A0A3Q0KPQ4_SCHMA Loading...

Protein kinase domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KPQ4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 497 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	31.9	Very low	69.6	Low	249 Å²	249	90.7 Å²	90.7	100%	1.227	53%	0.533	S	S	*	.				0	98.1	0	-69.8	-165.3	161.5	0	0	108.1
2	T	35	Very low	71.5	Confident	138 Å²	138	83.9 Å²	83.9	85%	0.847	49%	0.493	S	S	*	.			trans	-84.9	111	174.9	45.7	0	0	0	0	107.5	S4	T2-S4 PolarHBondContact O-N 3.41Å
3	S	33.9	Very low	73	Confident	112 Å²	112	78.5 Å²	78.5	78%	0.783	46%	0.459	S	S	*	.			trans	-54.4	106.3	166.5	54	0	0	0	0	107.8	S5	S3-S5 PolarHBondContact O-N 3.44Å
4	S	50.8	Low	74.3	Confident	76 Å²	76	73.3 Å²	73.3	53%	0.531	43%	0.429	S	S	.	.			trans	-68.1	108.7	173.9	54	0	0	0	0	106.6	T2 N83	T2-S4 PolarHBondContact O-N 3.41Å; S4-N83 WeakPolarHBondContact CB-OD1 3.24Å; S4-N83 PolarHBondContact O-OD1 3.26Å; S4-N83 PolarHBondContact OG-OD1 2.9Å
5	S	71.9	Confident	75.3	Confident	92 Å²	92	69 Å²	69	64%	0.643	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-83.4	130.5	175.7	53.5	0	0	0	0	108.6	S3 S7	S3-S5 PolarHBondContact O-N 3.44Å; S5-S7 PolarHBondContact O-N 3.44Å
6	M	83.2	Confident	76.3	Confident	71 Å²	71	69.4 Å²	69.4	35%	0.35	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-67.7	127.1	165.8	-86.8	-72.6	-169.9	0	0	109.6	A80 G82 N83 H85	M6-A80 HydrophobicContact SD-CB 4.22Å; M6-G82 WeakPolarHBondContact CE-O 3.26Å; M6-G82 WeakPolarHBondContact SD-CA 3Å; M6-G82 PolarHBondContact SD-N 2.92Å; M6-N83 HydrophobicContact CE-CB 4.12Å; M6-H85 HydrophobicContact CE-CB 3.96Å
7	S	91	Very high	76.8	Confident	40 Å²	40	67.3 Å²	67.3	28%	0.28	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	133.1	170.3	-60.7	0	0	0	0	109.2	S5 A80 I81	S5-S7 PolarHBondContact O-N 3.44Å; S7-A80 CarbonylContact O-C 3.6Å; S7-A80 VanDerWaalsContact O-CA 3.29Å; S7-A80 WeakPolarHBondContact O-CA 3.47Å; S7-I81 PolarHBondContact N-O 2.72Å; S7-I81 PolarHBondContact O-N 2.97Å
8	L	92.5	Very high	77.2	Confident	120 Å²	120	67.6 Å²	67.6	63%	0.628	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115	132.9	-177	-63.5	168.9	0	0	0	109.9	I78 A80	L8-I78 HydrophobicContact CD2-CG2 3.79Å; L8-A80 HydrophobicContact CD2-CB 3.38Å
9	F	92.6	Very high	77.1	Confident	24 Å²	24	65.1 Å²	65.1	11%	0.105	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	129.8	178.8	-55.2	-79.6	0	0	0	110.1	L11 I78 L79 I81 I229 N232 V233 C236	F9-L11 HydrophobicContact CB-CD2 4.39Å; F9-L11 HydrophobicContact CB-CG 4.23Å; F9-I78 CarbonylContact O-C 3.58Å; F9-I78 WeakPolarHBondContact O-CA 3.43Å; F9-L79 HydrophobicContact CB-CB 4.44Å; F9-L79 PolarHBondContact N-O 3.12Å; F9-L79 PolarHBondContact O-N 3.33Å; F9-I81 HydrophobicContact CD2-CD1 4.21Å; F9-I81 HydrophobicContact CE2-CD1 4Å; F9-I81 HydrophobicContact CE2-CG1 4.46Å; F9-I229 HydrophobicContact CD1-CG2 4.17Å; F9-N232 HydrophobicContact CE1-CB 3.69Å; F9-N232 HydrophobicContact CZ-CB 4.13Å; F9-V233 HydrophobicContact CB-CG2 3.98Å; F9-V233 HydrophobicContact CD1-CG2 3.63Å; F9-V233 HydrophobicContact CD2-CG2 3.61Å; F9-V233 HydrophobicContact CE1-CG2 3.94Å; F9-V233 HydrophobicContact CE2-CG2 3.92Å; F9-V233 HydrophobicContact CG-CG2 3.43Å; F9-V233 VanDerWaalsContact CG-CG2 3.43Å; F9-V233 HydrophobicContact CZ-CG2 4.07Å; F9-C236 HydrophobicContact CE2-CB 4.31Å
10	T	91.2	Very high	76.7	Confident	74 Å²	74	67.5 Å²	67.5	45%	0.454	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	119.4	169.4	-53.3	0	0	0	0	108.5	V77 L91	T10-V77 WeakPolarHBondContact CA-O 3.33Å; T10-L91 HydrophobicContact CG2-CD1 3.96Å
11	L	92.2	Very high	75.7	Confident	2 Å²	2	72.6 Å²	72.6	1%	0.01	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	158.5	-177.3	-57.1	177.3	0	0	0	110.2	F9 S76 V77 L79 I202 F222 A224 I229	F9-L11 HydrophobicContact CB-CD2 4.39Å; F9-L11 HydrophobicContact CB-CG 4.23Å; L11-S76 WeakPolarHBondContact O-CA 3.37Å; L11-V77 HydrophobicContact CB-CG2 4.15Å; L11-V77 PolarHBondContact N-O 2.84Å; L11-V77 WeakPolarHBondContact O-CG2 3.09Å; L11-V77 PolarHBondContact O-N 2.86Å; L11-L79 HydrophobicContact CD1-CB 3.88Å; L11-L79 HydrophobicContact CD1-CD2 3.61Å; L11-L79 HydrophobicContact CD1-CG 4.4Å; L11-I202 HydrophobicContact CD1-CD1 4.09Å; L11-I202 HydrophobicContact CD2-CD1 3.84Å; L11-F222 HydrophobicContact CB-CB 4.11Å; L11-F222 HydrophobicContact CB-CD1 4.31Å; L11-F222 HydrophobicContact CD1-CB 4.01Å; L11-F222 HydrophobicContact CD1-CD1 4.36Å; L11-F222 HydrophobicContact CD1-CG 4.11Å; L11-A224 HydrophobicContact CD2-CB 3.8Å; L11-I229 HydrophobicContact CD2-CG2 3.83Å
12	S	91.3	Very high	76.4	Confident	9 Å²	9	62.9 Å²	62.9	6%	0.063	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	126	169.8	-59.2	0	0	0	0	109.5	F222 L223	S12-F222 CarbonylContact O-C 3.56Å; S12-F222 WeakPolarHBondContact O-CA 3.47Å; S12-L223 PolarHBondContact N-O 3.49Å; S12-L223 PolarHBondContact O-N 3.1Å
13	Y	91.8	Very high	76.8	Confident	13 Å²	13	63.5 Å²	63.5	5%	0.051	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	121.7	-176.5	-178.9	-121.2	0	0	0	111.2	G15 H16 Y74 D75 V77 V116 Y220 F222	Y13-G15 VanDerWaalsContact CE2-C 3.5Å; Y13-G15 WeakPolarHBondContact CE2-O 3.43Å; Y13-G15 PolarHBondContact OH-O 3.14Å; Y13-H16 WeakPolarHBondContact OH-CB 3.42Å; Y13-H16 PolarHBondContact OH-N 3.44Å; Y13-H16 PolarHBondContact OH-ND1 3.39Å; Y13-Y74 WeakPolarHBondContact O-CD1 3Å; Y13-D75 PolarHBondContact N-O 3.34Å; Y13-V77 HydrophobicContact CG-CG1 4.31Å; Y13-V116 HydrophobicContact CD1-CG2 4.01Å; Y13-V116 HydrophobicContact CE1-CB 4.25Å; Y13-V116 HydrophobicContact CE1-CG2 3.33Å; Y13-Y220 HydrophobicContact CE2-CD1 4.16Å; Y13-F222 AromaticContact CD2-CD1 3.67Å; Y13-F222 HydrophobicContact CD2-CD1 3.67Å; Y13-F222 AromaticContact CD2-CE1 3.37Å; Y13-F222 HydrophobicContact CD2-CE1 3.37Å; Y13-F222 HydrophobicContact CD2-CZ 4.05Å; Y13-F222 AromaticContact CE2-CE1 3.95Å; Y13-F222 HydrophobicContact CE2-CE1 3.95Å; Y13-F222 HydrophobicContact CE2-CZ 4.18Å; Y13-F222 HydrophobicContact CG-CD1 4.49Å; Y13-F222 HydrophobicContact CG-CE1 4.33Å
14	L	90.8	Very high	77.1	Confident	6 Å²	6	65.3 Å²	65.3	3%	0.031	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	-22.1	180	-92.4	57.8	0	0	0	112.3	Y37 Y74 V221 L223	L14-Y37 HydrophobicContact CB-CD1 4.07Å; L14-Y37 WeakPolarHBondContact O-CE1 3.29Å; L14-Y74 HydrophobicContact CD1-CD1 3.84Å; L14-Y74 HydrophobicContact CD1-CE1 3.97Å; L14-Y74 HydrophobicContact CD1-CG 4.46Å; L14-Y74 HydrophobicContact CG-CD1 4.19Å; L14-Y74 HydrophobicContact CG-CE1 3.88Å; L14-V221 HydrophobicContact CB-CB 4.31Å; L14-V221 HydrophobicContact CB-CG1 4.19Å; L14-V221 HydrophobicContact CD2-CG1 4.29Å; L14-V221 PolarHBondContact N-O 3Å; L14-L223 HydrophobicContact CD1-CB 4.1Å; L14-L223 HydrophobicContact CD1-CD1 3.61Å; L14-L223 HydrophobicContact CD1-CG 3.45Å; L14-L223 VanDerWaalsContact CD1-CG 3.45Å; L14-L223 HydrophobicContact CD2-CD1 4.05Å; L14-L223 HydrophobicContact CD2-CD2 4.19Å; L14-L223 HydrophobicContact CD2-CG 3.79Å; L14-L223 HydrophobicContact CG-CD1 4.4Å; L14-L223 HydrophobicContact CG-CG 4.27Å
15	G	90.1	Very high	77.2	Confident	9 Å²	9	64.9 Å²	64.9	9%	0.093	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	134.1	-172.1	-179.2	0	0	0	0	0	112.4	Y13 V221	Y13-G15 VanDerWaalsContact CE2-C 3.5Å; Y13-G15 WeakPolarHBondContact CE2-O 3.43Å; Y13-G15 PolarHBondContact OH-O 3.14Å; G15-V221 PolarHBondContact O-N 3.35Å
16	H	90.2	Very high	76.7	Confident	76 Å²	76	62.6 Å²	62.6	35%	0.352	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	154.5	171.1	64.9	-79.6	0	0	0	110.2	Y13 Y37 T218 C219 Y220	Y13-H16 WeakPolarHBondContact OH-CB 3.42Å; Y13-H16 PolarHBondContact OH-N 3.44Å; Y13-H16 PolarHBondContact OH-ND1 3.39Å; H16-Y37 PolarHBondContact N-OH 3.02Å; H16-Y37 PolarHBondContact O-OH 3.34Å; H16-T218 HydrophobicContact CB-CG2 3.98Å; H16-C219 CarbonylContact C-O 3.57Å; H16-C219 WeakPolarHBondContact CA-O 3.4Å; H16-C219 VanDerWaalsContact CB-O 3.3Å; H16-C219 WeakPolarHBondContact CB-O 3.42Å; H16-Y220 HydrophobicContact CB-CD1 3.9Å; H16-Y220 HydrophobicContact CB-CE1 4.07Å; H16-Y220 HydrophobicContact CB-CG 4.27Å
17	S	86.1	Confident	75.7	Confident	33 Å²	33	61.8 Å²	61.8	23%	0.231	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	140.9	173.4	-73.9	0	0	0	0	110.3	L33 Y37 T218 C219	S17-L33 WeakPolarHBondContact OG-CD1 3.38Å; S17-Y37 PolarHBondContact N-OH 3.34Å; S17-Y37 PolarHBondContact OG-OH 2.83Å; S17-T218 WeakPolarHBondContact O-CA 3.36Å; S17-C219 PolarHBondContact N-O 2.89Å; S17-C219 PolarHBondContact O-N 3.36Å
18	T	82.9	Confident	74.6	Confident	73 Å²	73	63.9 Å²	63.9	45%	0.448	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	116.1	175.2	-59.1	0	0	0	0	109.3	C216 L217	T18-C216 HydrophobicContact CG2-CB 3.51Å; T18-C216 WeakPolarHBondContact CG2-SG 3.48Å; T18-L217 CarbonylContact C-O 3.49Å
19	I	75.1	Confident	73.5	Confident	19 Å²	19	61 Å²	61	10%	0.097	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	109.1	176	-54.4	173.5	0	0	0	106.7	I30 L33 M205 L217 C219	I19-I30 HydrophobicContact CD1-CD1 4.32Å; I19-I30 HydrophobicContact CD1-CG1 3.57Å; I19-L33 HydrophobicContact CD1-CD2 4.4Å; I19-M205 HydrophobicContact CD1-CE 4.1Å; I19-L217 HydrophobicContact CB-CB 4.4Å; I19-L217 PolarHBondContact N-O 3.46Å; I19-L217 PolarHBondContact O-N 3.44Å; I19-C219 HydrophobicContact CD1-CB 4.36Å
20	Q	68.7	Low	72.7	Confident	114 Å²	114	60.3 Å²	60.3	53%	0.533	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	145.1	168.3	-69.7	179.8	-19.3	0	0	108.7	S22	Q20-S22 PolarHBondContact O-N 3.23Å
21	K	57.1	Low	72.2	Confident	174 Å²	174	59.6 Å²	59.6	76%	0.757	31%	0.313	S	S	*	.			trans	-51.6	105	-178.6	-164.9	178	-176.2	-177.5	0	109.8
22	S	46.4	Very low	71.7	Confident	45 Å²	45	65.3 Å²	65.3	32%	0.315	34%	0.34	S	S	.	.			trans	-97.8	141.2	176.3	66.2	0	0	0	0	109	Q20 D24	Q20-S22 PolarHBondContact O-N 3.23Å; S22-D24 VanDerWaalsContact C-N 3.27Å; S22-D24 PolarHBondContact O-N 2.85Å
23	N	43.7	Very low	71.5	Confident	152 Å²	152	66.6 Å²	66.6	81%	0.813	35%	0.346	S	S	*	.	S	Bend	trans	-71.9	-12.6	-166.7	-86	-19.9	0	0	0	115
24	D	39.1	Very low	71.4	Confident	149 Å²	149	66 Å²	66	80%	0.797	34%	0.343	S	S	*	.	S	Bend	trans	-159	138	174.4	-75.6	-57.7	0	0	0	110.5	S22	S22-D24 VanDerWaalsContact C-N 3.27Å; S22-D24 PolarHBondContact O-N 2.85Å
25	C	52.7	Low	71.3	Confident	67 Å²	67	66.2 Å²	66.2	45%	0.453	34%	0.344	S	S	.	.			trans	73.2	40.1	175.6	-92.6	0	0	0	0	120.2	L27 E28 T29	C25-L27 PolarHBondContact O-N 2.93Å; C25-E28 HydrophobicContact CB-CB 4.33Å; C25-E28 PolarHBondContact O-N 3.17Å; C25-E28 VanDerWaalsContact O-N 3.12Å; C25-E28 PolarHBondContact SG-OE2 2.75Å; C25-T29 PolarHBondContact O-N 3.15Å; C25-T29 PolarHBondContact O-OG1 3.08Å
26	E	62.4	Low	71.3	Confident	44 Å²	44	70.6 Å²	70.6	21%	0.206	37%	0.366	C	S	.	.	H	α-helix	trans	-46.4	-36.2	173.6	-64.2	-178.2	162.5	0	0	114.3	I30	E26-I30 WeakPolarHBondContact O-CD1 3.38Å; E26-I30 WeakPolarHBondContact O-CG1 3.32Å; E26-I30 PolarHBondContact O-N 2.84Å
27	L	61.7	Low	71.3	Confident	54 Å²	54	69 Å²	69	28%	0.283	36%	0.357	S	S	.	.	H	α-helix	trans	-74.4	-36.5	-177.3	-70.1	172.8	0	0	0	114.6	C25 T29 I30 Y31 H323 L326	C25-L27 PolarHBondContact O-N 2.93Å; L27-T29 VanDerWaalsContact C-N 3.34Å; L27-I30 HydrophobicContact CD2-CD1 4.25Å; L27-I30 PolarHBondContact O-N 3.14Å; L27-Y31 PolarHBondContact O-N 3.14Å; L27-H323 HydrophobicContact CD1-CB 4.12Å; L27-L326 HydrophobicContact CD1-CD2 4.14Å; L27-L326 HydrophobicContact CD2-CD2 3.96Å; L27-L326 HydrophobicContact CG-CD2 4.48Å
28	E	67.9	Low	71.6	Confident	85 Å²	85	67.5 Å²	67.5	40%	0.397	35%	0.346	S	S	.	.	H	α-helix	trans	-67.2	-43.1	174.8	-72.2	178.8	165	0	0	108.9	C25 I30 Y31 E32	C25-E28 HydrophobicContact CB-CB 4.33Å; C25-E28 PolarHBondContact O-N 3.17Å; C25-E28 VanDerWaalsContact O-N 3.12Å; C25-E28 PolarHBondContact SG-OE2 2.75Å; E28-I30 VanDerWaalsContact C-N 3.3Å; E28-I30 PolarHBondContact O-N 2.81Å; E28-Y31 WeakPolarHBondContact O-CB 3.45Å; E28-Y31 PolarHBondContact O-N 3.43Å; E28-E32 WeakPolarHBondContact O-CG 3.43Å; E28-E32 PolarHBondContact O-N 3.28Å
29	T	69.7	Low	72	Confident	60 Å²	60	64.9 Å²	64.9	37%	0.368	33%	0.329	S	S	.	.	H	α-helix	trans	-57.2	-42.4	173	-50.6	0	0	0	0	112.1	C25 L27 L33	C25-T29 PolarHBondContact O-N 3.15Å; C25-T29 PolarHBondContact O-OG1 3.08Å; L27-T29 VanDerWaalsContact C-N 3.34Å; T29-L33 WeakPolarHBondContact O-CB 3.34Å; T29-L33 PolarHBondContact O-N 3.05Å
30	I	76	Confident	72.7	Confident	8 Å²	8	68 Å²	68	4%	0.041	34%	0.343	C	S	.	.	H	α-helix	trans	-62	-47.5	174.4	-71.7	162.5	0	0	0	110.5	I19 E26 L27 E28 L33 L34 Y203 M205	I19-I30 HydrophobicContact CD1-CD1 4.32Å; I19-I30 HydrophobicContact CD1-CG1 3.57Å; E26-I30 WeakPolarHBondContact O-CD1 3.38Å; E26-I30 WeakPolarHBondContact O-CG1 3.32Å; E26-I30 PolarHBondContact O-N 2.84Å; L27-I30 HydrophobicContact CD2-CD1 4.25Å; L27-I30 PolarHBondContact O-N 3.14Å; E28-I30 VanDerWaalsContact C-N 3.3Å; E28-I30 PolarHBondContact O-N 2.81Å; I30-L33 WeakPolarHBondContact O-CB 3.49Å; I30-L33 PolarHBondContact O-N 3.36Å; I30-L34 HydrophobicContact CG2-CD1 3.96Å; I30-L34 HydrophobicContact CG2-CG 4.33Å; I30-L34 VanDerWaalsContact O-CG 3.22Å; I30-L34 WeakPolarHBondContact O-CG 3.31Å; I30-L34 PolarHBondContact O-N 2.85Å; I30-Y203 HydrophobicContact CG2-CE2 4.16Å; I30-M205 HydrophobicContact CB-CE 4.03Å; I30-M205 HydrophobicContact CD1-CE 3.38Å; I30-M205 HydrophobicContact CD1-SD 3.63Å; I30-M205 HydrophobicContact CG1-CE 3.35Å; I30-M205 HydrophobicContact CG1-SD 4.26Å; I30-M205 HydrophobicContact CG2-CE 3.49Å; I30-M205 VanDerWaalsContact CG2-CE 3.49Å
31	Y	81.3	Confident	73.7	Confident	60 Å²	60	62.6 Å²	62.6	24%	0.235	32%	0.318	C	S	.	.	H	α-helix	trans	-61.6	-47.6	-177.5	-171.2	-105.3	0	0	0	111.6	L27 E28 L33 L34 I35 F164 I180	L27-Y31 PolarHBondContact O-N 3.14Å; E28-Y31 WeakPolarHBondContact O-CB 3.45Å; E28-Y31 PolarHBondContact O-N 3.43Å; Y31-L33 PolarHBondContact O-N 3.28Å; Y31-L34 PolarHBondContact O-N 2.9Å; Y31-I35 HydrophobicContact CD1-CD1 3.33Å; Y31-I35 HydrophobicContact CD1-CG1 4.48Å; Y31-I35 HydrophobicContact CE1-CD1 3.19Å; Y31-I35 HydrophobicContact CE1-CG1 4.32Å; Y31-I35 HydrophobicContact CG-CD1 4.12Å; Y31-I35 WeakPolarHBondContact O-CD1 3.04Å; Y31-I35 WeakPolarHBondContact O-CG1 3.05Å; Y31-I35 PolarHBondContact O-N 3.18Å; Y31-F164 HydrophobicContact CE2-CB 3.71Å; Y31-F164 HydrophobicContact CE2-CD2 4.3Å; Y31-F164 PolarHBondContact OH-N 3.21Å; Y31-F164 PolarHBondContact OH-O 2.9Å; Y31-I180 HydrophobicContact CE1-CD1 4.38Å
32	E	81.4	Confident	75.2	Confident	122 Å²	122	54.3 Å²	54.3	57%	0.57	28%	0.282	S	S	*	.	H	α-helix	trans	-58.3	-46.6	175	-70.7	177.8	169.9	0	0	111.6	E28 L34 I35 D36	E28-E32 WeakPolarHBondContact O-CG 3.43Å; E28-E32 PolarHBondContact O-N 3.28Å; E32-L34 VanDerWaalsContact C-N 3.34Å; E32-L34 PolarHBondContact O-N 3.16Å; E32-I35 WeakPolarHBondContact O-CB 3.38Å; E32-I35 PolarHBondContact O-N 3.22Å; E32-I35 VanDerWaalsContact O-N 3.1Å; E32-D36 PolarHBondContact O-N 3.31Å
33	L	86.8	Confident	77.2	Confident	36 Å²	36	57 Å²	57	19%	0.188	29%	0.285	C	S	.	.	H	α-helix	trans	-55.8	-47.6	175.8	177.8	76.8	0	0	0	111.9	S17 I19 T29 I30 Y31 I35 D36 Y37 C219	S17-L33 WeakPolarHBondContact OG-CD1 3.38Å; I19-L33 HydrophobicContact CD1-CD2 4.4Å; T29-L33 WeakPolarHBondContact O-CB 3.34Å; T29-L33 PolarHBondContact O-N 3.05Å; I30-L33 WeakPolarHBondContact O-CB 3.49Å; I30-L33 PolarHBondContact O-N 3.36Å; Y31-L33 PolarHBondContact O-N 3.28Å; L33-I35 VanDerWaalsContact C-N 3.28Å; L33-I35 PolarHBondContact O-N 2.7Å; L33-D36 PolarHBondContact O-N 3.02Å; L33-Y37 HydrophobicContact CD1-CD2 4.3Å; L33-Y37 HydrophobicContact CD1-CE2 3.83Å; L33-Y37 HydrophobicContact CD2-CE2 4.23Å; L33-Y37 HydrophobicContact CG-CD2 4.02Å; L33-Y37 HydrophobicContact CG-CE2 3.8Å; L33-Y37 WeakPolarHBondContact O-CD2 3.18Å; L33-Y37 PolarHBondContact O-N 3.37Å; L33-Y37 VanDerWaalsContact O-N 3.08Å; L33-C219 HydrophobicContact CD2-CB 4.18Å
34	L	89.6	Confident	79.1	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-65.5	-34.3	179.9	-61.5	174.6	0	0	0	111.4	I30 Y31 E32 Y38 Y131 F164 L201 Y203 V221	I30-L34 HydrophobicContact CG2-CD1 3.96Å; I30-L34 HydrophobicContact CG2-CG 4.33Å; I30-L34 VanDerWaalsContact O-CG 3.22Å; I30-L34 WeakPolarHBondContact O-CG 3.31Å; I30-L34 PolarHBondContact O-N 2.85Å; Y31-L34 PolarHBondContact O-N 2.9Å; E32-L34 VanDerWaalsContact C-N 3.34Å; E32-L34 PolarHBondContact O-N 3.16Å; L34-Y38 PolarHBondContact O-N 3.19Å; L34-Y131 HydrophobicContact CD1-CD2 4.1Å; L34-Y131 HydrophobicContact CD1-CE2 3.82Å; L34-F164 HydrophobicContact CB-CE2 4.14Å; L34-F164 WeakPolarHBondContact O-CE2 3.4Å; L34-L201 HydrophobicContact CB-CD2 4.27Å; L34-L201 HydrophobicContact CD1-CD2 4.34Å; L34-L201 HydrophobicContact CD2-CD2 4.04Å; L34-L201 HydrophobicContact CG-CD2 4.41Å; L34-Y203 HydrophobicContact CD1-CD1 3.51Å; L34-Y203 HydrophobicContact CD1-CD2 4.26Å; L34-Y203 HydrophobicContact CD1-CE1 3.57Å; L34-Y203 HydrophobicContact CD1-CE2 4.31Å; L34-Y203 HydrophobicContact CD1-CG 3.86Å; L34-Y203 HydrophobicContact CD2-CD1 4.19Å; L34-Y203 HydrophobicContact CD2-CD2 4.29Å; L34-Y203 HydrophobicContact CD2-CG 3.81Å; L34-Y203 HydrophobicContact CG-CG 4.5Å; L34-V221 HydrophobicContact CD2-CG1 4.27Å; L34-V221 HydrophobicContact CD2-CG2 3.65Å
35	I	89	Confident	81.2	Confident	11 Å²	11	44.6 Å²	44.6	6%	0.056	22%	0.218	C	C	.	.	H	α-helix	trans	-65.7	-46.4	175.4	-74.2	157	0	0	0	110.1	Y31 E32 L33 Y37 Y38 L39 F164 I180	Y31-I35 HydrophobicContact CD1-CD1 3.33Å; Y31-I35 HydrophobicContact CD1-CG1 4.48Å; Y31-I35 HydrophobicContact CE1-CD1 3.19Å; Y31-I35 HydrophobicContact CE1-CG1 4.32Å; Y31-I35 HydrophobicContact CG-CD1 4.12Å; Y31-I35 WeakPolarHBondContact O-CD1 3.04Å; Y31-I35 WeakPolarHBondContact O-CG1 3.05Å; Y31-I35 PolarHBondContact O-N 3.18Å; E32-I35 WeakPolarHBondContact O-CB 3.38Å; E32-I35 PolarHBondContact O-N 3.22Å; E32-I35 VanDerWaalsContact O-N 3.1Å; L33-I35 VanDerWaalsContact C-N 3.28Å; L33-I35 PolarHBondContact O-N 2.7Å; I35-Y37 VanDerWaalsContact C-N 3.33Å; I35-Y37 PolarHBondContact O-N 3.05Å; I35-Y38 CarbonylContact O-C 3.59Å; I35-Y38 PolarHBondContact O-N 3.11Å; I35-L39 HydrophobicContact CG2-CD1 3.6Å; I35-L39 HydrophobicContact CG2-CG 3.88Å; I35-L39 WeakPolarHBondContact O-CB 3.18Å; I35-L39 WeakPolarHBondContact O-CG 3.13Å; I35-L39 PolarHBondContact O-N 3.36Å; I35-F164 HydrophobicContact CB-CE2 4.3Å; I35-F164 HydrophobicContact CD1-CD2 4.47Å; I35-F164 HydrophobicContact CG1-CD2 3.56Å; I35-F164 HydrophobicContact CG1-CE2 3.61Å; I35-I180 HydrophobicContact CD1-CD1 3.16Å; I35-I180 HydrophobicContact CD1-CG1 4.47Å; I35-I180 HydrophobicContact CG1-CD1 3.9Å; I35-I180 HydrophobicContact CG2-CD1 4.11Å
36	D	89.5	Confident	82.6	Confident	101 Å²	101	42 Å²	42	54%	0.54	20%	0.201	S	C	.	.	H	α-helix	trans	-59.6	-45.3	179.6	-73.6	-20.9	0	0	0	111.3	E32 L33 Y38 L39 E40	E32-D36 PolarHBondContact O-N 3.31Å; L33-D36 PolarHBondContact O-N 3.02Å; D36-Y38 VanDerWaalsContact C-N 3.26Å; D36-Y38 PolarHBondContact O-N 2.82Å; D36-L39 PolarHBondContact O-N 3.37Å; D36-E40 VanDerWaalsContact O-CB 3.3Å; D36-E40 WeakPolarHBondContact O-CB 3.46Å; D36-E40 PolarHBondContact O-N 3.25Å
37	Y	90.5	Very high	83.4	Confident	43 Å²	43	43.7 Å²	43.7	17%	0.169	22%	0.217	C	C	.	.	H	α-helix	trans	-53.9	-43.1	172.9	-87.7	-65.6	0	0	0	112.4	L14 H16 S17 L33 I35 F41 V221	L14-Y37 HydrophobicContact CB-CD1 4.07Å; L14-Y37 WeakPolarHBondContact O-CE1 3.29Å; H16-Y37 PolarHBondContact N-OH 3.02Å; H16-Y37 PolarHBondContact O-OH 3.34Å; S17-Y37 PolarHBondContact N-OH 3.34Å; S17-Y37 PolarHBondContact OG-OH 2.83Å; L33-Y37 HydrophobicContact CD1-CD2 4.3Å; L33-Y37 HydrophobicContact CD1-CE2 3.83Å; L33-Y37 HydrophobicContact CD2-CE2 4.23Å; L33-Y37 HydrophobicContact CG-CD2 4.02Å; L33-Y37 HydrophobicContact CG-CE2 3.8Å; L33-Y37 WeakPolarHBondContact O-CD2 3.18Å; L33-Y37 PolarHBondContact O-N 3.37Å; L33-Y37 VanDerWaalsContact O-N 3.08Å; I35-Y37 VanDerWaalsContact C-N 3.33Å; I35-Y37 PolarHBondContact O-N 3.05Å; Y37-F41 PolarHBondContact O-N 3.27Å; Y37-F41 VanDerWaalsContact O-N 3.16Å; Y37-V221 HydrophobicContact CD2-CB 4.31Å; Y37-V221 HydrophobicContact CD2-CG1 4.39Å; Y37-V221 HydrophobicContact CD2-CG2 3.79Å; Y37-V221 HydrophobicContact CE2-CB 4.5Å; Y37-V221 HydrophobicContact CE2-CG2 3.82Å; Y37-V221 HydrophobicContact CG-CB 4.45Å; Y37-V221 HydrophobicContact CG-CG1 4.3Å; Y37-V221 HydrophobicContact CG-CG2 4.42Å
38	Y	92.1	Very high	83.8	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-80	-37	-175.7	-159	-86	0	0	0	113.4	L34 I35 D36 E40 F41 L42 F133 F164 R198 P199 L201 L223	L34-Y38 PolarHBondContact O-N 3.19Å; I35-Y38 CarbonylContact O-C 3.59Å; I35-Y38 PolarHBondContact O-N 3.11Å; D36-Y38 VanDerWaalsContact C-N 3.26Å; D36-Y38 PolarHBondContact O-N 2.82Å; Y38-E40 VanDerWaalsContact C-N 3.32Å; Y38-F41 HydrophobicContact CE1-CD1 4.43Å; Y38-F41 HydrophobicContact CE2-CD1 4.41Å; Y38-F41 WeakPolarHBondContact O-CB 3.38Å; Y38-F41 PolarHBondContact O-N 2.93Å; Y38-L42 HydrophobicContact CD1-CD1 3.89Å; Y38-L42 HydrophobicContact CD1-CG 3.98Å; Y38-L42 HydrophobicContact CE1-CD1 3.91Å; Y38-L42 HydrophobicContact CE1-CD2 4.12Å; Y38-L42 HydrophobicContact CE1-CG 3.96Å; Y38-L42 WeakPolarHBondContact O-CG 3.47Å; Y38-L42 PolarHBondContact O-N 2.98Å; Y38-F133 HydrophobicContact CD1-CB 4.01Å; Y38-F133 HydrophobicContact CD1-CD1 4.15Å; Y38-F133 AromaticContact CD1-CD2 3.65Å; Y38-F133 HydrophobicContact CD1-CD2 3.65Å; Y38-F133 HydrophobicContact CD1-CE1 4.48Å; Y38-F133 HydrophobicContact CD1-CE2 4.03Å; Y38-F133 AromaticContact CD1-CG 3.69Å; Y38-F133 HydrophobicContact CD1-CG 3.69Å; Y38-F133 HydrophobicContact CD1-CZ 4.4Å; Y38-F133 HydrophobicContact CE1-CB 3.35Å; Y38-F133 AromaticContact CE1-CD1 3.69Å; Y38-F133 HydrophobicContact CE1-CD1 3.69Å; Y38-F133 AromaticContact CE1-CD2 3.86Å; Y38-F133 HydrophobicContact CE1-CD2 3.86Å; Y38-F133 HydrophobicContact CE1-CE1 4.36Å; Y38-F133 AromaticContact CE1-CG 3.37Å; Y38-F133 HydrophobicContact CE1-CG 3.37Å; Y38-F133 HydrophobicContact CE2-CB 4.36Å; Y38-F133 HydrophobicContact CG-CD2 4.39Å; Y38-F164 VanDerWaalsContact CB-CZ 3.48Å; Y38-F164 HydrophobicContact CD1-CE1 4.38Å; Y38-F164 HydrophobicContact CD1-CZ 4.31Å; Y38-F164 AromaticContact CD2-CE1 3.91Å; Y38-F164 HydrophobicContact CD2-CE1 3.91Å; Y38-F164 AromaticContact CD2-CZ 3.8Å; Y38-F164 HydrophobicContact CD2-CZ 3.8Å; Y38-F164 HydrophobicContact CE2-CE1 4.31Å; Y38-F164 AromaticContact CG-CE1 3.94Å; Y38-F164 HydrophobicContact CG-CE1 3.94Å; Y38-F164 AromaticContact CG-CZ 3.6Å; Y38-F164 HydrophobicContact CG-CZ 3.6Å; Y38-R198 WeakPolarHBondContact OH-CB 3.48Å; Y38-P199 WeakPolarHBondContact CE2-O 3.26Å; Y38-P199 PolarHBondContact OH-O 3.21Å; Y38-L201 HydrophobicContact CD2-CB 3.99Å; Y38-L201 HydrophobicContact CD2-CD1 3.8Å; Y38-L201 HydrophobicContact CE2-CB 4.22Å; Y38-L201 HydrophobicContact CG-CD1 4.48Å; Y38-L223 HydrophobicContact CD2-CD2 3.89Å; Y38-L223 HydrophobicContact CE2-CD2 3.59Å
39	L	91.3	Very high	83.3	Confident	18 Å²	18	46 Å²	46	9%	0.094	23%	0.226	C	C	.	.	H	α-helix	trans	-65	-39.9	173.7	-70.1	-176.9	0	0	0	110.5	I35 D36 F41 L42 R43 F133 L182 I186	I35-L39 HydrophobicContact CG2-CD1 3.6Å; I35-L39 HydrophobicContact CG2-CG 3.88Å; I35-L39 WeakPolarHBondContact O-CB 3.18Å; I35-L39 WeakPolarHBondContact O-CG 3.13Å; I35-L39 PolarHBondContact O-N 3.36Å; D36-L39 PolarHBondContact O-N 3.37Å; L39-F41 VanDerWaalsContact C-N 3.33Å; L39-F41 PolarHBondContact O-N 3.08Å; L39-L42 HydrophobicContact CD2-CD1 4.38Å; L39-L42 PolarHBondContact O-N 3.32Å; L39-R43 WeakPolarHBondContact O-CG 3.48Å; L39-R43 PolarHBondContact O-N 2.82Å; L39-F133 HydrophobicContact CD2-CE2 4.43Å; L39-F133 HydrophobicContact CD2-CZ 3.98Å; L39-L182 HydrophobicContact CD2-CD2 3.68Å; L39-I186 HydrophobicContact CD2-CD1 4.18Å
40	E	89	Confident	82.6	Confident	85 Å²	85	45.3 Å²	45.3	40%	0.397	22%	0.22	S	C	.	.	H	α-helix	trans	-62.5	-42.4	174.8	-169.4	56.2	-153	0	0	111.5	D36 Y38 L42 R43 Q44	D36-E40 VanDerWaalsContact O-CB 3.3Å; D36-E40 WeakPolarHBondContact O-CB 3.46Å; D36-E40 PolarHBondContact O-N 3.25Å; Y38-E40 VanDerWaalsContact C-N 3.32Å; E40-L42 PolarHBondContact O-N 3.27Å; E40-R43 PolarHBondContact O-N 3.05Å; E40-R43 IonicContact OE2-NH1 3.64Å; E40-R43 PolarHBondContact OE2-NH1 3.32Å; E40-Q44 WeakPolarHBondContact O-CG 3.39Å; E40-Q44 PolarHBondContact O-N 3.23Å
41	F	90.1	Very high	81.4	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-54.3	-51.8	169	163.6	-109	0	0	0	112.4	Y37 Y38 L39 R43 Q44 I45 Y66 M70 Y74 P199 L223	Y37-F41 PolarHBondContact O-N 3.27Å; Y37-F41 VanDerWaalsContact O-N 3.16Å; Y38-F41 HydrophobicContact CE1-CD1 4.43Å; Y38-F41 HydrophobicContact CE2-CD1 4.41Å; Y38-F41 WeakPolarHBondContact O-CB 3.38Å; Y38-F41 PolarHBondContact O-N 2.93Å; L39-F41 VanDerWaalsContact C-N 3.33Å; L39-F41 PolarHBondContact O-N 3.08Å; F41-R43 VanDerWaalsContact C-N 3.31Å; F41-R43 PolarHBondContact O-N 2.68Å; F41-Q44 PolarHBondContact O-N 2.84Å; F41-I45 HydrophobicContact CD1-CD1 3.6Å; F41-I45 HydrophobicContact CD2-CD1 3.64Å; F41-I45 HydrophobicContact CD2-CG1 4.18Å; F41-I45 HydrophobicContact CE1-CD1 3.28Å; F41-I45 HydrophobicContact CE2-CD1 3.33Å; F41-I45 HydrophobicContact CE2-CG1 3.89Å; F41-I45 HydrophobicContact CG-CD1 3.78Å; F41-I45 HydrophobicContact CZ-CD1 3.16Å; F41-I45 HydrophobicContact CZ-CG1 4.13Å; F41-I45 VanDerWaalsContact O-CD1 3.24Å; F41-I45 WeakPolarHBondContact O-CD1 3.29Å; F41-I45 VanDerWaalsContact O-CG1 3.26Å; F41-I45 WeakPolarHBondContact O-CG1 3.28Å; F41-I45 PolarHBondContact O-N 3.22Å; F41-Y66 HydrophobicContact CE1-CD1 4.12Å; F41-Y66 HydrophobicContact CE1-CE1 4.19Å; F41-Y66 AromaticContact CZ-CD1 3.64Å; F41-Y66 HydrophobicContact CZ-CD1 3.64Å; F41-Y66 HydrophobicContact CZ-CE1 4.16Å; F41-Y66 HydrophobicContact CZ-CG 4.32Å; F41-M70 HydrophobicContact CE2-CG 3.96Å; F41-M70 HydrophobicContact CZ-CG 4.34Å; F41-Y74 VanDerWaalsContact CA-OH 3.25Å; F41-Y74 WeakPolarHBondContact CA-OH 3.46Å; F41-Y74 HydrophobicContact CD2-CD2 4.46Å; F41-Y74 AromaticContact CD2-CE2 3.61Å; F41-Y74 HydrophobicContact CD2-CE2 3.61Å; F41-Y74 AromaticContact CD2-CZ 3.84Å; F41-Y74 HydrophobicContact CE2-CE2 4.21Å; F41-P199 HydrophobicContact CE1-CG 3.57Å; F41-P199 HydrophobicContact CZ-CG 3.53Å; F41-L223 HydrophobicContact CD1-CD1 3.86Å; F41-L223 HydrophobicContact CD2-CD1 3.62Å; F41-L223 HydrophobicContact CE1-CD1 3.74Å; F41-L223 HydrophobicContact CE2-CD1 3.5Å; F41-L223 VanDerWaalsContact CE2-CD1 3.5Å; F41-L223 HydrophobicContact CG-CD1 3.79Å; F41-L223 HydrophobicContact CZ-CD1 3.53Å
42	L	89.4	Confident	79.6	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-61.2	-37.2	178	-69.2	179.6	0	0	0	112.8	Y38 L39 E40 I45 S46 Y66 F133 I186	Y38-L42 HydrophobicContact CD1-CD1 3.89Å; Y38-L42 HydrophobicContact CD1-CG 3.98Å; Y38-L42 HydrophobicContact CE1-CD1 3.91Å; Y38-L42 HydrophobicContact CE1-CD2 4.12Å; Y38-L42 HydrophobicContact CE1-CG 3.96Å; Y38-L42 WeakPolarHBondContact O-CG 3.47Å; Y38-L42 PolarHBondContact O-N 2.98Å; L39-L42 HydrophobicContact CD2-CD1 4.38Å; L39-L42 PolarHBondContact O-N 3.32Å; E40-L42 PolarHBondContact O-N 3.27Å; L42-I45 HydrophobicContact CD2-CD1 4.06Å; L42-I45 PolarHBondContact O-N 3.3Å; L42-S46 VanDerWaalsContact O-CB 3.3Å; L42-S46 WeakPolarHBondContact O-CB 3.48Å; L42-S46 PolarHBondContact O-N 2.55Å; L42-S46 PolarHBondContact O-OG 3.02Å; L42-Y66 HydrophobicContact CD2-CE1 4.42Å; L42-F133 HydrophobicContact CD1-CD1 4.11Å; L42-F133 HydrophobicContact CD1-CE1 3.56Å; L42-F133 HydrophobicContact CD1-CZ 3.94Å; L42-I186 HydrophobicContact CB-CD1 4.26Å; L42-I186 HydrophobicContact CB-CG1 4.42Å; L42-I186 HydrophobicContact CB-CG2 4.24Å; L42-I186 HydrophobicContact CD1-CG2 4.03Å
43	R	87.8	Confident	77.8	Confident	101 Å²	101	45.2 Å²	45.2	38%	0.381	25%	0.245	S	C	.	.	H	α-helix	trans	-62.7	-45.6	175.6	-74.2	178.5	-172.4	143.1	1.8	111.5	L39 E40 F41 I45 S46 S47 D183 I186	L39-R43 WeakPolarHBondContact O-CG 3.48Å; L39-R43 PolarHBondContact O-N 2.82Å; E40-R43 PolarHBondContact O-N 3.05Å; E40-R43 IonicContact OE2-NH1 3.64Å; E40-R43 PolarHBondContact OE2-NH1 3.32Å; F41-R43 VanDerWaalsContact C-N 3.31Å; F41-R43 PolarHBondContact O-N 2.68Å; R43-I45 PolarHBondContact O-N 3.41Å; R43-S46 PolarHBondContact O-N 3.32Å; R43-S46 PolarHBondContact O-OG 3.01Å; R43-S47 WeakPolarHBondContact O-CB 3.33Å; R43-S47 PolarHBondContact O-N 2.98Å; R43-S47 PolarHBondContact O-OG 3.06Å; R43-D183 IonicContact NE-OD2 3.71Å; R43-I186 HydrophobicContact CG-CD1 3.8Å; R43-I186 HydrophobicContact CG-CG1 4.17Å
44	Q	83.8	Confident	75.8	Confident	35 Å²	35	45.7 Å²	45.7	16%	0.164	25%	0.252	C	S	.	.	H	α-helix	trans	-62.2	-43.2	177.3	-69.9	178.8	7.2	0	0	112	E40 F41 S47 S48 Y74	E40-Q44 WeakPolarHBondContact O-CG 3.39Å; E40-Q44 PolarHBondContact O-N 3.23Å; F41-Q44 PolarHBondContact O-N 2.84Å; Q44-S47 PolarHBondContact O-N 3.07Å; Q44-S48 WeakPolarHBondContact O-CB 3.07Å; Q44-S48 PolarHBondContact O-N 2.94Å; Q44-Y74 VanDerWaalsContact CD-OH 3.26Å; Q44-Y74 PolarHBondContact OE1-OH 2.92Å
45	I	82.7	Confident	73.5	Confident	5 Å²	5	51.3 Å²	51.3	3%	0.026	29%	0.286	C	S	.	.	H	α-helix	trans	-61.6	-47	175.1	-63.7	151.3	0	0	0	111	F41 L42 R43 S47 S48 Y66 V69 W189	F41-I45 HydrophobicContact CD1-CD1 3.6Å; F41-I45 HydrophobicContact CD2-CD1 3.64Å; F41-I45 HydrophobicContact CD2-CG1 4.18Å; F41-I45 HydrophobicContact CE1-CD1 3.28Å; F41-I45 HydrophobicContact CE2-CD1 3.33Å; F41-I45 HydrophobicContact CE2-CG1 3.89Å; F41-I45 HydrophobicContact CG-CD1 3.78Å; F41-I45 HydrophobicContact CZ-CD1 3.16Å; F41-I45 HydrophobicContact CZ-CG1 4.13Å; F41-I45 VanDerWaalsContact O-CD1 3.24Å; F41-I45 WeakPolarHBondContact O-CD1 3.29Å; F41-I45 VanDerWaalsContact O-CG1 3.26Å; F41-I45 WeakPolarHBondContact O-CG1 3.28Å; F41-I45 PolarHBondContact O-N 3.22Å; L42-I45 HydrophobicContact CD2-CD1 4.06Å; L42-I45 PolarHBondContact O-N 3.3Å; R43-I45 PolarHBondContact O-N 3.41Å; I45-S47 PolarHBondContact O-N 3.17Å; I45-S48 PolarHBondContact O-N 3.16Å; I45-Y66 HydrophobicContact CD1-CD1 3.56Å; I45-Y66 HydrophobicContact CD1-CE1 3.43Å; I45-Y66 VanDerWaalsContact CD1-CE1 3.43Å; I45-Y66 HydrophobicContact CG1-CD1 4.24Å; I45-Y66 HydrophobicContact CG1-CE1 4.34Å; I45-Y66 HydrophobicContact CG2-CD1 4.44Å; I45-Y66 HydrophobicContact CG2-CE1 4.17Å; I45-V69 HydrophobicContact CB-CG1 4.35Å; I45-V69 HydrophobicContact CG1-CB 4.1Å; I45-V69 HydrophobicContact CG1-CG1 3.56Å; I45-V69 HydrophobicContact CG1-CG2 4.24Å; I45-V69 HydrophobicContact CG2-CG2 4.27Å; I45-W189 HydrophobicContact CG2-CH2 3.77Å; I45-W189 HydrophobicContact CG2-CZ2 3.27Å
46	S	82.1	Confident	71.1	Confident	14 Å²	14	55 Å²	55	10%	0.098	31%	0.312	C	S	.	.	H	α-helix	trans	-65.2	-26.1	-178.2	76.1	0	0	0	0	112.7	L42 R43 Q185	L42-S46 VanDerWaalsContact O-CB 3.3Å; L42-S46 WeakPolarHBondContact O-CB 3.48Å; L42-S46 PolarHBondContact O-N 2.55Å; L42-S46 PolarHBondContact O-OG 3.02Å; R43-S46 PolarHBondContact O-N 3.32Å; R43-S46 PolarHBondContact O-OG 3.01Å; S46-Q185 PolarHBondContact OG-NE2 3.1Å
47	S	78.9	Confident	69.1	Low	79 Å²	79	55.6 Å²	55.6	55%	0.552	33%	0.325	S	S	*	.	H	α-helix	trans	-91.8	-17.5	178.2	-52.8	0	0	0	0	113	R43 Q44 I45 Q185	R43-S47 WeakPolarHBondContact O-CB 3.33Å; R43-S47 PolarHBondContact O-N 2.98Å; R43-S47 PolarHBondContact O-OG 3.06Å; Q44-S47 PolarHBondContact O-N 3.07Å; I45-S47 PolarHBondContact O-N 3.17Å; S47-Q185 PolarHBondContact OG-NE2 3Å
48	S	71.7	Confident	66.7	Low	19 Å²	19	59.4 Å²	59.4	13%	0.133	35%	0.348	C	S	.	.	S	Bend	trans	-67.4	136.1	-178.2	177	0	0	0	0	111.6	Q44 I45 L50 T51	Q44-S48 WeakPolarHBondContact O-CB 3.07Å; Q44-S48 PolarHBondContact O-N 2.94Å; I45-S48 PolarHBondContact O-N 3.16Å; S48-L50 PolarHBondContact O-N 2.89Å; S48-L50 PolarHBondContact OG-N 2.78Å; S48-T51 PolarHBondContact O-N 3.49Å; S48-T51 VanDerWaalsContact O-N 3.16Å; S48-T51 PolarHBondContact O-OG1 3.23Å
49	K	57	Low	63.9	Low	167 Å²	167	66.8 Å²	66.8	73%	0.726	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-59.3	-12.9	177.2	-69.7	-176.9	179.8	177.9	0	113.6	T51 A52 S53	K49-T51 PolarHBondContact O-N 3.44Å; K49-A52 PolarHBondContact O-N 2.86Å; K49-S53 PolarHBondContact O-N 2.95Å; K49-S53 PolarHBondContact O-OG 2.91Å; K49-S53 VanDerWaalsContact O-OG 3.05Å
50	L	55	Low	61.5	Low	46 Å²	46	74.4 Å²	74.4	24%	0.241	42%	0.422	C	S	.	.	G	3₁₀ helix	trans	-51.7	-27.8	170.5	-82.6	158.6	0	0	0	112.5	S48 S54 L64 V69 E72	S48-L50 PolarHBondContact O-N 2.89Å; S48-L50 PolarHBondContact OG-N 2.78Å; L50-S54 PolarHBondContact O-OG 2.67Å; L50-L64 HydrophobicContact CB-CD2 4.47Å; L50-V69 HydrophobicContact CD1-CB 4.46Å; L50-V69 HydrophobicContact CD1-CG2 3.56Å; L50-E72 WeakPolarHBondContact CD1-OE2 3.47Å
51	T	49.8	Very low	59.3	Low	28 Å²	28	80.4 Å²	80.4	17%	0.172	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-77.1	-21.5	175.7	57.6	0	0	0	0	114.7	S48 K49 Y193	S48-T51 PolarHBondContact O-N 3.49Å; S48-T51 VanDerWaalsContact O-N 3.16Å; S48-T51 PolarHBondContact O-OG1 3.23Å; K49-T51 PolarHBondContact O-N 3.44Å; T51-Y193 HydrophobicContact CG2-CE2 4.05Å
52	A	45.1	Very low	57.3	Low	73 Å²	73	85.1 Å²	85.1	60%	0.603	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-29.5	-173.7	0	0	0	0	0	113.4	K49	K49-A52 PolarHBondContact O-N 2.86Å
53	S	43.5	Very low	55.6	Low	87 Å²	87	92.3 Å²	92.3	61%	0.608	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-9.6	-169.9	-42.9	0	0	0	0	115.4	K49	K49-S53 PolarHBondContact O-N 2.95Å; K49-S53 PolarHBondContact O-OG 2.91Å; K49-S53 VanDerWaalsContact O-OG 3.05Å
54	S	43.2	Very low	54.3	Low	46 Å²	46	89.5 Å²	89.5	32%	0.322	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	3	-177.2	53	0	0	0	0	114.4	L50 S56	L50-S54 PolarHBondContact O-OG 2.67Å; S54-S56 PolarHBondContact O-N 3.15Å
55	V	43	Very low	53.6	Low	119 Å²	119	90.5 Å²	90.5	72%	0.721	52%	0.516	S	S	*	.			trans	-91.5	51.2	167.9	-162.7	0	0	0	0	109.4
56	S	38.6	Very low	53.3	Low	87 Å²	87	90.6 Å²	90.6	61%	0.608	52%	0.516	S	S	*	.			trans	-81	128.2	161.4	168	0	0	0	0	107.4	S54 N58	S54-S56 PolarHBondContact O-N 3.15Å; S56-N58 PolarHBondContact O-N 2.96Å
57	S	46.6	Very low	53	Low	114 Å²	114	94.5 Å²	94.5	80%	0.797	53%	0.531	S	S	*	.	S	Bend	trans	-67.2	6.8	-169.3	54.6	0	0	0	0	115.7
58	N	40.3	Very low	52.6	Low	124 Å²	124	93.1 Å²	93.1	66%	0.663	52%	0.522	S	S	*	.	S	Bend	trans	-125.5	107.7	-176.1	-72.9	-16	0	0	0	111.3	S56	S56-N58 PolarHBondContact O-N 2.96Å
59	N	33.2	Very low	52.5	Low	154 Å²	154	92.6 Å²	92.6	82%	0.824	52%	0.518	S	S	*	.	S	Bend	trans	41.9	79.2	148.8	-65.6	-17.7	0	0	0	117.5
60	H	41.3	Very low	53.5	Low	179 Å²	179	84.9 Å²	84.9	83%	0.829	48%	0.484	S	S	*	.				172.5	116.6	126.9	-96.8	-74.4	0	0	0	106.5	T62	H60-T62 PolarHBondContact O-N 3.35Å; H60-T62 PolarHBondContact O-OG1 2.94Å
61	K	42.3	Very low	54.4	Low	210 Å²	210	86.8 Å²	86.8	91%	0.913	50%	0.498	S	S	*	.			trans	-59.7	87.4	176.6	-155.5	-178.9	-167.6	-179.8	0	108	I63	K61-I63 PolarHBondContact O-N 2.86Å
62	T	48.7	Very low	55.5	Low	99 Å²	99	90.9 Å²	90.9	61%	0.607	52%	0.515	S	S	*	.			trans	-68.9	107.4	-177.6	-3.1	0	0	0	0	105.8	H60 L64	H60-T62 PolarHBondContact O-N 3.35Å; H60-T62 PolarHBondContact O-OG1 2.94Å; T62-L64 PolarHBondContact O-N 3.12Å
63	I	53	Low	56.9	Low	152 Å²	152	90.8 Å²	90.8	78%	0.779	51%	0.505	S	S	*	.			trans	-61.2	109.3	178.2	-62.9	170.3	0	0	0	105.7	K61 S65	K61-I63 PolarHBondContact O-N 2.86Å; I63-S65 PolarHBondContact O-N 3.4Å
64	L	60.9	Low	58.7	Low	42 Å²	42	87.4 Å²	87.4	22%	0.22	48%	0.478	C	S	.	.			trans	-58	113	169.7	-81.6	158.5	0	0	0	107.1	L50 T62 Y193 V196	L50-L64 HydrophobicContact CB-CD2 4.47Å; T62-L64 PolarHBondContact O-N 3.12Å; L64-Y193 HydrophobicContact CD1-CD1 3.54Å; L64-Y193 HydrophobicContact CD1-CE1 3Å; L64-Y193 HydrophobicContact CD1-CE2 4.47Å; L64-Y193 HydrophobicContact CD1-CG 4.46Å; L64-Y193 HydrophobicContact CG-CE1 4.46Å; L64-V196 HydrophobicContact CB-CG2 4.45Å; L64-V196 WeakPolarHBondContact O-CG1 3.48Å
65	S	68.6	Low	60.5	Low	56 Å²	56	88.1 Å²	88.1	39%	0.392	48%	0.479	S	S	.	.			trans	-118.3	136.9	176.8	176.3	0	0	0	0	107.7	I63 K67 S68	I63-S65 PolarHBondContact O-N 3.4Å; S65-K67 PolarHBondContact O-N 3.06Å; S65-K67 VanDerWaalsContact OG-CB 3.31Å; S65-K67 WeakPolarHBondContact OG-CB 3.17Å; S65-K67 PolarHBondContact OG-N 2.96Å; S65-S68 PolarHBondContact O-N 2.93Å
66	Y	75.8	Confident	62.5	Low	8 Å²	8	84.1 Å²	84.1	3%	0.031	46%	0.456	C	S	.	.	H	α-helix	trans	-55.1	-23.5	171	-71.2	-73.6	0	0	0	112.3	F41 L42 I45 S68 V69 M70 W189 V196 L197 R198 P199	F41-Y66 HydrophobicContact CE1-CD1 4.12Å; F41-Y66 HydrophobicContact CE1-CE1 4.19Å; F41-Y66 AromaticContact CZ-CD1 3.64Å; F41-Y66 HydrophobicContact CZ-CD1 3.64Å; F41-Y66 HydrophobicContact CZ-CE1 4.16Å; F41-Y66 HydrophobicContact CZ-CG 4.32Å; L42-Y66 HydrophobicContact CD2-CE1 4.42Å; I45-Y66 HydrophobicContact CD1-CD1 3.56Å; I45-Y66 HydrophobicContact CD1-CE1 3.43Å; I45-Y66 VanDerWaalsContact CD1-CE1 3.43Å; I45-Y66 HydrophobicContact CG1-CD1 4.24Å; I45-Y66 HydrophobicContact CG1-CE1 4.34Å; I45-Y66 HydrophobicContact CG2-CD1 4.44Å; I45-Y66 HydrophobicContact CG2-CE1 4.17Å; Y66-S68 VanDerWaalsContact C-N 3.32Å; Y66-S68 PolarHBondContact O-N 3Å; Y66-V69 PolarHBondContact O-N 3.45Å; Y66-V69 VanDerWaalsContact O-N 3.14Å; Y66-M70 WeakPolarHBondContact O-CB 3.38Å; Y66-M70 VanDerWaalsContact O-CG 3.32Å; Y66-M70 WeakPolarHBondContact O-CG 2.91Å; Y66-M70 PolarHBondContact O-N 3.34Å; Y66-W189 AromaticContact CE1-CH2 3.67Å; Y66-W189 HydrophobicContact CE1-CH2 3.67Å; Y66-W189 HydrophobicContact CE1-CZ3 4.22Å; Y66-W189 AromaticContact CZ-CH2 3.65Å; Y66-W189 WeakPolarHBondContact OH-CH2 3.28Å; Y66-W189 WeakPolarHBondContact OH-CZ3 3.36Å; Y66-V196 HydrophobicContact CD2-CG1 3.48Å; Y66-V196 VanDerWaalsContact CD2-CG1 3.48Å; Y66-V196 HydrophobicContact CE2-CB 4.06Å; Y66-V196 HydrophobicContact CE2-CG1 3.31Å; Y66-V196 HydrophobicContact CG-CG1 4.44Å; Y66-L197 WeakPolarHBondContact CD2-O 3.36Å; Y66-L197 WeakPolarHBondContact CE2-O 3.46Å; Y66-R198 HydrophobicContact CE2-CB 4.42Å; Y66-R198 HydrophobicContact CE2-CG 4.03Å; Y66-R198 WeakPolarHBondContact OH-CG 3.36Å; Y66-P199 HydrophobicContact CG-CG 4.23Å
67	K	75.6	Confident	65	Low	95 Å²	95	80 Å²	80	41%	0.413	43%	0.427	S	S	.	.	H	α-helix	trans	-52	-46.5	178.9	-169.9	166.6	-175.5	135	0	112.7	S65 V69 M70 T71 E225	S65-K67 PolarHBondContact O-N 3.06Å; S65-K67 VanDerWaalsContact OG-CB 3.31Å; S65-K67 WeakPolarHBondContact OG-CB 3.17Å; S65-K67 PolarHBondContact OG-N 2.96Å; K67-V69 PolarHBondContact O-N 3.13Å; K67-M70 PolarHBondContact O-N 3.19Å; K67-T71 WeakPolarHBondContact O-CG2 3.25Å; K67-T71 PolarHBondContact O-N 2.91Å; K67-T71 PolarHBondContact O-OG1 2.79Å; K67-E225 WeakPolarHBondContact CE-OE1 3.32Å; K67-E225 VanDerWaalsContact NZ-CD 3.26Å; K67-E225 IonicContact NZ-OE1 3.35Å; K67-E225 PolarHBondContact NZ-OE1 3.4Å; K67-E225 IonicContact NZ-OE2 3.96Å; K67-E225 PolarHBondContact NZ-OE2 2.96Å
68	S	70.4	Confident	67.1	Low	51 Å²	51	77.1 Å²	77.1	36%	0.357	40%	0.402	S	S	.	.	H	α-helix	trans	-63.3	-44.4	179.8	-59.9	0	0	0	0	112	S65 Y66 T71 E72	S65-S68 PolarHBondContact O-N 2.93Å; Y66-S68 VanDerWaalsContact C-N 3.32Å; Y66-S68 PolarHBondContact O-N 3Å; S68-T71 WeakPolarHBondContact CA-OG1 3.45Å; S68-T71 PolarHBondContact O-N 3.48Å; S68-T71 PolarHBondContact O-OG1 2.92Å; S68-E72 WeakPolarHBondContact O-CB 3.36Å; S68-E72 VanDerWaalsContact O-CG 3.29Å; S68-E72 WeakPolarHBondContact O-CG 3.14Å; S68-E72 PolarHBondContact O-N 3.28Å
69	V	70.7	Confident	69.6	Low	7 Å²	7	71.2 Å²	71.2	4%	0.042	37%	0.371	C	S	.	.	H	α-helix	trans	-66.6	-41.8	178.5	-173.1	0	0	0	0	111.1	I45 L50 Y66 K67 E72 N73	I45-V69 HydrophobicContact CB-CG1 4.35Å; I45-V69 HydrophobicContact CG1-CB 4.1Å; I45-V69 HydrophobicContact CG1-CG1 3.56Å; I45-V69 HydrophobicContact CG1-CG2 4.24Å; I45-V69 HydrophobicContact CG2-CG2 4.27Å; L50-V69 HydrophobicContact CD1-CB 4.46Å; L50-V69 HydrophobicContact CD1-CG2 3.56Å; Y66-V69 PolarHBondContact O-N 3.45Å; Y66-V69 VanDerWaalsContact O-N 3.14Å; K67-V69 PolarHBondContact O-N 3.13Å; V69-E72 PolarHBondContact O-N 3.01Å; V69-N73 VanDerWaalsContact CG1-ND2 3.32Å; V69-N73 WeakPolarHBondContact CG1-ND2 3.32Å; V69-N73 WeakPolarHBondContact O-CB 3.28Å; V69-N73 PolarHBondContact O-N 3.08Å
70	M	76.9	Confident	72.5	Confident	5 Å²	5	64.1 Å²	64.1	3%	0.025	33%	0.333	C	S	.	.	H	α-helix	trans	-60	-45.8	176.7	-74.6	-171.5	-57.3	0	0	111.2	F41 Y66 K67 E72 Y74 P199 L223 E225	F41-M70 HydrophobicContact CE2-CG 3.96Å; F41-M70 HydrophobicContact CZ-CG 4.34Å; Y66-M70 WeakPolarHBondContact O-CB 3.38Å; Y66-M70 VanDerWaalsContact O-CG 3.32Å; Y66-M70 WeakPolarHBondContact O-CG 2.91Å; Y66-M70 PolarHBondContact O-N 3.34Å; K67-M70 PolarHBondContact O-N 3.19Å; M70-E72 VanDerWaalsContact C-N 3.35Å; M70-E72 PolarHBondContact O-N 3.37Å; M70-Y74 WeakPolarHBondContact O-CB 3.28Å; M70-Y74 PolarHBondContact O-N 3.39Å; M70-Y74 VanDerWaalsContact O-O 3.07Å; M70-P199 HydrophobicContact SD-CB 4.12Å; M70-P199 HydrophobicContact SD-CG 4.26Å; M70-L223 HydrophobicContact SD-CB 4.02Å; M70-L223 HydrophobicContact SD-CD1 4.17Å; M70-E225 HydrophobicContact CE-CG 4.5Å
71	T	75.6	Confident	74.9	Confident	86 Å²	86	55.8 Å²	55.8	53%	0.528	30%	0.295	S	S	.	.	H	α-helix	trans	-69.4	-28.3	178.6	51	0	0	0	0	114.3	K67 S68	K67-T71 WeakPolarHBondContact O-CG2 3.25Å; K67-T71 PolarHBondContact O-N 2.91Å; K67-T71 PolarHBondContact O-OG1 2.79Å; S68-T71 WeakPolarHBondContact CA-OG1 3.45Å; S68-T71 PolarHBondContact O-N 3.48Å; S68-T71 PolarHBondContact O-OG1 2.92Å
72	E	72.7	Confident	77	Confident	115 Å²	115	46.4 Å²	46.4	54%	0.537	26%	0.258	S	S	.	.	H	α-helix	trans	-84	-36.9	-178.4	-75.7	175.3	-171.6	0	0	112.7	L50 S68 V69 M70	L50-E72 WeakPolarHBondContact CD1-OE2 3.47Å; S68-E72 WeakPolarHBondContact O-CB 3.36Å; S68-E72 VanDerWaalsContact O-CG 3.29Å; S68-E72 WeakPolarHBondContact O-CG 3.14Å; S68-E72 PolarHBondContact O-N 3.28Å; V69-E72 PolarHBondContact O-N 3.01Å; M70-E72 VanDerWaalsContact C-N 3.35Å; M70-E72 PolarHBondContact O-N 3.37Å
73	N	74.4	Confident	78.6	Confident	71 Å²	71	45.6 Å²	45.6	38%	0.38	25%	0.25	S	C	.	.	H	α-helix	trans	-108.7	-20.2	-168.7	-66.5	-23.1	0	0	0	114.5	V69	V69-N73 VanDerWaalsContact CG1-ND2 3.32Å; V69-N73 WeakPolarHBondContact CG1-ND2 3.32Å; V69-N73 WeakPolarHBondContact O-CB 3.28Å; V69-N73 PolarHBondContact O-N 3.08Å
74	Y	81	Confident	80.1	Confident	15 Å²	15	39.6 Å²	39.6	6%	0.059	23%	0.226	C	C	.	.	S	Bend	trans	-123	144.2	-175.3	-63.2	-90.2	0	0	0	111.2	Y13 L14 F41 Q44 M70 S76	Y13-Y74 WeakPolarHBondContact O-CD1 3Å; L14-Y74 HydrophobicContact CD1-CD1 3.84Å; L14-Y74 HydrophobicContact CD1-CE1 3.97Å; L14-Y74 HydrophobicContact CD1-CG 4.46Å; L14-Y74 HydrophobicContact CG-CD1 4.19Å; L14-Y74 HydrophobicContact CG-CE1 3.88Å; F41-Y74 VanDerWaalsContact CA-OH 3.25Å; F41-Y74 WeakPolarHBondContact CA-OH 3.46Å; F41-Y74 HydrophobicContact CD2-CD2 4.46Å; F41-Y74 AromaticContact CD2-CE2 3.61Å; F41-Y74 HydrophobicContact CD2-CE2 3.61Å; F41-Y74 AromaticContact CD2-CZ 3.84Å; F41-Y74 HydrophobicContact CE2-CE2 4.21Å; Q44-Y74 VanDerWaalsContact CD-OH 3.26Å; Q44-Y74 PolarHBondContact OE1-OH 2.92Å; M70-Y74 WeakPolarHBondContact O-CB 3.28Å; M70-Y74 PolarHBondContact O-N 3.39Å; M70-Y74 VanDerWaalsContact O-O 3.07Å; Y74-S76 PolarHBondContact O-N 3.45Å
75	D	81.6	Confident	81.4	Confident	62 Å²	62	40.8 Å²	40.8	33%	0.332	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	132.7	174.3	-69.1	-31.4	0	0	0	109.5	Y13	Y13-D75 PolarHBondContact N-O 3.34Å
76	S	85.4	Confident	82.5	Confident	34 Å²	34	38.1 Å²	38.1	24%	0.238	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	134.5	172.6	-63.1	0	0	0	0	109	L11 Y74 L91	L11-S76 WeakPolarHBondContact O-CA 3.37Å; Y74-S76 PolarHBondContact O-N 3.45Å; S76-L91 WeakPolarHBondContact O-CB 3.27Å; S76-L91 PolarHBondContact O-N 3.08Å
77	V	90.3	Very high	83.2	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	150.1	178.8	-60.7	0	0	0	0	110.1	T10 L11 Y13 I88 K89 F222	T10-V77 WeakPolarHBondContact CA-O 3.33Å; L11-V77 HydrophobicContact CB-CG2 4.15Å; L11-V77 PolarHBondContact N-O 2.84Å; L11-V77 WeakPolarHBondContact O-CG2 3.09Å; L11-V77 PolarHBondContact O-N 2.86Å; Y13-V77 HydrophobicContact CG-CG1 4.31Å; V77-I88 HydrophobicContact CB-CG2 4.1Å; V77-I88 HydrophobicContact CG1-CG2 4.25Å; V77-I88 HydrophobicContact CG2-CG2 4.39Å; V77-K89 CarbonylContact C-O 3.6Å; V77-K89 VanDerWaalsContact CA-O 3.25Å; V77-K89 WeakPolarHBondContact CA-O 3.08Å; V77-K89 WeakPolarHBondContact CB-O 2.92Å; V77-F222 HydrophobicContact CG2-CD1 3.75Å; V77-F222 HydrophobicContact CG2-CE1 3.8Å
78	I	91.1	Very high	84.1	Confident	54 Å²	54	35.5 Å²	35.5	28%	0.277	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	119.2	163.9	-64.6	176	0	0	0	107.6	L8 F9 I88 K89 L91	L8-I78 HydrophobicContact CD2-CG2 3.79Å; F9-I78 CarbonylContact O-C 3.58Å; F9-I78 WeakPolarHBondContact O-CA 3.43Å; I78-I88 WeakPolarHBondContact O-CA 3.23Å; I78-K89 PolarHBondContact N-O 2.79Å; I78-K89 PolarHBondContact O-N 2.98Å; I78-L91 HydrophobicContact CD1-CD1 4.3Å; I78-L91 HydrophobicContact CD1-CD2 3.53Å; I78-L91 HydrophobicContact CD1-CG 4.04Å; I78-L91 HydrophobicContact CG1-CD1 3.74Å; I78-L91 HydrophobicContact CG1-CD2 3.88Å; I78-L91 HydrophobicContact CG1-CG 3.78Å
79	L	93.1	Very high	85	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	111.3	166.3	-176.8	69.3	0	0	0	108.5	F9 L11 I81 I86 L87 I88 F204 V233 F237	F9-L79 HydrophobicContact CB-CB 4.44Å; F9-L79 PolarHBondContact N-O 3.12Å; F9-L79 PolarHBondContact O-N 3.33Å; L11-L79 HydrophobicContact CD1-CB 3.88Å; L11-L79 HydrophobicContact CD1-CD2 3.61Å; L11-L79 HydrophobicContact CD1-CG 4.4Å; L79-I81 HydrophobicContact CD2-CD1 3.89Å; L79-I81 HydrophobicContact CD2-CG1 4.32Å; L79-I81 HydrophobicContact CG-CD1 4.17Å; L79-I81 HydrophobicContact CG-CG1 4.03Å; L79-I86 HydrophobicContact CD1-CG2 3.74Å; L79-L87 CarbonylContact C-O 3.53Å; L79-L87 WeakPolarHBondContact CA-O 3.29Å; L79-I88 HydrophobicContact CD1-CG1 3.91Å; L79-F204 HydrophobicContact CD1-CE1 4.19Å; L79-V233 HydrophobicContact CD2-CG1 3.97Å; L79-F237 HydrophobicContact CD2-CZ 3.94Å
80	A	92.4	Very high	85.7	Confident	5 Å²	5	39.1 Å²	39.1	4%	0.041	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	128.4	172.9	0	0	0	0	0	110.4	M6 S7 L8 I86 L87	M6-A80 HydrophobicContact SD-CB 4.22Å; S7-A80 CarbonylContact O-C 3.6Å; S7-A80 VanDerWaalsContact O-CA 3.29Å; S7-A80 WeakPolarHBondContact O-CA 3.47Å; L8-A80 HydrophobicContact CD2-CB 3.38Å; A80-I86 CarbonylContact O-C 3.59Å; A80-I86 WeakPolarHBondContact O-CA 3.39Å; A80-L87 HydrophobicContact CB-CB 4.12Å; A80-L87 HydrophobicContact CB-CD2 4.38Å; A80-L87 PolarHBondContact N-O 3.05Å; A80-L87 PolarHBondContact O-N 3.45Å
81	I	91.9	Very high	85.8	Confident	4 Å²	4	42 Å²	42	2%	0.021	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	123.9	179.9	-51.9	171.1	0	0	0	109	S7 F9 L79 V233 C236 F237 L240	S7-I81 PolarHBondContact N-O 2.72Å; S7-I81 PolarHBondContact O-N 2.97Å; F9-I81 HydrophobicContact CD2-CD1 4.21Å; F9-I81 HydrophobicContact CE2-CD1 4Å; F9-I81 HydrophobicContact CE2-CG1 4.46Å; L79-I81 HydrophobicContact CD2-CD1 3.89Å; L79-I81 HydrophobicContact CD2-CG1 4.32Å; L79-I81 HydrophobicContact CG-CD1 4.17Å; L79-I81 HydrophobicContact CG-CG1 4.03Å; I81-V233 HydrophobicContact CD1-CG1 3.99Å; I81-C236 HydrophobicContact CB-CB 3.93Å; I81-C236 HydrophobicContact CD1-CB 3.95Å; I81-C236 HydrophobicContact CG2-CB 3.71Å; I81-F237 HydrophobicContact CD1-CD1 3.74Å; I81-F237 HydrophobicContact CD1-CD2 4.48Å; I81-F237 HydrophobicContact CD1-CE1 3.49Å; I81-F237 VanDerWaalsContact CD1-CE1 3.49Å; I81-F237 HydrophobicContact CD1-CE2 4.3Å; I81-F237 HydrophobicContact CD1-CG 4.23Å; I81-F237 HydrophobicContact CD1-CZ 3.81Å; I81-F237 HydrophobicContact CG1-CD1 4.4Å; I81-F237 HydrophobicContact CG1-CE1 4.01Å; I81-F237 HydrophobicContact CG2-CD1 4.31Å; I81-L240 HydrophobicContact CG2-CB 4.47Å; I81-L240 HydrophobicContact CG2-CD2 4.21Å
82	G	86.9	Confident	85.1	Confident	13 Å²	13	44.1 Å²	44.1	13%	0.134	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	156.8	173.3	179.9	0	0	0	0	0	112.3	M6 G84 H85	M6-G82 WeakPolarHBondContact CE-O 3.26Å; M6-G82 WeakPolarHBondContact SD-CA 3Å; M6-G82 PolarHBondContact SD-N 2.92Å; G82-G84 PolarHBondContact O-N 2.97Å; G82-H85 PolarHBondContact N-O 3.41Å; G82-H85 VanDerWaalsContact N-O 3.11Å; G82-H85 PolarHBondContact O-N 3.27Å; G82-H85 VanDerWaalsContact O-O 3.09Å
83	N	83.2	Confident	84.1	Confident	82 Å²	82	48.9 Å²	48.9	44%	0.439	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	21.1	176.6	-52.6	-10.3	0	0	0	115.5	S4 M6 H85	S4-N83 WeakPolarHBondContact CB-OD1 3.24Å; S4-N83 PolarHBondContact O-OD1 3.26Å; S4-N83 PolarHBondContact OG-OD1 2.9Å; M6-N83 HydrophobicContact CE-CB 4.12Å; N83-H85 PolarHBondContact O-CD2 3.47Å
84	G	83.3	Confident	82.7	Confident	27 Å²	27	52.2 Å²	52.2	28%	0.278	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	7.9	-174.8	0	0	0	0	0	114.8	G82 A122	G82-G84 PolarHBondContact O-N 2.97Å; G84-A122 WeakPolarHBondContact O-CB 3.48Å; G84-A122 PolarHBondContact O-N 2.78Å
85	H	88.2	Confident	80.4	Confident	67 Å²	67	54.3 Å²	54.3	31%	0.31	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	157.5	-176.7	-66.2	-99.4	0	0	0	113	M6 G82 N83 D119 F120 L121	M6-H85 HydrophobicContact CE-CB 3.96Å; G82-H85 PolarHBondContact N-O 3.41Å; G82-H85 VanDerWaalsContact N-O 3.11Å; G82-H85 PolarHBondContact O-N 3.27Å; G82-H85 VanDerWaalsContact O-O 3.09Å; N83-H85 PolarHBondContact O-CD2 3.47Å; H85-D119 IonicContact ND1-OD1 3.26Å; H85-D119 PolarHBondContact ND1-OD1 3.41Å; H85-D119 IonicContact ND1-OD2 2.8Å; H85-F120 CarbonylContact C-O 3.49Å; H85-F120 VanDerWaalsContact CA-O 3.28Å; H85-F120 WeakPolarHBondContact CA-O 3.13Å; H85-L121 WeakPolarHBondContact CE1-CD2 3.24Å
86	I	91.5	Very high	78	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	118.1	169	-52.8	164.8	0	0	0	106.3	L79 A80 F120 L125 F204 F237 L240	L79-I86 HydrophobicContact CD1-CG2 3.74Å; A80-I86 CarbonylContact O-C 3.59Å; A80-I86 WeakPolarHBondContact O-CA 3.39Å; I86-F120 HydrophobicContact CB-CB 4.23Å; I86-F120 HydrophobicContact CB-CD2 4.27Å; I86-F120 HydrophobicContact CG2-CD2 4.31Å; I86-F120 PolarHBondContact N-O 3.04Å; I86-F120 PolarHBondContact O-N 2.81Å; I86-L125 HydrophobicContact CD1-CB 3.95Å; I86-L125 HydrophobicContact CD1-CD1 3.99Å; I86-L125 HydrophobicContact CD1-CD2 4Å; I86-L125 HydrophobicContact CD1-CG 4.2Å; I86-F204 HydrophobicContact CG2-CZ 4.18Å; I86-F237 HydrophobicContact CD1-CD1 4.13Å; I86-F237 HydrophobicContact CD1-CE1 3.8Å; I86-F237 HydrophobicContact CG1-CD1 4.47Å; I86-F237 HydrophobicContact CG1-CE1 4.07Å; I86-F237 HydrophobicContact CG2-CE1 3.97Å; I86-L240 HydrophobicContact CD1-CD2 3.74Å; I86-L240 HydrophobicContact CG1-CD2 3.38Å
87	L	92.1	Very high	75.7	Confident	47 Å²	47	66.4 Å²	66.4	25%	0.246	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	125.6	-179.6	174.6	77.4	0	0	0	109.1	L79 A80 K89 E118 D119	L79-L87 CarbonylContact C-O 3.53Å; L79-L87 WeakPolarHBondContact CA-O 3.29Å; A80-L87 HydrophobicContact CB-CB 4.12Å; A80-L87 HydrophobicContact CB-CD2 4.38Å; A80-L87 PolarHBondContact N-O 3.05Å; A80-L87 PolarHBondContact O-N 3.45Å; L87-K89 HydrophobicContact CD1-CG 4.22Å; L87-K89 HydrophobicContact CD2-CD 3.89Å; L87-K89 HydrophobicContact CD2-CG 4.12Å; L87-K89 HydrophobicContact CG-CD 4.34Å; L87-K89 HydrophobicContact CG-CG 4.02Å; L87-E118 CarbonylContact C-O 3.55Å; L87-E118 WeakPolarHBondContact CA-O 3.41Å; L87-D119 HydrophobicContact CD1-CB 4.11Å
88	I	92.5	Very high	73.3	Confident	0 Å²	0	76.7 Å²	76.7	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	127.8	166.6	-52.2	169.6	0	0	0	106.8	V77 I78 L79 V116 D117 E118 F120 F204 Y220 F222	V77-I88 HydrophobicContact CB-CG2 4.1Å; V77-I88 HydrophobicContact CG1-CG2 4.25Å; V77-I88 HydrophobicContact CG2-CG2 4.39Å; I78-I88 WeakPolarHBondContact O-CA 3.23Å; L79-I88 HydrophobicContact CD1-CG1 3.91Å; I88-V116 HydrophobicContact CB-CG1 4.4Å; I88-V116 HydrophobicContact CD1-CG1 4.29Å; I88-V116 HydrophobicContact CG2-CG1 3.93Å; I88-D117 WeakPolarHBondContact O-CA 2.98Å; I88-E118 HydrophobicContact CB-CB 4.32Å; I88-E118 HydrophobicContact CD1-CB 4.22Å; I88-E118 PolarHBondContact N-O 3.49Å; I88-E118 PolarHBondContact O-N 3.22Å; I88-F120 HydrophobicContact CD1-CE2 3.85Å; I88-F120 HydrophobicContact CG1-CE2 4.29Å; I88-F204 HydrophobicContact CD1-CE1 4.35Å; I88-F204 HydrophobicContact CD1-CZ 3.85Å; I88-F204 HydrophobicContact CG1-CZ 4.32Å; I88-Y220 HydrophobicContact CD1-CD1 3.69Å; I88-Y220 HydrophobicContact CD1-CE1 3.98Å; I88-Y220 HydrophobicContact CD1-CG 4.23Å; I88-F222 HydrophobicContact CD1-CE1 4.38Å; I88-F222 HydrophobicContact CD1-CZ 3.72Å; I88-F222 HydrophobicContact CG1-CZ 4.24Å; I88-F222 HydrophobicContact CG2-CE1 4.37Å
89	K	90	Very high	70.6	Confident	113 Å²	113	82.8 Å²	82.8	49%	0.491	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	132.3	169.9	-79.7	-174.8	168.5	178.9	0	111	V77 I78 L87 D117	V77-K89 CarbonylContact C-O 3.6Å; V77-K89 VanDerWaalsContact CA-O 3.25Å; V77-K89 WeakPolarHBondContact CA-O 3.08Å; V77-K89 WeakPolarHBondContact CB-O 2.92Å; I78-K89 PolarHBondContact N-O 2.79Å; I78-K89 PolarHBondContact O-N 2.98Å; L87-K89 HydrophobicContact CD1-CG 4.22Å; L87-K89 HydrophobicContact CD2-CD 3.89Å; L87-K89 HydrophobicContact CD2-CG 4.12Å; L87-K89 HydrophobicContact CG-CD 4.34Å; L87-K89 HydrophobicContact CG-CG 4.02Å; K89-D117 VanDerWaalsContact CA-OD1 3.31Å; K89-D117 WeakPolarHBondContact CA-OD1 3.28Å
90	S	86.2	Confident	67.9	Low	22 Å²	22	89.5 Å²	89.5	15%	0.154	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	137.2	174.7	-61.2	0	0	0	0	111.1	D92 V116 D117	S90-D92 PolarHBondContact O-N 2.94Å; S90-V116 PolarHBondContact N-O 3.36Å; S90-V116 PolarHBondContact OG-N 3.19Å; S90-V116 PolarHBondContact OG-O 3.18Å; S90-D117 PolarHBondContact N-OD1 3.24Å
91	L	78.8	Confident	65.4	Low	65 Å²	65	96.4 Å²	96.4	34%	0.34	48%	0.477	S	S	.	.			trans	-87.8	102.1	171.5	-75.9	160.5	0	0	0	108.3	T10 S76 I78 Y93	T10-L91 HydrophobicContact CG2-CD1 3.96Å; S76-L91 WeakPolarHBondContact O-CB 3.27Å; S76-L91 PolarHBondContact O-N 3.08Å; I78-L91 HydrophobicContact CD1-CD1 4.3Å; I78-L91 HydrophobicContact CD1-CD2 3.53Å; I78-L91 HydrophobicContact CD1-CG 4.04Å; I78-L91 HydrophobicContact CG1-CD1 3.74Å; I78-L91 HydrophobicContact CG1-CD2 3.88Å; I78-L91 HydrophobicContact CG1-CG 3.78Å; L91-Y93 VanDerWaalsContact C-N 3.27Å; L91-Y93 PolarHBondContact O-N 2.5Å
92	D	61.2	Low	62.8	Low	130 Å²	130	106 Å²	106	70%	0.695	52%	0.519	S	S	*	.			trans	-67	87.7	169.7	-89.3	-26.2	0	0	0	110.1	S90 K94	S90-D92 PolarHBondContact O-N 2.94Å; D92-K94 PolarHBondContact O-N 3.06Å
93	Y	50.5	Low	60.6	Low	216 Å²	216	114.3 Å²	114.3	85%	0.847	55%	0.552	S	S	*	*			trans	-84	8.8	172.7	-136.8	-90.3	0	0	0	112.9	L91 G95	L91-Y93 VanDerWaalsContact C-N 3.27Å; L91-Y93 PolarHBondContact O-N 2.5Å; Y93-G95 VanDerWaalsContact C-N 3.29Å; Y93-G95 PolarHBondContact O-N 3.08Å; Y93-G95 VanDerWaalsContact O-N 3.14Å
94	K	45.8	Very low	58.1	Low	140 Å²	140	119.7 Å²	119.7	61%	0.609	57%	0.571	S	S	*	*			trans	-91.6	58.2	-179.9	-74.1	-177	-176.8	156.4	0	112.8	D92	D92-K94 PolarHBondContact O-N 3.06Å
95	G	31.8	Very low	55.6	Low	60 Å²	60	126 Å²	126	62%	0.619	60%	0.598	S	S	*	*			trans	-91.7	110.6	147	0	0	0	0	0	109.1	Y93	Y93-G95 VanDerWaalsContact C-N 3.29Å; Y93-G95 PolarHBondContact O-N 3.08Å; Y93-G95 VanDerWaalsContact O-N 3.14Å
96	N	30.9	Very low	53	Low	155 Å²	155	127.7 Å²	127.7	83%	0.829	62%	0.618	S	S	*	*	S	Bend	trans	88	117.4	168	-59.9	-33	0	0	0	119.4
97	K	37	Very low	50	Low	195 Å²	195	133.2 Å²	133.2	85%	0.848	66%	0.657	S	S	*	*			trans	84.6	69.3	155.7	-54.8	176.1	-174.9	178.3	0	118.5
98	R	41.4	Very low	47.3	Very low	215 Å²	215	137.1 Å²	137.1	81%	0.811	68%	0.682	S	S	*	*			trans	-108	74.3	137.3	-73.4	-171.3	-178.8	-178	-1.2	108.3
99	K	34.4	Very low	44.8	Very low	183 Å²	183	141.5 Å²	141.5	80%	0.796	70%	0.703	S	S	*	*			trans	-71.4	127.3	157.4	-88.9	-173.9	172	-175	0	106.4
100	D	35.6	Very low	42	Very low	141 Å²	141	141.7 Å²	141.7	75%	0.754	72%	0.719	S	S	*	*			trans	36.5	100.6	146.7	-54.9	-44.7	0	0	0	116.4
101	D	41.3	Very low	39.6	Very low	149 Å²	149	145.1 Å²	145.1	80%	0.797	74%	0.743	S	S	*	*			trans	-151.3	115.9	134.6	-101.4	-27.6	0	0	0	112.1	F103	D101-F103 PolarHBondContact O-N 3.08Å
102	K	35.9	Very low	37.9	Very low	206 Å²	206	145.5 Å²	145.5	90%	0.896	75%	0.745	S	S	*	*			trans	-67.6	88.3	171.4	-71.1	169.3	175.1	171	0	109
103	F	40.4	Very low	37	Very low	188 Å²	188	143.6 Å²	143.6	83%	0.825	74%	0.742	S	S	*	*			trans	-126.1	91	157.1	-81.6	-79.2	0	0	0	110.1	D101	D101-F103 PolarHBondContact O-N 3.08Å
104	K	31.6	Very low	37.1	Very low	194 Å²	194	136.3 Å²	136.3	84%	0.843	72%	0.722	S	S	*	*			trans	-55	140.9	157.9	-78.9	175.3	169.8	179.2	0	108.8
105	N	31	Very low	38.1	Very low	159 Å²	159	135.2 Å²	135.2	85%	0.85	72%	0.72	S	S	*	*			trans	109.2	62.2	166.1	-51.7	-10.3	0	0	0	116.7
106	S	33.4	Very low	40.3	Very low	104 Å²	104	132.8 Å²	132.8	73%	0.727	69%	0.693	S	S	*	*			trans	-151.6	87.4	141.6	75.1	0	0	0	0	110.4	V108	S106-V108 PolarHBondContact O-N 3.27Å; S106-V108 VanDerWaalsContact O-N 3.08Å
107	S	28.6	Very low	42.9	Very low	116 Å²	116	129.1 Å²	129.1	81%	0.811	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	39.3	-174.7	60.4	0	0	0	0	114.2
108	V	34.8	Very low	45.5	Very low	129 Å²	129	122.1 Å²	122.1	78%	0.782	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.8	-2.9	-174.9	-171.9	0	0	0	0	114.3	S106	S106-V108 PolarHBondContact O-N 3.27Å; S106-V108 VanDerWaalsContact O-N 3.08Å
109	M	40.8	Very low	47.8	Very low	91 Å²	91	116.5 Å²	116.5	45%	0.448	63%	0.629	S	S	.	*			trans	-132.1	17.9	-178.3	-82.5	-159.2	83	0	0	116	S111 L112	M109-S111 PolarHBondContact O-N 3.37Å; M109-L112 HydrophobicContact CE-CB 4.1Å; M109-L112 HydrophobicContact CE-CD1 3.8Å; M109-L112 HydrophobicContact CE-CD2 3.74Å; M109-L112 HydrophobicContact CE-CG 4.08Å
110	S	31.7	Very low	50.5	Low	117 Å²	117	108 Å²	108	82%	0.818	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	9.1	179.6	-56.8	0	0	0	0	115.2
111	S	35	Very low	52.9	Low	94 Å²	94	104.3 Å²	104.3	66%	0.657	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.6	-1.4	-179.7	54.6	0	0	0	0	115.5	M109	M109-S111 PolarHBondContact O-N 3.37Å
112	L	42.5	Very low	54.7	Low	73 Å²	73	97.8 Å²	97.8	38%	0.382	54%	0.539	S	S	.	.	S	Bend	trans	-90.1	-5.2	-175.6	-101.7	92	0	0	0	116.1	M109 S114	M109-L112 HydrophobicContact CE-CB 4.1Å; M109-L112 HydrophobicContact CE-CD1 3.8Å; M109-L112 HydrophobicContact CE-CD2 3.74Å; M109-L112 HydrophobicContact CE-CG 4.08Å; L112-S114 PolarHBondContact O-N 2.75Å
113	S	43.1	Very low	56.8	Low	91 Å²	91	93.4 Å²	93.4	64%	0.636	52%	0.518	S	S	*	.			trans	-97.3	37.3	178.4	77.3	0	0	0	0	113.2	Q115	S113-Q115 PolarHBondContact O-N 3.49Å
114	S	53.1	Low	58.8	Low	62 Å²	62	86.7 Å²	86.7	43%	0.434	49%	0.489	S	S	.	.			trans	-81.4	112.8	168.5	60.3	0	0	0	0	107.6	L112 V116	L112-S114 PolarHBondContact O-N 2.75Å; S114-V116 WeakPolarHBondContact O-CG2 3.31Å; S114-V116 PolarHBondContact O-N 3.13Å
115	Q	65	Low	61.1	Low	118 Å²	118	77.8 Å²	77.8	55%	0.551	45%	0.45	S	S	*	.			trans	-44.6	114.4	165.8	-176.2	176.8	-1.7	0	0	108.8	S113 D117	S113-Q115 PolarHBondContact O-N 3.49Å; Q115-D117 PolarHBondContact NE2-OD2 3.32Å
116	V	78.2	Confident	63.4	Low	8 Å²	8	71.6 Å²	71.6	5%	0.048	42%	0.417	C	S	.	.			trans	-96.8	103.5	176	-179.5	0	0	0	0	107.5	Y13 I88 S90 S114 E118 Y220	Y13-V116 HydrophobicContact CD1-CG2 4.01Å; Y13-V116 HydrophobicContact CE1-CB 4.25Å; Y13-V116 HydrophobicContact CE1-CG2 3.33Å; I88-V116 HydrophobicContact CB-CG1 4.4Å; I88-V116 HydrophobicContact CD1-CG1 4.29Å; I88-V116 HydrophobicContact CG2-CG1 3.93Å; S90-V116 PolarHBondContact N-O 3.36Å; S90-V116 PolarHBondContact OG-N 3.19Å; S90-V116 PolarHBondContact OG-O 3.18Å; S114-V116 WeakPolarHBondContact O-CG2 3.31Å; S114-V116 PolarHBondContact O-N 3.13Å; V116-E118 HydrophobicContact CG1-CG 3.67Å; V116-Y220 HydrophobicContact CG1-CE1 4.37Å
117	D	86.3	Confident	65.6	Low	78 Å²	78	68.1 Å²	68.1	42%	0.417	39%	0.388	S	S	.	.			trans	-120.9	105.7	170.7	-69.5	-24.6	0	0	0	107.4	I88 K89 S90 Q115	I88-D117 WeakPolarHBondContact O-CA 2.98Å; K89-D117 VanDerWaalsContact CA-OD1 3.31Å; K89-D117 WeakPolarHBondContact CA-OD1 3.28Å; S90-D117 PolarHBondContact N-OD1 3.24Å; Q115-D117 PolarHBondContact NE2-OD2 3.32Å
118	E	90.8	Very high	68.5	Low	49 Å²	49	64.1 Å²	64.1	23%	0.229	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	138.7	-170.8	-64.7	-76.8	-152.6	0	0	110.4	L87 I88 V116 F120 R208 Y220	L87-E118 CarbonylContact C-O 3.55Å; L87-E118 WeakPolarHBondContact CA-O 3.41Å; I88-E118 HydrophobicContact CB-CB 4.32Å; I88-E118 HydrophobicContact CD1-CB 4.22Å; I88-E118 PolarHBondContact N-O 3.49Å; I88-E118 PolarHBondContact O-N 3.22Å; V116-E118 HydrophobicContact CG1-CG 3.67Å; E118-F120 HydrophobicContact CB-CE1 4.43Å; E118-F120 HydrophobicContact CB-CE2 3.62Å; E118-F120 HydrophobicContact CB-CZ 3.53Å; E118-F120 HydrophobicContact CG-CZ 4.14Å; E118-R208 IonicContact OE1-CZ 2.74Å; E118-R208 VanDerWaalsContact OE1-CZ 3.26Å; E118-R208 IonicContact OE1-NH1 3.27Å; E118-R208 PolarHBondContact OE1-NH1 3.28Å; E118-R208 IonicContact OE1-NH2 3.93Å; E118-R208 PolarHBondContact OE1-NH2 2.98Å; E118-R208 IonicContact OE2-CZ 3.53Å; E118-R208 IonicContact OE2-NH1 3.98Å; E118-R208 IonicContact OE2-NH2 2.9Å; E118-R208 PolarHBondContact OE2-NH2 2.75Å; E118-Y220 HydrophobicContact CG-CE1 4.32Å; E118-Y220 PolarHBondContact OE1-OH 2.72Å
119	D	90.8	Very high	71.1	Confident	96 Å²	96	58.9 Å²	58.9	51%	0.513	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	130.2	176.1	-174.6	3.6	0	0	0	109.5	H85 L87	H85-D119 IonicContact ND1-OD1 3.26Å; H85-D119 PolarHBondContact ND1-OD1 3.41Å; H85-D119 IonicContact ND1-OD2 2.8Å; L87-D119 HydrophobicContact CD1-CB 4.11Å
120	F	89.7	Confident	73.5	Confident	6 Å²	6	54.6 Å²	54.6	3%	0.026	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	142.8	179.7	-46.6	-78.6	0	0	0	111	H85 I86 I88 E118 Q124 F204 V206 Y220	H85-F120 CarbonylContact C-O 3.49Å; H85-F120 VanDerWaalsContact CA-O 3.28Å; H85-F120 WeakPolarHBondContact CA-O 3.13Å; I86-F120 HydrophobicContact CB-CB 4.23Å; I86-F120 HydrophobicContact CB-CD2 4.27Å; I86-F120 HydrophobicContact CG2-CD2 4.31Å; I86-F120 PolarHBondContact N-O 3.04Å; I86-F120 PolarHBondContact O-N 2.81Å; I88-F120 HydrophobicContact CD1-CE2 3.85Å; I88-F120 HydrophobicContact CG1-CE2 4.29Å; E118-F120 HydrophobicContact CB-CE1 4.43Å; E118-F120 HydrophobicContact CB-CE2 3.62Å; E118-F120 HydrophobicContact CB-CZ 3.53Å; E118-F120 HydrophobicContact CG-CZ 4.14Å; F120-Q124 VanDerWaalsContact CA-OE1 3.28Å; F120-F204 HydrophobicContact CD2-CE2 4.08Å; F120-F204 HydrophobicContact CD2-CZ 4.22Å; F120-F204 AromaticContact CE2-CE2 3.95Å; F120-F204 HydrophobicContact CE2-CE2 3.95Å; F120-F204 AromaticContact CE2-CZ 3.93Å; F120-F204 HydrophobicContact CE2-CZ 3.93Å; F120-V206 HydrophobicContact CD1-CB 4.21Å; F120-V206 HydrophobicContact CD1-CG1 3.91Å; F120-V206 HydrophobicContact CD1-CG2 4.06Å; F120-V206 HydrophobicContact CE1-CB 4.32Å; F120-V206 HydrophobicContact CE1-CG1 4.25Å; F120-V206 HydrophobicContact CE1-CG2 3.66Å; F120-V206 HydrophobicContact CG-CG1 4.09Å; F120-V206 HydrophobicContact CZ-CG2 4.22Å; F120-Y220 HydrophobicContact CE1-CE2 4.19Å; F120-Y220 HydrophobicContact CE2-CE2 4.36Å; F120-Y220 HydrophobicContact CZ-CD2 4.37Å; F120-Y220 HydrophobicContact CZ-CE1 4.33Å; F120-Y220 AromaticContact CZ-CE2 3.58Å; F120-Y220 HydrophobicContact CZ-CE2 3.58Å; F120-Y220 AromaticContact CZ-CZ 3.57Å
121	L	85.8	Confident	76.3	Confident	63 Å²	63	49.7 Å²	49.7	33%	0.33	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	149.4	170.8	-65.7	164.4	0	0	0	110.2	H85 Y123 Q124	H85-L121 WeakPolarHBondContact CE1-CD2 3.24Å; L121-Y123 HydrophobicContact CB-CD1 3.66Å; L121-Y123 HydrophobicContact CB-CE1 3.39Å; L121-Y123 HydrophobicContact CD1-CD1 4.45Å; L121-Y123 HydrophobicContact CD1-CE1 3.42Å; L121-Y123 VanDerWaalsContact CD1-CE1 3.42Å; L121-Y123 HydrophobicContact CG-CE1 3.98Å; L121-Y123 PolarHBondContact O-N 2.85Å; L121-Y123 VanDerWaalsContact O-N 3.08Å; L121-Q124 HydrophobicContact CB-CG 4.36Å; L121-Q124 VanDerWaalsContact O-CB 3.31Å; L121-Q124 WeakPolarHBondContact O-CB 3.47Å; L121-Q124 PolarHBondContact O-N 3.43Å
122	A	80.9	Confident	78.8	Confident	11 Å²	11	47.2 Å²	47.2	9%	0.091	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-50.3	-38.6	-178.3	0	0	0	0	0	114.1	G84 Q124 L125 L240	G84-A122 WeakPolarHBondContact O-CB 3.48Å; G84-A122 PolarHBondContact O-N 2.78Å; A122-Q124 PolarHBondContact O-N 2.83Å; A122-L125 WeakPolarHBondContact O-CB 3.22Å; A122-L125 PolarHBondContact O-N 3.22Å; A122-L240 HydrophobicContact CB-CD1 3.86Å; A122-L240 HydrophobicContact CB-CD2 3.97Å; A122-L240 HydrophobicContact CB-CG 3.58Å
123	Y	79	Confident	81	Confident	115 Å²	115	44 Å²	44	45%	0.451	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-70.4	-18.4	-179.2	71.9	-99.3	0	0	0	113.4	L121 L125	L121-Y123 HydrophobicContact CB-CD1 3.66Å; L121-Y123 HydrophobicContact CB-CE1 3.39Å; L121-Y123 HydrophobicContact CD1-CD1 4.45Å; L121-Y123 HydrophobicContact CD1-CE1 3.42Å; L121-Y123 VanDerWaalsContact CD1-CE1 3.42Å; L121-Y123 HydrophobicContact CG-CE1 3.98Å; L121-Y123 PolarHBondContact O-N 2.85Å; L121-Y123 VanDerWaalsContact O-N 3.08Å; Y123-L125 VanDerWaalsContact C-N 3.28Å
124	Q	82.3	Confident	83.1	Confident	47 Å²	47	40.5 Å²	40.5	22%	0.22	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-78.3	-15.8	177.1	-62	177.1	-55.9	0	0	111.7	F120 L121 A122 I126 V206 P207	F120-Q124 VanDerWaalsContact CA-OE1 3.28Å; L121-Q124 HydrophobicContact CB-CG 4.36Å; L121-Q124 VanDerWaalsContact O-CB 3.31Å; L121-Q124 WeakPolarHBondContact O-CB 3.47Å; L121-Q124 PolarHBondContact O-N 3.43Å; A122-Q124 PolarHBondContact O-N 2.83Å; Q124-I126 PolarHBondContact O-N 2.72Å; Q124-I126 VanDerWaalsContact O-N 3.14Å; Q124-V206 WeakPolarHBondContact O-CA 3.1Å; Q124-P207 WeakPolarHBondContact O-CD 3.31Å
125	L	80.6	Confident	84.7	Confident	7 Å²	7	38.8 Å²	38.8	4%	0.037	19%	0.186	C	C	.	.			trans	-74.7	102.4	178	-177	65.5	0	0	0	110.9	I86 A122 Y123 F128 F204 F237	I86-L125 HydrophobicContact CD1-CB 3.95Å; I86-L125 HydrophobicContact CD1-CD1 3.99Å; I86-L125 HydrophobicContact CD1-CD2 4Å; I86-L125 HydrophobicContact CD1-CG 4.2Å; A122-L125 WeakPolarHBondContact O-CB 3.22Å; A122-L125 PolarHBondContact O-N 3.22Å; Y123-L125 VanDerWaalsContact C-N 3.28Å; L125-F128 HydrophobicContact CD1-CB 4.29Å; L125-F128 HydrophobicContact CD1-CD1 3.94Å; L125-F128 HydrophobicContact CD2-CD1 3.49Å; L125-F128 VanDerWaalsContact CD2-CD1 3.49Å; L125-F128 HydrophobicContact CD2-CE1 3.68Å; L125-F128 HydrophobicContact CD2-CG 4.36Å; L125-F128 HydrophobicContact CG-CD1 3.67Å; L125-F128 HydrophobicContact CG-CE1 4.15Å; L125-F204 HydrophobicContact CD1-CB 3.68Å; L125-F204 HydrophobicContact CD1-CD2 3.95Å; L125-F204 HydrophobicContact CD1-CG 4.12Å; L125-F237 HydrophobicContact CD1-CD1 4.45Å; L125-F237 HydrophobicContact CD2-CB 3.95Å; L125-F237 HydrophobicContact CD2-CD1 3.66Å; L125-F237 HydrophobicContact CD2-CE1 4.45Å; L125-F237 HydrophobicContact CD2-CG 4.02Å
126	I	77.9	Confident	85.6	Confident	28 Å²	28	34.9 Å²	34.9	14%	0.144	17%	0.17	C	C	.	.			trans	-89.3	-51.4	-177.5	-61.4	173.8	0	0	0	110.9	Q124 M205 P207 L217 R241	Q124-I126 PolarHBondContact O-N 2.72Å; Q124-I126 VanDerWaalsContact O-N 3.14Å; I126-M205 PolarHBondContact N-O 2.9Å; I126-P207 HydrophobicContact CD1-CB 3.9Å; I126-P207 HydrophobicContact CD1-CG 3.84Å; I126-P207 HydrophobicContact CG1-CG 4.5Å; I126-L217 HydrophobicContact CD1-CD2 3.53Å; I126-R241 PolarHBondContact O-NH1 3.01Å
127	Y	81	Confident	85.6	Confident	32 Å²	32	36.8 Å²	36.8	13%	0.125	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	151.3	178.9	-66.9	-61.4	0	0	0	111.4	F204 M205 L326	Y127-F204 CarbonylContact O-C 3.48Å; Y127-F204 WeakPolarHBondContact O-CA 3.38Å; Y127-F204 WeakPolarHBondContact O-CB 3.32Å; Y127-M205 HydrophobicContact CD2-SD 4.01Å; Y127-M205 HydrophobicContact CG-SD 4.47Å; Y127-M205 PolarHBondContact O-N 3.42Å; Y127-L326 HydrophobicContact CD1-CD2 4.16Å; Y127-L326 HydrophobicContact CE1-CD1 3.67Å; Y127-L326 HydrophobicContact CE1-CD2 3.21Å; Y127-L326 HydrophobicContact CE1-CG 3.37Å; Y127-L326 HydrophobicContact CE2-CD2 4.02Å; Y127-L326 WeakPolarHBondContact OH-CD2 3.46Å; Y127-L326 WeakPolarHBondContact OH-CG 3.49Å
128	F	88.2	Confident	84.6	Confident	32 Å²	32	36 Å²	36	14%	0.14	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	146	168.4	54.1	-87.2	0	0	0	108.5	L125 Y203 F204 L234 F237	L125-F128 HydrophobicContact CD1-CB 4.29Å; L125-F128 HydrophobicContact CD1-CD1 3.94Å; L125-F128 HydrophobicContact CD2-CD1 3.49Å; L125-F128 VanDerWaalsContact CD2-CD1 3.49Å; L125-F128 HydrophobicContact CD2-CE1 3.68Å; L125-F128 HydrophobicContact CD2-CG 4.36Å; L125-F128 HydrophobicContact CG-CD1 3.67Å; L125-F128 HydrophobicContact CG-CE1 4.15Å; F128-Y203 WeakPolarHBondContact CA-O 3.46Å; F128-F204 HydrophobicContact CB-CB 3.78Å; F128-L234 HydrophobicContact CD2-CD2 3.72Å; F128-L234 HydrophobicContact CE2-CD2 4.35Å; F128-F237 HydrophobicContact CB-CD2 3.85Å; F128-F237 HydrophobicContact CB-CE2 4.32Å; F128-F237 HydrophobicContact CB-CG 4.33Å; F128-F237 HydrophobicContact CD1-CB 4.02Å; F128-F237 HydrophobicContact CD2-CB 3.52Å; F128-F237 HydrophobicContact CD2-CD2 4Å; F128-F237 HydrophobicContact CD2-CG 4.15Å; F128-F237 HydrophobicContact CE1-CB 4.03Å; F128-F237 HydrophobicContact CE2-CB 3.56Å; F128-F237 HydrophobicContact CG-CB 3.76Å; F128-F237 AromaticContact CG-CD2 3.99Å; F128-F237 HydrophobicContact CG-CD2 3.99Å; F128-F237 HydrophobicContact CG-CG 4.08Å; F128-F237 HydrophobicContact CZ-CB 3.81Å
129	N	89.9	Confident	82.9	Confident	19 Å²	19	39.2 Å²	39.2	10%	0.102	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	169.5	167.2	-134.1	-54.1	0	0	0	110.5	Y131 R166 Y203	N129-Y131 HydrophobicContact CB-CE2 4.14Å; N129-R166 WeakPolarHBondContact ND2-CD 3.21Å; N129-R166 PolarHBondContact ND2-NE 2.93Å; N129-Y203 HydrophobicContact CB-CD1 4.11Å; N129-Y203 HydrophobicContact CB-CE1 3.28Å; N129-Y203 PolarHBondContact N-O 2.96Å; N129-Y203 PolarHBondContact O-N 2.86Å
130	C	90.7	Very high	81	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	125	170.8	-177.5	0	0	0	0	107.5	I167 L201 I202 L234	C130-I167 HydrophobicContact CB-CB 4.37Å; C130-I167 HydrophobicContact CB-CG2 3.81Å; C130-I167 WeakPolarHBondContact O-CG2 3.48Å; C130-I167 PolarHBondContact O-N 2.9Å; C130-L201 CarbonylContact C-O 3.52Å; C130-L201 WeakPolarHBondContact CA-O 3.26Å; C130-I202 HydrophobicContact CB-CG1 4.25Å; C130-L234 HydrophobicContact CB-CD1 3.52Å; C130-L234 HydrophobicContact CB-CD2 3.97Å; C130-L234 HydrophobicContact CB-CG 3.59Å
131	Y	90.8	Very high	78.7	Confident	14 Å²	14	40.1 Å²	40.1	6%	0.055	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	147.7	178.1	-70.2	-75.9	0	0	0	109.5	L34 N129 F164 R165 R166 P200 L201 Y203	L34-Y131 HydrophobicContact CD1-CD2 4.1Å; L34-Y131 HydrophobicContact CD1-CE2 3.82Å; N129-Y131 HydrophobicContact CB-CE2 4.14Å; Y131-F164 HydrophobicContact CD1-CB 3.69Å; Y131-F164 HydrophobicContact CD1-CG 4.42Å; Y131-F164 HydrophobicContact CE1-CB 4.36Å; Y131-F164 HydrophobicContact CG-CB 3.94Å; Y131-F164 HydrophobicContact CG-CD1 4.39Å; Y131-F164 HydrophobicContact CG-CG 4.17Å; Y131-R165 CarbonylContact C-O 3.37Å; Y131-R165 VanDerWaalsContact CA-O 3.28Å; Y131-R165 WeakPolarHBondContact CA-O 3.43Å; Y131-R166 HydrophobicContact CD1-CB 4.33Å; Y131-R166 HydrophobicContact CD1-CG 3.77Å; Y131-R166 HydrophobicContact CE1-CB 4.19Å; Y131-R166 HydrophobicContact CE1-CG 3.18Å; Y131-R166 PolarHBondContact OH-NE 2.66Å; Y131-P200 CarbonylContact O-C 3.52Å; Y131-P200 VanDerWaalsContact O-CA 3.31Å; Y131-P200 WeakPolarHBondContact O-CA 3.34Å; Y131-L201 HydrophobicContact CD2-CD2 4.42Å; Y131-L201 PolarHBondContact N-O 2.71Å; Y131-L201 PolarHBondContact O-N 2.73Å; Y131-Y203 HydrophobicContact CD2-CD1 4.23Å; Y131-Y203 AromaticContact CD2-CE1 3.94Å; Y131-Y203 HydrophobicContact CD2-CE1 3.94Å; Y131-Y203 HydrophobicContact CE2-CD1 4.16Å; Y131-Y203 AromaticContact CE2-CE1 3.44Å; Y131-Y203 HydrophobicContact CE2-CE1 3.44Å; Y131-Y203 VanDerWaalsContact CE2-CE1 3.44Å
132	Y	88	Confident	76.4	Confident	42 Å²	42	44.2 Å²	44.2	17%	0.165	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	149.1	161.1	65.5	-101.8	0	0	0	108.8	E134 R165 I167	Y132-E134 HydrophobicContact CD2-CB 4.4Å; Y132-E134 HydrophobicContact CD2-CG 4.05Å; Y132-E134 HydrophobicContact CE2-CB 4.06Å; Y132-E134 HydrophobicContact CE2-CG 3.49Å; Y132-E134 VanDerWaalsContact CE2-CG 3.49Å; Y132-E134 WeakPolarHBondContact CE2-OE1 3.22Å; Y132-E134 VanDerWaalsContact CZ-OE1 3.25Å; Y132-E134 PolarHBondContact OH-OE1 3.45Å; Y132-R165 HydrophobicContact CD1-CB 4.38Å; Y132-R165 HydrophobicContact CD2-CB 4.12Å; Y132-R165 HydrophobicContact CE1-CB 3.81Å; Y132-R165 HydrophobicContact CE1-CG 3.76Å; Y132-R165 HydrophobicContact CE2-CB 3.43Å; Y132-R165 VanDerWaalsContact CE2-CB 3.43Å; Y132-R165 HydrophobicContact CE2-CG 4.02Å; Y132-R165 VanDerWaalsContact CZ-CG 3.42Å; Y132-R165 PolarHBondContact N-O 3.42Å; Y132-R165 PolarHBondContact O-N 3.15Å; Y132-R165 WeakPolarHBondContact OH-CD 3.28Å; Y132-R165 VanDerWaalsContact OH-CG 3.31Å; Y132-R165 WeakPolarHBondContact OH-CG 3.42Å; Y132-R165 PolarHBondContact OH-NE 3.5Å; Y132-R165 PolarHBondContact OH-NH1 3.28Å; Y132-I167 HydrophobicContact CD1-CB 4.32Å; Y132-I167 HydrophobicContact CD1-CG1 4.35Å
133	F	89.4	Confident	74.6	Confident	5 Å²	5	49.6 Å²	49.6	2%	0.022	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	108.1	-177.1	-166.8	-103.6	0	0	0	109.5	Y38 L39 L42 V135 A162 F164 L182 R198	Y38-F133 HydrophobicContact CD1-CB 4.01Å; Y38-F133 HydrophobicContact CD1-CD1 4.15Å; Y38-F133 AromaticContact CD1-CD2 3.65Å; Y38-F133 HydrophobicContact CD1-CD2 3.65Å; Y38-F133 HydrophobicContact CD1-CE1 4.48Å; Y38-F133 HydrophobicContact CD1-CE2 4.03Å; Y38-F133 AromaticContact CD1-CG 3.69Å; Y38-F133 HydrophobicContact CD1-CG 3.69Å; Y38-F133 HydrophobicContact CD1-CZ 4.4Å; Y38-F133 HydrophobicContact CE1-CB 3.35Å; Y38-F133 AromaticContact CE1-CD1 3.69Å; Y38-F133 HydrophobicContact CE1-CD1 3.69Å; Y38-F133 AromaticContact CE1-CD2 3.86Å; Y38-F133 HydrophobicContact CE1-CD2 3.86Å; Y38-F133 HydrophobicContact CE1-CE1 4.36Å; Y38-F133 AromaticContact CE1-CG 3.37Å; Y38-F133 HydrophobicContact CE1-CG 3.37Å; Y38-F133 HydrophobicContact CE2-CB 4.36Å; Y38-F133 HydrophobicContact CG-CD2 4.39Å; L39-F133 HydrophobicContact CD2-CE2 4.43Å; L39-F133 HydrophobicContact CD2-CZ 3.98Å; L42-F133 HydrophobicContact CD1-CD1 4.11Å; L42-F133 HydrophobicContact CD1-CE1 3.56Å; L42-F133 HydrophobicContact CD1-CZ 3.94Å; F133-V135 HydrophobicContact CD1-CG2 3.93Å; F133-V135 HydrophobicContact CE1-CG2 3.94Å; F133-A162 HydrophobicContact CD1-CB 4.2Å; F133-A162 HydrophobicContact CE1-CB 3.44Å; F133-A162 VanDerWaalsContact CE1-CB 3.44Å; F133-A162 HydrophobicContact CE2-CB 3.82Å; F133-A162 HydrophobicContact CZ-CB 3.24Å; F133-F164 HydrophobicContact CB-CD1 4.16Å; F133-F164 HydrophobicContact CB-CE1 3.91Å; F133-F164 AromaticContact CD2-CD1 3.88Å; F133-F164 HydrophobicContact CD2-CD1 3.88Å; F133-F164 AromaticContact CD2-CE1 3.63Å; F133-F164 HydrophobicContact CD2-CE1 3.63Å; F133-F164 HydrophobicContact CD2-CZ 4.1Å; F133-F164 HydrophobicContact CG-CE1 4.26Å; F133-L182 HydrophobicContact CE1-CD1 4.35Å; F133-L182 HydrophobicContact CZ-CD1 4.47Å; F133-L182 HydrophobicContact CZ-CD2 4.03Å; F133-R198 PolarHBondContact O-NE 3.26Å
134	E	86.9	Confident	72.7	Confident	19 Å²	19	47.7 Å²	47.7	9%	0.089	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	135.7	177.8	-112.9	178.9	-128.4	0	0	109.4	Y132 A162 Y163 R165	Y132-E134 HydrophobicContact CD2-CB 4.4Å; Y132-E134 HydrophobicContact CD2-CG 4.05Å; Y132-E134 HydrophobicContact CE2-CB 4.06Å; Y132-E134 HydrophobicContact CE2-CG 3.49Å; Y132-E134 VanDerWaalsContact CE2-CG 3.49Å; Y132-E134 WeakPolarHBondContact CE2-OE1 3.22Å; Y132-E134 VanDerWaalsContact CZ-OE1 3.25Å; Y132-E134 PolarHBondContact OH-OE1 3.45Å; E134-A162 CarbonylContact O-C 3.5Å; E134-A162 WeakPolarHBondContact O-CA 3.5Å; E134-A162 VanDerWaalsContact O-CB 3.24Å; E134-A162 WeakPolarHBondContact O-CB 3.22Å; E134-Y163 HydrophobicContact CB-CD1 3.99Å; E134-Y163 HydrophobicContact CB-CE1 3.33Å; E134-Y163 HydrophobicContact CG-CE1 4.26Å; E134-Y163 PolarHBondContact N-O 3.33Å; E134-Y163 PolarHBondContact O-N 2.95Å; E134-Y163 PolarHBondContact OE1-OH 3.48Å; E134-Y163 VanDerWaalsContact OE2-CE1 3.26Å; E134-Y163 WeakPolarHBondContact OE2-CE1 3.3Å; E134-Y163 VanDerWaalsContact OE2-CZ 3.24Å; E134-Y163 PolarHBondContact OE2-OH 2.69Å; E134-R165 IonicContact OE1-NH1 3.08Å; E134-R165 PolarHBondContact OE1-NH1 3Å; E134-R165 VanDerWaalsContact OE1-NH1 3.08Å
135	V	87.1	Confident	70.7	Confident	25 Å²	25	53.6 Å²	53.6	15%	0.152	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	126.4	-178.6	-176.7	0	0	0	0	108.4	F133 C160 Y161 A162 L190	F133-V135 HydrophobicContact CD1-CG2 3.93Å; F133-V135 HydrophobicContact CE1-CG2 3.94Å; V135-C160 HydrophobicContact CG1-CB 3.74Å; V135-Y161 CarbonylContact C-O 3.58Å; V135-Y161 WeakPolarHBondContact CA-O 3.46Å; V135-A162 HydrophobicContact CG2-CB 4.34Å; V135-L190 HydrophobicContact CG1-CD1 4.12Å; V135-L190 HydrophobicContact CG2-CD1 3.85Å; V135-L190 HydrophobicContact CG2-CD2 4.26Å
136	V	83.5	Confident	68.7	Low	36 Å²	36	60.5 Å²	60.5	22%	0.218	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	124.8	178.2	-177.4	0	0	0	0	108.6	Y161 L179	V136-Y161 PolarHBondContact N-O 2.85Å; V136-Y161 PolarHBondContact O-N 2.87Å; V136-L179 HydrophobicContact CG2-CD2 3.97Å
137	T	77.8	Confident	66.8	Low	48 Å²	48	63.4 Å²	63.4	29%	0.294	37%	0.368	S	S	.	.			trans	-98.8	132.9	171	52	0	0	0	0	109.3	V139 L191	T137-V139 PolarHBondContact O-N 3.14Å; T137-L191 HydrophobicContact CG2-CD2 3.58Å
138	P	65.4	Low	64.5	Low	61 Å²	61	66.3 Å²	66.3	40%	0.396	40%	0.398	S	S	.	.			trans	-66.1	118.3	174.3	25.7	-31.3	0	0	0	109.5	G140 H159	P138-G140 PolarHBondContact O-N 3.03Å; P138-H159 WeakPolarHBondContact CD-O 3.49Å
139	V	55.5	Low	62.1	Low	118 Å²	118	73.1 Å²	73.1	72%	0.715	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	106.1	173.1	-175.5	0	0	0	0	107.8	T137	T137-V139 PolarHBondContact O-N 3.14Å
140	G	50.2	Low	59.7	Low	64 Å²	64	80 Å²	80	66%	0.66	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	142.8	14	168.9	0	0	0	0	0	119.6	P138 N142	P138-G140 PolarHBondContact O-N 3.03Å; G140-N142 PolarHBondContact O-N 3.34Å
141	S	42.1	Very low	56.9	Low	57 Å²	57	83.4 Å²	83.4	40%	0.399	50%	0.502	S	S	.	.			trans	-76.4	116.2	161.1	69.8	0	0	0	0	108.2	I143 D158	S141-I143 VanDerWaalsContact C-N 3.34Å; S141-I143 PolarHBondContact O-N 3.01Å; S141-D158 WeakPolarHBondContact CB-OD1 3.46Å; S141-D158 PolarHBondContact OG-OD1 2.87Å; S141-D158 PolarHBondContact OG-OD2 2.95Å
142	N	38	Very low	54.3	Low	148 Å²	148	89.2 Å²	89.2	79%	0.791	53%	0.534	S	S	*	.			trans	-62.6	97.4	174.6	-69.7	-42.2	0	0	0	108.5	G140 S144	G140-N142 PolarHBondContact O-N 3.34Å; N142-S144 PolarHBondContact O-N 3.24Å
143	I	43.2	Very low	51.8	Low	124 Å²	124	93.9 Å²	93.9	64%	0.636	56%	0.562	S	S	*	*			trans	-68.7	72.4	150.7	-55.1	175.3	0	0	0	105.4	S141 H145	S141-I143 VanDerWaalsContact C-N 3.34Å; S141-I143 PolarHBondContact O-N 3.01Å; I143-H145 PolarHBondContact O-N 3.15Å
144	S	38.2	Very low	49.5	Very low	76 Å²	76	101 Å²	101	53%	0.531	60%	0.6	S	S	.	*			trans	-66.4	103.6	164.6	54.5	0	0	0	0	106	N142 N146	N142-S144 PolarHBondContact O-N 3.24Å; S144-N146 PolarHBondContact O-N 3.44Å
145	H	41.5	Very low	47.6	Very low	170 Å²	170	108.3 Å²	108.3	79%	0.787	63%	0.632	S	S	*	*	S	Bend	trans	-61.4	9.2	177	-93.3	-76	0	0	0	115	I143	I143-H145 PolarHBondContact O-N 3.15Å
146	N	38	Very low	45.7	Very low	152 Å²	152	114.2 Å²	114.2	81%	0.813	66%	0.662	S	S	*	*			trans	-139.7	78.9	-177.4	-68.8	-29.9	0	0	0	111.1	S144	S144-N146 PolarHBondContact O-N 3.44Å
147	S	37	Very low	44.4	Very low	90 Å²	90	122.1 Å²	122.1	63%	0.629	69%	0.688	S	S	*	*			trans	-170.4	82.2	147.3	47.6	0	0	0	0	110.5
148	A	33.9	Very low	43.8	Very low	93 Å²	93	122.9 Å²	122.9	77%	0.769	69%	0.691	S	S	*	*			trans	-61.7	138.7	144.1	0	0	0	0	0	107.2
149	H	38.2	Very low	44.5	Very low	174 Å²	174	121.3 Å²	121.3	81%	0.806	68%	0.678	S	S	*	*			trans	83.7	76.2	-174.6	-59.1	-71	0	0	0	116.8
150	N	38.7	Very low	46	Very low	163 Å²	163	115.7 Å²	115.7	87%	0.872	64%	0.644	S	S	*	*				-174.1	124.4	111.7	-106.6	-26.6	0	0	0	111.1	N152	N150-N152 PolarHBondContact O-N 3.35Å
151	G	32	Very low	47.8	Very low	72 Å²	72	116.6 Å²	116.6	74%	0.742	63%	0.628	S	S	*	*			trans	-70.8	111.7	172.9	0	0	0	0	0	110.5
152	N	36.8	Very low	50	Low	137 Å²	137	113.9 Å²	113.9	73%	0.733	61%	0.609	S	S	*	*			trans	-161.6	93.1	153.3	-112.1	-19.2	0	0	0	111.2	N150 N154	N150-N152 PolarHBondContact O-N 3.35Å; N152-N154 PolarHBondContact O-N 2.97Å
153	N	35.1	Very low	52.4	Low	140 Å²	140	107.3 Å²	107.3	75%	0.749	57%	0.573	S	S	*	*			trans	38.8	29.4	136.5	-67.2	-21	0	0	0	122.8	K155	N153-K155 VanDerWaalsContact C-N 3.3Å; N153-K155 PolarHBondContact O-N 3.31Å
154	N	41	Very low	54.5	Low	153 Å²	153	101.8 Å²	101.8	82%	0.818	55%	0.545	S	S	*	.			trans	-78.9	82	163.9	-81	-11.7	0	0	0	110.9	N152 N156	N152-N154 PolarHBondContact O-N 2.97Å; N154-N156 PolarHBondContact O-N 3.41Å; N154-N156 VanDerWaalsContact O-N 3.15Å
155	K	46.9	Very low	56.6	Low	174 Å²	174	99.8 Å²	99.8	76%	0.757	53%	0.525	S	S	*	.			trans	-67.7	3.8	175.2	-78.4	-177.2	176.2	177.1	0	114.8	N153 R157	N153-K155 VanDerWaalsContact C-N 3.3Å; N153-K155 PolarHBondContact O-N 3.31Å; K155-R157 PolarHBondContact O-N 2.8Å
156	N	47.6	Very low	58.7	Low	148 Å²	148	95.2 Å²	95.2	79%	0.791	50%	0.501	S	S	*	.			trans	-80.6	53.9	172.3	-75.4	-10.6	0	0	0	111.1	N154	N154-N156 PolarHBondContact O-N 3.41Å; N154-N156 VanDerWaalsContact O-N 3.15Å
157	R	54.6	Low	60.7	Low	202 Å²	202	89 Å²	89	76%	0.762	47%	0.468	S	S	*	.			trans	-65.2	135.4	170.5	-74.4	-178.6	172.9	175.9	-2.9	108.9	K155 H159	K155-R157 PolarHBondContact O-N 2.8Å; R157-H159 VanDerWaalsContact C-N 3.35Å; R157-H159 PolarHBondContact O-CD2 2.78Å; R157-H159 PolarHBondContact O-N 2.92Å
158	D	66.9	Low	62.7	Low	65 Å²	65	90.1 Å²	90.1	35%	0.348	47%	0.466	S	S	.	.			trans	-30.1	80.5	176.8	-56.5	-34.1	0	0	0	115.4	S141 T187	S141-D158 WeakPolarHBondContact CB-OD1 3.46Å; S141-D158 PolarHBondContact OG-OD1 2.87Å; S141-D158 PolarHBondContact OG-OD2 2.95Å; D158-T187 WeakPolarHBondContact O-CG2 3.15Å
159	H	79.7	Confident	64.7	Low	27 Å²	27	87.1 Å²	87.1	13%	0.125	44%	0.437	C	S	.	.			trans	-75.1	134.4	171	-70.9	-74.8	0	0	0	109.2	P138 R157 K181 L182 N184	P138-H159 WeakPolarHBondContact CD-O 3.49Å; R157-H159 VanDerWaalsContact C-N 3.35Å; R157-H159 PolarHBondContact O-CD2 2.78Å; R157-H159 PolarHBondContact O-N 2.92Å; H159-K181 HydrophobicContact CB-CG 4.13Å; H159-K181 WeakPolarHBondContact CD2-CE 3.32Å; H159-K181 PolarHBondContact CD2-NZ 3.08Å; H159-K181 VanDerWaalsContact NE2-CE 3.28Å; H159-K181 WeakPolarHBondContact NE2-CE 3.48Å; H159-K181 PolarHBondContact NE2-NZ 3.26Å; H159-K181 VanDerWaalsContact NE2-NZ 3.18Å; H159-L182 PolarHBondContact ND1-O 2.98Å; H159-N184 PolarHBondContact CE1-OD1 2.64Å; H159-N184 PolarHBondContact ND1-OD1 3.37Å
160	C	86.8	Confident	66.2	Low	1 Å²	1	84.7 Å²	84.7	1%	0.007	43%	0.434	C	S	.	.			trans	-71.6	144.7	163.3	-72.5	0	0	0	0	108.7	V135 L182 T187	V135-C160 HydrophobicContact CG1-CB 3.74Å; C160-L182 HydrophobicContact CB-CB 4.42Å; C160-L182 HydrophobicContact CB-CD1 3.89Å; C160-L182 HydrophobicContact CB-CG 4.44Å; C160-L182 WeakPolarHBondContact O-CB 3.36Å; C160-L182 PolarHBondContact O-N 2.83Å; C160-T187 HydrophobicContact CB-CG2 4.15Å; C160-T187 PolarHBondContact N-OG1 3.01Å
161	Y	88.3	Confident	67.6	Low	83 Å²	83	84.1 Å²	84.1	33%	0.325	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	155.4	165.3	-66.7	-95.9	0	0	0	108	V135 V136 L179 I180 K181	V135-Y161 CarbonylContact C-O 3.58Å; V135-Y161 WeakPolarHBondContact CA-O 3.46Å; V136-Y161 PolarHBondContact N-O 2.85Å; V136-Y161 PolarHBondContact O-N 2.87Å; Y161-L179 HydrophobicContact CD1-CB 4.21Å; Y161-I180 CarbonylContact C-O 3.51Å; Y161-I180 VanDerWaalsContact CA-O 3.27Å; Y161-I180 WeakPolarHBondContact CA-O 3.43Å; Y161-K181 HydrophobicContact CD1-CB 4.11Å; Y161-K181 HydrophobicContact CE1-CB 3.84Å; Y161-K181 HydrophobicContact CE1-CG 4.09Å
162	A	88.7	Confident	69.1	Low	0 Å²	0	91.5 Å²	91.5	0%	0	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	163.3	174.3	0	0	0	0	0	111.5	F133 E134 V135 I180 L182	F133-A162 HydrophobicContact CD1-CB 4.2Å; F133-A162 HydrophobicContact CE1-CB 3.44Å; F133-A162 VanDerWaalsContact CE1-CB 3.44Å; F133-A162 HydrophobicContact CE2-CB 3.82Å; F133-A162 HydrophobicContact CZ-CB 3.24Å; E134-A162 CarbonylContact O-C 3.5Å; E134-A162 WeakPolarHBondContact O-CA 3.5Å; E134-A162 VanDerWaalsContact O-CB 3.24Å; E134-A162 WeakPolarHBondContact O-CB 3.22Å; V135-A162 HydrophobicContact CG2-CB 4.34Å; A162-I180 PolarHBondContact N-O 2.7Å; A162-I180 PolarHBondContact O-N 2.99Å; A162-L182 HydrophobicContact CB-CD1 3.87Å; A162-L182 HydrophobicContact CB-CD2 4.03Å; A162-L182 HydrophobicContact CB-CG 4.1Å
163	Y	86.7	Confident	70.6	Confident	9 Å²	9	90 Å²	90	4%	0.035	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	159.5	173.6	76.2	-72.7	0	0	0	109.5	E134 R165 I174 A178 L179	E134-Y163 HydrophobicContact CB-CD1 3.99Å; E134-Y163 HydrophobicContact CB-CE1 3.33Å; E134-Y163 HydrophobicContact CG-CE1 4.26Å; E134-Y163 PolarHBondContact N-O 3.33Å; E134-Y163 PolarHBondContact O-N 2.95Å; E134-Y163 PolarHBondContact OE1-OH 3.48Å; E134-Y163 VanDerWaalsContact OE2-CE1 3.26Å; E134-Y163 WeakPolarHBondContact OE2-CE1 3.3Å; E134-Y163 VanDerWaalsContact OE2-CZ 3.24Å; E134-Y163 PolarHBondContact OE2-OH 2.69Å; Y163-R165 HydrophobicContact CD2-CB 4.39Å; Y163-R165 HydrophobicContact CE2-CB 3.52Å; Y163-R165 HydrophobicContact CE2-CG 4.22Å; Y163-R165 WeakPolarHBondContact OH-CD 3.49Å; Y163-I174 HydrophobicContact CD1-CD1 4.21Å; Y163-I174 HydrophobicContact CD1-CG2 4.05Å; Y163-I174 HydrophobicContact CD2-CG1 4.42Å; Y163-I174 HydrophobicContact CD2-CG2 3.73Å; Y163-I174 HydrophobicContact CE1-CB 4.47Å; Y163-I174 HydrophobicContact CE1-CD1 3.27Å; Y163-I174 HydrophobicContact CE1-CG1 3.78Å; Y163-I174 HydrophobicContact CE1-CG2 4.14Å; Y163-I174 HydrophobicContact CE2-CB 4.38Å; Y163-I174 HydrophobicContact CE2-CD1 4.08Å; Y163-I174 HydrophobicContact CE2-CG1 3.64Å; Y163-I174 HydrophobicContact CE2-CG2 3.8Å; Y163-I174 HydrophobicContact CG-CG2 3.87Å; Y163-I174 WeakPolarHBondContact OH-CD1 3.33Å; Y163-I174 VanDerWaalsContact OH-CG1 3.28Å; Y163-I174 WeakPolarHBondContact OH-CG1 3.41Å; Y163-A178 WeakPolarHBondContact CB-O 2.94Å; Y163-L179 HydrophobicContact CD1-CD2 3.91Å; Y163-L179 HydrophobicContact CG-CD2 4.35Å
164	F	87.4	Confident	72.1	Confident	9 Å²	9	85.8 Å²	85.8	4%	0.039	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	125.5	168	-81.7	-49.3	0	0	0	111.7	Y31 L34 I35 Y38 Y131 F133 L201	Y31-F164 HydrophobicContact CE2-CB 3.71Å; Y31-F164 HydrophobicContact CE2-CD2 4.3Å; Y31-F164 PolarHBondContact OH-N 3.21Å; Y31-F164 PolarHBondContact OH-O 2.9Å; L34-F164 HydrophobicContact CB-CE2 4.14Å; L34-F164 WeakPolarHBondContact O-CE2 3.4Å; I35-F164 HydrophobicContact CB-CE2 4.3Å; I35-F164 HydrophobicContact CD1-CD2 4.47Å; I35-F164 HydrophobicContact CG1-CD2 3.56Å; I35-F164 HydrophobicContact CG1-CE2 3.61Å; Y38-F164 VanDerWaalsContact CB-CZ 3.48Å; Y38-F164 HydrophobicContact CD1-CE1 4.38Å; Y38-F164 HydrophobicContact CD1-CZ 4.31Å; Y38-F164 AromaticContact CD2-CE1 3.91Å; Y38-F164 HydrophobicContact CD2-CE1 3.91Å; Y38-F164 AromaticContact CD2-CZ 3.8Å; Y38-F164 HydrophobicContact CD2-CZ 3.8Å; Y38-F164 HydrophobicContact CE2-CE1 4.31Å; Y38-F164 AromaticContact CG-CE1 3.94Å; Y38-F164 HydrophobicContact CG-CE1 3.94Å; Y38-F164 AromaticContact CG-CZ 3.6Å; Y38-F164 HydrophobicContact CG-CZ 3.6Å; Y131-F164 HydrophobicContact CD1-CB 3.69Å; Y131-F164 HydrophobicContact CD1-CG 4.42Å; Y131-F164 HydrophobicContact CE1-CB 4.36Å; Y131-F164 HydrophobicContact CG-CB 3.94Å; Y131-F164 HydrophobicContact CG-CD1 4.39Å; Y131-F164 HydrophobicContact CG-CG 4.17Å; F133-F164 HydrophobicContact CB-CD1 4.16Å; F133-F164 HydrophobicContact CB-CE1 3.91Å; F133-F164 AromaticContact CD2-CD1 3.88Å; F133-F164 HydrophobicContact CD2-CD1 3.88Å; F133-F164 AromaticContact CD2-CE1 3.63Å; F133-F164 HydrophobicContact CD2-CE1 3.63Å; F133-F164 HydrophobicContact CD2-CZ 4.1Å; F133-F164 HydrophobicContact CG-CE1 4.26Å; F164-L201 HydrophobicContact CE1-CB 4.34Å; F164-L201 HydrophobicContact CZ-CB 4.43Å; F164-L201 HydrophobicContact CZ-CD1 3.98Å
165	R	83.3	Confident	73.4	Confident	34 Å²	34	81.7 Å²	81.7	13%	0.128	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	134.8	167.8	-173.6	149.7	155.8	-147.8	-0.3	109.7	Y131 Y132 E134 Y163 I167 D169 R171	Y131-R165 CarbonylContact C-O 3.37Å; Y131-R165 VanDerWaalsContact CA-O 3.28Å; Y131-R165 WeakPolarHBondContact CA-O 3.43Å; Y132-R165 HydrophobicContact CD1-CB 4.38Å; Y132-R165 HydrophobicContact CD2-CB 4.12Å; Y132-R165 HydrophobicContact CE1-CB 3.81Å; Y132-R165 HydrophobicContact CE1-CG 3.76Å; Y132-R165 HydrophobicContact CE2-CB 3.43Å; Y132-R165 VanDerWaalsContact CE2-CB 3.43Å; Y132-R165 HydrophobicContact CE2-CG 4.02Å; Y132-R165 VanDerWaalsContact CZ-CG 3.42Å; Y132-R165 PolarHBondContact N-O 3.42Å; Y132-R165 PolarHBondContact O-N 3.15Å; Y132-R165 WeakPolarHBondContact OH-CD 3.28Å; Y132-R165 VanDerWaalsContact OH-CG 3.31Å; Y132-R165 WeakPolarHBondContact OH-CG 3.42Å; Y132-R165 PolarHBondContact OH-NE 3.5Å; Y132-R165 PolarHBondContact OH-NH1 3.28Å; E134-R165 IonicContact OE1-NH1 3.08Å; E134-R165 PolarHBondContact OE1-NH1 3Å; E134-R165 VanDerWaalsContact OE1-NH1 3.08Å; Y163-R165 HydrophobicContact CD2-CB 4.39Å; Y163-R165 HydrophobicContact CE2-CB 3.52Å; Y163-R165 HydrophobicContact CE2-CG 4.22Å; Y163-R165 WeakPolarHBondContact OH-CD 3.49Å; R165-I167 PolarHBondContact O-N 3.43Å; R165-D169 HydrophobicContact CG-CB 3.97Å; R165-D169 PolarHBondContact NE-O 2.8Å; R165-D169 PolarHBondContact NH2-O 3.03Å; R165-R171 PolarHBondContact NE-O 2.78Å; R165-R171 PolarHBondContact NH1-O 3.3Å; R165-R171 PolarHBondContact NH2-O 3.4Å
166	R	84.8	Confident	74.5	Confident	74 Å²	74	81.1 Å²	81.1	28%	0.279	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	139	172.9	-62.4	176.7	177.4	165.9	4.7	107.7	N129 Y131 I168 D169 H323	N129-R166 WeakPolarHBondContact ND2-CD 3.21Å; N129-R166 PolarHBondContact ND2-NE 2.93Å; Y131-R166 HydrophobicContact CD1-CB 4.33Å; Y131-R166 HydrophobicContact CD1-CG 3.77Å; Y131-R166 HydrophobicContact CE1-CB 4.19Å; Y131-R166 HydrophobicContact CE1-CG 3.18Å; Y131-R166 PolarHBondContact OH-NE 2.66Å; R166-I168 HydrophobicContact CB-CG1 4.25Å; R166-I168 PolarHBondContact O-N 3.42Å; R166-I168 VanDerWaalsContact O-N 3.1Å; R166-D169 HydrophobicContact CB-CB 4.02Å; R166-D169 VanDerWaalsContact O-CB 3.23Å; R166-D169 WeakPolarHBondContact O-CB 3.36Å; R166-D169 PolarHBondContact O-N 2.98Å; R166-H323 PolarHBondContact NH2-NE2 2.96Å
167	I	81.2	Confident	75.6	Confident	21 Å²	21	78.6 Å²	78.6	11%	0.108	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-25	-177.6	-159.3	163.4	0	0	0	113.2	C130 Y132 R165 P200 I227 L231 L234	C130-I167 HydrophobicContact CB-CB 4.37Å; C130-I167 HydrophobicContact CB-CG2 3.81Å; C130-I167 WeakPolarHBondContact O-CG2 3.48Å; C130-I167 PolarHBondContact O-N 2.9Å; Y132-I167 HydrophobicContact CD1-CB 4.32Å; Y132-I167 HydrophobicContact CD1-CG1 4.35Å; R165-I167 PolarHBondContact O-N 3.43Å; I167-P200 HydrophobicContact CD1-CB 4.48Å; I167-I227 HydrophobicContact CD1-CB 4.26Å; I167-I227 HydrophobicContact CD1-CG2 3.69Å; I167-I227 WeakPolarHBondContact CD1-O 3.49Å; I167-I227 HydrophobicContact CG1-CG2 4.01Å; I167-L231 HydrophobicContact CB-CD2 4.36Å; I167-L231 HydrophobicContact CD1-CD2 4.15Å; I167-L231 HydrophobicContact CD1-CG 3.76Å; I167-L231 HydrophobicContact CG1-CD2 3.88Å; I167-L231 HydrophobicContact CG1-CG 3.94Å; I167-L231 HydrophobicContact CG2-CD2 3.69Å; I167-L231 HydrophobicContact CG2-CG 4.44Å; I167-L234 HydrophobicContact CG2-CD1 3.37Å
168	I	77.2	Confident	76.4	Confident	114 Å²	114	70.4 Å²	70.4	59%	0.585	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-6.2	176.1	61.2	170.5	0	0	0	113.4	R166 T170 L231 L234	R166-I168 HydrophobicContact CB-CG1 4.25Å; R166-I168 PolarHBondContact O-N 3.42Å; R166-I168 VanDerWaalsContact O-N 3.1Å; I168-T170 PolarHBondContact O-N 3.26Å; I168-L231 HydrophobicContact CG2-CD2 4.32Å; I168-L234 HydrophobicContact CG2-CD1 4.33Å
169	D	77.7	Confident	77.1	Confident	30 Å²	30	69.5 Å²	69.5	16%	0.16	34%	0.34	C	S	.	.			trans	-78.5	120	-177.3	-168.5	-3.9	0	0	0	110.5	R165 R166 R171	R165-D169 HydrophobicContact CG-CB 3.97Å; R165-D169 PolarHBondContact NE-O 2.8Å; R165-D169 PolarHBondContact NH2-O 3.03Å; R166-D169 HydrophobicContact CB-CB 4.02Å; R166-D169 VanDerWaalsContact O-CB 3.23Å; R166-D169 WeakPolarHBondContact O-CB 3.36Å; R166-D169 PolarHBondContact O-N 2.98Å; D169-R171 VanDerWaalsContact OD1-CB 3.28Å; D169-R171 WeakPolarHBondContact OD1-CB 3.13Å; D169-R171 WeakPolarHBondContact OD1-CG 2.98Å; D169-R171 PolarHBondContact OD1-N 3.03Å; D169-R171 IonicContact OD1-NE 3.14Å; D169-R171 PolarHBondContact OD1-NE 3.28Å; D169-R171 VanDerWaalsContact OD1-NE 3.14Å; D169-R171 IonicContact OD2-CZ 3.19Å; D169-R171 IonicContact OD2-NE 2.85Å; D169-R171 PolarHBondContact OD2-NE 3.43Å; D169-R171 IonicContact OD2-NH2 2.69Å; D169-R171 PolarHBondContact OD2-NH2 3.48Å
170	T	69.7	Low	77.4	Confident	123 Å²	123	70.5 Å²	70.5	76%	0.755	35%	0.346	S	S	*	.			trans	-97.3	0.6	-178.9	55.4	0	0	0	0	113.1	I168 R172	I168-T170 PolarHBondContact O-N 3.26Å; T170-R172 PolarHBondContact O-N 3.22Å
171	R	67.1	Low	77.5	Confident	151 Å²	151	75.7 Å²	75.7	57%	0.57	37%	0.368	S	S	*	.			trans	-58.1	134.3	178.1	-71.3	-178.3	-65.8	168.2	3.8	110.7	R165 D169	R165-R171 PolarHBondContact NE-O 2.78Å; R165-R171 PolarHBondContact NH1-O 3.3Å; R165-R171 PolarHBondContact NH2-O 3.4Å; D169-R171 VanDerWaalsContact OD1-CB 3.28Å; D169-R171 WeakPolarHBondContact OD1-CB 3.13Å; D169-R171 WeakPolarHBondContact OD1-CG 2.98Å; D169-R171 PolarHBondContact OD1-N 3.03Å; D169-R171 IonicContact OD1-NE 3.14Å; D169-R171 PolarHBondContact OD1-NE 3.28Å; D169-R171 VanDerWaalsContact OD1-NE 3.14Å; D169-R171 IonicContact OD2-CZ 3.19Å; D169-R171 IonicContact OD2-NE 2.85Å; D169-R171 PolarHBondContact OD2-NE 3.43Å; D169-R171 IonicContact OD2-NH2 2.69Å; D169-R171 PolarHBondContact OD2-NH2 3.48Å
172	R	64.3	Low	77.5	Confident	226 Å²	226	72 Å²	72	85%	0.853	35%	0.354	S	S	*	.	S	Bend	trans	-91.9	-11.8	176.6	-64.2	-174.8	179.4	-173.6	-1	113.3	T170	T170-R172 PolarHBondContact O-N 3.22Å
173	C	67.3	Low	77.5	Confident	107 Å²	107	74.6 Å²	74.6	72%	0.723	37%	0.368	S	S	*	.			trans	-118.1	134.8	-176.3	-57.1	0	0	0	0	109
174	I	66.4	Low	77.5	Confident	50 Å²	50	78.8 Å²	78.8	26%	0.256	39%	0.391	S	S	.	.			trans	-119.5	130	179.9	-53.9	132.4	0	0	0	105.7	Y163 A178 L179	Y163-I174 HydrophobicContact CD1-CD1 4.21Å; Y163-I174 HydrophobicContact CD1-CG2 4.05Å; Y163-I174 HydrophobicContact CD2-CG1 4.42Å; Y163-I174 HydrophobicContact CD2-CG2 3.73Å; Y163-I174 HydrophobicContact CE1-CB 4.47Å; Y163-I174 HydrophobicContact CE1-CD1 3.27Å; Y163-I174 HydrophobicContact CE1-CG1 3.78Å; Y163-I174 HydrophobicContact CE1-CG2 4.14Å; Y163-I174 HydrophobicContact CE2-CB 4.38Å; Y163-I174 HydrophobicContact CE2-CD1 4.08Å; Y163-I174 HydrophobicContact CE2-CG1 3.64Å; Y163-I174 HydrophobicContact CE2-CG2 3.8Å; Y163-I174 HydrophobicContact CG-CG2 3.87Å; Y163-I174 WeakPolarHBondContact OH-CD1 3.33Å; Y163-I174 VanDerWaalsContact OH-CG1 3.28Å; Y163-I174 WeakPolarHBondContact OH-CG1 3.41Å; I174-A178 HydrophobicContact CG2-CB 4.35Å; I174-L179 HydrophobicContact CG2-CD2 4.32Å
175	P	68.4	Low	77.4	Confident	67 Å²	67	83 Å²	83	44%	0.435	41%	0.411	S	S	.	.			trans	-72	140	178.3	36.4	-37.9	0	0	0	108.9	D177 A178	P175-D177 WeakPolarHBondContact CB-OD1 3.49Å; P175-D177 WeakPolarHBondContact CG-OD1 3.29Å; P175-D177 PolarHBondContact O-N 2.82Å; P175-A178 HydrophobicContact CG-CB 3.99Å; P175-A178 WeakPolarHBondContact O-CB 3.32Å; P175-A178 PolarHBondContact O-N 3.19Å
176	E	69.7	Low	77.7	Confident	163 Å²	163	81.5 Å²	81.5	76%	0.762	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-61.8	-26.3	-174.6	-67.4	-179	176.9	0	0	112.7	A178 L179	E176-A178 PolarHBondContact O-N 3.26Å; E176-L179 VanDerWaalsContact O-CB 3.32Å; E176-L179 WeakPolarHBondContact O-CB 3.41Å; E176-L179 PolarHBondContact O-N 2.98Å; E176-L179 VanDerWaalsContact O-N 3.13Å
177	D	72.1	Confident	77.9	Confident	95 Å²	95	78.1 Å²	78.1	51%	0.508	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-69.9	-16.7	176.6	60.8	-7.6	0	0	0	113.7	P175 L179 Y378	P175-D177 WeakPolarHBondContact CB-OD1 3.49Å; P175-D177 WeakPolarHBondContact CG-OD1 3.29Å; P175-D177 PolarHBondContact O-N 2.82Å; D177-L179 VanDerWaalsContact C-N 3.34Å; D177-Y378 PolarHBondContact OD2-OH 3.29Å
178	A	71.3	Confident	78	Confident	30 Å²	30	80.7 Å²	80.7	25%	0.248	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-85.5	-6.9	172.1	0	0	0	0	0	113.1	Y163 I174 P175 E176	Y163-A178 WeakPolarHBondContact CB-O 2.94Å; I174-A178 HydrophobicContact CG2-CB 4.35Å; P175-A178 HydrophobicContact CG-CB 3.99Å; P175-A178 WeakPolarHBondContact O-CB 3.32Å; P175-A178 PolarHBondContact O-N 3.19Å; E176-A178 PolarHBondContact O-N 3.26Å
179	L	81.5	Confident	78.4	Confident	46 Å²	46	76.2 Å²	76.2	24%	0.241	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-82.1	126.5	-179.4	-64.1	178.1	0	0	0	111.1	V136 Y161 Y163 I174 E176 D177	V136-L179 HydrophobicContact CG2-CD2 3.97Å; Y161-L179 HydrophobicContact CD1-CB 4.21Å; Y163-L179 HydrophobicContact CD1-CD2 3.91Å; Y163-L179 HydrophobicContact CG-CD2 4.35Å; I174-L179 HydrophobicContact CG2-CD2 4.32Å; E176-L179 VanDerWaalsContact O-CB 3.32Å; E176-L179 WeakPolarHBondContact O-CB 3.41Å; E176-L179 PolarHBondContact O-N 2.98Å; E176-L179 VanDerWaalsContact O-N 3.13Å; D177-L179 VanDerWaalsContact C-N 3.34Å
180	I	85.1	Confident	78.7	Confident	47 Å²	47	75.1 Å²	75.1	24%	0.241	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	126.1	177	-63.3	144.4	0	0	0	108.5	Y31 I35 Y161 A162 L182	Y31-I180 HydrophobicContact CE1-CD1 4.38Å; I35-I180 HydrophobicContact CD1-CD1 3.16Å; I35-I180 HydrophobicContact CD1-CG1 4.47Å; I35-I180 HydrophobicContact CG1-CD1 3.9Å; I35-I180 HydrophobicContact CG2-CD1 4.11Å; Y161-I180 CarbonylContact C-O 3.51Å; Y161-I180 VanDerWaalsContact CA-O 3.27Å; Y161-I180 WeakPolarHBondContact CA-O 3.43Å; A162-I180 PolarHBondContact N-O 2.7Å; A162-I180 PolarHBondContact O-N 2.99Å; I180-L182 PolarHBondContact O-N 3.09Å
181	K	88.4	Confident	79.4	Confident	110 Å²	110	73 Å²	73	48%	0.478	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	124.6	175.5	-174	-178.1	178.1	-176.5	0	109.8	H159 Y161	H159-K181 HydrophobicContact CB-CG 4.13Å; H159-K181 WeakPolarHBondContact CD2-CE 3.32Å; H159-K181 PolarHBondContact CD2-NZ 3.08Å; H159-K181 VanDerWaalsContact NE2-CE 3.28Å; H159-K181 WeakPolarHBondContact NE2-CE 3.48Å; H159-K181 PolarHBondContact NE2-NZ 3.26Å; H159-K181 VanDerWaalsContact NE2-NZ 3.18Å; Y161-K181 HydrophobicContact CD1-CB 4.11Å; Y161-K181 HydrophobicContact CE1-CB 3.84Å; Y161-K181 HydrophobicContact CE1-CG 4.09Å
182	L	89.4	Confident	80	Confident	5 Å²	5	74 Å²	74	3%	0.026	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-85.2	150	178.3	-57.6	-176	0	0	0	111.9	L39 F133 H159 C160 A162 I180 I186 L190	L39-L182 HydrophobicContact CD2-CD2 3.68Å; F133-L182 HydrophobicContact CE1-CD1 4.35Å; F133-L182 HydrophobicContact CZ-CD1 4.47Å; F133-L182 HydrophobicContact CZ-CD2 4.03Å; H159-L182 PolarHBondContact ND1-O 2.98Å; C160-L182 HydrophobicContact CB-CB 4.42Å; C160-L182 HydrophobicContact CB-CD1 3.89Å; C160-L182 HydrophobicContact CB-CG 4.44Å; C160-L182 WeakPolarHBondContact O-CB 3.36Å; C160-L182 PolarHBondContact O-N 2.83Å; A162-L182 HydrophobicContact CB-CD1 3.87Å; A162-L182 HydrophobicContact CB-CD2 4.03Å; A162-L182 HydrophobicContact CB-CG 4.1Å; I180-L182 PolarHBondContact O-N 3.09Å; L182-I186 HydrophobicContact CD1-CG2 4.08Å; L182-L190 HydrophobicContact CD1-CD1 3.35Å
183	D	88.8	Confident	80.6	Confident	56 Å²	56	64.6 Å²	64.6	30%	0.299	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-65.5	164.2	173.2	71	51.7	0	0	0	111.7	R43 Q185 I186 T187	R43-D183 IonicContact NE-OD2 3.71Å; D183-Q185 VanDerWaalsContact C-N 3.29Å; D183-Q185 PolarHBondContact O-N 2.91Å; D183-Q185 WeakPolarHBondContact OD1-CA 3.21Å; D183-Q185 WeakPolarHBondContact OD1-CB 3.43Å; D183-Q185 PolarHBondContact OD1-N 3.22Å; D183-I186 WeakPolarHBondContact OD1-CB 3.35Å; D183-I186 WeakPolarHBondContact OD1-CG1 3.34Å; D183-I186 PolarHBondContact OD1-N 2.96Å; D183-I186 WeakPolarHBondContact OD2-CD1 3.42Å; D183-I186 WeakPolarHBondContact OD2-CG1 3.4Å; D183-T187 WeakPolarHBondContact O-CB 3.49Å; D183-T187 PolarHBondContact O-N 3.16Å; D183-T187 PolarHBondContact O-OG1 2.82Å
184	N	86	Confident	81	Confident	96 Å²	96	66.5 Å²	66.5	51%	0.513	33%	0.327	S	S	.	.	H	α-helix	trans	-64.2	-32.8	-176.3	-79	-29.2	0	0	0	113.3	H159 S188	H159-N184 PolarHBondContact CE1-OD1 2.64Å; H159-N184 PolarHBondContact ND1-OD1 3.37Å; N184-S188 VanDerWaalsContact O-CB 3.29Å; N184-S188 WeakPolarHBondContact O-CB 3.46Å; N184-S188 PolarHBondContact O-N 3.37Å; N184-S188 PolarHBondContact O-OG 2.78Å
185	Q	86.6	Confident	81.3	Confident	98 Å²	98	69.8 Å²	69.8	46%	0.458	35%	0.35	S	S	.	.	H	α-helix	trans	-72.1	-52.2	-176.1	178.8	178.1	-11.3	0	0	109.9	S46 S47 D183 T187 S188 W189	S46-Q185 PolarHBondContact OG-NE2 3.1Å; S47-Q185 PolarHBondContact OG-NE2 3Å; D183-Q185 VanDerWaalsContact C-N 3.29Å; D183-Q185 PolarHBondContact O-N 2.91Å; D183-Q185 WeakPolarHBondContact OD1-CA 3.21Å; D183-Q185 WeakPolarHBondContact OD1-CB 3.43Å; D183-Q185 PolarHBondContact OD1-N 3.22Å; Q185-T187 VanDerWaalsContact C-N 3.34Å; Q185-S188 PolarHBondContact O-N 3.22Å; Q185-W189 WeakPolarHBondContact O-CB 3.48Å; Q185-W189 PolarHBondContact O-N 2.86Å
186	I	88.5	Confident	81.7	Confident	2 Å²	2	67.5 Å²	67.5	1%	0.01	33%	0.334	C	S	.	.	H	α-helix	trans	-61.4	-45.3	175.6	-62.2	174.6	0	0	0	109.8	L39 L42 R43 L182 D183 S188 W189 L190	L39-I186 HydrophobicContact CD2-CD1 4.18Å; L42-I186 HydrophobicContact CB-CD1 4.26Å; L42-I186 HydrophobicContact CB-CG1 4.42Å; L42-I186 HydrophobicContact CB-CG2 4.24Å; L42-I186 HydrophobicContact CD1-CG2 4.03Å; R43-I186 HydrophobicContact CG-CD1 3.8Å; R43-I186 HydrophobicContact CG-CG1 4.17Å; L182-I186 HydrophobicContact CD1-CG2 4.08Å; D183-I186 WeakPolarHBondContact OD1-CB 3.35Å; D183-I186 WeakPolarHBondContact OD1-CG1 3.34Å; D183-I186 PolarHBondContact OD1-N 2.96Å; D183-I186 WeakPolarHBondContact OD2-CD1 3.42Å; D183-I186 WeakPolarHBondContact OD2-CG1 3.4Å; I186-S188 PolarHBondContact O-N 3.33Å; I186-W189 PolarHBondContact O-N 3.45Å; I186-L190 HydrophobicContact CG2-CD1 3.55Å; I186-L190 HydrophobicContact CG2-CG 4.04Å; I186-L190 WeakPolarHBondContact O-CB 3.39Å; I186-L190 VanDerWaalsContact O-CG 3.3Å; I186-L190 WeakPolarHBondContact O-CG 3.26Å; I186-L190 PolarHBondContact O-N 3.5Å
187	T	88.3	Confident	82.1	Confident	4 Å²	4	65.7 Å²	65.7	3%	0.025	33%	0.329	C	S	.	.	H	α-helix	trans	-53.8	-53.5	175.9	-70.3	0	0	0	0	111.2	D158 C160 D183 Q185 W189 L190 L191	D158-T187 WeakPolarHBondContact O-CG2 3.15Å; C160-T187 HydrophobicContact CB-CG2 4.15Å; C160-T187 PolarHBondContact N-OG1 3.01Å; D183-T187 WeakPolarHBondContact O-CB 3.49Å; D183-T187 PolarHBondContact O-N 3.16Å; D183-T187 PolarHBondContact O-OG1 2.82Å; Q185-T187 VanDerWaalsContact C-N 3.34Å; T187-W189 VanDerWaalsContact C-N 3.27Å; T187-W189 PolarHBondContact O-N 2.9Å; T187-L190 PolarHBondContact O-N 3.42Å; T187-L191 HydrophobicContact CG2-CD1 3.92Å; T187-L191 HydrophobicContact CG2-CG 4.49Å; T187-L191 WeakPolarHBondContact O-CB 3.5Å; T187-L191 VanDerWaalsContact O-CG 3.29Å; T187-L191 WeakPolarHBondContact O-CG 3.43Å; T187-L191 PolarHBondContact O-N 3.05Å
188	S	83.9	Confident	82.8	Confident	75 Å²	75	62.3 Å²	62.3	52%	0.524	31%	0.309	S	S	.	.	H	α-helix	trans	-61.7	-39.1	-178.2	-59.5	0	0	0	0	111.6	N184 Q185 I186 R192	N184-S188 VanDerWaalsContact O-CB 3.29Å; N184-S188 WeakPolarHBondContact O-CB 3.46Å; N184-S188 PolarHBondContact O-N 3.37Å; N184-S188 PolarHBondContact O-OG 2.78Å; Q185-S188 PolarHBondContact O-N 3.22Å; I186-S188 PolarHBondContact O-N 3.33Å; S188-R192 WeakPolarHBondContact O-CB 3.4Å; S188-R192 PolarHBondContact O-N 3.1Å; S188-R192 VanDerWaalsContact O-N 3.15Å
189	W	84.9	Confident	83.8	Confident	20 Å²	20	61 Å²	61	8%	0.076	30%	0.298	C	S	.	.	H	α-helix	trans	-66.4	-48.9	177.4	-172.7	94	0	0	0	111.7	I45 Y66 Q185 I186 T187 L191 R192 Y193	I45-W189 HydrophobicContact CG2-CH2 3.77Å; I45-W189 HydrophobicContact CG2-CZ2 3.27Å; Y66-W189 AromaticContact CE1-CH2 3.67Å; Y66-W189 HydrophobicContact CE1-CH2 3.67Å; Y66-W189 HydrophobicContact CE1-CZ3 4.22Å; Y66-W189 AromaticContact CZ-CH2 3.65Å; Y66-W189 WeakPolarHBondContact OH-CH2 3.28Å; Y66-W189 WeakPolarHBondContact OH-CZ3 3.36Å; Q185-W189 WeakPolarHBondContact O-CB 3.48Å; Q185-W189 PolarHBondContact O-N 2.86Å; I186-W189 PolarHBondContact O-N 3.45Å; T187-W189 VanDerWaalsContact C-N 3.27Å; T187-W189 PolarHBondContact O-N 2.9Å; W189-L191 VanDerWaalsContact C-N 3.34Å; W189-L191 PolarHBondContact O-N 2.88Å; W189-R192 PolarHBondContact O-N 2.92Å; W189-R192 VanDerWaalsContact O-N 3.15Å; W189-Y193 AromaticContact CD1-CD2 3.64Å; W189-Y193 AromaticContact CD1-CE2 3.62Å; W189-Y193 AromaticContact CD2-CD2 3.7Å; W189-Y193 HydrophobicContact CD2-CD2 3.7Å; W189-Y193 HydrophobicContact CD2-CE2 4.44Å; W189-Y193 AromaticContact CE2-CD2 3.37Å; W189-Y193 AromaticContact CE2-CE2 3.94Å; W189-Y193 HydrophobicContact CE3-CD2 4.43Å; W189-Y193 AromaticContact CG-CD2 3.84Å; W189-Y193 HydrophobicContact CG-CD2 3.84Å; W189-Y193 HydrophobicContact CG-CE2 4.24Å; W189-Y193 AromaticContact CZ2-CD2 3.83Å; W189-Y193 HydrophobicContact CZ2-CD2 3.83Å; W189-Y193 HydrophobicContact CZ2-CG 4.2Å; W189-Y193 AromaticContact NE1-CD2 3.38Å; W189-Y193 AromaticContact NE1-CE2 3.44Å; W189-Y193 VanDerWaalsContact O-CD2 3.24Å; W189-Y193 WeakPolarHBondContact O-CD2 3.4Å; W189-Y193 PolarHBondContact O-N 3.38Å
190	L	85.9	Confident	84.3	Confident	6 Å²	6	58.8 Å²	58.8	3%	0.031	29%	0.287	C	S	.	.	H	α-helix	trans	-61.9	-41.1	179.9	-73.9	170.4	0	0	0	112	V135 L182 I186 T187 R192 Y193 R194	V135-L190 HydrophobicContact CG1-CD1 4.12Å; V135-L190 HydrophobicContact CG2-CD1 3.85Å; V135-L190 HydrophobicContact CG2-CD2 4.26Å; L182-L190 HydrophobicContact CD1-CD1 3.35Å; I186-L190 HydrophobicContact CG2-CD1 3.55Å; I186-L190 HydrophobicContact CG2-CG 4.04Å; I186-L190 WeakPolarHBondContact O-CB 3.39Å; I186-L190 VanDerWaalsContact O-CG 3.3Å; I186-L190 WeakPolarHBondContact O-CG 3.26Å; I186-L190 PolarHBondContact O-N 3.5Å; T187-L190 PolarHBondContact O-N 3.42Å; L190-R192 VanDerWaalsContact C-N 3.33Å; L190-R192 PolarHBondContact O-N 3.02Å; L190-Y193 CarbonylContact O-C 3.48Å; L190-Y193 PolarHBondContact O-N 2.82Å; L190-R194 VanDerWaalsContact O-CA 3.28Å; L190-R194 WeakPolarHBondContact O-CA 3.17Å; L190-R194 PolarHBondContact O-N 2.86Å
191	L	82.7	Confident	84.8	Confident	79 Å²	79	56.6 Å²	56.6	41%	0.414	28%	0.275	S	S	.	.	H	α-helix	trans	-62.9	-40.6	175.5	-70.2	175	0	0	0	111.7	T137 T187 W189	T137-L191 HydrophobicContact CG2-CD2 3.58Å; T187-L191 HydrophobicContact CG2-CD1 3.92Å; T187-L191 HydrophobicContact CG2-CG 4.49Å; T187-L191 WeakPolarHBondContact O-CB 3.5Å; T187-L191 VanDerWaalsContact O-CG 3.29Å; T187-L191 WeakPolarHBondContact O-CG 3.43Å; T187-L191 PolarHBondContact O-N 3.05Å; W189-L191 VanDerWaalsContact C-N 3.34Å; W189-L191 PolarHBondContact O-N 2.88Å
192	R	80	Confident	85.1	Confident	172 Å²	172	51.3 Å²	51.3	65%	0.649	25%	0.252	S	S	*	.	H	α-helix	trans	-68.6	-34.9	177.3	-172.3	174.6	-175.6	176.7	-0.7	112.6	S188 W189 L190	S188-R192 WeakPolarHBondContact O-CB 3.4Å; S188-R192 PolarHBondContact O-N 3.1Å; S188-R192 VanDerWaalsContact O-N 3.15Å; W189-R192 PolarHBondContact O-N 2.92Å; W189-R192 VanDerWaalsContact O-N 3.15Å; L190-R192 VanDerWaalsContact C-N 3.33Å; L190-R192 PolarHBondContact O-N 3.02Å
193	Y	77.4	Confident	85.3	Confident	28 Å²	28	51.6 Å²	51.6	11%	0.11	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	35.3	-173.6	-59.5	-64.3	0	0	0	113	T51 L64 W189 L190 T195 V196	T51-Y193 HydrophobicContact CG2-CE2 4.05Å; L64-Y193 HydrophobicContact CD1-CD1 3.54Å; L64-Y193 HydrophobicContact CD1-CE1 3Å; L64-Y193 HydrophobicContact CD1-CE2 4.47Å; L64-Y193 HydrophobicContact CD1-CG 4.46Å; L64-Y193 HydrophobicContact CG-CE1 4.46Å; W189-Y193 AromaticContact CD1-CD2 3.64Å; W189-Y193 AromaticContact CD1-CE2 3.62Å; W189-Y193 AromaticContact CD2-CD2 3.7Å; W189-Y193 HydrophobicContact CD2-CD2 3.7Å; W189-Y193 HydrophobicContact CD2-CE2 4.44Å; W189-Y193 AromaticContact CE2-CD2 3.37Å; W189-Y193 AromaticContact CE2-CE2 3.94Å; W189-Y193 HydrophobicContact CE3-CD2 4.43Å; W189-Y193 AromaticContact CG-CD2 3.84Å; W189-Y193 HydrophobicContact CG-CD2 3.84Å; W189-Y193 HydrophobicContact CG-CE2 4.24Å; W189-Y193 AromaticContact CZ2-CD2 3.83Å; W189-Y193 HydrophobicContact CZ2-CD2 3.83Å; W189-Y193 HydrophobicContact CZ2-CG 4.2Å; W189-Y193 AromaticContact NE1-CD2 3.38Å; W189-Y193 AromaticContact NE1-CE2 3.44Å; W189-Y193 VanDerWaalsContact O-CD2 3.24Å; W189-Y193 WeakPolarHBondContact O-CD2 3.4Å; W189-Y193 PolarHBondContact O-N 3.38Å; L190-Y193 CarbonylContact O-C 3.48Å; L190-Y193 PolarHBondContact O-N 2.82Å; Y193-T195 PolarHBondContact O-N 3.36Å; Y193-V196 WeakPolarHBondContact O-CB 3.42Å; Y193-V196 WeakPolarHBondContact O-CG2 3.05Å; Y193-V196 PolarHBondContact O-N 2.79Å
194	R	75.8	Confident	85.3	Confident	147 Å²	147	49 Å²	49	56%	0.555	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-26.6	-175.2	68.2	-178.7	-178.2	164.4	0.7	115.3	L190 V196	L190-R194 VanDerWaalsContact O-CA 3.28Å; L190-R194 WeakPolarHBondContact O-CA 3.17Å; L190-R194 PolarHBondContact O-N 2.86Å; R194-V196 VanDerWaalsContact C-N 3.35Å
195	T	72.9	Confident	85.4	Confident	120 Å²	120	44.4 Å²	44.4	74%	0.736	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-6.3	-177.7	58.2	0	0	0	0	113.4	Y193 L197	Y193-T195 PolarHBondContact O-N 3.36Å; T195-L197 PolarHBondContact O-N 2.98Å
196	V	75.5	Confident	85.3	Confident	19 Å²	19	39.7 Å²	39.7	12%	0.115	19%	0.193	C	C	.	.	S	Bend	trans	-80.1	118.1	-179.4	-172.3	0	0	0	0	108.4	L64 Y66 Y193 R194 R198	L64-V196 HydrophobicContact CB-CG2 4.45Å; L64-V196 WeakPolarHBondContact O-CG1 3.48Å; Y66-V196 HydrophobicContact CD2-CG1 3.48Å; Y66-V196 VanDerWaalsContact CD2-CG1 3.48Å; Y66-V196 HydrophobicContact CE2-CB 4.06Å; Y66-V196 HydrophobicContact CE2-CG1 3.31Å; Y66-V196 HydrophobicContact CG-CG1 4.44Å; Y193-V196 WeakPolarHBondContact O-CB 3.42Å; Y193-V196 WeakPolarHBondContact O-CG2 3.05Å; Y193-V196 PolarHBondContact O-N 2.79Å; R194-V196 VanDerWaalsContact C-N 3.35Å; V196-R198 PolarHBondContact O-N 3Å
197	L	80.1	Confident	84.9	Confident	124 Å²	124	41 Å²	41	65%	0.649	20%	0.201	S	C	*	.	P	Polyproline II helix	trans	-64.4	120.5	179.3	-68	176.4	0	0	0	110.3	Y66 T195	Y66-L197 WeakPolarHBondContact CD2-O 3.36Å; Y66-L197 WeakPolarHBondContact CE2-O 3.46Å; T195-L197 PolarHBondContact O-N 2.98Å
198	R	86.6	Confident	84.4	Confident	25 Å²	25	44.4 Å²	44.4	9%	0.094	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-75	132	-177.8	-76.2	170.7	-65.3	-73.9	-5.7	110.7	Y38 Y66 F133 V196 P497	Y38-R198 WeakPolarHBondContact OH-CB 3.48Å; Y66-R198 HydrophobicContact CE2-CB 4.42Å; Y66-R198 HydrophobicContact CE2-CG 4.03Å; Y66-R198 WeakPolarHBondContact OH-CG 3.36Å; F133-R198 PolarHBondContact O-NE 3.26Å; V196-R198 PolarHBondContact O-N 3Å; R198-P497 PolarHBondContact NH2-O 3.31Å; R198-P497 PolarHBondContact NH2-OXT 2.96Å
199	P	91.1	Very high	84.1	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.013	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-67	135.9	179.8	26.2	-32.8	0	0	0	109.7	Y38 F41 Y66 M70 L223 A224	Y38-P199 WeakPolarHBondContact CE2-O 3.26Å; Y38-P199 PolarHBondContact OH-O 3.21Å; F41-P199 HydrophobicContact CE1-CG 3.57Å; F41-P199 HydrophobicContact CZ-CG 3.53Å; Y66-P199 HydrophobicContact CG-CG 4.23Å; M70-P199 HydrophobicContact SD-CB 4.12Å; M70-P199 HydrophobicContact SD-CG 4.26Å; P199-L223 HydrophobicContact CB-CB 4.29Å; P199-L223 HydrophobicContact CB-CD2 4.31Å; P199-L223 HydrophobicContact CG-CD1 4.06Å; P199-L223 HydrophobicContact CG-CD2 4.2Å; P199-A224 WeakPolarHBondContact CB-O 3.38Å
200	P	93.2	Very high	83.5	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-71.3	142.9	175	30	-36.5	0	0	0	111.2	Y131 I167 L223 A224 D226	Y131-P200 CarbonylContact O-C 3.52Å; Y131-P200 VanDerWaalsContact O-CA 3.31Å; Y131-P200 WeakPolarHBondContact O-CA 3.34Å; I167-P200 HydrophobicContact CD1-CB 4.48Å; P200-L223 WeakPolarHBondContact O-CA 3.3Å; P200-A224 WeakPolarHBondContact CD-O 3.34Å; P200-A224 HydrophobicContact CG-CB 3.79Å; P200-A224 PolarHBondContact O-N 3.31Å; P200-D226 VanDerWaalsContact CG-O 3.22Å; P200-D226 WeakPolarHBondContact CG-O 3.37Å
201	L	94.8	Very high	83	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	121.8	176.3	-179.5	146.6	0	0	0	109.5	L34 Y38 C130 Y131 F164 Y203 V221 F222 L223	L34-L201 HydrophobicContact CB-CD2 4.27Å; L34-L201 HydrophobicContact CD1-CD2 4.34Å; L34-L201 HydrophobicContact CD2-CD2 4.04Å; L34-L201 HydrophobicContact CG-CD2 4.41Å; Y38-L201 HydrophobicContact CD2-CB 3.99Å; Y38-L201 HydrophobicContact CD2-CD1 3.8Å; Y38-L201 HydrophobicContact CE2-CB 4.22Å; Y38-L201 HydrophobicContact CG-CD1 4.48Å; C130-L201 CarbonylContact C-O 3.52Å; C130-L201 WeakPolarHBondContact CA-O 3.26Å; Y131-L201 HydrophobicContact CD2-CD2 4.42Å; Y131-L201 PolarHBondContact N-O 2.71Å; Y131-L201 PolarHBondContact O-N 2.73Å; F164-L201 HydrophobicContact CE1-CB 4.34Å; F164-L201 HydrophobicContact CZ-CB 4.43Å; F164-L201 HydrophobicContact CZ-CD1 3.98Å; L201-Y203 HydrophobicContact CD2-CD1 4.35Å; L201-V221 HydrophobicContact CD1-CG1 3.66Å; L201-V221 HydrophobicContact CD2-CG1 4.13Å; L201-V221 HydrophobicContact CG-CG1 3.84Å; L201-F222 CarbonylContact C-O 3.48Å; L201-F222 WeakPolarHBondContact CA-O 3.24Å; L201-L223 HydrophobicContact CB-CD2 4.13Å
202	I	94.6	Very high	82.5	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	135.9	173.6	-57.9	165.2	0	0	0	107	L11 C130 F222 A224 V233 F237	L11-I202 HydrophobicContact CD1-CD1 4.09Å; L11-I202 HydrophobicContact CD2-CD1 3.84Å; C130-I202 HydrophobicContact CB-CG1 4.25Å; I202-F222 HydrophobicContact CB-CB 4.45Å; I202-F222 PolarHBondContact N-O 3.36Å; I202-F222 PolarHBondContact O-N 3.14Å; I202-A224 HydrophobicContact CD1-CB 3.67Å; I202-A224 HydrophobicContact CG1-CB 4.42Å; I202-V233 HydrophobicContact CD1-CB 4.07Å; I202-V233 HydrophobicContact CD1-CG1 4.17Å; I202-V233 HydrophobicContact CD1-CG2 4Å; I202-V233 HydrophobicContact CG2-CG1 3.9Å; I202-F237 HydrophobicContact CG2-CE2 4.32Å
203	Y	93.3	Very high	82.3	Confident	11 Å²	11	46 Å²	46	4%	0.043	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	156.4	167.6	80.4	-76.8	0	0	0	111.1	I30 L34 F128 N129 Y131 L201 M205 Y220	I30-Y203 HydrophobicContact CG2-CE2 4.16Å; L34-Y203 HydrophobicContact CD1-CD1 3.51Å; L34-Y203 HydrophobicContact CD1-CD2 4.26Å; L34-Y203 HydrophobicContact CD1-CE1 3.57Å; L34-Y203 HydrophobicContact CD1-CE2 4.31Å; L34-Y203 HydrophobicContact CD1-CG 3.86Å; L34-Y203 HydrophobicContact CD2-CD1 4.19Å; L34-Y203 HydrophobicContact CD2-CD2 4.29Å; L34-Y203 HydrophobicContact CD2-CG 3.81Å; L34-Y203 HydrophobicContact CG-CG 4.5Å; F128-Y203 WeakPolarHBondContact CA-O 3.46Å; N129-Y203 HydrophobicContact CB-CD1 4.11Å; N129-Y203 HydrophobicContact CB-CE1 3.28Å; N129-Y203 PolarHBondContact N-O 2.96Å; N129-Y203 PolarHBondContact O-N 2.86Å; Y131-Y203 HydrophobicContact CD2-CD1 4.23Å; Y131-Y203 AromaticContact CD2-CE1 3.94Å; Y131-Y203 HydrophobicContact CD2-CE1 3.94Å; Y131-Y203 HydrophobicContact CE2-CD1 4.16Å; Y131-Y203 AromaticContact CE2-CE1 3.44Å; Y131-Y203 HydrophobicContact CE2-CE1 3.44Å; Y131-Y203 VanDerWaalsContact CE2-CE1 3.44Å; L201-Y203 HydrophobicContact CD2-CD1 4.35Å; Y203-M205 HydrophobicContact CD2-CE 3.87Å; Y203-M205 HydrophobicContact CD2-CG 4.38Å; Y203-M205 HydrophobicContact CE2-CE 3.63Å; Y203-M205 HydrophobicContact CE2-CG 4.42Å; Y203-M205 HydrophobicContact CE2-SD 4.21Å; Y203-Y220 CarbonylContact C-O 3.44Å; Y203-Y220 WeakPolarHBondContact CA-O 3.22Å; Y203-Y220 VanDerWaalsContact CB-O 3.31Å; Y203-Y220 WeakPolarHBondContact CB-O 3.42Å
204	F	90.1	Very high	82	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	160.4	166.8	71	-95.1	0	0	0	111.6	L79 I86 I88 F120 L125 Y127 F128 V206 C219 Y220 F222 F237	L79-F204 HydrophobicContact CD1-CE1 4.19Å; I86-F204 HydrophobicContact CG2-CZ 4.18Å; I88-F204 HydrophobicContact CD1-CE1 4.35Å; I88-F204 HydrophobicContact CD1-CZ 3.85Å; I88-F204 HydrophobicContact CG1-CZ 4.32Å; F120-F204 HydrophobicContact CD2-CE2 4.08Å; F120-F204 HydrophobicContact CD2-CZ 4.22Å; F120-F204 AromaticContact CE2-CE2 3.95Å; F120-F204 HydrophobicContact CE2-CE2 3.95Å; F120-F204 AromaticContact CE2-CZ 3.93Å; F120-F204 HydrophobicContact CE2-CZ 3.93Å; L125-F204 HydrophobicContact CD1-CB 3.68Å; L125-F204 HydrophobicContact CD1-CD2 3.95Å; L125-F204 HydrophobicContact CD1-CG 4.12Å; Y127-F204 CarbonylContact O-C 3.48Å; Y127-F204 WeakPolarHBondContact O-CA 3.38Å; Y127-F204 WeakPolarHBondContact O-CB 3.32Å; F128-F204 HydrophobicContact CB-CB 3.78Å; F204-V206 HydrophobicContact CD2-CG1 3.92Å; F204-V206 HydrophobicContact CE2-CG1 3.82Å; F204-C219 WeakPolarHBondContact O-CA 3.41Å; F204-Y220 HydrophobicContact CD2-CD2 4.4Å; F204-Y220 AromaticContact CE2-CD2 3.83Å; F204-Y220 HydrophobicContact CE2-CD2 3.83Å; F204-Y220 HydrophobicContact CE2-CG 4.24Å; F204-Y220 HydrophobicContact CZ-CD2 4.14Å; F204-Y220 HydrophobicContact CZ-CG 4.1Å; F204-Y220 PolarHBondContact N-O 2.85Å; F204-Y220 PolarHBondContact O-N 2.89Å; F204-F222 AromaticContact CD1-CE2 3.79Å; F204-F222 HydrophobicContact CD1-CE2 3.79Å; F204-F222 HydrophobicContact CE1-CD2 4.47Å; F204-F222 AromaticContact CE1-CE2 3.4Å; F204-F222 HydrophobicContact CE1-CE2 3.4Å; F204-F222 AromaticContact CE1-CZ 3.83Å; F204-F222 HydrophobicContact CE1-CZ 3.83Å; F204-F222 HydrophobicContact CZ-CE2 4.39Å; F204-F237 HydrophobicContact CB-CE2 4.27Å; F204-F237 HydrophobicContact CB-CZ 4.24Å; F204-F237 HydrophobicContact CD1-CE1 4.44Å; F204-F237 HydrophobicContact CD1-CE2 4.1Å; F204-F237 AromaticContact CD1-CZ 3.56Å; F204-F237 HydrophobicContact CD1-CZ 3.56Å; F204-F237 HydrophobicContact CE1-CZ 4.06Å; F204-F237 HydrophobicContact CG-CE2 4.5Å; F204-F237 HydrophobicContact CG-CZ 4.03Å
205	M	87.2	Confident	81.8	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	137.2	-176.1	-69.1	170.5	178.9	0	0	111.7	I19 I30 I126 Y127 Y203 T218 C219	I19-M205 HydrophobicContact CD1-CE 4.1Å; I30-M205 HydrophobicContact CB-CE 4.03Å; I30-M205 HydrophobicContact CD1-CE 3.38Å; I30-M205 HydrophobicContact CD1-SD 3.63Å; I30-M205 HydrophobicContact CG1-CE 3.35Å; I30-M205 HydrophobicContact CG1-SD 4.26Å; I30-M205 HydrophobicContact CG2-CE 3.49Å; I30-M205 VanDerWaalsContact CG2-CE 3.49Å; I126-M205 PolarHBondContact N-O 2.9Å; Y127-M205 HydrophobicContact CD2-SD 4.01Å; Y127-M205 HydrophobicContact CG-SD 4.47Å; Y127-M205 PolarHBondContact O-N 3.42Å; Y203-M205 HydrophobicContact CD2-CE 3.87Å; Y203-M205 HydrophobicContact CD2-CG 4.38Å; Y203-M205 HydrophobicContact CE2-CE 3.63Å; Y203-M205 HydrophobicContact CE2-CG 4.42Å; Y203-M205 HydrophobicContact CE2-SD 4.21Å; M205-T218 VanDerWaalsContact CA-O 3.3Å; M205-T218 WeakPolarHBondContact CA-O 3.31Å; M205-C219 HydrophobicContact CE-CB 3.73Å; M205-C219 WeakPolarHBondContact CE-SG 3.22Å; M205-C219 HydrophobicContact CG-CB 4.02Å
206	V	83.8	Confident	81.9	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	144.5	177.4	-62.6	0	0	0	0	110.1	F120 Q124 F204 R208 T218 Y220	F120-V206 HydrophobicContact CD1-CB 4.21Å; F120-V206 HydrophobicContact CD1-CG1 3.91Å; F120-V206 HydrophobicContact CD1-CG2 4.06Å; F120-V206 HydrophobicContact CE1-CB 4.32Å; F120-V206 HydrophobicContact CE1-CG1 4.25Å; F120-V206 HydrophobicContact CE1-CG2 3.66Å; F120-V206 HydrophobicContact CG-CG1 4.09Å; F120-V206 HydrophobicContact CZ-CG2 4.22Å; Q124-V206 WeakPolarHBondContact O-CA 3.1Å; F204-V206 HydrophobicContact CD2-CG1 3.92Å; F204-V206 HydrophobicContact CE2-CG1 3.82Å; V206-R208 HydrophobicContact CG2-CG 4.47Å; V206-T218 PolarHBondContact N-O 3.05Å; V206-T218 PolarHBondContact O-N 3.23Å; V206-Y220 HydrophobicContact CG2-CD2 4.16Å; V206-Y220 HydrophobicContact CG2-CE2 3.61Å
207	P	80	Confident	82.1	Confident	30 Å²	30	43.2 Å²	43.2	20%	0.195	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	138	172.8	31.3	-31	0	0	0	109.6	Q124 I126 C216 L217	Q124-P207 WeakPolarHBondContact O-CD 3.31Å; I126-P207 HydrophobicContact CD1-CB 3.9Å; I126-P207 HydrophobicContact CD1-CG 3.84Å; I126-P207 HydrophobicContact CG1-CG 4.5Å; P207-C216 WeakPolarHBondContact CA-O 3.45Å; P207-L217 HydrophobicContact CB-CD2 4.42Å
208	R	79.6	Confident	82.4	Confident	74 Å²	74	37.4 Å²	37.4	28%	0.279	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	164.9	172.3	-74.3	-158.1	166.6	-169.9	-13.1	110.6	E118 V206 C216 T218 Y220	E118-R208 IonicContact OE1-CZ 2.74Å; E118-R208 VanDerWaalsContact OE1-CZ 3.26Å; E118-R208 IonicContact OE1-NH1 3.27Å; E118-R208 PolarHBondContact OE1-NH1 3.28Å; E118-R208 IonicContact OE1-NH2 3.93Å; E118-R208 PolarHBondContact OE1-NH2 2.98Å; E118-R208 IonicContact OE2-CZ 3.53Å; E118-R208 IonicContact OE2-NH1 3.98Å; E118-R208 IonicContact OE2-NH2 2.9Å; E118-R208 PolarHBondContact OE2-NH2 2.75Å; V206-R208 HydrophobicContact CG2-CG 4.47Å; R208-C216 PolarHBondContact N-O 3.45Å; R208-C216 PolarHBondContact O-N 2.11Å; R208-C216 VanDerWaalsContact O-O 3.09Å; R208-C216 PolarHBondContact O-SG 3.49Å; R208-C216 VanDerWaalsContact O-SG 3.36Å; R208-T218 WeakPolarHBondContact CD-OG1 3.41Å; R208-Y220 PolarHBondContact NH1-OH 3.12Å; R208-Y220 VanDerWaalsContact NH1-OH 3.13Å; R208-Y220 PolarHBondContact NH2-OH 3.3Å; R208-Y220 VanDerWaalsContact NH2-OH 3.16Å
209	L	76.3	Confident	82.5	Confident	75 Å²	75	36.2 Å²	36.2	39%	0.393	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	130.8	161.2	-68.4	172.7	0	0	0	108	E214 N215 L254	L209-E214 WeakPolarHBondContact CA-O 3.13Å; L209-N215 WeakPolarHBondContact CD2-OD1 3.46Å; L209-L254 HydrophobicContact CD1-CB 4.15Å; L209-L254 HydrophobicContact CD1-CD1 4.28Å; L209-L254 HydrophobicContact CD1-CD2 3.84Å; L209-L254 HydrophobicContact CD1-CG 4.29Å; L209-L254 HydrophobicContact CD2-CB 4.15Å; L209-L254 HydrophobicContact CD2-CD1 4.34Å; L209-L254 HydrophobicContact CG-CB 4.4Å; L209-L254 HydrophobicContact CG-CD1 4.03Å; L209-L254 HydrophobicContact CG-CD2 4.49Å
210	S	72.9	Confident	82.6	Confident	20 Å²	20	36.1 Å²	36.1	14%	0.14	21%	0.214	C	C	.	.			trans	-65.5	166.8	168.6	77	0	0	0	0	110	N212 G213 E214	S210-N212 PolarHBondContact O-N 2.83Å; S210-N212 PolarHBondContact OG-N 3.32Å; S210-G213 PolarHBondContact O-N 2.96Å; S210-E214 PolarHBondContact N-O 3.28Å; S210-E214 PolarHBondContact OG-N 3.23Å; S210-E214 PolarHBondContact OG-O 2.77Å
211	A	74	Confident	82.6	Confident	111 Å²	111	36.1 Å²	36.1	92%	0.917	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-24.4	173.7	0	0	0	0	0	113	G213	A211-G213 VanDerWaalsContact C-N 3.33Å
212	N	73.9	Confident	82.6	Confident	131 Å²	131	36.1 Å²	36.1	70%	0.701	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.8	4.8	179.4	-60	-2.1	0	0	0	112.8	S210 E214	S210-N212 PolarHBondContact O-N 2.83Å; S210-N212 PolarHBondContact OG-N 3.32Å; N212-E214 VanDerWaalsContact C-N 3.27Å; N212-E214 PolarHBondContact O-N 3.2Å
213	G	74.5	Confident	82.6	Confident	50 Å²	50	36.2 Å²	36.2	52%	0.515	21%	0.214	S	C	.	.	S	Bend	trans	77	9.2	-178	0	0	0	0	0	114.6	S210 A211	S210-G213 PolarHBondContact O-N 2.96Å; A211-G213 VanDerWaalsContact C-N 3.33Å
214	E	72.6	Confident	82.6	Confident	108 Å²	108	35.7 Å²	35.7	51%	0.505	21%	0.212	S	C	.	.			trans	-84.2	141.7	176.5	-61.9	-179.6	154.2	0	0	110.7	L209 S210 N212 C216	L209-E214 WeakPolarHBondContact CA-O 3.13Å; S210-E214 PolarHBondContact N-O 3.28Å; S210-E214 PolarHBondContact OG-N 3.23Å; S210-E214 PolarHBondContact OG-O 2.77Å; N212-E214 VanDerWaalsContact C-N 3.27Å; N212-E214 PolarHBondContact O-N 3.2Å; E214-C216 PolarHBondContact O-N 3.47Å
215	N	70.1	Confident	82.5	Confident	114 Å²	114	39.8 Å²	39.8	61%	0.61	23%	0.231	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-65.5	125.3	173.4	-69.1	-39.6	0	0	0	110.1	L209	L209-N215 WeakPolarHBondContact CD2-OD1 3.46Å
216	C	75	Confident	82.5	Confident	8 Å²	8	43.2 Å²	43.2	5%	0.054	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	164.8	175.3	63.4	0	0	0	0	110.9	T18 P207 R208 E214	T18-C216 HydrophobicContact CG2-CB 3.51Å; T18-C216 WeakPolarHBondContact CG2-SG 3.48Å; P207-C216 WeakPolarHBondContact CA-O 3.45Å; R208-C216 PolarHBondContact N-O 3.45Å; R208-C216 PolarHBondContact O-N 2.11Å; R208-C216 VanDerWaalsContact O-O 3.09Å; R208-C216 PolarHBondContact O-SG 3.49Å; R208-C216 VanDerWaalsContact O-SG 3.36Å; E214-C216 PolarHBondContact O-N 3.47Å
217	L	80.4	Confident	82.7	Confident	24 Å²	24	46.9 Å²	46.9	13%	0.126	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	125	172	-66.4	175.3	0	0	0	108.7	T18 I19 I126 P207	T18-L217 CarbonylContact C-O 3.49Å; I19-L217 HydrophobicContact CB-CB 4.4Å; I19-L217 PolarHBondContact N-O 3.46Å; I19-L217 PolarHBondContact O-N 3.44Å; I126-L217 HydrophobicContact CD1-CD2 3.53Å; P207-L217 HydrophobicContact CB-CD2 4.42Å
218	T	86.1	Confident	83.2	Confident	3 Å²	3	51.1 Å²	51.1	2%	0.018	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	120.4	171.7	-60	0	0	0	0	109.2	H16 S17 M205 V206 R208 Y220	H16-T218 HydrophobicContact CB-CG2 3.98Å; S17-T218 WeakPolarHBondContact O-CA 3.36Å; M205-T218 VanDerWaalsContact CA-O 3.3Å; M205-T218 WeakPolarHBondContact CA-O 3.31Å; V206-T218 PolarHBondContact N-O 3.05Å; V206-T218 PolarHBondContact O-N 3.23Å; R208-T218 WeakPolarHBondContact CD-OG1 3.41Å; T218-Y220 HydrophobicContact CG2-CD2 3.97Å; T218-Y220 HydrophobicContact CG2-CE2 3.4Å
219	C	88.3	Confident	83.8	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	115.8	174.5	-177.8	0	0	0	0	109.4	H16 S17 I19 L33 F204 M205	H16-C219 CarbonylContact C-O 3.57Å; H16-C219 WeakPolarHBondContact CA-O 3.4Å; H16-C219 VanDerWaalsContact CB-O 3.3Å; H16-C219 WeakPolarHBondContact CB-O 3.42Å; S17-C219 PolarHBondContact N-O 2.89Å; S17-C219 PolarHBondContact O-N 3.36Å; I19-C219 HydrophobicContact CD1-CB 4.36Å; L33-C219 HydrophobicContact CD2-CB 4.18Å; F204-C219 WeakPolarHBondContact O-CA 3.41Å; M205-C219 HydrophobicContact CE-CB 3.73Å; M205-C219 WeakPolarHBondContact CE-SG 3.22Å; M205-C219 HydrophobicContact CG-CB 4.02Å
220	Y	93	Very high	84.5	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	132.2	173.7	-69.3	-94.7	0	0	0	109.8	Y13 H16 I88 V116 E118 F120 Y203 F204 V206 R208 T218 F222	Y13-Y220 HydrophobicContact CE2-CD1 4.16Å; H16-Y220 HydrophobicContact CB-CD1 3.9Å; H16-Y220 HydrophobicContact CB-CE1 4.07Å; H16-Y220 HydrophobicContact CB-CG 4.27Å; I88-Y220 HydrophobicContact CD1-CD1 3.69Å; I88-Y220 HydrophobicContact CD1-CE1 3.98Å; I88-Y220 HydrophobicContact CD1-CG 4.23Å; V116-Y220 HydrophobicContact CG1-CE1 4.37Å; E118-Y220 HydrophobicContact CG-CE1 4.32Å; E118-Y220 PolarHBondContact OE1-OH 2.72Å; F120-Y220 HydrophobicContact CE1-CE2 4.19Å; F120-Y220 HydrophobicContact CE2-CE2 4.36Å; F120-Y220 HydrophobicContact CZ-CD2 4.37Å; F120-Y220 HydrophobicContact CZ-CE1 4.33Å; F120-Y220 AromaticContact CZ-CE2 3.58Å; F120-Y220 HydrophobicContact CZ-CE2 3.58Å; F120-Y220 AromaticContact CZ-CZ 3.57Å; Y203-Y220 CarbonylContact C-O 3.44Å; Y203-Y220 WeakPolarHBondContact CA-O 3.22Å; Y203-Y220 VanDerWaalsContact CB-O 3.31Å; Y203-Y220 WeakPolarHBondContact CB-O 3.42Å; F204-Y220 HydrophobicContact CD2-CD2 4.4Å; F204-Y220 AromaticContact CE2-CD2 3.83Å; F204-Y220 HydrophobicContact CE2-CD2 3.83Å; F204-Y220 HydrophobicContact CE2-CG 4.24Å; F204-Y220 HydrophobicContact CZ-CD2 4.14Å; F204-Y220 HydrophobicContact CZ-CG 4.1Å; F204-Y220 PolarHBondContact N-O 2.85Å; F204-Y220 PolarHBondContact O-N 2.89Å; V206-Y220 HydrophobicContact CG2-CD2 4.16Å; V206-Y220 HydrophobicContact CG2-CE2 3.61Å; R208-Y220 PolarHBondContact NH1-OH 3.12Å; R208-Y220 VanDerWaalsContact NH1-OH 3.13Å; R208-Y220 PolarHBondContact NH2-OH 3.3Å; R208-Y220 VanDerWaalsContact NH2-OH 3.16Å; T218-Y220 HydrophobicContact CG2-CD2 3.97Å; T218-Y220 HydrophobicContact CG2-CE2 3.4Å; Y220-F222 HydrophobicContact CD1-CZ 4.49Å
221	V	94.4	Very high	85.4	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	133.1	-173.6	-171.1	0	0	0	0	110.6	L14 G15 L34 Y37 L201	L14-V221 HydrophobicContact CB-CB 4.31Å; L14-V221 HydrophobicContact CB-CG1 4.19Å; L14-V221 HydrophobicContact CD2-CG1 4.29Å; L14-V221 PolarHBondContact N-O 3Å; G15-V221 PolarHBondContact O-N 3.35Å; L34-V221 HydrophobicContact CD2-CG1 4.27Å; L34-V221 HydrophobicContact CD2-CG2 3.65Å; Y37-V221 HydrophobicContact CD2-CB 4.31Å; Y37-V221 HydrophobicContact CD2-CG1 4.39Å; Y37-V221 HydrophobicContact CD2-CG2 3.79Å; Y37-V221 HydrophobicContact CE2-CB 4.5Å; Y37-V221 HydrophobicContact CE2-CG2 3.82Å; Y37-V221 HydrophobicContact CG-CB 4.45Å; Y37-V221 HydrophobicContact CG-CG1 4.3Å; Y37-V221 HydrophobicContact CG-CG2 4.42Å; L201-V221 HydrophobicContact CD1-CG1 3.66Å; L201-V221 HydrophobicContact CD2-CG1 4.13Å; L201-V221 HydrophobicContact CG-CG1 3.84Å
222	F	95.1	Very high	86.3	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	157.4	-177	-48.3	-95.2	0	0	0	111	L11 S12 Y13 V77 I88 L201 I202 F204 Y220	L11-F222 HydrophobicContact CB-CB 4.11Å; L11-F222 HydrophobicContact CB-CD1 4.31Å; L11-F222 HydrophobicContact CD1-CB 4.01Å; L11-F222 HydrophobicContact CD1-CD1 4.36Å; L11-F222 HydrophobicContact CD1-CG 4.11Å; S12-F222 CarbonylContact O-C 3.56Å; S12-F222 WeakPolarHBondContact O-CA 3.47Å; Y13-F222 AromaticContact CD2-CD1 3.67Å; Y13-F222 HydrophobicContact CD2-CD1 3.67Å; Y13-F222 AromaticContact CD2-CE1 3.37Å; Y13-F222 HydrophobicContact CD2-CE1 3.37Å; Y13-F222 HydrophobicContact CD2-CZ 4.05Å; Y13-F222 AromaticContact CE2-CE1 3.95Å; Y13-F222 HydrophobicContact CE2-CE1 3.95Å; Y13-F222 HydrophobicContact CE2-CZ 4.18Å; Y13-F222 HydrophobicContact CG-CD1 4.49Å; Y13-F222 HydrophobicContact CG-CE1 4.33Å; V77-F222 HydrophobicContact CG2-CD1 3.75Å; V77-F222 HydrophobicContact CG2-CE1 3.8Å; I88-F222 HydrophobicContact CD1-CE1 4.38Å; I88-F222 HydrophobicContact CD1-CZ 3.72Å; I88-F222 HydrophobicContact CG1-CZ 4.24Å; I88-F222 HydrophobicContact CG2-CE1 4.37Å; L201-F222 CarbonylContact C-O 3.48Å; L201-F222 WeakPolarHBondContact CA-O 3.24Å; I202-F222 HydrophobicContact CB-CB 4.45Å; I202-F222 PolarHBondContact N-O 3.36Å; I202-F222 PolarHBondContact O-N 3.14Å; F204-F222 AromaticContact CD1-CE2 3.79Å; F204-F222 HydrophobicContact CD1-CE2 3.79Å; F204-F222 HydrophobicContact CE1-CD2 4.47Å; F204-F222 AromaticContact CE1-CE2 3.4Å; F204-F222 HydrophobicContact CE1-CE2 3.4Å; F204-F222 AromaticContact CE1-CZ 3.83Å; F204-F222 HydrophobicContact CE1-CZ 3.83Å; F204-F222 HydrophobicContact CZ-CE2 4.39Å; Y220-F222 HydrophobicContact CD1-CZ 4.49Å
223	L	94.6	Very high	87.2	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	135.3	163.9	-68	175.2	0	0	0	109.8	S12 L14 Y38 F41 M70 P199 P200 L201	S12-L223 PolarHBondContact N-O 3.49Å; S12-L223 PolarHBondContact O-N 3.1Å; L14-L223 HydrophobicContact CD1-CB 4.1Å; L14-L223 HydrophobicContact CD1-CD1 3.61Å; L14-L223 HydrophobicContact CD1-CG 3.45Å; L14-L223 VanDerWaalsContact CD1-CG 3.45Å; L14-L223 HydrophobicContact CD2-CD1 4.05Å; L14-L223 HydrophobicContact CD2-CD2 4.19Å; L14-L223 HydrophobicContact CD2-CG 3.79Å; L14-L223 HydrophobicContact CG-CD1 4.4Å; L14-L223 HydrophobicContact CG-CG 4.27Å; Y38-L223 HydrophobicContact CD2-CD2 3.89Å; Y38-L223 HydrophobicContact CE2-CD2 3.59Å; F41-L223 HydrophobicContact CD1-CD1 3.86Å; F41-L223 HydrophobicContact CD2-CD1 3.62Å; F41-L223 HydrophobicContact CE1-CD1 3.74Å; F41-L223 HydrophobicContact CE2-CD1 3.5Å; F41-L223 VanDerWaalsContact CE2-CD1 3.5Å; F41-L223 HydrophobicContact CG-CD1 3.79Å; F41-L223 HydrophobicContact CZ-CD1 3.53Å; M70-L223 HydrophobicContact SD-CB 4.02Å; M70-L223 HydrophobicContact SD-CD1 4.17Å; P199-L223 HydrophobicContact CB-CB 4.29Å; P199-L223 HydrophobicContact CB-CD2 4.31Å; P199-L223 HydrophobicContact CG-CD1 4.06Å; P199-L223 HydrophobicContact CG-CD2 4.2Å; P200-L223 WeakPolarHBondContact O-CA 3.3Å; L201-L223 HydrophobicContact CB-CD2 4.13Å
224	A	92.8	Very high	87.9	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.186	C	C	.	.			trans	-93	153	167.5	0	0	0	0	0	110.1	L11 P199 P200 I202 D226 I229	L11-A224 HydrophobicContact CD2-CB 3.8Å; P199-A224 WeakPolarHBondContact CB-O 3.38Å; P200-A224 WeakPolarHBondContact CD-O 3.34Å; P200-A224 HydrophobicContact CG-CB 3.79Å; P200-A224 PolarHBondContact O-N 3.31Å; I202-A224 HydrophobicContact CD1-CB 3.67Å; I202-A224 HydrophobicContact CG1-CB 4.42Å; A224-D226 VanDerWaalsContact C-N 3.26Å; A224-D226 PolarHBondContact O-N 2.89Å; A224-I229 HydrophobicContact CB-CB 3.99Å; A224-I229 HydrophobicContact CB-CG2 3.82Å
225	E	87.6	Confident	88.7	Confident	86 Å²	86	38.7 Å²	38.7	40%	0.402	19%	0.188	S	C	.	.	S	Bend	trans	-64.5	-34.2	177.4	-59.8	-165.4	164.4	0	0	112	K67 M70 I229	K67-E225 WeakPolarHBondContact CE-OE1 3.32Å; K67-E225 VanDerWaalsContact NZ-CD 3.26Å; K67-E225 IonicContact NZ-OE1 3.35Å; K67-E225 PolarHBondContact NZ-OE1 3.4Å; K67-E225 IonicContact NZ-OE2 3.96Å; K67-E225 PolarHBondContact NZ-OE2 2.96Å; M70-E225 HydrophobicContact CE-CG 4.5Å; E225-I229 HydrophobicContact CB-CD1 3.97Å; E225-I229 HydrophobicContact CG-CD1 4.44Å
226	D	88	Confident	89.7	Confident	73 Å²	73	33.9 Å²	33.9	39%	0.39	16%	0.163	S	C	.	.	S	Bend	trans	-149.6	170.9	180	69.3	47.2	0	0	0	113.2	P200 A224 Q228 I229 G230	P200-D226 VanDerWaalsContact CG-O 3.22Å; P200-D226 WeakPolarHBondContact CG-O 3.37Å; A224-D226 VanDerWaalsContact C-N 3.26Å; A224-D226 PolarHBondContact O-N 2.89Å; D226-Q228 VanDerWaalsContact C-N 3.29Å; D226-Q228 PolarHBondContact O-N 3.26Å; D226-Q228 WeakPolarHBondContact OD1-CA 3.11Å; D226-Q228 VanDerWaalsContact OD1-CB 3.29Å; D226-Q228 WeakPolarHBondContact OD1-CB 3.21Å; D226-Q228 PolarHBondContact OD1-N 3.01Å; D226-I229 PolarHBondContact O-N 3.05Å; D226-I229 PolarHBondContact OD1-N 2.74Å; D226-G230 PolarHBondContact O-N 3.35Å
227	I	87.7	Confident	90.3	Very high	76 Å²	76	33.5 Å²	33.5	39%	0.39	16%	0.161	S	C	.	.	H	α-helix	trans	-60	-34.3	179.8	-67.7	175.1	0	0	0	112.2	I167 G230 L231	I167-I227 HydrophobicContact CD1-CB 4.26Å; I167-I227 HydrophobicContact CD1-CG2 3.69Å; I167-I227 WeakPolarHBondContact CD1-O 3.49Å; I167-I227 HydrophobicContact CG1-CG2 4.01Å; I227-G230 PolarHBondContact O-N 3.34Å; I227-L231 HydrophobicContact CG2-CD1 4.04Å; I227-L231 HydrophobicContact CG2-CG 4.49Å; I227-L231 WeakPolarHBondContact O-CB 3.36Å; I227-L231 WeakPolarHBondContact O-CG 3.02Å; I227-L231 PolarHBondContact O-N 3.5Å
228	Q	90.9	Very high	90.6	Very high	120 Å²	120	34.4 Å²	34.4	56%	0.561	17%	0.169	S	C	*	.	H	α-helix	trans	-69.6	-42.2	-178.3	-61.9	-61.1	-37.8	0	0	111.1	D226 G230 L231 N232	D226-Q228 VanDerWaalsContact C-N 3.29Å; D226-Q228 PolarHBondContact O-N 3.26Å; D226-Q228 WeakPolarHBondContact OD1-CA 3.11Å; D226-Q228 VanDerWaalsContact OD1-CB 3.29Å; D226-Q228 WeakPolarHBondContact OD1-CB 3.21Å; D226-Q228 PolarHBondContact OD1-N 3.01Å; Q228-G230 VanDerWaalsContact C-N 3.34Å; Q228-L231 PolarHBondContact O-N 3.21Å; Q228-N232 WeakPolarHBondContact O-CB 3.08Å; Q228-N232 PolarHBondContact O-N 3.34Å; Q228-N232 PolarHBondContact O-ND2 3.05Å
229	I	92	Very high	90.5	Very high	38 Å²	38	39.5 Å²	39.5	20%	0.195	19%	0.193	C	C	.	.	H	α-helix	trans	-59.9	-47.5	173.3	-61.7	173.9	0	0	0	109.5	F9 L11 A224 E225 D226 L231 N232 V233	F9-I229 HydrophobicContact CD1-CG2 4.17Å; L11-I229 HydrophobicContact CD2-CG2 3.83Å; A224-I229 HydrophobicContact CB-CB 3.99Å; A224-I229 HydrophobicContact CB-CG2 3.82Å; E225-I229 HydrophobicContact CB-CD1 3.97Å; E225-I229 HydrophobicContact CG-CD1 4.44Å; D226-I229 PolarHBondContact O-N 3.05Å; D226-I229 PolarHBondContact OD1-N 2.74Å; I229-L231 PolarHBondContact O-N 2.77Å; I229-N232 PolarHBondContact O-N 2.91Å; I229-V233 HydrophobicContact CG2-CG2 4.45Å; I229-V233 WeakPolarHBondContact O-CG2 3.46Å; I229-V233 PolarHBondContact O-N 3.24Å
230	G	91.4	Very high	90.1	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-56.5	-46.1	176.6	0	0	0	0	0	113.8	D226 I227 Q228 V233 L234	D226-G230 PolarHBondContact O-N 3.35Å; I227-G230 PolarHBondContact O-N 3.34Å; Q228-G230 VanDerWaalsContact C-N 3.34Å; G230-V233 PolarHBondContact O-N 3.31Å; G230-L234 PolarHBondContact O-N 3.42Å; G230-L234 VanDerWaalsContact O-N 3.09Å
231	L	90.5	Very high	89.2	Confident	53 Å²	53	45.3 Å²	45.3	28%	0.277	22%	0.215	S	C	.	.	H	α-helix	trans	-64.7	-39.4	176.6	-77.3	170.8	0	0	0	112.9	I167 I168 I227 Q228 I229 L234 R235	I167-L231 HydrophobicContact CB-CD2 4.36Å; I167-L231 HydrophobicContact CD1-CD2 4.15Å; I167-L231 HydrophobicContact CD1-CG 3.76Å; I167-L231 HydrophobicContact CG1-CD2 3.88Å; I167-L231 HydrophobicContact CG1-CG 3.94Å; I167-L231 HydrophobicContact CG2-CD2 3.69Å; I167-L231 HydrophobicContact CG2-CG 4.44Å; I168-L231 HydrophobicContact CG2-CD2 4.32Å; I227-L231 HydrophobicContact CG2-CD1 4.04Å; I227-L231 HydrophobicContact CG2-CG 4.49Å; I227-L231 WeakPolarHBondContact O-CB 3.36Å; I227-L231 WeakPolarHBondContact O-CG 3.02Å; I227-L231 PolarHBondContact O-N 3.5Å; Q228-L231 PolarHBondContact O-N 3.21Å; I229-L231 PolarHBondContact O-N 2.77Å; L231-L234 PolarHBondContact O-N 3.42Å; L231-R235 PolarHBondContact O-N 2.82Å
232	N	92.9	Very high	88.1	Confident	57 Å²	57	53.9 Å²	53.9	31%	0.305	25%	0.252	S	S	.	.	H	α-helix	trans	-67.5	-42.2	178.5	-72	-25	0	0	0	111.4	F9 Q228 I229 L234 R235 C236	F9-N232 HydrophobicContact CE1-CB 3.69Å; F9-N232 HydrophobicContact CZ-CB 4.13Å; Q228-N232 WeakPolarHBondContact O-CB 3.08Å; Q228-N232 PolarHBondContact O-N 3.34Å; Q228-N232 PolarHBondContact O-ND2 3.05Å; I229-N232 PolarHBondContact O-N 2.91Å; N232-L234 VanDerWaalsContact C-N 3.34Å; N232-L234 PolarHBondContact O-N 3.42Å; N232-R235 WeakPolarHBondContact O-CB 3.22Å; N232-R235 PolarHBondContact O-N 3.24Å; N232-R235 VanDerWaalsContact O-N 3.17Å; N232-C236 PolarHBondContact O-N 3.18Å; N232-C236 PolarHBondContact O-SG 3.04Å; N232-C236 VanDerWaalsContact O-SG 3.36Å
233	V	92.6	Very high	86.3	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-58.8	-46.4	173.8	171.7	0	0	0	0	110.8	F9 L79 I81 I202 I229 G230 R235 C236 F237	F9-V233 HydrophobicContact CB-CG2 3.98Å; F9-V233 HydrophobicContact CD1-CG2 3.63Å; F9-V233 HydrophobicContact CD2-CG2 3.61Å; F9-V233 HydrophobicContact CE1-CG2 3.94Å; F9-V233 HydrophobicContact CE2-CG2 3.92Å; F9-V233 HydrophobicContact CG-CG2 3.43Å; F9-V233 VanDerWaalsContact CG-CG2 3.43Å; F9-V233 HydrophobicContact CZ-CG2 4.07Å; L79-V233 HydrophobicContact CD2-CG1 3.97Å; I81-V233 HydrophobicContact CD1-CG1 3.99Å; I202-V233 HydrophobicContact CD1-CB 4.07Å; I202-V233 HydrophobicContact CD1-CG1 4.17Å; I202-V233 HydrophobicContact CD1-CG2 4Å; I202-V233 HydrophobicContact CG2-CG1 3.9Å; I229-V233 HydrophobicContact CG2-CG2 4.45Å; I229-V233 WeakPolarHBondContact O-CG2 3.46Å; I229-V233 PolarHBondContact O-N 3.24Å; G230-V233 PolarHBondContact O-N 3.31Å; V233-R235 VanDerWaalsContact C-N 3.31Å; V233-R235 PolarHBondContact O-N 3.36Å; V233-C236 PolarHBondContact O-N 2.81Å; V233-F237 HydrophobicContact CG1-CD2 3.75Å; V233-F237 HydrophobicContact CG1-CE2 3.42Å; V233-F237 VanDerWaalsContact CG1-CE2 3.42Å; V233-F237 HydrophobicContact CG1-CZ 4.12Å; V233-F237 PolarHBondContact O-N 3.28Å
234	L	90.6	Very high	84.5	Confident	13 Å²	13	59.4 Å²	59.4	7%	0.068	29%	0.292	C	S	.	.	H	α-helix	trans	-60.3	-39	175.4	-77.4	-168.7	0	0	0	113.5	F128 C130 I167 I168 G230 L231 N232 S238	F128-L234 HydrophobicContact CD2-CD2 3.72Å; F128-L234 HydrophobicContact CE2-CD2 4.35Å; C130-L234 HydrophobicContact CB-CD1 3.52Å; C130-L234 HydrophobicContact CB-CD2 3.97Å; C130-L234 HydrophobicContact CB-CG 3.59Å; I167-L234 HydrophobicContact CG2-CD1 3.37Å; I168-L234 HydrophobicContact CG2-CD1 4.33Å; G230-L234 PolarHBondContact O-N 3.42Å; G230-L234 VanDerWaalsContact O-N 3.09Å; L231-L234 PolarHBondContact O-N 3.42Å; N232-L234 VanDerWaalsContact C-N 3.34Å; N232-L234 PolarHBondContact O-N 3.42Å; L234-S238 VanDerWaalsContact O-CB 3.31Å; L234-S238 WeakPolarHBondContact O-CB 3.19Å; L234-S238 PolarHBondContact O-N 2.81Å; L234-S238 PolarHBondContact O-OG 2.86Å
235	R	89.5	Confident	81.8	Confident	146 Å²	146	65.2 Å²	65.2	55%	0.551	33%	0.329	S	S	*	.	H	α-helix	trans	-61.7	-48.7	175.8	-172.6	-175.3	-59.4	163.4	6.1	110.2	L231 N232 V233 F237 S238 E239	L231-R235 PolarHBondContact O-N 2.82Å; N232-R235 WeakPolarHBondContact O-CB 3.22Å; N232-R235 PolarHBondContact O-N 3.24Å; N232-R235 VanDerWaalsContact O-N 3.17Å; V233-R235 VanDerWaalsContact C-N 3.31Å; V233-R235 PolarHBondContact O-N 3.36Å; R235-F237 PolarHBondContact O-N 3.49Å; R235-S238 WeakPolarHBondContact O-CB 3.31Å; R235-S238 PolarHBondContact O-N 3.01Å; R235-S238 VanDerWaalsContact O-N 3.15Å; R235-E239 WeakPolarHBondContact CG-OE1 3.3Å; R235-E239 WeakPolarHBondContact O-CG 3.21Å; R235-E239 PolarHBondContact O-N 3.2Å
236	C	90.1	Very high	79.4	Confident	13 Å²	13	64.4 Å²	64.4	9%	0.088	34%	0.344	C	S	.	.	H	α-helix	trans	-61.3	-44.2	178.3	-65.9	0	0	0	0	112.3	F9 I81 N232 V233 S238 E239 L240	F9-C236 HydrophobicContact CE2-CB 4.31Å; I81-C236 HydrophobicContact CB-CB 3.93Å; I81-C236 HydrophobicContact CD1-CB 3.95Å; I81-C236 HydrophobicContact CG2-CB 3.71Å; N232-C236 PolarHBondContact O-N 3.18Å; N232-C236 PolarHBondContact O-SG 3.04Å; N232-C236 VanDerWaalsContact O-SG 3.36Å; V233-C236 PolarHBondContact O-N 2.81Å; C236-S238 VanDerWaalsContact C-N 3.32Å; C236-S238 PolarHBondContact O-N 2.79Å; C236-E239 PolarHBondContact O-N 3.27Å; C236-L240 VanDerWaalsContact O-CB 3.29Å; C236-L240 WeakPolarHBondContact O-CB 3.42Å; C236-L240 PolarHBondContact O-N 3.34Å
237	F	88.7	Confident	76.9	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-61.4	-40	173.6	-75.8	-38	0	0	0	112.7	L79 I81 I86 L125 F128 I202 F204 V233 R235 L240 R241	L79-F237 HydrophobicContact CD2-CZ 3.94Å; I81-F237 HydrophobicContact CD1-CD1 3.74Å; I81-F237 HydrophobicContact CD1-CD2 4.48Å; I81-F237 HydrophobicContact CD1-CE1 3.49Å; I81-F237 VanDerWaalsContact CD1-CE1 3.49Å; I81-F237 HydrophobicContact CD1-CE2 4.3Å; I81-F237 HydrophobicContact CD1-CG 4.23Å; I81-F237 HydrophobicContact CD1-CZ 3.81Å; I81-F237 HydrophobicContact CG1-CD1 4.4Å; I81-F237 HydrophobicContact CG1-CE1 4.01Å; I81-F237 HydrophobicContact CG2-CD1 4.31Å; I86-F237 HydrophobicContact CD1-CD1 4.13Å; I86-F237 HydrophobicContact CD1-CE1 3.8Å; I86-F237 HydrophobicContact CG1-CD1 4.47Å; I86-F237 HydrophobicContact CG1-CE1 4.07Å; I86-F237 HydrophobicContact CG2-CE1 3.97Å; L125-F237 HydrophobicContact CD1-CD1 4.45Å; L125-F237 HydrophobicContact CD2-CB 3.95Å; L125-F237 HydrophobicContact CD2-CD1 3.66Å; L125-F237 HydrophobicContact CD2-CE1 4.45Å; L125-F237 HydrophobicContact CD2-CG 4.02Å; F128-F237 HydrophobicContact CB-CD2 3.85Å; F128-F237 HydrophobicContact CB-CE2 4.32Å; F128-F237 HydrophobicContact CB-CG 4.33Å; F128-F237 HydrophobicContact CD1-CB 4.02Å; F128-F237 HydrophobicContact CD2-CB 3.52Å; F128-F237 HydrophobicContact CD2-CD2 4Å; F128-F237 HydrophobicContact CD2-CG 4.15Å; F128-F237 HydrophobicContact CE1-CB 4.03Å; F128-F237 HydrophobicContact CE2-CB 3.56Å; F128-F237 HydrophobicContact CG-CB 3.76Å; F128-F237 AromaticContact CG-CD2 3.99Å; F128-F237 HydrophobicContact CG-CD2 3.99Å; F128-F237 HydrophobicContact CG-CG 4.08Å; F128-F237 HydrophobicContact CZ-CB 3.81Å; I202-F237 HydrophobicContact CG2-CE2 4.32Å; F204-F237 HydrophobicContact CB-CE2 4.27Å; F204-F237 HydrophobicContact CB-CZ 4.24Å; F204-F237 HydrophobicContact CD1-CE1 4.44Å; F204-F237 HydrophobicContact CD1-CE2 4.1Å; F204-F237 AromaticContact CD1-CZ 3.56Å; F204-F237 HydrophobicContact CD1-CZ 3.56Å; F204-F237 HydrophobicContact CE1-CZ 4.06Å; F204-F237 HydrophobicContact CG-CE2 4.5Å; F204-F237 HydrophobicContact CG-CZ 4.03Å; V233-F237 HydrophobicContact CG1-CD2 3.75Å; V233-F237 HydrophobicContact CG1-CE2 3.42Å; V233-F237 VanDerWaalsContact CG1-CE2 3.42Å; V233-F237 HydrophobicContact CG1-CZ 4.12Å; V233-F237 PolarHBondContact O-N 3.28Å; R235-F237 PolarHBondContact O-N 3.49Å; F237-L240 PolarHBondContact O-N 3.49Å; F237-R241 PolarHBondContact O-N 2.96Å
238	S	85.8	Confident	74.3	Confident	44 Å²	44	66.7 Å²	66.7	31%	0.308	36%	0.36	S	S	.	.	H	α-helix	trans	-66.3	-40.8	177.4	-59.5	0	0	0	0	112.2	L234 R235 C236 R241 K242	L234-S238 VanDerWaalsContact O-CB 3.31Å; L234-S238 WeakPolarHBondContact O-CB 3.19Å; L234-S238 PolarHBondContact O-N 2.81Å; L234-S238 PolarHBondContact O-OG 2.86Å; R235-S238 WeakPolarHBondContact O-CB 3.31Å; R235-S238 PolarHBondContact O-N 3.01Å; R235-S238 VanDerWaalsContact O-N 3.15Å; C236-S238 VanDerWaalsContact C-N 3.32Å; C236-S238 PolarHBondContact O-N 2.79Å; S238-R241 PolarHBondContact O-N 3.03Å; S238-K242 VanDerWaalsContact O-CG 3.31Å; S238-K242 WeakPolarHBondContact O-CG 3.25Å; S238-K242 PolarHBondContact O-N 2.91Å; S238-K242 VanDerWaalsContact O-N 3.12Å
239	E	83.5	Confident	71.5	Confident	109 Å²	109	65 Å²	65	51%	0.509	35%	0.354	S	S	.	.	H	α-helix	trans	-66	-43.2	175.1	-74.5	172.1	-174.1	0	0	111.3	R235 C236 R241 K242 S243	R235-E239 WeakPolarHBondContact CG-OE1 3.3Å; R235-E239 WeakPolarHBondContact O-CG 3.21Å; R235-E239 PolarHBondContact O-N 3.2Å; C236-E239 PolarHBondContact O-N 3.27Å; E239-R241 VanDerWaalsContact C-N 3.3Å; E239-R241 PolarHBondContact O-N 3.41Å; E239-K242 PolarHBondContact O-N 3.31Å; E239-K242 VanDerWaalsContact O-N 3.16Å; E239-S243 WeakPolarHBondContact O-CB 3.12Å; E239-S243 PolarHBondContact O-N 2.83Å; E239-S243 PolarHBondContact O-OG 3.16Å; E239-S243 VanDerWaalsContact O-OG 3.08Å
240	L	80.4	Confident	68.8	Low	7 Å²	7	67.6 Å²	67.6	4%	0.037	37%	0.367	C	S	.	.	H	α-helix	trans	-59	-41.6	176.3	-168.3	72.5	0	0	0	111.9	I81 I86 A122 C236 F237 S243 S244	I81-L240 HydrophobicContact CG2-CB 4.47Å; I81-L240 HydrophobicContact CG2-CD2 4.21Å; I86-L240 HydrophobicContact CD1-CD2 3.74Å; I86-L240 HydrophobicContact CG1-CD2 3.38Å; A122-L240 HydrophobicContact CB-CD1 3.86Å; A122-L240 HydrophobicContact CB-CD2 3.97Å; A122-L240 HydrophobicContact CB-CG 3.58Å; C236-L240 VanDerWaalsContact O-CB 3.29Å; C236-L240 WeakPolarHBondContact O-CB 3.42Å; C236-L240 PolarHBondContact O-N 3.34Å; F237-L240 PolarHBondContact O-N 3.49Å; L240-S243 PolarHBondContact O-OG 2.79Å; L240-S243 VanDerWaalsContact O-OG 3.14Å; L240-S244 PolarHBondContact O-N 2.99Å
241	R	73.2	Confident	65.9	Low	116 Å²	116	70 Å²	70	44%	0.438	38%	0.383	S	S	.	.	H	α-helix	trans	-69	-33.8	176.8	-168.5	174.9	-174.6	148.4	9.2	112.7	I126 F237 S238 E239	I126-R241 PolarHBondContact O-NH1 3.01Å; F237-R241 PolarHBondContact O-N 2.96Å; S238-R241 PolarHBondContact O-N 3.03Å; E239-R241 VanDerWaalsContact C-N 3.3Å; E239-R241 PolarHBondContact O-N 3.41Å
242	K	72.4	Confident	63.2	Low	179 Å²	179	76.6 Å²	76.6	78%	0.778	40%	0.404	S	S	*	.	H	α-helix	trans	-76.9	-34.7	177.5	-73.6	174.7	-177.5	-178.6	0	112.8	S238 E239 S244	S238-K242 VanDerWaalsContact O-CG 3.31Å; S238-K242 WeakPolarHBondContact O-CG 3.25Å; S238-K242 PolarHBondContact O-N 2.91Å; S238-K242 VanDerWaalsContact O-N 3.12Å; E239-K242 PolarHBondContact O-N 3.31Å; E239-K242 VanDerWaalsContact O-N 3.16Å; K242-S244 VanDerWaalsContact C-N 3.3Å
243	S	58.3	Low	60.2	Low	74 Å²	74	79.4 Å²	79.4	52%	0.517	42%	0.424	S	S	.	.	H	α-helix	trans	-79.2	-12.8	-176.1	64.8	0	0	0	0	113.3	E239 L240 P245	E239-S243 WeakPolarHBondContact O-CB 3.12Å; E239-S243 PolarHBondContact O-N 2.83Å; E239-S243 PolarHBondContact O-OG 3.16Å; E239-S243 VanDerWaalsContact O-OG 3.08Å; L240-S243 PolarHBondContact O-OG 2.79Å; L240-S243 VanDerWaalsContact O-OG 3.14Å; S243-P245 WeakPolarHBondContact O-CD 3.44Å; S243-P245 WeakPolarHBondContact O-CG 3.32Å
244	S	55.2	Low	57.3	Low	44 Å²	44	83.8 Å²	83.8	31%	0.308	45%	0.447	S	S	.	.			trans	-76.4	95	170.4	-174.7	0	0	0	0	109.8	L240 K242	L240-S244 PolarHBondContact O-N 2.99Å; K242-S244 VanDerWaalsContact C-N 3.3Å
245	P	36.3	Very low	54.3	Low	121 Å²	121	88 Å²	88	79%	0.786	48%	0.476	S	S	*	.			trans	-90.4	113.8	-176.5	12.3	11.4	0	0	0	107.2	S243	S243-P245 WeakPolarHBondContact O-CD 3.44Å; S243-P245 WeakPolarHBondContact O-CG 3.32Å
246	G	37.3	Very low	51.2	Low	70 Å²	70	90.2 Å²	90.2	72%	0.722	49%	0.49	S	S	*	.	S	Bend	trans	80.5	69.5	165	0	0	0	0	0	115.6
247	T	35.4	Very low	48.2	Very low	74 Å²	74	94.6 Å²	94.6	45%	0.454	52%	0.519	S	S	.	.			trans	-159.8	88.6	138.8	25.7	0	0	0	0	108.3	I249	T247-I249 HydrophobicContact CG2-CB 4.15Å; T247-I249 HydrophobicContact CG2-CD1 3.56Å; T247-I249 HydrophobicContact CG2-CG1 3.8Å; T247-I249 PolarHBondContact O-N 3.06Å
248	N	33.5	Very low	45.1	Very low	122 Å²	122	102.1 Å²	102.1	65%	0.652	56%	0.559	S	S	*	*			trans	-67.7	46.3	153.1	-90.5	-13.6	0	0	0	110.1	S334	N248-S334 WeakPolarHBondContact CB-OG 3.16Å; N248-S334 PolarHBondContact O-OG 3.03Å
249	I	32.5	Very low	42.4	Very low	86 Å²	86	103.6 Å²	103.6	44%	0.441	58%	0.575	S	S	.	*			trans	-113.4	84.8	174.4	-53	-178.7	0	0	0	103.1	T247 R252	T247-I249 HydrophobicContact CG2-CB 4.15Å; T247-I249 HydrophobicContact CG2-CD1 3.56Å; T247-I249 HydrophobicContact CG2-CG1 3.8Å; T247-I249 PolarHBondContact O-N 3.06Å; I249-R252 HydrophobicContact CG2-CB 4.14Å; I249-R252 HydrophobicContact CG2-CG 4.22Å
250	L	35.7	Very low	39.8	Very low	91 Å²	91	105.9 Å²	105.9	48%	0.476	59%	0.589	S	S	.	*			trans	-37.5	130.5	143.4	-94.6	140.2	0	0	0	106.3	R252	L250-R252 VanDerWaalsContact C-N 3.33Å; L250-R252 PolarHBondContact O-N 3.42Å
251	P	30.1	Very low	37.2	Very low	52 Å²	52	114.2 Å²	114.2	34%	0.338	63%	0.625	S	S	.	*			trans	-51.9	100.7	-171.5	20	-30.7	0	0	0	109	T253	P251-T253 PolarHBondContact O-N 3.39Å; P251-T253 VanDerWaalsContact O-N 3.12Å
252	R	33.3	Very low	34.9	Very low	190 Å²	190	114.6 Å²	114.6	72%	0.717	64%	0.643	S	S	*	*	S	Bend	trans	-67.9	-6.4	175	-92	-176.7	172.3	167.8	-2.1	110.4	I249 L250	I249-R252 HydrophobicContact CG2-CB 4.14Å; I249-R252 HydrophobicContact CG2-CG 4.22Å; L250-R252 VanDerWaalsContact C-N 3.33Å; L250-R252 PolarHBondContact O-N 3.42Å
253	T	29.7	Very low	32.9	Very low	117 Å²	117	113.3 Å²	113.3	72%	0.718	64%	0.643	S	S	*	*			trans	-134	62.2	-163.9	51.8	0	0	0	0	110.5	P251	P251-T253 PolarHBondContact O-N 3.39Å; P251-T253 VanDerWaalsContact O-N 3.12Å
254	L	32.1	Very low	31.4	Very low	92 Å²	92	118.3 Å²	118.3	48%	0.482	66%	0.658	S	S	.	*	S	Bend	trans	-116.7	5.3	146.7	-72.8	165.8	0	0	0	111.7	L209 K256	L209-L254 HydrophobicContact CD1-CB 4.15Å; L209-L254 HydrophobicContact CD1-CD1 4.28Å; L209-L254 HydrophobicContact CD1-CD2 3.84Å; L209-L254 HydrophobicContact CD1-CG 4.29Å; L209-L254 HydrophobicContact CD2-CB 4.15Å; L209-L254 HydrophobicContact CD2-CD1 4.34Å; L209-L254 HydrophobicContact CG-CB 4.4Å; L209-L254 HydrophobicContact CG-CD1 4.03Å; L209-L254 HydrophobicContact CG-CD2 4.49Å; L254-K256 PolarHBondContact O-N 3.05Å
255	C	26.8	Very low	30.3	Very low	100 Å²	100	121.5 Å²	121.5	68%	0.676	68%	0.68	S	S	*	*			trans	-88.2	81.6	166.8	-161	0	0	0	0	108.9	C257	C255-C257 PolarHBondContact O-N 3.06Å
256	K	25.7	Very low	29.9	Very low	194 Å²	194	123.7 Å²	123.7	84%	0.843	68%	0.68	S	S	*	*			trans	-83.3	73.8	151.8	-77.9	-172.8	177.6	-177.2	0	107.3	L254	L254-K256 PolarHBondContact O-N 3.05Å
257	C	26.5	Very low	29.4	Very low	104 Å²	104	125.2 Å²	125.2	70%	0.703	69%	0.686	S	S	*	*			trans	-95.9	86.4	156	-74.6	0	0	0	0	106.7	C255 A259	C255-C257 PolarHBondContact O-N 3.06Å; C257-A259 PolarHBondContact O-N 2.74Å
258	D	23.8	Very low	29.2	Very low	158 Å²	158	129 Å²	129	85%	0.845	70%	0.702	S	S	*	*			trans	-64.9	86.7	157.4	-74.4	-42.3	0	0	0	107.7
259	A	28.1	Very low	28.9	Very low	76 Å²	76	131.2 Å²	131.2	63%	0.628	71%	0.708	S	S	*	*			trans	-161.7	97.8	167	0	0	0	0	0	113	C257	C257-A259 PolarHBondContact O-N 2.74Å
260	L	29	Very low	28.7	Very low	156 Å²	156	136.3 Å²	136.3	82%	0.817	72%	0.723	S	S	*	*				68.7	102.5	129.1	-59.4	166.9	0	0	0	119.9
261	K	27.3	Very low	28.5	Very low	182 Å²	182	139.9 Å²	139.9	79%	0.791	74%	0.737	S	S	*	*			trans	73	123.8	138.4	-63.7	-175.7	178.8	-179.1	0	119.2	I263	K261-I263 PolarHBondContact O-N 2.96Å
262	P	24.1	Very low	28.4	Very low	125 Å²	125	142.8 Å²	142.8	81%	0.812	76%	0.758	S	S	*	*			trans	-76	118.8	169.5	31.7	-28.4	0	0	0	108.9	Q264	P262-Q264 PolarHBondContact O-N 3.38Å
263	I	30	Very low	28.4	Very low	152 Å²	152	143.9 Å²	143.9	78%	0.779	77%	0.769	S	S	*	*			trans	-83.7	107.6	164.3	-63.3	176.5	0	0	0	106.9	K261	K261-I263 PolarHBondContact O-N 2.96Å
264	Q	26.8	Very low	28.4	Very low	179 Å²	179	149.4 Å²	149.4	84%	0.836	78%	0.776	S	S	*	*			trans	-59.9	126.6	156	-67.3	174.6	-7	0	0	107.4	P262	P262-Q264 PolarHBondContact O-N 3.38Å
265	S	31.8	Very low	28.6	Very low	110 Å²	110	153.9 Å²	153.9	77%	0.769	80%	0.797	S	S	*	*			trans	-121.9	106.3	166.3	-57.3	0	0	0	0	107.6
266	E	29	Very low	28.9	Very low	167 Å²	167	155.9 Å²	155.9	78%	0.78	80%	0.801	S	S	*	*			trans	-57.4	149.5	179.2	-67.6	165.3	136.3	0	0	112.1	I268	E266-I268 PolarHBondContact O-N 3.17Å
267	A	26.3	Very low	29.4	Very low	102 Å²	102	154.6 Å²	154.6	84%	0.843	80%	0.803	S	S	*	*			trans	-62.4	121.9	164.1	0	0	0	0	0	110.1
268	I	32.3	Very low	29.7	Very low	153 Å²	153	158.5 Å²	158.5	79%	0.785	81%	0.808	S	S	*	*			trans	-128.3	100.8	161.5	-58.4	-179.9	0	0	0	108	E266	E266-I268 PolarHBondContact O-N 3.17Å
269	H	25.8	Very low	30.2	Very low	169 Å²	169	158.4 Å²	158.4	78%	0.782	81%	0.807	S	S	*	*			trans	-57.1	137.4	153.2	-93.7	-76.9	0	0	0	109.1
270	Y	29.1	Very low	30.4	Very low	193 Å²	193	161.3 Å²	161.3	76%	0.757	81%	0.812	S	S	*	*				176.8	122.1	120.3	-112.3	-105.1	0	0	0	113
271	Q	30.8	Very low	30.7	Very low	167 Å²	167	158.8 Å²	158.8	78%	0.78	80%	0.803	S	S	*	*			trans	57.3	130.1	139.9	-70.1	-175.7	-4.1	0	0	123.9
272	S	28.7	Very low	30.9	Very low	112 Å²	112	156.2 Å²	156.2	78%	0.783	80%	0.798	S	S	*	*			trans	-78.6	149	170.7	88.7	0	0	0	0	112.9
273	K	33.7	Very low	31.2	Very low	214 Å²	214	158.4 Å²	158.4	93%	0.93	80%	0.795	S	S	*	*			trans	-151.3	125.4	145	-121.6	174.9	-176.4	177.7	0	111.3
274	R	29.8	Very low	31	Very low	233 Å²	233	161.6 Å²	161.6	88%	0.879	80%	0.798	S	S	*	*			trans	-64.2	148.2	174.6	-63.1	172.4	172.5	176	-4	111.3
275	M	35.9	Very low	31.1	Very low	186 Å²	186	161.7 Å²	161.7	92%	0.916	80%	0.799	S	S	*	*			trans	-157.5	137.6	132.6	-95.5	-57	169.7	0	0	109.4
276	N	33.2	Very low	31	Very low	142 Å²	142	163 Å²	163	76%	0.759	80%	0.797	S	S	*	*			trans	-71.9	151.5	179.1	-61.5	-53.7	0	0	0	110.6
277	D	35.5	Very low	31.1	Very low	166 Å²	166	160.8 Å²	160.8	89%	0.888	80%	0.801	S	S	*	*				-156.4	139.1	119.2	-109	-25.1	0	0	0	113.5
278	K	33	Very low	31.3	Very low	186 Å²	186	164.8 Å²	164.8	81%	0.809	80%	0.799	S	S	*	*			trans	-80	151.8	-178.5	-71.5	165.5	168.8	172.4	0	110.4
279	L	33.9	Very low	31.3	Very low	157 Å²	157	161 Å²	161	82%	0.822	79%	0.785	S	S	*	*			trans	158.7	105.3	134.8	-91.9	135.1	0	0	0	106.5
280	N	33.6	Very low	31.5	Very low	137 Å²	137	160 Å²	160	73%	0.733	79%	0.786	S	S	*	*				55.1	122.2	96.7	-82.2	-5.5	0	0	0	110.9
281	T	33.2	Very low	31.5	Very low	102 Å²	102	160 Å²	160	63%	0.626	79%	0.786	S	S	*	*			cis	177.8	148.6	43	3.8	0	0	0	0	108.8
282	N	31.8	Very low	31.7	Very low	128 Å²	128	158.9 Å²	158.9	68%	0.684	79%	0.785	S	S	*	*			trans	69.1	142.5	147.1	-56.4	-26	0	0	0	117.9
283	K	31.2	Very low	31.9	Very low	171 Å²	171	159.4 Å²	159.4	74%	0.743	78%	0.779	S	S	*	*			cis	177.4	142.4	-10.5	-112.1	173.2	-179.4	178.9	0	101.8
284	Y	26.1	Very low	31.9	Very low	219 Å²	219	153.1 Å²	153.1	86%	0.859	76%	0.758	S	S	*	*			trans	73.6	96.7	-178.9	-72	-95.6	0	0	0	116
285	E	29.1	Very low	32.4	Very low	181 Å²	181	145.3 Å²	145.3	85%	0.846	74%	0.736	S	S	*	*			trans	175.2	140.8	133.3	-97.8	168.7	-171.3	0	0	110
286	N	30	Very low	32.7	Very low	137 Å²	137	142.3 Å²	142.3	73%	0.733	72%	0.718	S	S	*	*			trans	70.3	75.8	162.9	-58	-31.8	0	0	0	119.4	K288	N286-K288 PolarHBondContact O-N 3.42Å; N286-K288 VanDerWaalsContact O-N 3.11Å
287	S	29.6	Very low	33.2	Very low	122 Å²	122	142.4 Å²	142.4	85%	0.853	71%	0.709	S	S	*	*			trans	-80.4	68.9	147.8	60.5	0	0	0	0	110	S289	S287-S289 PolarHBondContact O-N 2.94Å; S287-S289 VanDerWaalsContact O-N 3.14Å
288	K	30.8	Very low	33.8	Very low	186 Å²	186	138.7 Å²	138.7	81%	0.809	69%	0.685	S	S	*	*			trans	-70	91.8	150.1	-88.1	-179.1	175.4	176.6	0	105	N286 D290	N286-K288 PolarHBondContact O-N 3.42Å; N286-K288 VanDerWaalsContact O-N 3.11Å; K288-D290 PolarHBondContact O-N 3.21Å; K288-D290 VanDerWaalsContact O-N 3.14Å
289	S	31.8	Very low	34.7	Very low	72 Å²	72	134.7 Å²	134.7	50%	0.503	67%	0.669	S	S	.	*			trans	-62	115.1	174.9	42.9	0	0	0	0	109.1	S287 Y291	S287-S289 PolarHBondContact O-N 2.94Å; S287-S289 VanDerWaalsContact O-N 3.14Å; S289-Y291 VanDerWaalsContact C-N 3.31Å; S289-Y291 VanDerWaalsContact O-CD2 3.32Å; S289-Y291 WeakPolarHBondContact O-CD2 3.22Å; S289-Y291 PolarHBondContact O-N 3.41Å; S289-Y291 WeakPolarHBondContact OG-CD2 3.32Å; S289-Y291 WeakPolarHBondContact OG-CE2 3.38Å
290	D	31.3	Very low	35.3	Very low	148 Å²	148	127.7 Å²	127.7	79%	0.791	63%	0.633	S	S	*	*			trans	-51.8	89.5	166.4	-71.9	-46.9	0	0	0	110.5	K288	K288-D290 PolarHBondContact O-N 3.21Å; K288-D290 VanDerWaalsContact O-N 3.14Å
291	Y	29.7	Very low	36.1	Very low	195 Å²	195	128.7 Å²	128.7	77%	0.765	63%	0.633	S	S	*	*			trans	-91	15.1	166.8	-72.4	-69.3	0	0	0	112.1	S289	S289-Y291 VanDerWaalsContact C-N 3.31Å; S289-Y291 VanDerWaalsContact O-CD2 3.32Å; S289-Y291 WeakPolarHBondContact O-CD2 3.22Å; S289-Y291 PolarHBondContact O-N 3.41Å; S289-Y291 WeakPolarHBondContact OG-CD2 3.32Å; S289-Y291 WeakPolarHBondContact OG-CE2 3.38Å
292	L	33.1	Very low	36.6	Very low	142 Å²	142	128.3 Å²	128.3	74%	0.743	63%	0.633	S	S	*	*	S	Bend	trans	-89.4	111.8	175.9	-77.6	156	0	0	0	109.9
293	N	33.9	Very low	38	Very low	123 Å²	123	123.6 Å²	123.6	66%	0.658	61%	0.61	S	S	*	*			trans	72.2	68.9	166.3	-52.8	-42	0	0	0	117.2	T295	N293-T295 PolarHBondContact O-N 3.37Å
294	V	34.1	Very low	39.1	Very low	82 Å²	82	123.2 Å²	123.2	50%	0.497	61%	0.611	S	S	.	*			trans	-68.8	99.5	154.7	-178.7	0	0	0	0	107.7	K296	V294-K296 HydrophobicContact CG1-CG 4.21Å; V294-K296 PolarHBondContact O-N 3.48Å
295	T	38.7	Very low	40.2	Very low	69 Å²	69	115.6 Å²	115.6	42%	0.423	59%	0.585	S	S	.	*			trans	-82.8	94.7	169.5	9	0	0	0	0	107.4	N293 Y297	N293-T295 PolarHBondContact O-N 3.37Å; T295-Y297 PolarHBondContact O-N 3.09Å
296	K	43.1	Very low	41.2	Very low	123 Å²	123	114.2 Å²	114.2	54%	0.535	57%	0.573	S	S	.	*			trans	-77.5	117.1	165.9	-89.3	-176.4	-173.5	162.2	0	109.3	V294 K298 E311	V294-K296 HydrophobicContact CG1-CG 4.21Å; V294-K296 PolarHBondContact O-N 3.48Å; K296-K298 PolarHBondContact O-N 3.21Å; K296-E311 WeakPolarHBondContact CD-OE1 3.29Å
297	Y	43.8	Very low	42	Very low	144 Å²	144	108.4 Å²	108.4	57%	0.565	54%	0.542	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.5	119.9	168.7	-64.9	-81.3	0	0	0	109.3	T295 Y306	T295-Y297 PolarHBondContact O-N 3.09Å; Y297-Y306 HydrophobicContact CD1-CD1 4.02Å; Y297-Y306 HydrophobicContact CD1-CG 4.47Å; Y297-Y306 HydrophobicContact CG-CD1 4.2Å
298	K	48.7	Very low	42.7	Very low	89 Å²	89	110.9 Å²	110.9	39%	0.387	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	143.8	166.7	-74.6	-173.6	177.8	180	0	108.9	K296 L307	K296-K298 PolarHBondContact O-N 3.21Å; K298-L307 PolarHBondContact N-O 2.95Å; K298-L307 WeakPolarHBondContact O-CA 3.31Å; K298-L307 VanDerWaalsContact O-CB 3.32Å; K298-L307 WeakPolarHBondContact O-CB 3.32Å; K298-L307 PolarHBondContact O-N 3.39Å
299	H	50.8	Low	43.1	Very low	102 Å²	102	102.8 Å²	102.8	47%	0.472	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	138.4	173.6	-72.7	-60.4	0	0	0	110.4	Q304 Y306	H299-Q304 PolarHBondContact ND1-O 3.32Å; H299-Y306 AromaticContact CE1-CD1 3.53Å; H299-Y306 AromaticContact CE1-CE1 3.1Å; H299-Y306 WeakPolarHBondContact CE1-CE1 3.39Å; H299-Y306 AromaticContact CE1-CZ 3.42Å; H299-Y306 VanDerWaalsContact CE1-CZ 3.42Å; H299-Y306 AromaticContact ND1-CD1 3.88Å; H299-Y306 AromaticContact ND1-CE1 3.92Å; H299-Y306 AromaticContact NE2-CE1 3.74Å
300	C	46.7	Very low	43.4	Very low	10 Å²	10	109.9 Å²	109.9	7%	0.068	52%	0.52	C	S	.	.			trans	-75.5	124.8	165.1	-178.5	0	0	0	0	109.4	C302 C303 Q304 D305 L307 C344	C300-C302 PolarHBondContact O-N 3.06Å; C300-C302 PolarHBondContact SG-N 3.14Å; C300-C303 WeakPolarHBondContact CB-SG 3.45Å; C300-C303 PolarHBondContact SG-SG 3.2Å; C300-Q304 VanDerWaalsContact O-CA 3.22Å; C300-Q304 WeakPolarHBondContact O-CA 3.29Å; C300-Q304 PolarHBondContact O-N 3.3Å; C300-D305 PolarHBondContact N-O 3.39Å; C300-L307 HydrophobicContact CB-CD1 3.79Å; C300-L307 HydrophobicContact CB-CG 4.26Å; C300-C344 HydrophobicContact CB-CB 4.39Å
301	E	50.6	Low	43.4	Very low	157 Å²	157	106 Å²	106	73%	0.734	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-20.7	179.1	-66.2	-179.5	176.2	0	0	113.1
302	C	44.6	Very low	43.6	Very low	94 Å²	94	99.2 Å²	99.2	64%	0.635	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-43.6	178.1	-62.5	0	0	0	0	113.9	C300	C300-C302 PolarHBondContact O-N 3.06Å; C300-C302 PolarHBondContact SG-N 3.14Å
303	C	60.4	Low	43.7	Very low	29 Å²	29	97.3 Å²	97.3	20%	0.196	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-4.6	-172	57.1	0	0	0	0	112.8	C300 D305 C344 Q346	C300-C303 WeakPolarHBondContact CB-SG 3.45Å; C300-C303 PolarHBondContact SG-SG 3.2Å; C303-D305 HydrophobicContact CB-CB 4.32Å; C303-D305 PolarHBondContact O-N 3.25Å; C303-C344 WeakPolarHBondContact CB-SG 3.42Å; C303-C344 WeakPolarHBondContact SG-CB 3.31Å; C303-C344 CovalentContact SG-SG 2.11Å; C303-C344 PolarHBondContact SG-SG 2.98Å; C303-Q346 HydrophobicContact CB-CB 4.42Å
304	Q	54.8	Low	43.7	Very low	163 Å²	163	98.5 Å²	98.5	76%	0.762	48%	0.48	S	S	*	.			trans	53.5	-1.5	-167.7	-69.5	-171.2	-7.1	0	0	115.4	H299 C300	H299-Q304 PolarHBondContact ND1-O 3.32Å; C300-Q304 VanDerWaalsContact O-CA 3.22Å; C300-Q304 WeakPolarHBondContact O-CA 3.29Å; C300-Q304 PolarHBondContact O-N 3.3Å
305	D	47.7	Very low	43.7	Very low	59 Å²	59	98.2 Å²	98.2	32%	0.316	48%	0.475	S	S	.	.			trans	-72.6	149.6	-174.9	-119.6	-12	0	0	0	112.1	C300 C303 L307 Q346	C300-D305 PolarHBondContact N-O 3.39Å; C303-D305 HydrophobicContact CB-CB 4.32Å; C303-D305 PolarHBondContact O-N 3.25Å; D305-L307 PolarHBondContact O-N 2.86Å; D305-Q346 WeakPolarHBondContact OD2-CG 3.39Å; D305-Q346 PolarHBondContact OD2-NE2 2.9Å
306	Y	50.4	Low	43.5	Very low	152 Å²	152	98.4 Å²	98.4	60%	0.596	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.1	105.9	-177.8	-75.7	-77.3	0	0	0	111	Y297 H299 K308	Y297-Y306 HydrophobicContact CD1-CD1 4.02Å; Y297-Y306 HydrophobicContact CD1-CG 4.47Å; Y297-Y306 HydrophobicContact CG-CD1 4.2Å; H299-Y306 AromaticContact CE1-CD1 3.53Å; H299-Y306 AromaticContact CE1-CE1 3.1Å; H299-Y306 WeakPolarHBondContact CE1-CE1 3.39Å; H299-Y306 AromaticContact CE1-CZ 3.42Å; H299-Y306 VanDerWaalsContact CE1-CZ 3.42Å; H299-Y306 AromaticContact ND1-CD1 3.88Å; H299-Y306 AromaticContact ND1-CE1 3.92Å; H299-Y306 AromaticContact NE2-CE1 3.74Å; Y306-K308 PolarHBondContact O-N 3.11Å
307	L	48.3	Very low	43.2	Very low	16 Å²	16	98.8 Å²	98.8	8%	0.084	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	114.9	169.6	-71.9	153	0	0	0	109.1	K298 C300 D305 C309 A342 Y351	K298-L307 PolarHBondContact N-O 2.95Å; K298-L307 WeakPolarHBondContact O-CA 3.31Å; K298-L307 VanDerWaalsContact O-CB 3.32Å; K298-L307 WeakPolarHBondContact O-CB 3.32Å; K298-L307 PolarHBondContact O-N 3.39Å; C300-L307 HydrophobicContact CB-CD1 3.79Å; C300-L307 HydrophobicContact CB-CG 4.26Å; D305-L307 PolarHBondContact O-N 2.86Å; L307-C309 VanDerWaalsContact C-N 3.27Å; L307-C309 PolarHBondContact O-N 3.14Å; L307-A342 HydrophobicContact CD2-CB 4.06Å; L307-Y351 HydrophobicContact CD1-CD2 4.14Å; L307-Y351 HydrophobicContact CD1-CE2 4.4Å
308	K	44.1	Very low	42.7	Very low	173 Å²	173	98.6 Å²	98.6	75%	0.752	48%	0.482	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.9	86.1	164	-80	-177	178.3	176.2	0	108.8	Y306	Y306-K308 PolarHBondContact O-N 3.11Å
309	C	38.2	Very low	42	Very low	16 Å²	16	95.5 Å²	95.5	11%	0.108	47%	0.472	C	S	.	.			trans	-80.6	119.6	166.9	-66.8	0	0	0	0	108.6	L307 E311	L307-C309 VanDerWaalsContact C-N 3.27Å; L307-C309 PolarHBondContact O-N 3.14Å; C309-E311 PolarHBondContact O-N 3.31Å
310	R	37.5	Very low	41.6	Very low	221 Å²	221	92.9 Å²	92.9	83%	0.834	46%	0.463	S	S	*	.			trans	-73.8	104.2	160.1	-82.7	-171.6	172.9	-170.1	-1.8	106.8	S312	R310-S312 PolarHBondContact O-N 3.1Å
311	E	33.3	Very low	41.1	Very low	66 Å²	66	97.1 Å²	97.1	31%	0.308	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-62.7	133.2	164.3	-75.3	-171.4	150.7	0	0	107.8	K296 C309	K296-E311 WeakPolarHBondContact CD-OE1 3.29Å; C309-E311 PolarHBondContact O-N 3.31Å
312	S	33.6	Very low	40.5	Very low	54 Å²	54	92.4 Å²	92.4	38%	0.378	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-56.7	150.4	167.2	-49	0	0	0	0	108.5	R310 L314 Q328	R310-S312 PolarHBondContact O-N 3.1Å; S312-L314 PolarHBondContact O-N 3.25Å; S312-Q328 PolarHBondContact OG-NE2 3.17Å
313	P	34.2	Very low	40.2	Very low	101 Å²	101	89.7 Å²	89.7	66%	0.656	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-47.3	134.7	177.2	-22.2	30.9	0	0	0	109.5	L315	P313-L315 VanDerWaalsContact C-N 3.25Å; P313-L315 PolarHBondContact O-N 2.89Å
314	L	34.2	Very low	39.2	Very low	148 Å²	148	91.2 Å²	91.2	78%	0.775	45%	0.446	S	S	*	.			trans	-59.8	94	173.4	-72.1	166.8	0	0	0	107.5	S312	S312-L314 PolarHBondContact O-N 3.25Å
315	L	33.9	Very low	38.6	Very low	77 Å²	77	86.6 Å²	86.6	40%	0.403	43%	0.427	S	S	.	.			trans	-72.4	142.4	176.5	-71.2	168.7	0	0	0	108.6	P313 A319 L327	P313-L315 VanDerWaalsContact C-N 3.25Å; P313-L315 PolarHBondContact O-N 2.89Å; L315-A319 HydrophobicContact CB-CB 4.4Å; L315-L327 HydrophobicContact CD1-CB 4.02Å; L315-L327 HydrophobicContact CD1-CD1 3.52Å; L315-L327 HydrophobicContact CD1-CG 4.42Å; L315-L327 HydrophobicContact CD2-CD1 3.72Å; L315-L327 HydrophobicContact CG-CD1 4.21Å
316	S	34.2	Very low	38.1	Very low	73 Å²	73	85.4 Å²	85.4	51%	0.51	42%	0.42	S	S	.	.			trans	-36.6	138.5	175.7	170.4	0	0	0	0	112.6	R318 A319	S316-R318 PolarHBondContact O-N 2.98Å; S316-R318 PolarHBondContact OG-N 3.32Å; S316-A319 PolarHBondContact O-N 3.27Å
317	E	37	Very low	37.5	Very low	130 Å²	130	80.6 Å²	80.6	61%	0.607	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	-15.3	172.5	-92.4	-179.3	161.8	0	0	113.3
318	R	33.3	Very low	37	Very low	141 Å²	141	83 Å²	83	53%	0.532	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-9.4	178.2	-64.5	-177.5	173.8	165.9	-0.5	115.4	S316 T320 Y378	S316-R318 PolarHBondContact O-N 2.98Å; S316-R318 PolarHBondContact OG-N 3.32Å; R318-T320 PolarHBondContact O-N 3.27Å; R318-T320 VanDerWaalsContact O-N 3.16Å; R318-Y378 HydrophobicContact CG-CE2 4.38Å; R318-Y378 PolarHBondContact NE-OH 2.85Å; R318-Y378 PolarHBondContact NH2-OH 3.12Å
319	A	34.6	Very low	36.9	Very low	23 Å²	23	81 Å²	81	19%	0.19	40%	0.403	C	S	.	.			trans	-79.4	100.5	-176.2	0	0	0	0	0	112	L315 S316 H323 I324	L315-A319 HydrophobicContact CB-CB 4.4Å; S316-A319 PolarHBondContact O-N 3.27Å; A319-H323 HydrophobicContact CB-CB 4.26Å; A319-I324 HydrophobicContact CB-CG1 4.16Å
320	T	42.4	Very low	36.9	Very low	47 Å²	47	83.3 Å²	83.3	29%	0.288	41%	0.414	S	S	.	.			trans	-55	154.8	170	73.8	0	0	0	0	111.8	R318 S322 H323 I324	R318-T320 PolarHBondContact O-N 3.27Å; R318-T320 VanDerWaalsContact O-N 3.16Å; T320-S322 PolarHBondContact O-N 3.24Å; T320-S322 VanDerWaalsContact O-N 3.09Å; T320-S322 PolarHBondContact OG1-OG 3.28Å; T320-H323 PolarHBondContact N-ND1 3.2Å; T320-H323 CarbonylContact O-C 3.59Å; T320-H323 WeakPolarHBondContact O-CA 3.47Å; T320-H323 WeakPolarHBondContact O-CB 3.34Å; T320-H323 PolarHBondContact O-N 3.5Å; T320-H323 PolarHBondContact OG1-CE1 2.96Å; T320-H323 PolarHBondContact OG1-ND1 3.16Å; T320-H323 PolarHBondContact OG1-NE2 3.21Å; T320-I324 PolarHBondContact O-N 2.81Å
321	R	35.6	Very low	36.9	Very low	99 Å²	99	78.5 Å²	78.5	37%	0.374	40%	0.404	S	S	.	.	H	α-helix	trans	-53.2	-32.5	179.2	-108	172.6	165.2	170.5	-9.5	115.2	H323 I324 D325 I367	R321-H323 VanDerWaalsContact C-N 3.3Å; R321-I324 HydrophobicContact CG-CD1 4.48Å; R321-I324 PolarHBondContact O-N 3.34Å; R321-D325 PolarHBondContact O-N 3.31Å; R321-D325 VanDerWaalsContact O-N 3.12Å; R321-I367 VanDerWaalsContact NH1-CD1 3.34Å
322	S	37.6	Very low	36.9	Very low	58 Å²	58	79.8 Å²	79.8	41%	0.406	41%	0.414	S	S	.	.	H	α-helix	trans	-66.8	-32.6	170.8	47.9	0	0	0	0	112.6	T320 L326	T320-S322 PolarHBondContact O-N 3.24Å; T320-S322 VanDerWaalsContact O-N 3.09Å; T320-S322 PolarHBondContact OG1-OG 3.28Å; S322-L326 WeakPolarHBondContact O-CB 3.45Å; S322-L326 WeakPolarHBondContact O-CD1 3.46Å; S322-L326 PolarHBondContact O-N 2.98Å
323	H	38.6	Very low	37	Very low	38 Å²	38	80.5 Å²	80.5	18%	0.176	42%	0.422	C	S	.	.	H	α-helix	trans	-72.7	-32.3	174.2	-52.6	150.1	0	0	0	112	L27 R166 A319 T320 R321 L326 L327	L27-H323 HydrophobicContact CD1-CB 4.12Å; R166-H323 PolarHBondContact NH2-NE2 2.96Å; A319-H323 HydrophobicContact CB-CB 4.26Å; T320-H323 PolarHBondContact N-ND1 3.2Å; T320-H323 CarbonylContact O-C 3.59Å; T320-H323 WeakPolarHBondContact O-CA 3.47Å; T320-H323 WeakPolarHBondContact O-CB 3.34Å; T320-H323 PolarHBondContact O-N 3.5Å; T320-H323 PolarHBondContact OG1-CE1 2.96Å; T320-H323 PolarHBondContact OG1-ND1 3.16Å; T320-H323 PolarHBondContact OG1-NE2 3.21Å; R321-H323 VanDerWaalsContact C-N 3.3Å; H323-L326 VanDerWaalsContact O-CB 3.26Å; H323-L326 WeakPolarHBondContact O-CB 3.45Å; H323-L326 PolarHBondContact O-N 3.26Å; H323-L327 WeakPolarHBondContact O-CG 3.48Å; H323-L327 PolarHBondContact O-N 3.49Å; H323-L327 VanDerWaalsContact O-N 3.1Å
324	I	39.8	Very low	37	Very low	61 Å²	61	77.7 Å²	77.7	31%	0.313	41%	0.405	S	S	.	.	H	α-helix	trans	-68.9	-45.2	174.5	-60.6	172.8	0	0	0	111.3	A319 T320 R321 L326 L327 Q328	A319-I324 HydrophobicContact CB-CG1 4.16Å; T320-I324 PolarHBondContact O-N 2.81Å; R321-I324 HydrophobicContact CG-CD1 4.48Å; R321-I324 PolarHBondContact O-N 3.34Å; I324-L326 PolarHBondContact O-N 3.36Å; I324-L327 PolarHBondContact O-N 3.1Å; I324-Q328 WeakPolarHBondContact O-CB 3.07Å; I324-Q328 WeakPolarHBondContact O-CG 3.3Å; I324-Q328 PolarHBondContact O-N 2.89Å
325	D	41.7	Very low	36.7	Very low	66 Å²	66	75.4 Å²	75.4	35%	0.353	40%	0.398	S	S	.	.	H	α-helix	trans	-64.7	-30.7	177.7	-152.1	40.7	0	0	0	111.5	R321 R329	R321-D325 PolarHBondContact O-N 3.31Å; R321-D325 VanDerWaalsContact O-N 3.12Å; D325-R329 WeakPolarHBondContact O-CG 3.16Å; D325-R329 PolarHBondContact O-N 3.47Å; D325-R329 IonicContact OD1-NH2 3.89Å; D325-R329 IonicContact OD2-CZ 2.89Å; D325-R329 VanDerWaalsContact OD2-CZ 3.29Å; D325-R329 IonicContact OD2-NH1 2.79Å; D325-R329 IonicContact OD2-NH2 2.65Å; D325-R329 PolarHBondContact OD2-NH2 3.27Å
326	L	37.1	Very low	36.4	Very low	34 Å²	34	76 Å²	76	18%	0.178	41%	0.408	C	S	.	.	H	α-helix	trans	-64	-52.4	172.5	-114.7	100.5	0	0	0	112.7	L27 Y127 S322 H323 I324 Q328 R329 L330	L27-L326 HydrophobicContact CD1-CD2 4.14Å; L27-L326 HydrophobicContact CD2-CD2 3.96Å; L27-L326 HydrophobicContact CG-CD2 4.48Å; Y127-L326 HydrophobicContact CD1-CD2 4.16Å; Y127-L326 HydrophobicContact CE1-CD1 3.67Å; Y127-L326 HydrophobicContact CE1-CD2 3.21Å; Y127-L326 HydrophobicContact CE1-CG 3.37Å; Y127-L326 HydrophobicContact CE2-CD2 4.02Å; Y127-L326 WeakPolarHBondContact OH-CD2 3.46Å; Y127-L326 WeakPolarHBondContact OH-CG 3.49Å; S322-L326 WeakPolarHBondContact O-CB 3.45Å; S322-L326 WeakPolarHBondContact O-CD1 3.46Å; S322-L326 PolarHBondContact O-N 2.98Å; H323-L326 VanDerWaalsContact O-CB 3.26Å; H323-L326 WeakPolarHBondContact O-CB 3.45Å; H323-L326 PolarHBondContact O-N 3.26Å; I324-L326 PolarHBondContact O-N 3.36Å; L326-Q328 VanDerWaalsContact C-N 3.32Å; L326-Q328 PolarHBondContact O-N 3.16Å; L326-R329 PolarHBondContact O-N 3.01Å; L326-L330 PolarHBondContact O-N 3.08Å; L326-L330 VanDerWaalsContact O-N 3.16Å
327	L	38.2	Very low	36.2	Very low	51 Å²	51	77.3 Å²	77.3	27%	0.267	41%	0.406	S	S	.	.	H	α-helix	trans	-70.3	-31.2	-177.5	-71.7	164.7	0	0	0	111.8	L315 H323 I324 N331	L315-L327 HydrophobicContact CD1-CB 4.02Å; L315-L327 HydrophobicContact CD1-CD1 3.52Å; L315-L327 HydrophobicContact CD1-CG 4.42Å; L315-L327 HydrophobicContact CD2-CD1 3.72Å; L315-L327 HydrophobicContact CG-CD1 4.21Å; H323-L327 WeakPolarHBondContact O-CG 3.48Å; H323-L327 PolarHBondContact O-N 3.49Å; H323-L327 VanDerWaalsContact O-N 3.1Å; I324-L327 PolarHBondContact O-N 3.1Å; L327-N331 WeakPolarHBondContact O-CB 3.4Å; L327-N331 PolarHBondContact O-N 3.29Å; L327-N331 PolarHBondContact O-ND2 3.23Å
328	Q	38.7	Very low	35.9	Very low	65 Å²	65	75.8 Å²	75.8	30%	0.304	41%	0.407	S	S	.	.	H	α-helix	trans	-69	-34.8	172.8	-75.6	-176.3	-17	0	0	112.9	S312 I324 L326 N332	S312-Q328 PolarHBondContact OG-NE2 3.17Å; I324-Q328 WeakPolarHBondContact O-CB 3.07Å; I324-Q328 WeakPolarHBondContact O-CG 3.3Å; I324-Q328 PolarHBondContact O-N 2.89Å; L326-Q328 VanDerWaalsContact C-N 3.32Å; L326-Q328 PolarHBondContact O-N 3.16Å; Q328-N332 PolarHBondContact O-N 2.92Å
329	R	41.5	Very low	35.8	Very low	133 Å²	133	72.8 Å²	72.8	50%	0.502	41%	0.408	S	S	.	.	H	α-helix	trans	-75.4	-27.9	176.2	-76.5	-177.4	-173.9	135.7	16.9	114.2	D325 L326	D325-R329 WeakPolarHBondContact O-CG 3.16Å; D325-R329 PolarHBondContact O-N 3.47Å; D325-R329 IonicContact OD1-NH2 3.89Å; D325-R329 IonicContact OD2-CZ 2.89Å; D325-R329 VanDerWaalsContact OD2-CZ 3.29Å; D325-R329 IonicContact OD2-NH1 2.79Å; D325-R329 IonicContact OD2-NH2 2.65Å; D325-R329 PolarHBondContact OD2-NH2 3.27Å; L326-R329 PolarHBondContact O-N 3.01Å
330	L	38.1	Very low	35.9	Very low	63 Å²	63	76.1 Å²	76.1	33%	0.33	42%	0.421	S	S	.	.	H	α-helix	trans	-80.6	-33.5	177.9	-73.5	168.5	0	0	0	112.6	L326	L326-L330 PolarHBondContact O-N 3.08Å; L326-L330 VanDerWaalsContact O-N 3.16Å
331	N	38.3	Very low	35.9	Very low	120 Å²	120	76.5 Å²	76.5	64%	0.642	42%	0.421	S	S	*	.	H	α-helix	trans	-92	-18.4	-176.6	-73.8	-36.6	0	0	0	114.7	L327	L327-N331 WeakPolarHBondContact O-CB 3.4Å; L327-N331 PolarHBondContact O-N 3.29Å; L327-N331 PolarHBondContact O-ND2 3.23Å
332	N	33.3	Very low	36.3	Very low	94 Å²	94	72.9 Å²	72.9	50%	0.503	41%	0.413	S	S	.	.	S	Bend	trans	-125.4	123.1	176.6	-67.3	-41	0	0	0	110.2	Q328 S334	Q328-N332 PolarHBondContact O-N 2.92Å; N332-S334 PolarHBondContact O-N 2.84Å
333	A	35.3	Very low	36.8	Very low	68 Å²	68	73.1 Å²	73.1	56%	0.562	41%	0.411	S	S	*	.			trans	-51.9	117.1	172.5	0	0	0	0	0	109.2	T335	A333-T335 VanDerWaalsContact C-N 3.27Å; A333-T335 PolarHBondContact O-N 2.98Å
334	S	32.8	Very low	37.1	Very low	42 Å²	42	71.5 Å²	71.5	29%	0.294	40%	0.404	S	S	.	.			trans	-52.9	84.3	179.3	42.3	0	0	0	0	112.3	N248 N332	N248-S334 WeakPolarHBondContact CB-OG 3.16Å; N248-S334 PolarHBondContact O-OG 3.03Å; N332-S334 PolarHBondContact O-N 2.84Å
335	T	29.4	Very low	37.5	Very low	101 Å²	101	73.8 Å²	73.8	62%	0.62	43%	0.425	S	S	*	.			trans	-91.8	123.5	147.4	42.2	0	0	0	0	105.5	A333	A333-T335 VanDerWaalsContact C-N 3.27Å; A333-T335 PolarHBondContact O-N 2.98Å
336	S	26.6	Very low	37.9	Very low	88 Å²	88	77.2 Å²	77.2	62%	0.615	44%	0.439	S	S	*	.	S	Bend	trans	-5.1	133.5	162.1	51.3	0	0	0	0	116.9
337	E	29.3	Very low	39.1	Very low	102 Å²	102	77.9 Å²	77.9	48%	0.477	45%	0.446	S	S	.	.	S	Bend	trans	71.3	141.5	175.4	-57.5	-177.3	134.8	0	0	113.9	S339 K350	E337-S339 VanDerWaalsContact C-N 3.35Å; E337-S339 PolarHBondContact O-N 2.8Å; E337-K350 IonicContact OE2-NZ 3.29Å
338	P	31.7	Very low	39.6	Very low	97 Å²	97	81.7 Å²	81.7	63%	0.63	47%	0.467	S	S	*	.			trans	-54.8	107.9	166.7	24.1	-30.5	0	0	0	106.2	M340	P338-M340 PolarHBondContact O-N 2.67Å
339	S	31.9	Very low	39.8	Very low	79 Å²	79	83.4 Å²	83.4	55%	0.552	48%	0.478	S	S	*	.	S	Bend	trans	-74.1	62.7	-176.3	52.7	0	0	0	0	110	E337 N341	E337-S339 VanDerWaalsContact C-N 3.35Å; E337-S339 PolarHBondContact O-N 2.8Å; S339-N341 PolarHBondContact O-N 2.82Å
340	M	37	Very low	40.2	Very low	92 Å²	92	81.4 Å²	81.4	45%	0.453	47%	0.473	S	S	.	.			trans	-85.2	37.9	140.9	-71.7	-98.3	-168.1	0	0	108.4	P338 A342	P338-M340 PolarHBondContact O-N 2.67Å; M340-A342 PolarHBondContact O-N 2.92Å
341	N	41	Very low	40.3	Very low	56 Å²	56	82.4 Å²	82.4	30%	0.299	47%	0.473	S	S	.	.			trans	-75.6	62.9	165.9	-75.4	-23.4	0	0	0	107.8	S339 V343	S339-N341 PolarHBondContact O-N 2.82Å; N341-V343 PolarHBondContact O-N 2.82Å
342	A	44.5	Very low	40.2	Very low	23 Å²	23	82.3 Å²	82.3	19%	0.19	46%	0.464	C	S	.	.			trans	-72.1	109.5	162.5	0	0	0	0	0	105.6	L307 M340 Y351	L307-A342 HydrophobicContact CD2-CB 4.06Å; M340-A342 PolarHBondContact O-N 2.92Å; A342-Y351 WeakPolarHBondContact O-CB 2.93Å; A342-Y351 PolarHBondContact O-N 2.85Å
343	V	47.1	Very low	40.4	Very low	62 Å²	62	80.8 Å²	80.8	38%	0.376	46%	0.46	S	S	.	.	B	Isolated β-bridge	trans	-94.8	124.9	174.8	-175.9	0	0	0	0	106.3	N341 S345 N348 K350	N341-V343 PolarHBondContact O-N 2.82Å; V343-S345 PolarHBondContact O-N 3.12Å; V343-S345 VanDerWaalsContact O-N 3.17Å; V343-N348 HydrophobicContact CG1-CB 4.49Å; V343-K350 HydrophobicContact CG2-CG 4.25Å
344	C	45.4	Very low	40.5	Very low	4 Å²	4	83 Å²	83	3%	0.027	47%	0.465	C	S	.	.			trans	-63.2	120.7	169.7	166	0	0	0	0	107.1	C300 C303 Q346 C347 N348 L349	C300-C344 HydrophobicContact CB-CB 4.39Å; C303-C344 WeakPolarHBondContact CB-SG 3.42Å; C303-C344 WeakPolarHBondContact SG-CB 3.31Å; C303-C344 CovalentContact SG-SG 2.11Å; C303-C344 PolarHBondContact SG-SG 2.98Å; C344-Q346 PolarHBondContact O-N 3.08Å; C344-Q346 VanDerWaalsContact O-N 3.1Å; C344-Q346 PolarHBondContact SG-N 3.33Å; C344-C347 WeakPolarHBondContact CB-SG 3.45Å; C344-C347 PolarHBondContact O-N 2.83Å; C344-C347 PolarHBondContact SG-SG 3.16Å; C344-N348 WeakPolarHBondContact O-CA 3.4Å; C344-N348 PolarHBondContact O-N 2.83Å; C344-L349 PolarHBondContact N-O 3.36Å
345	S	49.1	Very low	40.8	Very low	109 Å²	109	84.5 Å²	84.5	76%	0.762	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-21.9	-178.9	45.9	0	0	0	0	113.4	V343	V343-S345 PolarHBondContact O-N 3.12Å; V343-S345 VanDerWaalsContact O-N 3.17Å
346	Q	49.5	Very low	41.2	Very low	138 Å²	138	82.4 Å²	82.4	65%	0.645	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-40.3	177.8	-63.5	-165.1	-0.4	0	0	113.9	C303 D305 C344	C303-Q346 HydrophobicContact CB-CB 4.42Å; D305-Q346 WeakPolarHBondContact OD2-CG 3.39Å; D305-Q346 PolarHBondContact OD2-NE2 2.9Å; C344-Q346 PolarHBondContact O-N 3.08Å; C344-Q346 VanDerWaalsContact O-N 3.1Å; C344-Q346 PolarHBondContact SG-N 3.33Å
347	C	61.7	Low	41.6	Very low	48 Å²	48	85.4 Å²	85.4	32%	0.324	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	0.3	-172.8	66.8	0	0	0	0	115	C344 L349	C344-C347 WeakPolarHBondContact CB-SG 3.45Å; C344-C347 PolarHBondContact O-N 2.83Å; C344-C347 PolarHBondContact SG-SG 3.16Å; C347-L349 HydrophobicContact CB-CD1 4.13Å; C347-L349 PolarHBondContact O-N 3.4Å
348	N	49	Very low	42.1	Very low	132 Å²	132	83.1 Å²	83.1	71%	0.706	46%	0.457	S	S	*	.			trans	54.7	10.7	-178.8	-96.1	-18.8	0	0	0	115.5	V343 C344 K350	V343-N348 HydrophobicContact CG1-CB 4.49Å; C344-N348 WeakPolarHBondContact O-CA 3.4Å; C344-N348 PolarHBondContact O-N 2.83Å; N348-K350 PolarHBondContact O-N 3.5Å
349	L	44.5	Very low	42.5	Very low	100 Å²	100	80.8 Å²	80.8	52%	0.524	44%	0.443	S	S	.	.			trans	-71.7	122.8	175	-92.9	128.6	0	0	0	109.9	C344 C347	C344-L349 PolarHBondContact N-O 3.36Å; C347-L349 HydrophobicContact CB-CD1 4.13Å; C347-L349 PolarHBondContact O-N 3.4Å
350	K	48.7	Very low	43	Very low	91 Å²	91	84.8 Å²	84.8	40%	0.396	45%	0.453	S	S	.	.	B	Isolated β-bridge	trans	-68.7	125.4	169.2	-77.9	-177	175.6	-173.2	0	109.4	E337 V343 N348 Y352	E337-K350 IonicContact OE2-NZ 3.29Å; V343-K350 HydrophobicContact CG2-CG 4.25Å; N348-K350 PolarHBondContact O-N 3.5Å; K350-Y352 HydrophobicContact CB-CD2 4.07Å; K350-Y352 HydrophobicContact CB-CE2 3.6Å; K350-Y352 HydrophobicContact CD-CE2 4.14Å; K350-Y352 WeakPolarHBondContact CD-OH 3.34Å; K350-Y352 WeakPolarHBondContact O-CD2 3.42Å; K350-Y352 PolarHBondContact O-N 3.34Å
351	Y	39.8	Very low	43.3	Very low	85 Å²	85	87.8 Å²	87.8	33%	0.333	47%	0.466	S	S	.	.			trans	-73.3	94.7	171.3	-155.5	-89.2	0	0	0	109.6	L307 A342	L307-Y351 HydrophobicContact CD1-CD2 4.14Å; L307-Y351 HydrophobicContact CD1-CE2 4.4Å; A342-Y351 WeakPolarHBondContact O-CB 2.93Å; A342-Y351 PolarHBondContact O-N 2.85Å
352	Y	36.6	Very low	43.5	Very low	118 Å²	118	88.5 Å²	88.5	46%	0.463	47%	0.467	S	S	.	.			trans	-80.1	122.9	169.1	-72.2	-82.9	0	0	0	108.6	K350 V354	K350-Y352 HydrophobicContact CB-CD2 4.07Å; K350-Y352 HydrophobicContact CB-CE2 3.6Å; K350-Y352 HydrophobicContact CD-CE2 4.14Å; K350-Y352 WeakPolarHBondContact CD-OH 3.34Å; K350-Y352 WeakPolarHBondContact O-CD2 3.42Å; K350-Y352 PolarHBondContact O-N 3.34Å; Y352-V354 PolarHBondContact O-N 3.44Å
353	P	37.2	Very low	43.5	Very low	62 Å²	62	92.5 Å²	92.5	40%	0.403	48%	0.477	S	S	.	.			trans	-59.2	128.8	168.2	24.6	-29.6	0	0	0	107.4	H355 S356	P353-H355 PolarHBondContact O-N 2.93Å; P353-S356 PolarHBondContact O-N 2.88Å
354	V	37.6	Very low	43.3	Very low	113 Å²	113	92.6 Å²	92.6	69%	0.685	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-47.6	-6.5	-174.9	179	0	0	0	0	114.9	Y352 S356	Y352-V354 PolarHBondContact O-N 3.44Å; V354-S356 VanDerWaalsContact C-N 3.34Å; V354-S356 PolarHBondContact O-N 3.15Å
355	H	38.6	Very low	43.5	Very low	74 Å²	74	99.4 Å²	99.4	34%	0.343	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-80.5	-0.5	176.6	-56.8	-43.7	0	0	0	115.2	P353 N357 R363	P353-H355 PolarHBondContact O-N 2.93Å; H355-N357 PolarHBondContact O-N 3.48Å; H355-R363 VanDerWaalsContact O-CZ 3.29Å; H355-R363 PolarHBondContact O-NE 3.44Å; H355-R363 PolarHBondContact O-NH2 3.02Å
356	S	38.7	Very low	43.5	Very low	57 Å²	57	96 Å²	96	40%	0.399	48%	0.484	S	S	.	.	G	3₁₀ helix	trans	-65.5	-31.8	-175.8	66.4	0	0	0	0	114.2	P353 V354 R363	P353-S356 PolarHBondContact O-N 2.88Å; V354-S356 VanDerWaalsContact C-N 3.34Å; V354-S356 PolarHBondContact O-N 3.15Å; S356-R363 PolarHBondContact O-NH2 3.02Å
357	N	35.8	Very low	43.4	Very low	151 Å²	151	92.2 Å²	92.2	81%	0.807	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-105.4	4.9	-169.6	-61.8	-1.8	0	0	0	114.6	H355	H355-N357 PolarHBondContact O-N 3.48Å
358	L	39.3	Very low	42.9	Very low	54 Å²	54	96.5 Å²	96.5	28%	0.283	48%	0.483	S	S	.	.	S	Bend	trans	-80.3	129.9	179.1	-71.4	169.9	0	0	0	110.3	H362 R363	L358-H362 HydrophobicContact CB-CB 4.31Å; L358-H362 HydrophobicContact CD2-CB 4.21Å; L358-R363 HydrophobicContact CB-CG 3.92Å
359	C	40.5	Very low	42.9	Very low	49 Å²	49	96.1 Å²	96.1	33%	0.331	48%	0.478	S	S	.	.			trans	-56.5	151.6	173.6	95.1	0	0	0	0	110.4	Q361 H362 R363	C359-Q361 PolarHBondContact O-N 2.94Å; C359-H362 PolarHBondContact O-N 2.97Å; C359-R363 PolarHBondContact O-N 3.41Å
360	E	42.4	Very low	43.4	Very low	163 Å²	163	95.4 Å²	95.4	76%	0.762	47%	0.471	S	S	*	.	H	α-helix	trans	-52.8	-33.9	-175.9	-78.6	-171.7	145.4	0	0	113.5	S364	E360-S364 VanDerWaalsContact O-CB 3.28Å; E360-S364 WeakPolarHBondContact O-CB 3.41Å; E360-S364 PolarHBondContact O-N 3.5Å; E360-S364 PolarHBondContact O-OG 2.86Å
361	Q	41.8	Very low	43.3	Very low	155 Å²	155	94.6 Å²	94.6	72%	0.724	47%	0.471	S	S	*	.	H	α-helix	trans	-66.4	-43.6	176	-65.9	-176.6	-8	0	0	111.7	C359 S364 K365	C359-Q361 PolarHBondContact O-N 2.94Å; Q361-S364 PolarHBondContact O-N 3.23Å; Q361-K365 WeakPolarHBondContact O-CB 3.42Å; Q361-K365 PolarHBondContact O-N 3.05Å
362	H	45.6	Very low	43.7	Very low	70 Å²	70	92.4 Å²	92.4	32%	0.324	47%	0.474	S	S	.	.	H	α-helix	trans	-69.4	-41.5	178.1	-161.4	115.1	0	0	0	111	L358 C359 S364 K365 V366	L358-H362 HydrophobicContact CB-CB 4.31Å; L358-H362 HydrophobicContact CD2-CB 4.21Å; C359-H362 PolarHBondContact O-N 2.97Å; H362-S364 PolarHBondContact O-N 3.45Å; H362-K365 PolarHBondContact O-N 2.93Å; H362-V366 WeakPolarHBondContact O-CG2 3.46Å; H362-V366 PolarHBondContact O-N 2.8Å
363	R	45.7	Very low	44.6	Very low	108 Å²	108	91 Å²	91	41%	0.408	47%	0.473	S	S	.	.	H	α-helix	trans	-54.1	-54.3	170.5	-85.1	-174.5	174.9	170	3.6	110.4	H355 S356 L358 C359 K365 V366 I367	H355-R363 VanDerWaalsContact O-CZ 3.29Å; H355-R363 PolarHBondContact O-NE 3.44Å; H355-R363 PolarHBondContact O-NH2 3.02Å; S356-R363 PolarHBondContact O-NH2 3.02Å; L358-R363 HydrophobicContact CB-CG 3.92Å; C359-R363 PolarHBondContact O-N 3.41Å; R363-K365 VanDerWaalsContact C-N 3.26Å; R363-K365 PolarHBondContact O-N 3.36Å; R363-V366 PolarHBondContact O-N 3.24Å; R363-V366 VanDerWaalsContact O-N 3.12Å; R363-I367 WeakPolarHBondContact O-CG1 3.29Å; R363-I367 PolarHBondContact O-N 2.89Å
364	S	42.9	Very low	45.2	Very low	63 Å²	63	93 Å²	93	44%	0.441	48%	0.477	S	S	.	.	H	α-helix	trans	-55.8	-40.7	-179.7	-63	0	0	0	0	112.3	E360 Q361 H362 I367 Q368	E360-S364 VanDerWaalsContact O-CB 3.28Å; E360-S364 WeakPolarHBondContact O-CB 3.41Å; E360-S364 PolarHBondContact O-N 3.5Å; E360-S364 PolarHBondContact O-OG 2.86Å; Q361-S364 PolarHBondContact O-N 3.23Å; H362-S364 PolarHBondContact O-N 3.45Å; S364-I367 PolarHBondContact O-N 3.03Å; S364-Q368 WeakPolarHBondContact O-CB 3.39Å; S364-Q368 WeakPolarHBondContact O-CG 3.5Å; S364-Q368 PolarHBondContact O-N 2.73Å
365	K	48.6	Very low	45.8	Very low	148 Å²	148	90.6 Å²	90.6	64%	0.643	47%	0.469	S	S	*	.	H	α-helix	trans	-66.1	-43.6	177.5	-140.8	176.2	-173.6	-177.3	0	112.4	Q361 H362 R363 I367 Q368 M369	Q361-K365 WeakPolarHBondContact O-CB 3.42Å; Q361-K365 PolarHBondContact O-N 3.05Å; H362-K365 PolarHBondContact O-N 2.93Å; R363-K365 VanDerWaalsContact C-N 3.26Å; R363-K365 PolarHBondContact O-N 3.36Å; K365-I367 VanDerWaalsContact C-N 3.33Å; K365-Q368 PolarHBondContact O-N 2.74Å; K365-M369 WeakPolarHBondContact O-CB 3.42Å; K365-M369 PolarHBondContact O-N 2.98Å
366	V	48.4	Very low	46.5	Very low	36 Å²	36	91.2 Å²	91.2	22%	0.218	47%	0.473	C	S	.	.	H	α-helix	trans	-65.2	-37.6	174.4	173.6	0	0	0	0	111.1	H362 R363 M369 K370	H362-V366 WeakPolarHBondContact O-CG2 3.46Å; H362-V366 PolarHBondContact O-N 2.8Å; R363-V366 PolarHBondContact O-N 3.24Å; R363-V366 VanDerWaalsContact O-N 3.12Å; V366-M369 PolarHBondContact O-N 2.85Å; V366-K370 WeakPolarHBondContact O-CG 3.48Å; V366-K370 PolarHBondContact O-N 3.46Å
367	I	48.3	Very low	47.6	Very low	59 Å²	59	91.1 Å²	91.1	30%	0.303	47%	0.468	S	S	.	.	H	α-helix	trans	-62.3	-49.8	173.8	-50.3	-142.3	0	0	0	110.2	R321 R363 S364 K365 M369 K370 L371	R321-I367 VanDerWaalsContact NH1-CD1 3.34Å; R363-I367 WeakPolarHBondContact O-CG1 3.29Å; R363-I367 PolarHBondContact O-N 2.89Å; S364-I367 PolarHBondContact O-N 3.03Å; K365-I367 VanDerWaalsContact C-N 3.33Å; I367-M369 VanDerWaalsContact C-N 3.29Å; I367-M369 PolarHBondContact O-N 2.8Å; I367-K370 PolarHBondContact O-N 3.14Å; I367-L371 HydrophobicContact CG2-CD1 3.79Å; I367-L371 HydrophobicContact CG2-CG 4.23Å; I367-L371 WeakPolarHBondContact O-CB 3.3Å; I367-L371 WeakPolarHBondContact O-CG 3.48Å; I367-L371 PolarHBondContact O-N 2.96Å
368	Q	49.9	Very low	48.3	Very low	138 Å²	138	86.6 Å²	86.6	65%	0.645	44%	0.44	S	S	*	.	H	α-helix	trans	-58.7	-41.5	177.8	-78.1	177.1	-7.3	0	0	111.9	S364 K365 L371 G372	S364-Q368 WeakPolarHBondContact O-CB 3.39Å; S364-Q368 WeakPolarHBondContact O-CG 3.5Å; S364-Q368 PolarHBondContact O-N 2.73Å; K365-Q368 PolarHBondContact O-N 2.74Å; Q368-L371 PolarHBondContact O-N 2.79Å; Q368-G372 PolarHBondContact O-N 3.04Å
369	M	51	Low	48.9	Very low	125 Å²	125	88.2 Å²	88.2	62%	0.616	44%	0.443	S	S	*	.	H	α-helix	trans	-65.4	-43.8	178.6	-158.5	176.9	95.6	0	0	111.8	K365 V366 I367 G372 I373	K365-M369 WeakPolarHBondContact O-CB 3.42Å; K365-M369 PolarHBondContact O-N 2.98Å; V366-M369 PolarHBondContact O-N 2.85Å; I367-M369 VanDerWaalsContact C-N 3.29Å; I367-M369 PolarHBondContact O-N 2.8Å; M369-G372 PolarHBondContact O-N 3.5Å; M369-I373 WeakPolarHBondContact O-CG1 3.48Å; M369-I373 PolarHBondContact O-N 3.03Å; M369-I373 VanDerWaalsContact O-N 3.08Å
370	K	54.3	Low	49.8	Very low	85 Å²	85	90 Å²	90	37%	0.37	44%	0.443	S	S	.	.	H	α-helix	trans	-63.5	-45.7	175.6	-74.9	-174.5	175.9	-172.7	0	112.2	V366 I367 G372 I373 E374	V366-K370 WeakPolarHBondContact O-CG 3.48Å; V366-K370 PolarHBondContact O-N 3.46Å; I367-K370 PolarHBondContact O-N 3.14Å; K370-G372 VanDerWaalsContact C-N 3.28Å; K370-G372 PolarHBondContact O-N 2.85Å; K370-I373 PolarHBondContact O-N 2.98Å; K370-E374 WeakPolarHBondContact O-CG 2.95Å; K370-E374 PolarHBondContact O-N 2.87Å
371	L	45.4	Very low	51	Low	74 Å²	74	84.6 Å²	84.6	39%	0.387	42%	0.42	S	S	.	.	H	α-helix	trans	-61.7	-35.9	176.3	-71.3	172.4	0	0	0	112.2	I367 Q368 A375	I367-L371 HydrophobicContact CG2-CD1 3.79Å; I367-L371 HydrophobicContact CG2-CG 4.23Å; I367-L371 WeakPolarHBondContact O-CB 3.3Å; I367-L371 WeakPolarHBondContact O-CG 3.48Å; I367-L371 PolarHBondContact O-N 2.96Å; Q368-L371 PolarHBondContact O-N 2.79Å; L371-A375 VanDerWaalsContact O-CB 3.26Å; L371-A375 WeakPolarHBondContact O-CB 3.43Å; L371-A375 PolarHBondContact O-N 3.48Å
372	G	48.2	Very low	52.1	Low	38 Å²	38	81.6 Å²	81.6	39%	0.392	41%	0.409	S	S	.	.	H	α-helix	trans	-65.9	-41.3	174.9	0	0	0	0	0	112.8	Q368 M369 K370 M376	Q368-G372 PolarHBondContact O-N 3.04Å; M369-G372 PolarHBondContact O-N 3.5Å; K370-G372 VanDerWaalsContact C-N 3.28Å; K370-G372 PolarHBondContact O-N 2.85Å; G372-M376 VanDerWaalsContact O-CG 3.31Å; G372-M376 WeakPolarHBondContact O-CG 3.31Å; G372-M376 PolarHBondContact O-N 3.03Å
373	I	55.5	Low	52.7	Low	88 Å²	88	81.5 Å²	81.5	45%	0.451	41%	0.408	S	S	.	.	H	α-helix	trans	-66.4	-47.6	176.3	-66.3	165.9	0	0	0	110.6	M369 K370 A375 M376 D377	M369-I373 WeakPolarHBondContact O-CG1 3.48Å; M369-I373 PolarHBondContact O-N 3.03Å; M369-I373 VanDerWaalsContact O-N 3.08Å; K370-I373 PolarHBondContact O-N 2.98Å; I373-A375 VanDerWaalsContact C-N 3.32Å; I373-A375 PolarHBondContact O-N 2.98Å; I373-M376 WeakPolarHBondContact O-CB 3.4Å; I373-M376 PolarHBondContact O-N 3.45Å; I373-M376 VanDerWaalsContact O-N 3.12Å; I373-D377 PolarHBondContact O-N 3.14Å
374	E	51.5	Low	53.2	Low	106 Å²	106	80.6 Å²	80.6	50%	0.495	42%	0.419	S	S	.	.	H	α-helix	trans	-59.4	-42.2	177.3	-73.6	168.2	-172.5	0	0	111.6	K370 M376 D377 Y378	K370-E374 WeakPolarHBondContact O-CG 2.95Å; K370-E374 PolarHBondContact O-N 2.87Å; E374-M376 VanDerWaalsContact C-N 3.34Å; E374-M376 PolarHBondContact O-N 3.46Å; E374-D377 PolarHBondContact O-N 2.81Å; E374-Y378 WeakPolarHBondContact O-CB 3.36Å; E374-Y378 PolarHBondContact O-N 2.9Å
375	A	49.1	Very low	54.2	Low	61 Å²	61	81.5 Å²	81.5	50%	0.504	42%	0.416	S	S	.	.	H	α-helix	trans	-63.2	-38.7	175.4	0	0	0	0	0	112.6	L371 I373 Y379	L371-A375 VanDerWaalsContact O-CB 3.26Å; L371-A375 WeakPolarHBondContact O-CB 3.43Å; L371-A375 PolarHBondContact O-N 3.48Å; I373-A375 VanDerWaalsContact C-N 3.32Å; I373-A375 PolarHBondContact O-N 2.98Å; A375-Y379 WeakPolarHBondContact O-CB 3.33Å; A375-Y379 PolarHBondContact O-N 2.84Å
376	M	54.2	Low	54.7	Low	88 Å²	88	76.8 Å²	76.8	43%	0.433	39%	0.394	S	S	.	.	H	α-helix	trans	-68.3	-43	175.6	-74.4	-61.5	-52.5	0	0	111.9	G372 I373 E374 Y379 Y380	G372-M376 VanDerWaalsContact O-CG 3.31Å; G372-M376 WeakPolarHBondContact O-CG 3.31Å; G372-M376 PolarHBondContact O-N 3.03Å; I373-M376 WeakPolarHBondContact O-CB 3.4Å; I373-M376 PolarHBondContact O-N 3.45Å; I373-M376 VanDerWaalsContact O-N 3.12Å; E374-M376 VanDerWaalsContact C-N 3.34Å; E374-M376 PolarHBondContact O-N 3.46Å; M376-Y379 PolarHBondContact O-N 3.4Å; M376-Y380 HydrophobicContact CB-CE2 4.46Å; M376-Y380 HydrophobicContact CE-CD2 4.19Å; M376-Y380 HydrophobicContact CE-CE2 3.29Å; M376-Y380 VanDerWaalsContact CE-CZ 3.49Å; M376-Y380 WeakPolarHBondContact CE-OH 3.28Å; M376-Y380 WeakPolarHBondContact O-CD2 3.4Å; M376-Y380 PolarHBondContact O-N 2.87Å
377	D	60.2	Low	54.9	Low	55 Å²	55	79.4 Å²	79.4	29%	0.294	40%	0.404	S	S	.	.	H	α-helix	trans	-63.5	-43.1	177.4	-80.7	-29.7	0	0	0	111.6	I373 E374 Y380 N381 R390	I373-D377 PolarHBondContact O-N 3.14Å; E374-D377 PolarHBondContact O-N 2.81Å; D377-Y380 PolarHBondContact O-N 2.95Å; D377-N381 VanDerWaalsContact O-CB 3.29Å; D377-N381 WeakPolarHBondContact O-CB 3.39Å; D377-N381 PolarHBondContact O-N 2.94Å; D377-N381 PolarHBondContact O-ND2 3.08Å; D377-R390 IonicContact OD1-CZ 3.7Å; D377-R390 IonicContact OD1-NH1 3.85Å; D377-R390 IonicContact OD1-NH2 2.68Å; D377-R390 PolarHBondContact OD1-NH2 2.86Å
378	Y	52.1	Low	55.2	Low	55 Å²	55	83.5 Å²	83.5	22%	0.216	42%	0.422	C	S	.	.	H	α-helix	trans	-59.7	-46	172.7	-178.5	-95.3	0	0	0	112	D177 R318 E374 Y380 N381 N382	D177-Y378 PolarHBondContact OD2-OH 3.29Å; R318-Y378 HydrophobicContact CG-CE2 4.38Å; R318-Y378 PolarHBondContact NE-OH 2.85Å; R318-Y378 PolarHBondContact NH2-OH 3.12Å; E374-Y378 WeakPolarHBondContact O-CB 3.36Å; E374-Y378 PolarHBondContact O-N 2.9Å; Y378-Y380 VanDerWaalsContact C-N 3.32Å; Y378-Y380 PolarHBondContact O-N 3.04Å; Y378-N381 PolarHBondContact O-N 2.75Å; Y378-N382 WeakPolarHBondContact CD2-ND2 3.5Å; Y378-N382 WeakPolarHBondContact CE2-ND2 3.38Å; Y378-N382 PolarHBondContact O-N 2.83Å
379	Y	52.1	Low	55.5	Low	88 Å²	88	82.6 Å²	82.6	35%	0.345	42%	0.416	S	S	.	.	H	α-helix	trans	-58.6	-45.6	178.1	-176.4	-99.3	0	0	0	111.3	A375 M376 H383 Y386	A375-Y379 WeakPolarHBondContact O-CB 3.33Å; A375-Y379 PolarHBondContact O-N 2.84Å; M376-Y379 PolarHBondContact O-N 3.4Å; Y379-H383 AromaticContact CD2-CE1 3.65Å; Y379-H383 AromaticContact CD2-ND1 3.74Å; Y379-H383 AromaticContact CE2-CE1 3.64Å; Y379-H383 AromaticContact CE2-ND1 3.88Å; Y379-H383 AromaticContact CE2-NE2 3.87Å; Y379-H383 WeakPolarHBondContact O-CB 3.48Å; Y379-H383 PolarHBondContact O-N 3.49Å; Y379-H383 PolarHBondContact O-ND1 2.85Å; Y379-Y386 HydrophobicContact CD1-CD2 4.28Å; Y379-Y386 HydrophobicContact CD1-CE2 4.2Å; Y379-Y386 AromaticContact CE1-CD2 3.71Å; Y379-Y386 HydrophobicContact CE1-CD2 3.71Å; Y379-Y386 AromaticContact CE1-CE2 3.21Å; Y379-Y386 HydrophobicContact CE1-CE2 3.21Å; Y379-Y386 AromaticContact CE1-CZ 3.74Å; Y379-Y386 AromaticContact CZ-CE2 3.53Å; Y379-Y386 WeakPolarHBondContact OH-CE2 3.25Å; Y379-Y386 PolarHBondContact OH-OH 2.76Å
380	Y	59.4	Low	55.3	Low	86 Å²	86	81.9 Å²	81.9	34%	0.337	41%	0.406	S	S	.	.	H	α-helix	trans	-69.5	-33.2	177.8	-71.3	-51.1	0	0	0	113.6	M376 D377 Y378 Y386	M376-Y380 HydrophobicContact CB-CE2 4.46Å; M376-Y380 HydrophobicContact CE-CD2 4.19Å; M376-Y380 HydrophobicContact CE-CE2 3.29Å; M376-Y380 VanDerWaalsContact CE-CZ 3.49Å; M376-Y380 WeakPolarHBondContact CE-OH 3.28Å; M376-Y380 WeakPolarHBondContact O-CD2 3.4Å; M376-Y380 PolarHBondContact O-N 2.87Å; D377-Y380 PolarHBondContact O-N 2.95Å; Y378-Y380 VanDerWaalsContact C-N 3.32Å; Y378-Y380 PolarHBondContact O-N 3.04Å; Y380-Y386 HydrophobicContact CD1-CD1 4.34Å; Y380-Y386 AromaticContact CD1-CG 3.95Å; Y380-Y386 HydrophobicContact CD1-CG 3.95Å; Y380-Y386 HydrophobicContact CE1-CD1 4.19Å; Y380-Y386 HydrophobicContact CE1-CG 4.25Å
381	N	67.7	Low	55.2	Low	51 Å²	51	84 Å²	84	27%	0.273	42%	0.422	S	S	.	.	H	α-helix	trans	-77.6	-29.7	179.9	-74.9	-14.8	0	0	0	113.1	D377 Y378 Q387 R390	D377-N381 VanDerWaalsContact O-CB 3.29Å; D377-N381 WeakPolarHBondContact O-CB 3.39Å; D377-N381 PolarHBondContact O-N 2.94Å; D377-N381 PolarHBondContact O-ND2 3.08Å; Y378-N381 PolarHBondContact O-N 2.75Å; N381-Q387 PolarHBondContact O-NE2 3.33Å; N381-R390 PolarHBondContact OD1-NH1 3.05Å
382	N	63	Low	55.4	Low	91 Å²	91	85.5 Å²	85.5	49%	0.487	43%	0.434	S	S	.	.	H	α-helix	trans	-99.4	-11.5	-176.4	-76.3	-37	0	0	0	115.4	Y378	Y378-N382 WeakPolarHBondContact CD2-ND2 3.5Å; Y378-N382 WeakPolarHBondContact CE2-ND2 3.38Å; Y378-N382 PolarHBondContact O-N 2.83Å
383	H	59.1	Low	55.5	Low	69 Å²	69	88 Å²	88	32%	0.319	44%	0.438	S	S	.	.			trans	-102.5	103.7	176.2	-70.5	77.7	0	0	0	109.2	Y379 Q385 Y386 Q387	Y379-H383 AromaticContact CD2-CE1 3.65Å; Y379-H383 AromaticContact CD2-ND1 3.74Å; Y379-H383 AromaticContact CE2-CE1 3.64Å; Y379-H383 AromaticContact CE2-ND1 3.88Å; Y379-H383 AromaticContact CE2-NE2 3.87Å; Y379-H383 WeakPolarHBondContact O-CB 3.48Å; Y379-H383 PolarHBondContact O-N 3.49Å; Y379-H383 PolarHBondContact O-ND1 2.85Å; H383-Q385 HydrophobicContact CB-CG 4.19Å; H383-Q385 PolarHBondContact O-N 2.85Å; H383-Y386 HydrophobicContact CB-CD2 3.6Å; H383-Y386 HydrophobicContact CB-CE2 4.15Å; H383-Y386 PolarHBondContact O-N 2.98Å; H383-Q387 PolarHBondContact O-N 3.22Å
384	S	55.8	Low	55	Low	89 Å²	89	88.4 Å²	88.4	62%	0.622	45%	0.45	S	S	*	.	H	α-helix	trans	-50.7	-33.3	-178.4	55.5	0	0	0	0	113.7	Y386 Q387 Q388	S384-Y386 PolarHBondContact O-N 2.81Å; S384-Q387 PolarHBondContact O-N 3.46Å; S384-Q388 PolarHBondContact O-N 2.88Å
385	Q	63.6	Low	54.2	Low	81 Å²	81	91.6 Å²	91.6	38%	0.379	46%	0.464	S	S	.	.	H	α-helix	trans	-60	-24.8	174.4	62.4	-176.8	-6	0	0	114.2	H383	H383-Q385 HydrophobicContact CB-CG 4.19Å; H383-Q385 PolarHBondContact O-N 2.85Å
386	Y	59.9	Low	53.5	Low	49 Å²	49	94.8 Å²	94.8	19%	0.192	47%	0.471	C	S	.	.	H	α-helix	trans	-102.5	-21.8	175.4	-57.2	-73.4	0	0	0	113.7	Y379 Y380 H383 S384 Q388 K389 R390	Y379-Y386 HydrophobicContact CD1-CD2 4.28Å; Y379-Y386 HydrophobicContact CD1-CE2 4.2Å; Y379-Y386 AromaticContact CE1-CD2 3.71Å; Y379-Y386 HydrophobicContact CE1-CD2 3.71Å; Y379-Y386 AromaticContact CE1-CE2 3.21Å; Y379-Y386 HydrophobicContact CE1-CE2 3.21Å; Y379-Y386 AromaticContact CE1-CZ 3.74Å; Y379-Y386 AromaticContact CZ-CE2 3.53Å; Y379-Y386 WeakPolarHBondContact OH-CE2 3.25Å; Y379-Y386 PolarHBondContact OH-OH 2.76Å; Y380-Y386 HydrophobicContact CD1-CD1 4.34Å; Y380-Y386 AromaticContact CD1-CG 3.95Å; Y380-Y386 HydrophobicContact CD1-CG 3.95Å; Y380-Y386 HydrophobicContact CE1-CD1 4.19Å; Y380-Y386 HydrophobicContact CE1-CG 4.25Å; H383-Y386 HydrophobicContact CB-CD2 3.6Å; H383-Y386 HydrophobicContact CB-CE2 4.15Å; H383-Y386 PolarHBondContact O-N 2.98Å; S384-Y386 PolarHBondContact O-N 2.81Å; Y386-Q388 PolarHBondContact O-N 2.82Å; Y386-K389 WeakPolarHBondContact O-CA 3.35Å; Y386-K389 WeakPolarHBondContact O-CB 3.01Å; Y386-K389 PolarHBondContact O-N 2.83Å; Y386-R390 PolarHBondContact O-N 2.79Å; Y386-R390 VanDerWaalsContact O-N 3.11Å
387	Q	53	Low	52.5	Low	92 Å²	92	96 Å²	96	43%	0.43	49%	0.488	S	S	.	.	H	α-helix	trans	-58.1	-39	170	-72.6	-171.3	-10.7	0	0	111.4	N381 H383 S384 K389 R390 N391	N381-Q387 PolarHBondContact O-NE2 3.33Å; H383-Q387 PolarHBondContact O-N 3.22Å; S384-Q387 PolarHBondContact O-N 3.46Å; Q387-K389 VanDerWaalsContact C-N 3.26Å; Q387-K389 PolarHBondContact O-N 3.08Å; Q387-R390 PolarHBondContact O-N 3.24Å; Q387-R390 VanDerWaalsContact O-N 3.08Å; Q387-N391 PolarHBondContact O-N 3.11Å
388	Q	54.7	Low	51.1	Low	144 Å²	144	101.5 Å²	101.5	67%	0.673	51%	0.51	S	S	*	.	H	α-helix	trans	-63.5	-30.2	174.8	-73.9	-175.8	-8.5	0	0	113	S384 Y386 T392	S384-Q388 PolarHBondContact O-N 2.88Å; Y386-Q388 PolarHBondContact O-N 2.82Å; Q388-T392 PolarHBondContact O-N 2.8Å; Q388-T392 PolarHBondContact O-OG1 2.75Å
389	K	55.6	Low	50.1	Low	120 Å²	120	104.5 Å²	104.5	52%	0.522	54%	0.536	S	S	.	.	H	α-helix	trans	-75.3	-24.8	173.5	-104.1	179	179	174.2	0	113.3	Y386 Q387 T392 N393	Y386-K389 WeakPolarHBondContact O-CA 3.35Å; Y386-K389 WeakPolarHBondContact O-CB 3.01Å; Y386-K389 PolarHBondContact O-N 2.83Å; Q387-K389 VanDerWaalsContact C-N 3.26Å; Q387-K389 PolarHBondContact O-N 3.08Å; K389-T392 WeakPolarHBondContact CA-OG1 3.03Å; K389-N393 PolarHBondContact O-ND2 2.87Å
390	R	47.8	Very low	49.1	Very low	109 Å²	109	107.3 Å²	107.3	41%	0.411	56%	0.557	S	S	.	*	H	α-helix	trans	-73.8	-42.2	170.7	-98.2	-174.7	169.4	172.3	-1.5	111.3	D377 N381 Y386 Q387 T392 N393	D377-R390 IonicContact OD1-CZ 3.7Å; D377-R390 IonicContact OD1-NH1 3.85Å; D377-R390 IonicContact OD1-NH2 2.68Å; D377-R390 PolarHBondContact OD1-NH2 2.86Å; N381-R390 PolarHBondContact OD1-NH1 3.05Å; Y386-R390 PolarHBondContact O-N 2.79Å; Y386-R390 VanDerWaalsContact O-N 3.11Å; Q387-R390 PolarHBondContact O-N 3.24Å; Q387-R390 VanDerWaalsContact O-N 3.08Å; R390-T392 VanDerWaalsContact C-N 3.29Å; R390-T392 PolarHBondContact O-N 2.79Å; R390-N393 PolarHBondContact O-N 2.86Å
391	N	50.5	Low	47.8	Very low	129 Å²	129	111 Å²	111	69%	0.69	58%	0.583	S	S	*	*	H	α-helix	trans	-72	-20.8	179.9	-70.6	-2.8	0	0	0	113.8	Q387 S394	Q387-N391 PolarHBondContact O-N 3.11Å; N391-S394 PolarHBondContact O-OG 2.82Å
392	T	51.6	Low	46.3	Very low	106 Å²	106	120.2 Å²	120.2	65%	0.65	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	-7.4	176.8	42.7	0	0	0	0	114.3	Q388 K389 R390	Q388-T392 PolarHBondContact O-N 2.8Å; Q388-T392 PolarHBondContact O-OG1 2.75Å; K389-T392 WeakPolarHBondContact CA-OG1 3.03Å; R390-T392 VanDerWaalsContact C-N 3.29Å; R390-T392 PolarHBondContact O-N 2.79Å
393	N	49	Very low	45.1	Very low	90 Å²	90	127.8 Å²	127.8	48%	0.481	64%	0.635	S	S	.	*	S	Bend	trans	-110.5	12.7	179.3	-75.8	-52.9	0	0	0	113.9	K389 R390 E395	K389-N393 PolarHBondContact O-ND2 2.87Å; R390-N393 PolarHBondContact O-N 2.86Å; N393-E395 PolarHBondContact O-N 2.95Å
394	S	44.5	Very low	43.7	Very low	98 Å²	98	131.8 Å²	131.8	69%	0.685	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	-5.4	178.5	48.1	0	0	0	0	114.5	N391	N391-S394 PolarHBondContact O-OG 2.82Å
395	E	35.1	Very low	42.9	Very low	172 Å²	172	133.7 Å²	133.7	80%	0.804	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	-1.6	179.3	-74.7	-170.9	157.1	0	0	115.7	N393 S397	N393-E395 PolarHBondContact O-N 2.95Å; E395-S397 PolarHBondContact O-N 3.33Å
396	I	35.6	Very low	41.6	Very low	128 Å²	128	139 Å²	139	66%	0.656	67%	0.669	S	S	*	*			trans	-97.4	71.8	178.9	-49.8	180	0	0	0	110.2	K398	I396-K398 PolarHBondContact O-N 3.14Å; I396-K398 VanDerWaalsContact O-N 3.08Å
397	S	32.8	Very low	40.6	Very low	113 Å²	113	141.1 Å²	141.1	79%	0.79	69%	0.691	S	S	*	*			trans	-71.9	80.1	156.8	47.5	0	0	0	0	109	E395	E395-S397 PolarHBondContact O-N 3.33Å
398	K	31	Very low	39.8	Very low	171 Å²	171	140.3 Å²	140.3	74%	0.743	69%	0.692	S	S	*	*			trans	-163.8	119.6	160	-105.7	161.9	-164.8	-176.1	0	108.7	I396 N400	I396-K398 PolarHBondContact O-N 3.14Å; I396-K398 VanDerWaalsContact O-N 3.08Å; K398-N400 PolarHBondContact O-N 2.62Å; K398-N400 VanDerWaalsContact O-N 3.15Å
399	P	30.5	Very low	38.8	Very low	118 Å²	118	137.3 Å²	137.3	77%	0.766	69%	0.685	S	S	*	*	S	Bend	trans	-76.3	105.1	173.5	31.6	-27.2	0	0	0	106.5
400	N	31.6	Very low	37.9	Very low	148 Å²	148	136.2 Å²	136.2	79%	0.791	69%	0.689	S	S	*	*	S	Bend	trans	156.6	136.8	158.9	-80.4	-24.5	0	0	0	108.1	K398	K398-N400 PolarHBondContact O-N 2.62Å; K398-N400 VanDerWaalsContact O-N 3.15Å
401	N	32.1	Very low	37.5	Very low	163 Å²	163	138.8 Å²	138.8	87%	0.872	71%	0.705	S	S	*	*			trans	91.7	42.1	179.3	-56.5	-19.7	0	0	0	118.1	R403	N401-R403 PolarHBondContact O-N 2.7Å
402	R	34.6	Very low	36.8	Very low	244 Å²	244	137.5 Å²	137.5	92%	0.921	70%	0.698	S	S	*	*			trans	-79.6	115.1	151.4	-77	-170.8	178.8	172.9	2.2	109.2	R404	R402-R404 PolarHBondContact O-N 3.36Å
403	R	39.2	Very low	35.9	Very low	250 Å²	250	137 Å²	137	94%	0.943	69%	0.688	S	S	*	*			trans	-46	129.3	175.9	-80.7	176.1	167.8	170.4	-4.2	110.8	N401	N401-R403 PolarHBondContact O-N 2.7Å
404	R	30.1	Very low	35.2	Very low	154 Å²	154	136.5 Å²	136.5	58%	0.581	69%	0.691	S	S	*	*			trans	-49	131.3	174.1	-90.1	179.4	175.4	163.7	-1.5	112.3	R402 Y406	R402-R404 PolarHBondContact O-N 3.36Å; R404-Y406 HydrophobicContact CB-CD2 4.08Å; R404-Y406 HydrophobicContact CB-CE2 3.84Å
405	D	37.3	Very low	34.7	Very low	129 Å²	129	141.5 Å²	141.5	69%	0.69	70%	0.695	S	S	*	*			trans	-85.5	113	148.7	-109.4	-30.1	0	0	0	107.8	S407	D405-S407 PolarHBondContact O-N 3.31Å; D405-S407 VanDerWaalsContact O-N 3.14Å
406	Y	37.1	Very low	34.8	Very low	191 Å²	191	137.4 Å²	137.4	75%	0.749	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	10.2	-179.3	-76	-83.9	0	0	0	113.8	R404	R404-Y406 HydrophobicContact CB-CD2 4.08Å; R404-Y406 HydrophobicContact CB-CE2 3.84Å
407	S	39.6	Very low	34.8	Very low	95 Å²	95	137.3 Å²	137.3	66%	0.664	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-9.3	-178.1	51.1	0	0	0	0	113.6	D405	D405-S407 PolarHBondContact O-N 3.31Å; D405-S407 VanDerWaalsContact O-N 3.14Å
408	V	35.5	Very low	34.9	Very low	75 Å²	75	138.7 Å²	138.7	46%	0.455	68%	0.676	S	S	.	*	S	Bend	trans	-95.1	124.6	177.1	-172.2	0	0	0	0	109.4	T410 L412	V408-T410 PolarHBondContact O-N 3.38Å; V408-L412 HydrophobicContact CG1-CB 4.08Å
409	P	33.9	Very low	35.2	Very low	81 Å²	81	135.2 Å²	135.2	53%	0.526	67%	0.669	S	S	.	*			trans	-55.9	127.1	173.8	-22.3	31.6	0	0	0	110.3	Q411 L412	P409-Q411 PolarHBondContact O-N 2.86Å; P409-L412 HydrophobicContact CB-CD1 4.46Å; P409-L412 HydrophobicContact CG-CD1 4.3Å; P409-L412 WeakPolarHBondContact O-CB 3.36Å; P409-L412 PolarHBondContact O-N 2.82Å
410	T	36.3	Very low	35.5	Very low	96 Å²	96	138.7 Å²	138.7	59%	0.589	67%	0.674	S	S	*	*	H	α-helix	trans	-51.9	-23.8	179.5	11.3	0	0	0	0	113.6	V408 L412 E413 C414	V408-T410 PolarHBondContact O-N 3.38Å; T410-L412 VanDerWaalsContact C-N 3.27Å; T410-L412 PolarHBondContact O-N 2.66Å; T410-E413 PolarHBondContact O-N 3.12Å; T410-C414 PolarHBondContact O-N 3.16Å
411	Q	39.1	Very low	35.7	Very low	164 Å²	164	135.9 Å²	135.9	77%	0.766	66%	0.659	S	S	*	*	H	α-helix	trans	-69.2	-19.6	175.6	-65.6	-177.4	-2.9	0	0	114.1	P409	P409-Q411 PolarHBondContact O-N 2.86Å
412	L	36.1	Very low	35.8	Very low	102 Å²	102	134.5 Å²	134.5	53%	0.534	65%	0.651	S	S	.	*	H	α-helix	trans	-82.3	-37.4	173.9	-97.8	127.5	0	0	0	112.2	V408 P409 T410 R415 V416	V408-L412 HydrophobicContact CG1-CB 4.08Å; P409-L412 HydrophobicContact CB-CD1 4.46Å; P409-L412 HydrophobicContact CG-CD1 4.3Å; P409-L412 WeakPolarHBondContact O-CB 3.36Å; P409-L412 PolarHBondContact O-N 2.82Å; T410-L412 VanDerWaalsContact C-N 3.27Å; T410-L412 PolarHBondContact O-N 2.66Å; L412-R415 PolarHBondContact O-N 3.13Å; L412-R415 VanDerWaalsContact O-N 3.16Å; L412-V416 WeakPolarHBondContact O-CG2 3.49Å; L412-V416 PolarHBondContact O-N 3.25Å
413	E	33.2	Very low	36	Very low	95 Å²	95	127.7 Å²	127.7	44%	0.444	64%	0.638	S	S	.	*	H	α-helix	trans	-64.9	-40.3	178.3	-82.6	-175.9	146.3	0	0	112.4	T410 R415 V416 N417	T410-E413 PolarHBondContact O-N 3.12Å; E413-R415 PolarHBondContact O-N 2.89Å; E413-V416 PolarHBondContact O-N 2.65Å; E413-N417 PolarHBondContact O-N 3.03Å
414	C	33.4	Very low	35.9	Very low	80 Å²	80	124.1 Å²	124.1	54%	0.541	63%	0.626	S	S	.	*	H	α-helix	trans	-61.9	-27.7	175.6	-67	0	0	0	0	112.4	T410 H418	T410-C414 PolarHBondContact O-N 3.16Å; C414-H418 PolarHBondContact O-CD2 2.79Å
415	R	34.9	Very low	36.1	Very low	203 Å²	203	123.6 Å²	123.6	77%	0.766	64%	0.635	S	S	*	*	H	α-helix	trans	-82.5	-23.3	178	-81.4	-177.8	166.4	171.1	-2.8	113.9	L412 E413	L412-R415 PolarHBondContact O-N 3.13Å; L412-R415 VanDerWaalsContact O-N 3.16Å; E413-R415 PolarHBondContact O-N 2.89Å
416	V	37.6	Very low	36.2	Very low	86 Å²	86	125.2 Å²	125.2	52%	0.521	64%	0.639	S	S	.	*	H	α-helix	trans	-83.1	-30.9	-179.1	175.4	0	0	0	0	111.5	L412 E413 H418 T419	L412-V416 WeakPolarHBondContact O-CG2 3.49Å; L412-V416 PolarHBondContact O-N 3.25Å; E413-V416 PolarHBondContact O-N 2.65Å; V416-H418 VanDerWaalsContact C-N 3.32Å; V416-H418 PolarHBondContact O-N 2.81Å; V416-T419 PolarHBondContact O-OG1 2.96Å
417	N	35.4	Very low	36.2	Very low	126 Å²	126	124.8 Å²	124.8	67%	0.674	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-75.5	-17.1	177.7	-71.4	-17.6	0	0	0	114	E413	E413-N417 PolarHBondContact O-N 3.03Å
418	H	35.2	Very low	36.1	Very low	142 Å²	142	122.7 Å²	122.7	66%	0.657	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-88.4	0.7	177.3	-67.4	-47.6	0	0	0	114.5	C414 V416 I421	C414-H418 PolarHBondContact O-CD2 2.79Å; V416-H418 VanDerWaalsContact C-N 3.32Å; V416-H418 PolarHBondContact O-N 2.81Å; H418-I421 WeakPolarHBondContact O-CD1 3.32Å; H418-I421 WeakPolarHBondContact O-CG1 3.26Å
419	T	37.5	Very low	36.5	Very low	97 Å²	97	124.7 Å²	124.7	60%	0.595	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-97.3	7.6	-179.2	44.2	0	0	0	0	114.8	V416 I421	V416-T419 PolarHBondContact O-OG1 2.96Å; T419-I421 PolarHBondContact O-N 3.22Å
420	H	36.5	Very low	36.8	Very low	191 Å²	191	127.2 Å²	127.2	88%	0.884	65%	0.651	S	S	*	*			trans	-76.5	72.1	159.1	-91	-76.3	0	0	0	109
421	I	34.4	Very low	36.8	Very low	90 Å²	90	124.9 Å²	124.9	46%	0.462	64%	0.638	S	S	.	*			trans	-109.5	124.3	175.2	-61.1	175.8	0	0	0	107.7	H418 T419 Q426	H418-I421 WeakPolarHBondContact O-CD1 3.32Å; H418-I421 WeakPolarHBondContact O-CG1 3.26Å; T419-I421 PolarHBondContact O-N 3.22Å; I421-Q426 HydrophobicContact CG2-CB 4.47Å
422	D	35.7	Very low	36.8	Very low	134 Å²	134	123.3 Å²	123.3	72%	0.717	64%	0.642	S	S	*	*			trans	-46.2	127.6	175.3	-111.5	-37.9	0	0	0	111	Y424	D422-Y424 PolarHBondContact O-N 2.91Å
423	P	38.7	Very low	36.8	Very low	100 Å²	100	125.4 Å²	125.4	65%	0.649	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	1.4	-174.1	27.1	-32.5	0	0	0	114.4
424	Y	36.6	Very low	36.8	Very low	176 Å²	176	129 Å²	129	69%	0.69	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	-12.7	-168.2	-91	-76.4	0	0	0	117.3	D422	D422-Y424 PolarHBondContact O-N 2.91Å
425	N	34.7	Very low	36.6	Very low	143 Å²	143	129.1 Å²	129.1	77%	0.765	68%	0.681	S	S	*	*	S	Bend	trans	-169	93.4	176.9	-86.2	-42.5	0	0	0	109.5
426	Q	38.4	Very low	36.5	Very low	163 Å²	163	126.9 Å²	126.9	76%	0.762	68%	0.684	S	S	*	*			trans	-177.4	129.7	150.2	-101.7	154.6	40.3	0	0	110.4	I421	I421-Q426 HydrophobicContact CG2-CB 4.47Å
427	E	37.6	Very low	36.2	Very low	181 Å²	181	127.7 Å²	127.7	85%	0.846	69%	0.694	S	S	*	*			trans	-52.3	140.4	173.8	-65.4	174.2	154.3	0	0	110.9	P429	E427-P429 WeakPolarHBondContact O-CD 3.31Å; E427-P429 VanDerWaalsContact O-N 3.13Å
428	C	38	Very low	35.9	Very low	52 Å²	52	128.7 Å²	128.7	35%	0.351	70%	0.699	S	S	.	*			trans	-61.5	115.5	176.2	178.5	0	0	0	0	109	L430 C431	C428-L430 PolarHBondContact O-N 3Å; C428-C431 HydrophobicContact CB-CB 4.08Å; C428-C431 PolarHBondContact O-N 2.85Å; C428-C431 VanDerWaalsContact SG-SG 3.64Å
429	P	42.6	Very low	35.5	Very low	117 Å²	117	131.5 Å²	131.5	76%	0.76	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-3.2	-179.4	25.6	-33	0	0	0	113.3	E427	E427-P429 WeakPolarHBondContact O-CD 3.31Å; E427-P429 VanDerWaalsContact O-N 3.13Å
430	L	41.1	Very low	35.2	Very low	134 Å²	134	131.8 Å²	131.8	70%	0.702	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.5	2.5	176.2	-60.3	171.6	0	0	0	113	C428	C428-L430 PolarHBondContact O-N 3Å
431	C	36.5	Very low	34.9	Very low	47 Å²	47	128.5 Å²	128.5	32%	0.318	71%	0.71	S	S	.	*			trans	-134.6	83.6	-178.5	-58.1	0	0	0	0	110.4	C428 I433	C428-C431 HydrophobicContact CB-CB 4.08Å; C428-C431 PolarHBondContact O-N 2.85Å; C428-C431 VanDerWaalsContact SG-SG 3.64Å; C431-I433 PolarHBondContact O-N 3.46Å; C431-I433 VanDerWaalsContact O-N 3.08Å
432	P	39.8	Very low	34.6	Very low	130 Å²	130	128.9 Å²	128.9	84%	0.844	72%	0.72	S	S	*	*			trans	-68.6	105.8	169.4	27.8	-30.5	0	0	0	108.7
433	I	36.2	Very low	34.4	Very low	147 Å²	147	131 Å²	131	75%	0.754	73%	0.726	S	S	*	*			trans	-101.1	110.9	167.9	-61.9	176.5	0	0	0	106.8	C431 A435	C431-I433 PolarHBondContact O-N 3.46Å; C431-I433 VanDerWaalsContact O-N 3.08Å; I433-A435 PolarHBondContact O-N 3.35Å; I433-A435 VanDerWaalsContact O-N 3.08Å
434	N	32.3	Very low	33.9	Very low	171 Å²	171	134.8 Å²	134.8	91%	0.914	73%	0.734	S	S	*	*			trans	-64.3	103.3	161.4	-102.5	-6.6	0	0	0	107.6
435	A	29.5	Very low	33.6	Very low	82 Å²	82	134.6 Å²	134.6	68%	0.678	74%	0.743	S	S	*	*			trans	-86.4	111.4	162.3	0	0	0	0	0	107.8	I433	I433-A435 PolarHBondContact O-N 3.35Å; I433-A435 VanDerWaalsContact O-N 3.08Å
436	N	32	Very low	33.1	Very low	155 Å²	155	130.8 Å²	130.8	83%	0.829	74%	0.738	S	S	*	*			trans	-170.4	124.1	151.4	-94.1	-18.7	0	0	0	108.9
437	S	30.8	Very low	32.5	Very low	103 Å²	103	134.6 Å²	134.6	72%	0.72	75%	0.745	S	S	*	*			trans	72.5	137	158.5	124.8	0	0	0	0	115.2
438	D	29.5	Very low	32	Very low	148 Å²	148	131.4 Å²	131.4	79%	0.791	74%	0.74	S	S	*	*			cis	-156	154.1	3.1	-86.3	-46.6	0	0	0	109
439	F	28.1	Very low	31.4	Very low	201 Å²	201	133.6 Å²	133.6	88%	0.882	76%	0.755	S	S	*	*			trans	-56.2	159.6	160.8	-97.2	-109.9	0	0	0	111.7
440	S	29.8	Very low	30.7	Very low	103 Å²	103	134 Å²	134	72%	0.72	76%	0.759	S	S	*	*			trans	99.5	122.9	154.2	75.6	0	0	0	0	119.6
441	T	29.9	Very low	30.1	Very low	122 Å²	122	137.6 Å²	137.6	75%	0.748	76%	0.763	S	S	*	*			trans	78.8	121.5	139.9	47.7	0	0	0	0	121.7
442	S	29.6	Very low	29.7	Very low	98 Å²	98	145.7 Å²	145.7	69%	0.685	79%	0.789	S	S	*	*			trans	65.4	119	135.3	65.6	0	0	0	0	120.5
443	E	30.9	Very low	29.3	Very low	178 Å²	178	147.5 Å²	147.5	83%	0.832	78%	0.783	S	S	*	*				57	118.6	129.1	-62.8	-175.5	160.6	0	0	119.8
444	H	28.3	Very low	29.1	Very low	179 Å²	179	148.3 Å²	148.3	83%	0.829	79%	0.787	S	S	*	*			trans	31.7	104.7	139.4	-70.8	-67.3	0	0	0	118
445	I	29.4	Very low	28.9	Very low	172 Å²	172	146.3 Å²	146.3	88%	0.882	78%	0.777	S	S	*	*				163.9	122.9	118.3	-81.4	153.1	0	0	0	108.8
446	G	24.7	Very low	28.9	Very low	63 Å²	63	150 Å²	150	65%	0.649	78%	0.78	S	S	*	*			trans	79.9	112.8	135.2	0	0	0	0	0	120.6
447	R	25.4	Very low	28.9	Very low	244 Å²	244	153.1 Å²	153.1	92%	0.921	78%	0.78	S	S	*	*			trans	72.7	164.3	141.8	-63.5	-175.5	175.7	-168.4	0.7	116.7
448	P	27	Very low	28.8	Very low	113 Å²	113	154.5 Å²	154.5	73%	0.734	78%	0.784	S	S	*	*			cis	-133.4	160.7	0.8	22	3	0	0	0	116.3
449	C	25.4	Very low	28.9	Very low	98 Å²	98	159 Å²	159	66%	0.662	79%	0.79	S	S	*	*			trans	40.4	112.8	131.7	-142.2	0	0	0	0	120.3
450	C	28.4	Very low	28.9	Very low	125 Å²	125	154.9 Å²	154.9	85%	0.845	79%	0.786	S	S	*	*			trans	-129.4	83.9	138.9	-82.9	0	0	0	0	108.8	Y452	C450-Y452 PolarHBondContact O-N 2.76Å
451	R	28.2	Very low	29.2	Very low	210 Å²	210	155.5 Å²	155.5	79%	0.792	79%	0.791	S	S	*	*			trans	-71.1	106.8	161.1	-88.2	-179.3	168.6	171.8	-3.7	108.2	K453	R451-K453 PolarHBondContact O-N 2.94Å
452	Y	29.3	Very low	29.1	Very low	218 Å²	218	157.2 Å²	157.2	86%	0.855	80%	0.796	S	S	*	*			trans	-79.1	97.1	154	-89.3	-85	0	0	0	108.3	C450 I454	C450-Y452 PolarHBondContact O-N 2.76Å; Y452-I454 PolarHBondContact O-N 3.46Å
453	K	29.8	Very low	29.3	Very low	168 Å²	168	164.5 Å²	164.5	73%	0.73	81%	0.808	S	S	*	*			trans	-70.1	115.6	157.2	-86.4	-179.1	172.1	-179.3	0	107.1	R451	R451-K453 PolarHBondContact O-N 2.94Å
454	I	33.2	Very low	29.2	Very low	163 Å²	163	162.3 Å²	162.3	84%	0.836	81%	0.807	S	S	*	*			trans	-104.5	95.5	153.6	-60.1	175.9	0	0	0	105.2	Y452	Y452-I454 PolarHBondContact O-N 3.46Å
455	N	28.6	Very low	29.2	Very low	129 Å²	129	164 Å²	164	69%	0.69	81%	0.806	S	S	*	*			trans	-108.2	152.7	166.4	-119.6	12.6	0	0	0	107
456	E	29.1	Very low	29.3	Very low	160 Å²	160	162.5 Å²	162.5	75%	0.748	80%	0.795	S	S	*	*			trans	82.3	98.6	163.4	-62	176.6	-163.1	0	0	118.2
457	R	30.7	Very low	29.3	Very low	221 Å²	221	164.7 Å²	164.7	83%	0.834	80%	0.801	S	S	*	*				174.8	106.4	97.4	-97.4	164.7	-175.1	174.7	0.6	112.1
458	T	28.8	Very low	29.4	Very low	131 Å²	131	159.5 Å²	159.5	80%	0.804	80%	0.8	S	S	*	*			trans	-4.6	126.2	133.6	35.8	0	0	0	0	116.9
459	R	32.4	Very low	29.3	Very low	242 Å²	242	159.9 Å²	159.9	91%	0.913	81%	0.805	S	S	*	*				-173.7	123.9	115.8	-105.1	174.9	173.1	-179.9	-2	112.3
460	S	28.7	Very low	29.5	Very low	115 Å²	115	160 Å²	160	80%	0.804	81%	0.814	S	S	*	*			trans	-58	143.3	161	42.1	0	0	0	0	112.2
461	S	35.3	Very low	29.7	Very low	116 Å²	116	159.3 Å²	159.3	81%	0.811	81%	0.81	S	S	*	*			trans	-162.4	119	138.3	66.8	0	0	0	0	111
462	N	29	Very low	29.5	Very low	159 Å²	159	160.2 Å²	160.2	85%	0.85	81%	0.814	S	S	*	*			trans	-45.2	139.9	161.9	-67.2	-39.5	0	0	0	112.4
463	R	33.6	Very low	29.6	Very low	250 Å²	250	160 Å²	160	94%	0.943	81%	0.813	S	S	*	*			trans	-159.1	100.3	145.3	-111.3	171.6	-171.2	-173.3	2.7	111.5
464	T	27.6	Very low	29.5	Very low	132 Å²	132	160.1 Å²	160.1	81%	0.81	81%	0.814	S	S	*	*			trans	-61.8	155.6	150	18.9	0	0	0	0	111.1
465	R	29.5	Very low	29.3	Very low	214 Å²	214	159.3 Å²	159.3	81%	0.808	81%	0.81	S	S	*	*			trans	118.9	141.8	166.3	-75.5	-176.3	166.3	-157.6	-0.2	111.9
466	Q	30.8	Very low	29.3	Very low	141 Å²	141	157.9 Å²	157.9	66%	0.659	81%	0.81	S	S	*	*			cis	-167.4	150.9	-6.7	-115.1	160.6	-21.5	0	0	104.3
467	S	24.7	Very low	29.2	Very low	109 Å²	109	162.1 Å²	162.1	76%	0.762	82%	0.819	S	S	*	*			trans	-52	137.5	165.2	45.9	0	0	0	0	113.4
468	C	28.1	Very low	29.2	Very low	135 Å²	135	157.1 Å²	157.1	91%	0.912	82%	0.818	S	S	*	*			trans	-143.1	117.7	154.3	-79.6	0	0	0	0	110.7
469	S	24.6	Very low	29.3	Very low	121 Å²	121	162.2 Å²	162.2	85%	0.846	82%	0.822	S	S	*	*			trans	-100.4	138.5	161.2	32.7	0	0	0	0	109
470	A	30.2	Very low	29.2	Very low	101 Å²	101	157.6 Å²	157.6	84%	0.835	82%	0.816	S	S	*	*			trans	154.8	151.3	162.2	0	0	0	0	0	108.2
471	S	30.7	Very low	29.3	Very low	111 Å²	111	159.9 Å²	159.9	78%	0.776	82%	0.819	S	S	*	*			cis	-167.2	157.9	-14.9	58.8	0	0	0	0	106.6
472	R	25.3	Very low	29.1	Very low	229 Å²	229	159.4 Å²	159.4	86%	0.864	81%	0.813	S	S	*	*			trans	-64.6	149.3	173.8	-58.1	170.7	-174.8	168.6	0.2	112.2
473	Y	30.7	Very low	29	Very low	212 Å²	212	161 Å²	161	83%	0.831	81%	0.812	S	S	*	*			trans	-178	107.1	140.5	-91	-75.8	0	0	0	106.9
474	F	27.5	Very low	28.8	Very low	171 Å²	171	156 Å²	156	75%	0.75	80%	0.795	S	S	*	*				90.6	130.4	81.8	-100.7	-65.6	0	0	0	115.8
475	I	28.8	Very low	28.7	Very low	147 Å²	147	156 Å²	156	75%	0.754	80%	0.798	S	S	*	*			trans	81.3	134.5	145.8	-57.3	165.1	0	0	0	117.3
476	S	30.3	Very low	28.5	Very low	99 Å²	99	153.3 Å²	153.3	69%	0.692	80%	0.795	S	S	*	*			cis	-170.5	146.1	-1.1	40.2	0	0	0	0	112.8
477	R	27	Very low	28.3	Very low	248 Å²	248	150.9 Å²	150.9	94%	0.936	80%	0.799	S	S	*	*			trans	24.1	123	145.1	-64.4	-179.7	174.8	178.4	-1.4	122.7
478	S	30.5	Very low	28.4	Very low	116 Å²	116	153.6 Å²	153.6	81%	0.811	80%	0.799	S	S	*	*				-168.2	107.9	118.9	56.9	0	0	0	0	108.9
479	R	29.3	Very low	28.5	Very low	238 Å²	238	153.9 Å²	153.9	90%	0.898	79%	0.79	S	S	*	*				50.4	129.5	106.6	-85.2	-171.6	178.2	175.9	-0.8	116.9
480	D	32.2	Very low	28.5	Very low	146 Å²	146	151.8 Å²	151.8	78%	0.781	79%	0.788	S	S	*	*			trans	89.8	79.1	164.2	-50.3	-21.4	0	0	0	119.3
481	N	29.7	Very low	28.2	Very low	162 Å²	162	149.3 Å²	149.3	87%	0.866	77%	0.772	S	S	*	*				177.8	148.5	123.4	-101.7	-39.5	0	0	0	112.8	K483	N481-K483 PolarHBondContact O-N 3.41Å
482	P	31.4	Very low	28	Very low	106 Å²	106	149.1 Å²	149.1	69%	0.688	77%	0.771	S	S	*	*			trans	-78.3	121.5	-170.3	31.4	-31.5	0	0	0	112.5
483	K	27.6	Very low	28.1	Very low	192 Å²	192	143.2 Å²	143.2	84%	0.835	76%	0.756	S	S	*	*			trans	30	100.2	137	-64.2	178.8	177.8	179.3	0	117.2	N481	N481-K483 PolarHBondContact O-N 3.41Å
484	Y	28.7	Very low	27.9	Very low	147 Å²	147	140.3 Å²	140.3	58%	0.576	75%	0.75	S	S	*	*			trans	-140	110.4	134.8	-77.1	-77	0	0	0	108.8	H486	Y484-H486 PolarHBondContact O-N 3.39Å; Y484-H486 VanDerWaalsContact O-N 3.14Å
485	C	24.7	Very low	28.1	Very low	130 Å²	130	137.6 Å²	137.6	88%	0.878	74%	0.743	S	S	*	*			trans	-65.4	108.1	171.1	-75.1	0	0	0	0	108.6	A487	C485-A487 PolarHBondContact O-N 3.26Å; C485-A487 VanDerWaalsContact O-N 3.14Å
486	H	27	Very low	28.1	Very low	159 Å²	159	133 Å²	133	74%	0.736	72%	0.72	S	S	*	*			trans	-63	106.7	147.8	-75.1	-84.5	0	0	0	106.5	Y484 H488	Y484-H486 PolarHBondContact O-N 3.39Å; Y484-H486 VanDerWaalsContact O-N 3.14Å; H486-H488 PolarHBondContact O-N 3.43Å
487	A	26	Very low	28.2	Very low	90 Å²	90	134.1 Å²	134.1	74%	0.744	73%	0.725	S	S	*	*			trans	-67.5	79.4	157.6	0	0	0	0	0	106.9	C485 L489	C485-A487 PolarHBondContact O-N 3.26Å; C485-A487 VanDerWaalsContact O-N 3.14Å; A487-L489 VanDerWaalsContact C-N 3.26Å; A487-L489 PolarHBondContact O-N 2.9Å
488	H	27.2	Very low	28.2	Very low	166 Å²	166	128.5 Å²	128.5	77%	0.769	71%	0.714	S	S	*	*			trans	-54.6	105.3	144.7	-85	-74	0	0	0	105.2	H486 G490	H486-H488 PolarHBondContact O-N 3.43Å; H488-G490 PolarHBondContact O-N 3.2Å
489	L	29.1	Very low	28.1	Very low	140 Å²	140	129.1 Å²	129.1	73%	0.733	71%	0.709	S	S	*	*			trans	-67.3	64	155.2	-73.2	167.8	0	0	0	107.5	A487 G491 L493	A487-L489 VanDerWaalsContact C-N 3.26Å; A487-L489 PolarHBondContact O-N 2.9Å; L489-G491 VanDerWaalsContact C-N 3.27Å; L489-L493 HydrophobicContact CD1-CD1 4.15Å; L489-L493 HydrophobicContact CD2-CD1 4.16Å
490	G	25.6	Very low	28	Very low	77 Å²	77	123.1 Å²	123.1	79%	0.794	70%	0.698	S	S	*	*			trans	-95.4	18.7	163.7	0	0	0	0	0	110.9	H488	H488-G490 PolarHBondContact O-N 3.2Å
491	G	24.3	Very low	27.8	Very low	49 Å²	49	121.7 Å²	121.7	51%	0.505	69%	0.694	S	S	.	*	S	Bend	trans	-110.6	122.4	162.8	0	0	0	0	0	107.6	L489 L493	L489-G491 VanDerWaalsContact C-N 3.27Å; G491-L493 PolarHBondContact O-N 3.29Å
492	S	25.7	Very low	27.7	Very low	108 Å²	108	119.2 Å²	119.2	76%	0.755	68%	0.683	S	S	*	*			trans	-48.2	103.1	177.3	36.1	0	0	0	0	112.2	E494	S492-E494 PolarHBondContact O-N 3.04Å
493	L	28.1	Very low	27.4	Very low	104 Å²	104	120.1 Å²	120.1	55%	0.545	68%	0.682	S	S	.	*			trans	-67.8	103.8	153.7	-79.6	161.7	0	0	0	106	L489 G491 L495	L489-L493 HydrophobicContact CD1-CD1 4.15Å; L489-L493 HydrophobicContact CD2-CD1 4.16Å; G491-L493 PolarHBondContact O-N 3.29Å; L493-L495 PolarHBondContact O-N 3.39Å; L493-L495 VanDerWaalsContact O-N 3.1Å
494	E	25.8	Very low	27.4	Very low	151 Å²	151	114.9 Å²	114.9	71%	0.706	67%	0.672	S	S	*	*			trans	-68.4	105.5	166.3	-82.2	-171.3	156.7	0	0	107.8	S492 L496	S492-E494 PolarHBondContact O-N 3.04Å; E494-L496 PolarHBondContact O-N 3.4Å
495	L	30.5	Very low	27.3	Very low	114 Å²	114	112.5 Å²	112.5	60%	0.597	68%	0.679	S	S	*	*			trans	-62.8	103.6	158.4	-75.3	162	0	0	0	106.7	L493	L493-L495 PolarHBondContact O-N 3.39Å; L493-L495 VanDerWaalsContact O-N 3.1Å
496	L	29	Very low	27.6	Very low	52 Å²	52	111 Å²	111	27%	0.272	66%	0.662	S	S	.	*			trans	-77.3	130.6	170.8	-68.6	168.2	0	0	0	108.1	E494	E494-L496 PolarHBondContact O-N 3.4Å
497	P	32.5	Very low	27.6	Very low	122 Å²	122	106.6 Å²	106.6	79%	0.792	66%	0.656	S	S	*	*			trans	-59.1	0	178.7	23.1	-31.9	0	0	0	113.9	R198	R198-P497 PolarHBondContact NH2-O 3.31Å; R198-P497 PolarHBondContact NH2-OXT 2.96Å

Retrieved 497 of 497 residues in 170.3 ms (Link to these results)

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