondContact O-N 3.28Å; D339-A342 PolarHBondContact O-N 3.04Å; D339-A342 VanDerWaalsContact O-N 3.11Å; D339-N343 WeakPolarHBondContact O-CB 2.8Å; D339-N343 PolarHBondContact O-N 3.3Å; D339-N343 PolarHBondContact OD1-ND2 2.83Å; D339-N343 VanDerWaalsContact OD1-ND2 3.1Å; D339-N343 PolarHBondContact OD2-ND2 3.19Å; D339-K364 HydrophobicContact CB-CD 3.93Å; D339-K364 WeakPolarHBondContact OD1-CD 3.48Å; D339-K364 VanDerWaalsContact OD1-CE 3.3Å; D339-K364 WeakPolarHBondContact OD1-CE 3.06Å; D339-K364 IonicContact OD1-NZ 3.13Å; D339-K364 PolarHBondContact OD1-NZ 2.94Å
340	A	92.6	Very high	93.2	Very high	29 Å²	29	31 Å²	31	24%	0.24	19%	0.187	C	C	.	.	H	α-helix	trans	-55.5	-42.2	178.5	0	0	0	0	0	111.4	V242 Y336 G344	V242-A340 HydrophobicContact CG1-CB 3.83Å; Y336-A340 HydrophobicContact CE1-CB 4.5Å; Y336-A340 WeakPolarHBondContact O-CB 3.42Å; Y336-A340 PolarHBondContact O-N 3.14Å; A340-G344 VanDerWaalsContact O-CA 3.25Å; A340-G344 WeakPolarHBondContact O-CA 3.28Å; A340-G344 PolarHBondContact O-N 3.36Å
341	F	92.8	Very high	92.9	Very high	1 Å²	1	35.9 Å²	35.9	0%	0.004	22%	0.217	C	C	.	.	H	α-helix	trans	-68.8	-48.7	175	-158.1	-93.6	0	0	0	112.3	F204 L207 Y209 V212 P215 L218 F219 L337 D339 L352 L360	F204-F341 HydrophobicContact CE1-CB 4.25Å; F204-F341 AromaticContact CE1-CD2 3.87Å; F204-F341 HydrophobicContact CE1-CD2 3.87Å; F204-F341 AromaticContact CE2-CD2 3.89Å; F204-F341 HydrophobicContact CE2-CD2 3.89Å; F204-F341 HydrophobicContact CZ-CB 3.74Å; F204-F341 AromaticContact CZ-CD2 3.46Å; F204-F341 HydrophobicContact CZ-CD2 3.46Å; F204-F341 VanDerWaalsContact CZ-CD2 3.46Å; F204-F341 HydrophobicContact CZ-CG 4.04Å; L207-F341 HydrophobicContact CD1-CE2 4.17Å; Y209-F341 HydrophobicContact CD1-CE1 4.31Å; Y209-F341 AromaticContact CD1-CE2 3.95Å; Y209-F341 HydrophobicContact CD1-CE2 3.95Å; Y209-F341 AromaticContact CD1-CZ 3.68Å; Y209-F341 HydrophobicContact CD1-CZ 3.68Å; Y209-F341 AromaticContact CE1-CD2 3.93Å; Y209-F341 HydrophobicContact CE1-CD2 3.93Å; Y209-F341 HydrophobicContact CE1-CE1 4.15Å; Y209-F341 AromaticContact CE1-CE2 3.52Å; Y209-F341 HydrophobicContact CE1-CE2 3.52Å; Y209-F341 HydrophobicContact CE1-CG 4.42Å; Y209-F341 AromaticContact CE1-CZ 3.63Å; Y209-F341 HydrophobicContact CE1-CZ 3.63Å; Y209-F341 HydrophobicContact CG-CZ 4.47Å; Y209-F341 PolarHBondContact OH-O 2.76Å; V212-F341 HydrophobicContact CB-CZ 4.31Å; V212-F341 HydrophobicContact CG1-CZ 4.04Å; V212-F341 HydrophobicContact CG2-CZ 4.19Å; P215-F341 HydrophobicContact CB-CD1 3.93Å; P215-F341 HydrophobicContact CB-CE1 3.37Å; P215-F341 HydrophobicContact CB-CZ 3.99Å; P215-F341 HydrophobicContact CG-CE1 4.2Å; L218-F341 HydrophobicContact CD2-CE2 4.43Å; F219-F341 HydrophobicContact CE2-CB 4.41Å; F219-F341 HydrophobicContact CE2-CG 4.48Å; F219-F341 HydrophobicContact CZ-CB 3.68Å; F219-F341 HydrophobicContact CZ-CG 4.03Å; L337-F341 WeakPolarHBondContact O-CB 3.1Å; L337-F341 PolarHBondContact O-N 2.87Å; D339-F341 VanDerWaalsContact C-N 3.26Å; D339-F341 PolarHBondContact O-N 3.28Å; F341-L352 HydrophobicContact CD1-CD1 3.37Å; F341-L352 HydrophobicContact CE1-CD1 3.48Å; F341-L352 VanDerWaalsContact CE1-CD1 3.48Å; F341-L352 HydrophobicContact CE1-CD2 4.12Å; F341-L352 HydrophobicContact CE1-CG 4.22Å; F341-L352 HydrophobicContact CG-CD1 4.39Å; F341-L352 WeakPolarHBondContact O-CD1 3.26Å; F341-L360 HydrophobicContact CD1-CD1 3.78Å; F341-L360 HydrophobicContact CE1-CD1 4.43Å
342	A	94.3	Very high	92.6	Very high	2 Å²	2	36.7 Å²	36.7	2%	0.017	22%	0.221	C	C	.	.	H	α-helix	trans	-69.3	-35.8	-172.9	0	0	0	0	0	113.1	I338 D339 K357 L360 L361	I338-A342 VanDerWaalsContact O-CB 3.23Å; I338-A342 WeakPolarHBondContact O-CB 3.38Å; I338-A342 PolarHBondContact O-N 2.66Å; D339-A342 PolarHBondContact O-N 3.04Å; D339-A342 VanDerWaalsContact O-N 3.11Å; A342-K357 HydrophobicContact CB-CG 4.45Å; A342-K357 VanDerWaalsContact O-CD 3.31Å; A342-K357 WeakPolarHBondContact O-CD 2.95Å; A342-K357 WeakPolarHBondContact O-CE 3.31Å; A342-K357 WeakPolarHBondContact O-CG 3.29Å; A342-L360 HydrophobicContact CB-CB 3.91Å; A342-L360 HydrophobicContact CB-CD1 4.19Å; A342-L361 HydrophobicContact CB-CD2 3.87Å; A342-L361 HydrophobicContact CB-CG 4.13Å
343	N	93.7	Very high	92.3	Very high	72 Å²	72	37.7 Å²	37.7	39%	0.385	24%	0.235	S	C	.	.	H	α-helix	trans	-99.1	-20.2	-177.7	-70.7	-42.4	0	0	0	113.8	D339 K357	D339-N343 WeakPolarHBondContact O-CB 2.8Å; D339-N343 PolarHBondContact O-N 3.3Å; D339-N343 PolarHBondContact OD1-ND2 2.83Å; D339-N343 VanDerWaalsContact OD1-ND2 3.1Å; D339-N343 PolarHBondContact OD2-ND2 3.19Å; N343-K357 WeakPolarHBondContact OD1-CE 3.1Å; N343-K357 PolarHBondContact OD1-NZ 3.42Å
344	G	90.1	Very high	92.1	Very high	27 Å²	27	42.8 Å²	42.8	28%	0.278	27%	0.268	S	S	.	.	S	Bend	trans	-76.8	177	179.5	0	0	0	0	0	114.2	A340	A340-G344 VanDerWaalsContact O-CA 3.25Å; A340-G344 WeakPolarHBondContact O-CA 3.28Å; A340-G344 PolarHBondContact O-N 3.36Å
345	T	87.8	Confident	92	Very high	87 Å²	87	46.3 Å²	46.3	53%	0.534	30%	0.297	S	S	.	.			trans	-106.2	147.2	167.3	50.3	0	0	0	0	109.7	A350 T351	T345-A350 CarbonylContact C-O 3.54Å; T345-A350 WeakPolarHBondContact CA-O 3.26Å; T345-T351 HydrophobicContact CG2-CG2 3.78Å
346	D	86.9	Confident	91.8	Very high	6 Å²	6	50.3 Å²	50.3	3%	0.032	31%	0.314	C	S	.	.			trans	-67.7	170.3	168.4	95.3	-16.7	0	0	0	110.8	L207 S208 Y209 L348 G349 A350	L207-D346 WeakPolarHBondContact O-CB 3.17Å; S208-D346 WeakPolarHBondContact CA-OD2 3.19Å; S208-D346 PolarHBondContact OG-OD2 2.99Å; Y209-D346 HydrophobicContact CD1-CB 3.41Å; Y209-D346 VanDerWaalsContact CD1-CB 3.41Å; Y209-D346 HydrophobicContact CD2-CB 3.87Å; Y209-D346 HydrophobicContact CE1-CB 3.74Å; Y209-D346 HydrophobicContact CE2-CB 4.19Å; Y209-D346 HydrophobicContact CG-CB 3.49Å; Y209-D346 VanDerWaalsContact CG-CB 3.49Å; Y209-D346 PolarHBondContact N-OD2 3.41Å; D346-L348 PolarHBondContact O-N 3.25Å; D346-L348 VanDerWaalsContact OD1-CA 3.29Å; D346-L348 WeakPolarHBondContact OD1-CA 3.37Å; D346-L348 WeakPolarHBondContact OD1-CB 3.34Å; D346-L348 PolarHBondContact OD1-N 2.76Å; D346-G349 PolarHBondContact O-N 3.33Å; D346-G349 PolarHBondContact OD1-N 3.47Å; D346-G349 VanDerWaalsContact OD1-N 3.15Å; D346-A350 PolarHBondContact N-O 2.8Å; D346-A350 WeakPolarHBondContact OD1-CB 3.4Å; D346-A350 PolarHBondContact OD1-N 3.38Å
347	Y	82.7	Confident	91.7	Very high	112 Å²	112	52.4 Å²	52.4	44%	0.439	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-12.3	-177.5	78.5	-85.7	0	0	0	114.6	R206	R206-Y347 WeakPolarHBondContact O-CD1 3.42Å; R206-Y347 WeakPolarHBondContact O-CE1 3.47Å
348	L	87.1	Confident	91.8	Very high	110 Å²	110	59 Å²	59	58%	0.576	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	6.2	174.3	-61.3	172.5	0	0	0	111.8	D346 A350	D346-L348 PolarHBondContact O-N 3.25Å; D346-L348 VanDerWaalsContact OD1-CA 3.29Å; D346-L348 WeakPolarHBondContact OD1-CA 3.37Å; D346-L348 WeakPolarHBondContact OD1-CB 3.34Å; D346-L348 PolarHBondContact OD1-N 2.76Å; L348-A350 VanDerWaalsContact C-N 3.33Å
349	G	89.3	Confident	91.8	Very high	53 Å²	53	64.3 Å²	64.3	55%	0.546	37%	0.374	S	S	.	.	S	Bend	trans	78.6	10.8	-177.5	0	0	0	0	0	114.3	D346	D346-G349 PolarHBondContact O-N 3.33Å; D346-G349 PolarHBondContact OD1-N 3.47Å; D346-G349 VanDerWaalsContact OD1-N 3.15Å
350	A	90.4	Very high	91.8	Very high	33 Å²	33	62.2 Å²	62.2	27%	0.273	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-82.4	143.6	179.9	0	0	0	0	0	111.8	Y209 T345 D346 L348	Y209-A350 WeakPolarHBondContact CD2-O 3.19Å; T345-A350 CarbonylContact C-O 3.54Å; T345-A350 WeakPolarHBondContact CA-O 3.26Å; D346-A350 PolarHBondContact N-O 2.8Å; D346-A350 WeakPolarHBondContact OD1-CB 3.4Å; D346-A350 PolarHBondContact OD1-N 3.38Å; L348-A350 VanDerWaalsContact C-N 3.33Å
351	T	92	Very high	92.1	Very high	103 Å²	103	62.5 Å²	62.5	63%	0.632	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-101.9	159.8	174.2	56	0	0	0	0	111.4	T345	T345-T351 HydrophobicContact CG2-CG2 3.78Å
352	L	91.3	Very high	92.3	Very high	18 Å²	18	65 Å²	65	9%	0.094	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-67.8	144.7	172.9	-90.5	133.6	0	0	0	112	Y209 P215 F341 K356 K357 L360	Y209-L352 HydrophobicContact CD2-CD1 3.97Å; Y209-L352 HydrophobicContact CD2-CG 3.78Å; Y209-L352 HydrophobicContact CE2-CD1 3.64Å; Y209-L352 HydrophobicContact CE2-CG 3.96Å; Y209-L352 HydrophobicContact CG-CG 4.46Å; P215-L352 HydrophobicContact CG-CD2 4.42Å; F341-L352 HydrophobicContact CD1-CD1 3.37Å; F341-L352 HydrophobicContact CE1-CD1 3.48Å; F341-L352 VanDerWaalsContact CE1-CD1 3.48Å; F341-L352 HydrophobicContact CE1-CD2 4.12Å; F341-L352 HydrophobicContact CE1-CG 4.22Å; F341-L352 HydrophobicContact CG-CD1 4.39Å; F341-L352 WeakPolarHBondContact O-CD1 3.26Å; L352-K356 HydrophobicContact CD2-CB 3.67Å; L352-K356 HydrophobicContact CD2-CD 3.99Å; L352-K357 HydrophobicContact CB-CB 4.28Å; L352-L360 HydrophobicContact CD1-CD1 4.37Å
353	A	91.9	Very high	92.5	Very high	58 Å²	58	65 Å²	65	48%	0.479	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-53.8	137.5	169.4	0	0	0	0	0	110.6	A355 K356 K357	A353-A355 VanDerWaalsContact C-N 3.3Å; A353-A355 PolarHBondContact O-N 3.27Å; A353-A355 VanDerWaalsContact O-N 3.13Å; A353-K356 PolarHBondContact O-N 3.38Å; A353-K357 PolarHBondContact O-N 2.92Å
354	P	93.9	Very high	92.6	Very high	109 Å²	109	63.5 Å²	63.5	71%	0.708	36%	0.364	S	S	*	.	H	α-helix	trans	-50.8	-44	-172.2	-31.3	35.4	0	0	0	114.6	K356 K357 E358	P354-K356 PolarHBondContact O-N 3.25Å; P354-K357 WeakPolarHBondContact O-CB 3.49Å; P354-K357 PolarHBondContact O-N 3.49Å; P354-E358 WeakPolarHBondContact O-CB 3.26Å; P354-E358 PolarHBondContact O-N 2.87Å
355	A	94.4	Very high	93	Very high	75 Å²	75	69.2 Å²	69.2	62%	0.62	38%	0.377	S	S	*	.	H	α-helix	trans	-64.3	-37.1	179	0	0	0	0	0	113.5	A353 R359	A353-A355 VanDerWaalsContact C-N 3.3Å; A353-A355 PolarHBondContact O-N 3.27Å; A353-A355 VanDerWaalsContact O-N 3.13Å; A355-R359 VanDerWaalsContact O-CB 3.3Å; A355-R359 WeakPolarHBondContact O-CB 3.32Å; A355-R359 PolarHBondContact O-N 2.94Å; A355-R359 VanDerWaalsContact O-N 3.1Å
356	K	92.7	Very high	93.5	Very high	87 Å²	87	67.1 Å²	67.1	38%	0.378	36%	0.361	S	S	.	.	H	α-helix	trans	-70.7	-40.6	175.8	-72.7	-174.1	172.2	-174.4	0	110.8	K213 L352 A353 P354 R359 L360	K213-K356 PolarHBondContact O-NZ 3.32Å; K213-K356 VanDerWaalsContact O-NZ 3.13Å; L352-K356 HydrophobicContact CD2-CB 3.67Å; L352-K356 HydrophobicContact CD2-CD 3.99Å; A353-K356 PolarHBondContact O-N 3.38Å; P354-K356 PolarHBondContact O-N 3.25Å; K356-R359 PolarHBondContact O-N 2.95Å; K356-L360 WeakPolarHBondContact O-CG 3.24Å; K356-L360 PolarHBondContact O-N 2.98Å
357	K	95.2	Very high	94	Very high	72 Å²	72	66.8 Å²	66.8	31%	0.313	36%	0.359	S	S	.	.	H	α-helix	trans	-58.8	-53.2	174.7	174.1	172.5	-177.5	165	0	111	A342 N343 L352 A353 P354 R359 L360 L361	A342-K357 HydrophobicContact CB-CG 4.45Å; A342-K357 VanDerWaalsContact O-CD 3.31Å; A342-K357 WeakPolarHBondContact O-CD 2.95Å; A342-K357 WeakPolarHBondContact O-CE 3.31Å; A342-K357 WeakPolarHBondContact O-CG 3.29Å; N343-K357 WeakPolarHBondContact OD1-CE 3.1Å; N343-K357 PolarHBondContact OD1-NZ 3.42Å; L352-K357 HydrophobicContact CB-CB 4.28Å; A353-K357 PolarHBondContact O-N 2.92Å; P354-K357 WeakPolarHBondContact O-CB 3.49Å; P354-K357 PolarHBondContact O-N 3.49Å; K357-R359 VanDerWaalsContact C-N 3.29Å; K357-R359 PolarHBondContact O-N 2.89Å; K357-L360 PolarHBondContact O-N 3.44Å; K357-L361 HydrophobicContact CG-CD1 4.02Å; K357-L361 HydrophobicContact CG-CG 4.45Å; K357-L361 WeakPolarHBondContact O-CG 3.2Å; K357-L361 PolarHBondContact O-N 2.86Å
358	E	97	Very high	94.6	Very high	138 Å²	138	65.1 Å²	65.1	65%	0.645	36%	0.355	S	S	*	.	H	α-helix	trans	-57.2	-43.6	178.9	-175.7	179.1	-173.1	0	0	112	P354 L360 L361 N362	P354-E358 WeakPolarHBondContact O-CB 3.26Å; P354-E358 PolarHBondContact O-N 2.87Å; E358-L360 PolarHBondContact O-N 3.38Å; E358-L361 PolarHBondContact O-N 3.15Å; E358-N362 PolarHBondContact O-N 2.77Å
359	R	96.1	Very high	95.1	Very high	112 Å²	112	66.5 Å²	66.5	42%	0.423	36%	0.359	S	S	.	.	H	α-helix	trans	-60.7	-45.2	177	-177.5	165.2	175.1	76.1	17.2	112.7	E216 A355 K356 K357 N362 I363	E216-R359 IonicContact OE1-CZ 2.85Å; E216-R359 IonicContact OE1-NE 3.77Å; E216-R359 PolarHBondContact OE1-NE 2.96Å; E216-R359 IonicContact OE1-NH2 3.28Å; E216-R359 PolarHBondContact OE1-NH2 3.29Å; E216-R359 IonicContact OE2-NH2 2.83Å; A355-R359 VanDerWaalsContact O-CB 3.3Å; A355-R359 WeakPolarHBondContact O-CB 3.32Å; A355-R359 PolarHBondContact O-N 2.94Å; A355-R359 VanDerWaalsContact O-N 3.1Å; K356-R359 PolarHBondContact O-N 2.95Å; K357-R359 VanDerWaalsContact C-N 3.29Å; K357-R359 PolarHBondContact O-N 2.89Å; R359-N362 PolarHBondContact O-N 2.96Å; R359-I363 HydrophobicContact CG-CD1 4.43Å; R359-I363 WeakPolarHBondContact O-CG1 3.42Å; R359-I363 PolarHBondContact O-N 3.01Å; R359-I363 VanDerWaalsContact O-N 3.11Å
360	L	96.6	Very high	95.5	Very high	2 Å²	2	64 Å²	64	1%	0.01	33%	0.333	C	S	.	.	H	α-helix	trans	-64.8	-40.3	175.9	-72.6	179.6	0	0	0	112	P215 E216 F219 I338 F341 A342 L352 K356 K357 E358 N362 I363 K364	P215-L360 HydrophobicContact CB-CD1 4.09Å; P215-L360 HydrophobicContact CG-CD1 3.95Å; P215-L360 HydrophobicContact CG-CD2 4.33Å; P215-L360 HydrophobicContact CG-CG 4.4Å; E216-L360 HydrophobicContact CG-CD2 4.31Å; F219-L360 HydrophobicContact CD2-CD2 4.04Å; F219-L360 HydrophobicContact CE2-CD1 4.29Å; F219-L360 HydrophobicContact CE2-CD2 3.87Å; I338-L360 HydrophobicContact CG2-CB 4.05Å; I338-L360 WeakPolarHBondContact CG2-O 3.41Å; F341-L360 HydrophobicContact CD1-CD1 3.78Å; F341-L360 HydrophobicContact CE1-CD1 4.43Å; A342-L360 HydrophobicContact CB-CB 3.91Å; A342-L360 HydrophobicContact CB-CD1 4.19Å; L352-L360 HydrophobicContact CD1-CD1 4.37Å; K356-L360 WeakPolarHBondContact O-CG 3.24Å; K356-L360 PolarHBondContact O-N 2.98Å; K357-L360 PolarHBondContact O-N 3.44Å; E358-L360 PolarHBondContact O-N 3.38Å; L360-N362 VanDerWaalsContact C-N 3.34Å; L360-N362 PolarHBondContact O-N 3.5Å; L360-I363 PolarHBondContact O-N 3.46Å; L360-K364 WeakPolarHBondContact O-CB 3.46Å; L360-K364 PolarHBondContact O-N 2.98Å
361	L	97.8	Very high	95.8	Very high	36 Å²	36	67 Å²	67	19%	0.188	34%	0.344	C	S	.	.	H	α-helix	trans	-67.7	-32	178	-66.4	178.2	0	0	0	112.8	A342 K357 E358 K364 R365	A342-L361 HydrophobicContact CB-CD2 3.87Å; A342-L361 HydrophobicContact CB-CG 4.13Å; K357-L361 HydrophobicContact CG-CD1 4.02Å; K357-L361 HydrophobicContact CG-CG 4.45Å; K357-L361 WeakPolarHBondContact O-CG 3.2Å; K357-L361 PolarHBondContact O-N 2.86Å; E358-L361 PolarHBondContact O-N 3.15Å; L361-K364 HydrophobicContact CD2-CD 4.42Å; L361-K364 WeakPolarHBondContact O-CB 3.07Å; L361-R365 WeakPolarHBondContact O-CG 3.45Å; L361-R365 PolarHBondContact O-N 3.19Å
362	N	97.6	Very high	96.1	Very high	54 Å²	54	63 Å²	63	29%	0.289	32%	0.321	S	S	.	.	H	α-helix	trans	-65.2	-47.1	169.9	-176.7	25	0	0	0	111.1	E358 R359 L360 K364 R365 Q366	E358-N362 PolarHBondContact O-N 2.77Å; R359-N362 PolarHBondContact O-N 2.96Å; L360-N362 VanDerWaalsContact C-N 3.34Å; L360-N362 PolarHBondContact O-N 3.5Å; N362-K364 VanDerWaalsContact C-N 3.3Å; N362-K364 PolarHBondContact O-N 2.98Å; N362-R365 PolarHBondContact O-N 3.41Å; N362-Q366 PolarHBondContact O-N 2.93Å; N362-Q366 PolarHBondContact OD1-NE2 3.27Å
363	I	97.1	Very high	96.3	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-58.2	-44.7	176.2	-68.2	168.4	0	0	0	110.5	E216 I338 R359 L360 R365 Q366 V367 E381 L382	E216-I363 HydrophobicContact CG-CD1 3.94Å; I338-I363 HydrophobicContact CD1-CG2 4.17Å; R359-I363 HydrophobicContact CG-CD1 4.43Å; R359-I363 WeakPolarHBondContact O-CG1 3.42Å; R359-I363 PolarHBondContact O-N 3.01Å; R359-I363 VanDerWaalsContact O-N 3.11Å; L360-I363 PolarHBondContact O-N 3.46Å; I363-R365 VanDerWaalsContact C-N 3.33Å; I363-R365 PolarHBondContact O-N 2.97Å; I363-Q366 WeakPolarHBondContact O-CB 3.03Å; I363-Q366 PolarHBondContact O-N 3.47Å; I363-V367 HydrophobicContact CG2-CG2 4.07Å; I363-V367 VanDerWaalsContact O-CG2 3.32Å; I363-V367 WeakPolarHBondContact O-CG2 3.31Å; I363-V367 PolarHBondContact O-N 2.9Å; I363-E381 HydrophobicContact CG1-CB 4.24Å; I363-L382 HydrophobicContact CG2-CB 3.91Å; I363-L382 HydrophobicContact CG2-CD1 4.34Å
364	K	97.7	Very high	96.4	Very high	40 Å²	40	61.1 Å²	61.1	17%	0.174	30%	0.302	C	S	.	.	H	α-helix	trans	-51.6	-50.2	176.2	-172	-159.4	171.5	-160.1	0	111.6	A335 I338 D339 L360 L361 N362 Q366 V367 E368	A335-K364 HydrophobicContact CB-CG 4.2Å; I338-K364 HydrophobicContact CB-CB 4.37Å; I338-K364 HydrophobicContact CB-CG 4.48Å; I338-K364 HydrophobicContact CG2-CB 3.77Å; I338-K364 HydrophobicContact CG2-CG 4.35Å; D339-K364 HydrophobicContact CB-CD 3.93Å; D339-K364 WeakPolarHBondContact OD1-CD 3.48Å; D339-K364 VanDerWaalsContact OD1-CE 3.3Å; D339-K364 WeakPolarHBondContact OD1-CE 3.06Å; D339-K364 IonicContact OD1-NZ 3.13Å; D339-K364 PolarHBondContact OD1-NZ 2.94Å; L360-K364 WeakPolarHBondContact O-CB 3.46Å; L360-K364 PolarHBondContact O-N 2.98Å; L361-K364 HydrophobicContact CD2-CD 4.42Å; L361-K364 WeakPolarHBondContact O-CB 3.07Å; N362-K364 VanDerWaalsContact C-N 3.3Å; N362-K364 PolarHBondContact O-N 2.98Å; K364-Q366 PolarHBondContact O-N 3.15Å; K364-V367 WeakPolarHBondContact O-CB 3.48Å; K364-V367 PolarHBondContact O-N 3.03Å; K364-V367 VanDerWaalsContact O-N 3.1Å; K364-E368 WeakPolarHBondContact CE-OE1 3.41Å; K364-E368 IonicContact NZ-OE1 3.88Å; K364-E368 PolarHBondContact NZ-OE1 2.64Å; K364-E368 WeakPolarHBondContact O-CG 3.27Å; K364-E368 PolarHBondContact O-N 2.94Å
365	R	97.9	Very high	96.4	Very high	147 Å²	147	58.6 Å²	58.6	56%	0.555	28%	0.28	S	S	*	.	H	α-helix	trans	-59	-35.9	178.9	-70.6	-178.7	-128.9	139.2	-2.8	112.6	L361 N362 I363 Q369	L361-R365 WeakPolarHBondContact O-CG 3.45Å; L361-R365 PolarHBondContact O-N 3.19Å; N362-R365 PolarHBondContact O-N 3.41Å; I363-R365 VanDerWaalsContact C-N 3.33Å; I363-R365 PolarHBondContact O-N 2.97Å; R365-Q369 WeakPolarHBondContact O-CG 3.3Å
366	Q	97.5	Very high	96.4	Very high	43 Å²	43	55 Å²	55	20%	0.201	25%	0.251	C	S	.	.	H	α-helix	trans	-72.2	-41.3	176.2	-60.1	175.9	16.5	0	0	111.6	N362 I363 K364 E368 Q369 C370 T380 E381	N362-Q366 PolarHBondContact O-N 2.93Å; N362-Q366 PolarHBondContact OD1-NE2 3.27Å; I363-Q366 WeakPolarHBondContact O-CB 3.03Å; I363-Q366 PolarHBondContact O-N 3.47Å; K364-Q366 PolarHBondContact O-N 3.15Å; Q366-E368 VanDerWaalsContact C-N 3.32Å; Q366-E368 PolarHBondContact O-N 2.88Å; Q366-Q369 PolarHBondContact O-N 3Å; Q366-C370 PolarHBondContact O-SG 3.4Å; Q366-T380 HydrophobicContact CB-CG2 3.94Å; Q366-E381 VanDerWaalsContact NE2-CD 3.33Å; Q366-E381 PolarHBondContact NE2-OE1 3.24Å
367	V	97.6	Very high	96.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-58.5	-44.9	174.9	174	0	0	0	0	110.2	V331 I334 A335 I338 I363 K364 Q369 C370 T376 T380	V331-V367 HydrophobicContact CG1-CG1 3.75Å; V331-V367 WeakPolarHBondContact CG1-O 3.31Å; I334-V367 HydrophobicContact CB-CG1 4.18Å; I334-V367 HydrophobicContact CG2-CG1 3.91Å; A335-V367 HydrophobicContact CB-CG1 4.19Å; I338-V367 HydrophobicContact CD1-CG2 3.94Å; I363-V367 HydrophobicContact CG2-CG2 4.07Å; I363-V367 VanDerWaalsContact O-CG2 3.32Å; I363-V367 WeakPolarHBondContact O-CG2 3.31Å; I363-V367 PolarHBondContact O-N 2.9Å; K364-V367 WeakPolarHBondContact O-CB 3.48Å; K364-V367 PolarHBondContact O-N 3.03Å; K364-V367 VanDerWaalsContact O-N 3.1Å; V367-Q369 PolarHBondContact O-N 2.83Å; V367-C370 VanDerWaalsContact O-CB 3.23Å; V367-C370 WeakPolarHBondContact O-CB 3.13Å; V367-C370 PolarHBondContact O-N 2.99Å; V367-T376 HydrophobicContact CG1-CG2 4.46Å; V367-T376 HydrophobicContact CG2-CG2 3.92Å; V367-T380 HydrophobicContact CG2-CG2 4.23Å
368	E	96.7	Very high	96	Very high	76 Å²	76	48.6 Å²	48.6	36%	0.355	22%	0.224	S	C	.	.	H	α-helix	trans	-58.4	-22.5	178.8	-73.1	170.9	155.9	0	0	113.8	K328 A335 K364 Q366	K328-E368 PolarHBondContact NZ-O 3.31Å; A335-E368 HydrophobicContact CB-CG 3.8Å; K364-E368 WeakPolarHBondContact CE-OE1 3.41Å; K364-E368 IonicContact NZ-OE1 3.88Å; K364-E368 PolarHBondContact NZ-OE1 2.64Å; K364-E368 WeakPolarHBondContact O-CG 3.27Å; K364-E368 PolarHBondContact O-N 2.94Å; Q366-E368 VanDerWaalsContact C-N 3.32Å; Q366-E368 PolarHBondContact O-N 2.88Å
369	Q	96.8	Very high	95.6	Very high	140 Å²	140	46.6 Å²	46.6	65%	0.654	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	-8.5	175.2	-57.2	-56.6	-40.8	0	0	113.7	R365 Q366 V367	R365-Q369 WeakPolarHBondContact O-CG 3.3Å; Q366-Q369 PolarHBondContact O-N 3Å; V367-Q369 PolarHBondContact O-N 2.83Å
370	C	97.5	Very high	95.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.198	C	C	.	.			trans	-85.4	150.9	-177.6	-61.3	0	0	0	0	111.8	K328 V331 Q366 V367 Q375 T376 T380	K328-C370 WeakPolarHBondContact CD-O 3.47Å; K328-C370 VanDerWaalsContact CE-O 3.25Å; K328-C370 WeakPolarHBondContact CE-O 3.47Å; K328-C370 PolarHBondContact NZ-O 3.36Å; V331-C370 HydrophobicContact CG1-CB 4.15Å; V331-C370 WeakPolarHBondContact CG1-O 3.26Å; V331-C370 HydrophobicContact CG2-CB 4.37Å; Q366-C370 PolarHBondContact O-SG 3.4Å; V367-C370 VanDerWaalsContact O-CB 3.23Å; V367-C370 WeakPolarHBondContact O-CB 3.13Å; V367-C370 PolarHBondContact O-N 2.99Å; C370-Q375 HydrophobicContact CB-CB 4Å; C370-Q375 HydrophobicContact CB-CG 3.99Å; C370-T376 WeakPolarHBondContact CB-OG1 3.38Å; C370-T380 VanDerWaalsContact SG-CG2 3.53Å
371	N	97.2	Very high	95.1	Very high	95 Å²	95	45 Å²	45	51%	0.508	21%	0.214	S	C	.	.	S	Bend	trans	-103.4	-7.5	179.2	-64.6	-45.1	0	0	0	114.1	P327 K328 Q375	P327-N371 CarbonylContact C-O 3.57Å; K328-N371 WeakPolarHBondContact CA-O 3.36Å; K328-N371 PolarHBondContact N-O 3.43Å; K328-N371 VanDerWaalsContact N-O 3.09Å; N371-Q375 PolarHBondContact ND2-OE1 2.76Å
372	S	97.6	Very high	94.7	Very high	19 Å²	19	43.3 Å²	43.3	13%	0.133	21%	0.205	C	C	.	.	S	Bend	trans	-159.3	167	178.8	62.8	0	0	0	0	110.6	V331 E374 Q375 T376	V331-S372 VanDerWaalsContact CG2-C 3.45Å; S372-E374 PolarHBondContact O-N 3.19Å; S372-Q375 PolarHBondContact O-N 3.13Å; S372-Q375 VanDerWaalsContact O-N 3.12Å; S372-Q375 PolarHBondContact OG-N 3.08Å; S372-Q375 VanDerWaalsContact OG-N 3.15Å; S372-T376 PolarHBondContact O-N 2.72Å; S372-T376 PolarHBondContact O-OG1 2.86Å
373	S	95.8	Very high	94.3	Very high	0 Å²	0	41 Å²	41	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-63.3	-30.6	172.6	-56.6	0	0	0	0	111.8	L226 E230 T376 L377	L226-S373 WeakPolarHBondContact CB-OG 3.4Å; E230-S373 VanDerWaalsContact OE1-CB 3.25Å; E230-S373 WeakPolarHBondContact OE1-CB 3.49Å; E230-S373 PolarHBondContact OE1-N 2.56Å; E230-S373 VanDerWaalsContact OE1-N 3.14Å; E230-S373 PolarHBondContact OE1-OG 3.22Å; E230-S373 WeakPolarHBondContact OE2-CB 3.36Å; E230-S373 PolarHBondContact OE2-N 2.89Å; S373-T376 WeakPolarHBondContact O-CB 3.11Å; S373-T376 PolarHBondContact O-N 2.7Å; S373-L377 WeakPolarHBondContact O-CD1 3.4Å; S373-L377 PolarHBondContact O-N 2.77Å
374	E	93	Very high	93.2	Very high	38 Å²	38	44 Å²	44	18%	0.178	21%	0.212	C	C	.	.	H	α-helix	trans	-59	-48.4	169.8	-179.2	168.7	-126.5	0	0	111.8	Y227 K231 S372 T376 L377 L378 I393	Y227-E374 HydrophobicContact CD2-CB 3.62Å; Y227-E374 HydrophobicContact CD2-CG 4.25Å; Y227-E374 HydrophobicContact CE2-CB 3.64Å; Y227-E374 HydrophobicContact CE2-CG 3.76Å; K231-E374 WeakPolarHBondContact CE-OE1 3.39Å; K231-E374 WeakPolarHBondContact CE-OE2 3.33Å; K231-E374 IonicContact NZ-OE1 2.73Å; K231-E374 PolarHBondContact NZ-OE1 3.2Å; K231-E374 IonicContact NZ-OE2 2.8Å; K231-E374 PolarHBondContact NZ-OE2 3.33Å; S372-E374 PolarHBondContact O-N 3.19Å; E374-T376 VanDerWaalsContact C-N 3.31Å; E374-T376 PolarHBondContact O-N 3.02Å; E374-L377 WeakPolarHBondContact O-CB 3.34Å; E374-L377 PolarHBondContact O-N 3.07Å; E374-L378 HydrophobicContact CG-CD1 4.02Å; E374-L378 HydrophobicContact CG-CG 4.48Å; E374-L378 VanDerWaalsContact O-CG 3.26Å; E374-L378 WeakPolarHBondContact O-CG 3.47Å; E374-L378 PolarHBondContact O-N 3.18Å; E374-L378 VanDerWaalsContact O-N 3.1Å; E374-I393 HydrophobicContact CG-CG2 4.45Å
375	Q	94.5	Very high	91.7	Very high	55 Å²	55	46 Å²	46	26%	0.257	23%	0.229	S	C	.	.	H	α-helix	trans	-64.2	-41.2	178.7	-171.2	174.5	-2.1	0	0	110.5	C370 N371 S372 L377 L378 I379	C370-Q375 HydrophobicContact CB-CB 4Å; C370-Q375 HydrophobicContact CB-CG 3.99Å; N371-Q375 PolarHBondContact ND2-OE1 2.76Å; S372-Q375 PolarHBondContact O-N 3.13Å; S372-Q375 VanDerWaalsContact O-N 3.12Å; S372-Q375 PolarHBondContact OG-N 3.08Å; S372-Q375 VanDerWaalsContact OG-N 3.15Å; Q375-L377 VanDerWaalsContact C-N 3.29Å; Q375-L377 PolarHBondContact O-N 2.85Å; Q375-L378 PolarHBondContact O-N 2.56Å; Q375-I379 HydrophobicContact CG-CD1 3.61Å; Q375-I379 HydrophobicContact CG-CG1 3.99Å; Q375-I379 HydrophobicContact CG-CG2 4.43Å; Q375-I379 WeakPolarHBondContact O-CG1 3.39Å; Q375-I379 PolarHBondContact O-N 3.3Å
376	T	95.1	Very high	89.8	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-54.5	-45.3	174.6	-58.8	0	0	0	0	112.1	T223 V367 C370 S372 S373 E374 L378 T380 L382	T223-T376 HydrophobicContact CG2-CG2 3.65Å; V367-T376 HydrophobicContact CG1-CG2 4.46Å; V367-T376 HydrophobicContact CG2-CG2 3.92Å; C370-T376 WeakPolarHBondContact CB-OG1 3.38Å; S372-T376 PolarHBondContact O-N 2.72Å; S372-T376 PolarHBondContact O-OG1 2.86Å; S373-T376 WeakPolarHBondContact O-CB 3.11Å; S373-T376 PolarHBondContact O-N 2.7Å; E374-T376 VanDerWaalsContact C-N 3.31Å; E374-T376 PolarHBondContact O-N 3.02Å; T376-L378 VanDerWaalsContact C-N 3.28Å; T376-L378 PolarHBondContact O-N 3.43Å; T376-T380 HydrophobicContact CG2-CG2 4.09Å; T376-T380 WeakPolarHBondContact O-CB 3.36Å; T376-T380 WeakPolarHBondContact O-CG2 3.24Å; T376-T380 PolarHBondContact O-N 3.14Å; T376-T380 PolarHBondContact O-OG1 3.08Å; T376-L382 HydrophobicContact CG2-CD2 4.45Å
377	L	90.9	Very high	88.4	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.8	-33.9	174.6	-87.6	155.6	0	0	0	113.8	T223 V224 Y227 S373 E374 Q375 F383 F389	T223-L377 HydrophobicContact CG2-CD1 4.43Å; T223-L377 HydrophobicContact CG2-CG 4.02Å; V224-L377 HydrophobicContact CG2-CD2 3.93Å; Y227-L377 HydrophobicContact CD1-CD1 3.45Å; Y227-L377 VanDerWaalsContact CD1-CD1 3.45Å; Y227-L377 HydrophobicContact CD2-CD1 3.96Å; Y227-L377 HydrophobicContact CE1-CD1 4.17Å; Y227-L377 HydrophobicContact CG-CD1 3.31Å; S373-L377 WeakPolarHBondContact O-CD1 3.4Å; S373-L377 PolarHBondContact O-N 2.77Å; E374-L377 WeakPolarHBondContact O-CB 3.34Å; E374-L377 PolarHBondContact O-N 3.07Å; Q375-L377 VanDerWaalsContact C-N 3.29Å; Q375-L377 PolarHBondContact O-N 2.85Å; L377-F383 HydrophobicContact CD2-CD1 3.59Å; L377-F383 HydrophobicContact CD2-CD2 3.86Å; L377-F383 HydrophobicContact CD2-CE1 3.37Å; L377-F383 HydrophobicContact CD2-CE2 3.68Å; L377-F383 HydrophobicContact CD2-CG 3.8Å; L377-F383 HydrophobicContact CD2-CZ 3.41Å; L377-F383 VanDerWaalsContact CD2-CZ 3.41Å; L377-F383 HydrophobicContact CG-CD2 4.23Å; L377-F383 HydrophobicContact CG-CE1 4.47Å; L377-F383 HydrophobicContact CG-CE2 3.96Å; L377-F383 HydrophobicContact CG-CZ 4.07Å; L377-F383 WeakPolarHBondContact O-CB 3.45Å; L377-F389 HydrophobicContact CD2-CE1 3.6Å; L377-F389 HydrophobicContact CD2-CZ 4.3Å
378	L	88.1	Confident	87.2	Confident	25 Å²	25	50.7 Å²	50.7	13%	0.131	27%	0.269	C	S	.	.	H	α-helix	trans	-88.7	-34	-170.4	-73.7	-176.9	0	0	0	114.2	E374 Q375 T376 V390 I393 R394	E374-L378 HydrophobicContact CG-CD1 4.02Å; E374-L378 HydrophobicContact CG-CG 4.48Å; E374-L378 VanDerWaalsContact O-CG 3.26Å; E374-L378 WeakPolarHBondContact O-CG 3.47Å; E374-L378 PolarHBondContact O-N 3.18Å; E374-L378 VanDerWaalsContact O-N 3.1Å; Q375-L378 PolarHBondContact O-N 2.56Å; T376-L378 VanDerWaalsContact C-N 3.28Å; T376-L378 PolarHBondContact O-N 3.43Å; L378-V390 HydrophobicContact CD2-CG1 4.11Å; L378-I393 HydrophobicContact CD1-CG2 4.25Å; L378-I393 HydrophobicContact CD2-CB 3.99Å; L378-I393 HydrophobicContact CD2-CG2 3.61Å; L378-I393 HydrophobicContact CG-CG2 4.09Å; L378-R394 HydrophobicContact CD2-CB 4.4Å; L378-R394 HydrophobicContact CD2-CG 3.4Å; L378-R394 VanDerWaalsContact CD2-CG 3.4Å; L378-R394 PolarHBondContact O-NH2 3.34Å
379	I	87.9	Confident	86.1	Confident	95 Å²	95	48 Å²	48	49%	0.487	26%	0.256	S	S	.	.	H	α-helix	trans	-120.9	-10.9	-166.6	75.5	173	0	0	0	114.9	Q375	Q375-I379 HydrophobicContact CG-CD1 3.61Å; Q375-I379 HydrophobicContact CG-CG1 3.99Å; Q375-I379 HydrophobicContact CG-CG2 4.43Å; Q375-I379 WeakPolarHBondContact O-CG1 3.39Å; Q375-I379 PolarHBondContact O-N 3.3Å
380	T	91.2	Very high	85	Confident	4 Å²	4	41.4 Å²	41.4	3%	0.025	23%	0.225	C	C	.	.	S	Bend	trans	-96	153.3	-176.9	74.5	0	0	0	0	112.1	Q366 V367 C370 T376 L382 F383	Q366-T380 HydrophobicContact CB-CG2 3.94Å; V367-T380 HydrophobicContact CG2-CG2 4.23Å; C370-T380 VanDerWaalsContact SG-CG2 3.53Å; T376-T380 HydrophobicContact CG2-CG2 4.09Å; T376-T380 WeakPolarHBondContact O-CB 3.36Å; T376-T380 WeakPolarHBondContact O-CG2 3.24Å; T376-T380 PolarHBondContact O-N 3.14Å; T376-T380 PolarHBondContact O-OG1 3.08Å; T380-L382 PolarHBondContact O-N 2.85Å; T380-L382 VanDerWaalsContact O-N 3.12Å; T380-L382 VanDerWaalsContact OG1-CB 3.32Å; T380-L382 WeakPolarHBondContact OG1-CB 3.47Å; T380-L382 PolarHBondContact OG1-N 2.82Å; T380-F383 CarbonylContact O-C 3.5Å; T380-F383 PolarHBondContact O-N 2.89Å
381	E	91.9	Very high	84	Confident	77 Å²	77	48.5 Å²	48.5	36%	0.36	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-7.7	171.4	-76.6	176.9	-142.7	0	0	113.7	I363 Q366 F383 P384	I363-E381 HydrophobicContact CG1-CB 4.24Å; Q366-E381 VanDerWaalsContact NE2-CD 3.33Å; Q366-E381 PolarHBondContact NE2-OE1 3.24Å; E381-F383 PolarHBondContact O-N 2.82Å; E381-P384 WeakPolarHBondContact O-CD 3.43Å
382	L	89.7	Confident	82.9	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-26.7	168.3	-168.6	59.5	0	0	0	110.9	E216 F219 K220 I363 T376 T380	E216-L382 HydrophobicContact CB-CD1 4Å; E216-L382 HydrophobicContact CG-CD1 4.34Å; F219-L382 HydrophobicContact CB-CD1 3.96Å; F219-L382 HydrophobicContact CB-CD2 3.9Å; K220-L382 WeakPolarHBondContact CE-O 3.38Å; K220-L382 HydrophobicContact CG-CD1 3.88Å; K220-L382 HydrophobicContact CG-CG 3.85Å; K220-L382 WeakPolarHBondContact CG-O 3.42Å; I363-L382 HydrophobicContact CG2-CB 3.91Å; I363-L382 HydrophobicContact CG2-CD1 4.34Å; T376-L382 HydrophobicContact CG2-CD2 4.45Å; T380-L382 PolarHBondContact O-N 2.85Å; T380-L382 VanDerWaalsContact O-N 3.12Å; T380-L382 VanDerWaalsContact OG1-CB 3.32Å; T380-L382 WeakPolarHBondContact OG1-CB 3.47Å; T380-L382 PolarHBondContact OG1-N 2.82Å
383	F	87.7	Confident	81.8	Confident	5 Å²	5	46 Å²	46	2%	0.022	24%	0.237	C	C	.	.	S	Bend	trans	-130.8	74.5	177	-62.4	-91.5	0	0	0	110.7	K220 T223 V224 L377 T380 E381 V390	K220-F383 HydrophobicContact CB-CE1 3.82Å; K220-F383 HydrophobicContact CB-CZ 3.76Å; K220-F383 HydrophobicContact CD-CE1 4.35Å; K220-F383 HydrophobicContact CG-CD1 4.19Å; K220-F383 HydrophobicContact CG-CE1 3.68Å; K220-F383 HydrophobicContact CG-CE2 4.25Å; K220-F383 HydrophobicContact CG-CZ 3.72Å; T223-F383 HydrophobicContact CG2-CE2 3.86Å; T223-F383 HydrophobicContact CG2-CZ 4.27Å; V224-F383 HydrophobicContact CG2-CE1 3.71Å; V224-F383 HydrophobicContact CG2-CZ 3.76Å; L377-F383 HydrophobicContact CD2-CD1 3.59Å; L377-F383 HydrophobicContact CD2-CD2 3.86Å; L377-F383 HydrophobicContact CD2-CE1 3.37Å; L377-F383 HydrophobicContact CD2-CE2 3.68Å; L377-F383 HydrophobicContact CD2-CG 3.8Å; L377-F383 HydrophobicContact CD2-CZ 3.41Å; L377-F383 VanDerWaalsContact CD2-CZ 3.41Å; L377-F383 HydrophobicContact CG-CD2 4.23Å; L377-F383 HydrophobicContact CG-CE1 4.47Å; L377-F383 HydrophobicContact CG-CE2 3.96Å; L377-F383 HydrophobicContact CG-CZ 4.07Å; L377-F383 WeakPolarHBondContact O-CB 3.45Å; T380-F383 CarbonylContact O-C 3.5Å; T380-F383 PolarHBondContact O-N 2.89Å; E381-F383 PolarHBondContact O-N 2.82Å; F383-V390 HydrophobicContact CB-CG2 3.93Å
384	P	75.7	Confident	80.6	Confident	64 Å²	64	50.8 Å²	50.8	42%	0.416	26%	0.255	S	S	.	.			trans	-63.3	133.4	-173.7	24.8	-31	0	0	0	111.1	E381	E381-P384 WeakPolarHBondContact O-CD 3.43Å
385	P	64.4	Low	79.5	Confident	82 Å²	82	52.7 Å²	52.7	53%	0.532	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	129.6	169	-14.7	28.3	0	0	0	108.4
386	P	59.4	Low	78.3	Confident	87 Å²	87	52.8 Å²	52.8	57%	0.565	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	cis	-129.1	43.6	47.4	40.9	-26.3	0	0	0	112	Q388	P386-Q388 PolarHBondContact O-N 2.95Å; P386-Q388 VanDerWaalsContact O-N 3.09Å
387	T	67.1	Low	76.8	Confident	54 Å²	54	53.9 Å²	53.9	33%	0.331	28%	0.281	S	S	.	.			trans	-58.6	123.8	174.5	51.6	0	0	0	0	108.8	F389 V390 R391	T387-F389 PolarHBondContact O-N 3.28Å; T387-V390 PolarHBondContact O-N 3.01Å; T387-V390 WeakPolarHBondContact OG1-CG2 3.46Å; T387-R391 PolarHBondContact O-N 2.91Å; T387-R391 VanDerWaalsContact O-N 3.16Å
388	Q	72.3	Confident	75.2	Confident	148 Å²	148	58.9 Å²	58.9	69%	0.692	31%	0.308	S	S	*	.	H	α-helix	trans	-51.3	-31.2	179.2	-175.1	174.1	16.6	0	0	111.2	P386 R391 N392	P386-Q388 PolarHBondContact O-N 2.95Å; P386-Q388 VanDerWaalsContact O-N 3.09Å; Q388-R391 WeakPolarHBondContact O-CB 3.23Å; Q388-R391 PolarHBondContact O-N 3.38Å; Q388-N392 WeakPolarHBondContact O-CB 3.23Å; Q388-N392 PolarHBondContact O-N 2.84Å; Q388-N392 PolarHBondContact O-OD1 3.43Å
389	F	74.8	Confident	73.6	Confident	20 Å²	20	62.6 Å²	62.6	9%	0.088	33%	0.327	C	S	.	.	H	α-helix	trans	-58.1	-55.4	171.9	176	-121.1	0	0	0	114.6	I259 Y264 L377 T387 R391 N392 I393	I259-F389 HydrophobicContact CD1-CE2 3.54Å; I259-F389 HydrophobicContact CD1-CZ 3.46Å; I259-F389 VanDerWaalsContact CD1-CZ 3.46Å; Y264-F389 HydrophobicContact CD1-CD1 4.28Å; Y264-F389 AromaticContact CD1-CE1 3.88Å; Y264-F389 HydrophobicContact CD1-CE1 3.88Å; Y264-F389 HydrophobicContact CD1-CE2 4.47Å; Y264-F389 AromaticContact CD1-CZ 3.99Å; Y264-F389 HydrophobicContact CD1-CZ 3.99Å; Y264-F389 HydrophobicContact CD2-CB 3.41Å; Y264-F389 VanDerWaalsContact CD2-CB 3.41Å; Y264-F389 AromaticContact CD2-CD1 3.13Å; Y264-F389 HydrophobicContact CD2-CD1 3.13Å; Y264-F389 AromaticContact CD2-CD2 3.56Å; Y264-F389 HydrophobicContact CD2-CD2 3.56Å; Y264-F389 AromaticContact CD2-CE1 3.59Å; Y264-F389 HydrophobicContact CD2-CE1 3.59Å; Y264-F389 HydrophobicContact CD2-CE2 4.04Å; Y264-F389 AromaticContact CD2-CG 3.06Å; Y264-F389 HydrophobicContact CD2-CG 3.06Å; Y264-F389 HydrophobicContact CD2-CZ 4.01Å; Y264-F389 HydrophobicContact CE1-CD1 4.35Å; Y264-F389 HydrophobicContact CE1-CE1 4.02Å; Y264-F389 HydrophobicContact CE2-CB 3.8Å; Y264-F389 AromaticContact CE2-CD1 3.16Å; Y264-F389 HydrophobicContact CE2-CD1 3.16Å; Y264-F389 HydrophobicContact CE2-CD2 4.43Å; Y264-F389 AromaticContact CE2-CE1 3.68Å; Y264-F389 HydrophobicContact CE2-CE1 3.68Å; Y264-F389 AromaticContact CE2-CG 3.56Å; Y264-F389 HydrophobicContact CE2-CG 3.56Å; Y264-F389 HydrophobicContact CG-CB 4.41Å; Y264-F389 AromaticContact CG-CD1 3.7Å; Y264-F389 HydrophobicContact CG-CD1 3.7Å; Y264-F389 AromaticContact CG-CD2 3.72Å; Y264-F389 HydrophobicContact CG-CD2 3.72Å; Y264-F389 AromaticContact CG-CE1 3.64Å; Y264-F389 HydrophobicContact CG-CE1 3.64Å; Y264-F389 AromaticContact CG-CE2 3.75Å; Y264-F389 HydrophobicContact CG-CE2 3.75Å; Y264-F389 AromaticContact CG-CG 3.68Å; Y264-F389 HydrophobicContact CG-CG 3.68Å; Y264-F389 AromaticContact CG-CZ 3.67Å; Y264-F389 HydrophobicContact CG-CZ 3.67Å; Y264-F389 AromaticContact CZ-CD1 3.79Å; Y264-F389 AromaticContact CZ-CE1 3.87Å; L377-F389 HydrophobicContact CD2-CE1 3.6Å; L377-F389 HydrophobicContact CD2-CZ 4.3Å; T387-F389 PolarHBondContact O-N 3.28Å; F389-R391 PolarHBondContact O-N 3.07Å; F389-N392 PolarHBondContact O-N 3.12Å; F389-N392 VanDerWaalsContact O-N 3.09Å; F389-I393 HydrophobicContact CD1-CD1 4.29Å; F389-I393 HydrophobicContact CD2-CD1 4.08Å; F389-I393 HydrophobicContact CD2-CG1 4.32Å; F389-I393 HydrophobicContact CE1-CD1 3.72Å; F389-I393 HydrophobicContact CE2-CD1 3.4Å; F389-I393 HydrophobicContact CE2-CG1 3.95Å; F389-I393 HydrophobicContact CG-CD1 4.48Å; F389-I393 HydrophobicContact CZ-CD1 3.23Å; F389-I393 HydrophobicContact CZ-CG1 4.27Å; F389-I393 PolarHBondContact O-N 3.46Å
390	V	74.1	Confident	72.1	Confident	1 Å²	1	64.5 Å²	64.5	1%	0.006	33%	0.328	C	S	.	.	H	α-helix	trans	-61	-37.8	178.1	173.2	0	0	0	0	109.9	L378 F383 T387 I393 R394	L378-V390 HydrophobicContact CD2-CG1 4.11Å; F383-V390 HydrophobicContact CB-CG2 3.93Å; T387-V390 PolarHBondContact O-N 3.01Å; T387-V390 WeakPolarHBondContact OG1-CG2 3.46Å; V390-I393 PolarHBondContact O-N 3.16Å; V390-R394 HydrophobicContact CG1-CG 4.45Å; V390-R394 VanDerWaalsContact O-CG 3.31Å; V390-R394 WeakPolarHBondContact O-CG 3.28Å; V390-R394 PolarHBondContact O-N 2.87Å
391	R	74.5	Confident	70.3	Confident	150 Å²	150	68.7 Å²	68.7	57%	0.566	36%	0.358	S	S	*	.	H	α-helix	trans	-59.4	-49.1	172.9	-70.6	-178	178.6	163.3	-2.4	111.7	T387 Q388 F389 I393 R394 T395	T387-R391 PolarHBondContact O-N 2.91Å; T387-R391 VanDerWaalsContact O-N 3.16Å; Q388-R391 WeakPolarHBondContact O-CB 3.23Å; Q388-R391 PolarHBondContact O-N 3.38Å; F389-R391 PolarHBondContact O-N 3.07Å; R391-I393 PolarHBondContact O-N 3.37Å; R391-R394 PolarHBondContact O-N 2.81Å; R391-T395 PolarHBondContact O-N 3.26Å; R391-T395 PolarHBondContact O-OG1 3.04Å
392	N	75.6	Confident	68.2	Low	53 Å²	53	70.3 Å²	70.3	28%	0.283	37%	0.373	S	S	.	.	H	α-helix	trans	-60.7	-43.9	179.8	-69.7	-4.4	0	0	0	111.7	Q388 F389 T395 N396	Q388-N392 WeakPolarHBondContact O-CB 3.23Å; Q388-N392 PolarHBondContact O-N 2.84Å; Q388-N392 PolarHBondContact O-OD1 3.43Å; F389-N392 PolarHBondContact O-N 3.12Å; F389-N392 VanDerWaalsContact O-N 3.09Å; N392-T395 PolarHBondContact O-N 3.03Å; N392-N396 PolarHBondContact O-N 3.04Å
393	I	74.3	Confident	65.6	Low	7 Å²	7	83.6 Å²	83.6	4%	0.036	42%	0.423	C	S	.	.	H	α-helix	trans	-61.2	-46.4	175	-65.1	178.5	0	0	0	110.8	Y227 E374 L378 F389 V390 R391 T395 N396 A397	Y227-I393 HydrophobicContact CE1-CD1 3.7Å; E374-I393 HydrophobicContact CG-CG2 4.45Å; L378-I393 HydrophobicContact CD1-CG2 4.25Å; L378-I393 HydrophobicContact CD2-CB 3.99Å; L378-I393 HydrophobicContact CD2-CG2 3.61Å; L378-I393 HydrophobicContact CG-CG2 4.09Å; F389-I393 HydrophobicContact CD1-CD1 4.29Å; F389-I393 HydrophobicContact CD2-CD1 4.08Å; F389-I393 HydrophobicContact CD2-CG1 4.32Å; F389-I393 HydrophobicContact CE1-CD1 3.72Å; F389-I393 HydrophobicContact CE2-CD1 3.4Å; F389-I393 HydrophobicContact CE2-CG1 3.95Å; F389-I393 HydrophobicContact CG-CD1 4.48Å; F389-I393 HydrophobicContact CZ-CD1 3.23Å; F389-I393 HydrophobicContact CZ-CG1 4.27Å; F389-I393 PolarHBondContact O-N 3.46Å; V390-I393 PolarHBondContact O-N 3.16Å; R391-I393 PolarHBondContact O-N 3.37Å; I393-T395 VanDerWaalsContact C-N 3.25Å; I393-T395 PolarHBondContact O-N 2.91Å; I393-N396 PolarHBondContact O-N 3.5Å; I393-A397 WeakPolarHBondContact O-CB 3.24Å; I393-A397 PolarHBondContact O-N 3.49Å
394	R	71.2	Confident	64.5	Low	101 Å²	101	87.5 Å²	87.5	38%	0.381	44%	0.443	S	S	.	.	H	α-helix	trans	-56.9	-41.5	176.9	-73.5	-178.2	-178.7	180	-1.4	112	L378 V390 R391 A397 N398	L378-R394 HydrophobicContact CD2-CB 4.4Å; L378-R394 HydrophobicContact CD2-CG 3.4Å; L378-R394 VanDerWaalsContact CD2-CG 3.4Å; L378-R394 PolarHBondContact O-NH2 3.34Å; V390-R394 HydrophobicContact CG1-CG 4.45Å; V390-R394 VanDerWaalsContact O-CG 3.31Å; V390-R394 WeakPolarHBondContact O-CG 3.28Å; V390-R394 PolarHBondContact O-N 2.87Å; R391-R394 PolarHBondContact O-N 2.81Å; R394-A397 PolarHBondContact O-N 2.7Å; R394-N398 WeakPolarHBondContact O-CB 3.35Å; R394-N398 VanDerWaalsContact O-CG 3.28Å; R394-N398 PolarHBondContact O-N 3.36Å; R394-N398 PolarHBondContact O-ND2 3.23Å
395	T	69.4	Low	63.9	Low	78 Å²	78	88.7 Å²	88.7	48%	0.479	44%	0.444	S	S	.	.	H	α-helix	trans	-64.3	-45.3	179.8	-26.4	0	0	0	0	110.9	R391 N392 I393 N398 L399	R391-T395 PolarHBondContact O-N 3.26Å; R391-T395 PolarHBondContact O-OG1 3.04Å; N392-T395 PolarHBondContact O-N 3.03Å; I393-T395 VanDerWaalsContact C-N 3.25Å; I393-T395 PolarHBondContact O-N 2.91Å; T395-N398 PolarHBondContact O-N 3.13Å; T395-L399 WeakPolarHBondContact O-CG 3.45Å; T395-L399 PolarHBondContact O-N 3.45Å; T395-L399 VanDerWaalsContact O-N 3.13Å
396	N	67.9	Low	63.9	Low	57 Å²	57	89.1 Å²	89.1	31%	0.305	44%	0.44	S	S	.	.	H	α-helix	trans	-66.1	-39	176.4	-76.8	-4.8	0	0	0	112.9	E260 N392 I393 L399 R400	E260-N396 PolarHBondContact OE2-ND2 3.49Å; N392-N396 PolarHBondContact O-N 3.04Å; I393-N396 PolarHBondContact O-N 3.5Å; N396-L399 PolarHBondContact O-N 3.13Å; N396-R400 PolarHBondContact O-N 3.06Å
397	A	64	Low	64.2	Low	24 Å²	24	89.2 Å²	89.2	20%	0.198	43%	0.432	C	S	.	.	H	α-helix	trans	-63.5	-44.7	177.5	0	0	0	0	0	111.6	I393 R394 L399 R400 S401	I393-A397 WeakPolarHBondContact O-CB 3.24Å; I393-A397 PolarHBondContact O-N 3.49Å; R394-A397 PolarHBondContact O-N 2.7Å; A397-L399 VanDerWaalsContact C-N 3.32Å; A397-L399 PolarHBondContact O-N 3.18Å; A397-R400 PolarHBondContact O-N 2.88Å; A397-R400 VanDerWaalsContact O-N 3.1Å; A397-S401 PolarHBondContact O-N 3.18Å; A397-S401 VanDerWaalsContact O-N 3.17Å
398	N	58.3	Low	64	Low	105 Å²	105	91.4 Å²	91.4	56%	0.561	44%	0.438	S	S	*	.	H	α-helix	trans	-66	-32.9	177.2	-71.4	-16.3	0	0	0	113	R394 T395 R400 S401 T402	R394-N398 WeakPolarHBondContact O-CB 3.35Å; R394-N398 VanDerWaalsContact O-CG 3.28Å; R394-N398 PolarHBondContact O-N 3.36Å; R394-N398 PolarHBondContact O-ND2 3.23Å; T395-N398 PolarHBondContact O-N 3.13Å; N398-R400 PolarHBondContact O-N 3.46Å; N398-S401 PolarHBondContact O-N 3.11Å; N398-S401 PolarHBondContact O-OG 2.84Å; N398-S401 VanDerWaalsContact O-OG 3.13Å; N398-T402 WeakPolarHBondContact O-CG2 3.44Å; N398-T402 PolarHBondContact O-N 2.91Å; N398-T402 PolarHBondContact O-OG1 3.47Å
399	L	53.4	Low	63.4	Low	102 Å²	102	87.7 Å²	87.7	53%	0.534	42%	0.422	S	S	.	.	H	α-helix	trans	-67.4	-24	173.9	-75.6	166.9	0	0	0	112.8	T395 N396 A397 T402	T395-L399 WeakPolarHBondContact O-CG 3.45Å; T395-L399 PolarHBondContact O-N 3.45Å; T395-L399 VanDerWaalsContact O-N 3.13Å; N396-L399 PolarHBondContact O-N 3.13Å; A397-L399 VanDerWaalsContact C-N 3.32Å; A397-L399 PolarHBondContact O-N 3.18Å; L399-T402 PolarHBondContact O-OG1 3.27Å
400	R	56.1	Low	62.6	Low	135 Å²	135	92.5 Å²	92.5	51%	0.509	45%	0.445	S	S	.	.	H	α-helix	trans	-86.5	-29.2	176.5	-69.7	-177	-168.9	-177.8	9	113.2	E260 N396 A397 N398 T402	E260-R400 IonicContact OE1-CZ 3.53Å; E260-R400 IonicContact OE1-NH1 3.75Å; E260-R400 IonicContact OE1-NH2 2.63Å; E260-R400 PolarHBondContact OE1-NH2 3.32Å; E260-R400 IonicContact OE2-NH2 3.61Å; N396-R400 PolarHBondContact O-N 3.06Å; A397-R400 PolarHBondContact O-N 2.88Å; A397-R400 VanDerWaalsContact O-N 3.1Å; N398-R400 PolarHBondContact O-N 3.46Å; R400-T402 PolarHBondContact O-N 3.37Å
401	S	54.2	Low	61.7	Low	92 Å²	92	99.5 Å²	99.5	64%	0.643	48%	0.479	S	S	*	.	H	α-helix	trans	-77.2	-10.1	176.3	65.4	0	0	0	0	113.7	A397 N398	A397-S401 PolarHBondContact O-N 3.18Å; A397-S401 VanDerWaalsContact O-N 3.17Å; N398-S401 PolarHBondContact O-N 3.11Å; N398-S401 PolarHBondContact O-OG 2.84Å; N398-S401 VanDerWaalsContact O-OG 3.13Å
402	T	47.5	Very low	60.7	Low	111 Å²	111	95.3 Å²	95.3	68%	0.681	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	1.2	-178.6	46.4	0	0	0	0	113.7	N398 L399 R400	N398-T402 WeakPolarHBondContact O-CG2 3.44Å; N398-T402 PolarHBondContact O-N 2.91Å; N398-T402 PolarHBondContact O-OG1 3.47Å; L399-T402 PolarHBondContact O-OG1 3.27Å; R400-T402 PolarHBondContact O-N 3.37Å
403	R	35.9	Very low	59.3	Low	279 Å²	279	99.2 Å²	99.2	100%	1.053	49%	0.489	S	S	*	.			trans	-110.1	0	170.5	-72.8	-176.3	177.3	-168	-0.9	109.2

Retrieved 403 of 403 residues in 2913.7 ms (Link to these results)

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