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Vitamin D receptor b

Nuclear receptor for calcitriol, the active form of vitamin D3 which mediates the action of this vitamin on cells. Enters the nucleus upon vitamin D3 binding where it forms heterodimers with the retinoid X receptor/RXR. The VDR-RXR heterodimers bind to specific response elements on DNA and activate the transcription of vitamin D3-responsive target genes. Recruited to promoters via its interaction with BAZ1B/WSTF which mediates the interaction with acetylated histones, an essential step for VDR-promoter association. Plays a central role in calcium homeostasis.

AlphaFold DB , UniProt , Accession A0A087X750, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 430 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.4	Very low	32.2	Very low	249 Å²	249	142.9 Å²	142.9	100%	1.227	84%	0.843	S	S	*	*				0	94.3	0	-83.2	175.9	171.4	0	0	106.7
2	E	29.8	Very low	32.3	Very low	187 Å²	187	138.1 Å²	138.1	87%	0.874	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-81.1	149.1	175.8	-70.8	178.8	127.7	0	0	110.2	T4	E2-T4 PolarHBondContact O-N 3.13Å
3	P	33.5	Very low	33.6	Very low	120 Å²	120	137 Å²	137	78%	0.779	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-78.8	121.7	177.4	31	-29.9	0	0	0	110.5	V5	P3-V5 PolarHBondContact O-N 3.38Å
4	T	31.7	Very low	34.9	Very low	138 Å²	138	136.3 Å²	136.3	85%	0.847	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-66.9	120.2	174.7	6.6	0	0	0	0	110.9	E2	E2-T4 PolarHBondContact O-N 3.13Å
5	V	31.9	Very low	35.6	Very low	131 Å²	131	140.5 Å²	140.5	79%	0.794	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-77.9	118.8	173.5	-175.1	0	0	0	0	108.8	P3 S7	P3-V5 PolarHBondContact O-N 3.38Å; V5-S7 PolarHBondContact O-N 3.27Å
6	V	33.2	Very low	36.9	Very low	125 Å²	125	139.5 Å²	139.5	76%	0.758	81%	0.809	S	S	*	*			trans	-79	104.1	173	176.3	0	0	0	0	108.6	T8	V6-T8 PolarHBondContact O-N 3.39Å
7	S	26.9	Very low	38.4	Very low	107 Å²	107	137.5 Å²	137.5	75%	0.748	80%	0.795	S	S	*	*			trans	-66.5	108.8	171.3	-64	0	0	0	0	110.2	V5 S9	V5-S7 PolarHBondContact O-N 3.27Å; S7-S9 PolarHBondContact O-N 2.88Å
8	T	31.1	Very low	39.7	Very low	125 Å²	125	143.2 Å²	143.2	77%	0.767	80%	0.8	S	S	*	*			trans	-80	108.3	166.1	21.5	0	0	0	0	108	V6 T10	V6-T8 PolarHBondContact O-N 3.39Å; T8-T10 PolarHBondContact O-N 2.79Å
9	S	29.6	Very low	40.8	Very low	116 Å²	116	143.3 Å²	143.3	81%	0.811	80%	0.799	S	S	*	*			trans	-61.4	106.5	175	-59.7	0	0	0	0	110.3	S7 V11	S7-S9 PolarHBondContact O-N 2.88Å; S9-V11 PolarHBondContact O-N 2.91Å
10	T	33.8	Very low	42.4	Very low	135 Å²	135	140.8 Å²	140.8	83%	0.828	79%	0.787	S	S	*	*			trans	-70.2	105.8	165.4	40	0	0	0	0	108.5	T8 A12	T8-T10 PolarHBondContact O-N 2.79Å; T10-A12 PolarHBondContact O-N 2.83Å
11	V	34.3	Very low	44.1	Very low	139 Å²	139	138.9 Å²	138.9	84%	0.842	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-66.4	117.3	168.1	179.7	0	0	0	0	107.5	S9	S9-V11 PolarHBondContact O-N 2.91Å
12	A	33.8	Very low	46.5	Very low	85 Å²	85	132.2 Å²	132.2	70%	0.702	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-59	139	178.7	0	0	0	0	0	111.3	T10	T10-A12 PolarHBondContact O-N 2.83Å
13	P	49	Very low	49.6	Very low	124 Å²	124	128.3 Å²	128.3	81%	0.805	73%	0.726	S	S	*	*	S	Bend	trans	-81	134.6	166.6	31.3	-26.5	0	0	0	109.1
14	D	51.1	Low	52.6	Low	127 Å²	127	122.7 Å²	122.7	68%	0.679	69%	0.69	S	S	*	*			trans	97.3	65.2	158	-127.1	17.4	0	0	0	118.3
15	E	45.3	Very low	55.7	Low	200 Å²	200	117.7 Å²	117.7	94%	0.935	67%	0.665	S	S	*	*			trans	-116	78.4	141.5	-87.4	-166.7	156.2	0	0	108.9
16	F	57.1	Low	58.8	Low	124 Å²	124	111.6 Å²	111.6	54%	0.544	63%	0.629	S	S	.	*			trans	-104.9	114.6	167.9	-74.2	-77.6	0	0	0	109.6	R18 F34	F16-R18 PolarHBondContact O-N 2.95Å; F16-F34 HydrophobicContact CZ-CE2 4.48Å
17	D	61.8	Low	61.9	Low	106 Å²	106	105.9 Å²	105.9	57%	0.567	59%	0.594	S	S	*	*			trans	-46.7	118.9	177.1	-173.2	-6.9	0	0	0	111.6	N19 V20	D17-N19 PolarHBondContact O-N 3.35Å; D17-N19 VanDerWaalsContact O-N 3.17Å; D17-N19 PolarHBondContact OD1-N 3.2Å; D17-V20 HydrophobicContact CB-CG2 4.15Å; D17-V20 PolarHBondContact O-N 3.46Å
18	R	61.8	Low	65.2	Low	239 Å²	239	103.1 Å²	103.1	90%	0.902	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-14.2	-177.8	-74.5	-174.9	-179.3	-163.4	1.7	112.8	F16	F16-R18 PolarHBondContact O-N 2.95Å
19	N	61.8	Low	68.3	Low	146 Å²	146	98.4 Å²	98.4	78%	0.781	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-3.2	-176	-75.2	-16.5	0	0	0	114.9	D17	D17-N19 PolarHBondContact O-N 3.35Å; D17-N19 VanDerWaalsContact O-N 3.17Å; D17-N19 PolarHBondContact OD1-N 3.2Å
20	V	72.9	Confident	71.4	Confident	92 Å²	92	101.1 Å²	101.1	56%	0.558	55%	0.55	S	S	*	.	S	Bend	trans	-88.1	123.3	176.6	-176.7	0	0	0	0	110.5	D17 R22	D17-V20 HydrophobicContact CB-CG2 4.15Å; D17-V20 PolarHBondContact O-N 3.46Å; V20-R22 PolarHBondContact O-N 3.38Å
21	P	76.7	Confident	74.4	Confident	101 Å²	101	95 Å²	95	66%	0.656	51%	0.513	S	S	*	.			trans	-57	114.4	175.6	-24.7	34.1	0	0	0	111.3	I23	P21-I23 HydrophobicContact CB-CG1 4.33Å; P21-I23 PolarHBondContact O-N 3.47Å; P21-I23 VanDerWaalsContact O-N 3.12Å
22	R	89.3	Confident	77.3	Confident	110 Å²	110	92 Å²	92	42%	0.415	50%	0.496	S	S	.	.			trans	-73.8	104.1	173.8	-61.7	-172.6	-178.1	-171.1	-2.7	108.7	V20 A31 M39	V20-R22 PolarHBondContact O-N 3.38Å; R22-A31 HydrophobicContact CB-CB 4.06Å; R22-A31 WeakPolarHBondContact O-CB 3.44Å; R22-A31 PolarHBondContact O-N 3.4Å; R22-M39 HydrophobicContact CB-SD 4.24Å
23	I	94.9	Very high	80.1	Confident	105 Å²	105	88.5 Å²	88.5	54%	0.538	47%	0.467	S	S	.	.	B	Isolated β-bridge	trans	-103	137	-179.1	-61	176.3	0	0	0	109.6	P21 G25	P21-I23 HydrophobicContact CB-CG1 4.33Å; P21-I23 PolarHBondContact O-N 3.47Å; P21-I23 VanDerWaalsContact O-N 3.12Å; I23-G25 PolarHBondContact O-N 3.29Å
24	C	97.6	Very high	82.3	Confident	2 Å²	2	88.2 Å²	88.2	1%	0.014	45%	0.454	C	S	.	.			trans	-72	120.1	177.5	174.2	0	0	0	0	110.7	V26 C27 G28 D29 A31 C41	C24-V26 PolarHBondContact O-N 3.34Å; C24-C27 PolarHBondContact O-N 3.34Å; C24-G28 WeakPolarHBondContact O-CA 3.2Å; C24-G28 PolarHBondContact O-N 3.29Å; C24-D29 WeakPolarHBondContact CB-O 3.47Å; C24-D29 PolarHBondContact N-O 2.92Å; C24-A31 HydrophobicContact CB-CB 4.34Å; C24-C41 HydrophobicContact CB-CB 4.08Å; C24-C41 PolarHBondContact SG-N 3.19Å; C24-C41 VanDerWaalsContact SG-N 3.38Å; C24-C41 VanDerWaalsContact SG-SG 3.67Å
25	G	95.9	Very high	84.5	Confident	32 Å²	32	83.6 Å²	83.6	33%	0.33	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-15	-179.3	0	0	0	0	0	115.6	I23 M39 R83 I87	I23-G25 PolarHBondContact O-N 3.29Å; G25-M39 PolarHBondContact N-O 2.94Å; G25-M39 VanDerWaalsContact N-O 3.1Å; G25-R83 PolarHBondContact O-NE 3.37Å; G25-R83 PolarHBondContact O-NH2 2.88Å; G25-I87 WeakPolarHBondContact O-CG2 3.44Å
26	V	97.9	Very high	86.9	Confident	4 Å²	4	75.5 Å²	75.5	2%	0.024	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-46.8	179.5	-174.4	0	0	0	0	112.7	C24 T40 C44 I68 R80 R83 I87 M89	C24-V26 PolarHBondContact O-N 3.34Å; V26-T40 HydrophobicContact CG2-CG2 4Å; V26-C44 HydrophobicContact CB-CB 4.13Å; V26-C44 HydrophobicContact CG1-CB 4.41Å; V26-C44 HydrophobicContact CG2-CB 4.05Å; V26-I68 HydrophobicContact CG1-CG2 4.27Å; V26-I68 WeakPolarHBondContact O-CB 3.48Å; V26-I68 WeakPolarHBondContact O-CG2 3.47Å; V26-R80 HydrophobicContact CG1-CG 4.14Å; V26-R83 HydrophobicContact CB-CG 4.5Å; V26-R83 HydrophobicContact CG1-CB 4.31Å; V26-R83 HydrophobicContact CG1-CG 4.08Å; V26-I87 HydrophobicContact CB-CD1 4.49Å; V26-I87 HydrophobicContact CG2-CD1 3.32Å; V26-I87 HydrophobicContact CG2-CG1 4.1Å; V26-M89 HydrophobicContact CG2-SD 4.31Å
27	C	96.9	Very high	88.7	Confident	4 Å²	4	73.8 Å²	73.8	3%	0.027	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-133.7	1.3	-166.3	67.3	0	0	0	0	114.5	C24 D29 C41 I68 T69 K70 R73	C24-C27 PolarHBondContact O-N 3.34Å; C27-D29 PolarHBondContact O-N 3.34Å; C27-D29 VanDerWaalsContact SG-CB 3.58Å; C27-C41 VanDerWaalsContact SG-SG 3.68Å; C27-I68 HydrophobicContact CB-CG2 3.99Å; C27-T69 CarbonylContact O-C 3.55Å; C27-T69 VanDerWaalsContact O-CA 3.28Å; C27-T69 WeakPolarHBondContact O-CA 3.39Å; C27-K70 PolarHBondContact O-N 3Å; C27-R73 HydrophobicContact CB-CB 4.16Å; C27-R73 PolarHBondContact SG-NH1 2.88Å
28	G	95.6	Very high	90.3	Very high	50 Å²	50	69 Å²	69	52%	0.515	36%	0.361	S	S	.	.	S	Bend	trans	74.1	-0.8	-179.3	0	0	0	0	0	115.6	C24	C24-G28 WeakPolarHBondContact O-CA 3.2Å; C24-G28 PolarHBondContact O-N 3.29Å
29	D	96.4	Very high	92	Very high	25 Å²	25	59.7 Å²	59.7	13%	0.134	33%	0.328	C	S	.	.	S	Bend	trans	-70.6	166.6	175	-161.3	8.4	0	0	0	111.8	C24 C27 A31 C41 K70 R73	C24-D29 WeakPolarHBondContact CB-O 3.47Å; C24-D29 PolarHBondContact N-O 2.92Å; C27-D29 PolarHBondContact O-N 3.34Å; C27-D29 VanDerWaalsContact SG-CB 3.58Å; D29-A31 PolarHBondContact O-N 3.33Å; D29-A31 VanDerWaalsContact O-N 3.14Å; D29-C41 HydrophobicContact CB-CB 4.32Å; D29-K70 HydrophobicContact CB-CB 4.27Å; D29-K70 HydrophobicContact CB-CD 4.19Å; D29-K70 HydrophobicContact CB-CG 4.11Å; D29-K70 WeakPolarHBondContact OD1-CD 3.13Å; D29-K70 VanDerWaalsContact OD1-CE 3.23Å; D29-K70 WeakPolarHBondContact OD1-CE 3.47Å; D29-K70 IonicContact OD1-NZ 2.85Å; D29-K70 PolarHBondContact OD1-NZ 3.15Å; D29-R73 IonicContact OD2-CZ 3.75Å; D29-R73 IonicContact OD2-NH1 2.6Å; D29-R73 PolarHBondContact OD2-NH1 3.29Å; D29-R73 IonicContact OD2-NH2 3.16Å; D29-R73 PolarHBondContact OD2-NH2 2.72Å; D29-R73 VanDerWaalsContact OD2-NH2 3.16Å
30	K	95.8	Very high	93.7	Very high	173 Å²	173	52.8 Å²	52.8	75%	0.752	29%	0.291	S	S	*	.	B	Isolated β-bridge	trans	-60.1	118.2	177.4	-172.7	175.1	-178.9	176.9	0	110.4	C41	K30-C41 VanDerWaalsContact O-CB 3.24Å; K30-C41 WeakPolarHBondContact O-CB 3.3Å
31	A	96.2	Very high	94.8	Very high	7 Å²	7	48.6 Å²	48.6	6%	0.058	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-77.7	141.3	176.3	0	0	0	0	0	110.8	R22 C24 D29 M39 T40	R22-A31 HydrophobicContact CB-CB 4.06Å; R22-A31 WeakPolarHBondContact O-CB 3.44Å; R22-A31 PolarHBondContact O-N 3.4Å; C24-A31 HydrophobicContact CB-CB 4.34Å; D29-A31 PolarHBondContact O-N 3.33Å; D29-A31 VanDerWaalsContact O-N 3.14Å; A31-M39 HydrophobicContact CB-CG 3.66Å; A31-M39 HydrophobicContact CB-SD 3.66Å; A31-T40 WeakPolarHBondContact CA-O 3.39Å
32	T	94.7	Very high	95.8	Very high	77 Å²	77	48.2 Å²	48.2	47%	0.472	26%	0.256	S	S	.	.			trans	-96.1	-14	179.1	45	0	0	0	0	112.3	H35 T40 E42	T32-H35 PolarHBondContact OG1-NE2 2.84Å; T32-T40 PolarHBondContact N-O 2.76Å; T32-T40 PolarHBondContact OG1-O 2.72Å; T32-E42 HydrophobicContact CG2-CG 3.9Å; T32-E42 PolarHBondContact OG1-OE1 3.23Å
33	G	93.6	Very high	96.2	Very high	10 Å²	10	44.5 Å²	44.5	10%	0.103	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	152.1	-171.1	-179.6	0	0	0	0	0	112	M39 T40	G33-M39 VanDerWaalsContact C-SD 3.55Å; G33-T40 PolarHBondContact O-N 3.44Å
34	F	95.3	Very high	96.3	Very high	119 Å²	119	39.5 Å²	39.5	52%	0.522	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	123.7	170.5	-75.3	-91.1	0	0	0	110.1	F16 A38 M39	F16-F34 HydrophobicContact CZ-CE2 4.48Å; F34-A38 WeakPolarHBondContact CA-O 3.4Å; F34-M39 HydrophobicContact CD2-CE 3.7Å; F34-M39 HydrophobicContact CE1-CB 4.47Å; F34-M39 HydrophobicContact CE2-CE 3.4Å; F34-M39 HydrophobicContact CG-CE 4.47Å; F34-M39 HydrophobicContact CZ-CE 3.94Å
35	H	96.3	Very high	96.3	Very high	29 Å²	29	41.7 Å²	41.7	13%	0.134	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	124.7	173.6	-60.2	-62.3	0	0	0	108.7	T32 N37 A38 T40 E42 K45	T32-H35 PolarHBondContact OG1-NE2 2.84Å; H35-N37 VanDerWaalsContact C-N 3.26Å; H35-N37 PolarHBondContact O-N 2.91Å; H35-A38 PolarHBondContact N-O 3.28Å; H35-A38 PolarHBondContact O-N 2.88Å; H35-T40 WeakPolarHBondContact CB-OG1 3.28Å; H35-T40 PolarHBondContact CD2-O 3.24Å; H35-T40 PolarHBondContact CD2-OG1 2.92Å; H35-E42 IonicContact CE1-OE1 3.11Å; H35-E42 PolarHBondContact CE1-OE1 2.85Å; H35-E42 VanDerWaalsContact CE1-OE1 3.29Å; H35-E42 IonicContact NE2-OE1 2.82Å; H35-E42 PolarHBondContact NE2-OE1 3.45Å; H35-E42 VanDerWaalsContact NE2-OE1 3.12Å; H35-K45 HydrophobicContact CB-CB 3.99Å; H35-K45 HydrophobicContact CB-CD 4.36Å; H35-K45 HydrophobicContact CB-CG 3.83Å; H35-K45 PolarHBondContact CE1-NZ 2.8Å; H35-K45 WeakPolarHBondContact ND1-CD 3.47Å; H35-K45 VanDerWaalsContact ND1-CE 3.3Å; H35-K45 WeakPolarHBondContact ND1-CE 3.4Å
36	F	96.1	Very high	96.3	Very high	31 Å²	31	40.5 Å²	40.5	14%	0.136	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	42.2	-178.6	-46.2	-67.3	0	0	0	112.7	K45 F48 R49 M89 M90 F93 I94	F36-K45 HydrophobicContact CE2-CB 4.47Å; F36-K45 HydrophobicContact CE2-CG 3.73Å; F36-K45 HydrophobicContact CZ-CG 4.42Å; F36-F48 HydrophobicContact CB-CD1 4.29Å; F36-F48 HydrophobicContact CB-CE1 4.11Å; F36-F48 AromaticContact CD2-CD1 3.75Å; F36-F48 HydrophobicContact CD2-CD1 3.75Å; F36-F48 HydrophobicContact CD2-CE1 4.37Å; F36-F48 HydrophobicContact CE2-CD1 4.3Å; F36-F48 HydrophobicContact CG-CD1 4.06Å; F36-F48 HydrophobicContact CG-CE1 4.24Å; F36-R49 HydrophobicContact CE2-CB 4.09Å; F36-R49 HydrophobicContact CZ-CB 3.88Å; F36-R49 HydrophobicContact CZ-CG 4.2Å; F36-M89 HydrophobicContact CB-CB 4.48Å; F36-M89 HydrophobicContact CB-CE 4.28Å; F36-M89 HydrophobicContact CD2-CE 3.57Å; F36-M89 HydrophobicContact CE2-CE 4.44Å; F36-M89 HydrophobicContact CG-CE 4.4Å; F36-M89 CarbonylContact O-C 3.16Å; F36-M89 VanDerWaalsContact O-CA 3.26Å; F36-M89 WeakPolarHBondContact O-CA 3.16Å; F36-M90 PolarHBondContact O-N 3.36Å; F36-F93 HydrophobicContact CB-CB 4.37Å; F36-F93 HydrophobicContact CD1-CB 3.92Å; F36-I94 HydrophobicContact CD1-CG1 3.61Å; F36-I94 HydrophobicContact CE1-CB 4.23Å; F36-I94 HydrophobicContact CE1-CG1 3.43Å; F36-I94 VanDerWaalsContact CE1-CG1 3.43Å; F36-I94 HydrophobicContact CG-CG1 4.38Å; F36-I94 HydrophobicContact CZ-CG1 4.02Å
37	N	95.5	Very high	96.3	Very high	87 Å²	87	40.9 Å²	40.9	47%	0.465	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.4	11.8	-178.5	-160.1	64.8	0	0	0	116.9	H35 M90 F93	H35-N37 VanDerWaalsContact C-N 3.26Å; H35-N37 PolarHBondContact O-N 2.91Å; N37-M90 HydrophobicContact CB-CG 4.37Å; N37-M90 HydrophobicContact CB-SD 3.98Å; N37-M90 WeakPolarHBondContact ND2-CE 3.19Å; N37-F93 HydrophobicContact CB-CD2 4.4Å; N37-F93 HydrophobicContact CB-CE2 4.1Å
38	A	95.9	Very high	96.4	Very high	5 Å²	5	40.7 Å²	40.7	4%	0.041	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	145.4	174.5	0	0	0	0	0	113.9	F34 H35 T40 I87 M89	F34-A38 WeakPolarHBondContact CA-O 3.4Å; H35-A38 PolarHBondContact N-O 3.28Å; H35-A38 PolarHBondContact O-N 2.88Å; A38-T40 HydrophobicContact CB-CG2 4.25Å; A38-T40 PolarHBondContact O-N 2.95Å; A38-T40 VanDerWaalsContact O-N 3.13Å; A38-I87 HydrophobicContact CB-CD1 3.82Å; A38-I87 HydrophobicContact CB-CG1 4.12Å; A38-M89 HydrophobicContact CB-CG 3.68Å
39	M	96	Very high	96.4	Very high	45 Å²	45	44 Å²	44	22%	0.222	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	106.8	176	-175.3	62.6	71.5	0	0	110.9	R22 G25 A31 G33 F34	R22-M39 HydrophobicContact CB-SD 4.24Å; G25-M39 PolarHBondContact N-O 2.94Å; G25-M39 VanDerWaalsContact N-O 3.1Å; A31-M39 HydrophobicContact CB-CG 3.66Å; A31-M39 HydrophobicContact CB-SD 3.66Å; G33-M39 VanDerWaalsContact C-SD 3.55Å; F34-M39 HydrophobicContact CD2-CE 3.7Å; F34-M39 HydrophobicContact CE1-CB 4.47Å; F34-M39 HydrophobicContact CE2-CE 3.4Å; F34-M39 HydrophobicContact CG-CE 4.47Å; F34-M39 HydrophobicContact CZ-CE 3.94Å
40	T	97.7	Very high	96.3	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	163.8	-174.3	61.8	0	0	0	0	114.1	V26 A31 T32 G33 H35 A38 I87 M89	V26-T40 HydrophobicContact CG2-CG2 4Å; A31-T40 WeakPolarHBondContact CA-O 3.39Å; T32-T40 PolarHBondContact N-O 2.76Å; T32-T40 PolarHBondContact OG1-O 2.72Å; G33-T40 PolarHBondContact O-N 3.44Å; H35-T40 WeakPolarHBondContact CB-OG1 3.28Å; H35-T40 PolarHBondContact CD2-O 3.24Å; H35-T40 PolarHBondContact CD2-OG1 2.92Å; A38-T40 HydrophobicContact CB-CG2 4.25Å; A38-T40 PolarHBondContact O-N 2.95Å; A38-T40 VanDerWaalsContact O-N 3.13Å; T40-I87 HydrophobicContact CG2-CD1 3.71Å; T40-M89 HydrophobicContact CG2-CE 4.32Å; T40-M89 HydrophobicContact CG2-CG 4.42Å; T40-M89 HydrophobicContact CG2-SD 3.87Å
41	C	97.3	Very high	96.3	Very high	4 Å²	4	40.9 Å²	40.9	3%	0.027	20%	0.203	C	C	.	.			trans	-83.3	161.3	170.3	64.2	0	0	0	0	111.3	C24 C27 D29 K30 G43 C44 K45 R73	C24-C41 HydrophobicContact CB-CB 4.08Å; C24-C41 PolarHBondContact SG-N 3.19Å; C24-C41 VanDerWaalsContact SG-N 3.38Å; C24-C41 VanDerWaalsContact SG-SG 3.67Å; C27-C41 VanDerWaalsContact SG-SG 3.68Å; D29-C41 HydrophobicContact CB-CB 4.32Å; K30-C41 VanDerWaalsContact O-CB 3.24Å; K30-C41 WeakPolarHBondContact O-CB 3.3Å; C41-G43 PolarHBondContact O-N 3.16Å; C41-G43 VanDerWaalsContact O-N 3.15Å; C41-C44 PolarHBondContact O-N 2.82Å; C41-C44 VanDerWaalsContact O-N 3.09Å; C41-C44 PolarHBondContact SG-N 3.26Å; C41-C44 VanDerWaalsContact SG-SG 3.67Å; C41-K45 PolarHBondContact O-N 3.24Å; C41-R73 PolarHBondContact SG-NH1 3.01Å
42	E	97.2	Very high	96.2	Very high	94 Å²	94	43 Å²	43	44%	0.439	21%	0.212	S	C	.	.	H	α-helix	trans	-55.9	-32.2	175.8	-72	-61.3	131.9	0	0	113.1	T32 H35 K45 G46	T32-E42 HydrophobicContact CG2-CG 3.9Å; T32-E42 PolarHBondContact OG1-OE1 3.23Å; H35-E42 IonicContact CE1-OE1 3.11Å; H35-E42 PolarHBondContact CE1-OE1 2.85Å; H35-E42 VanDerWaalsContact CE1-OE1 3.29Å; H35-E42 IonicContact NE2-OE1 2.82Å; H35-E42 PolarHBondContact NE2-OE1 3.45Å; H35-E42 VanDerWaalsContact NE2-OE1 3.12Å; E42-K45 WeakPolarHBondContact OE1-CD 3.42Å; E42-K45 IonicContact OE1-NZ 3.12Å; E42-K45 PolarHBondContact OE1-NZ 2.91Å; E42-K45 WeakPolarHBondContact OE2-CD 3.18Å; E42-K45 IonicContact OE2-NZ 2.72Å; E42-K45 PolarHBondContact OE2-NZ 3.19Å; E42-G46 PolarHBondContact O-N 3.46Å
43	G	97.1	Very high	96	Very high	32 Å²	32	43.7 Å²	43.7	33%	0.33	21%	0.208	S	C	.	.	H	α-helix	trans	-64	-41.9	177.1	0	0	0	0	0	113.4	C41 F47 R80	C41-G43 PolarHBondContact O-N 3.16Å; C41-G43 VanDerWaalsContact O-N 3.15Å; G43-F47 WeakPolarHBondContact O-CB 3.38Å; G43-F47 PolarHBondContact O-N 3.35Å; G43-R80 PolarHBondContact O-NH2 3.13Å
44	C	98	Very high	95.8	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-81.8	-34.9	179.2	-66.4	0	0	0	0	112.1	V26 C41 F47 F48 R80	V26-C44 HydrophobicContact CB-CB 4.13Å; V26-C44 HydrophobicContact CG1-CB 4.41Å; V26-C44 HydrophobicContact CG2-CB 4.05Å; C41-C44 PolarHBondContact O-N 2.82Å; C41-C44 VanDerWaalsContact O-N 3.09Å; C41-C44 PolarHBondContact SG-N 3.26Å; C41-C44 VanDerWaalsContact SG-SG 3.67Å; C44-F47 PolarHBondContact O-N 3.41Å; C44-F48 WeakPolarHBondContact O-CB 3.31Å; C44-F48 PolarHBondContact O-N 3.19Å; C44-R80 PolarHBondContact SG-NH2 2.85Å; C44-R80 VanDerWaalsContact SG-NH2 3.39Å
45	K	97.5	Very high	95.6	Very high	47 Å²	47	56.1 Å²	56.1	20%	0.204	25%	0.254	C	S	.	.	H	α-helix	trans	-53.1	-54.9	167.5	174.3	-159.8	-166.3	177.7	0	111.8	H35 F36 C41 E42 F47 F48 R49	H35-K45 HydrophobicContact CB-CB 3.99Å; H35-K45 HydrophobicContact CB-CD 4.36Å; H35-K45 HydrophobicContact CB-CG 3.83Å; H35-K45 PolarHBondContact CE1-NZ 2.8Å; H35-K45 WeakPolarHBondContact ND1-CD 3.47Å; H35-K45 VanDerWaalsContact ND1-CE 3.3Å; H35-K45 WeakPolarHBondContact ND1-CE 3.4Å; F36-K45 HydrophobicContact CE2-CB 4.47Å; F36-K45 HydrophobicContact CE2-CG 3.73Å; F36-K45 HydrophobicContact CZ-CG 4.42Å; C41-K45 PolarHBondContact O-N 3.24Å; E42-K45 WeakPolarHBondContact OE1-CD 3.42Å; E42-K45 IonicContact OE1-NZ 3.12Å; E42-K45 PolarHBondContact OE1-NZ 2.91Å; E42-K45 WeakPolarHBondContact OE2-CD 3.18Å; E42-K45 IonicContact OE2-NZ 2.72Å; E42-K45 PolarHBondContact OE2-NZ 3.19Å; K45-F47 VanDerWaalsContact C-N 3.34Å; K45-F47 PolarHBondContact O-N 3.39Å; K45-F48 PolarHBondContact O-N 3.47Å; K45-R49 WeakPolarHBondContact O-CB 3.41Å; K45-R49 PolarHBondContact O-N 3.34Å
46	G	96.4	Very high	95.3	Very high	8 Å²	8	56.1 Å²	56.1	8%	0.082	26%	0.259	C	S	.	.	H	α-helix	trans	-64.5	-38.6	-178.8	0	0	0	0	0	112.8	E42 R50	E42-G46 PolarHBondContact O-N 3.46Å; G46-R50 WeakPolarHBondContact O-CG 3.5Å; G46-R50 PolarHBondContact O-N 3.16Å; G46-R50 VanDerWaalsContact O-N 3.14Å; G46-R50 PolarHBondContact O-NH1 2.89Å
47	F	97.8	Very high	95.1	Very high	11 Å²	11	60.2 Å²	60.2	5%	0.048	29%	0.291	C	S	.	.	H	α-helix	trans	-63.5	-50.5	176	172.2	-100.4	0	0	0	112.1	G43 C44 K45 R50 S51 F58 Q77 R80 L81	G43-F47 WeakPolarHBondContact O-CB 3.38Å; G43-F47 PolarHBondContact O-N 3.35Å; C44-F47 PolarHBondContact O-N 3.41Å; K45-F47 VanDerWaalsContact C-N 3.34Å; K45-F47 PolarHBondContact O-N 3.39Å; F47-R50 PolarHBondContact O-N 3.41Å; F47-S51 WeakPolarHBondContact O-CB 3.35Å; F47-S51 PolarHBondContact O-N 3.2Å; F47-S51 PolarHBondContact O-OG 3.38Å; F47-F58 HydrophobicContact CE2-CE2 4.17Å; F47-F58 HydrophobicContact CE2-CZ 4.32Å; F47-F58 AromaticContact CZ-CE2 3.95Å; F47-F58 HydrophobicContact CZ-CE2 3.95Å; F47-Q77 HydrophobicContact CE2-CB 4.13Å; F47-Q77 HydrophobicContact CE2-CG 4.09Å; F47-Q77 HydrophobicContact CZ-CB 4.14Å; F47-Q77 WeakPolarHBondContact CZ-O 3.16Å; F47-R80 HydrophobicContact CD1-CG 3.82Å; F47-R80 HydrophobicContact CE1-CB 3.92Å; F47-R80 HydrophobicContact CE1-CG 3.56Å; F47-R80 HydrophobicContact CZ-CB 4.15Å; F47-R80 HydrophobicContact CZ-CG 4.17Å; F47-L81 HydrophobicContact CE1-CB 3.89Å; F47-L81 HydrophobicContact CE1-CD1 4.27Å; F47-L81 HydrophobicContact CZ-CB 4.05Å
48	F	97.5	Very high	95.1	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-59.9	-48.6	179	-176.1	-101.8	0	0	0	111.6	F36 C44 K45 R50 S51 M52 L81 C84 V85 M89 I94	F36-F48 HydrophobicContact CB-CD1 4.29Å; F36-F48 HydrophobicContact CB-CE1 4.11Å; F36-F48 AromaticContact CD2-CD1 3.75Å; F36-F48 HydrophobicContact CD2-CD1 3.75Å; F36-F48 HydrophobicContact CD2-CE1 4.37Å; F36-F48 HydrophobicContact CE2-CD1 4.3Å; F36-F48 HydrophobicContact CG-CD1 4.06Å; F36-F48 HydrophobicContact CG-CE1 4.24Å; C44-F48 WeakPolarHBondContact O-CB 3.31Å; C44-F48 PolarHBondContact O-N 3.19Å; K45-F48 PolarHBondContact O-N 3.47Å; F48-R50 PolarHBondContact O-N 3.45Å; F48-S51 PolarHBondContact O-N 3.45Å; F48-M52 HydrophobicContact CD1-CG 4.28Å; F48-M52 HydrophobicContact CD2-CE 4.15Å; F48-M52 HydrophobicContact CD2-CG 4.28Å; F48-M52 HydrophobicContact CE1-CG 3.95Å; F48-M52 HydrophobicContact CE2-CE 3.29Å; F48-M52 HydrophobicContact CE2-CG 3.98Å; F48-M52 HydrophobicContact CE2-SD 4.49Å; F48-M52 HydrophobicContact CG-CG 4.45Å; F48-M52 HydrophobicContact CZ-CE 3.57Å; F48-M52 HydrophobicContact CZ-CG 3.79Å; F48-M52 HydrophobicContact CZ-SD 4.47Å; F48-M52 WeakPolarHBondContact O-CG 3.42Å; F48-M52 PolarHBondContact O-N 3.35Å; F48-L81 HydrophobicContact CD2-CD1 4Å; F48-L81 HydrophobicContact CE2-CD1 4.45Å; F48-C84 HydrophobicContact CD2-CB 3.45Å; F48-C84 VanDerWaalsContact CD2-CB 3.45Å; F48-C84 HydrophobicContact CE2-CB 4.01Å; F48-C84 HydrophobicContact CG-CB 4.33Å; F48-V85 HydrophobicContact CE2-CG2 4.06Å; F48-M89 HydrophobicContact CB-CE 3.48Å; F48-M89 VanDerWaalsContact CB-CE 3.48Å; F48-M89 HydrophobicContact CB-SD 4Å; F48-M89 HydrophobicContact CD1-CB 4.07Å; F48-M89 HydrophobicContact CD1-CE 3.67Å; F48-M89 HydrophobicContact CD1-SD 4.46Å; F48-M89 HydrophobicContact CD2-CB 3.94Å; F48-M89 HydrophobicContact CD2-CE 4.31Å; F48-M89 HydrophobicContact CD2-SD 4.11Å; F48-M89 HydrophobicContact CE1-CB 3.77Å; F48-M89 HydrophobicContact CE1-CE 4.47Å; F48-M89 HydrophobicContact CE2-CB 3.59Å; F48-M89 HydrophobicContact CG-CB 4.14Å; F48-M89 HydrophobicContact CG-CE 3.56Å; F48-M89 HydrophobicContact CG-SD 3.95Å; F48-M89 VanDerWaalsContact CZ-C 3.49Å; F48-M89 HydrophobicContact CZ-CB 3.51Å; F48-M89 WeakPolarHBondContact CZ-O 3.23Å; F48-I94 HydrophobicContact CD1-CD1 4.1Å; F48-I94 HydrophobicContact CE1-CD1 3.97Å
49	R	95.9	Very high	95	Very high	119 Å²	119	64.8 Å²	64.8	45%	0.449	32%	0.317	S	S	.	.	H	α-helix	trans	-55.1	-48.4	177.6	-175.7	177.2	63.5	-175.4	-0.1	112.5	F36 K45 K53 I94	F36-R49 HydrophobicContact CE2-CB 4.09Å; F36-R49 HydrophobicContact CZ-CB 3.88Å; F36-R49 HydrophobicContact CZ-CG 4.2Å; K45-R49 WeakPolarHBondContact O-CB 3.41Å; K45-R49 PolarHBondContact O-N 3.34Å; R49-K53 WeakPolarHBondContact O-CB 3.42Å; R49-K53 WeakPolarHBondContact O-CG 3.34Å; R49-K53 PolarHBondContact O-N 3.09Å; R49-I94 HydrophobicContact CG-CG2 4.07Å
50	R	95.2	Very high	95.1	Very high	127 Å²	127	64 Å²	64	48%	0.479	32%	0.316	S	S	.	.	H	α-helix	trans	-66.8	-40.7	179.7	-73.3	-172.2	-59.6	-90.7	-1.3	112.1	G46 F47 F48 R54	G46-R50 WeakPolarHBondContact O-CG 3.5Å; G46-R50 PolarHBondContact O-N 3.16Å; G46-R50 VanDerWaalsContact O-N 3.14Å; G46-R50 PolarHBondContact O-NH1 2.89Å; F47-R50 PolarHBondContact O-N 3.41Å; F48-R50 PolarHBondContact O-N 3.45Å; R50-R54 WeakPolarHBondContact O-CB 3.32Å; R50-R54 WeakPolarHBondContact O-CG 3.37Å; R50-R54 PolarHBondContact O-N 3.06Å; R50-R54 VanDerWaalsContact O-N 3.07Å
51	S	95.6	Very high	94.9	Very high	6 Å²	6	68.1 Å²	68.1	4%	0.042	34%	0.343	C	S	.	.	H	α-helix	trans	-66	-44.4	-178.3	-54.9	0	0	0	0	111.3	F47 F48 K55 A56	F47-S51 WeakPolarHBondContact O-CB 3.35Å; F47-S51 PolarHBondContact O-N 3.2Å; F47-S51 PolarHBondContact O-OG 3.38Å; F48-S51 PolarHBondContact O-N 3.45Å; S51-K55 PolarHBondContact O-N 3.29Å; S51-A56 PolarHBondContact O-N 2.88Å
52	M	94.4	Very high	94.7	Very high	53 Å²	53	74.3 Å²	74.3	26%	0.261	37%	0.37	S	S	.	.	H	α-helix	trans	-69.9	-45.4	177.4	-69.4	-59.7	-179.6	0	0	112.5	F48 R54 K55 L81 V85 K91 I94	F48-M52 HydrophobicContact CD1-CG 4.28Å; F48-M52 HydrophobicContact CD2-CE 4.15Å; F48-M52 HydrophobicContact CD2-CG 4.28Å; F48-M52 HydrophobicContact CE1-CG 3.95Å; F48-M52 HydrophobicContact CE2-CE 3.29Å; F48-M52 HydrophobicContact CE2-CG 3.98Å; F48-M52 HydrophobicContact CE2-SD 4.49Å; F48-M52 HydrophobicContact CG-CG 4.45Å; F48-M52 HydrophobicContact CZ-CE 3.57Å; F48-M52 HydrophobicContact CZ-CG 3.79Å; F48-M52 HydrophobicContact CZ-SD 4.47Å; F48-M52 WeakPolarHBondContact O-CG 3.42Å; F48-M52 PolarHBondContact O-N 3.35Å; M52-R54 VanDerWaalsContact C-N 3.35Å; M52-R54 PolarHBondContact O-N 3.15Å; M52-K55 PolarHBondContact O-N 3.19Å; M52-L81 HydrophobicContact CE-CD1 4.2Å; M52-V85 HydrophobicContact CE-CG2 3.69Å; M52-K91 HydrophobicContact CB-CB 4.28Å; M52-K91 HydrophobicContact CG-CB 3.99Å; M52-K91 HydrophobicContact SD-CB 4.06Å; M52-I94 HydrophobicContact CB-CD1 3.42Å; M52-I94 VanDerWaalsContact CB-CD1 3.42Å; M52-I94 HydrophobicContact CG-CD1 3.93Å
53	K	89.1	Confident	94.5	Very high	90 Å²	90	75.8 Å²	75.8	39%	0.391	38%	0.38	S	S	.	.	H	α-helix	trans	-60.6	-41.2	178	-80.1	-156.9	169.5	-161	0	112.9	R49 K55 I94 L95 D97	R49-K53 WeakPolarHBondContact O-CB 3.42Å; R49-K53 WeakPolarHBondContact O-CG 3.34Å; R49-K53 PolarHBondContact O-N 3.09Å; K53-K55 VanDerWaalsContact C-N 3.28Å; K53-K55 PolarHBondContact O-N 3.46Å; K53-I94 HydrophobicContact CD-CG2 4.27Å; K53-I94 HydrophobicContact CG-CG2 3.83Å; K53-L95 WeakPolarHBondContact CE-O 3.46Å; K53-L95 PolarHBondContact NZ-O 2.96Å; K53-D97 IonicContact NZ-OD1 3.41Å; K53-D97 PolarHBondContact NZ-OD1 3.34Å
54	R	90.6	Very high	94.3	Very high	199 Å²	199	75.6 Å²	75.6	75%	0.751	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	0	-179.3	-65.2	179.8	179	-178.4	-2.8	113.6	R50 M52 A56	R50-R54 WeakPolarHBondContact O-CB 3.32Å; R50-R54 WeakPolarHBondContact O-CG 3.37Å; R50-R54 PolarHBondContact O-N 3.06Å; R50-R54 VanDerWaalsContact O-N 3.07Å; M52-R54 VanDerWaalsContact C-N 3.35Å; M52-R54 PolarHBondContact O-N 3.15Å; R54-A56 PolarHBondContact O-N 3.39Å
55	K	89.7	Confident	94.1	Very high	192 Å²	192	79.5 Å²	79.5	84%	0.835	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.9	44.5	-170.7	-58.4	-180	-179.1	177.6	0	111.5	S51 M52 K53 S57	S51-K55 PolarHBondContact O-N 3.29Å; M52-K55 PolarHBondContact O-N 3.19Å; K53-K55 VanDerWaalsContact C-N 3.28Å; K53-K55 PolarHBondContact O-N 3.46Å; K55-S57 PolarHBondContact O-N 2.96Å
56	A	89.9	Confident	94.1	Very high	29 Å²	29	78.8 Å²	78.8	24%	0.24	41%	0.407	C	S	.	.			trans	-65.9	128.4	-173.2	0	0	0	0	0	110.7	S51 R54 F58	S51-A56 PolarHBondContact O-N 2.88Å; R54-A56 PolarHBondContact O-N 3.39Å; A56-F58 HydrophobicContact CB-CD2 4.46Å; A56-F58 HydrophobicContact CB-CE1 3.99Å; A56-F58 HydrophobicContact CB-CE2 3.73Å; A56-F58 HydrophobicContact CB-CZ 3.46Å; A56-F58 VanDerWaalsContact CB-CZ 3.46Å
57	S	92.1	Very high	94	Very high	116 Å²	116	83.7 Å²	83.7	81%	0.811	44%	0.435	S	S	*	.			trans	-101.5	124.2	169	-174.8	0	0	0	0	108.5	K55	K55-S57 PolarHBondContact O-N 2.96Å
58	F	95.4	Very high	94	Very high	60 Å²	60	84.1 Å²	84.1	26%	0.263	44%	0.437	S	S	.	.			trans	-119.4	135.5	179.2	-58	-61.3	0	0	0	109.4	F47 A56 Q77 A78 L81	F47-F58 HydrophobicContact CE2-CE2 4.17Å; F47-F58 HydrophobicContact CE2-CZ 4.32Å; F47-F58 AromaticContact CZ-CE2 3.95Å; F47-F58 HydrophobicContact CZ-CE2 3.95Å; A56-F58 HydrophobicContact CB-CD2 4.46Å; A56-F58 HydrophobicContact CB-CE1 3.99Å; A56-F58 HydrophobicContact CB-CE2 3.73Å; A56-F58 HydrophobicContact CB-CZ 3.46Å; A56-F58 VanDerWaalsContact CB-CZ 3.46Å; F58-Q77 HydrophobicContact CB-CB 4.18Å; F58-Q77 HydrophobicContact CD1-CB 3.71Å; F58-Q77 VanDerWaalsContact CD1-OE1 3.22Å; F58-Q77 HydrophobicContact CD2-CB 3.87Å; F58-Q77 HydrophobicContact CE1-CB 3.98Å; F58-Q77 HydrophobicContact CE1-CG 4.46Å; F58-Q77 HydrophobicContact CE2-CB 4.11Å; F58-Q77 HydrophobicContact CG-CB 3.65Å; F58-Q77 HydrophobicContact CZ-CB 4.17Å; F58-A78 HydrophobicContact CB-CB 3.79Å; F58-A78 WeakPolarHBondContact O-CB 3.26Å; F58-L81 HydrophobicContact CD2-CB 4.28Å; F58-L81 HydrophobicContact CD2-CD2 3.91Å; F58-L81 HydrophobicContact CE2-CD2 4.03Å
59	T	95.6	Very high	94	Very high	129 Å²	129	86.6 Å²	86.6	79%	0.791	45%	0.453	S	S	*	.			trans	-97.9	136.3	171.3	-53	0	0	0	0	109.2	P61	T59-P61 WeakPolarHBondContact O-CD 3.38Å
60	C	96.5	Very high	94	Very high	27 Å²	27	86 Å²	86	18%	0.182	45%	0.454	C	S	.	.			trans	-71.5	126.6	173.5	-172.9	0	0	0	0	108.9	F62 G64 C66 C76 A78 C79	C60-F62 PolarHBondContact O-N 3.38Å; C60-F62 PolarHBondContact SG-N 3.14Å; C60-F62 VanDerWaalsContact SG-N 3.38Å; C60-G64 PolarHBondContact SG-N 3.21Å; C60-C66 VanDerWaalsContact SG-SG 3.69Å; C60-C76 PolarHBondContact SG-SG 3.04Å; C60-A78 HydrophobicContact CB-CB 4.06Å; C60-C79 VanDerWaalsContact SG-SG 3.61Å
61	P	93.4	Very high	94.1	Very high	88 Å²	88	86.4 Å²	86.4	57%	0.571	47%	0.465	S	S	*	.	S	Bend	trans	-76.6	0.4	174.3	30.6	-31.3	0	0	0	112.7	T59	T59-P61 WeakPolarHBondContact O-CD 3.38Å
62	F	93.1	Very high	94	Very high	134 Å²	134	88.6 Å²	88.6	59%	0.588	48%	0.476	S	S	*	.	S	Bend	trans	-123.7	-138.7	-177.9	-49.2	-74.2	0	0	0	110.1	C60 C66 C76	C60-F62 PolarHBondContact O-N 3.38Å; C60-F62 PolarHBondContact SG-N 3.14Å; C60-F62 VanDerWaalsContact SG-N 3.38Å; F62-C66 WeakPolarHBondContact CD2-SG 3.36Å; F62-C76 HydrophobicContact CD2-CB 4.31Å; F62-C76 HydrophobicContact CE2-CB 4.28Å
63	N	93.4	Very high	94	Very high	124 Å²	124	87.8 Å²	87.8	66%	0.663	47%	0.47	S	S	*	.	S	Bend	trans	-94.5	6.7	-174.7	66.8	1.2	0	0	0	115.4	S65	N63-S65 VanDerWaalsContact C-N 3.31Å; N63-S65 PolarHBondContact ND2-OG 2.92Å; N63-S65 VanDerWaalsContact ND2-OG 3.13Å; N63-S65 PolarHBondContact O-N 3.36Å; N63-S65 PolarHBondContact OD1-N 3.07Å; N63-S65 PolarHBondContact OD1-OG 3.02Å
64	G	92.6	Very high	94.3	Very high	29 Å²	29	93.3 Å²	93.3	30%	0.299	49%	0.489	S	S	.	.	S	Bend	trans	77.8	3.6	-177.6	0	0	0	0	0	116.3	C60 C79	C60-G64 PolarHBondContact SG-N 3.21Å; G64-C79 PolarHBondContact O-SG 2.79Å; G64-C79 VanDerWaalsContact O-SG 3.38Å
65	S	94.8	Very high	94.6	Very high	82 Å²	82	90 Å²	90	57%	0.573	48%	0.481	S	S	*	.			trans	-125.1	32.5	-179.2	62	0	0	0	0	114.1	N63 T67	N63-S65 VanDerWaalsContact C-N 3.31Å; N63-S65 PolarHBondContact ND2-OG 2.92Å; N63-S65 VanDerWaalsContact ND2-OG 3.13Å; N63-S65 PolarHBondContact O-N 3.36Å; N63-S65 PolarHBondContact OD1-N 3.07Å; N63-S65 PolarHBondContact OD1-OG 3.02Å; S65-T67 PolarHBondContact O-N 3.4Å
66	C	96.5	Very high	94.9	Very high	32 Å²	32	81 Å²	81	22%	0.216	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-62.8	127	-179.6	-50.4	0	0	0	0	112.5	C60 F62 I68 C76 C79	C60-C66 VanDerWaalsContact SG-SG 3.69Å; F62-C66 WeakPolarHBondContact CD2-SG 3.36Å; C66-I68 HydrophobicContact CB-CD1 4.42Å; C66-I68 PolarHBondContact O-N 3.14Å; C66-C76 HydrophobicContact CB-CB 4.34Å; C66-C79 HydrophobicContact CB-CB 3.74Å; C66-C79 PolarHBondContact N-SG 3.24Å; C66-C79 VanDerWaalsContact SG-SG 3.64Å
67	T	96	Very high	95.2	Very high	111 Å²	111	84.3 Å²	84.3	68%	0.681	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-69.4	123.6	169.4	-55.6	0	0	0	0	110.3	S65 T69 N72	S65-T67 PolarHBondContact O-N 3.4Å; T67-T69 HydrophobicContact CG2-CG2 4.36Å; T67-N72 PolarHBondContact O-ND2 3.48Å; T67-N72 PolarHBondContact O-OD1 2.93Å
68	I	97.6	Very high	95.5	Very high	19 Å²	19	79.7 Å²	79.7	10%	0.097	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-96.3	122	-177.1	-54.6	-60.4	0	0	0	110.7	V26 C27 C66 N72 R73 C79 R80 R83	V26-I68 HydrophobicContact CG1-CG2 4.27Å; V26-I68 WeakPolarHBondContact O-CB 3.48Å; V26-I68 WeakPolarHBondContact O-CG2 3.47Å; C27-I68 HydrophobicContact CB-CG2 3.99Å; C66-I68 HydrophobicContact CB-CD1 4.42Å; C66-I68 PolarHBondContact O-N 3.14Å; I68-N72 WeakPolarHBondContact CA-OD1 3.24Å; I68-R73 HydrophobicContact CG2-CB 3.69Å; I68-C79 HydrophobicContact CD1-CB 4.08Å; I68-R80 HydrophobicContact CD1-CB 4.18Å; I68-R80 HydrophobicContact CG1-CB 4.44Å; I68-R80 HydrophobicContact CG2-CG 4.36Å; I68-R83 HydrophobicContact CG1-CB 4.44Å
69	T	97.1	Very high	95.6	Very high	52 Å²	52	77.3 Å²	77.3	32%	0.319	41%	0.413	S	S	.	.			trans	-126.5	171.1	178.4	72.2	0	0	0	0	110.9	C27 T67 D71 N72 R73	C27-T69 CarbonylContact O-C 3.55Å; C27-T69 VanDerWaalsContact O-CA 3.28Å; C27-T69 WeakPolarHBondContact O-CA 3.39Å; T67-T69 HydrophobicContact CG2-CG2 4.36Å; T69-D71 PolarHBondContact O-N 2.99Å; T69-N72 PolarHBondContact N-OD1 3.02Å; T69-N72 PolarHBondContact O-N 3.38Å; T69-N72 PolarHBondContact OG1-N 2.79Å; T69-N72 PolarHBondContact OG1-ND2 3.38Å; T69-N72 PolarHBondContact OG1-OD1 3.1Å; T69-R73 WeakPolarHBondContact O-CB 3.47Å; T69-R73 PolarHBondContact O-N 3.07Å
70	K	95.9	Very high	95.7	Very high	108 Å²	108	72 Å²	72	47%	0.47	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-42.8	-179.9	179.3	176.7	-179.6	155.4	0	111.9	C27 D29 R73	C27-K70 PolarHBondContact O-N 3Å; D29-K70 HydrophobicContact CB-CB 4.27Å; D29-K70 HydrophobicContact CB-CD 4.19Å; D29-K70 HydrophobicContact CB-CG 4.11Å; D29-K70 WeakPolarHBondContact OD1-CD 3.13Å; D29-K70 VanDerWaalsContact OD1-CE 3.23Å; D29-K70 WeakPolarHBondContact OD1-CE 3.47Å; D29-K70 IonicContact OD1-NZ 2.85Å; D29-K70 PolarHBondContact OD1-NZ 3.15Å; K70-R73 WeakPolarHBondContact O-CG 3.24Å; K70-R73 PolarHBondContact O-NE 3.29Å
71	D	95.9	Very high	95.8	Very high	135 Å²	135	72 Å²	72	72%	0.722	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-36.1	-175	-50.3	-47.5	0	0	0	111	T69	T69-D71 PolarHBondContact O-N 2.99Å
72	N	94.4	Very high	95.9	Very high	51 Å²	51	73.7 Å²	73.7	27%	0.273	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-7.5	-172.1	83.4	16	0	0	0	115.2	T67 I68 T69 R74 H75	T67-N72 PolarHBondContact O-ND2 3.48Å; T67-N72 PolarHBondContact O-OD1 2.93Å; I68-N72 WeakPolarHBondContact CA-OD1 3.24Å; T69-N72 PolarHBondContact N-OD1 3.02Å; T69-N72 PolarHBondContact O-N 3.38Å; T69-N72 PolarHBondContact OG1-N 2.79Å; T69-N72 PolarHBondContact OG1-ND2 3.38Å; T69-N72 PolarHBondContact OG1-OD1 3.1Å; N72-R74 PolarHBondContact O-N 3.39Å; N72-H75 WeakPolarHBondContact CA-ND1 3.34Å; N72-H75 WeakPolarHBondContact O-CB 3.47Å; N72-H75 PolarHBondContact O-N 3.21Å; N72-H75 PolarHBondContact O-ND1 2.95Å
73	R	95	Very high	96.1	Very high	36 Å²	36	72.6 Å²	72.6	14%	0.136	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-2.6	-176.1	66.5	-170.2	-179.4	-174.3	-4	116.2	C27 D29 C41 I68 T69 K70 R80	C27-R73 HydrophobicContact CB-CB 4.16Å; C27-R73 PolarHBondContact SG-NH1 2.88Å; D29-R73 IonicContact OD2-CZ 3.75Å; D29-R73 IonicContact OD2-NH1 2.6Å; D29-R73 PolarHBondContact OD2-NH1 3.29Å; D29-R73 IonicContact OD2-NH2 3.16Å; D29-R73 PolarHBondContact OD2-NH2 2.72Å; D29-R73 VanDerWaalsContact OD2-NH2 3.16Å; C41-R73 PolarHBondContact SG-NH1 3.01Å; I68-R73 HydrophobicContact CG2-CB 3.69Å; T69-R73 WeakPolarHBondContact O-CB 3.47Å; T69-R73 PolarHBondContact O-N 3.07Å; K70-R73 WeakPolarHBondContact O-CG 3.24Å; K70-R73 PolarHBondContact O-NE 3.29Å; R73-R80 WeakPolarHBondContact O-CD 3.41Å; R73-R80 PolarHBondContact O-NH1 3.34Å
74	R	95.3	Very high	96.3	Very high	207 Å²	207	66.7 Å²	66.7	78%	0.781	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-18.1	173.9	-64.3	-178.4	-178.1	-119.9	5.8	113.2	N72	N72-R74 PolarHBondContact O-N 3.39Å
75	H	95.6	Very high	96.5	Very high	129 Å²	129	68.7 Å²	68.7	60%	0.597	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-29.5	-172.7	-61.5	89.5	0	0	0	113.9	N72	N72-H75 WeakPolarHBondContact CA-ND1 3.34Å; N72-H75 WeakPolarHBondContact O-CB 3.47Å; N72-H75 PolarHBondContact O-N 3.21Å; N72-H75 PolarHBondContact O-ND1 2.95Å
76	C	96.9	Very high	96.6	Very high	4 Å²	4	69.5 Å²	69.5	3%	0.027	34%	0.339	C	S	.	.			trans	-138.6	104.2	177.8	-177.4	0	0	0	0	111.1	C60 F62 C66 C79 R80	C60-C76 PolarHBondContact SG-SG 3.04Å; F62-C76 HydrophobicContact CD2-CB 4.31Å; F62-C76 HydrophobicContact CE2-CB 4.28Å; C66-C76 HydrophobicContact CB-CB 4.34Å; C76-C79 HydrophobicContact CB-CB 4.38Å; C76-C79 PolarHBondContact SG-N 3.12Å; C76-C79 VanDerWaalsContact SG-SG 3.64Å; C76-R80 VanDerWaalsContact O-CB 3.3Å; C76-R80 WeakPolarHBondContact O-CB 3.25Å; C76-R80 PolarHBondContact O-N 3.24Å
77	Q	97.1	Very high	96.6	Very high	98 Å²	98	70 Å²	70	46%	0.458	34%	0.339	S	S	.	.	H	α-helix	trans	-71.1	-32.2	178.2	-65.8	176.1	-26	0	0	111.9	F47 F58 R80 L81	F47-Q77 HydrophobicContact CE2-CB 4.13Å; F47-Q77 HydrophobicContact CE2-CG 4.09Å; F47-Q77 HydrophobicContact CZ-CB 4.14Å; F47-Q77 WeakPolarHBondContact CZ-O 3.16Å; F58-Q77 HydrophobicContact CB-CB 4.18Å; F58-Q77 HydrophobicContact CD1-CB 3.71Å; F58-Q77 VanDerWaalsContact CD1-OE1 3.22Å; F58-Q77 HydrophobicContact CD2-CB 3.87Å; F58-Q77 HydrophobicContact CE1-CB 3.98Å; F58-Q77 HydrophobicContact CE1-CG 4.46Å; F58-Q77 HydrophobicContact CE2-CB 4.11Å; F58-Q77 HydrophobicContact CG-CB 3.65Å; F58-Q77 HydrophobicContact CZ-CB 4.17Å; Q77-R80 PolarHBondContact O-N 3.47Å; Q77-L81 WeakPolarHBondContact O-CB 3.19Å; Q77-L81 PolarHBondContact O-N 2.85Å
78	A	97.4	Very high	96.6	Very high	19 Å²	19	65.9 Å²	65.9	16%	0.157	32%	0.319	C	S	.	.	H	α-helix	trans	-62.8	-56.3	178.1	0	0	0	0	0	112.2	F58 C60 R80 L81 K82	F58-A78 HydrophobicContact CB-CB 3.79Å; F58-A78 WeakPolarHBondContact O-CB 3.26Å; C60-A78 HydrophobicContact CB-CB 4.06Å; A78-R80 VanDerWaalsContact C-N 3.27Å; A78-R80 PolarHBondContact O-N 2.91Å; A78-L81 PolarHBondContact O-N 2.8Å; A78-K82 WeakPolarHBondContact O-CB 3.14Å; A78-K82 PolarHBondContact O-N 3.39Å
79	C	97.6	Very high	96.6	Very high	9 Å²	9	65.3 Å²	65.3	6%	0.061	32%	0.316	C	S	.	.	H	α-helix	trans	-65.8	-30.4	177.7	-66	0	0	0	0	112.2	C60 G64 C66 I68 C76 R83	C60-C79 VanDerWaalsContact SG-SG 3.61Å; G64-C79 PolarHBondContact O-SG 2.79Å; G64-C79 VanDerWaalsContact O-SG 3.38Å; C66-C79 HydrophobicContact CB-CB 3.74Å; C66-C79 PolarHBondContact N-SG 3.24Å; C66-C79 VanDerWaalsContact SG-SG 3.64Å; I68-C79 HydrophobicContact CD1-CB 4.08Å; C76-C79 HydrophobicContact CB-CB 4.38Å; C76-C79 PolarHBondContact SG-N 3.12Å; C76-C79 VanDerWaalsContact SG-SG 3.64Å; C79-R83 VanDerWaalsContact O-CB 3.31Å; C79-R83 WeakPolarHBondContact O-CB 3.49Å; C79-R83 PolarHBondContact O-N 3.02Å
80	R	98	Very high	96.5	Very high	18 Å²	18	66.5 Å²	66.5	7%	0.068	32%	0.319	C	S	.	.	H	α-helix	trans	-66.6	-46.1	173.2	-173.1	-175.9	-167.7	176.5	-8.2	112.7	V26 G43 C44 F47 I68 R73 C76 Q77 A78 R83 C84	V26-R80 HydrophobicContact CG1-CG 4.14Å; G43-R80 PolarHBondContact O-NH2 3.13Å; C44-R80 PolarHBondContact SG-NH2 2.85Å; C44-R80 VanDerWaalsContact SG-NH2 3.39Å; F47-R80 HydrophobicContact CD1-CG 3.82Å; F47-R80 HydrophobicContact CE1-CB 3.92Å; F47-R80 HydrophobicContact CE1-CG 3.56Å; F47-R80 HydrophobicContact CZ-CB 4.15Å; F47-R80 HydrophobicContact CZ-CG 4.17Å; I68-R80 HydrophobicContact CD1-CB 4.18Å; I68-R80 HydrophobicContact CG1-CB 4.44Å; I68-R80 HydrophobicContact CG2-CG 4.36Å; R73-R80 WeakPolarHBondContact O-CD 3.41Å; R73-R80 PolarHBondContact O-NH1 3.34Å; C76-R80 VanDerWaalsContact O-CB 3.3Å; C76-R80 WeakPolarHBondContact O-CB 3.25Å; C76-R80 PolarHBondContact O-N 3.24Å; Q77-R80 PolarHBondContact O-N 3.47Å; A78-R80 VanDerWaalsContact C-N 3.27Å; A78-R80 PolarHBondContact O-N 2.91Å; R80-R83 PolarHBondContact O-N 3.12Å; R80-C84 PolarHBondContact O-N 2.99Å; R80-C84 PolarHBondContact O-SG 3.49Å; R80-C84 VanDerWaalsContact O-SG 3.35Å
81	L	97.4	Very high	96.3	Very high	27 Å²	27	67.3 Å²	67.3	14%	0.141	32%	0.322	C	S	.	.	H	α-helix	trans	-66.3	-42.2	178.6	-176.9	61.1	0	0	0	110.8	F47 F48 M52 F58 Q77 A78 R83 C84 V85	F47-L81 HydrophobicContact CE1-CB 3.89Å; F47-L81 HydrophobicContact CE1-CD1 4.27Å; F47-L81 HydrophobicContact CZ-CB 4.05Å; F48-L81 HydrophobicContact CD2-CD1 4Å; F48-L81 HydrophobicContact CE2-CD1 4.45Å; M52-L81 HydrophobicContact CE-CD1 4.2Å; F58-L81 HydrophobicContact CD2-CB 4.28Å; F58-L81 HydrophobicContact CD2-CD2 3.91Å; F58-L81 HydrophobicContact CE2-CD2 4.03Å; Q77-L81 WeakPolarHBondContact O-CB 3.19Å; Q77-L81 PolarHBondContact O-N 2.85Å; A78-L81 PolarHBondContact O-N 2.8Å; L81-R83 VanDerWaalsContact C-N 3.34Å; L81-R83 PolarHBondContact O-N 3.17Å; L81-C84 WeakPolarHBondContact O-CB 3.45Å; L81-C84 PolarHBondContact O-N 3.48Å; L81-V85 PolarHBondContact O-N 3.39Å; L81-V85 VanDerWaalsContact O-N 3.15Å
82	K	96.7	Very high	96.1	Very high	123 Å²	123	67.3 Å²	67.3	54%	0.535	32%	0.318	S	S	.	.	H	α-helix	trans	-53.5	-52.2	171.4	-177.7	177.6	176.8	178	0	110.6	A78 C84 V85 D86	A78-K82 WeakPolarHBondContact O-CB 3.14Å; A78-K82 PolarHBondContact O-N 3.39Å; K82-C84 VanDerWaalsContact C-N 3.31Å; K82-C84 PolarHBondContact O-N 3.37Å; K82-V85 PolarHBondContact O-N 2.9Å; K82-D86 PolarHBondContact O-N 3.29Å
83	R	97.6	Very high	95.9	Very high	111 Å²	111	70.8 Å²	70.8	42%	0.419	33%	0.331	S	S	.	.	H	α-helix	trans	-60.6	-36.8	178.4	-174.3	60.3	179.5	169.7	0.1	113.3	G25 V26 I68 C79 R80 L81 V85 D86 I87	G25-R83 PolarHBondContact O-NE 3.37Å; G25-R83 PolarHBondContact O-NH2 2.88Å; V26-R83 HydrophobicContact CB-CG 4.5Å; V26-R83 HydrophobicContact CG1-CB 4.31Å; V26-R83 HydrophobicContact CG1-CG 4.08Å; I68-R83 HydrophobicContact CG1-CB 4.44Å; C79-R83 VanDerWaalsContact O-CB 3.31Å; C79-R83 WeakPolarHBondContact O-CB 3.49Å; C79-R83 PolarHBondContact O-N 3.02Å; R80-R83 PolarHBondContact O-N 3.12Å; L81-R83 VanDerWaalsContact C-N 3.34Å; L81-R83 PolarHBondContact O-N 3.17Å; R83-V85 VanDerWaalsContact C-N 3.34Å; R83-D86 PolarHBondContact O-N 3.32Å; R83-I87 WeakPolarHBondContact O-CG1 3.28Å; R83-I87 WeakPolarHBondContact O-CG2 3.49Å; R83-I87 PolarHBondContact O-N 3.36Å; R83-I87 VanDerWaalsContact O-N 3.16Å
84	C	97.8	Very high	95.8	Very high	0 Å²	0	70 Å²	70	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-58.5	-45	173.5	-73.2	0	0	0	0	112	F48 R80 L81 K82 I87 M89	F48-C84 HydrophobicContact CD2-CB 3.45Å; F48-C84 VanDerWaalsContact CD2-CB 3.45Å; F48-C84 HydrophobicContact CE2-CB 4.01Å; F48-C84 HydrophobicContact CG-CB 4.33Å; R80-C84 PolarHBondContact O-N 2.99Å; R80-C84 PolarHBondContact O-SG 3.49Å; R80-C84 VanDerWaalsContact O-SG 3.35Å; L81-C84 WeakPolarHBondContact O-CB 3.45Å; L81-C84 PolarHBondContact O-N 3.48Å; K82-C84 VanDerWaalsContact C-N 3.31Å; K82-C84 PolarHBondContact O-N 3.37Å; C84-I87 VanDerWaalsContact O-CG1 3.24Å; C84-I87 WeakPolarHBondContact O-CG1 3.44Å; C84-M89 HydrophobicContact CB-CB 4.48Å; C84-M89 HydrophobicContact CB-CG 4.39Å; C84-M89 HydrophobicContact CB-SD 3.59Å; C84-M89 VanDerWaalsContact CB-SD 3.59Å; C84-M89 WeakPolarHBondContact O-CB 3.5Å; C84-M89 VanDerWaalsContact O-CG 3.25Å; C84-M89 WeakPolarHBondContact O-CG 3.49Å; C84-M89 PolarHBondContact O-N 2.81Å; C84-M89 VanDerWaalsContact O-N 3.07Å
85	V	96.5	Very high	95.5	Very high	71 Å²	71	63.9 Å²	63.9	43%	0.43	31%	0.312	S	S	.	.	H	α-helix	trans	-68.6	-43.7	177.7	178.1	0	0	0	0	110.7	F48 M52 L81 K82 R83 I87 G88	F48-V85 HydrophobicContact CE2-CG2 4.06Å; M52-V85 HydrophobicContact CE-CG2 3.69Å; L81-V85 PolarHBondContact O-N 3.39Å; L81-V85 VanDerWaalsContact O-N 3.15Å; K82-V85 PolarHBondContact O-N 2.9Å; R83-V85 VanDerWaalsContact C-N 3.34Å; V85-I87 PolarHBondContact O-N 3.44Å; V85-G88 WeakPolarHBondContact O-CA 3.3Å; V85-G88 PolarHBondContact O-N 2.97Å
86	D	96.7	Very high	95.2	Very high	99 Å²	99	61 Å²	61	53%	0.529	30%	0.303	S	S	.	.	H	α-helix	trans	-59.3	-32.3	-178.5	-64.4	-17.4	0	0	0	112.9	K82 R83 G88	K82-D86 PolarHBondContact O-N 3.29Å; R83-D86 PolarHBondContact O-N 3.32Å; D86-G88 VanDerWaalsContact C-N 3.25Å; D86-G88 PolarHBondContact O-N 3.35Å
87	I	96.4	Very high	94.8	Very high	42 Å²	42	66.7 Å²	66.7	22%	0.215	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	5.5	176.5	69.5	157.7	0	0	0	113.6	G25 V26 A38 T40 R83 C84 V85 M89	G25-I87 WeakPolarHBondContact O-CG2 3.44Å; V26-I87 HydrophobicContact CB-CD1 4.49Å; V26-I87 HydrophobicContact CG2-CD1 3.32Å; V26-I87 HydrophobicContact CG2-CG1 4.1Å; A38-I87 HydrophobicContact CB-CD1 3.82Å; A38-I87 HydrophobicContact CB-CG1 4.12Å; T40-I87 HydrophobicContact CG2-CD1 3.71Å; R83-I87 WeakPolarHBondContact O-CG1 3.28Å; R83-I87 WeakPolarHBondContact O-CG2 3.49Å; R83-I87 PolarHBondContact O-N 3.36Å; R83-I87 VanDerWaalsContact O-N 3.16Å; C84-I87 VanDerWaalsContact O-CG1 3.24Å; C84-I87 WeakPolarHBondContact O-CG1 3.44Å; V85-I87 PolarHBondContact O-N 3.44Å; I87-M89 HydrophobicContact CD1-CG 4.28Å; I87-M89 HydrophobicContact CG1-CG 4.19Å
88	G	95.5	Very high	94.5	Very high	25 Å²	25	69.1 Å²	69.1	26%	0.258	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.6	21	175.5	0	0	0	0	0	115.6	V85 D86 M90	V85-G88 WeakPolarHBondContact O-CA 3.3Å; V85-G88 PolarHBondContact O-N 2.97Å; D86-G88 VanDerWaalsContact C-N 3.25Å; D86-G88 PolarHBondContact O-N 3.35Å; G88-M90 PolarHBondContact O-N 3.39Å
89	M	97.5	Very high	94.2	Very high	7 Å²	7	71.5 Å²	71.5	3%	0.034	35%	0.353	C	S	.	.			trans	-69.2	124.1	169.7	-62.5	-177.4	78.7	0	0	110.3	V26 F36 A38 T40 F48 C84 I87	V26-M89 HydrophobicContact CG2-SD 4.31Å; F36-M89 HydrophobicContact CB-CB 4.48Å; F36-M89 HydrophobicContact CB-CE 4.28Å; F36-M89 HydrophobicContact CD2-CE 3.57Å; F36-M89 HydrophobicContact CE2-CE 4.44Å; F36-M89 HydrophobicContact CG-CE 4.4Å; F36-M89 CarbonylContact O-C 3.16Å; F36-M89 VanDerWaalsContact O-CA 3.26Å; F36-M89 WeakPolarHBondContact O-CA 3.16Å; A38-M89 HydrophobicContact CB-CG 3.68Å; T40-M89 HydrophobicContact CG2-CE 4.32Å; T40-M89 HydrophobicContact CG2-CG 4.42Å; T40-M89 HydrophobicContact CG2-SD 3.87Å; F48-M89 HydrophobicContact CB-CE 3.48Å; F48-M89 VanDerWaalsContact CB-CE 3.48Å; F48-M89 HydrophobicContact CB-SD 4Å; F48-M89 HydrophobicContact CD1-CB 4.07Å; F48-M89 HydrophobicContact CD1-CE 3.67Å; F48-M89 HydrophobicContact CD1-SD 4.46Å; F48-M89 HydrophobicContact CD2-CB 3.94Å; F48-M89 HydrophobicContact CD2-CE 4.31Å; F48-M89 HydrophobicContact CD2-SD 4.11Å; F48-M89 HydrophobicContact CE1-CB 3.77Å; F48-M89 HydrophobicContact CE1-CE 4.47Å; F48-M89 HydrophobicContact CE2-CB 3.59Å; F48-M89 HydrophobicContact CG-CB 4.14Å; F48-M89 HydrophobicContact CG-CE 3.56Å; F48-M89 HydrophobicContact CG-SD 3.95Å; F48-M89 VanDerWaalsContact CZ-C 3.49Å; F48-M89 HydrophobicContact CZ-CB 3.51Å; F48-M89 WeakPolarHBondContact CZ-O 3.23Å; C84-M89 HydrophobicContact CB-CB 4.48Å; C84-M89 HydrophobicContact CB-CG 4.39Å; C84-M89 HydrophobicContact CB-SD 3.59Å; C84-M89 VanDerWaalsContact CB-SD 3.59Å; C84-M89 WeakPolarHBondContact O-CB 3.5Å; C84-M89 VanDerWaalsContact O-CG 3.25Å; C84-M89 WeakPolarHBondContact O-CG 3.49Å; C84-M89 PolarHBondContact O-N 2.81Å; C84-M89 VanDerWaalsContact O-N 3.07Å; I87-M89 HydrophobicContact CD1-CG 4.28Å; I87-M89 HydrophobicContact CG1-CG 4.19Å
90	M	95.1	Very high	93.8	Very high	78 Å²	78	73.4 Å²	73.4	38%	0.384	36%	0.364	S	S	.	.			trans	-107.8	128.4	-173.1	-71.8	174.2	-174.1	0	0	111.2	F36 N37 G88 E92 F93	F36-M90 PolarHBondContact O-N 3.36Å; N37-M90 HydrophobicContact CB-CG 4.37Å; N37-M90 HydrophobicContact CB-SD 3.98Å; N37-M90 WeakPolarHBondContact ND2-CE 3.19Å; G88-M90 PolarHBondContact O-N 3.39Å; M90-E92 WeakPolarHBondContact CB-OE2 3.43Å; M90-E92 PolarHBondContact O-N 3.13Å; M90-F93 HydrophobicContact CB-CD2 3.65Å; M90-F93 HydrophobicContact CB-CE2 4.05Å; M90-F93 PolarHBondContact O-N 3.27Å; M90-F93 HydrophobicContact SD-CD2 4.28Å; M90-F93 HydrophobicContact SD-CE2 3.7Å
91	K	92.5	Very high	93.6	Very high	124 Å²	124	76.9 Å²	76.9	54%	0.539	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-70.8	-23	-178.6	66.2	176.2	-178.6	-178.1	0	112.1	M52 F93 I94	M52-K91 HydrophobicContact CB-CB 4.28Å; M52-K91 HydrophobicContact CG-CB 3.99Å; M52-K91 HydrophobicContact SD-CB 4.06Å; K91-F93 PolarHBondContact O-N 3.42Å; K91-I94 HydrophobicContact CB-CD1 4.36Å; K91-I94 VanDerWaalsContact O-CB 3.28Å; K91-I94 WeakPolarHBondContact O-CB 3.49Å; K91-I94 PolarHBondContact O-N 2.81Å
92	E	90.9	Very high	93.4	Very high	135 Å²	135	82.4 Å²	82.4	63%	0.631	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-63.6	-22.5	-178.8	-63.3	68.2	-148.7	0	0	111.7	M90 I94	M90-E92 WeakPolarHBondContact CB-OE2 3.43Å; M90-E92 PolarHBondContact O-N 3.13Å; E92-I94 VanDerWaalsContact C-N 3.33Å
93	F	91.2	Very high	93.2	Very high	124 Å²	124	82.5 Å²	82.5	54%	0.544	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-87	1.1	174.1	-71.2	-88.6	0	0	0	113.6	F36 N37 M90 K91 L95	F36-F93 HydrophobicContact CB-CB 4.37Å; F36-F93 HydrophobicContact CD1-CB 3.92Å; N37-F93 HydrophobicContact CB-CD2 4.4Å; N37-F93 HydrophobicContact CB-CE2 4.1Å; M90-F93 HydrophobicContact CB-CD2 3.65Å; M90-F93 HydrophobicContact CB-CE2 4.05Å; M90-F93 PolarHBondContact O-N 3.27Å; M90-F93 HydrophobicContact SD-CD2 4.28Å; M90-F93 HydrophobicContact SD-CE2 3.7Å; K91-F93 PolarHBondContact O-N 3.42Å; F93-L95 PolarHBondContact O-N 3.45Å
94	I	91.3	Very high	93.1	Very high	20 Å²	20	83.1 Å²	83.1	10%	0.103	41%	0.406	C	S	.	.	S	Bend	trans	-86.9	110	174.6	-60.6	168.2	0	0	0	108.6	F36 F48 R49 M52 K53 K91 E92 T96	F36-I94 HydrophobicContact CD1-CG1 3.61Å; F36-I94 HydrophobicContact CE1-CB 4.23Å; F36-I94 HydrophobicContact CE1-CG1 3.43Å; F36-I94 VanDerWaalsContact CE1-CG1 3.43Å; F36-I94 HydrophobicContact CG-CG1 4.38Å; F36-I94 HydrophobicContact CZ-CG1 4.02Å; F48-I94 HydrophobicContact CD1-CD1 4.1Å; F48-I94 HydrophobicContact CE1-CD1 3.97Å; R49-I94 HydrophobicContact CG-CG2 4.07Å; M52-I94 HydrophobicContact CB-CD1 3.42Å; M52-I94 VanDerWaalsContact CB-CD1 3.42Å; M52-I94 HydrophobicContact CG-CD1 3.93Å; K53-I94 HydrophobicContact CD-CG2 4.27Å; K53-I94 HydrophobicContact CG-CG2 3.83Å; K91-I94 HydrophobicContact CB-CD1 4.36Å; K91-I94 VanDerWaalsContact O-CB 3.28Å; K91-I94 WeakPolarHBondContact O-CB 3.49Å; K91-I94 PolarHBondContact O-N 2.81Å; E92-I94 VanDerWaalsContact C-N 3.33Å; I94-T96 PolarHBondContact O-N 2.86Å
95	L	89.3	Confident	92.9	Very high	79 Å²	79	86.5 Å²	86.5	41%	0.414	42%	0.424	S	S	.	.			trans	-55	133	176.3	-63.8	170.1	0	0	0	111.9	K53 F93 E99 V100	K53-L95 WeakPolarHBondContact CE-O 3.46Å; K53-L95 PolarHBondContact NZ-O 2.96Å; F93-L95 PolarHBondContact O-N 3.45Å; L95-E99 VanDerWaalsContact CA-OE2 3.26Å; L95-E99 WeakPolarHBondContact CA-OE2 3.35Å; L95-E99 HydrophobicContact CB-CB 4.23Å; L95-E99 HydrophobicContact CD2-CB 4.03Å; L95-V100 HydrophobicContact CB-CG2 3.83Å; L95-V100 HydrophobicContact CD1-CG2 4.43Å
96	T	88.9	Confident	92.8	Very high	68 Å²	68	87.6 Å²	87.6	42%	0.417	43%	0.427	S	S	.	.			trans	-66	163.4	171	71.7	0	0	0	0	110.5	I94 E98 E99 V100	I94-T96 PolarHBondContact O-N 2.86Å; T96-E98 PolarHBondContact O-N 2.89Å; T96-E99 PolarHBondContact N-OE2 2.9Å; T96-E99 PolarHBondContact O-N 3.15Å; T96-E99 VanDerWaalsContact OG1-CG 3.27Å; T96-E99 WeakPolarHBondContact OG1-CG 3.26Å; T96-E99 PolarHBondContact OG1-N 3.45Å; T96-E99 VanDerWaalsContact OG1-N 3.13Å; T96-E99 PolarHBondContact OG1-OE2 2.98Å; T96-V100 WeakPolarHBondContact O-CG2 3.34Å; T96-V100 PolarHBondContact O-N 3.01Å
97	D	88.8	Confident	92.7	Very high	123 Å²	123	87 Å²	87	66%	0.658	42%	0.423	S	S	*	.	H	α-helix	trans	-66.3	-32.7	179.2	-64.5	-19.9	0	0	0	111.2	K53 V100 Q101	K53-D97 IonicContact NZ-OD1 3.41Å; K53-D97 PolarHBondContact NZ-OD1 3.34Å; D97-V100 PolarHBondContact O-N 3.12Å; D97-Q101 WeakPolarHBondContact O-CB 3.41Å; D97-Q101 PolarHBondContact O-N 3.23Å
98	E	90.6	Very high	92.6	Very high	150 Å²	150	89.7 Å²	89.7	70%	0.701	43%	0.434	S	S	*	.	H	α-helix	trans	-63.7	-43	171.5	-65.9	177.3	-175.8	0	0	112.6	T96 Q101 R102	T96-E98 PolarHBondContact O-N 2.89Å; E98-Q101 PolarHBondContact O-N 3.35Å; E98-R102 WeakPolarHBondContact O-CB 3.27Å; E98-R102 PolarHBondContact O-N 3.45Å
99	E	91.1	Very high	92.6	Very high	69 Å²	69	96.5 Å²	96.5	32%	0.322	45%	0.452	S	S	.	.	H	α-helix	trans	-68.1	-37.9	177	-71.3	171	144.4	0	0	112.1	L95 T96 K103	L95-E99 VanDerWaalsContact CA-OE2 3.26Å; L95-E99 WeakPolarHBondContact CA-OE2 3.35Å; L95-E99 HydrophobicContact CB-CB 4.23Å; L95-E99 HydrophobicContact CD2-CB 4.03Å; T96-E99 PolarHBondContact N-OE2 2.9Å; T96-E99 PolarHBondContact O-N 3.15Å; T96-E99 VanDerWaalsContact OG1-CG 3.27Å; T96-E99 WeakPolarHBondContact OG1-CG 3.26Å; T96-E99 PolarHBondContact OG1-N 3.45Å; T96-E99 VanDerWaalsContact OG1-N 3.13Å; T96-E99 PolarHBondContact OG1-OE2 2.98Å; E99-K103 WeakPolarHBondContact O-CB 3.38Å; E99-K103 PolarHBondContact O-N 3.05Å
100	V	90.9	Very high	92.5	Very high	49 Å²	49	104.5 Å²	104.5	30%	0.297	48%	0.482	S	S	.	.	H	α-helix	trans	-63.1	-44.3	173.1	171.3	0	0	0	0	110.3	L95 T96 D97 K103 K104	L95-V100 HydrophobicContact CB-CG2 3.83Å; L95-V100 HydrophobicContact CD1-CG2 4.43Å; T96-V100 WeakPolarHBondContact O-CG2 3.34Å; T96-V100 PolarHBondContact O-N 3.01Å; D97-V100 PolarHBondContact O-N 3.12Å; V100-K103 PolarHBondContact O-N 3.21Å; V100-K104 WeakPolarHBondContact O-CG 3.46Å; V100-K104 PolarHBondContact O-N 2.93Å
101	Q	92.1	Very high	92.6	Very high	91 Å²	91	106.8 Å²	106.8	43%	0.425	49%	0.49	S	S	.	.	H	α-helix	trans	-64.1	-47.6	177.9	-170.3	57.9	40.9	0	0	111.2	D97 E98 K103 K104 D105	D97-Q101 WeakPolarHBondContact O-CB 3.41Å; D97-Q101 PolarHBondContact O-N 3.23Å; E98-Q101 PolarHBondContact O-N 3.35Å; Q101-K103 VanDerWaalsContact C-N 3.25Å; Q101-K103 PolarHBondContact O-N 2.98Å; Q101-K104 WeakPolarHBondContact O-CA 3.47Å; Q101-K104 WeakPolarHBondContact O-CB 3.39Å; Q101-K104 PolarHBondContact O-N 2.97Å; Q101-D105 PolarHBondContact NE2-OD1 2.99Å; Q101-D105 VanDerWaalsContact O-CG 3.24Å; Q101-D105 PolarHBondContact O-N 3.07Å
102	R	94.3	Very high	92.7	Very high	143 Å²	143	105.5 Å²	105.5	54%	0.54	49%	0.486	S	S	.	.	H	α-helix	trans	-54.6	-41.8	175.1	-163.9	-168.9	-46.8	158.7	7.8	112.1	E98 D105 L106	E98-R102 WeakPolarHBondContact O-CB 3.27Å; E98-R102 PolarHBondContact O-N 3.45Å; R102-D105 PolarHBondContact O-N 3.38Å; R102-L106 HydrophobicContact CG-CD1 4.41Å; R102-L106 WeakPolarHBondContact O-CB 3.42Å; R102-L106 WeakPolarHBondContact O-CD1 3.44Å; R102-L106 PolarHBondContact O-N 3.17Å
103	K	93.1	Very high	92.9	Very high	125 Å²	125	103.7 Å²	103.7	54%	0.543	48%	0.478	S	S	.	.	H	α-helix	trans	-67.3	-37.6	176.8	-167.9	173.4	-177.4	174.7	0	112.3	E99 V100 Q101 I107	E99-K103 WeakPolarHBondContact O-CB 3.38Å; E99-K103 PolarHBondContact O-N 3.05Å; V100-K103 PolarHBondContact O-N 3.21Å; Q101-K103 VanDerWaalsContact C-N 3.25Å; Q101-K103 PolarHBondContact O-N 2.98Å; K103-I107 HydrophobicContact CG-CD1 4.3Å; K103-I107 WeakPolarHBondContact O-CD1 3.25Å; K103-I107 VanDerWaalsContact O-CG1 3.25Å; K103-I107 WeakPolarHBondContact O-CG1 3.5Å; K103-I107 PolarHBondContact O-N 2.86Å; K103-I107 VanDerWaalsContact O-N 3.12Å
104	K	93.9	Very high	93	Very high	123 Å²	123	104 Å²	104	54%	0.535	48%	0.481	S	S	.	.	H	α-helix	trans	-64.5	-45.6	173.6	-73.2	176.9	177.8	-179.7	0	111.4	V100 Q101 L106 I107 Q108	V100-K104 WeakPolarHBondContact O-CG 3.46Å; V100-K104 PolarHBondContact O-N 2.93Å; Q101-K104 WeakPolarHBondContact O-CA 3.47Å; Q101-K104 WeakPolarHBondContact O-CB 3.39Å; Q101-K104 PolarHBondContact O-N 2.97Å; K104-L106 VanDerWaalsContact C-N 3.33Å; K104-L106 PolarHBondContact O-N 3.14Å; K104-I107 PolarHBondContact O-N 3.4Å; K104-I107 VanDerWaalsContact O-N 3.15Å; K104-Q108 PolarHBondContact O-N 3.32Å
105	D	94.5	Very high	93.2	Very high	72 Å²	72	105.9 Å²	105.9	39%	0.385	50%	0.499	S	S	.	.	H	α-helix	trans	-63.1	-41	179.8	-58.6	-19.3	0	0	0	111.1	Q101 R102 I107 Q108 R109	Q101-D105 PolarHBondContact NE2-OD1 2.99Å; Q101-D105 VanDerWaalsContact O-CG 3.24Å; Q101-D105 PolarHBondContact O-N 3.07Å; R102-D105 PolarHBondContact O-N 3.38Å; D105-I107 PolarHBondContact O-N 3.14Å; D105-Q108 PolarHBondContact O-N 3.48Å; D105-R109 WeakPolarHBondContact O-CG 3.42Å; D105-R109 PolarHBondContact O-N 3.39Å
106	L	94.3	Very high	93.4	Very high	93 Å²	93	108 Å²	108	49%	0.487	51%	0.507	S	S	.	.	H	α-helix	trans	-59	-43.4	172.4	-89.2	155.2	0	0	0	112.8	R102 K104 R110	R102-L106 HydrophobicContact CG-CD1 4.41Å; R102-L106 WeakPolarHBondContact O-CB 3.42Å; R102-L106 WeakPolarHBondContact O-CD1 3.44Å; R102-L106 PolarHBondContact O-N 3.17Å; K104-L106 VanDerWaalsContact C-N 3.33Å; K104-L106 PolarHBondContact O-N 3.14Å; L106-R110 WeakPolarHBondContact O-CG 3.43Å; L106-R110 PolarHBondContact O-N 3.48Å; L106-R110 VanDerWaalsContact O-N 3.14Å
107	I	93.8	Very high	93.6	Very high	87 Å²	87	113.1 Å²	113.1	45%	0.446	52%	0.519	S	S	.	.	H	α-helix	trans	-67.1	-41.6	178.1	-68.7	163.9	0	0	0	110.5	K103 K104 D105 R110 K111	K103-I107 HydrophobicContact CG-CD1 4.3Å; K103-I107 WeakPolarHBondContact O-CD1 3.25Å; K103-I107 VanDerWaalsContact O-CG1 3.25Å; K103-I107 WeakPolarHBondContact O-CG1 3.5Å; K103-I107 PolarHBondContact O-N 2.86Å; K103-I107 VanDerWaalsContact O-N 3.12Å; K104-I107 PolarHBondContact O-N 3.4Å; K104-I107 VanDerWaalsContact O-N 3.15Å; D105-I107 PolarHBondContact O-N 3.14Å; I107-R110 PolarHBondContact O-N 2.92Å; I107-K111 WeakPolarHBondContact O-CG 3.41Å; I107-K111 PolarHBondContact O-N 3.36Å
108	Q	95.2	Very high	93.7	Very high	98 Å²	98	112.3 Å²	112.3	46%	0.458	51%	0.511	S	S	.	.	H	α-helix	trans	-64.5	-46.3	179.8	-176.2	59	25.2	0	0	111.5	K104 D105 R110 K111 E112	K104-Q108 PolarHBondContact O-N 3.32Å; D105-Q108 PolarHBondContact O-N 3.48Å; Q108-R110 VanDerWaalsContact C-N 3.34Å; Q108-R110 PolarHBondContact O-N 2.96Å; Q108-K111 WeakPolarHBondContact O-CB 3.39Å; Q108-K111 PolarHBondContact O-N 3.48Å; Q108-K111 VanDerWaalsContact O-N 3.14Å; Q108-E112 WeakPolarHBondContact CG-OE1 3.33Å; Q108-E112 PolarHBondContact NE2-OE1 3.2Å; Q108-E112 WeakPolarHBondContact O-CG 3.47Å; Q108-E112 PolarHBondContact O-N 2.86Å
109	R	95.8	Very high	93.8	Very high	168 Å²	168	108 Å²	108	63%	0.634	50%	0.501	S	S	*	.	H	α-helix	trans	-57.9	-44.1	174.1	-73.5	-178.4	-171.5	-176	2.2	112.4	D105 K111 E112 E113	D105-R109 WeakPolarHBondContact O-CG 3.42Å; D105-R109 PolarHBondContact O-N 3.39Å; R109-K111 VanDerWaalsContact C-N 3.31Å; R109-K111 PolarHBondContact O-N 3.22Å; R109-E112 PolarHBondContact O-N 3.03Å; R109-E113 WeakPolarHBondContact O-CB 3.48Å; R109-E113 WeakPolarHBondContact O-CG 3.47Å; R109-E113 PolarHBondContact O-N 3.42Å
110	R	95.4	Very high	93.7	Very high	175 Å²	175	110 Å²	110	66%	0.66	51%	0.511	S	S	*	.	H	α-helix	trans	-60.1	-40.7	176.2	-77.4	-178.4	-177.4	-171.5	-0.2	112.6	L106 I107 Q108 E114	L106-R110 WeakPolarHBondContact O-CG 3.43Å; L106-R110 PolarHBondContact O-N 3.48Å; L106-R110 VanDerWaalsContact O-N 3.14Å; I107-R110 PolarHBondContact O-N 2.92Å; Q108-R110 VanDerWaalsContact C-N 3.34Å; Q108-R110 PolarHBondContact O-N 2.96Å; R110-E114 WeakPolarHBondContact O-CB 3.34Å; R110-E114 PolarHBondContact O-N 3.38Å
111	K	95.8	Very high	93.6	Very high	126 Å²	126	113.3 Å²	113.3	55%	0.548	52%	0.521	S	S	.	.	H	α-helix	trans	-65.3	-40.1	176	-74.9	-177.1	174.2	-171	0	112.2	I107 Q108 R109 E114 A115	I107-K111 WeakPolarHBondContact O-CG 3.41Å; I107-K111 PolarHBondContact O-N 3.36Å; Q108-K111 WeakPolarHBondContact O-CB 3.39Å; Q108-K111 PolarHBondContact O-N 3.48Å; Q108-K111 VanDerWaalsContact O-N 3.14Å; R109-K111 VanDerWaalsContact C-N 3.31Å; R109-K111 PolarHBondContact O-N 3.22Å; K111-E114 PolarHBondContact O-N 3.27Å; K111-A115 WeakPolarHBondContact O-CB 3.36Å; K111-A115 PolarHBondContact O-N 2.91Å
112	E	95.2	Very high	93.3	Very high	97 Å²	97	113.8 Å²	113.8	45%	0.453	52%	0.523	S	S	.	.	H	α-helix	trans	-66.3	-44.2	176.8	-72.9	165.6	-170.7	0	0	111.4	Q108 R109 E114 A115 Q116	Q108-E112 WeakPolarHBondContact CG-OE1 3.33Å; Q108-E112 PolarHBondContact NE2-OE1 3.2Å; Q108-E112 WeakPolarHBondContact O-CG 3.47Å; Q108-E112 PolarHBondContact O-N 2.86Å; R109-E112 PolarHBondContact O-N 3.03Å; E112-E114 VanDerWaalsContact C-N 3.35Å; E112-E114 PolarHBondContact O-N 3.5Å; E112-A115 PolarHBondContact O-N 2.93Å; E112-Q116 WeakPolarHBondContact O-CB 3.32Å; E112-Q116 WeakPolarHBondContact O-CG 3.28Å; E112-Q116 PolarHBondContact O-N 2.92Å
113	E	95.1	Very high	92.8	Very high	98 Å²	98	110.5 Å²	110.5	46%	0.458	53%	0.526	S	S	.	.	H	α-helix	trans	-61.3	-41	174.4	-73.1	171.6	-170	0	0	112	R109 R117	R109-E113 WeakPolarHBondContact O-CB 3.48Å; R109-E113 WeakPolarHBondContact O-CG 3.47Å; R109-E113 PolarHBondContact O-N 3.42Å; E113-R117 VanDerWaalsContact O-CG 3.28Å; E113-R117 WeakPolarHBondContact O-CG 3.42Å; E113-R117 PolarHBondContact O-N 3.46Å
114	E	94.4	Very high	92.4	Very high	130 Å²	130	114 Å²	114	61%	0.607	54%	0.536	S	S	*	.	H	α-helix	trans	-67.4	-43.3	176.6	-171.3	171.8	-167.3	0	0	111.7	R110 K111 E112 Q116 R117 E118	R110-E114 WeakPolarHBondContact O-CB 3.34Å; R110-E114 PolarHBondContact O-N 3.38Å; K111-E114 PolarHBondContact O-N 3.27Å; E112-E114 VanDerWaalsContact C-N 3.35Å; E112-E114 PolarHBondContact O-N 3.5Å; E114-Q116 PolarHBondContact O-N 3.31Å; E114-R117 PolarHBondContact O-N 3Å; E114-E118 PolarHBondContact O-N 3.48Å
115	A	94.6	Very high	91.9	Very high	60 Å²	60	114.9 Å²	114.9	50%	0.496	54%	0.536	S	S	.	.	H	α-helix	trans	-63.4	-39.8	175.2	0	0	0	0	0	112.3	K111 E112 E118 A119	K111-A115 WeakPolarHBondContact O-CB 3.36Å; K111-A115 PolarHBondContact O-N 2.91Å; E112-A115 PolarHBondContact O-N 2.93Å; A115-E118 PolarHBondContact O-N 3.28Å; A115-A119 WeakPolarHBondContact O-CB 3.44Å; A115-A119 PolarHBondContact O-N 2.88Å
116	Q	93.4	Very high	91.5	Very high	124 Å²	124	116.2 Å²	116.2	58%	0.579	55%	0.549	S	S	*	.	H	α-helix	trans	-63.2	-43.5	174.1	-78.6	178.4	-8	0	0	111.7	E112 E114 E118 A119 E120	E112-Q116 WeakPolarHBondContact O-CB 3.32Å; E112-Q116 WeakPolarHBondContact O-CG 3.28Å; E112-Q116 PolarHBondContact O-N 2.92Å; E114-Q116 PolarHBondContact O-N 3.31Å; Q116-E118 PolarHBondContact O-N 3.27Å; Q116-A119 PolarHBondContact O-N 2.85Å; Q116-E120 WeakPolarHBondContact O-CB 3.36Å; Q116-E120 WeakPolarHBondContact O-CG 3.35Å; Q116-E120 PolarHBondContact O-N 3.02Å
117	R	92.7	Very high	91.3	Very high	174 Å²	174	121.8 Å²	121.8	66%	0.657	56%	0.563	S	S	*	*	H	α-helix	trans	-62	-42.6	176.9	-74.7	172.7	-174.5	-174.4	4.2	112.6	E113 E114 K121	E113-R117 VanDerWaalsContact O-CG 3.28Å; E113-R117 WeakPolarHBondContact O-CG 3.42Å; E113-R117 PolarHBondContact O-N 3.46Å; E114-R117 PolarHBondContact O-N 3Å; R117-K121 VanDerWaalsContact O-CB 3.27Å; R117-K121 WeakPolarHBondContact O-CB 3.48Å; R117-K121 PolarHBondContact O-N 3.24Å
118	E	92.1	Very high	91.4	Very high	106 Å²	106	118.9 Å²	118.9	50%	0.495	55%	0.549	S	S	.	.	H	α-helix	trans	-67	-39.7	176	-73.1	-63	144.7	0	0	111.6	E114 A115 Q116 K121 E122	E114-E118 PolarHBondContact O-N 3.48Å; A115-E118 PolarHBondContact O-N 3.28Å; Q116-E118 PolarHBondContact O-N 3.27Å; E118-K121 PolarHBondContact O-N 3.01Å; E118-K121 IonicContact OE1-NZ 2.82Å; E118-K121 IonicContact OE2-NZ 3.99Å; E118-E122 PolarHBondContact O-N 3.48Å
119	A	91.4	Very high	91.4	Very high	61 Å²	61	117.6 Å²	117.6	50%	0.504	55%	0.548	S	S	.	.	H	α-helix	trans	-64.2	-42.8	175.1	0	0	0	0	0	112.6	A115 Q116 K121 E122 A123	A115-A119 WeakPolarHBondContact O-CB 3.44Å; A115-A119 PolarHBondContact O-N 2.88Å; Q116-A119 PolarHBondContact O-N 2.85Å; A119-K121 VanDerWaalsContact C-N 3.33Å; A119-K121 PolarHBondContact O-N 3.2Å; A119-E122 PolarHBondContact O-N 3.3Å; A119-A123 WeakPolarHBondContact O-CB 3.48Å; A119-A123 PolarHBondContact O-N 2.83Å
120	E	90.4	Very high	91.5	Very high	110 Å²	110	116.7 Å²	116.7	51%	0.514	56%	0.555	S	S	.	*	H	α-helix	trans	-63.8	-38.8	174.6	-77	-177.6	-173.5	0	0	112	Q116 A123 R124	Q116-E120 WeakPolarHBondContact O-CB 3.36Å; Q116-E120 WeakPolarHBondContact O-CG 3.35Å; Q116-E120 PolarHBondContact O-N 3.02Å; E120-A123 PolarHBondContact O-N 3.4Å; E120-R124 WeakPolarHBondContact O-CB 3.37Å; E120-R124 VanDerWaalsContact O-CG 3.24Å; E120-R124 WeakPolarHBondContact O-CG 3.43Å; E120-R124 PolarHBondContact O-N 3.4Å
121	K	88.9	Confident	91.5	Very high	118 Å²	118	113.8 Å²	113.8	51%	0.513	55%	0.549	S	S	.	.	H	α-helix	trans	-65.4	-41.6	176.6	-177.1	-177.5	174.4	-167.9	0	111.6	R117 E118 A119 R124 R125	R117-K121 VanDerWaalsContact O-CB 3.27Å; R117-K121 WeakPolarHBondContact O-CB 3.48Å; R117-K121 PolarHBondContact O-N 3.24Å; E118-K121 PolarHBondContact O-N 3.01Å; E118-K121 IonicContact OE1-NZ 2.82Å; E118-K121 IonicContact OE2-NZ 3.99Å; A119-K121 VanDerWaalsContact C-N 3.33Å; A119-K121 PolarHBondContact O-N 3.2Å; K121-R124 PolarHBondContact O-N 2.61Å; K121-R125 PolarHBondContact O-N 3.43Å
122	E	85.8	Confident	91.7	Very high	102 Å²	102	109.2 Å²	109.2	48%	0.477	53%	0.53	S	S	.	.	H	α-helix	trans	-65.9	-43.3	174.8	-166.5	62	-155.1	0	0	111.3	E118 A119 R124 R125	E118-E122 PolarHBondContact O-N 3.48Å; A119-E122 PolarHBondContact O-N 3.3Å; E122-R124 PolarHBondContact O-N 3.05Å; E122-R125 VanDerWaalsContact CD-NH1 3.34Å; E122-R125 WeakPolarHBondContact O-CB 3.28Å; E122-R125 PolarHBondContact O-N 3.26Å; E122-R125 WeakPolarHBondContact OE1-CD 3.27Å; E122-R125 IonicContact OE1-CZ 2.8Å; E122-R125 IonicContact OE1-NE 3.82Å; E122-R125 IonicContact OE1-NH1 3.9Å; E122-R125 PolarHBondContact OE1-NH1 3.03Å; E122-R125 WeakPolarHBondContact OE2-CD 3.24Å; E122-R125 IonicContact OE2-CZ 2.85Å; E122-R125 IonicContact OE2-NE 3.02Å; E122-R125 PolarHBondContact OE2-NE 2.97Å; E122-R125 IonicContact OE2-NH1 3.99Å; E122-R125 PolarHBondContact OE2-NH1 2.7Å; E122-R125 IonicContact OE2-NH2 3.29Å
123	A	83.8	Confident	91.8	Very high	73 Å²	73	107 Å²	107	60%	0.603	53%	0.525	S	S	*	.	H	α-helix	trans	-63.5	-27.2	177.7	0	0	0	0	0	113.4	A119 E120	A119-A123 WeakPolarHBondContact O-CB 3.48Å; A119-A123 PolarHBondContact O-N 2.83Å; E120-A123 PolarHBondContact O-N 3.4Å
124	R	84.3	Confident	92	Very high	199 Å²	199	108.3 Å²	108.3	75%	0.751	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-7.3	175.6	-72.7	174.1	-171.7	-139.2	6.1	113.7	E120 K121 E122	E120-R124 WeakPolarHBondContact O-CB 3.37Å; E120-R124 VanDerWaalsContact O-CG 3.24Å; E120-R124 WeakPolarHBondContact O-CG 3.43Å; E120-R124 PolarHBondContact O-N 3.4Å; K121-R124 PolarHBondContact O-N 2.61Å; E122-R124 PolarHBondContact O-N 3.05Å
125	R	84	Confident	92.2	Very high	142 Å²	142	102.5 Å²	102.5	54%	0.536	50%	0.504	S	S	.	.	S	Bend	trans	-63.3	132.4	177	-76.6	-176.3	174.2	172.8	-4.3	109.5	K121 E122 R127	K121-R125 PolarHBondContact O-N 3.43Å; E122-R125 VanDerWaalsContact CD-NH1 3.34Å; E122-R125 WeakPolarHBondContact O-CB 3.28Å; E122-R125 PolarHBondContact O-N 3.26Å; E122-R125 WeakPolarHBondContact OE1-CD 3.27Å; E122-R125 IonicContact OE1-CZ 2.8Å; E122-R125 IonicContact OE1-NE 3.82Å; E122-R125 IonicContact OE1-NH1 3.9Å; E122-R125 PolarHBondContact OE1-NH1 3.03Å; E122-R125 WeakPolarHBondContact OE2-CD 3.24Å; E122-R125 IonicContact OE2-CZ 2.85Å; E122-R125 IonicContact OE2-NE 3.02Å; E122-R125 PolarHBondContact OE2-NE 2.97Å; E122-R125 IonicContact OE2-NH1 3.99Å; E122-R125 PolarHBondContact OE2-NH1 2.7Å; E122-R125 IonicContact OE2-NH2 3.29Å; R125-R127 PolarHBondContact O-N 2.94Å
126	P	84.4	Confident	92.4	Very high	99 Å²	99	100.2 Å²	100.2	64%	0.643	48%	0.484	S	S	*	.			trans	-59.7	134.1	173.8	25.3	-31.6	0	0	0	108.5	L374	P126-L374 HydrophobicContact CB-CD1 4.5Å; P126-L374 HydrophobicContact CG-CD1 4.29Å; P126-L374 WeakPolarHBondContact O-CD1 3.42Å
127	R	91.1	Very high	92.6	Very high	210 Å²	210	97 Å²	97	79%	0.792	48%	0.478	S	S	*	.			trans	-142.8	153.6	175.2	58.1	179.7	171.2	175.2	-0.8	108.3	R125	R125-R127 PolarHBondContact O-N 2.94Å
128	L	95.3	Very high	92.9	Very high	27 Å²	27	89.9 Å²	89.9	14%	0.141	45%	0.454	C	S	.	.			trans	-64.7	149	169.5	-63.6	171.2	0	0	0	109.4	Q132 S133 I136 A370 Y371 L374	L128-Q132 HydrophobicContact CB-CB 4.17Å; L128-Q132 HydrophobicContact CD2-CB 4.3Å; L128-S133 WeakPolarHBondContact CB-OG 3.43Å; L128-I136 HydrophobicContact CD1-CD1 3.81Å; L128-A370 HydrophobicContact CD2-CB 3.69Å; L128-Y371 HydrophobicContact CD1-CD2 4.12Å; L128-L374 HydrophobicContact CG-CD2 4.15Å
129	T	96.2	Very high	93.2	Very high	71 Å²	71	84.8 Å²	84.8	44%	0.436	43%	0.43	S	S	.	.			trans	-69.1	160.7	167.8	68.6	0	0	0	0	110	E131 Q132 S133	T129-E131 PolarHBondContact O-N 3.12Å; T129-Q132 PolarHBondContact O-N 2.58Å; T129-Q132 WeakPolarHBondContact OG1-CB 3.48Å; T129-Q132 VanDerWaalsContact OG1-CG 3.25Å; T129-Q132 WeakPolarHBondContact OG1-CG 3.32Å; T129-Q132 PolarHBondContact OG1-N 3.4Å; T129-Q132 VanDerWaalsContact OG1-N 3.09Å; T129-S133 WeakPolarHBondContact O-CB 3.42Å; T129-S133 PolarHBondContact O-N 3.03Å; T129-S133 PolarHBondContact O-OG 3.49Å
130	D	96.7	Very high	93.6	Very high	149 Å²	149	83 Å²	83	80%	0.797	41%	0.413	S	S	*	.	H	α-helix	trans	-58.6	-37.5	176.1	-63.6	-26	0	0	0	110.9	S133 H134	D130-S133 PolarHBondContact O-N 3.45Å; D130-H134 WeakPolarHBondContact O-CB 3.42Å; D130-H134 PolarHBondContact O-N 2.73Å
131	E	97.1	Very high	94	Very high	113 Å²	113	82.1 Å²	82.1	53%	0.528	41%	0.409	S	S	.	.	H	α-helix	trans	-65.8	-47.3	176.3	-177	172.9	-151	0	0	112.5	T129 S133 H134 V135 K363	T129-E131 PolarHBondContact O-N 3.12Å; E131-S133 VanDerWaalsContact C-N 3.31Å; E131-S133 PolarHBondContact O-N 3.11Å; E131-H134 PolarHBondContact O-N 3.48Å; E131-V135 WeakPolarHBondContact O-CG2 3.44Å; E131-V135 PolarHBondContact O-N 3.25Å; E131-K363 WeakPolarHBondContact OE1-CE 3.31Å; E131-K363 IonicContact OE1-NZ 3.24Å; E131-K363 PolarHBondContact OE1-NZ 3.21Å
132	Q	98.3	Very high	94.4	Very high	31 Å²	31	76.5 Å²	76.5	15%	0.145	38%	0.384	C	S	.	.	H	α-helix	trans	-59.5	-44.1	175.6	-76.1	173.2	-25.3	0	0	111.3	L128 T129 H134 V135 I136 T367	L128-Q132 HydrophobicContact CB-CB 4.17Å; L128-Q132 HydrophobicContact CD2-CB 4.3Å; T129-Q132 PolarHBondContact O-N 2.58Å; T129-Q132 WeakPolarHBondContact OG1-CB 3.48Å; T129-Q132 VanDerWaalsContact OG1-CG 3.25Å; T129-Q132 WeakPolarHBondContact OG1-CG 3.32Å; T129-Q132 PolarHBondContact OG1-N 3.4Å; T129-Q132 VanDerWaalsContact OG1-N 3.09Å; Q132-H134 VanDerWaalsContact C-N 3.33Å; Q132-H134 PolarHBondContact O-N 2.97Å; Q132-V135 PolarHBondContact O-N 3.45Å; Q132-I136 WeakPolarHBondContact O-CG1 3.36Å; Q132-I136 PolarHBondContact O-N 3.39Å; Q132-T367 HydrophobicContact CB-CG2 4.03Å; Q132-T367 HydrophobicContact CG-CG2 4.13Å
133	S	98.1	Very high	95	Very high	51 Å²	51	71.7 Å²	71.7	36%	0.357	36%	0.362	S	S	.	.	H	α-helix	trans	-62.5	-41.3	178.2	-54.7	0	0	0	0	111.4	L128 T129 D130 E131 I136 A137	L128-S133 WeakPolarHBondContact CB-OG 3.43Å; T129-S133 WeakPolarHBondContact O-CB 3.42Å; T129-S133 PolarHBondContact O-N 3.03Å; T129-S133 PolarHBondContact O-OG 3.49Å; D130-S133 PolarHBondContact O-N 3.45Å; E131-S133 VanDerWaalsContact C-N 3.31Å; E131-S133 PolarHBondContact O-N 3.11Å; S133-I136 PolarHBondContact O-N 3.17Å; S133-A137 WeakPolarHBondContact O-CB 3.4Å; S133-A137 PolarHBondContact O-N 3.39Å
134	H	98.4	Very high	95.7	Very high	125 Å²	125	73.3 Å²	73.3	58%	0.579	36%	0.357	S	S	*	.	H	α-helix	trans	-66.1	-42.5	176.8	179.4	64	0	0	0	112.8	D130 E131 Q132 A137 T138	D130-H134 WeakPolarHBondContact O-CB 3.42Å; D130-H134 PolarHBondContact O-N 2.73Å; E131-H134 PolarHBondContact O-N 3.48Å; Q132-H134 VanDerWaalsContact C-N 3.33Å; Q132-H134 PolarHBondContact O-N 2.97Å; H134-A137 PolarHBondContact O-N 3.47Å; H134-T138 WeakPolarHBondContact O-CB 3.15Å; H134-T138 PolarHBondContact O-N 3.11Å; H134-T138 PolarHBondContact O-OG1 2.92Å
135	V	98.6	Very high	96.3	Very high	7 Å²	7	70 Å²	70	4%	0.042	35%	0.348	C	S	.	.	H	α-helix	trans	-59.2	-48.9	175.4	168.8	0	0	0	0	110.4	E131 Q132 A137 T138 L139 P249 L364	E131-V135 WeakPolarHBondContact O-CG2 3.44Å; E131-V135 PolarHBondContact O-N 3.25Å; Q132-V135 PolarHBondContact O-N 3.45Å; V135-A137 PolarHBondContact O-N 2.96Å; V135-T138 PolarHBondContact O-N 3.41Å; V135-L139 HydrophobicContact CG1-CD1 4.12Å; V135-L139 WeakPolarHBondContact O-CG 3.4Å; V135-L139 PolarHBondContact O-N 3.49Å; V135-P249 HydrophobicContact CG2-CG 4.37Å; V135-L364 HydrophobicContact CG1-CD2 3.68Å
136	I	98.8	Very high	97	Very high	13 Å²	13	63.7 Å²	63.7	7%	0.067	33%	0.325	C	S	.	.	H	α-helix	trans	-59.7	-49.7	178.8	-69.3	169.9	0	0	0	110.9	L128 Q132 S133 T138 L139 V140 E328 L332 T367 Y371	L128-I136 HydrophobicContact CD1-CD1 3.81Å; Q132-I136 WeakPolarHBondContact O-CG1 3.36Å; Q132-I136 PolarHBondContact O-N 3.39Å; S133-I136 PolarHBondContact O-N 3.17Å; I136-T138 VanDerWaalsContact C-N 3.27Å; I136-T138 PolarHBondContact O-N 3.49Å; I136-L139 PolarHBondContact O-N 2.97Å; I136-L139 VanDerWaalsContact O-N 3.15Å; I136-V140 HydrophobicContact CG2-CG2 4.34Å; I136-V140 WeakPolarHBondContact O-CG2 3.46Å; I136-V140 PolarHBondContact O-N 3.47Å; I136-E328 HydrophobicContact CG2-CB 3.81Å; I136-E328 HydrophobicContact CG2-CG 3.43Å; I136-E328 VanDerWaalsContact CG2-CG 3.43Å; I136-L332 HydrophobicContact CD1-CD1 4.35Å; I136-L332 HydrophobicContact CG1-CD1 4.04Å; I136-L332 HydrophobicContact CG1-CD2 4.5Å; I136-T367 HydrophobicContact CD1-CG2 3.79Å; I136-T367 HydrophobicContact CG1-CG2 3.69Å; I136-Y371 HydrophobicContact CD1-CD2 3.74Å; I136-Y371 HydrophobicContact CD1-CG 4.38Å
137	A	98.8	Very high	97.5	Very high	57 Å²	57	61 Å²	61	47%	0.471	30%	0.303	S	S	.	.	H	α-helix	trans	-57.9	-41.5	179	0	0	0	0	0	112.1	S133 H134 V135 V140 E141	S133-A137 WeakPolarHBondContact O-CB 3.4Å; S133-A137 PolarHBondContact O-N 3.39Å; H134-A137 PolarHBondContact O-N 3.47Å; V135-A137 PolarHBondContact O-N 2.96Å; A137-V140 PolarHBondContact O-N 2.88Å; A137-E141 WeakPolarHBondContact O-CB 3.46Å; A137-E141 PolarHBondContact O-N 3.32Å
138	T	98.8	Very high	97.6	Very high	23 Å²	23	52.9 Å²	52.9	14%	0.141	28%	0.275	C	S	.	.	H	α-helix	trans	-64	-42.5	177.7	-57	0	0	0	0	111.7	H134 V135 I136 E141 A142 M247 P249	H134-T138 WeakPolarHBondContact O-CB 3.15Å; H134-T138 PolarHBondContact O-N 3.11Å; H134-T138 PolarHBondContact O-OG1 2.92Å; V135-T138 PolarHBondContact O-N 3.41Å; I136-T138 VanDerWaalsContact C-N 3.27Å; I136-T138 PolarHBondContact O-N 3.49Å; T138-E141 PolarHBondContact O-N 2.99Å; T138-A142 VanDerWaalsContact O-CB 3.31Å; T138-A142 WeakPolarHBondContact O-CB 3.39Å; T138-A142 PolarHBondContact O-N 3.42Å; T138-M247 VanDerWaalsContact CG2-O 3.31Å; T138-M247 WeakPolarHBondContact CG2-O 3.31Å; T138-P249 HydrophobicContact CG2-CG 4.27Å
139	L	98.8	Very high	97.4	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-70.5	-37.7	179.6	-67.7	178.4	0	0	0	112.6	V135 I136 A142 H143 F244 I248 V331 L332 A335 L364	V135-L139 HydrophobicContact CG1-CD1 4.12Å; V135-L139 WeakPolarHBondContact O-CG 3.4Å; V135-L139 PolarHBondContact O-N 3.49Å; I136-L139 PolarHBondContact O-N 2.97Å; I136-L139 VanDerWaalsContact O-N 3.15Å; L139-A142 PolarHBondContact O-N 3.44Å; L139-H143 WeakPolarHBondContact O-CB 3.31Å; L139-H143 PolarHBondContact O-N 3.15Å; L139-F244 HydrophobicContact CD2-CZ 4.14Å; L139-I248 HydrophobicContact CD2-CB 4.31Å; L139-I248 HydrophobicContact CD2-CG1 3.81Å; L139-I248 HydrophobicContact CD2-CG2 4.36Å; L139-V331 HydrophobicContact CB-CB 4.11Å; L139-V331 HydrophobicContact CB-CG2 3.69Å; L139-L332 HydrophobicContact CD1-CD2 3.67Å; L139-L332 HydrophobicContact CD1-CG 4.25Å; L139-A335 HydrophobicContact CD1-CB 3.92Å; L139-A335 HydrophobicContact CD2-CB 4.04Å; L139-L364 HydrophobicContact CD1-CD2 3.96Å
140	V	98.8	Very high	97.2	Very high	24 Å²	24	57.5 Å²	57.5	15%	0.145	30%	0.302	C	S	.	.	H	α-helix	trans	-63.1	-46.7	172.9	170.9	0	0	0	0	110.2	I136 A137 A142 H143 H144 E327 E328 V331	I136-V140 HydrophobicContact CG2-CG2 4.34Å; I136-V140 WeakPolarHBondContact O-CG2 3.46Å; I136-V140 PolarHBondContact O-N 3.47Å; A137-V140 PolarHBondContact O-N 2.88Å; V140-A142 VanDerWaalsContact C-N 3.34Å; V140-A142 PolarHBondContact O-N 3.27Å; V140-H143 WeakPolarHBondContact O-CB 3.43Å; V140-H143 PolarHBondContact O-N 2.96Å; V140-H143 VanDerWaalsContact O-N 3.11Å; V140-H144 VanDerWaalsContact CG1-CE1 3.42Å; V140-H144 WeakPolarHBondContact CG1-CE1 3.42Å; V140-H144 PolarHBondContact O-N 2.8Å; V140-E327 WeakPolarHBondContact CG1-OE2 3.36Å; V140-E328 HydrophobicContact CG2-CG 4.04Å; V140-V331 HydrophobicContact CG2-CG2 3.99Å
141	E	98.7	Very high	97	Very high	90 Å²	90	51.7 Å²	51.7	42%	0.421	27%	0.269	S	S	.	.	H	α-helix	trans	-60.9	-42.9	176	-174.2	-174.9	178.6	0	0	111.9	A137 T138 H143 H144 K145 M247	A137-E141 WeakPolarHBondContact O-CB 3.46Å; A137-E141 PolarHBondContact O-N 3.32Å; T138-E141 PolarHBondContact O-N 2.99Å; E141-H143 VanDerWaalsContact C-N 3.26Å; E141-H143 PolarHBondContact O-N 3.49Å; E141-H144 PolarHBondContact O-N 3.35Å; E141-K145 HydrophobicContact CG-CD 4.15Å; E141-K145 WeakPolarHBondContact O-CB 3.34Å; E141-K145 WeakPolarHBondContact O-CG 3.35Å; E141-K145 PolarHBondContact O-N 3.46Å; E141-K145 VanDerWaalsContact OE1-CE 3.28Å; E141-K145 WeakPolarHBondContact OE1-CE 3.25Å; E141-K145 IonicContact OE1-NZ 3.76Å; E141-K145 PolarHBondContact OE1-NZ 2.93Å; E141-M247 HydrophobicContact CG-CE 4.4Å
142	A	98.7	Very high	96.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-60	-38.9	175.2	0	0	0	0	0	111.8	T138 L139 V140 T146 F244 M247	T138-A142 VanDerWaalsContact O-CB 3.31Å; T138-A142 WeakPolarHBondContact O-CB 3.39Å; T138-A142 PolarHBondContact O-N 3.42Å; L139-A142 PolarHBondContact O-N 3.44Å; V140-A142 VanDerWaalsContact C-N 3.34Å; V140-A142 PolarHBondContact O-N 3.27Å; A142-T146 WeakPolarHBondContact O-CB 3.45Å; A142-T146 VanDerWaalsContact O-CG2 3.23Å; A142-T146 WeakPolarHBondContact O-CG2 3.44Å; A142-T146 PolarHBondContact O-N 3.43Å; A142-T146 PolarHBondContact O-OG1 3.24Å; A142-F244 HydrophobicContact CB-CD2 3.71Å; A142-F244 HydrophobicContact CB-CE2 3.96Å; A142-M247 HydrophobicContact CB-CB 3.49Å; A142-M247 VanDerWaalsContact CB-CB 3.49Å; A142-M247 HydrophobicContact CB-CE 4.08Å; A142-M247 HydrophobicContact CB-CG 4.18Å; A142-M247 HydrophobicContact CB-SD 3.86Å
143	H	98.2	Very high	96.4	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.009	27%	0.27	C	S	.	.	H	α-helix	trans	-64.1	-53.7	176.4	180	56.1	0	0	0	111.1	L139 V140 E141 K145 T146 Y147 F244 Q277 E327 V331	L139-H143 WeakPolarHBondContact O-CB 3.31Å; L139-H143 PolarHBondContact O-N 3.15Å; V140-H143 WeakPolarHBondContact O-CB 3.43Å; V140-H143 PolarHBondContact O-N 2.96Å; V140-H143 VanDerWaalsContact O-N 3.11Å; E141-H143 VanDerWaalsContact C-N 3.26Å; E141-H143 PolarHBondContact O-N 3.49Å; H143-K145 VanDerWaalsContact C-N 3.27Å; H143-K145 PolarHBondContact O-N 3.25Å; H143-T146 CarbonylContact O-C 3.6Å; H143-T146 PolarHBondContact O-N 3.48Å; H143-T146 PolarHBondContact O-OG1 3.09Å; H143-Y147 AromaticContact CE1-CD1 3.96Å; H143-Y147 AromaticContact CE1-CG 3.67Å; H143-Y147 AromaticContact NE2-CD1 3.93Å; H143-Y147 VanDerWaalsContact O-CB 3.31Å; H143-Y147 WeakPolarHBondContact O-CB 3.28Å; H143-Y147 PolarHBondContact O-N 3.23Å; H143-F244 HydrophobicContact CB-CE2 4.19Å; H143-Q277 PolarHBondContact CE1-NE2 3.49Å; H143-Q277 VanDerWaalsContact CE1-NE2 3.28Å; H143-Q277 PolarHBondContact CE1-OE1 2.87Å; H143-Q277 PolarHBondContact NE2-NE2 2.97Å; H143-Q277 PolarHBondContact NE2-OE1 3.34Å; H143-E327 IonicContact CD2-OE1 2.83Å; H143-V331 HydrophobicContact CB-CG1 3.46Å; H143-V331 VanDerWaalsContact CB-CG1 3.46Å
144	H	97.8	Very high	96.1	Very high	107 Å²	107	48.1 Å²	48.1	50%	0.495	26%	0.256	S	S	.	.	H	α-helix	trans	-60	-33.7	178.4	-63.8	158.8	0	0	0	113.4	V140 E141 T146 E327	V140-H144 VanDerWaalsContact CG1-CE1 3.42Å; V140-H144 WeakPolarHBondContact CG1-CE1 3.42Å; V140-H144 PolarHBondContact O-N 2.8Å; E141-H144 PolarHBondContact O-N 3.35Å; H144-T146 VanDerWaalsContact C-N 3.29Å; H144-T146 PolarHBondContact O-N 2.94Å; H144-E327 IonicContact CD2-OE1 3.27Å; H144-E327 PolarHBondContact CD2-OE1 3.17Å; H144-E327 IonicContact CE1-OE1 3.47Å; H144-E327 IonicContact CE1-OE2 2.62Å; H144-E327 PolarHBondContact CE1-OE2 3.45Å; H144-E327 IonicContact NE2-OE1 3.98Å; H144-E327 PolarHBondContact NE2-OE1 2.94Å; H144-E327 IonicContact NE2-OE2 2.91Å; H144-E327 PolarHBondContact NE2-OE2 3.17Å; H144-E327 VanDerWaalsContact NE2-OE2 3.17Å
145	K	97.9	Very high	95.6	Very high	129 Å²	129	46.7 Å²	46.7	56%	0.561	26%	0.259	S	S	*	.	H	α-helix	trans	-73	-20.6	176.2	-78.2	177.3	171	171	0	114	E141 H143 M247	E141-K145 HydrophobicContact CG-CD 4.15Å; E141-K145 WeakPolarHBondContact O-CB 3.34Å; E141-K145 WeakPolarHBondContact O-CG 3.35Å; E141-K145 PolarHBondContact O-N 3.46Å; E141-K145 VanDerWaalsContact OE1-CE 3.28Å; E141-K145 WeakPolarHBondContact OE1-CE 3.25Å; E141-K145 IonicContact OE1-NZ 3.76Å; E141-K145 PolarHBondContact OE1-NZ 2.93Å; H143-K145 VanDerWaalsContact C-N 3.27Å; H143-K145 PolarHBondContact O-N 3.25Å; K145-M247 HydrophobicContact CD-CE 4.11Å; K145-M247 HydrophobicContact CD-SD 4.03Å
146	T	97.8	Very high	95.3	Very high	10 Å²	10	55.4 Å²	55.4	6%	0.061	29%	0.291	C	S	.	.	H	α-helix	trans	-118	-1.5	-172.2	64.8	0	0	0	0	112.9	A142 H143 H144 K240 F244 R274	A142-T146 WeakPolarHBondContact O-CB 3.45Å; A142-T146 VanDerWaalsContact O-CG2 3.23Å; A142-T146 WeakPolarHBondContact O-CG2 3.44Å; A142-T146 PolarHBondContact O-N 3.43Å; A142-T146 PolarHBondContact O-OG1 3.24Å; H143-T146 CarbonylContact O-C 3.6Å; H143-T146 PolarHBondContact O-N 3.48Å; H143-T146 PolarHBondContact O-OG1 3.09Å; H144-T146 VanDerWaalsContact C-N 3.29Å; H144-T146 PolarHBondContact O-N 2.94Å; T146-K240 WeakPolarHBondContact CB-O 3.18Å; T146-K240 WeakPolarHBondContact O-CB 3.3Å; T146-K240 VanDerWaalsContact O-CD 3.31Å; T146-K240 WeakPolarHBondContact O-CD 3.5Å; T146-K240 WeakPolarHBondContact O-CG 3.5Å; T146-F244 HydrophobicContact CG2-CB 4.31Å; T146-R274 PolarHBondContact O-NH1 2.93Å; T146-R274 PolarHBondContact OG1-NH1 3.3Å; T146-R274 VanDerWaalsContact OG1-NH1 3.15Å
147	Y	95.3	Very high	95	Very high	43 Å²	43	56.7 Å²	56.7	17%	0.169	30%	0.296	C	S	.	.			trans	-127.2	116.7	176.3	-178	-100.7	0	0	0	108.9	H143 D149 Y151 R274 Q277	H143-Y147 AromaticContact CE1-CD1 3.96Å; H143-Y147 AromaticContact CE1-CG 3.67Å; H143-Y147 AromaticContact NE2-CD1 3.93Å; H143-Y147 VanDerWaalsContact O-CB 3.31Å; H143-Y147 WeakPolarHBondContact O-CB 3.28Å; H143-Y147 PolarHBondContact O-N 3.23Å; Y147-D149 HydrophobicContact CD1-CB 4.42Å; Y147-D149 HydrophobicContact CE1-CB 3.91Å; Y147-Y151 PolarHBondContact OH-OH 2.99Å; Y147-R274 HydrophobicContact CD2-CG 3.91Å; Y147-R274 HydrophobicContact CE2-CG 4.11Å; Y147-Q277 HydrophobicContact CE1-CB 4.46Å; Y147-Q277 HydrophobicContact CE2-CB 4.46Å; Y147-Q277 VanDerWaalsContact CE2-OE1 3.24Å; Y147-Q277 WeakPolarHBondContact OH-CB 3.32Å
148	D	92.7	Very high	94.8	Very high	38 Å²	38	58.2 Å²	58.2	20%	0.203	29%	0.29	C	S	.	.			trans	-100.3	107.2	174.8	174.5	19.8	0	0	0	108	S150 Y151 S152	D148-S150 PolarHBondContact O-N 3.21Å; D148-S150 VanDerWaalsContact OD1-CB 3.32Å; D148-S150 WeakPolarHBondContact OD1-CB 3.27Å; D148-S150 PolarHBondContact OD1-N 3.33Å; D148-S150 PolarHBondContact OD1-OG 3.2Å; D148-S150 PolarHBondContact OD2-OG 3.14Å; D148-S150 VanDerWaalsContact OD2-OG 3.12Å; D148-Y151 PolarHBondContact O-N 2.66Å; D148-S152 PolarHBondContact OD2-N 3.18Å; D148-S152 PolarHBondContact OD2-OG 3.13Å
149	D	91.6	Very high	94.4	Very high	126 Å²	126	61.7 Å²	61.7	67%	0.674	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-15.8	179.2	67	-18.8	0	0	0	113	Y147 Y151	Y147-D149 HydrophobicContact CD1-CB 4.42Å; Y147-D149 HydrophobicContact CE1-CB 3.91Å; D149-Y151 VanDerWaalsContact C-N 3.31Å; D149-Y151 WeakPolarHBondContact O-CD2 3.17Å; D149-Y151 VanDerWaalsContact O-CE2 3.27Å; D149-Y151 WeakPolarHBondContact O-CE2 3.32Å
150	S	92.1	Very high	94.1	Very high	69 Å²	69	62.9 Å²	62.9	48%	0.483	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-18	172.1	79.8	0	0	0	0	112.9	D148 S152	D148-S150 PolarHBondContact O-N 3.21Å; D148-S150 VanDerWaalsContact OD1-CB 3.32Å; D148-S150 WeakPolarHBondContact OD1-CB 3.27Å; D148-S150 PolarHBondContact OD1-N 3.33Å; D148-S150 PolarHBondContact OD1-OG 3.2Å; D148-S150 PolarHBondContact OD2-OG 3.14Å; D148-S150 VanDerWaalsContact OD2-OG 3.12Å; S150-S152 PolarHBondContact O-N 2.98Å; S150-S152 WeakPolarHBondContact OG-CB 3.01Å; S150-S152 PolarHBondContact OG-N 3.26Å
151	Y	92.8	Very high	93.8	Very high	27 Å²	27	65.2 Å²	65.2	11%	0.106	33%	0.334	C	S	.	.			trans	53.3	33	-175.3	-57.6	-81.3	0	0	0	113.7	Y147 D148 D149 D153 F154 S278 C288 G289	Y147-Y151 PolarHBondContact OH-OH 2.99Å; D148-Y151 PolarHBondContact O-N 2.66Å; D149-Y151 VanDerWaalsContact C-N 3.31Å; D149-Y151 WeakPolarHBondContact O-CD2 3.17Å; D149-Y151 VanDerWaalsContact O-CE2 3.27Å; D149-Y151 WeakPolarHBondContact O-CE2 3.32Å; Y151-D153 PolarHBondContact O-N 3.28Å; Y151-F154 HydrophobicContact CD1-CD1 4.06Å; Y151-F154 AromaticContact CD1-CE1 3.6Å; Y151-F154 HydrophobicContact CD1-CE1 3.6Å; Y151-F154 HydrophobicContact CD1-CE2 4.16Å; Y151-F154 AromaticContact CD1-CZ 3.66Å; Y151-F154 HydrophobicContact CD1-CZ 3.66Å; Y151-F154 HydrophobicContact CE1-CE1 4.44Å; Y151-F154 HydrophobicContact CE1-CZ 4.21Å; Y151-F154 HydrophobicContact CG-CE1 4.47Å; Y151-F154 VanDerWaalsContact O-CB 3.32Å; Y151-F154 WeakPolarHBondContact O-CB 3.14Å; Y151-F154 PolarHBondContact O-N 2.83Å; Y151-S278 VanDerWaalsContact OH-CB 3.24Å; Y151-S278 WeakPolarHBondContact OH-CB 3.29Å; Y151-C288 VanDerWaalsContact CB-O 3.3Å; Y151-C288 WeakPolarHBondContact CB-O 3.15Å; Y151-C288 HydrophobicContact CD1-CB 3.63Å; Y151-C288 VanDerWaalsContact CD2-CA 3.41Å; Y151-C288 HydrophobicContact CD2-CB 4.06Å; Y151-C288 HydrophobicContact CE1-CB 3.8Å; Y151-C288 HydrophobicContact CE2-CB 4.2Å; Y151-C288 VanDerWaalsContact CG-C 3.41Å; Y151-C288 HydrophobicContact CG-CB 3.74Å; Y151-G289 VanDerWaalsContact CD2-N 3.27Å
152	S	91	Very high	93.2	Very high	68 Å²	68	64.5 Å²	64.5	48%	0.476	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-59.2	-34	-173.5	61.9	0	0	0	0	113.5	D148 S150 F154 C155	D148-S152 PolarHBondContact OD2-N 3.18Å; D148-S152 PolarHBondContact OD2-OG 3.13Å; S150-S152 PolarHBondContact O-N 2.98Å; S150-S152 WeakPolarHBondContact OG-CB 3.01Å; S150-S152 PolarHBondContact OG-N 3.26Å; S152-F154 PolarHBondContact O-N 3.46Å; S152-C155 PolarHBondContact O-SG 3Å
153	D	91.3	Very high	92	Very high	39 Å²	39	72.9 Å²	72.9	21%	0.209	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-70.8	-15.2	178	-82.1	-43.1	0	0	0	113.5	Y151 C155 R156 F157 Y236	Y151-D153 PolarHBondContact O-N 3.28Å; D153-C155 PolarHBondContact O-N 3.47Å; D153-R156 VanDerWaalsContact O-CB 3.28Å; D153-R156 WeakPolarHBondContact O-CB 3.31Å; D153-R156 WeakPolarHBondContact O-CG 3.48Å; D153-R156 PolarHBondContact O-N 3.01Å; D153-R156 WeakPolarHBondContact OD1-CD 3.37Å; D153-R156 IonicContact OD1-NH1 2.83Å; D153-R156 PolarHBondContact OD1-NH1 3.39Å; D153-R156 VanDerWaalsContact OD1-NH1 3.11Å; D153-F157 HydrophobicContact CB-CZ 4.4Å; D153-Y236 HydrophobicContact CB-CE2 3.92Å
154	F	91.6	Very high	90.3	Very high	13 Å²	13	74.5 Å²	74.5	6%	0.057	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-64.4	-28.9	-174.3	-83.7	42.3	0	0	0	112.9	Y151 S152 R156 F157 L233 Y236 C288 F293 Y295	Y151-F154 HydrophobicContact CD1-CD1 4.06Å; Y151-F154 AromaticContact CD1-CE1 3.6Å; Y151-F154 HydrophobicContact CD1-CE1 3.6Å; Y151-F154 HydrophobicContact CD1-CE2 4.16Å; Y151-F154 AromaticContact CD1-CZ 3.66Å; Y151-F154 HydrophobicContact CD1-CZ 3.66Å; Y151-F154 HydrophobicContact CE1-CE1 4.44Å; Y151-F154 HydrophobicContact CE1-CZ 4.21Å; Y151-F154 HydrophobicContact CG-CE1 4.47Å; Y151-F154 VanDerWaalsContact O-CB 3.32Å; Y151-F154 WeakPolarHBondContact O-CB 3.14Å; Y151-F154 PolarHBondContact O-N 2.83Å; S152-F154 PolarHBondContact O-N 3.46Å; F154-R156 PolarHBondContact O-N 3.21Å; F154-R156 VanDerWaalsContact O-N 3.14Å; F154-F157 HydrophobicContact CB-CD2 4.29Å; F154-F157 HydrophobicContact CB-CE2 4.28Å; F154-F157 HydrophobicContact CD1-CD2 4.39Å; F154-F157 AromaticContact CD1-CE2 3.63Å; F154-F157 HydrophobicContact CD1-CE2 3.63Å; F154-F157 HydrophobicContact CE1-CE2 4.05Å; F154-F157 HydrophobicContact CG-CD2 4.26Å; F154-F157 AromaticContact CG-CE2 3.96Å; F154-F157 HydrophobicContact CG-CE2 3.96Å; F154-F157 WeakPolarHBondContact O-CD2 3.31Å; F154-F157 PolarHBondContact O-N 3Å; F154-L233 HydrophobicContact CD2-CD2 3.79Å; F154-L233 HydrophobicContact CE1-CD2 4.41Å; F154-L233 HydrophobicContact CE2-CD1 4.25Å; F154-L233 HydrophobicContact CE2-CD2 3.59Å; F154-L233 HydrophobicContact CG-CD2 4.29Å; F154-L233 HydrophobicContact CZ-CD2 3.93Å; F154-Y236 HydrophobicContact CE1-CD1 4.28Å; F154-Y236 HydrophobicContact CE1-CE1 4.05Å; F154-C288 HydrophobicContact CD2-CB 3.82Å; F154-C288 HydrophobicContact CE2-CB 3.41Å; F154-C288 VanDerWaalsContact CE2-CB 3.41Å; F154-C288 HydrophobicContact CZ-CB 4.09Å; F154-F293 HydrophobicContact CB-CD1 4.07Å; F154-F293 HydrophobicContact CB-CD2 4.13Å; F154-F293 HydrophobicContact CB-CE1 4.06Å; F154-F293 HydrophobicContact CB-CE2 4.13Å; F154-F293 HydrophobicContact CB-CG 4.1Å; F154-F293 HydrophobicContact CB-CZ 4.1Å; F154-F293 HydrophobicContact CD2-CB 4.18Å; F154-F293 HydrophobicContact CD2-CD1 4.1Å; F154-F293 HydrophobicContact CD2-CG 4.14Å; F154-F293 WeakPolarHBondContact O-CZ 3.46Å; F154-Y295 HydrophobicContact CE2-CE2 4.15Å
155	C	88.2	Confident	88.3	Confident	96 Å²	96	73.2 Å²	73.2	65%	0.649	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-65	-13.1	175.1	70.8	0	0	0	0	114.3	S152 D153	S152-C155 PolarHBondContact O-SG 3Å; D153-C155 PolarHBondContact O-N 3.47Å
156	R	91	Very high	86.2	Confident	190 Å²	190	71.1 Å²	71.1	72%	0.717	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-91	-10.3	-177.1	-52.8	175.7	72	179.5	2.8	113	D153 F154	D153-R156 VanDerWaalsContact O-CB 3.28Å; D153-R156 WeakPolarHBondContact O-CB 3.31Å; D153-R156 WeakPolarHBondContact O-CG 3.48Å; D153-R156 PolarHBondContact O-N 3.01Å; D153-R156 WeakPolarHBondContact OD1-CD 3.37Å; D153-R156 IonicContact OD1-NH1 2.83Å; D153-R156 PolarHBondContact OD1-NH1 3.39Å; D153-R156 VanDerWaalsContact OD1-NH1 3.11Å; F154-R156 PolarHBondContact O-N 3.21Å; F154-R156 VanDerWaalsContact O-N 3.14Å
157	F	93.3	Very high	84.4	Confident	39 Å²	39	72.1 Å²	72.1	17%	0.171	39%	0.39	C	S	.	.	S	Bend	trans	-85.7	163.7	-179.6	-52.4	-39.4	0	0	0	111.5	D153 F154 D232 L233 Y236	D153-F157 HydrophobicContact CB-CZ 4.4Å; F154-F157 HydrophobicContact CB-CD2 4.29Å; F154-F157 HydrophobicContact CB-CE2 4.28Å; F154-F157 HydrophobicContact CD1-CD2 4.39Å; F154-F157 AromaticContact CD1-CE2 3.63Å; F154-F157 HydrophobicContact CD1-CE2 3.63Å; F154-F157 HydrophobicContact CE1-CE2 4.05Å; F154-F157 HydrophobicContact CG-CD2 4.26Å; F154-F157 AromaticContact CG-CE2 3.96Å; F154-F157 HydrophobicContact CG-CE2 3.96Å; F154-F157 WeakPolarHBondContact O-CD2 3.31Å; F154-F157 PolarHBondContact O-N 3Å; F157-D232 HydrophobicContact CB-CB 3.8Å; F157-D232 HydrophobicContact CD1-CB 4.02Å; F157-D232 HydrophobicContact CG-CB 3.95Å; F157-L233 HydrophobicContact CD2-CD2 3.31Å; F157-L233 HydrophobicContact CE2-CD2 3.58Å; F157-L233 HydrophobicContact CG-CD2 4.32Å; F157-Y236 HydrophobicContact CE1-CD2 4.27Å; F157-Y236 HydrophobicContact CE1-CG 4.34Å; F157-Y236 HydrophobicContact CE2-CG 4.32Å; F157-Y236 HydrophobicContact CZ-CD1 4.15Å; F157-Y236 AromaticContact CZ-CD2 3.67Å; F157-Y236 HydrophobicContact CZ-CD2 3.67Å; F157-Y236 HydrophobicContact CZ-CE2 4.32Å; F157-Y236 AromaticContact CZ-CG 3.55Å; F157-Y236 HydrophobicContact CZ-CG 3.55Å
158	R	94	Very high	82.8	Confident	90 Å²	90	77.2 Å²	77.2	34%	0.34	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-53.4	132.3	170.4	-72	172.1	-78.9	-179.4	-0.7	108.6	P228 H229 D232 Q416	R158-P228 PolarHBondContact NE-O 2.86Å; R158-P228 PolarHBondContact NH2-O 3.14Å; R158-H229 PolarHBondContact O-ND1 3.32Å; R158-D232 WeakPolarHBondContact CB-OD2 3.43Å; R158-D232 WeakPolarHBondContact CG-OD2 3.42Å; R158-D232 IonicContact CZ-OD1 3.95Å; R158-D232 IonicContact CZ-OD2 2.79Å; R158-D232 PolarHBondContact N-OD2 2.85Å; R158-D232 IonicContact NE-OD1 3.49Å; R158-D232 PolarHBondContact NE-OD1 2.85Å; R158-D232 IonicContact NE-OD2 2.69Å; R158-D232 PolarHBondContact NE-OD2 2.9Å; R158-D232 IonicContact NH2-OD1 3.91Å; R158-D232 PolarHBondContact NH2-OD1 3.45Å; R158-D232 IonicContact NH2-OD2 3.84Å; R158-Q416 PolarHBondContact NH1-O 3.11Å; R158-Q416 VanDerWaalsContact NH1-O 3.09Å; R158-Q416 PolarHBondContact NH2-O 2.99Å
159	P	91.6	Very high	81.1	Confident	96 Å²	96	76.9 Å²	76.9	62%	0.623	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-66.3	151.8	-173.3	26.3	-34.6	0	0	0	112	V161	P159-V161 PolarHBondContact O-N 2.99Å
160	P	92.5	Very high	79.5	Confident	25 Å²	25	70.9 Å²	70.9	16%	0.162	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-65.8	123.1	176.6	26.8	-33.4	0	0	0	110.9	M226	P160-M226 HydrophobicContact CB-CE 3.75Å; P160-M226 HydrophobicContact CB-SD 3.94Å
161	V	91.3	Very high	77.8	Confident	72 Å²	72	70 Å²	70	44%	0.436	37%	0.371	S	S	.	.			trans	-105.8	95.3	176.9	-174.5	0	0	0	0	109.3	P159 S225 M226	P159-V161 PolarHBondContact O-N 2.99Å; V161-S225 VanDerWaalsContact O-CB 3.25Å; V161-S225 WeakPolarHBondContact O-CB 3.2Å; V161-S225 PolarHBondContact O-OG 3.35Å; V161-M226 VanDerWaalsContact C-SD 3.56Å; V161-M226 PolarHBondContact N-SD 3.23Å; V161-M226 VanDerWaalsContact N-SD 3.38Å; V161-M226 VanDerWaalsContact O-SD 3.34Å
162	R	87.4	Confident	76.3	Confident	75 Å²	75	74.1 Å²	74.1	28%	0.283	39%	0.386	S	S	.	.			trans	-86.2	-13.3	-177.9	-63.6	-173.8	178.1	84.6	-1.5	113.6	M226 D292 K294 D299 K302	R162-M226 HydrophobicContact CG-SD 4.1Å; R162-D292 PolarHBondContact NH1-O 3.33Å; R162-D292 PolarHBondContact NH2-O 2.95Å; R162-K294 PolarHBondContact NH2-O 2.93Å; R162-D299 WeakPolarHBondContact CD-OD1 3.23Å; R162-D299 WeakPolarHBondContact CG-OD1 3.46Å; R162-D299 IonicContact NE-OD1 3.17Å; R162-D299 PolarHBondContact NE-OD1 3.15Å; R162-D299 IonicContact NE-OD2 3.11Å; R162-D299 PolarHBondContact NE-OD2 2.91Å; R162-D299 IonicContact NH2-OD2 2.61Å; R162-K302 PolarHBondContact O-NZ 2.71Å
163	E	72.8	Confident	74.7	Confident	176 Å²	176	71 Å²	71	82%	0.822	37%	0.365	S	S	*	.			trans	-84.1	126	174.2	-62.4	-174.4	173.8	0	0	109.6
164	G	61.7	Low	72.9	Confident	37 Å²	37	71.6 Å²	71.6	38%	0.381	38%	0.375	S	S	.	.	S	Bend	trans	168.5	170.6	-176.6	0	0	0	0	0	112.8	V166	G164-V166 PolarHBondContact O-N 3.41Å
165	P	55.5	Low	70.9	Confident	80 Å²	80	73.8 Å²	73.8	52%	0.519	39%	0.392	S	S	.	.			trans	-58	127.5	178.7	21.6	-29.5	0	0	0	110.3	T167	P165-T167 PolarHBondContact O-N 3.35Å
166	V	54.2	Low	69	Low	84 Å²	84	70.5 Å²	70.5	51%	0.509	37%	0.368	S	S	.	.			trans	-81.1	108	-176.9	-165.7	0	0	0	0	107.9	G164 A170 S171	G164-V166 PolarHBondContact O-N 3.41Å; V166-A170 HydrophobicContact CG1-CB 3.62Å; V166-S171 VanDerWaalsContact CG1-N 3.27Å; V166-S171 WeakPolarHBondContact CG1-OG 3.23Å
167	T	61.4	Low	66.8	Low	32 Å²	32	65.2 Å²	65.2	20%	0.196	35%	0.351	C	S	.	.			trans	-61.9	155.5	172.6	68	0	0	0	0	109.8	P165 S169 A170 S171 F224	P165-T167 PolarHBondContact O-N 3.35Å; T167-S169 PolarHBondContact O-N 3.03Å; T167-S169 VanDerWaalsContact O-N 3.1Å; T167-A170 CarbonylContact O-C 3.53Å; T167-A170 WeakPolarHBondContact O-CA 3.48Å; T167-A170 WeakPolarHBondContact O-CB 3.46Å; T167-A170 PolarHBondContact O-N 2.92Å; T167-A170 WeakPolarHBondContact OG1-CB 3.4Å; T167-A170 PolarHBondContact OG1-N 3.12Å; T167-S171 PolarHBondContact O-N 2.95Å; T167-S171 PolarHBondContact O-OG 3.34Å; T167-F224 HydrophobicContact CG2-CE1 4.41Å
168	R	60.8	Low	64.2	Low	150 Å²	150	67.9 Å²	67.9	57%	0.566	38%	0.375	S	S	*	.	H	α-helix	trans	-52.9	-35.9	174.9	-72.6	-174.5	-170.6	164.3	5	111.8	R172 S216	R168-R172 WeakPolarHBondContact O-CB 3.32Å; R168-R172 VanDerWaalsContact O-CG 3.29Å; R168-R172 WeakPolarHBondContact O-CG 3.22Å; R168-R172 PolarHBondContact O-N 3.05Å; R168-S216 PolarHBondContact NH2-O 3.14Å
169	S	57.5	Low	61.5	Low	30 Å²	30	70.1 Å²	70.1	21%	0.21	39%	0.387	C	S	.	.	H	α-helix	trans	-65.6	-42.8	173.3	-57.1	0	0	0	0	112.5	T167 R172 A173	T167-S169 PolarHBondContact O-N 3.03Å; T167-S169 VanDerWaalsContact O-N 3.1Å; S169-R172 PolarHBondContact O-N 3.25Å; S169-A173 WeakPolarHBondContact O-CB 3.46Å; S169-A173 PolarHBondContact O-N 3.22Å
170	A	57.2	Low	59	Low	1 Å²	1	69.5 Å²	69.5	1%	0.008	39%	0.385	C	S	.	.	H	α-helix	trans	-67.6	-36.4	175.3	0	0	0	0	0	112.7	V166 T167 A173 A174 T301 K302	V166-A170 HydrophobicContact CG1-CB 3.62Å; T167-A170 CarbonylContact O-C 3.53Å; T167-A170 WeakPolarHBondContact O-CA 3.48Å; T167-A170 WeakPolarHBondContact O-CB 3.46Å; T167-A170 PolarHBondContact O-N 2.92Å; T167-A170 WeakPolarHBondContact OG1-CB 3.4Å; T167-A170 PolarHBondContact OG1-N 3.12Å; A170-A173 PolarHBondContact O-N 3.32Å; A170-A174 VanDerWaalsContact O-CB 3.28Å; A170-A174 WeakPolarHBondContact O-CB 3.34Å; A170-A174 PolarHBondContact O-N 3.47Å; A170-T301 VanDerWaalsContact CA-OG1 3.31Å; A170-T301 WeakPolarHBondContact CA-OG1 3.38Å; A170-T301 WeakPolarHBondContact CB-OG1 3.29Å; A170-K302 HydrophobicContact CB-CG 4.38Å
171	S	57.2	Low	56.2	Low	51 Å²	51	75.8 Å²	75.8	36%	0.357	42%	0.418	S	S	.	.	H	α-helix	trans	-67	-43.9	175.6	-64.2	0	0	0	0	110.7	V166 T167 A173 A174 S175	V166-S171 VanDerWaalsContact CG1-N 3.27Å; V166-S171 WeakPolarHBondContact CG1-OG 3.23Å; T167-S171 PolarHBondContact O-N 2.95Å; T167-S171 PolarHBondContact O-OG 3.34Å; S171-A173 VanDerWaalsContact C-N 3.28Å; S171-A173 PolarHBondContact O-N 3.41Å; S171-A174 PolarHBondContact O-N 3.17Å; S171-S175 PolarHBondContact O-N 3.41Å; S171-S175 VanDerWaalsContact O-N 3.13Å; S171-S175 PolarHBondContact O-OG 2.95Å
172	R	60.7	Low	53.5	Low	112 Å²	112	76.6 Å²	76.6	42%	0.423	43%	0.432	S	S	.	.	H	α-helix	trans	-61.5	-36.5	172.4	-75.7	177.6	177.4	179.9	0.1	111.8	R168 S169 L176 L307	R168-R172 WeakPolarHBondContact O-CB 3.32Å; R168-R172 VanDerWaalsContact O-CG 3.29Å; R168-R172 WeakPolarHBondContact O-CG 3.22Å; R168-R172 PolarHBondContact O-N 3.05Å; S169-R172 PolarHBondContact O-N 3.25Å; R172-L176 WeakPolarHBondContact O-CD1 3.37Å; R172-L176 VanDerWaalsContact O-CG 3.26Å; R172-L176 WeakPolarHBondContact O-CG 3.39Å; R172-L307 HydrophobicContact CB-CD1 4.46Å
173	A	58.3	Low	51.2	Low	3 Å²	3	77.9 Å²	77.9	3%	0.025	45%	0.452	C	S	.	.	H	α-helix	trans	-73	-37.7	176.1	0	0	0	0	0	113.3	S169 A170 S171 L176 I297	S169-A173 WeakPolarHBondContact O-CB 3.46Å; S169-A173 PolarHBondContact O-N 3.22Å; A170-A173 PolarHBondContact O-N 3.32Å; S171-A173 VanDerWaalsContact C-N 3.28Å; S171-A173 PolarHBondContact O-N 3.41Å; A173-L176 WeakPolarHBondContact O-CB 3.38Å; A173-L176 WeakPolarHBondContact O-CD1 3.37Å; A173-L176 WeakPolarHBondContact O-CG 3.33Å; A173-I297 HydrophobicContact CB-CG2 4.45Å
174	A	52.9	Low	49.5	Very low	51 Å²	51	74.6 Å²	74.6	42%	0.421	45%	0.449	S	S	.	.	H	α-helix	trans	-75.5	-36.8	-175.8	0	0	0	0	0	113.5	A170 S171 L176 H177	A170-A174 VanDerWaalsContact O-CB 3.28Å; A170-A174 WeakPolarHBondContact O-CB 3.34Å; A170-A174 PolarHBondContact O-N 3.47Å; S171-A174 PolarHBondContact O-N 3.17Å; A174-L176 PolarHBondContact O-N 3.29Å; A174-H177 PolarHBondContact O-N 3.01Å
175	S	49.7	Very low	48.2	Very low	60 Å²	60	79.8 Å²	79.8	42%	0.42	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-10.1	175.9	-62.5	0	0	0	0	113.9	S171 F179	S171-S175 PolarHBondContact O-N 3.41Å; S171-S175 VanDerWaalsContact O-N 3.13Å; S171-S175 PolarHBondContact O-OG 2.95Å; S175-F179 WeakPolarHBondContact O-CD2 3.43Å
176	L	48	Very low	47.1	Very low	26 Å²	26	80.4 Å²	80.4	14%	0.136	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-26.4	177.8	-56.6	167.4	0	0	0	113	R172 A173 A174 M206 Y207	R172-L176 WeakPolarHBondContact O-CD1 3.37Å; R172-L176 VanDerWaalsContact O-CG 3.26Å; R172-L176 WeakPolarHBondContact O-CG 3.39Å; A173-L176 WeakPolarHBondContact O-CB 3.38Å; A173-L176 WeakPolarHBondContact O-CD1 3.37Å; A173-L176 WeakPolarHBondContact O-CG 3.33Å; A174-L176 PolarHBondContact O-N 3.29Å; L176-M206 HydrophobicContact CD2-CB 3.73Å; L176-M206 HydrophobicContact CD2-CE 3.99Å; L176-M206 HydrophobicContact CD2-SD 4.47Å; L176-Y207 HydrophobicContact CD1-CD1 4.03Å; L176-Y207 HydrophobicContact CD1-CE1 3.24Å; L176-Y207 HydrophobicContact CD2-CE1 4.49Å; L176-Y207 HydrophobicContact CG-CE1 4.48Å
177	H	45.2	Very low	46	Very low	79 Å²	79	86 Å²	86	37%	0.366	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-20.7	-176.5	-76.7	-67	0	0	0	113.4	A174 F179 S180 Q296	A174-H177 PolarHBondContact O-N 3.01Å; H177-F179 VanDerWaalsContact C-N 3.32Å; H177-F179 PolarHBondContact O-N 3.03Å; H177-S180 PolarHBondContact O-OG 3.27Å; H177-Q296 PolarHBondContact CE1-NE2 3.34Å; H177-Q296 PolarHBondContact NE2-NE2 2.81Å
178	S	39.2	Very low	44.9	Very low	95 Å²	95	89.4 Å²	89.4	66%	0.664	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-4.5	-172.5	-160.2	0	0	0	0	114.7
179	F	36.8	Very low	43.5	Very low	137 Å²	137	91.7 Å²	91.7	60%	0.601	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.3	-7	-179.5	-65.7	-71.4	0	0	0	114.2	S175 H177 D181 A182 M206	S175-F179 WeakPolarHBondContact O-CD2 3.43Å; H177-F179 VanDerWaalsContact C-N 3.32Å; H177-F179 PolarHBondContact O-N 3.03Å; F179-D181 VanDerWaalsContact C-N 3.28Å; F179-D181 PolarHBondContact O-N 2.94Å; F179-A182 PolarHBondContact O-N 3.26Å; F179-M206 HydrophobicContact CD2-CE 4.42Å
180	S	39.2	Very low	42.2	Very low	84 Å²	84	95.6 Å²	95.6	59%	0.587	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-73.8	-18	174.4	57.6	0	0	0	0	113.3	H177 A182	H177-S180 PolarHBondContact O-OG 3.27Å; S180-A182 VanDerWaalsContact C-N 3.26Å; S180-A182 PolarHBondContact O-N 3.39Å
181	D	34.3	Very low	41.7	Very low	157 Å²	157	100.8 Å²	100.8	84%	0.84	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-77.5	-6.9	176.4	-98.8	-3.8	0	0	0	113.7	F179	F179-D181 VanDerWaalsContact C-N 3.28Å; F179-D181 PolarHBondContact O-N 2.94Å
182	A	33.7	Very low	40.5	Very low	88 Å²	88	106.2 Å²	106.2	73%	0.727	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-98.6	-1.3	-174.7	0	0	0	0	0	115.2	F179 S180	F179-A182 PolarHBondContact O-N 3.26Å; S180-A182 VanDerWaalsContact C-N 3.26Å; S180-A182 PolarHBondContact O-N 3.39Å
183	S	39	Very low	39.6	Very low	102 Å²	102	106.2 Å²	106.2	71%	0.713	63%	0.632	S	S	*	*			trans	-120.5	26.4	-177.5	102.9	0	0	0	0	115.4	D185	S183-D185 PolarHBondContact O-N 3.11Å
184	S	36.7	Very low	38.6	Very low	108 Å²	108	110.2 Å²	110.2	76%	0.755	66%	0.656	S	S	*	*			trans	-78.7	72.8	162.3	171.4	0	0	0	0	109.5
185	D	34	Very low	38.1	Very low	146 Å²	146	113.6 Å²	113.6	78%	0.781	67%	0.666	S	S	*	*			trans	-163.6	125.6	145	-100.8	-22.1	0	0	0	111.8	S183	S183-D185 PolarHBondContact O-N 3.11Å
186	S	34.3	Very low	37.7	Very low	92 Å²	92	114.3 Å²	114.3	64%	0.643	67%	0.668	S	S	*	*			trans	82.4	101.5	161.1	-40.3	0	0	0	0	118.2
187	F	30.5	Very low	37.1	Very low	201 Å²	201	120.3 Å²	120.3	88%	0.882	69%	0.694	S	S	*	*				164.2	132.5	94.8	-91.9	-72.5	0	0	0	111.6
188	S	38.9	Very low	36.7	Very low	105 Å²	105	121.8 Å²	121.8	73%	0.734	70%	0.702	S	S	*	*			trans	-73.9	130.4	169	-45	0	0	0	0	111.2
189	H	30.6	Very low	37.4	Very low	197 Å²	197	122.2 Å²	122.2	91%	0.912	70%	0.697	S	S	*	*			trans	175.3	159.9	134.1	-93.9	-62.7	0	0	0	112.5
190	S	29.5	Very low	37.8	Very low	113 Å²	113	118.2 Å²	118.2	79%	0.79	68%	0.679	S	S	*	*			trans	-74.8	178.8	-163.7	-122.4	0	0	0	0	116.3
191	P	47.2	Very low	38	Very low	109 Å²	109	118 Å²	118	71%	0.708	67%	0.671	S	S	*	*				-116.9	127	-126.9	34.8	-15.3	0	0	0	114.1
192	E	31.4	Very low	38.6	Very low	165 Å²	165	114.5 Å²	114.5	77%	0.771	65%	0.653	S	S	*	*			trans	-143.9	106.8	157.3	-76.7	-168.5	156.6	0	0	110.4	V194	E192-V194 WeakPolarHBondContact O-CG2 2.95Å; E192-V194 PolarHBondContact O-N 3.29Å
193	S	41.8	Very low	39.4	Very low	113 Å²	113	112.2 Å²	112.2	79%	0.79	63%	0.628	S	S	*	*	S	Bend	trans	37.3	7	148.1	73.7	0	0	0	0	123.4
194	V	38.1	Very low	39.7	Very low	87 Å²	87	109.1 Å²	109.1	53%	0.527	60%	0.603	S	S	.	*	S	Bend	trans	-98.2	-30.4	-178.1	-174.5	0	0	0	0	111.9	E192 T196 K197 M198	E192-V194 WeakPolarHBondContact O-CG2 2.95Å; E192-V194 PolarHBondContact O-N 3.29Å; V194-T196 PolarHBondContact O-N 3.38Å; V194-K197 PolarHBondContact O-N 3Å; V194-M198 HydrophobicContact CG1-CG 4.36Å; V194-M198 PolarHBondContact O-N 3.29Å; V194-M198 VanDerWaalsContact O-N 3.1Å
195	D	42	Very low	40	Very low	121 Å²	121	108 Å²	108	65%	0.647	59%	0.588	S	S	*	*	H	α-helix	trans	-67	-38.2	-172.8	-63.7	-41.2	0	0	0	113.9	K197 M198 N199	D195-K197 VanDerWaalsContact C-N 3.28Å; D195-K197 PolarHBondContact O-N 3.03Å; D195-M198 PolarHBondContact O-N 2.76Å; D195-N199 PolarHBondContact O-N 2.72Å
196	T	41.3	Very low	40.4	Very low	75 Å²	75	104.7 Å²	104.7	46%	0.46	57%	0.569	S	S	.	*	H	α-helix	trans	-72.1	-25.5	179.7	-28	0	0	0	0	112.6	V194 F200	V194-T196 PolarHBondContact O-N 3.38Å; T196-F200 WeakPolarHBondContact O-CB 3.5Å; T196-F200 PolarHBondContact O-N 2.99Å
197	K	36.3	Very low	40.9	Very low	153 Å²	153	102.1 Å²	102.1	67%	0.665	55%	0.545	S	S	*	.	H	α-helix	trans	-80	-37.3	178	-137.3	177.5	-174.8	-178.9	0	110.4	V194 D195 N201	V194-K197 PolarHBondContact O-N 3Å; D195-K197 VanDerWaalsContact C-N 3.28Å; D195-K197 PolarHBondContact O-N 3.03Å; K197-N201 VanDerWaalsContact O-CB 3.3Å; K197-N201 WeakPolarHBondContact O-CB 3.11Å; K197-N201 PolarHBondContact O-N 3.28Å
198	M	36.8	Very low	41.4	Very low	110 Å²	110	99.2 Å²	99.2	54%	0.542	54%	0.535	S	S	.	.	H	α-helix	trans	-61.4	-47	168.6	-79.9	-87.2	-172.8	0	0	111.4	V194 D195 F200 N201 N202	V194-M198 HydrophobicContact CG1-CG 4.36Å; V194-M198 PolarHBondContact O-N 3.29Å; V194-M198 VanDerWaalsContact O-N 3.1Å; D195-M198 PolarHBondContact O-N 2.76Å; M198-F200 PolarHBondContact O-N 2.6Å; M198-N201 PolarHBondContact O-N 3.39Å; M198-N202 WeakPolarHBondContact O-CB 3.37Å; M198-N202 PolarHBondContact O-N 3.33Å; M198-N202 PolarHBondContact O-ND2 2.93Å
199	N	52.2	Low	41.4	Very low	104 Å²	104	101.1 Å²	101.1	56%	0.556	53%	0.532	S	S	*	.	H	α-helix	trans	-62	-43.1	177.8	-104.2	17.4	0	0	0	113	D195 L203	D195-N199 PolarHBondContact O-N 2.72Å; N199-L203 VanDerWaalsContact O-CB 3.22Å; N199-L203 WeakPolarHBondContact O-CB 3.5Å; N199-L203 PolarHBondContact O-N 2.99Å
200	F	45.8	Very low	42.1	Very low	53 Å²	53	97.8 Å²	97.8	23%	0.232	52%	0.517	C	S	.	.	H	α-helix	trans	-72.2	-41.1	-179.7	178.8	-98.4	0	0	0	112.8	T196 M198 L203 L204 K315	T196-F200 WeakPolarHBondContact O-CB 3.5Å; T196-F200 PolarHBondContact O-N 2.99Å; M198-F200 PolarHBondContact O-N 2.6Å; F200-L203 PolarHBondContact O-N 3.22Å; F200-L204 HydrophobicContact CE1-CD2 4.41Å; F200-L204 VanDerWaalsContact O-CB 3.31Å; F200-L204 WeakPolarHBondContact O-CB 3.34Å; F200-L204 PolarHBondContact O-N 2.81Å; F200-K315 HydrophobicContact CE2-CD 4.33Å; F200-K315 HydrophobicContact CE2-CG 3.51Å; F200-K315 HydrophobicContact CZ-CD 3.77Å; F200-K315 HydrophobicContact CZ-CG 3.4Å; F200-K315 VanDerWaalsContact CZ-CG 3.4Å
201	N	42.7	Very low	42.3	Very low	79 Å²	79	94.6 Å²	94.6	42%	0.422	50%	0.501	S	S	.	.	H	α-helix	trans	-69.4	-36.9	176	-79.7	-3.8	0	0	0	111.8	K197 M198 L204 L205	K197-N201 VanDerWaalsContact O-CB 3.3Å; K197-N201 WeakPolarHBondContact O-CB 3.11Å; K197-N201 PolarHBondContact O-N 3.28Å; M198-N201 PolarHBondContact O-N 3.39Å; N201-L204 CarbonylContact O-C 3.6Å; N201-L204 PolarHBondContact O-N 3.34Å; N201-L205 VanDerWaalsContact O-CB 3.28Å; N201-L205 WeakPolarHBondContact O-CB 3.46Å; N201-L205 WeakPolarHBondContact O-CD1 3.24Å; N201-L205 PolarHBondContact O-N 2.76Å
202	N	47.5	Very low	41.7	Very low	84 Å²	84	97.2 Å²	97.2	45%	0.449	51%	0.51	S	S	.	.	H	α-helix	trans	-66.6	-41.9	173.5	-73.1	-15.7	0	0	0	110.9	M198 L204 L205 M206	M198-N202 WeakPolarHBondContact O-CB 3.37Å; M198-N202 PolarHBondContact O-N 3.33Å; M198-N202 PolarHBondContact O-ND2 2.93Å; N202-L204 VanDerWaalsContact C-N 3.31Å; N202-L204 PolarHBondContact O-N 3.17Å; N202-L205 PolarHBondContact O-N 2.97Å; N202-M206 VanDerWaalsContact O-CB 3.23Å; N202-M206 WeakPolarHBondContact O-CB 3.26Å; N202-M206 WeakPolarHBondContact O-CG 3.43Å; N202-M206 PolarHBondContact O-N 3.31Å
203	L	50	Low	41.8	Very low	39 Å²	39	94.9 Å²	94.9	20%	0.204	51%	0.512	C	S	.	.	H	α-helix	trans	-59.2	-43.3	172.3	-161.5	77.1	0	0	0	110.8	N199 F200 M206 Y207 M284	N199-L203 VanDerWaalsContact O-CB 3.22Å; N199-L203 WeakPolarHBondContact O-CB 3.5Å; N199-L203 PolarHBondContact O-N 2.99Å; F200-L203 PolarHBondContact O-N 3.22Å; L203-M206 PolarHBondContact O-N 3.28Å; L203-Y207 HydrophobicContact CB-CE2 4.4Å; L203-Y207 HydrophobicContact CD1-CE2 4.34Å; L203-Y207 HydrophobicContact CD2-CE2 3.81Å; L203-Y207 HydrophobicContact CG-CD2 4.27Å; L203-Y207 HydrophobicContact CG-CE2 3.48Å; L203-Y207 VanDerWaalsContact CG-CE2 3.48Å; L203-Y207 WeakPolarHBondContact O-CD2 2.93Å; L203-Y207 WeakPolarHBondContact O-CE2 2.98Å; L203-Y207 PolarHBondContact O-N 3.2Å; L203-M284 HydrophobicContact CD2-CG 4.35Å
204	L	45.9	Very low	41.7	Very low	38 Å²	38	94.8 Å²	94.8	20%	0.199	51%	0.508	C	S	.	.	H	α-helix	trans	-70.4	-37.6	178.3	-158.5	72.8	0	0	0	114.3	F200 N201 N202 Y207 Q208	F200-L204 HydrophobicContact CE1-CD2 4.41Å; F200-L204 VanDerWaalsContact O-CB 3.31Å; F200-L204 WeakPolarHBondContact O-CB 3.34Å; F200-L204 PolarHBondContact O-N 2.81Å; N201-L204 CarbonylContact O-C 3.6Å; N201-L204 PolarHBondContact O-N 3.34Å; N202-L204 VanDerWaalsContact C-N 3.31Å; N202-L204 PolarHBondContact O-N 3.17Å; L204-Y207 PolarHBondContact O-N 3.05Å; L204-Q208 PolarHBondContact O-N 3.45Å
205	L	43.3	Very low	41.8	Very low	83 Å²	83	97.9 Å²	97.9	44%	0.435	52%	0.522	S	S	.	.	H	α-helix	trans	-68.8	-37.3	172.4	-94.4	137.5	0	0	0	111.1	N201 N202 Y207 Q208 E209	N201-L205 VanDerWaalsContact O-CB 3.28Å; N201-L205 WeakPolarHBondContact O-CB 3.46Å; N201-L205 WeakPolarHBondContact O-CD1 3.24Å; N201-L205 PolarHBondContact O-N 2.76Å; N202-L205 PolarHBondContact O-N 2.97Å; L205-Y207 VanDerWaalsContact C-N 3.28Å; L205-Y207 PolarHBondContact O-N 2.98Å; L205-Q208 PolarHBondContact O-N 3.33Å; L205-E209 PolarHBondContact O-N 3.36Å
206	M	43.3	Very low	41.5	Very low	77 Å²	77	96 Å²	96	38%	0.379	52%	0.518	S	S	.	.	H	α-helix	trans	-64.4	-30.5	171	-74.2	-174.7	81.1	0	0	112.6	L176 F179 N202 L203 Q208	L176-M206 HydrophobicContact CD2-CB 3.73Å; L176-M206 HydrophobicContact CD2-CE 3.99Å; L176-M206 HydrophobicContact CD2-SD 4.47Å; F179-M206 HydrophobicContact CD2-CE 4.42Å; N202-M206 VanDerWaalsContact O-CB 3.23Å; N202-M206 WeakPolarHBondContact O-CB 3.26Å; N202-M206 WeakPolarHBondContact O-CG 3.43Å; N202-M206 PolarHBondContact O-N 3.31Å; L203-M206 PolarHBondContact O-N 3.28Å; M206-Q208 VanDerWaalsContact C-N 3.35Å
207	Y	44.3	Very low	41.2	Very low	38 Å²	38	96.8 Å²	96.8	15%	0.149	53%	0.527	C	S	.	.	H	α-helix	trans	-72.9	-23.7	171	-70.2	-61.6	0	0	0	113.1	L176 L203 L204 L205 L307	L176-Y207 HydrophobicContact CD1-CD1 4.03Å; L176-Y207 HydrophobicContact CD1-CE1 3.24Å; L176-Y207 HydrophobicContact CD2-CE1 4.49Å; L176-Y207 HydrophobicContact CG-CE1 4.48Å; L203-Y207 HydrophobicContact CB-CE2 4.4Å; L203-Y207 HydrophobicContact CD1-CE2 4.34Å; L203-Y207 HydrophobicContact CD2-CE2 3.81Å; L203-Y207 HydrophobicContact CG-CD2 4.27Å; L203-Y207 HydrophobicContact CG-CE2 3.48Å; L203-Y207 VanDerWaalsContact CG-CE2 3.48Å; L203-Y207 WeakPolarHBondContact O-CD2 2.93Å; L203-Y207 WeakPolarHBondContact O-CE2 2.98Å; L203-Y207 PolarHBondContact O-N 3.2Å; L204-Y207 PolarHBondContact O-N 3.05Å; L205-Y207 VanDerWaalsContact C-N 3.28Å; L205-Y207 PolarHBondContact O-N 2.98Å; Y207-L307 HydrophobicContact CD1-CD1 4.3Å; Y207-L307 HydrophobicContact CE1-CD2 4.46Å
208	Q	39.5	Very low	41.4	Very low	140 Å²	140	98.6 Å²	98.6	65%	0.654	54%	0.538	S	S	*	.	H	α-helix	trans	-94.7	-29.9	-176.6	-75.9	-179.6	-14.7	0	0	114.7	L204 L205 M206 H210	L204-Q208 PolarHBondContact O-N 3.45Å; L205-Q208 PolarHBondContact O-N 3.33Å; M206-Q208 VanDerWaalsContact C-N 3.35Å; Q208-H210 PolarHBondContact O-N 3.04Å
209	E	39.3	Very low	41.5	Very low	146 Å²	146	101.6 Å²	101.6	68%	0.682	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-4.4	-168.8	-80.4	-167.3	154.7	0	0	116.6	L205	L205-E209 PolarHBondContact O-N 3.36Å
210	H	45.4	Very low	41	Very low	126 Å²	126	106.2 Å²	106.2	58%	0.583	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.1	31.5	179.5	-67.5	-8.4	0	0	0	113.9	Q208 N212	Q208-H210 PolarHBondContact O-N 3.04Å; H210-N212 VanDerWaalsContact C-N 3.35Å; H210-N212 PolarHBondContact O-N 2.89Å
211	G	34.5	Very low	41.1	Very low	46 Å²	46	106.7 Å²	106.7	47%	0.474	59%	0.588	S	S	.	*			trans	-73.1	-11.2	177.4	0	0	0	0	0	116.5
212	N	35.3	Very low	41.8	Very low	165 Å²	165	105 Å²	105	88%	0.882	58%	0.582	S	S	*	*			trans	-123.1	91.2	-172.3	-79.1	6.6	0	0	0	113.4	H210	H210-N212 VanDerWaalsContact C-N 3.35Å; H210-N212 PolarHBondContact O-N 2.89Å
213	S	32.3	Very low	43.1	Very low	116 Å²	116	104.3 Å²	104.3	81%	0.811	58%	0.584	S	S	*	*			trans	-160.6	146.1	149.2	-148.9	0	0	0	0	110.5
214	P	40.5	Very low	45	Very low	110 Å²	110	103.8 Å²	103.8	71%	0.714	58%	0.581	S	S	*	*			trans	-87	142.2	-147.7	34.2	-33	0	0	0	113.6
215	D	40.1	Very low	47.2	Very low	153 Å²	153	103 Å²	103	82%	0.818	58%	0.578	S	S	*	*			trans	33	91.6	142.2	-134.5	10.5	0	0	0	117.4
216	S	35.4	Very low	49.6	Very low	80 Å²	80	99 Å²	99	56%	0.559	56%	0.557	S	S	*	*			trans	-124.1	118.7	152.5	67.3	0	0	0	0	108	R168	R168-S216 PolarHBondContact NH2-O 3.14Å
217	S	34.7	Very low	52	Low	93 Å²	93	95.7 Å²	95.7	65%	0.65	54%	0.541	S	S	*	.			trans	-36.1	135.4	179.3	41.9	0	0	0	0	113.9	E219	S217-E219 PolarHBondContact O-N 3.43Å
218	E	41.2	Very low	54.5	Low	191 Å²	191	95.3 Å²	95.3	89%	0.893	54%	0.543	S	S	*	.			trans	-54.9	103.4	162	-67.2	176.4	162.7	0	0	108.3	E220	E218-E220 PolarHBondContact O-N 3.24Å
219	E	39.2	Very low	57.1	Low	172 Å²	172	88.8 Å²	88.8	80%	0.804	51%	0.512	S	S	*	.			trans	-78.8	112.3	167.9	-79.7	-172.7	169.1	0	0	108.5	S217 G221	S217-E219 PolarHBondContact O-N 3.43Å; E219-G221 PolarHBondContact O-N 3.11Å
220	E	40.8	Very low	59.8	Low	202 Å²	202	83 Å²	83	94%	0.944	49%	0.486	S	S	*	.	S	Bend	trans	-43.3	115.4	162.4	-68	171.7	142	0	0	110	E218	E218-E220 PolarHBondContact O-N 3.24Å
221	G	48.4	Very low	62.3	Low	62 Å²	62	77.2 Å²	77.2	64%	0.639	46%	0.46	S	S	*	.			trans	121.2	25.3	174.7	0	0	0	0	0	117	E219 S223	E219-G221 PolarHBondContact O-N 3.11Å; G221-S223 PolarHBondContact O-N 2.82Å
222	S	57	Low	65.3	Low	43 Å²	43	76.2 Å²	76.2	30%	0.301	44%	0.444	S	S	.	.			trans	-63.8	100.4	175.7	-178	0	0	0	0	111.4	F224 H413	S222-F224 PolarHBondContact O-N 2.91Å; S222-H413 PolarHBondContact O-NE2 3.12Å
223	S	75.2	Confident	68.2	Low	71 Å²	71	69.2 Å²	69.2	50%	0.497	41%	0.406	S	S	.	.			trans	-68	117.4	169.3	-176.5	0	0	0	0	110	G221 S225	G221-S223 PolarHBondContact O-N 2.82Å; S223-S225 PolarHBondContact O-N 2.89Å
224	F	89.7	Confident	71.3	Confident	28 Å²	28	65.4 Å²	65.4	12%	0.123	38%	0.378	C	S	.	.			trans	-81.8	89.5	175.2	-65.6	-50.1	0	0	0	110.8	T167 S222 M226 L227 P228 K302 G304 L407 H413	T167-F224 HydrophobicContact CG2-CE1 4.41Å; S222-F224 PolarHBondContact O-N 2.91Å; F224-M226 PolarHBondContact O-N 3.06Å; F224-M226 VanDerWaalsContact O-N 3.1Å; F224-L227 HydrophobicContact CB-CB 3.61Å; F224-L227 HydrophobicContact CB-CD2 4.24Å; F224-L227 HydrophobicContact CD2-CD2 4.24Å; F224-L227 WeakPolarHBondContact O-CB 3.46Å; F224-L227 PolarHBondContact O-N 3.19Å; F224-P228 WeakPolarHBondContact O-CD 3.45Å; F224-K302 CarbonylContact C-O 3.17Å; F224-K302 VanDerWaalsContact CA-O 3.22Å; F224-K302 WeakPolarHBondContact CA-O 3.38Å; F224-K302 WeakPolarHBondContact CB-O 3.42Å; F224-G304 VanDerWaalsContact CE1-CA 3.4Å; F224-L407 HydrophobicContact CD2-CD2 3.76Å; F224-L407 HydrophobicContact CE2-CD2 3.24Å; F224-L407 HydrophobicContact CZ-CD2 3.98Å; F224-H413 AromaticContact CD2-CD2 3.85Å; F224-H413 AromaticContact CD2-CE1 3.48Å; F224-H413 VanDerWaalsContact CD2-CE1 3.48Å; F224-H413 WeakPolarHBondContact CD2-CE1 3.39Å; F224-H413 AromaticContact CD2-CG 3.91Å; F224-H413 AromaticContact CD2-ND1 3.65Å; F224-H413 AromaticContact CD2-NE2 3.58Å; F224-H413 AromaticContact CE2-CE1 3.12Å; F224-H413 WeakPolarHBondContact CE2-CE1 3.35Å; F224-H413 AromaticContact CE2-ND1 3.39Å; F224-H413 WeakPolarHBondContact CE2-ND1 3.24Å; F224-H413 AromaticContact CE2-NE2 3.69Å
225	S	91.4	Very high	74	Confident	20 Å²	20	60.8 Å²	60.8	14%	0.14	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-30.9	-172.1	70.7	0	0	0	0	114.1	V161 S223 K302	V161-S225 VanDerWaalsContact O-CB 3.25Å; V161-S225 WeakPolarHBondContact O-CB 3.2Å; V161-S225 PolarHBondContact O-OG 3.35Å; S223-S225 PolarHBondContact O-N 2.89Å; S225-K302 PolarHBondContact N-O 2.84Å
226	M	94.2	Very high	76.7	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-9.9	-179.8	-71.6	-64.7	-60.8	0	0	113.8	P160 V161 R162 F224 H229 L230 D299 K302 A303	P160-M226 HydrophobicContact CB-CE 3.75Å; P160-M226 HydrophobicContact CB-SD 3.94Å; V161-M226 VanDerWaalsContact C-SD 3.56Å; V161-M226 PolarHBondContact N-SD 3.23Å; V161-M226 VanDerWaalsContact N-SD 3.38Å; V161-M226 VanDerWaalsContact O-SD 3.34Å; R162-M226 HydrophobicContact CG-SD 4.1Å; F224-M226 PolarHBondContact O-N 3.06Å; F224-M226 VanDerWaalsContact O-N 3.1Å; M226-H229 PolarHBondContact O-N 3.44Å; M226-L230 HydrophobicContact CE-CD2 4.46Å; M226-L230 PolarHBondContact O-N 2.93Å; M226-D299 WeakPolarHBondContact CB-O 3.45Å; M226-D299 HydrophobicContact CE-CB 4.15Å; M226-K302 HydrophobicContact CB-CB 3.88Å; M226-K302 HydrophobicContact CG-CB 3.63Å; M226-K302 HydrophobicContact CG-CD 4.31Å; M226-K302 PolarHBondContact N-O 3.31Å; M226-A303 HydrophobicContact CB-CB 4.06Å
227	L	94.8	Very high	79.7	Confident	8 Å²	8	52.4 Å²	52.4	4%	0.042	30%	0.298	C	S	.	.	H	α-helix	trans	-59.5	-46.6	-176.4	176.4	63.6	0	0	0	113.1	F224 H229 L230 A231 A303 H413 Q416 L417	F224-L227 HydrophobicContact CB-CB 3.61Å; F224-L227 HydrophobicContact CB-CD2 4.24Å; F224-L227 HydrophobicContact CD2-CD2 4.24Å; F224-L227 WeakPolarHBondContact O-CB 3.46Å; F224-L227 PolarHBondContact O-N 3.19Å; L227-H229 VanDerWaalsContact C-N 3.33Å; L227-H229 PolarHBondContact O-N 3.46Å; L227-L230 PolarHBondContact O-N 2.98Å; L227-A231 VanDerWaalsContact O-CB 3.23Å; L227-A231 WeakPolarHBondContact O-CB 3.5Å; L227-A231 PolarHBondContact O-N 3.15Å; L227-A303 HydrophobicContact CB-CB 4.38Å; L227-H413 HydrophobicContact CD2-CB 3.83Å; L227-Q416 HydrophobicContact CD2-CB 4.22Å; L227-Q416 HydrophobicContact CG-CB 4.34Å; L227-L417 HydrophobicContact CD1-CD2 3.76Å; L227-L417 HydrophobicContact CG-CD2 4.41Å
228	P	95.1	Very high	82.7	Confident	30 Å²	30	48.1 Å²	48.1	20%	0.195	27%	0.268	C	S	.	.	H	α-helix	trans	-57.6	-44.3	177.3	-26.5	36.2	0	0	0	112.9	R158 F224 D232 Q416	R158-P228 PolarHBondContact NE-O 2.86Å; R158-P228 PolarHBondContact NH2-O 3.14Å; F224-P228 WeakPolarHBondContact O-CD 3.45Å; P228-D232 PolarHBondContact O-N 3.47Å; P228-Q416 HydrophobicContact CG-CB 4.18Å; P228-Q416 HydrophobicContact CG-CG 4.29Å
229	H	95.5	Very high	85.5	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.009	25%	0.249	C	C	.	.	H	α-helix	trans	-67.7	-50.3	-178.7	174.4	66.8	0	0	0	111.5	R158 M226 L227 A231 D232 L233 Y295	R158-H229 PolarHBondContact O-ND1 3.32Å; M226-H229 PolarHBondContact O-N 3.44Å; L227-H229 VanDerWaalsContact C-N 3.33Å; L227-H229 PolarHBondContact O-N 3.46Å; H229-A231 VanDerWaalsContact C-N 3.26Å; H229-A231 PolarHBondContact O-N 3.34Å; H229-D232 WeakPolarHBondContact O-CB 3.26Å; H229-D232 PolarHBondContact O-N 2.87Å; H229-D232 VanDerWaalsContact O-N 3.08Å; H229-L233 PolarHBondContact O-N 3.14Å; H229-L233 VanDerWaalsContact O-N 3.13Å; H229-Y295 AromaticContact CD2-CE1 3.81Å; H229-Y295 AromaticContact NE2-CE1 3.24Å; H229-Y295 WeakPolarHBondContact NE2-CE1 3.42Å; H229-Y295 AromaticContact NE2-CZ 3.49Å; H229-Y295 PolarHBondContact NE2-OH 3.13Å
230	L	96	Very high	88.3	Confident	25 Å²	25	38.5 Å²	38.5	13%	0.131	22%	0.222	C	C	.	.	H	α-helix	trans	-65.2	-31.7	179	-65.5	-168.1	0	0	0	111.9	M226 L227 D232 L233 V234 Y295 V300 A303	M226-L230 HydrophobicContact CE-CD2 4.46Å; M226-L230 PolarHBondContact O-N 2.93Å; L227-L230 PolarHBondContact O-N 2.98Å; L230-D232 VanDerWaalsContact C-N 3.3Å; L230-D232 PolarHBondContact O-N 3.48Å; L230-L233 HydrophobicContact CD2-CD1 3.71Å; L230-L233 PolarHBondContact O-N 2.95Å; L230-V234 WeakPolarHBondContact O-CB 3.37Å; L230-V234 VanDerWaalsContact O-CG2 3.25Å; L230-V234 WeakPolarHBondContact O-CG2 3.5Å; L230-V234 PolarHBondContact O-N 3.42Å; L230-Y295 HydrophobicContact CD2-CD1 4.34Å; L230-Y295 HydrophobicContact CD2-CE1 4.37Å; L230-V300 HydrophobicContact CD1-CB 4.42Å; L230-V300 HydrophobicContact CD1-CG1 4.19Å; L230-V300 HydrophobicContact CD1-CG2 4.43Å; L230-A303 HydrophobicContact CB-CB 4.33Å; L230-A303 HydrophobicContact CD1-CB 3.43Å; L230-A303 VanDerWaalsContact CD1-CB 3.43Å; L230-A303 HydrophobicContact CG-CB 4.11Å
231	A	96.7	Very high	91	Very high	4 Å²	4	29 Å²	29	3%	0.033	18%	0.177	C	C	.	.	H	α-helix	trans	-61.1	-37.6	172.7	0	0	0	0	0	112.3	L227 H229 S235 L417 T418	L227-A231 VanDerWaalsContact O-CB 3.23Å; L227-A231 WeakPolarHBondContact O-CB 3.5Å; L227-A231 PolarHBondContact O-N 3.15Å; H229-A231 VanDerWaalsContact C-N 3.26Å; H229-A231 PolarHBondContact O-N 3.34Å; A231-S235 VanDerWaalsContact O-CB 3.25Å; A231-S235 WeakPolarHBondContact O-CB 3.31Å; A231-S235 PolarHBondContact O-N 3.46Å; A231-L417 HydrophobicContact CB-CD2 4.06Å; A231-T418 HydrophobicContact CB-CG2 4.38Å
232	D	97.3	Very high	93.4	Very high	25 Å²	25	28 Å²	28	13%	0.134	16%	0.157	C	C	.	.	H	α-helix	trans	-66.7	-44.5	173.7	-70.2	-18.3	0	0	0	111.5	F157 R158 P228 H229 L230 V234 S235 Y236 T418	F157-D232 HydrophobicContact CB-CB 3.8Å; F157-D232 HydrophobicContact CD1-CB 4.02Å; F157-D232 HydrophobicContact CG-CB 3.95Å; R158-D232 WeakPolarHBondContact CB-OD2 3.43Å; R158-D232 WeakPolarHBondContact CG-OD2 3.42Å; R158-D232 IonicContact CZ-OD1 3.95Å; R158-D232 IonicContact CZ-OD2 2.79Å; R158-D232 PolarHBondContact N-OD2 2.85Å; R158-D232 IonicContact NE-OD1 3.49Å; R158-D232 PolarHBondContact NE-OD1 2.85Å; R158-D232 IonicContact NE-OD2 2.69Å; R158-D232 PolarHBondContact NE-OD2 2.9Å; R158-D232 IonicContact NH2-OD1 3.91Å; R158-D232 PolarHBondContact NH2-OD1 3.45Å; R158-D232 IonicContact NH2-OD2 3.84Å; P228-D232 PolarHBondContact O-N 3.47Å; H229-D232 WeakPolarHBondContact O-CB 3.26Å; H229-D232 PolarHBondContact O-N 2.87Å; H229-D232 VanDerWaalsContact O-N 3.08Å; L230-D232 VanDerWaalsContact C-N 3.3Å; L230-D232 PolarHBondContact O-N 3.48Å; D232-V234 PolarHBondContact O-N 3.29Å; D232-S235 WeakPolarHBondContact O-CB 3.45Å; D232-S235 PolarHBondContact O-N 2.96Å; D232-Y236 WeakPolarHBondContact O-CB 3.48Å; D232-Y236 PolarHBondContact O-N 3.02Å; D232-T418 WeakPolarHBondContact OD1-CG2 3.46Å
233	L	96.5	Very high	95.4	Very high	18 Å²	18	27.2 Å²	27.2	9%	0.094	16%	0.156	C	C	.	.	H	α-helix	trans	-60.9	-44.5	177.8	-61.2	-171.6	0	0	0	112.2	F154 F157 H229 L230 Y236 S237 Y295	F154-L233 HydrophobicContact CD2-CD2 3.79Å; F154-L233 HydrophobicContact CE1-CD2 4.41Å; F154-L233 HydrophobicContact CE2-CD1 4.25Å; F154-L233 HydrophobicContact CE2-CD2 3.59Å; F154-L233 HydrophobicContact CG-CD2 4.29Å; F154-L233 HydrophobicContact CZ-CD2 3.93Å; F157-L233 HydrophobicContact CD2-CD2 3.31Å; F157-L233 HydrophobicContact CE2-CD2 3.58Å; F157-L233 HydrophobicContact CG-CD2 4.32Å; H229-L233 PolarHBondContact O-N 3.14Å; H229-L233 VanDerWaalsContact O-N 3.13Å; L230-L233 HydrophobicContact CD2-CD1 3.71Å; L230-L233 PolarHBondContact O-N 2.95Å; L233-Y236 PolarHBondContact O-N 3.44Å; L233-S237 WeakPolarHBondContact O-CB 3.48Å; L233-S237 PolarHBondContact O-N 3.22Å; L233-S237 PolarHBondContact O-OG 2.88Å; L233-Y295 HydrophobicContact CD1-CE1 3.94Å; L233-Y295 HydrophobicContact CD1-CE2 4.02Å; L233-Y295 WeakPolarHBondContact CD1-OH 3.42Å
234	V	97	Very high	96.5	Very high	36 Å²	36	23.8 Å²	23.8	22%	0.218	13%	0.132	C	C	.	.	H	α-helix	trans	-66.4	-43.1	178.2	172.9	0	0	0	0	110	L230 D232 Y236 S237 I238 V421 F425	L230-V234 WeakPolarHBondContact O-CB 3.37Å; L230-V234 VanDerWaalsContact O-CG2 3.25Å; L230-V234 WeakPolarHBondContact O-CG2 3.5Å; L230-V234 PolarHBondContact O-N 3.42Å; D232-V234 PolarHBondContact O-N 3.29Å; V234-Y236 PolarHBondContact O-N 3.45Å; V234-S237 PolarHBondContact O-N 2.89Å; V234-S237 VanDerWaalsContact O-N 3.14Å; V234-I238 HydrophobicContact CG1-CD1 4.02Å; V234-I238 HydrophobicContact CG1-CG1 4.42Å; V234-I238 VanDerWaalsContact O-CG1 3.29Å; V234-I238 WeakPolarHBondContact O-CG1 3.31Å; V234-I238 PolarHBondContact O-N 3.41Å; V234-V421 HydrophobicContact CB-CG2 4.25Å; V234-V421 HydrophobicContact CG1-CG2 3.9Å; V234-F425 HydrophobicContact CG1-CE2 3.64Å; V234-F425 HydrophobicContact CG1-CZ 4.35Å
235	S	97.7	Very high	96.9	Very high	14 Å²	14	22.5 Å²	22.5	10%	0.098	13%	0.127	C	C	.	.	H	α-helix	trans	-57	-48.9	174.9	-163	0	0	0	0	112.1	A231 D232 S237 I238 Q239 T418	A231-S235 VanDerWaalsContact O-CB 3.25Å; A231-S235 WeakPolarHBondContact O-CB 3.31Å; A231-S235 PolarHBondContact O-N 3.46Å; D232-S235 WeakPolarHBondContact O-CB 3.45Å; D232-S235 PolarHBondContact O-N 2.96Å; S235-S237 VanDerWaalsContact C-N 3.32Å; S235-S237 PolarHBondContact O-N 3.39Å; S235-I238 PolarHBondContact O-N 3.11Å; S235-Q239 WeakPolarHBondContact O-CG 3.33Å; S235-Q239 PolarHBondContact O-N 3.48Å; S235-Q239 VanDerWaalsContact O-N 3.14Å; S235-T418 WeakPolarHBondContact CB-OG1 3.36Å; S235-T418 PolarHBondContact OG-OG1 2.96Å
236	Y	97.6	Very high	97.3	Very high	26 Å²	26	26.2 Å²	26.2	10%	0.102	14%	0.14	C	C	.	.	H	α-helix	trans	-58.3	-45.5	174.3	172.3	-100.1	0	0	0	111.5	D153 F154 F157 D232 L233 V234 I238 Q239 K240	D153-Y236 HydrophobicContact CB-CE2 3.92Å; F154-Y236 HydrophobicContact CE1-CD1 4.28Å; F154-Y236 HydrophobicContact CE1-CE1 4.05Å; F157-Y236 HydrophobicContact CE1-CD2 4.27Å; F157-Y236 HydrophobicContact CE1-CG 4.34Å; F157-Y236 HydrophobicContact CE2-CG 4.32Å; F157-Y236 HydrophobicContact CZ-CD1 4.15Å; F157-Y236 AromaticContact CZ-CD2 3.67Å; F157-Y236 HydrophobicContact CZ-CD2 3.67Å; F157-Y236 HydrophobicContact CZ-CE2 4.32Å; F157-Y236 AromaticContact CZ-CG 3.55Å; F157-Y236 HydrophobicContact CZ-CG 3.55Å; D232-Y236 WeakPolarHBondContact O-CB 3.48Å; D232-Y236 PolarHBondContact O-N 3.02Å; L233-Y236 PolarHBondContact O-N 3.44Å; V234-Y236 PolarHBondContact O-N 3.45Å; Y236-I238 PolarHBondContact O-N 2.85Å; Y236-Q239 WeakPolarHBondContact O-CB 3.32Å; Y236-Q239 PolarHBondContact O-N 2.97Å; Y236-Q239 VanDerWaalsContact O-N 3.15Å; Y236-K240 HydrophobicContact CD1-CG 4.37Å; Y236-K240 HydrophobicContact CE1-CG 4.02Å; Y236-K240 HydrophobicContact CE2-CD 4.42Å; Y236-K240 HydrophobicContact CE2-CG 4.45Å; Y236-K240 WeakPolarHBondContact O-CG 3.45Å; Y236-K240 PolarHBondContact O-N 3.41Å; Y236-K240 WeakPolarHBondContact OH-CE 3.31Å; Y236-K240 PolarHBondContact OH-NZ 2.98Å
237	S	98	Very high	97.5	Very high	31 Å²	31	28.4 Å²	28.4	22%	0.217	15%	0.151	C	C	.	.	H	α-helix	trans	-65.1	-38.5	-178.8	-56.4	0	0	0	0	112.1	L233 V234 S235 Q239 K240 V241	L233-S237 WeakPolarHBondContact O-CB 3.48Å; L233-S237 PolarHBondContact O-N 3.22Å; L233-S237 PolarHBondContact O-OG 2.88Å; V234-S237 PolarHBondContact O-N 2.89Å; V234-S237 VanDerWaalsContact O-N 3.14Å; S235-S237 VanDerWaalsContact C-N 3.32Å; S235-S237 PolarHBondContact O-N 3.39Å; S237-Q239 VanDerWaalsContact C-N 3.35Å; S237-Q239 PolarHBondContact O-N 3.28Å; S237-K240 PolarHBondContact O-N 3.25Å; S237-V241 WeakPolarHBondContact O-CG2 3.29Å; S237-V241 PolarHBondContact O-N 3.06Å
238	I	98.4	Very high	97.7	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.01	15%	0.15	C	C	.	.	H	α-helix	trans	-57.6	-47.5	171.9	-70.3	165.8	0	0	0	110.2	V234 S235 Y236 K240 V241 I242 I271 L420 V421 V424 F425	V234-I238 HydrophobicContact CG1-CD1 4.02Å; V234-I238 HydrophobicContact CG1-CG1 4.42Å; V234-I238 VanDerWaalsContact O-CG1 3.29Å; V234-I238 WeakPolarHBondContact O-CG1 3.31Å; V234-I238 PolarHBondContact O-N 3.41Å; S235-I238 PolarHBondContact O-N 3.11Å; Y236-I238 PolarHBondContact O-N 2.85Å; I238-K240 VanDerWaalsContact C-N 3.26Å; I238-K240 PolarHBondContact O-N 3.25Å; I238-V241 PolarHBondContact O-N 2.81Å; I238-V241 VanDerWaalsContact O-N 3.14Å; I238-I242 HydrophobicContact CG2-CD1 3.85Å; I238-I242 HydrophobicContact CG2-CG1 4.39Å; I238-I242 VanDerWaalsContact O-CG1 3.32Å; I238-I242 WeakPolarHBondContact O-CG1 3.31Å; I238-I242 PolarHBondContact O-N 2.88Å; I238-I271 HydrophobicContact CG1-CD1 4.01Å; I238-L420 HydrophobicContact CB-CD2 4.09Å; I238-L420 HydrophobicContact CB-CG 4.4Å; I238-L420 HydrophobicContact CD1-CG 4.49Å; I238-L420 HydrophobicContact CG2-CD1 4.07Å; I238-L420 HydrophobicContact CG2-CD2 3.76Å; I238-L420 HydrophobicContact CG2-CG 3.84Å; I238-V421 HydrophobicContact CD1-CG2 4.13Å; I238-V424 HydrophobicContact CD1-CB 4.12Å; I238-V424 HydrophobicContact CD1-CG1 4.23Å; I238-V424 HydrophobicContact CD1-CG2 4.39Å; I238-V424 HydrophobicContact CG2-CG2 3.87Å; I238-F425 HydrophobicContact CD1-CE2 4.04Å; I238-F425 HydrophobicContact CD1-CZ 4.11Å; I238-F425 HydrophobicContact CG1-CZ 4.4Å
239	Q	98.3	Very high	97.8	Very high	108 Å²	108	29.1 Å²	29.1	51%	0.505	16%	0.156	S	C	.	.	H	α-helix	trans	-59.5	-39.1	178.3	-65	174	7.7	0	0	112	S235 Y236 S237 I242 G243 L420	S235-Q239 WeakPolarHBondContact O-CG 3.33Å; S235-Q239 PolarHBondContact O-N 3.48Å; S235-Q239 VanDerWaalsContact O-N 3.14Å; Y236-Q239 WeakPolarHBondContact O-CB 3.32Å; Y236-Q239 PolarHBondContact O-N 2.97Å; Y236-Q239 VanDerWaalsContact O-N 3.15Å; S237-Q239 VanDerWaalsContact C-N 3.35Å; S237-Q239 PolarHBondContact O-N 3.28Å; Q239-I242 PolarHBondContact O-N 2.91Å; Q239-G243 PolarHBondContact O-N 3.47Å; Q239-L420 HydrophobicContact CG-CD2 3.51Å
240	K	98.3	Very high	97.9	Very high	54 Å²	54	29.7 Å²	29.7	24%	0.235	16%	0.162	C	C	.	.	H	α-helix	trans	-68.8	-37.9	175.7	-64.5	-48	-175.6	172.2	0	112.9	T146 Y236 S237 I238 G243 F244	T146-K240 WeakPolarHBondContact CB-O 3.18Å; T146-K240 WeakPolarHBondContact O-CB 3.3Å; T146-K240 VanDerWaalsContact O-CD 3.31Å; T146-K240 WeakPolarHBondContact O-CD 3.5Å; T146-K240 WeakPolarHBondContact O-CG 3.5Å; Y236-K240 HydrophobicContact CD1-CG 4.37Å; Y236-K240 HydrophobicContact CE1-CG 4.02Å; Y236-K240 HydrophobicContact CE2-CD 4.42Å; Y236-K240 HydrophobicContact CE2-CG 4.45Å; Y236-K240 WeakPolarHBondContact O-CG 3.45Å; Y236-K240 PolarHBondContact O-N 3.41Å; Y236-K240 WeakPolarHBondContact OH-CE 3.31Å; Y236-K240 PolarHBondContact OH-NZ 2.98Å; S237-K240 PolarHBondContact O-N 3.25Å; I238-K240 VanDerWaalsContact C-N 3.26Å; I238-K240 PolarHBondContact O-N 3.25Å; K240-G243 PolarHBondContact O-N 3.34Å; K240-F244 WeakPolarHBondContact O-CB 3.39Å; K240-F244 PolarHBondContact O-N 3.47Å
241	V	98.6	Very high	98	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.006	16%	0.156	C	C	.	.	H	α-helix	trans	-62.9	-44.2	172.4	172.5	0	0	0	0	110.8	S237 I238 G243 F244 A245 L263 V270 I271 L338	S237-V241 WeakPolarHBondContact O-CG2 3.29Å; S237-V241 PolarHBondContact O-N 3.06Å; I238-V241 PolarHBondContact O-N 2.81Å; I238-V241 VanDerWaalsContact O-N 3.14Å; V241-G243 VanDerWaalsContact C-N 3.32Å; V241-G243 PolarHBondContact O-N 3.35Å; V241-F244 WeakPolarHBondContact O-CB 3.22Å; V241-F244 PolarHBondContact O-N 3.47Å; V241-A245 WeakPolarHBondContact O-CB 3.49Å; V241-A245 PolarHBondContact O-N 3.09Å; V241-L263 HydrophobicContact CG1-CD2 4.2Å; V241-V270 HydrophobicContact CG1-CB 4.21Å; V241-V270 HydrophobicContact CG1-CG1 4.14Å; V241-V270 HydrophobicContact CG2-CB 4.09Å; V241-V270 HydrophobicContact CG2-CG1 3.74Å; V241-I271 HydrophobicContact CG2-CG1 3.97Å; V241-L338 HydrophobicContact CG1-CD1 4.14Å
242	I	98.5	Very high	98	Very high	41 Å²	41	36 Å²	36	21%	0.21	18%	0.183	C	C	.	.	H	α-helix	trans	-59.7	-44	174.9	-65.8	167.4	0	0	0	110.8	I238 Q239 F244 A245 K246 L263	I238-I242 HydrophobicContact CG2-CD1 3.85Å; I238-I242 HydrophobicContact CG2-CG1 4.39Å; I238-I242 VanDerWaalsContact O-CG1 3.32Å; I238-I242 WeakPolarHBondContact O-CG1 3.31Å; I238-I242 PolarHBondContact O-N 2.88Å; Q239-I242 PolarHBondContact O-N 2.91Å; I242-F244 VanDerWaalsContact C-N 3.32Å; I242-F244 PolarHBondContact O-N 3.22Å; I242-A245 PolarHBondContact O-N 2.88Å; I242-K246 HydrophobicContact CG2-CD 4.22Å; I242-K246 WeakPolarHBondContact O-CG 3.5Å; I242-K246 PolarHBondContact O-N 2.88Å; I242-K246 VanDerWaalsContact O-N 3.11Å; I242-L263 HydrophobicContact CG1-CD1 4.06Å; I242-L263 HydrophobicContact CG1-CD2 4Å
243	G	98.6	Very high	98.1	Very high	27 Å²	27	40.5 Å²	40.5	28%	0.278	20%	0.204	S	C	.	.	H	α-helix	trans	-58.8	-43.4	175.5	0	0	0	0	0	112.4	Q239 K240 V241	Q239-G243 PolarHBondContact O-N 3.47Å; K240-G243 PolarHBondContact O-N 3.34Å; V241-G243 VanDerWaalsContact C-N 3.32Å; V241-G243 PolarHBondContact O-N 3.35Å
244	F	98.8	Very high	98.1	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-66.5	-48.1	178.9	178	-97.5	0	0	0	111	L139 A142 H143 T146 K240 V241 I242 K246 M247 I248 V331 M334 A335	L139-F244 HydrophobicContact CD2-CZ 4.14Å; A142-F244 HydrophobicContact CB-CD2 3.71Å; A142-F244 HydrophobicContact CB-CE2 3.96Å; H143-F244 HydrophobicContact CB-CE2 4.19Å; T146-F244 HydrophobicContact CG2-CB 4.31Å; K240-F244 WeakPolarHBondContact O-CB 3.39Å; K240-F244 PolarHBondContact O-N 3.47Å; V241-F244 WeakPolarHBondContact O-CB 3.22Å; V241-F244 PolarHBondContact O-N 3.47Å; I242-F244 VanDerWaalsContact C-N 3.32Å; I242-F244 PolarHBondContact O-N 3.22Å; F244-K246 VanDerWaalsContact C-N 3.28Å; F244-K246 PolarHBondContact O-N 3.31Å; F244-M247 PolarHBondContact O-N 3.33Å; F244-I248 HydrophobicContact CD1-CD1 4.15Å; F244-I248 HydrophobicContact CD1-CG1 4.39Å; F244-I248 HydrophobicContact CE1-CD1 3.91Å; F244-I248 HydrophobicContact CE1-CG1 4.15Å; F244-I248 PolarHBondContact O-N 3.27Å; F244-V331 HydrophobicContact CE2-CB 4.49Å; F244-V331 HydrophobicContact CZ-CB 4.41Å; F244-M334 HydrophobicContact CE1-CB 4.06Å; F244-M334 HydrophobicContact CE2-CE 4.15Å; F244-M334 HydrophobicContact CZ-CB 4.24Å; F244-M334 HydrophobicContact CZ-CE 4.07Å; F244-A335 HydrophobicContact CE1-CB 4.4Å
245	A	98.6	Very high	98	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-53.8	-45.6	178.7	0	0	0	0	0	112	V241 I242 M247 I248 F251 L263 L338	V241-A245 WeakPolarHBondContact O-CB 3.49Å; V241-A245 PolarHBondContact O-N 3.09Å; I242-A245 PolarHBondContact O-N 2.88Å; A245-M247 PolarHBondContact O-N 2.78Å; A245-I248 WeakPolarHBondContact O-CB 3.43Å; A245-I248 PolarHBondContact O-N 3.47Å; A245-F251 HydrophobicContact CB-CD1 4.2Å; A245-F251 HydrophobicContact CB-CE1 3.83Å; A245-F251 HydrophobicContact CB-CE2 4.19Å; A245-F251 HydrophobicContact CB-CZ 3.83Å; A245-F251 WeakPolarHBondContact O-CB 3.28Å; A245-F251 VanDerWaalsContact O-CD1 3.25Å; A245-F251 WeakPolarHBondContact O-CD1 3.42Å; A245-F251 VanDerWaalsContact O-CG 3.26Å; A245-F251 WeakPolarHBondContact O-CG 3.33Å; A245-L263 HydrophobicContact CB-CD2 3.82Å; A245-L338 HydrophobicContact CB-CD1 3.49Å; A245-L338 VanDerWaalsContact CB-CD1 3.49Å; A245-L338 HydrophobicContact CB-CD2 4.13Å; A245-L338 HydrophobicContact CB-CG 4.47Å
246	K	98.4	Very high	98	Very high	98 Å²	98	43.5 Å²	43.5	43%	0.426	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-11.8	178.5	-75.8	177.4	178.2	179.2	0	114.3	I242 F244 R252	I242-K246 HydrophobicContact CG2-CD 4.22Å; I242-K246 WeakPolarHBondContact O-CG 3.5Å; I242-K246 PolarHBondContact O-N 2.88Å; I242-K246 VanDerWaalsContact O-N 3.11Å; F244-K246 VanDerWaalsContact C-N 3.28Å; F244-K246 PolarHBondContact O-N 3.31Å; K246-R252 PolarHBondContact O-NE 2.62Å; K246-R252 PolarHBondContact O-NH2 3.24Å
247	M	98.6	Very high	97.8	Very high	47 Å²	47	47.9 Å²	47.9	23%	0.232	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-7.2	176	-66.7	-169.1	61.4	0	0	113	T138 E141 A142 K145 F244 A245 P249	T138-M247 VanDerWaalsContact CG2-O 3.31Å; T138-M247 WeakPolarHBondContact CG2-O 3.31Å; E141-M247 HydrophobicContact CG-CE 4.4Å; A142-M247 HydrophobicContact CB-CB 3.49Å; A142-M247 VanDerWaalsContact CB-CB 3.49Å; A142-M247 HydrophobicContact CB-CE 4.08Å; A142-M247 HydrophobicContact CB-CG 4.18Å; A142-M247 HydrophobicContact CB-SD 3.86Å; K145-M247 HydrophobicContact CD-CE 4.11Å; K145-M247 HydrophobicContact CD-SD 4.03Å; F244-M247 PolarHBondContact O-N 3.33Å; A245-M247 PolarHBondContact O-N 2.78Å; M247-P249 WeakPolarHBondContact O-CD 3.42Å
248	I	98.6	Very high	97.6	Very high	4 Å²	4	46.5 Å²	46.5	2%	0.021	24%	0.239	C	C	.	.	S	Bend	trans	-66.8	125.1	174.2	-58.6	175	0	0	0	108.6	L139 F244 A245 G250 F251 A335 L338 L339 L364	L139-I248 HydrophobicContact CD2-CB 4.31Å; L139-I248 HydrophobicContact CD2-CG1 3.81Å; L139-I248 HydrophobicContact CD2-CG2 4.36Å; F244-I248 HydrophobicContact CD1-CD1 4.15Å; F244-I248 HydrophobicContact CD1-CG1 4.39Å; F244-I248 HydrophobicContact CE1-CD1 3.91Å; F244-I248 HydrophobicContact CE1-CG1 4.15Å; F244-I248 PolarHBondContact O-N 3.27Å; A245-I248 WeakPolarHBondContact O-CB 3.43Å; A245-I248 PolarHBondContact O-N 3.47Å; I248-G250 PolarHBondContact O-N 3.27Å; I248-F251 HydrophobicContact CB-CB 4.07Å; I248-F251 WeakPolarHBondContact O-CB 3.25Å; I248-F251 PolarHBondContact O-N 3.19Å; I248-F251 VanDerWaalsContact O-N 3.11Å; I248-A335 HydrophobicContact CD1-CB 3.99Å; I248-A335 HydrophobicContact CG1-CB 4.38Å; I248-L338 HydrophobicContact CD1-CB 4.32Å; I248-L338 HydrophobicContact CD1-CD1 4.16Å; I248-L338 HydrophobicContact CD1-CD2 4.14Å; I248-L338 HydrophobicContact CD1-CG 4.44Å; I248-L339 HydrophobicContact CG2-CD1 3.61Å; I248-L364 HydrophobicContact CG2-CD1 4.42Å
249	P	98.1	Very high	97.5	Very high	49 Å²	49	48.2 Å²	48.2	32%	0.318	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	127.3	177.5	-26.7	35.7	0	0	0	111.9	V135 T138 M247	V135-P249 HydrophobicContact CG2-CG 4.37Å; T138-P249 HydrophobicContact CG2-CG 4.27Å; M247-P249 WeakPolarHBondContact O-CD 3.42Å
250	G	97.2	Very high	97.3	Very high	13 Å²	13	47.5 Å²	47.5	13%	0.134	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.8	-14	-179	0	0	0	0	0	115.4	I248 E253	I248-G250 PolarHBondContact O-N 3.27Å; G250-E253 WeakPolarHBondContact CA-OE2 3.48Å; G250-E253 PolarHBondContact N-OE2 3.09Å; G250-E253 VanDerWaalsContact O-OE2 3.13Å
251	F	98.1	Very high	97	Very high	1 Å²	1	45.5 Å²	45.5	0%	0.004	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-41.3	-176.6	-176.3	-92.5	0	0	0	113	A245 I248 E253 L254 Q259 L262 L263 L338 L339	A245-F251 HydrophobicContact CB-CD1 4.2Å; A245-F251 HydrophobicContact CB-CE1 3.83Å; A245-F251 HydrophobicContact CB-CE2 4.19Å; A245-F251 HydrophobicContact CB-CZ 3.83Å; A245-F251 WeakPolarHBondContact O-CB 3.28Å; A245-F251 VanDerWaalsContact O-CD1 3.25Å; A245-F251 WeakPolarHBondContact O-CD1 3.42Å; A245-F251 VanDerWaalsContact O-CG 3.26Å; A245-F251 WeakPolarHBondContact O-CG 3.33Å; I248-F251 HydrophobicContact CB-CB 4.07Å; I248-F251 WeakPolarHBondContact O-CB 3.25Å; I248-F251 PolarHBondContact O-N 3.19Å; I248-F251 VanDerWaalsContact O-N 3.11Å; F251-E253 PolarHBondContact N-OE2 3.32Å; F251-E253 PolarHBondContact O-N 2.59Å; F251-L254 HydrophobicContact CD2-CD1 4.14Å; F251-L254 WeakPolarHBondContact O-CB 3.26Å; F251-L254 PolarHBondContact O-N 3.17Å; F251-Q259 HydrophobicContact CD1-CG 4.16Å; F251-Q259 HydrophobicContact CE1-CB 3.97Å; F251-Q259 HydrophobicContact CE1-CG 3.68Å; F251-Q259 HydrophobicContact CE2-CG 4.35Å; F251-Q259 HydrophobicContact CZ-CB 3.77Å; F251-Q259 HydrophobicContact CZ-CG 3.78Å; F251-Q259 WeakPolarHBondContact O-CG 3.48Å; F251-Q259 PolarHBondContact O-NE2 2.64Å; F251-L262 HydrophobicContact CE2-CB 4.43Å; F251-L262 HydrophobicContact CE2-CD1 4.1Å; F251-L263 HydrophobicContact CZ-CD1 4.15Å; F251-L263 HydrophobicContact CZ-CG 4.13Å; F251-L338 HydrophobicContact CD2-CD2 3.81Å; F251-L338 HydrophobicContact CE2-CD2 3.46Å; F251-L338 VanDerWaalsContact CE2-CD2 3.46Å; F251-L338 HydrophobicContact CZ-CD2 4.34Å; F251-L339 HydrophobicContact CD2-CD2 4.04Å
252	R	97.6	Very high	96.8	Very high	162 Å²	162	45.4 Å²	45.4	61%	0.611	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-20.8	-178.7	-69	-169.7	-178.6	-167.7	1	112.8	K246 L254 Q259	K246-R252 PolarHBondContact O-NE 2.62Å; K246-R252 PolarHBondContact O-NH2 3.24Å; R252-L254 VanDerWaalsContact C-N 3.31Å; R252-Q259 PolarHBondContact O-NE2 3.34Å
253	E	97.6	Very high	96.6	Very high	119 Å²	119	44.7 Å²	44.7	56%	0.556	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-5	179	-57.5	85.9	166.3	0	0	112.6	G250 F251 R356	G250-E253 WeakPolarHBondContact CA-OE2 3.48Å; G250-E253 PolarHBondContact N-OE2 3.09Å; G250-E253 VanDerWaalsContact O-OE2 3.13Å; F251-E253 PolarHBondContact N-OE2 3.32Å; F251-E253 PolarHBondContact O-N 2.59Å; E253-R356 PolarHBondContact O-NH2 2.8Å
254	L	96.8	Very high	96.3	Very high	10 Å²	10	46.5 Å²	46.5	5%	0.052	24%	0.235	C	C	.	.	S	Bend	trans	-73.2	161.2	167.7	-60.9	175.7	0	0	0	110.9	F251 R252 D258 Q259 L262 L339 R356 I357 L360	F251-L254 HydrophobicContact CD2-CD1 4.14Å; F251-L254 WeakPolarHBondContact O-CB 3.26Å; F251-L254 PolarHBondContact O-N 3.17Å; R252-L254 VanDerWaalsContact C-N 3.31Å; L254-D258 HydrophobicContact CB-CB 4.22Å; L254-Q259 HydrophobicContact CB-CG 3.96Å; L254-Q259 PolarHBondContact O-NE2 3.13Å; L254-L262 HydrophobicContact CD1-CD1 3.63Å; L254-L339 HydrophobicContact CD1-CD2 4.11Å; L254-R356 HydrophobicContact CD2-CG 3.89Å; L254-I357 HydrophobicContact CD1-CG1 4.2Å; L254-I357 HydrophobicContact CD2-CG1 4.03Å; L254-L360 HydrophobicContact CD1-CD1 4.4Å; L254-L360 HydrophobicContact CD2-CD1 4.01Å; L254-L360 HydrophobicContact CG-CD1 4.32Å
255	T	96.5	Very high	95.9	Very high	62 Å²	62	47.3 Å²	47.3	38%	0.38	24%	0.241	S	C	.	.			trans	-61.7	156.8	172.7	69.3	0	0	0	0	110.8	E257 D258 Q259	T255-E257 WeakPolarHBondContact CB-OE2 3.37Å; T255-E257 PolarHBondContact O-N 2.94Å; T255-D258 PolarHBondContact O-N 2.83Å; T255-D258 VanDerWaalsContact OG1-CB 3.3Å; T255-D258 WeakPolarHBondContact OG1-CB 3.32Å; T255-D258 PolarHBondContact OG1-N 2.81Å; T255-D258 PolarHBondContact OG1-OD2 3.38Å; T255-Q259 VanDerWaalsContact O-CG 3.32Å; T255-Q259 WeakPolarHBondContact O-CG 3.37Å; T255-Q259 PolarHBondContact O-N 3.28Å
256	A	95.8	Very high	95.6	Very high	58 Å²	58	47.3 Å²	47.3	48%	0.479	24%	0.241	S	C	.	.	H	α-helix	trans	-63.7	-36.5	178.3	0	0	0	0	0	110.7	Q259 I260	A256-Q259 PolarHBondContact O-N 3.36Å; A256-I260 WeakPolarHBondContact O-CB 3.42Å; A256-I260 WeakPolarHBondContact O-CD1 3.43Å; A256-I260 WeakPolarHBondContact O-CG1 3.31Å; A256-I260 PolarHBondContact O-N 3.08Å
257	E	93.8	Very high	95.5	Very high	119 Å²	119	42.8 Å²	42.8	56%	0.556	22%	0.222	S	C	*	.	H	α-helix	trans	-60	-49.4	176	-63.7	73.8	-165.4	0	0	111	T255 I260 A261	T255-E257 WeakPolarHBondContact CB-OE2 3.37Å; T255-E257 PolarHBondContact O-N 2.94Å; E257-I260 PolarHBondContact O-N 3.36Å; E257-A261 WeakPolarHBondContact O-CB 3.09Å; E257-A261 PolarHBondContact O-N 3.26Å
258	D	94.3	Very high	95.4	Very high	2 Å²	2	41 Å²	41	1%	0.011	21%	0.213	C	C	.	.	H	α-helix	trans	-63.9	-43.4	176.7	-71.1	-40.1	0	0	0	111.9	L254 T255 I260 A261 L262 Q352 D353 I357	L254-D258 HydrophobicContact CB-CB 4.22Å; T255-D258 PolarHBondContact O-N 2.83Å; T255-D258 VanDerWaalsContact OG1-CB 3.3Å; T255-D258 WeakPolarHBondContact OG1-CB 3.32Å; T255-D258 PolarHBondContact OG1-N 2.81Å; T255-D258 PolarHBondContact OG1-OD2 3.38Å; D258-I260 VanDerWaalsContact C-N 3.3Å; D258-I260 PolarHBondContact O-N 3.3Å; D258-A261 PolarHBondContact O-N 2.83Å; D258-L262 WeakPolarHBondContact O-CB 3.34Å; D258-L262 WeakPolarHBondContact O-CG 3.29Å; D258-L262 PolarHBondContact O-N 3.31Å; D258-Q352 PolarHBondContact OD1-N 3.37Å; D258-D353 PolarHBondContact OD1-N 2.93Å; D258-I357 HydrophobicContact CB-CD1 4.32Å
259	Q	96	Very high	95.3	Very high	38 Å²	38	41 Å²	41	18%	0.178	21%	0.213	C	C	.	.	H	α-helix	trans	-58.9	-43.5	177.1	-71.2	179.1	53.1	0	0	111.1	F251 R252 L254 T255 A256 L263	F251-Q259 HydrophobicContact CD1-CG 4.16Å; F251-Q259 HydrophobicContact CE1-CB 3.97Å; F251-Q259 HydrophobicContact CE1-CG 3.68Å; F251-Q259 HydrophobicContact CE2-CG 4.35Å; F251-Q259 HydrophobicContact CZ-CB 3.77Å; F251-Q259 HydrophobicContact CZ-CG 3.78Å; F251-Q259 WeakPolarHBondContact O-CG 3.48Å; F251-Q259 PolarHBondContact O-NE2 2.64Å; R252-Q259 PolarHBondContact O-NE2 3.34Å; L254-Q259 HydrophobicContact CB-CG 3.96Å; L254-Q259 PolarHBondContact O-NE2 3.13Å; T255-Q259 VanDerWaalsContact O-CG 3.32Å; T255-Q259 WeakPolarHBondContact O-CG 3.37Å; T255-Q259 PolarHBondContact O-N 3.28Å; A256-Q259 PolarHBondContact O-N 3.36Å; Q259-L263 WeakPolarHBondContact O-CB 3.29Å; Q259-L263 WeakPolarHBondContact O-CD1 3.23Å; Q259-L263 VanDerWaalsContact O-CG 3.26Å; Q259-L263 WeakPolarHBondContact O-CG 3.13Å; Q259-L263 PolarHBondContact O-N 3.02Å; Q259-L263 VanDerWaalsContact O-N 3.11Å
260	I	93.8	Very high	95.3	Very high	93 Å²	93	38.6 Å²	38.6	48%	0.477	20%	0.198	S	C	.	.	H	α-helix	trans	-66.3	-48.3	177.6	-68.8	163.8	0	0	0	110.5	A256 E257 D258 L262 L263 K264	A256-I260 WeakPolarHBondContact O-CB 3.42Å; A256-I260 WeakPolarHBondContact O-CD1 3.43Å; A256-I260 WeakPolarHBondContact O-CG1 3.31Å; A256-I260 PolarHBondContact O-N 3.08Å; E257-I260 PolarHBondContact O-N 3.36Å; D258-I260 VanDerWaalsContact C-N 3.3Å; D258-I260 PolarHBondContact O-N 3.3Å; I260-L262 VanDerWaalsContact C-N 3.34Å; I260-L262 PolarHBondContact O-N 3.34Å; I260-L263 PolarHBondContact O-N 3.12Å; I260-K264 HydrophobicContact CG2-CD 4.11Å; I260-K264 HydrophobicContact CG2-CG 4.22Å; I260-K264 WeakPolarHBondContact O-CG 3.24Å; I260-K264 PolarHBondContact O-N 2.79Å
261	A	92.6	Very high	95.3	Very high	11 Å²	11	39.1 Å²	39.1	9%	0.091	20%	0.197	C	C	.	.	H	α-helix	trans	-60.1	-43.2	-179.2	0	0	0	0	0	112	E257 D258 S265 V351	E257-A261 WeakPolarHBondContact O-CB 3.09Å; E257-A261 PolarHBondContact O-N 3.26Å; D258-A261 PolarHBondContact O-N 2.83Å; A261-S265 WeakPolarHBondContact O-CB 3Å; A261-S265 PolarHBondContact O-N 2.83Å; A261-S265 VanDerWaalsContact O-N 3.08Å; A261-S265 PolarHBondContact O-OG 2.98Å; A261-V351 HydrophobicContact CB-CG2 3.86Å
262	L	94.4	Very high	95.3	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63.7	-42.8	175.9	-69.7	171.4	0	0	0	112	F251 L254 D258 I260 S265 S266 L339 S340 R348 V351 I357	F251-L262 HydrophobicContact CE2-CB 4.43Å; F251-L262 HydrophobicContact CE2-CD1 4.1Å; L254-L262 HydrophobicContact CD1-CD1 3.63Å; D258-L262 WeakPolarHBondContact O-CB 3.34Å; D258-L262 WeakPolarHBondContact O-CG 3.29Å; D258-L262 PolarHBondContact O-N 3.31Å; I260-L262 VanDerWaalsContact C-N 3.34Å; I260-L262 PolarHBondContact O-N 3.34Å; L262-S265 PolarHBondContact O-OG 2.97Å; L262-S266 VanDerWaalsContact O-CB 3.28Å; L262-S266 WeakPolarHBondContact O-CB 3.46Å; L262-S266 PolarHBondContact O-N 3.3Å; L262-S266 VanDerWaalsContact O-N 3.08Å; L262-S266 PolarHBondContact O-OG 3.21Å; L262-L339 HydrophobicContact CD1-CD2 4.11Å; L262-S340 VanDerWaalsContact CD2-O 3.28Å; L262-S340 WeakPolarHBondContact CD2-O 3.3Å; L262-R348 VanDerWaalsContact CD2-NH1 3.34Å; L262-V351 HydrophobicContact CD2-CG2 4.35Å; L262-I357 HydrophobicContact CD1-CD1 4.05Å; L262-I357 HydrophobicContact CD1-CG1 4.23Å; L262-I357 HydrophobicContact CD2-CD1 4.28Å; L262-I357 HydrophobicContact CD2-CG2 4.16Å; L262-I357 HydrophobicContact CG-CD1 4.36Å
263	L	95.1	Very high	95.4	Very high	25 Å²	25	31.9 Å²	31.9	13%	0.131	17%	0.17	C	C	.	.	H	α-helix	trans	-67.1	-46	178.6	-76	165.7	0	0	0	111.8	V241 I242 A245 F251 Q259 I260 S265 S266 A267 L338	V241-L263 HydrophobicContact CG1-CD2 4.2Å; I242-L263 HydrophobicContact CG1-CD1 4.06Å; I242-L263 HydrophobicContact CG1-CD2 4Å; A245-L263 HydrophobicContact CB-CD2 3.82Å; F251-L263 HydrophobicContact CZ-CD1 4.15Å; F251-L263 HydrophobicContact CZ-CG 4.13Å; Q259-L263 WeakPolarHBondContact O-CB 3.29Å; Q259-L263 WeakPolarHBondContact O-CD1 3.23Å; Q259-L263 VanDerWaalsContact O-CG 3.26Å; Q259-L263 WeakPolarHBondContact O-CG 3.13Å; Q259-L263 PolarHBondContact O-N 3.02Å; Q259-L263 VanDerWaalsContact O-N 3.11Å; I260-L263 PolarHBondContact O-N 3.12Å; L263-S265 VanDerWaalsContact C-N 3.32Å; L263-S265 PolarHBondContact O-N 2.97Å; L263-S266 PolarHBondContact O-N 3.01Å; L263-A267 WeakPolarHBondContact O-CB 3.46Å; L263-A267 PolarHBondContact O-N 3.05Å; L263-L338 HydrophobicContact CD2-CD1 4.41Å
264	K	92.1	Very high	95.4	Very high	66 Å²	66	27.1 Å²	27.1	29%	0.287	15%	0.147	S	C	.	.	H	α-helix	trans	-59.6	-42.3	178.4	-73.5	-166.6	175.8	-166.1	0	112.2	I260 E423	I260-K264 HydrophobicContact CG2-CD 4.11Å; I260-K264 HydrophobicContact CG2-CG 4.22Å; I260-K264 WeakPolarHBondContact O-CG 3.24Å; I260-K264 PolarHBondContact O-N 2.79Å; K264-E423 WeakPolarHBondContact CE-O 3.45Å; K264-E423 PolarHBondContact NZ-O 3.47Å
265	S	89.1	Confident	95.4	Very high	17 Å²	17	28 Å²	28	12%	0.119	15%	0.154	C	C	.	.	H	α-helix	trans	-79.2	-26	-177.1	55.7	0	0	0	0	114.8	A261 L262 L263 R348 N397	A261-S265 WeakPolarHBondContact O-CB 3Å; A261-S265 PolarHBondContact O-N 2.83Å; A261-S265 VanDerWaalsContact O-N 3.08Å; A261-S265 PolarHBondContact O-OG 2.98Å; L262-S265 PolarHBondContact O-OG 2.97Å; L263-S265 VanDerWaalsContact C-N 3.32Å; L263-S265 PolarHBondContact O-N 2.97Å; S265-R348 WeakPolarHBondContact OG-CD 3.47Å; S265-R348 PolarHBondContact OG-NE 3.21Å; S265-N397 PolarHBondContact O-ND2 3.32Å
266	S	93.1	Very high	95.4	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-111.2	-12.7	-172.8	69.6	0	0	0	0	115.2	L262 L263 I268 E269 V270	L262-S266 VanDerWaalsContact O-CB 3.28Å; L262-S266 WeakPolarHBondContact O-CB 3.46Å; L262-S266 PolarHBondContact O-N 3.3Å; L262-S266 VanDerWaalsContact O-N 3.08Å; L262-S266 PolarHBondContact O-OG 3.21Å; L263-S266 PolarHBondContact O-N 3.01Å; S266-I268 VanDerWaalsContact C-N 3.32Å; S266-I268 PolarHBondContact O-N 2.9Å; S266-E269 WeakPolarHBondContact O-CB 3.35Å; S266-E269 PolarHBondContact O-N 3.29Å; S266-V270 WeakPolarHBondContact O-CG2 3.36Å; S266-V270 PolarHBondContact O-N 3.46Å
267	A	96	Very high	95.4	Very high	2 Å²	2	25.7 Å²	25.7	2%	0.017	13%	0.13	C	C	.	.	H	α-helix	trans	-54.8	-46.9	-171.2	0	0	0	0	0	112.6	L263 E269 V270 I271 V424 F425	L263-A267 WeakPolarHBondContact O-CB 3.46Å; L263-A267 PolarHBondContact O-N 3.05Å; A267-E269 PolarHBondContact O-N 2.69Å; A267-V270 PolarHBondContact O-N 3.25Å; A267-I271 WeakPolarHBondContact O-CB 3.12Å; A267-I271 WeakPolarHBondContact O-CD1 3.41Å; A267-I271 WeakPolarHBondContact O-CG1 3.4Å; A267-I271 PolarHBondContact O-N 3.24Å; A267-V424 HydrophobicContact CB-CG1 3.93Å; A267-F425 HydrophobicContact CB-CE1 4.1Å; A267-F425 HydrophobicContact CB-CZ 4.43Å
268	I	96.3	Very high	95.5	Very high	11 Å²	11	20.8 Å²	20.8	6%	0.056	11%	0.108	C	C	.	.	H	α-helix	trans	-67.5	-36.8	179.6	-166.5	64.5	0	0	0	112.4	S266 V270 I271 M272 N397 F425	S266-I268 VanDerWaalsContact C-N 3.32Å; S266-I268 PolarHBondContact O-N 2.9Å; I268-V270 PolarHBondContact O-N 3.42Å; I268-I271 PolarHBondContact O-N 2.96Å; I268-M272 HydrophobicContact CD1-CE 4.35Å; I268-M272 HydrophobicContact CG1-CE 3.74Å; I268-M272 HydrophobicContact CG1-CG 4.48Å; I268-M272 HydrophobicContact CG1-SD 4.34Å; I268-M272 WeakPolarHBondContact O-CB 3.49Å; I268-M272 VanDerWaalsContact O-CG 3.28Å; I268-M272 WeakPolarHBondContact O-CG 3.43Å; I268-M272 PolarHBondContact O-N 2.88Å; I268-N397 HydrophobicContact CG2-CB 4.27Å; I268-N397 WeakPolarHBondContact CG2-OD1 3.33Å; I268-F425 HydrophobicContact CB-CE1 3.9Å; I268-F425 HydrophobicContact CB-CZ 3.82Å; I268-F425 HydrophobicContact CD1-CZ 4.18Å; I268-F425 HydrophobicContact CG1-CZ 4.49Å; I268-F425 HydrophobicContact CG2-CE1 4.49Å
269	E	96.5	Very high	95.6	Very high	2 Å²	2	21 Å²	21	1%	0.009	11%	0.109	C	C	.	.	H	α-helix	trans	-62.7	-44.6	177.7	-60.1	179.5	-172.6	0	0	110.7	S266 A267 M272 L273 C337 R348 L393 R394 N397	S266-E269 WeakPolarHBondContact O-CB 3.35Å; S266-E269 PolarHBondContact O-N 3.29Å; A267-E269 PolarHBondContact O-N 2.69Å; E269-M272 PolarHBondContact O-N 3.47Å; E269-L273 PolarHBondContact O-N 2.71Å; E269-C337 VanDerWaalsContact CB-SG 3.5Å; E269-C337 PolarHBondContact OE2-SG 3.42Å; E269-C337 VanDerWaalsContact OE2-SG 3.34Å; E269-R348 IonicContact OE2-NH2 3.8Å; E269-L393 HydrophobicContact CB-CB 4.18Å; E269-L393 HydrophobicContact CB-CD1 4.19Å; E269-L393 HydrophobicContact CB-CD2 4.35Å; E269-L393 HydrophobicContact CB-CG 4.47Å; E269-L393 HydrophobicContact CG-CB 4.06Å; E269-R394 WeakPolarHBondContact OE1-CD 3.44Å; E269-R394 IonicContact OE1-NE 2.99Å; E269-N397 HydrophobicContact CG-CB 3.93Å; E269-N397 PolarHBondContact OE1-ND2 2.98Å
270	V	98.1	Very high	95.4	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-67.6	-37.1	176.4	-179.7	0	0	0	0	111.3	V241 S266 A267 I268 L273 R274 M334 C337 L338	V241-V270 HydrophobicContact CG1-CB 4.21Å; V241-V270 HydrophobicContact CG1-CG1 4.14Å; V241-V270 HydrophobicContact CG2-CB 4.09Å; V241-V270 HydrophobicContact CG2-CG1 3.74Å; S266-V270 WeakPolarHBondContact O-CG2 3.36Å; S266-V270 PolarHBondContact O-N 3.46Å; A267-V270 PolarHBondContact O-N 3.25Å; I268-V270 PolarHBondContact O-N 3.42Å; V270-L273 PolarHBondContact O-N 2.87Å; V270-R274 VanDerWaalsContact O-CB 3.26Å; V270-R274 WeakPolarHBondContact O-CB 3.25Å; V270-R274 PolarHBondContact O-N 3.39Å; V270-M334 HydrophobicContact CG1-CB 4.4Å; V270-M334 HydrophobicContact CG1-CG 4.31Å; V270-M334 HydrophobicContact CG1-SD 4.14Å; V270-C337 HydrophobicContact CG2-CB 4.46Å; V270-L338 HydrophobicContact CG2-CB 4.28Å
271	I	98.4	Very high	95.3	Very high	23 Å²	23	20.6 Å²	20.6	12%	0.118	11%	0.109	C	C	.	.	H	α-helix	trans	-62.8	-45	173.7	-69.6	167.2	0	0	0	110.5	I238 V241 A267 I268 R274 S275	I238-I271 HydrophobicContact CG1-CD1 4.01Å; V241-I271 HydrophobicContact CG2-CG1 3.97Å; A267-I271 WeakPolarHBondContact O-CB 3.12Å; A267-I271 WeakPolarHBondContact O-CD1 3.41Å; A267-I271 WeakPolarHBondContact O-CG1 3.4Å; A267-I271 PolarHBondContact O-N 3.24Å; I268-I271 PolarHBondContact O-N 2.96Å; I271-R274 PolarHBondContact O-N 3.35Å; I271-S275 WeakPolarHBondContact O-CB 3.42Å; I271-S275 PolarHBondContact O-N 2.9Å
272	M	98.1	Very high	95.1	Very high	11 Å²	11	28.1 Å²	28.1	5%	0.054	14%	0.142	C	C	.	.	H	α-helix	trans	-63	-43.9	177.1	-72	173.4	175.5	0	0	111.5	I268 E269 S275 L309 L313 F316 Q317 L393 L396 H400	I268-M272 HydrophobicContact CD1-CE 4.35Å; I268-M272 HydrophobicContact CG1-CE 3.74Å; I268-M272 HydrophobicContact CG1-CG 4.48Å; I268-M272 HydrophobicContact CG1-SD 4.34Å; I268-M272 WeakPolarHBondContact O-CB 3.49Å; I268-M272 VanDerWaalsContact O-CG 3.28Å; I268-M272 WeakPolarHBondContact O-CG 3.43Å; I268-M272 PolarHBondContact O-N 2.88Å; E269-M272 PolarHBondContact O-N 3.47Å; M272-S275 PolarHBondContact O-OG 3.45Å; M272-L309 HydrophobicContact CE-CD1 4.23Å; M272-L313 HydrophobicContact CB-CD1 4.21Å; M272-L313 HydrophobicContact CE-CD1 4.42Å; M272-L313 HydrophobicContact CG-CD1 3.83Å; M272-L313 HydrophobicContact SD-CD1 4.08Å; M272-F316 HydrophobicContact CB-CE1 4.43Å; M272-Q317 PolarHBondContact O-NE2 3.2Å; M272-L393 HydrophobicContact CB-CD2 3.84Å; M272-L393 HydrophobicContact SD-CD2 4.19Å; M272-L396 HydrophobicContact CE-CB 4.28Å; M272-L396 HydrophobicContact SD-CB 3.82Å; M272-L396 HydrophobicContact SD-CD1 4.13Å; M272-L396 HydrophobicContact SD-CG 4.43Å; M272-H400 HydrophobicContact CE-CB 4.35Å
273	L	98.2	Very high	94.7	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-56.3	-53.7	172.2	-82	165.3	0	0	0	111.4	E269 V270 S275 N276 F316 L320 H330 L333 M334 C337 L390 L393	E269-L273 PolarHBondContact O-N 2.71Å; V270-L273 PolarHBondContact O-N 2.87Å; L273-S275 VanDerWaalsContact C-N 3.32Å; L273-S275 PolarHBondContact O-N 2.92Å; L273-N276 WeakPolarHBondContact O-CB 3.33Å; L273-N276 PolarHBondContact O-N 2.85Å; L273-N276 VanDerWaalsContact O-N 3.12Å; L273-F316 HydrophobicContact CD2-CZ 3.77Å; L273-F316 HydrophobicContact CG-CZ 4.16Å; L273-L320 HydrophobicContact CD2-CD2 3.84Å; L273-H330 PolarHBondContact O-CE1 3Å; L273-H330 VanDerWaalsContact O-CE1 3.24Å; L273-L333 HydrophobicContact CD2-CD2 3.86Å; L273-L333 HydrophobicContact CD2-CG 4.24Å; L273-M334 HydrophobicContact CB-CG 4.17Å; L273-M334 HydrophobicContact CD1-CG 4.34Å; L273-C337 HydrophobicContact CD1-CB 3.79Å; L273-L390 HydrophobicContact CD1-CD2 4.25Å; L273-L393 HydrophobicContact CD1-CD1 3.6Å; L273-L393 HydrophobicContact CD2-CD1 4.03Å; L273-L393 HydrophobicContact CG-CD1 3.55Å
274	R	97.4	Very high	94.4	Very high	19 Å²	19	30.7 Å²	30.7	7%	0.072	16%	0.155	C	C	.	.	H	α-helix	trans	-63.8	-36.4	-176.3	-172.6	179.6	-66.9	-139.3	-1.8	112.5	T146 Y147 V270 I271 N276 Q277 M334	T146-R274 PolarHBondContact O-NH1 2.93Å; T146-R274 PolarHBondContact OG1-NH1 3.3Å; T146-R274 VanDerWaalsContact OG1-NH1 3.15Å; Y147-R274 HydrophobicContact CD2-CG 3.91Å; Y147-R274 HydrophobicContact CE2-CG 4.11Å; V270-R274 VanDerWaalsContact O-CB 3.26Å; V270-R274 WeakPolarHBondContact O-CB 3.25Å; V270-R274 PolarHBondContact O-N 3.39Å; I271-R274 PolarHBondContact O-N 3.35Å; R274-N276 PolarHBondContact O-N 2.87Å; R274-Q277 WeakPolarHBondContact O-CB 3.25Å; R274-Q277 WeakPolarHBondContact O-CG 3.48Å; R274-Q277 PolarHBondContact O-N 3Å; R274-M334 HydrophobicContact CB-SD 4.18Å
275	S	97	Very high	94.4	Very high	28 Å²	28	27.5 Å²	27.5	20%	0.196	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-60.8	-15.7	177.5	77.1	0	0	0	0	113.3	I271 M272 L273 Q277 S278 F279 W286 Q317	I271-S275 WeakPolarHBondContact O-CB 3.42Å; I271-S275 PolarHBondContact O-N 2.9Å; M272-S275 PolarHBondContact O-OG 3.45Å; L273-S275 VanDerWaalsContact C-N 3.32Å; L273-S275 PolarHBondContact O-N 2.92Å; S275-Q277 PolarHBondContact O-N 2.97Å; S275-S278 PolarHBondContact O-N 3.32Å; S275-S278 PolarHBondContact O-OG 2.83Å; S275-F279 PolarHBondContact O-N 3.49Å; S275-W286 PolarHBondContact O-NE1 2.9Å; S275-W286 PolarHBondContact OG-NE1 3.13Å; S275-Q317 PolarHBondContact OG-NE2 3.33Å
276	N	97.3	Very high	94.8	Very high	12 Å²	12	27.7 Å²	27.7	6%	0.064	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-60.3	-26.1	173.2	-164.1	-110.5	0	0	0	113.1	L273 R274 F279 Q317 L320 K321	L273-N276 WeakPolarHBondContact O-CB 3.33Å; L273-N276 PolarHBondContact O-N 2.85Å; L273-N276 VanDerWaalsContact O-N 3.12Å; R274-N276 PolarHBondContact O-N 2.87Å; N276-F279 PolarHBondContact O-N 2.94Å; N276-Q317 VanDerWaalsContact CB-OE1 3.24Å; N276-Q317 PolarHBondContact ND2-O 2.78Å; N276-Q317 PolarHBondContact ND2-OE1 3.1Å; N276-L320 HydrophobicContact CB-CD2 3.67Å; N276-L320 HydrophobicContact CB-CG 4.3Å; N276-K321 WeakPolarHBondContact O-CE 3.35Å; N276-K321 PolarHBondContact O-NZ 3.44Å; N276-K321 WeakPolarHBondContact OD1-CD 3.36Å
277	Q	95.4	Very high	94.8	Very high	61 Å²	61	29.9 Å²	29.9	29%	0.285	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-64.9	-39.7	179.8	-65.6	-178.3	-56.5	0	0	112	H143 Y147 R274 S275	H143-Q277 PolarHBondContact CE1-NE2 3.49Å; H143-Q277 VanDerWaalsContact CE1-NE2 3.28Å; H143-Q277 PolarHBondContact CE1-OE1 2.87Å; H143-Q277 PolarHBondContact NE2-NE2 2.97Å; H143-Q277 PolarHBondContact NE2-OE1 3.34Å; Y147-Q277 HydrophobicContact CE1-CB 4.46Å; Y147-Q277 HydrophobicContact CE2-CB 4.46Å; Y147-Q277 VanDerWaalsContact CE2-OE1 3.24Å; Y147-Q277 WeakPolarHBondContact OH-CB 3.32Å; R274-Q277 WeakPolarHBondContact O-CB 3.25Å; R274-Q277 WeakPolarHBondContact O-CG 3.48Å; R274-Q277 PolarHBondContact O-N 3Å; S275-Q277 PolarHBondContact O-N 2.97Å
278	S	95.7	Very high	94.7	Very high	16 Å²	16	30.2 Å²	30.2	11%	0.112	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-5.2	174.7	43.5	0	0	0	0	115.3	Y151 S275 W286 S287	Y151-S278 VanDerWaalsContact OH-CB 3.24Å; Y151-S278 WeakPolarHBondContact OH-CB 3.29Å; S275-S278 PolarHBondContact O-N 3.32Å; S275-S278 PolarHBondContact O-OG 2.83Å; S278-W286 WeakPolarHBondContact O-CA 3.21Å; S278-S287 VanDerWaalsContact CB-O 3.26Å; S278-S287 WeakPolarHBondContact CB-O 3.34Å; S278-S287 PolarHBondContact O-N 3.38Å
279	F	96.7	Very high	94.3	Very high	5 Å²	5	32.1 Å²	32.1	2%	0.022	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-72.9	128.5	-178.5	-172.7	-106.1	0	0	0	112	S275 N276 L281 M284 S285 W286 V314 Q317 V318 K321	S275-F279 PolarHBondContact O-N 3.49Å; N276-F279 PolarHBondContact O-N 2.94Å; F279-L281 HydrophobicContact CD1-CD2 4.4Å; F279-L281 HydrophobicContact CE1-CD2 4Å; F279-M284 HydrophobicContact CE1-SD 4.08Å; F279-M284 HydrophobicContact CE2-CB 4.45Å; F279-M284 HydrophobicContact CZ-CB 4.16Å; F279-M284 HydrophobicContact CZ-SD 3.69Å; F279-S285 CarbonylContact C-O 3.51Å; F279-S285 WeakPolarHBondContact CA-O 3.42Å; F279-W286 AromaticContact CD2-CD2 3.84Å; F279-W286 HydrophobicContact CD2-CD2 3.84Å; F279-W286 AromaticContact CD2-CE2 3.53Å; F279-W286 HydrophobicContact CD2-CE3 4.26Å; F279-W286 HydrophobicContact CD2-CG 4.34Å; F279-W286 HydrophobicContact CD2-CH2 4.14Å; F279-W286 AromaticContact CD2-CZ2 3.73Å; F279-W286 HydrophobicContact CD2-CZ2 3.73Å; F279-W286 HydrophobicContact CD2-CZ3 4.39Å; F279-W286 AromaticContact CD2-NE1 3.83Å; F279-W286 HydrophobicContact CE2-CD2 4.46Å; F279-W286 HydrophobicContact CE2-CE3 4.47Å; F279-W286 AromaticContact CE2-CH2 3.95Å; F279-W286 HydrophobicContact CE2-CH2 3.95Å; F279-W286 AromaticContact CE2-CZ2 3.96Å; F279-W286 HydrophobicContact CE2-CZ2 3.96Å; F279-W286 HydrophobicContact CE2-CZ3 4.2Å; F279-V314 HydrophobicContact CZ-CG1 4.35Å; F279-Q317 HydrophobicContact CD1-CB 3.55Å; F279-Q317 HydrophobicContact CD1-CG 4.4Å; F279-Q317 HydrophobicContact CD2-CB 4Å; F279-Q317 HydrophobicContact CD2-CG 4.04Å; F279-Q317 HydrophobicContact CE1-CB 3.57Å; F279-Q317 HydrophobicContact CE2-CB 4.03Å; F279-Q317 HydrophobicContact CE2-CG 4.26Å; F279-Q317 HydrophobicContact CG-CB 3.75Å; F279-Q317 HydrophobicContact CG-CG 4.1Å; F279-Q317 HydrophobicContact CZ-CB 3.81Å; F279-V318 HydrophobicContact CE1-CG2 3.91Å; F279-V318 HydrophobicContact CZ-CG2 4.26Å; F279-K321 HydrophobicContact CD1-CG 4.31Å; F279-K321 WeakPolarHBondContact O-CE 3.33Å; F279-K321 PolarHBondContact O-NZ 3.13Å
280	N	92.6	Very high	93.7	Very high	53 Å²	53	33.7 Å²	33.7	28%	0.283	20%	0.196	S	C	.	.			trans	-104.5	130.5	177.9	-170.3	-33.4	0	0	0	110.7	E282 M284 S285	N280-E282 VanDerWaalsContact OD1-CB 3.31Å; N280-E282 WeakPolarHBondContact OD1-CB 3.46Å; N280-E282 PolarHBondContact OD1-N 3.26Å; N280-M284 VanDerWaalsContact O-CA 3.23Å; N280-M284 WeakPolarHBondContact O-CA 3.28Å; N280-M284 PolarHBondContact O-N 3.42Å; N280-M284 VanDerWaalsContact O-N 3.09Å; N280-S285 PolarHBondContact N-O 2.94Å
281	L	91.4	Very high	93	Very high	70 Å²	70	39.2 Å²	39.2	37%	0.366	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-18.6	-179.8	-70.2	176.2	0	0	0	114.1	F279 M284 V318 K321	F279-L281 HydrophobicContact CD1-CD2 4.4Å; F279-L281 HydrophobicContact CE1-CD2 4Å; L281-M284 WeakPolarHBondContact O-CE 3.29Å; L281-V318 HydrophobicContact CD2-CB 4.28Å; L281-V318 HydrophobicContact CD2-CG1 4.25Å; L281-V318 HydrophobicContact CD2-CG2 3.94Å; L281-K321 HydrophobicContact CD1-CB 4.02Å; L281-K321 HydrophobicContact CD1-CG 4.42Å; L281-K321 HydrophobicContact CD2-CB 4.05Å; L281-K321 HydrophobicContact CD2-CG 4.18Å; L281-K321 HydrophobicContact CG-CB 4.24Å; L281-K321 HydrophobicContact CG-CG 4.2Å
282	E	87.9	Confident	92.4	Very high	169 Å²	169	43.2 Å²	43.2	79%	0.79	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-45	-177	-64.2	179.9	168.6	0	0	111.1	N280	N280-E282 VanDerWaalsContact OD1-CB 3.31Å; N280-E282 WeakPolarHBondContact OD1-CB 3.46Å; N280-E282 PolarHBondContact OD1-N 3.26Å
283	D	86.6	Confident	92.2	Very high	47 Å²	47	44.4 Å²	44.4	25%	0.251	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.2	7.4	-174.1	65.9	6.2	0	0	0	113.9	S285 K294	D283-S285 PolarHBondContact O-N 3.49Å; D283-S285 VanDerWaalsContact OD1-CB 3.29Å; D283-S285 WeakPolarHBondContact OD1-CB 3.35Å; D283-S285 PolarHBondContact OD1-N 2.96Å; D283-S285 VanDerWaalsContact OD1-N 3.17Å; D283-S285 PolarHBondContact OD1-OG 3.1Å; D283-S285 PolarHBondContact OD2-OG 3.34Å; D283-K294 WeakPolarHBondContact OD2-CE 3.38Å; D283-K294 IonicContact OD2-NZ 3.98Å; D283-K294 PolarHBondContact OD2-NZ 3.11Å
284	M	88.3	Confident	92	Very high	32 Å²	32	48 Å²	48	16%	0.158	28%	0.275	C	S	.	.	S	Bend	trans	54.3	37.7	178.3	-54.1	-62.4	166.9	0	0	113	L203 F279 N280 L281 V314 V318	L203-M284 HydrophobicContact CD2-CG 4.35Å; F279-M284 HydrophobicContact CE1-SD 4.08Å; F279-M284 HydrophobicContact CE2-CB 4.45Å; F279-M284 HydrophobicContact CZ-CB 4.16Å; F279-M284 HydrophobicContact CZ-SD 3.69Å; N280-M284 VanDerWaalsContact O-CA 3.23Å; N280-M284 WeakPolarHBondContact O-CA 3.28Å; N280-M284 PolarHBondContact O-N 3.42Å; N280-M284 VanDerWaalsContact O-N 3.09Å; L281-M284 WeakPolarHBondContact O-CE 3.29Å; M284-V314 HydrophobicContact SD-CG1 4.26Å; M284-V318 HydrophobicContact CE-CG2 4.17Å; M284-V318 HydrophobicContact SD-CG2 3.72Å
285	S	92.8	Very high	91.9	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.273	C	S	.	.			trans	-114.5	163.4	-179.5	75.1	0	0	0	0	112.7	F279 N280 D283 K294 Y295	F279-S285 CarbonylContact C-O 3.51Å; F279-S285 WeakPolarHBondContact CA-O 3.42Å; N280-S285 PolarHBondContact N-O 2.94Å; D283-S285 PolarHBondContact O-N 3.49Å; D283-S285 VanDerWaalsContact OD1-CB 3.29Å; D283-S285 WeakPolarHBondContact OD1-CB 3.35Å; D283-S285 PolarHBondContact OD1-N 2.96Å; D283-S285 VanDerWaalsContact OD1-N 3.17Å; D283-S285 PolarHBondContact OD1-OG 3.1Å; D283-S285 PolarHBondContact OD2-OG 3.34Å; S285-K294 WeakPolarHBondContact OG-CE 3.26Å; S285-Y295 CarbonylContact C-O 3.54Å; S285-Y295 VanDerWaalsContact CA-O 3.29Å; S285-Y295 WeakPolarHBondContact CA-O 3.14Å; S285-Y295 VanDerWaalsContact CB-O 3.3Å; S285-Y295 WeakPolarHBondContact CB-O 3.45Å
286	W	96	Very high	91.6	Very high	21 Å²	21	49 Å²	49	8%	0.08	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	121.4	169.7	-67.1	-101.1	0	0	0	109.3	S275 S278 F279 K294 Y295 I297 L313 V314 Q317	S275-W286 PolarHBondContact O-NE1 2.9Å; S275-W286 PolarHBondContact OG-NE1 3.13Å; S278-W286 WeakPolarHBondContact O-CA 3.21Å; F279-W286 AromaticContact CD2-CD2 3.84Å; F279-W286 HydrophobicContact CD2-CD2 3.84Å; F279-W286 AromaticContact CD2-CE2 3.53Å; F279-W286 HydrophobicContact CD2-CE3 4.26Å; F279-W286 HydrophobicContact CD2-CG 4.34Å; F279-W286 HydrophobicContact CD2-CH2 4.14Å; F279-W286 AromaticContact CD2-CZ2 3.73Å; F279-W286 HydrophobicContact CD2-CZ2 3.73Å; F279-W286 HydrophobicContact CD2-CZ3 4.39Å; F279-W286 AromaticContact CD2-NE1 3.83Å; F279-W286 HydrophobicContact CE2-CD2 4.46Å; F279-W286 HydrophobicContact CE2-CE3 4.47Å; F279-W286 AromaticContact CE2-CH2 3.95Å; F279-W286 HydrophobicContact CE2-CH2 3.95Å; F279-W286 AromaticContact CE2-CZ2 3.96Å; F279-W286 HydrophobicContact CE2-CZ2 3.96Å; F279-W286 HydrophobicContact CE2-CZ3 4.2Å; W286-K294 CarbonylContact O-C 3.54Å; W286-K294 WeakPolarHBondContact O-CA 3.37Å; W286-Y295 HydrophobicContact CB-CD2 4.35Å; W286-Y295 PolarHBondContact N-O 2.78Å; W286-Y295 PolarHBondContact O-N 3.21Å; W286-I297 HydrophobicContact CH2-CD1 4.02Å; W286-I297 HydrophobicContact CZ3-CD1 3.81Å; W286-L313 HydrophobicContact CH2-CD2 4.38Å; W286-L313 HydrophobicContact CZ2-CD2 4.35Å; W286-L313 HydrophobicContact CZ2-CG 4.4Å; W286-V314 HydrophobicContact CH2-CG2 4.44Å; W286-Q317 HydrophobicContact CZ2-CG 3.74Å
287	S	94.6	Very high	91.2	Very high	46 Å²	46	49 Å²	49	32%	0.322	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	109.2	179	-62.7	0	0	0	0	110.3	S278	S278-S287 VanDerWaalsContact CB-O 3.26Å; S278-S287 WeakPolarHBondContact CB-O 3.34Å; S278-S287 PolarHBondContact O-N 3.38Å
288	C	93.3	Very high	90.7	Very high	8 Å²	8	46.6 Å²	46.6	5%	0.054	27%	0.266	C	S	.	.			trans	-114.2	64.8	-175.4	-60	0	0	0	0	111.3	Y151 F154 F293 Y295	Y151-C288 VanDerWaalsContact CB-O 3.3Å; Y151-C288 WeakPolarHBondContact CB-O 3.15Å; Y151-C288 HydrophobicContact CD1-CB 3.63Å; Y151-C288 VanDerWaalsContact CD2-CA 3.41Å; Y151-C288 HydrophobicContact CD2-CB 4.06Å; Y151-C288 HydrophobicContact CE1-CB 3.8Å; Y151-C288 HydrophobicContact CE2-CB 4.2Å; Y151-C288 VanDerWaalsContact CG-C 3.41Å; Y151-C288 HydrophobicContact CG-CB 3.74Å; F154-C288 HydrophobicContact CD2-CB 3.82Å; F154-C288 HydrophobicContact CE2-CB 3.41Å; F154-C288 VanDerWaalsContact CE2-CB 3.41Å; F154-C288 HydrophobicContact CZ-CB 4.09Å; C288-F293 HydrophobicContact CB-CB 4.23Å; C288-F293 WeakPolarHBondContact CB-O 3.44Å; C288-F293 PolarHBondContact N-O 2.84Å; C288-F293 WeakPolarHBondContact O-CB 3.45Å; C288-Y295 HydrophobicContact CB-CE2 4.01Å
289	G	87.4	Confident	90.6	Very high	51 Å²	51	45.9 Å²	45.9	53%	0.526	26%	0.261	S	S	.	.	S	Bend	trans	93.1	-118.8	-179.8	0	0	0	0	0	112.6	Y151	Y151-G289 VanDerWaalsContact CD2-N 3.27Å
290	G	83.8	Confident	90.4	Very high	36 Å²	36	46.8 Å²	46.8	37%	0.371	27%	0.267	S	S	.	.	S	Bend	trans	-69.3	166.8	-176.3	0	0	0	0	0	114.5	D292 F293	G290-D292 PolarHBondContact O-N 2.62Å; G290-D292 VanDerWaalsContact O-N 3.17Å; G290-F293 PolarHBondContact O-N 3.36Å
291	P	84.1	Confident	90.2	Very high	116 Å²	116	44.3 Å²	44.3	75%	0.753	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-59.8	-29.8	-176	24.6	-34.3	0	0	0	113.6	F293 K294	P291-F293 PolarHBondContact O-N 2.93Å; P291-K294 WeakPolarHBondContact O-CB 3.45Å; P291-K294 PolarHBondContact O-N 3.48Å
292	D	86.9	Confident	90.2	Very high	107 Å²	107	42.7 Å²	42.7	57%	0.572	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-67.5	-23.8	177.9	-63.8	-36	0	0	0	112.9	R162 G290	R162-D292 PolarHBondContact NH1-O 3.33Å; R162-D292 PolarHBondContact NH2-O 2.95Å; G290-D292 PolarHBondContact O-N 2.62Å; G290-D292 VanDerWaalsContact O-N 3.17Å
293	F	93.1	Very high	90.4	Very high	35 Å²	35	34.7 Å²	34.7	15%	0.154	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-104.7	33.3	-179.2	-55.4	-61.7	0	0	0	112	F154 C288 G290 P291 Y295	F154-F293 HydrophobicContact CB-CD1 4.07Å; F154-F293 HydrophobicContact CB-CD2 4.13Å; F154-F293 HydrophobicContact CB-CE1 4.06Å; F154-F293 HydrophobicContact CB-CE2 4.13Å; F154-F293 HydrophobicContact CB-CG 4.1Å; F154-F293 HydrophobicContact CB-CZ 4.1Å; F154-F293 HydrophobicContact CD2-CB 4.18Å; F154-F293 HydrophobicContact CD2-CD1 4.1Å; F154-F293 HydrophobicContact CD2-CG 4.14Å; F154-F293 WeakPolarHBondContact O-CZ 3.46Å; C288-F293 HydrophobicContact CB-CB 4.23Å; C288-F293 WeakPolarHBondContact CB-O 3.44Å; C288-F293 PolarHBondContact N-O 2.84Å; C288-F293 WeakPolarHBondContact O-CB 3.45Å; G290-F293 PolarHBondContact O-N 3.36Å; P291-F293 PolarHBondContact O-N 2.93Å; F293-Y295 HydrophobicContact CB-CE2 4.29Å; F293-Y295 WeakPolarHBondContact CD1-OH 3.18Å; F293-Y295 VanDerWaalsContact O-CE2 3.24Å; F293-Y295 WeakPolarHBondContact O-CE2 3.31Å
294	K	94.1	Very high	90.6	Very high	77 Å²	77	33 Å²	33	34%	0.335	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	122.3	165.6	-172.4	174.8	-177	177	0	109.5	R162 D283 S285 W286 P291	R162-K294 PolarHBondContact NH2-O 2.93Å; D283-K294 WeakPolarHBondContact OD2-CE 3.38Å; D283-K294 IonicContact OD2-NZ 3.98Å; D283-K294 PolarHBondContact OD2-NZ 3.11Å; S285-K294 WeakPolarHBondContact OG-CE 3.26Å; W286-K294 CarbonylContact O-C 3.54Å; W286-K294 WeakPolarHBondContact O-CA 3.37Å; P291-K294 WeakPolarHBondContact O-CB 3.45Å; P291-K294 PolarHBondContact O-N 3.48Å
295	Y	94.4	Very high	90.8	Very high	12 Å²	12	32.9 Å²	32.9	5%	0.047	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	124.5	-174.4	-52.7	-77.2	0	0	0	111.3	F154 H229 L230 L233 S285 W286 C288 F293 D299	F154-Y295 HydrophobicContact CE2-CE2 4.15Å; H229-Y295 AromaticContact CD2-CE1 3.81Å; H229-Y295 AromaticContact NE2-CE1 3.24Å; H229-Y295 WeakPolarHBondContact NE2-CE1 3.42Å; H229-Y295 AromaticContact NE2-CZ 3.49Å; H229-Y295 PolarHBondContact NE2-OH 3.13Å; L230-Y295 HydrophobicContact CD2-CD1 4.34Å; L230-Y295 HydrophobicContact CD2-CE1 4.37Å; L233-Y295 HydrophobicContact CD1-CE1 3.94Å; L233-Y295 HydrophobicContact CD1-CE2 4.02Å; L233-Y295 WeakPolarHBondContact CD1-OH 3.42Å; S285-Y295 CarbonylContact C-O 3.54Å; S285-Y295 VanDerWaalsContact CA-O 3.29Å; S285-Y295 WeakPolarHBondContact CA-O 3.14Å; S285-Y295 VanDerWaalsContact CB-O 3.3Å; S285-Y295 WeakPolarHBondContact CB-O 3.45Å; W286-Y295 HydrophobicContact CB-CD2 4.35Å; W286-Y295 PolarHBondContact N-O 2.78Å; W286-Y295 PolarHBondContact O-N 3.21Å; C288-Y295 HydrophobicContact CB-CE2 4.01Å; F293-Y295 HydrophobicContact CB-CE2 4.29Å; F293-Y295 WeakPolarHBondContact CD1-OH 3.18Å; F293-Y295 VanDerWaalsContact O-CE2 3.24Å; F293-Y295 WeakPolarHBondContact O-CE2 3.31Å; Y295-D299 WeakPolarHBondContact CA-OD2 3.25Å
296	Q	90.9	Very high	90.7	Very high	55 Å²	55	35.1 Å²	35.1	26%	0.257	21%	0.213	S	C	.	.			trans	-100.9	167.7	172.8	-66.5	178.2	-33.2	0	0	110.7	H177 S298 D299 V300	H177-Q296 PolarHBondContact CE1-NE2 3.34Å; H177-Q296 PolarHBondContact NE2-NE2 2.81Å; Q296-S298 PolarHBondContact O-N 2.87Å; Q296-D299 PolarHBondContact N-OD2 2.99Å; Q296-D299 WeakPolarHBondContact O-CB 3.23Å; Q296-D299 PolarHBondContact O-N 3.39Å; Q296-V300 PolarHBondContact O-N 3.32Å
297	I	89.3	Confident	90.4	Very high	13 Å²	13	35.1 Å²	35.1	7%	0.067	21%	0.214	C	C	.	.	H	α-helix	trans	-55.1	-37.8	174.3	-59.8	-59.1	0	0	0	111.4	A173 W286 D299 V300 T301 L307 L310 V314	A173-I297 HydrophobicContact CB-CG2 4.45Å; W286-I297 HydrophobicContact CH2-CD1 4.02Å; W286-I297 HydrophobicContact CZ3-CD1 3.81Å; I297-D299 VanDerWaalsContact C-N 3.26Å; I297-D299 PolarHBondContact O-N 2.96Å; I297-V300 PolarHBondContact O-N 3.04Å; I297-T301 WeakPolarHBondContact O-CG2 3.45Å; I297-T301 PolarHBondContact O-N 3.35Å; I297-L307 HydrophobicContact CG2-CD2 4.17Å; I297-L310 HydrophobicContact CG2-CB 4.14Å; I297-L310 HydrophobicContact CG2-CD1 3.81Å; I297-V314 HydrophobicContact CD1-CG2 3.3Å; I297-V314 HydrophobicContact CG1-CG2 4.11Å
298	S	85.9	Confident	90.3	Very high	9 Å²	9	38.7 Å²	38.7	6%	0.063	23%	0.226	C	C	.	.	H	α-helix	trans	-58.4	-35.8	175.2	54.3	0	0	0	0	113.1	Q296 T301 K302	Q296-S298 PolarHBondContact O-N 2.87Å; S298-T301 WeakPolarHBondContact CA-OG1 3.35Å; S298-T301 PolarHBondContact O-N 2.93Å; S298-T301 PolarHBondContact O-OG1 3.47Å; S298-K302 WeakPolarHBondContact O-CG 3.21Å; S298-K302 PolarHBondContact O-N 3.25Å
299	D	91.8	Very high	90.3	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.011	23%	0.225	C	C	.	.	H	α-helix	trans	-67.5	-39.1	179.5	-64.9	-37.2	0	0	0	111.2	R162 M226 Y295 Q296 I297 K302 A303	R162-D299 WeakPolarHBondContact CD-OD1 3.23Å; R162-D299 WeakPolarHBondContact CG-OD1 3.46Å; R162-D299 IonicContact NE-OD1 3.17Å; R162-D299 PolarHBondContact NE-OD1 3.15Å; R162-D299 IonicContact NE-OD2 3.11Å; R162-D299 PolarHBondContact NE-OD2 2.91Å; R162-D299 IonicContact NH2-OD2 2.61Å; M226-D299 WeakPolarHBondContact CB-O 3.45Å; M226-D299 HydrophobicContact CE-CB 4.15Å; Y295-D299 WeakPolarHBondContact CA-OD2 3.25Å; Q296-D299 PolarHBondContact N-OD2 2.99Å; Q296-D299 WeakPolarHBondContact O-CB 3.23Å; Q296-D299 PolarHBondContact O-N 3.39Å; I297-D299 VanDerWaalsContact C-N 3.26Å; I297-D299 PolarHBondContact O-N 2.96Å; D299-K302 PolarHBondContact O-N 3.32Å; D299-A303 PolarHBondContact O-N 3.39Å
300	V	92.4	Very high	90.6	Very high	23 Å²	23	36.3 Å²	36.3	14%	0.139	20%	0.2	C	C	.	.	H	α-helix	trans	-71.7	-33.7	177.2	-162	0	0	0	0	111.2	L230 Q296 I297 K302 A303 H305 L310	L230-V300 HydrophobicContact CD1-CB 4.42Å; L230-V300 HydrophobicContact CD1-CG1 4.19Å; L230-V300 HydrophobicContact CD1-CG2 4.43Å; Q296-V300 PolarHBondContact O-N 3.32Å; I297-V300 PolarHBondContact O-N 3.04Å; V300-K302 VanDerWaalsContact C-N 3.32Å; V300-K302 PolarHBondContact O-N 3.21Å; V300-A303 WeakPolarHBondContact O-CB 3.48Å; V300-A303 PolarHBondContact O-N 3.13Å; V300-A303 VanDerWaalsContact O-N 3.13Å; V300-H305 HydrophobicContact CG1-CB 4.06Å; V300-H305 PolarHBondContact O-N 3.06Å; V300-L310 HydrophobicContact CB-CD1 4.11Å; V300-L310 HydrophobicContact CB-CD2 3.85Å; V300-L310 HydrophobicContact CG1-CD1 4.43Å; V300-L310 HydrophobicContact CG1-CD2 3.57Å; V300-L310 HydrophobicContact CG2-CD2 4.5Å
301	T	90.1	Very high	90.9	Very high	1 Å²	1	37 Å²	37	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-66.5	-32	171.9	62.9	0	0	0	0	113.6	A170 I297 S298 A303 G304 H305 L310	A170-T301 VanDerWaalsContact CA-OG1 3.31Å; A170-T301 WeakPolarHBondContact CA-OG1 3.38Å; A170-T301 WeakPolarHBondContact CB-OG1 3.29Å; I297-T301 WeakPolarHBondContact O-CG2 3.45Å; I297-T301 PolarHBondContact O-N 3.35Å; S298-T301 WeakPolarHBondContact CA-OG1 3.35Å; S298-T301 PolarHBondContact O-N 2.93Å; S298-T301 PolarHBondContact O-OG1 3.47Å; T301-A303 PolarHBondContact O-N 3.43Å; T301-G304 PolarHBondContact O-N 3.19Å; T301-G304 VanDerWaalsContact O-N 3.07Å; T301-H305 VanDerWaalsContact CA-O 3.29Å; T301-H305 WeakPolarHBondContact CA-O 3.38Å; T301-L310 HydrophobicContact CG2-CD1 3.45Å; T301-L310 VanDerWaalsContact CG2-CD1 3.45Å
302	K	90.3	Very high	91.5	Very high	36 Å²	36	34.1 Å²	34.1	16%	0.157	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-9	173.9	-71.5	171.1	-172.8	173.9	0	113	R162 A170 F224 S225 M226 S298 D299 V300	R162-K302 PolarHBondContact O-NZ 2.71Å; A170-K302 HydrophobicContact CB-CG 4.38Å; F224-K302 CarbonylContact C-O 3.17Å; F224-K302 VanDerWaalsContact CA-O 3.22Å; F224-K302 WeakPolarHBondContact CA-O 3.38Å; F224-K302 WeakPolarHBondContact CB-O 3.42Å; S225-K302 PolarHBondContact N-O 2.84Å; M226-K302 HydrophobicContact CB-CB 3.88Å; M226-K302 HydrophobicContact CG-CB 3.63Å; M226-K302 HydrophobicContact CG-CD 4.31Å; M226-K302 PolarHBondContact N-O 3.31Å; S298-K302 WeakPolarHBondContact O-CG 3.21Å; S298-K302 PolarHBondContact O-N 3.25Å; D299-K302 PolarHBondContact O-N 3.32Å; V300-K302 VanDerWaalsContact C-N 3.32Å; V300-K302 PolarHBondContact O-N 3.21Å
303	A	92.4	Very high	91.9	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.008	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	4	169.6	0	0	0	0	0	112.9	M226 L227 L230 D299 V300 T301	M226-A303 HydrophobicContact CB-CB 4.06Å; L227-A303 HydrophobicContact CB-CB 4.38Å; L230-A303 HydrophobicContact CB-CB 4.33Å; L230-A303 HydrophobicContact CD1-CB 3.43Å; L230-A303 VanDerWaalsContact CD1-CB 3.43Å; L230-A303 HydrophobicContact CG-CB 4.11Å; D299-A303 PolarHBondContact O-N 3.39Å; V300-A303 WeakPolarHBondContact O-CB 3.48Å; V300-A303 PolarHBondContact O-N 3.13Å; V300-A303 VanDerWaalsContact O-N 3.13Å; T301-A303 PolarHBondContact O-N 3.43Å
304	G	90.9	Very high	92	Very high	12 Å²	12	28.6 Å²	28.6	12%	0.124	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	97.2	4.1	174.4	0	0	0	0	0	115.6	F224 T301	F224-G304 VanDerWaalsContact CE1-CA 3.4Å; T301-G304 PolarHBondContact O-N 3.19Å; T301-G304 VanDerWaalsContact O-N 3.07Å
305	H	92.1	Very high	92.1	Very high	30 Å²	30	28.7 Å²	28.7	14%	0.139	15%	0.148	C	C	.	.			trans	-83.7	145.3	172.9	-66.5	-68	0	0	0	112.4	V300 T301 L309 L310 Q403	V300-H305 HydrophobicContact CG1-CB 4.06Å; V300-H305 PolarHBondContact O-N 3.06Å; T301-H305 VanDerWaalsContact CA-O 3.29Å; T301-H305 WeakPolarHBondContact CA-O 3.38Å; H305-L309 HydrophobicContact CB-CD2 4.38Å; H305-L310 HydrophobicContact CB-CD1 4.46Å; H305-L310 HydrophobicContact CB-CD2 4.47Å; H305-Q403 VanDerWaalsContact CA-OE1 3.25Å; H305-Q403 PolarHBondContact ND1-OE1 3.08Å
306	T	91.5	Very high	92.3	Very high	47 Å²	47	28.3 Å²	28.3	29%	0.288	15%	0.146	S	C	.	.			trans	-102.7	168.7	-178.4	79.8	0	0	0	0	111.8	E308 L309 L310 Q403	T306-E308 PolarHBondContact O-N 3.28Å; T306-E308 PolarHBondContact OG1-N 2.88Å; T306-L309 PolarHBondContact O-N 3.03Å; T306-L309 VanDerWaalsContact O-N 3.14Å; T306-L310 WeakPolarHBondContact O-CG 3.48Å; T306-L310 PolarHBondContact O-N 3.41Å; T306-Q403 PolarHBondContact OG1-NE2 3.26Å
307	L	88.2	Confident	92.6	Very high	21 Å²	21	25.7 Å²	25.7	11%	0.11	13%	0.134	C	C	.	.	H	α-helix	trans	-63.2	-19.9	176.8	-62.6	179	0	0	0	113.3	R172 Y207 I297 L309 L310 E311	R172-L307 HydrophobicContact CB-CD1 4.46Å; Y207-L307 HydrophobicContact CD1-CD1 4.3Å; Y207-L307 HydrophobicContact CE1-CD2 4.46Å; I297-L307 HydrophobicContact CG2-CD2 4.17Å; L307-L309 PolarHBondContact O-N 2.72Å; L307-L310 PolarHBondContact O-N 3.07Å; L307-E311 HydrophobicContact CB-CG 4.39Å; L307-E311 WeakPolarHBondContact O-CB 3.48Å; L307-E311 PolarHBondContact O-N 3.02Å
308	E	92.8	Very high	92.9	Very high	121 Å²	121	25.5 Å²	25.5	57%	0.565	13%	0.134	S	C	*	.	H	α-helix	trans	-58.5	-33.5	173.8	-63.4	-175.8	176.3	0	0	111.8	T306 P312 E399 K402	T306-E308 PolarHBondContact O-N 3.28Å; T306-E308 PolarHBondContact OG1-N 2.88Å; E308-P312 WeakPolarHBondContact O-CD 3.21Å; E308-P312 VanDerWaalsContact O-CG 3.32Å; E308-P312 WeakPolarHBondContact O-CG 3.3Å; E308-E399 HydrophobicContact CB-CG 4.36Å; E308-K402 IonicContact OE2-NZ 2.89Å; E308-K402 PolarHBondContact OE2-NZ 3.39Å
309	L	94.9	Very high	93.4	Very high	6 Å²	6	25.8 Å²	25.8	3%	0.031	14%	0.138	C	C	.	.	H	α-helix	trans	-89.1	-44.3	174.2	178.7	61.6	0	0	0	111.8	M272 H305 T306 L307 P312 L313 L396 E399 H400	M272-L309 HydrophobicContact CE-CD1 4.23Å; H305-L309 HydrophobicContact CB-CD2 4.38Å; T306-L309 PolarHBondContact O-N 3.03Å; T306-L309 VanDerWaalsContact O-N 3.14Å; L307-L309 PolarHBondContact O-N 2.72Å; L309-P312 WeakPolarHBondContact O-CD 3.42Å; L309-L313 WeakPolarHBondContact O-CB 3.31Å; L309-L313 PolarHBondContact O-N 3.42Å; L309-L313 VanDerWaalsContact O-N 3.08Å; L309-L396 HydrophobicContact CD1-CD2 4.01Å; L309-E399 HydrophobicContact CB-CG 4Å; L309-E399 HydrophobicContact CD1-CB 4.22Å; L309-E399 HydrophobicContact CD1-CG 4.27Å; L309-H400 HydrophobicContact CD1-CB 4.08Å; L309-H400 HydrophobicContact CD2-CB 4.25Å
310	L	93.1	Very high	93.7	Very high	2 Å²	2	25.8 Å²	25.8	1%	0.01	14%	0.138	C	C	.	.	H	α-helix	trans	-73.6	-34.9	-167.7	-60	174.3	0	0	0	112.9	I297 V300 T301 H305 T306 L307 L313 V314	I297-L310 HydrophobicContact CG2-CB 4.14Å; I297-L310 HydrophobicContact CG2-CD1 3.81Å; V300-L310 HydrophobicContact CB-CD1 4.11Å; V300-L310 HydrophobicContact CB-CD2 3.85Å; V300-L310 HydrophobicContact CG1-CD1 4.43Å; V300-L310 HydrophobicContact CG1-CD2 3.57Å; V300-L310 HydrophobicContact CG2-CD2 4.5Å; T301-L310 HydrophobicContact CG2-CD1 3.45Å; T301-L310 VanDerWaalsContact CG2-CD1 3.45Å; H305-L310 HydrophobicContact CB-CD1 4.46Å; H305-L310 HydrophobicContact CB-CD2 4.47Å; T306-L310 WeakPolarHBondContact O-CG 3.48Å; T306-L310 PolarHBondContact O-N 3.41Å; L307-L310 PolarHBondContact O-N 3.07Å; L310-L313 HydrophobicContact CD2-CD2 4.32Å; L310-L313 PolarHBondContact O-N 3.48Å; L310-V314 WeakPolarHBondContact O-CG2 3.45Å; L310-V314 PolarHBondContact O-N 3.36Å
311	E	90.3	Very high	93.9	Very high	52 Å²	52	27.8 Å²	27.8	24%	0.243	15%	0.145	C	C	.	.	H	α-helix	trans	-64.4	-50.9	176.6	-78.3	-178.5	-156.6	0	0	112.3	L307 L313 V314 K315	L307-E311 HydrophobicContact CB-CG 4.39Å; L307-E311 WeakPolarHBondContact O-CB 3.48Å; L307-E311 PolarHBondContact O-N 3.02Å; E311-L313 VanDerWaalsContact C-N 3.26Å; E311-L313 PolarHBondContact O-N 3.47Å; E311-V314 PolarHBondContact O-N 3.28Å; E311-K315 VanDerWaalsContact O-CG 3.27Å; E311-K315 WeakPolarHBondContact O-CG 3.5Å; E311-K315 PolarHBondContact O-N 3.41Å; E311-K315 IonicContact OE2-NZ 3.48Å
312	P	95.6	Very high	94.1	Very high	55 Å²	55	33.5 Å²	33.5	36%	0.357	17%	0.17	S	C	.	.	H	α-helix	trans	-58.6	-36.3	171.2	-26.1	35.9	0	0	0	113	E308 L309 K315 F316 L396	E308-P312 WeakPolarHBondContact O-CD 3.21Å; E308-P312 VanDerWaalsContact O-CG 3.32Å; E308-P312 WeakPolarHBondContact O-CG 3.3Å; L309-P312 WeakPolarHBondContact O-CD 3.42Å; P312-K315 WeakPolarHBondContact O-CB 3.45Å; P312-K315 PolarHBondContact O-N 3.37Å; P312-F316 WeakPolarHBondContact O-CB 3.25Å; P312-F316 PolarHBondContact O-N 2.92Å; P312-L396 HydrophobicContact CB-CD2 3.76Å; P312-L396 HydrophobicContact CB-CG 4.49Å
313	L	96.8	Very high	94.3	Very high	18 Å²	18	33.1 Å²	33.1	9%	0.094	17%	0.17	C	C	.	.	H	α-helix	trans	-64.6	-46.9	-179.9	177.6	60.3	0	0	0	111.2	M272 W286 L309 L310 E311 K315 F316 Q317 L396	M272-L313 HydrophobicContact CB-CD1 4.21Å; M272-L313 HydrophobicContact CE-CD1 4.42Å; M272-L313 HydrophobicContact CG-CD1 3.83Å; M272-L313 HydrophobicContact SD-CD1 4.08Å; W286-L313 HydrophobicContact CH2-CD2 4.38Å; W286-L313 HydrophobicContact CZ2-CD2 4.35Å; W286-L313 HydrophobicContact CZ2-CG 4.4Å; L309-L313 WeakPolarHBondContact O-CB 3.31Å; L309-L313 PolarHBondContact O-N 3.42Å; L309-L313 VanDerWaalsContact O-N 3.08Å; L310-L313 HydrophobicContact CD2-CD2 4.32Å; L310-L313 PolarHBondContact O-N 3.48Å; E311-L313 VanDerWaalsContact C-N 3.26Å; E311-L313 PolarHBondContact O-N 3.47Å; L313-K315 VanDerWaalsContact C-N 3.34Å; L313-K315 PolarHBondContact O-N 3.37Å; L313-F316 HydrophobicContact CD1-CD1 4.49Å; L313-F316 WeakPolarHBondContact O-CB 3.44Å; L313-F316 PolarHBondContact O-N 3.18Å; L313-Q317 HydrophobicContact CD1-CG 4.47Å; L313-Q317 WeakPolarHBondContact O-CG 3.35Å; L313-Q317 PolarHBondContact O-N 2.68Å; L313-L396 HydrophobicContact CB-CD2 3.95Å; L313-L396 HydrophobicContact CD1-CD1 4.48Å
314	V	95	Very high	94.4	Very high	8 Å²	8	39.2 Å²	39.2	5%	0.048	20%	0.202	C	C	.	.	H	α-helix	trans	-62.8	-42.7	176.1	172.7	0	0	0	0	110.9	F279 M284 W286 I297 L310 E311 F316 Q317 V318	F279-V314 HydrophobicContact CZ-CG1 4.35Å; M284-V314 HydrophobicContact SD-CG1 4.26Å; W286-V314 HydrophobicContact CH2-CG2 4.44Å; I297-V314 HydrophobicContact CD1-CG2 3.3Å; I297-V314 HydrophobicContact CG1-CG2 4.11Å; L310-V314 WeakPolarHBondContact O-CG2 3.45Å; L310-V314 PolarHBondContact O-N 3.36Å; E311-V314 PolarHBondContact O-N 3.28Å; V314-F316 VanDerWaalsContact C-N 3.26Å; V314-F316 PolarHBondContact O-N 3.16Å; V314-Q317 PolarHBondContact O-N 3.43Å; V314-V318 HydrophobicContact CG1-CG2 4.29Å; V314-V318 WeakPolarHBondContact O-CG2 3.32Å; V314-V318 PolarHBondContact O-N 3.18Å
315	K	95.4	Very high	94.6	Very high	79 Å²	79	40.2 Å²	40.2	34%	0.343	20%	0.204	S	C	.	.	H	α-helix	trans	-56.7	-43.3	174.3	-74.3	173.4	-157	174.6	0	111.6	F200 E311 P312 L313 G319	F200-K315 HydrophobicContact CE2-CD 4.33Å; F200-K315 HydrophobicContact CE2-CG 3.51Å; F200-K315 HydrophobicContact CZ-CD 3.77Å; F200-K315 HydrophobicContact CZ-CG 3.4Å; F200-K315 VanDerWaalsContact CZ-CG 3.4Å; E311-K315 VanDerWaalsContact O-CG 3.27Å; E311-K315 WeakPolarHBondContact O-CG 3.5Å; E311-K315 PolarHBondContact O-N 3.41Å; E311-K315 IonicContact OE2-NZ 3.48Å; P312-K315 WeakPolarHBondContact O-CB 3.45Å; P312-K315 PolarHBondContact O-N 3.37Å; L313-K315 VanDerWaalsContact C-N 3.34Å; L313-K315 PolarHBondContact O-N 3.37Å; K315-G319 PolarHBondContact O-N 2.94Å
316	F	98.1	Very high	94.8	Very high	3 Å²	3	41.8 Å²	41.8	1%	0.013	21%	0.212	C	C	.	.	H	α-helix	trans	-61.7	-50.9	175.3	170	-92.9	0	0	0	111.4	M272 L273 P312 L313 V314 V318 G319 L320 K389 D392 L393 L396	M272-F316 HydrophobicContact CB-CE1 4.43Å; L273-F316 HydrophobicContact CD2-CZ 3.77Å; L273-F316 HydrophobicContact CG-CZ 4.16Å; P312-F316 WeakPolarHBondContact O-CB 3.25Å; P312-F316 PolarHBondContact O-N 2.92Å; L313-F316 HydrophobicContact CD1-CD1 4.49Å; L313-F316 WeakPolarHBondContact O-CB 3.44Å; L313-F316 PolarHBondContact O-N 3.18Å; V314-F316 VanDerWaalsContact C-N 3.26Å; V314-F316 PolarHBondContact O-N 3.16Å; F316-V318 PolarHBondContact O-N 3.44Å; F316-G319 PolarHBondContact O-N 2.93Å; F316-G319 VanDerWaalsContact O-N 3.17Å; F316-L320 HydrophobicContact CE1-CD2 3.97Å; F316-L320 HydrophobicContact CZ-CD2 3.9Å; F316-L320 WeakPolarHBondContact O-CB 3.47Å; F316-L320 PolarHBondContact O-N 3.44Å; F316-K389 HydrophobicContact CD2-CD 3.89Å; F316-K389 HydrophobicContact CE2-CB 3.92Å; F316-K389 HydrophobicContact CE2-CD 3.91Å; F316-K389 HydrophobicContact CE2-CG 4.48Å; F316-K389 WeakPolarHBondContact CE2-O 3.34Å; F316-D392 HydrophobicContact CD2-CB 3.98Å; F316-L393 HydrophobicContact CD2-CD2 4.32Å; F316-L393 HydrophobicContact CD2-CG 4.35Å; F316-L393 HydrophobicContact CE1-CD2 3.96Å; F316-L393 HydrophobicContact CE2-CD1 4.07Å; F316-L393 HydrophobicContact CE2-CD2 3.72Å; F316-L393 HydrophobicContact CE2-CG 3.58Å; F316-L393 HydrophobicContact CZ-CD1 3.96Å; F316-L393 HydrophobicContact CZ-CD2 3.51Å; F316-L393 HydrophobicContact CZ-CG 3.75Å; F316-L396 HydrophobicContact CB-CD1 3.77Å; F316-L396 HydrophobicContact CD1-CD1 4.32Å; F316-L396 HydrophobicContact CD2-CD1 4.19Å; F316-L396 HydrophobicContact CG-CD1 3.83Å
317	Q	98.1	Very high	95.1	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59.5	-46.6	-179.6	-67.1	-53.2	-27.3	0	0	112.8	M272 S275 N276 F279 W286 L313 V314 G319 L320 K321	M272-Q317 PolarHBondContact O-NE2 3.2Å; S275-Q317 PolarHBondContact OG-NE2 3.33Å; N276-Q317 VanDerWaalsContact CB-OE1 3.24Å; N276-Q317 PolarHBondContact ND2-O 2.78Å; N276-Q317 PolarHBondContact ND2-OE1 3.1Å; F279-Q317 HydrophobicContact CD1-CB 3.55Å; F279-Q317 HydrophobicContact CD1-CG 4.4Å; F279-Q317 HydrophobicContact CD2-CB 4Å; F279-Q317 HydrophobicContact CD2-CG 4.04Å; F279-Q317 HydrophobicContact CE1-CB 3.57Å; F279-Q317 HydrophobicContact CE2-CB 4.03Å; F279-Q317 HydrophobicContact CE2-CG 4.26Å; F279-Q317 HydrophobicContact CG-CB 3.75Å; F279-Q317 HydrophobicContact CG-CG 4.1Å; F279-Q317 HydrophobicContact CZ-CB 3.81Å; W286-Q317 HydrophobicContact CZ2-CG 3.74Å; L313-Q317 HydrophobicContact CD1-CG 4.47Å; L313-Q317 WeakPolarHBondContact O-CG 3.35Å; L313-Q317 PolarHBondContact O-N 2.68Å; V314-Q317 PolarHBondContact O-N 3.43Å; Q317-G319 VanDerWaalsContact C-N 3.34Å; Q317-L320 PolarHBondContact O-N 2.71Å; Q317-K321 PolarHBondContact O-N 2.92Å
318	V	96.1	Very high	95.6	Very high	9 Å²	9	44.7 Å²	44.7	6%	0.055	22%	0.221	C	C	.	.	H	α-helix	trans	-61.9	-45.1	175.9	172.1	0	0	0	0	110.5	F279 L281 M284 V314 F316 L320 K321 K322	F279-V318 HydrophobicContact CE1-CG2 3.91Å; F279-V318 HydrophobicContact CZ-CG2 4.26Å; L281-V318 HydrophobicContact CD2-CB 4.28Å; L281-V318 HydrophobicContact CD2-CG1 4.25Å; L281-V318 HydrophobicContact CD2-CG2 3.94Å; M284-V318 HydrophobicContact CE-CG2 4.17Å; M284-V318 HydrophobicContact SD-CG2 3.72Å; V314-V318 HydrophobicContact CG1-CG2 4.29Å; V314-V318 WeakPolarHBondContact O-CG2 3.32Å; V314-V318 PolarHBondContact O-N 3.18Å; F316-V318 PolarHBondContact O-N 3.44Å; V318-L320 VanDerWaalsContact C-N 3.31Å; V318-L320 PolarHBondContact O-N 3.3Å; V318-K321 PolarHBondContact O-N 3.39Å; V318-K322 HydrophobicContact CG1-CD 4.18Å; V318-K322 VanDerWaalsContact O-CG 3.32Å; V318-K322 WeakPolarHBondContact O-CG 3.34Å; V318-K322 PolarHBondContact O-N 3.29Å; V318-K322 VanDerWaalsContact O-N 3.13Å
319	G	96.3	Very high	95.9	Very high	16 Å²	16	39 Å²	39	17%	0.165	19%	0.194	C	C	.	.	H	α-helix	trans	-61.1	-39.3	178.2	0	0	0	0	0	112.7	K315 F316 Q317	K315-G319 PolarHBondContact O-N 2.94Å; F316-G319 PolarHBondContact O-N 2.93Å; F316-G319 VanDerWaalsContact O-N 3.17Å; Q317-G319 VanDerWaalsContact C-N 3.34Å
320	L	97.4	Very high	96.1	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-71.7	-43.4	179.2	-174.8	57.7	0	0	0	111.9	L273 N276 F316 Q317 V318 K322 L323 L325 L333 K389	L273-L320 HydrophobicContact CD2-CD2 3.84Å; N276-L320 HydrophobicContact CB-CD2 3.67Å; N276-L320 HydrophobicContact CB-CG 4.3Å; F316-L320 HydrophobicContact CE1-CD2 3.97Å; F316-L320 HydrophobicContact CZ-CD2 3.9Å; F316-L320 WeakPolarHBondContact O-CB 3.47Å; F316-L320 PolarHBondContact O-N 3.44Å; Q317-L320 PolarHBondContact O-N 2.71Å; V318-L320 VanDerWaalsContact C-N 3.31Å; V318-L320 PolarHBondContact O-N 3.3Å; L320-K322 VanDerWaalsContact C-N 3.26Å; L320-K322 PolarHBondContact O-N 3.47Å; L320-L323 HydrophobicContact CD1-CD1 4.2Å; L320-L323 WeakPolarHBondContact O-CB 3.23Å; L320-L323 PolarHBondContact O-N 3.36Å; L320-L325 HydrophobicContact CD1-CD1 3.69Å; L320-L333 HydrophobicContact CD1-CD2 4.31Å; L320-K389 HydrophobicContact CD1-CG 4.4Å
321	K	95.4	Very high	96.3	Very high	65 Å²	65	39.2 Å²	39.2	28%	0.283	20%	0.195	S	C	.	.	H	α-helix	trans	-57.2	-39.5	173.3	-80.4	-62	-165.6	-169.8	0	112.2	N276 F279 L281 Q317 V318 L323 N324	N276-K321 WeakPolarHBondContact O-CE 3.35Å; N276-K321 PolarHBondContact O-NZ 3.44Å; N276-K321 WeakPolarHBondContact OD1-CD 3.36Å; F279-K321 HydrophobicContact CD1-CG 4.31Å; F279-K321 WeakPolarHBondContact O-CE 3.33Å; F279-K321 PolarHBondContact O-NZ 3.13Å; L281-K321 HydrophobicContact CD1-CB 4.02Å; L281-K321 HydrophobicContact CD1-CG 4.42Å; L281-K321 HydrophobicContact CD2-CB 4.05Å; L281-K321 HydrophobicContact CD2-CG 4.18Å; L281-K321 HydrophobicContact CG-CB 4.24Å; L281-K321 HydrophobicContact CG-CG 4.2Å; Q317-K321 PolarHBondContact O-N 2.92Å; V318-K321 PolarHBondContact O-N 3.39Å; K321-L323 PolarHBondContact O-N 3.21Å; K321-N324 PolarHBondContact O-N 3.47Å
322	K	94.7	Very high	96.7	Very high	122 Å²	122	36.7 Å²	36.7	53%	0.53	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-16.8	178.6	-75.6	174.7	-179.7	176.8	0	114.1	V318 L320 N324	V318-K322 HydrophobicContact CG1-CD 4.18Å; V318-K322 VanDerWaalsContact O-CG 3.32Å; V318-K322 WeakPolarHBondContact O-CG 3.34Å; V318-K322 PolarHBondContact O-N 3.29Å; V318-K322 VanDerWaalsContact O-N 3.13Å; L320-K322 VanDerWaalsContact C-N 3.26Å; L320-K322 PolarHBondContact O-N 3.47Å; K322-N324 VanDerWaalsContact C-N 3.25Å
323	L	95.1	Very high	96.8	Very high	28 Å²	28	34.1 Å²	34.1	15%	0.147	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-18.7	173.6	-59.3	-174.9	0	0	0	112.3	L320 K321 L325 L382 K385 M386 K389	L320-L323 HydrophobicContact CD1-CD1 4.2Å; L320-L323 WeakPolarHBondContact O-CB 3.23Å; L320-L323 PolarHBondContact O-N 3.36Å; K321-L323 PolarHBondContact O-N 3.21Å; L323-L325 VanDerWaalsContact C-N 3.29Å; L323-L325 HydrophobicContact CB-CD2 3.61Å; L323-L325 HydrophobicContact CB-CG 3.86Å; L323-L325 HydrophobicContact CD1-CD2 4.26Å; L323-L325 PolarHBondContact O-N 2.97Å; L323-L382 HydrophobicContact CB-CD1 4.33Å; L323-L382 HydrophobicContact CD2-CD1 4.5Å; L323-K385 HydrophobicContact CD2-CB 3.81Å; L323-K385 HydrophobicContact CD2-CD 3.98Å; L323-K385 HydrophobicContact CD2-CG 4.47Å; L323-M386 HydrophobicContact CD1-CG 4.06Å; L323-K389 HydrophobicContact CD1-CG 4.1Å
324	N	93.6	Very high	96.9	Very high	129 Å²	129	33.2 Å²	33.2	69%	0.69	16%	0.162	S	C	*	.			trans	48.9	50.5	-178.8	-166.4	53.2	0	0	0	112.3	K321 K322	K321-N324 PolarHBondContact O-N 3.47Å; K322-N324 VanDerWaalsContact C-N 3.25Å
325	L	96.1	Very high	97.1	Very high	33 Å²	33	32.9 Å²	32.9	17%	0.173	16%	0.16	C	C	.	.			trans	-65.8	142	-175.5	-59.4	-176.1	0	0	0	111.2	L320 L323 E329 L333 L382 M386	L320-L325 HydrophobicContact CD1-CD1 3.69Å; L323-L325 VanDerWaalsContact C-N 3.29Å; L323-L325 HydrophobicContact CB-CD2 3.61Å; L323-L325 HydrophobicContact CB-CG 3.86Å; L323-L325 HydrophobicContact CD1-CD2 4.26Å; L323-L325 PolarHBondContact O-N 2.97Å; L325-E329 WeakPolarHBondContact CA-OE2 3.17Å; L325-E329 HydrophobicContact CB-CB 4.19Å; L325-E329 HydrophobicContact CD2-CB 4.4Å; L325-L333 HydrophobicContact CD1-CD2 4.23Å; L325-L382 HydrophobicContact CD2-CD1 4.01Å; L325-M386 HydrophobicContact CD1-CE 4.08Å; L325-M386 HydrophobicContact CD2-CE 4.12Å; L325-M386 HydrophobicContact CD2-CG 3.86Å; L325-M386 HydrophobicContact CD2-SD 3.76Å
326	H	97.4	Very high	97.2	Very high	63 Å²	63	29.2 Å²	29.2	29%	0.292	14%	0.144	S	C	.	.			trans	-67.1	161.2	162.2	-60.9	178.3	0	0	0	110.1	E328 E329 H330 Y371 H376	H326-E328 VanDerWaalsContact C-N 3.28Å; H326-E328 WeakPolarHBondContact CB-OE2 3.31Å; H326-E328 PolarHBondContact O-N 3Å; H326-E329 HydrophobicContact CB-CG 4.15Å; H326-E329 IonicContact CG-OE2 3.02Å; H326-E329 PolarHBondContact N-OE2 2.9Å; H326-E329 PolarHBondContact O-N 2.85Å; H326-H330 PolarHBondContact O-N 2.89Å; H326-Y371 HydrophobicContact CB-CE1 4.15Å; H326-Y371 AromaticContact ND1-CE1 3.54Å; H326-Y371 AromaticContact ND1-CZ 3.72Å; H326-Y371 PolarHBondContact ND1-OH 3.2Å; H326-H376 AromaticContact CD2-NE2 3.99Å; H326-H376 AromaticContact CE1-CE1 3.85Å; H326-H376 AromaticContact CE1-NE2 3.68Å; H326-H376 AromaticContact ND1-NE2 3.94Å; H326-H376 AromaticContact NE2-CE1 3.53Å; H326-H376 AromaticContact NE2-NE2 3.72Å
327	E	97.8	Very high	97.1	Very high	73 Å²	73	29.2 Å²	29.2	34%	0.341	14%	0.144	S	C	.	.	H	α-helix	trans	-59.4	-42.9	177.6	179.7	173.7	-117.5	0	0	111.2	V140 H143 H144 E329 H330 V331	V140-E327 WeakPolarHBondContact CG1-OE2 3.36Å; H143-E327 IonicContact CD2-OE1 2.83Å; H144-E327 IonicContact CD2-OE1 3.27Å; H144-E327 PolarHBondContact CD2-OE1 3.17Å; H144-E327 IonicContact CE1-OE1 3.47Å; H144-E327 IonicContact CE1-OE2 2.62Å; H144-E327 PolarHBondContact CE1-OE2 3.45Å; H144-E327 IonicContact NE2-OE1 3.98Å; H144-E327 PolarHBondContact NE2-OE1 2.94Å; H144-E327 IonicContact NE2-OE2 2.91Å; H144-E327 PolarHBondContact NE2-OE2 3.17Å; H144-E327 VanDerWaalsContact NE2-OE2 3.17Å; E327-E329 VanDerWaalsContact C-N 3.29Å; E327-E329 PolarHBondContact O-N 3.35Å; E327-H330 WeakPolarHBondContact O-CB 3.45Å; E327-H330 PolarHBondContact O-N 3.48Å; E327-H330 VanDerWaalsContact O-N 3.12Å; E327-V331 HydrophobicContact CG-CG1 4.42Å; E327-V331 WeakPolarHBondContact O-CG1 3.37Å; E327-V331 PolarHBondContact O-N 2.85Å
328	E	98.4	Very high	97	Very high	56 Å²	56	29.2 Å²	29.2	26%	0.262	14%	0.144	S	C	.	.	H	α-helix	trans	-58.2	-42	177.9	-62.9	88.1	156	0	0	111.7	I136 V140 H326 V331 L332 Y371	I136-E328 HydrophobicContact CG2-CB 3.81Å; I136-E328 HydrophobicContact CG2-CG 3.43Å; I136-E328 VanDerWaalsContact CG2-CG 3.43Å; V140-E328 HydrophobicContact CG2-CG 4.04Å; H326-E328 VanDerWaalsContact C-N 3.28Å; H326-E328 WeakPolarHBondContact CB-OE2 3.31Å; H326-E328 PolarHBondContact O-N 3Å; E328-V331 VanDerWaalsContact O-CG2 3.29Å; E328-V331 WeakPolarHBondContact O-CG2 3.49Å; E328-L332 WeakPolarHBondContact O-CB 3.28Å; E328-L332 WeakPolarHBondContact O-CD1 3.47Å; E328-L332 VanDerWaalsContact O-CG 3.23Å; E328-L332 WeakPolarHBondContact O-CG 3.48Å; E328-L332 PolarHBondContact O-N 3.09Å; E328-Y371 HydrophobicContact CB-CD2 4.16Å; E328-Y371 HydrophobicContact CB-CE1 4.15Å; E328-Y371 HydrophobicContact CB-CE2 3.61Å; E328-Y371 HydrophobicContact CG-CE2 3.69Å; E328-Y371 PolarHBondContact OE1-OH 2.79Å; E328-Y371 PolarHBondContact OE2-OH 3.3Å
329	E	98.3	Very high	96.9	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-68	-39.1	178	-63.8	176.7	142.1	0	0	111.3	L325 H326 E327 L333 L368 Y371 I372 H376 M386	L325-E329 WeakPolarHBondContact CA-OE2 3.17Å; L325-E329 HydrophobicContact CB-CB 4.19Å; L325-E329 HydrophobicContact CD2-CB 4.4Å; H326-E329 HydrophobicContact CB-CG 4.15Å; H326-E329 IonicContact CG-OE2 3.02Å; H326-E329 PolarHBondContact N-OE2 2.9Å; H326-E329 PolarHBondContact O-N 2.85Å; E327-E329 VanDerWaalsContact C-N 3.29Å; E327-E329 PolarHBondContact O-N 3.35Å; E329-L333 VanDerWaalsContact O-CB 3.31Å; E329-L333 WeakPolarHBondContact O-CB 3.48Å; E329-L333 PolarHBondContact O-N 3.19Å; E329-L368 HydrophobicContact CB-CD1 4.13Å; E329-L368 HydrophobicContact CG-CD1 4.07Å; E329-Y371 HydrophobicContact CG-CD1 3.6Å; E329-Y371 HydrophobicContact CG-CE1 3.63Å; E329-I372 VanDerWaalsContact OE1-CG1 3.31Å; E329-I372 WeakPolarHBondContact OE1-CG1 3.45Å; E329-H376 VanDerWaalsContact CD-NE2 3.29Å; E329-H376 IonicContact OE1-CD2 3.37Å; E329-H376 PolarHBondContact OE1-CD2 2.95Å; E329-H376 IonicContact OE1-NE2 3.28Å; E329-H376 PolarHBondContact OE1-NE2 3.06Å; E329-H376 IonicContact OE2-CE1 3.72Å; E329-H376 IonicContact OE2-NE2 3.69Å; E329-H376 PolarHBondContact OE2-NE2 3.33Å; E329-H376 VanDerWaalsContact OE2-NE2 3.11Å; E329-M386 HydrophobicContact CB-CE 3.87Å; E329-M386 HydrophobicContact CB-SD 4.45Å; E329-M386 VanDerWaalsContact O-CE 3.29Å; E329-M386 WeakPolarHBondContact O-CE 3.3Å
330	H	98.3	Very high	96.4	Very high	13 Å²	13	28.9 Å²	28.9	6%	0.06	14%	0.14	C	C	.	.	H	α-helix	trans	-65.4	-46.3	177.3	-167.4	81.8	0	0	0	111.9	L273 H326 E327 L333 M334	L273-H330 PolarHBondContact O-CE1 3Å; L273-H330 VanDerWaalsContact O-CE1 3.24Å; H326-H330 PolarHBondContact O-N 2.89Å; E327-H330 WeakPolarHBondContact O-CB 3.45Å; E327-H330 PolarHBondContact O-N 3.48Å; E327-H330 VanDerWaalsContact O-N 3.12Å; H330-L333 PolarHBondContact O-N 3.28Å; H330-M334 WeakPolarHBondContact O-CG 3.4Å; H330-M334 PolarHBondContact O-N 3.23Å
331	V	98.6	Very high	95.3	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-70.2	-34.6	179.8	-57.1	0	0	0	0	112.7	L139 V140 H143 F244 E327 E328 M334 A335	L139-V331 HydrophobicContact CB-CB 4.11Å; L139-V331 HydrophobicContact CB-CG2 3.69Å; V140-V331 HydrophobicContact CG2-CG2 3.99Å; H143-V331 HydrophobicContact CB-CG1 3.46Å; H143-V331 VanDerWaalsContact CB-CG1 3.46Å; F244-V331 HydrophobicContact CE2-CB 4.49Å; F244-V331 HydrophobicContact CZ-CB 4.41Å; E327-V331 HydrophobicContact CG-CG1 4.42Å; E327-V331 WeakPolarHBondContact O-CG1 3.37Å; E327-V331 PolarHBondContact O-N 2.85Å; E328-V331 VanDerWaalsContact O-CG2 3.29Å; E328-V331 WeakPolarHBondContact O-CG2 3.49Å; V331-M334 HydrophobicContact CB-CE 4.11Å; V331-M334 HydrophobicContact CG1-CE 3.8Å; V331-M334 PolarHBondContact O-N 3.04Å; V331-A335 WeakPolarHBondContact O-CB 3.42Å; V331-A335 PolarHBondContact O-N 3.46Å
332	L	98.7	Very high	93.9	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-64.7	-42.6	171.4	-77	165.8	0	0	0	111.1	I136 L139 E328 M334 A335 I336 L364 T367 L368	I136-L332 HydrophobicContact CD1-CD1 4.35Å; I136-L332 HydrophobicContact CG1-CD1 4.04Å; I136-L332 HydrophobicContact CG1-CD2 4.5Å; L139-L332 HydrophobicContact CD1-CD2 3.67Å; L139-L332 HydrophobicContact CD1-CG 4.25Å; E328-L332 WeakPolarHBondContact O-CB 3.28Å; E328-L332 WeakPolarHBondContact O-CD1 3.47Å; E328-L332 VanDerWaalsContact O-CG 3.23Å; E328-L332 WeakPolarHBondContact O-CG 3.48Å; E328-L332 PolarHBondContact O-N 3.09Å; L332-M334 PolarHBondContact O-N 2.95Å; L332-A335 PolarHBondContact O-N 3.44Å; L332-I336 WeakPolarHBondContact O-CB 3.35Å; L332-I336 WeakPolarHBondContact O-CD1 3.47Å; L332-I336 VanDerWaalsContact O-CG1 3.22Å; L332-I336 WeakPolarHBondContact O-CG1 3.49Å; L332-I336 PolarHBondContact O-N 3.06Å; L332-L364 HydrophobicContact CD2-CD2 4.14Å; L332-T367 HydrophobicContact CD1-CG2 4.35Å; L332-T367 HydrophobicContact CD2-CG2 4.01Å; L332-L368 HydrophobicContact CB-CB 4.22Å; L332-L368 HydrophobicContact CB-CD1 4.07Å; L332-L368 HydrophobicContact CD1-CB 3.97Å; L332-L368 HydrophobicContact CD1-CD1 3.88Å
333	L	98.4	Very high	91.9	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-62.5	-41.7	176.7	-171.2	61.1	0	0	0	112.1	L273 L320 L325 E329 H330 I336 C337 M386 L390	L273-L333 HydrophobicContact CD2-CD2 3.86Å; L273-L333 HydrophobicContact CD2-CG 4.24Å; L320-L333 HydrophobicContact CD1-CD2 4.31Å; L325-L333 HydrophobicContact CD1-CD2 4.23Å; E329-L333 VanDerWaalsContact O-CB 3.31Å; E329-L333 WeakPolarHBondContact O-CB 3.48Å; E329-L333 PolarHBondContact O-N 3.19Å; H330-L333 PolarHBondContact O-N 3.28Å; L333-I336 PolarHBondContact O-N 3.14Å; L333-C337 VanDerWaalsContact O-CB 3.31Å; L333-C337 WeakPolarHBondContact O-CB 3.19Å; L333-C337 PolarHBondContact O-N 3.02Å; L333-M386 HydrophobicContact CB-CE 3.89Å; L333-M386 HydrophobicContact CD1-CB 4.11Å; L333-M386 HydrophobicContact CD1-CE 4.32Å; L333-M386 HydrophobicContact CD2-CB 4.38Å; L333-M386 HydrophobicContact CD2-CE 4.12Å; L333-M386 HydrophobicContact CG-CE 4.35Å; L333-L390 HydrophobicContact CD1-CD1 3.92Å; L333-L390 HydrophobicContact CD1-CD2 3.61Å; L333-L390 HydrophobicContact CD1-CG 3.71Å; L333-L390 HydrophobicContact CG-CD2 3.98Å
334	M	98.5	Very high	89.8	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-61	-44.2	172.7	-73.2	-168.6	-65	0	0	112	F244 V270 L273 R274 H330 V331 L332 C337 L338	F244-M334 HydrophobicContact CE1-CB 4.06Å; F244-M334 HydrophobicContact CE2-CE 4.15Å; F244-M334 HydrophobicContact CZ-CB 4.24Å; F244-M334 HydrophobicContact CZ-CE 4.07Å; V270-M334 HydrophobicContact CG1-CB 4.4Å; V270-M334 HydrophobicContact CG1-CG 4.31Å; V270-M334 HydrophobicContact CG1-SD 4.14Å; L273-M334 HydrophobicContact CB-CG 4.17Å; L273-M334 HydrophobicContact CD1-CG 4.34Å; R274-M334 HydrophobicContact CB-SD 4.18Å; H330-M334 WeakPolarHBondContact O-CG 3.4Å; H330-M334 PolarHBondContact O-N 3.23Å; V331-M334 HydrophobicContact CB-CE 4.11Å; V331-M334 HydrophobicContact CG1-CE 3.8Å; V331-M334 PolarHBondContact O-N 3.04Å; L332-M334 PolarHBondContact O-N 2.95Å; M334-C337 WeakPolarHBondContact O-CB 3.42Å; M334-C337 PolarHBondContact O-N 3.27Å; M334-L338 WeakPolarHBondContact O-CB 3.4Å; M334-L338 PolarHBondContact O-N 2.93Å
335	A	98.6	Very high	87.6	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-66.4	-40.2	179.7	0	0	0	0	0	112.2	L139 F244 I248 V331 L332 L338 L339 L364	L139-A335 HydrophobicContact CD1-CB 3.92Å; L139-A335 HydrophobicContact CD2-CB 4.04Å; F244-A335 HydrophobicContact CE1-CB 4.4Å; I248-A335 HydrophobicContact CD1-CB 3.99Å; I248-A335 HydrophobicContact CG1-CB 4.38Å; V331-A335 WeakPolarHBondContact O-CB 3.42Å; V331-A335 PolarHBondContact O-N 3.46Å; L332-A335 PolarHBondContact O-N 3.44Å; A335-L338 PolarHBondContact O-N 3.42Å; A335-L339 WeakPolarHBondContact O-CB 3.28Å; A335-L339 PolarHBondContact O-N 3.42Å; A335-L364 HydrophobicContact CB-CD1 3.69Å; A335-L364 HydrophobicContact CB-CD2 4.47Å
336	I	97.8	Very high	85.4	Confident	3 Å²	3	31.2 Å²	31.2	2%	0.015	19%	0.192	C	C	.	.	H	α-helix	trans	-64.1	-42.3	174.2	-67.2	164.2	0	0	0	110.8	L332 L333 L338 L339 Q361 L364 L368 L390	L332-I336 WeakPolarHBondContact O-CB 3.35Å; L332-I336 WeakPolarHBondContact O-CD1 3.47Å; L332-I336 VanDerWaalsContact O-CG1 3.22Å; L332-I336 WeakPolarHBondContact O-CG1 3.49Å; L332-I336 PolarHBondContact O-N 3.06Å; L333-I336 PolarHBondContact O-N 3.14Å; I336-L338 VanDerWaalsContact C-N 3.34Å; I336-L339 CarbonylContact O-C 3.59Å; I336-Q361 HydrophobicContact CG2-CG 3.96Å; I336-Q361 PolarHBondContact O-NE2 3.22Å; I336-L364 HydrophobicContact CD1-CB 4.39Å; I336-L364 HydrophobicContact CG1-CB 3.69Å; I336-L368 HydrophobicContact CD1-CB 4.28Å; I336-L368 HydrophobicContact CD1-CD2 3.76Å; I336-L390 HydrophobicContact CB-CD1 4.4Å; I336-L390 HydrophobicContact CG2-CD1 3.61Å
337	C	96.2	Very high	83.4	Confident	2 Å²	2	30.2 Å²	30.2	1%	0.014	19%	0.188	C	C	.	.	H	α-helix	trans	-59.3	-44.8	174.4	175.5	0	0	0	0	111.5	E269 V270 L273 L333 M334 R348 L390	E269-C337 VanDerWaalsContact CB-SG 3.5Å; E269-C337 PolarHBondContact OE2-SG 3.42Å; E269-C337 VanDerWaalsContact OE2-SG 3.34Å; V270-C337 HydrophobicContact CG2-CB 4.46Å; L273-C337 HydrophobicContact CD1-CB 3.79Å; L333-C337 VanDerWaalsContact O-CB 3.31Å; L333-C337 WeakPolarHBondContact O-CB 3.19Å; L333-C337 PolarHBondContact O-N 3.02Å; M334-C337 WeakPolarHBondContact O-CB 3.42Å; M334-C337 PolarHBondContact O-N 3.27Å; C337-R348 PolarHBondContact O-NH2 2.91Å; C337-L390 HydrophobicContact CB-CD2 3.7Å
338	L	96	Very high	81.9	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-67.3	-47.6	-179.3	-165	151.1	0	0	0	111.9	V241 A245 I248 F251 L263 V270 M334 A335 I336 S340 R348	V241-L338 HydrophobicContact CG1-CD1 4.14Å; A245-L338 HydrophobicContact CB-CD1 3.49Å; A245-L338 VanDerWaalsContact CB-CD1 3.49Å; A245-L338 HydrophobicContact CB-CD2 4.13Å; A245-L338 HydrophobicContact CB-CG 4.47Å; I248-L338 HydrophobicContact CD1-CB 4.32Å; I248-L338 HydrophobicContact CD1-CD1 4.16Å; I248-L338 HydrophobicContact CD1-CD2 4.14Å; I248-L338 HydrophobicContact CD1-CG 4.44Å; F251-L338 HydrophobicContact CD2-CD2 3.81Å; F251-L338 HydrophobicContact CE2-CD2 3.46Å; F251-L338 VanDerWaalsContact CE2-CD2 3.46Å; F251-L338 HydrophobicContact CZ-CD2 4.34Å; L263-L338 HydrophobicContact CD2-CD1 4.41Å; V270-L338 HydrophobicContact CG2-CB 4.28Å; M334-L338 WeakPolarHBondContact O-CB 3.4Å; M334-L338 PolarHBondContact O-N 2.93Å; A335-L338 PolarHBondContact O-N 3.42Å; I336-L338 VanDerWaalsContact C-N 3.34Å; L338-S340 PolarHBondContact O-N 3.39Å; L338-S340 VanDerWaalsContact O-N 3.13Å; L338-R348 PolarHBondContact O-NH1 2.86Å
339	L	94.6	Very high	80.5	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.005	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	43	178.6	-73	170.1	0	0	0	112.7	I248 F251 L254 L262 A335 I336 L360 Q361 L364	I248-L339 HydrophobicContact CG2-CD1 3.61Å; F251-L339 HydrophobicContact CD2-CD2 4.04Å; L254-L339 HydrophobicContact CD1-CD2 4.11Å; L262-L339 HydrophobicContact CD1-CD2 4.11Å; A335-L339 WeakPolarHBondContact O-CB 3.28Å; A335-L339 PolarHBondContact O-N 3.42Å; I336-L339 CarbonylContact O-C 3.59Å; L339-L360 HydrophobicContact CD1-CB 3.99Å; L339-L360 HydrophobicContact CD2-CD1 4.22Å; L339-Q361 VanDerWaalsContact O-CB 3.25Å; L339-Q361 WeakPolarHBondContact O-CB 3.21Å; L339-Q361 VanDerWaalsContact O-CG 3.23Å; L339-Q361 WeakPolarHBondContact O-CG 3.06Å; L339-Q361 PolarHBondContact O-NE2 3.02Å; L339-L364 HydrophobicContact CD1-CD1 3.54Å
340	S	85.8	Confident	79.6	Confident	17 Å²	17	30.9 Å²	30.9	12%	0.119	21%	0.211	C	C	.	.			trans	-89.7	130.8	172	-169.6	0	0	0	0	110.4	L262 L338 G342 R348 Q361 R394	L262-S340 VanDerWaalsContact CD2-O 3.28Å; L262-S340 WeakPolarHBondContact CD2-O 3.3Å; L338-S340 PolarHBondContact O-N 3.39Å; L338-S340 VanDerWaalsContact O-N 3.13Å; S340-G342 PolarHBondContact O-N 2.96Å; S340-R348 WeakPolarHBondContact O-CD 3.38Å; S340-R348 VanDerWaalsContact O-CZ 3.3Å; S340-R348 PolarHBondContact O-NE 2.87Å; S340-R348 PolarHBondContact O-NH1 3.41Å; S340-Q361 VanDerWaalsContact CA-NE2 3.34Å; S340-R394 PolarHBondContact OG-NH2 3.26Å
341	P	72.6	Confident	79.1	Confident	18 Å²	18	30.7 Å²	30.7	12%	0.117	21%	0.211	C	C	.	.			trans	-71.9	-16.1	177.4	27	-32.8	0	0	0	112.8	I357 E358	P341-I357 HydrophobicContact CB-CB 4.49Å; P341-I357 HydrophobicContact CB-CG2 4.11Å; P341-E358 HydrophobicContact CG-CB 4.29Å
342	G	66.8	Low	78.6	Confident	12 Å²	12	37 Å²	37	12%	0.124	24%	0.24	C	C	.	.			trans	76.8	137.5	-166.2	0	0	0	0	0	110.3	S340 S344	S340-G342 PolarHBondContact O-N 2.96Å; G342-S344 VanDerWaalsContact C-N 3.27Å
343	S	51.9	Low	78.3	Confident	117 Å²	117	40.1 Å²	40.1	82%	0.818	26%	0.257	S	S	*	.	S	Bend	trans	-81.4	-10.1	179.4	33.3	0	0	0	0	113	D347	S343-D347 WeakPolarHBondContact CA-OD2 3.28Å; S343-D347 PolarHBondContact N-OD2 3.4Å; S343-D347 PolarHBondContact OG-OD2 3.08Å
344	S	50.7	Low	78	Confident	56 Å²	56	43 Å²	43	39%	0.392	27%	0.271	S	S	.	.	S	Bend	trans	-152.5	157.9	178.5	63.7	0	0	0	0	110.8	G342 A346 D347	G342-S344 VanDerWaalsContact C-N 3.27Å; S344-A346 PolarHBondContact O-N 3.08Å; S344-D347 PolarHBondContact N-OD2 2.98Å; S344-D347 WeakPolarHBondContact O-CB 3.38Å; S344-D347 PolarHBondContact O-N 3.44Å; S344-D347 VanDerWaalsContact OG-CG 3.31Å; S344-D347 PolarHBondContact OG-N 2.78Å; S344-D347 PolarHBondContact OG-OD2 3.34Å
345	D	48.6	Very low	77.7	Confident	135 Å²	135	48.1 Å²	48.1	72%	0.722	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-18.6	171.4	-73.2	-37.7	0	0	0	112.9
346	A	49.3	Very low	77.5	Confident	90 Å²	90	53.1 Å²	53.1	74%	0.744	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-26.2	174.6	0	0	0	0	0	113.7	S344	S344-A346 PolarHBondContact O-N 3.08Å
347	D	55.8	Low	77.4	Confident	41 Å²	41	53 Å²	53	22%	0.219	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-32.6	-175.9	-69.8	-46.5	0	0	0	112.5	S343 S344	S343-D347 WeakPolarHBondContact CA-OD2 3.28Å; S343-D347 PolarHBondContact N-OD2 3.4Å; S343-D347 PolarHBondContact OG-OD2 3.08Å; S344-D347 PolarHBondContact N-OD2 2.98Å; S344-D347 WeakPolarHBondContact O-CB 3.38Å; S344-D347 PolarHBondContact O-N 3.44Å; S344-D347 VanDerWaalsContact OG-CG 3.31Å; S344-D347 PolarHBondContact OG-N 2.78Å; S344-D347 PolarHBondContact OG-OD2 3.34Å
348	R	66.8	Low	77.3	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.008	34%	0.341	C	S	.	.	S	Bend	trans	-151	77	179.8	-64.8	-163.3	171.1	-163.4	-2.7	111.7	L262 S265 E269 C337 L338 S340 G350 V351	L262-R348 VanDerWaalsContact CD2-NH1 3.34Å; S265-R348 WeakPolarHBondContact OG-CD 3.47Å; S265-R348 PolarHBondContact OG-NE 3.21Å; E269-R348 IonicContact OE2-NH2 3.8Å; C337-R348 PolarHBondContact O-NH2 2.91Å; L338-R348 PolarHBondContact O-NH1 2.86Å; S340-R348 WeakPolarHBondContact O-CD 3.38Å; S340-R348 VanDerWaalsContact O-CZ 3.3Å; S340-R348 PolarHBondContact O-NE 2.87Å; S340-R348 PolarHBondContact O-NH1 3.41Å; R348-G350 PolarHBondContact O-N 2.74Å; R348-V351 HydrophobicContact CB-CG2 4.05Å
349	P	67.6	Low	77.3	Confident	100 Å²	100	60.4 Å²	60.4	65%	0.649	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	133	178.3	24.9	-33.2	0	0	0	110.7
350	G	79.8	Confident	77.4	Confident	42 Å²	42	61.8 Å²	61.8	43%	0.433	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	103.7	-8.2	173	0	0	0	0	0	116	R348 Q352	R348-G350 PolarHBondContact O-N 2.74Å; G350-Q352 PolarHBondContact O-NE2 2.8Å
351	V	87.3	Confident	77.9	Confident	8 Å²	8	62.5 Å²	62.5	5%	0.048	37%	0.373	C	S	.	.			trans	-68.1	134.2	170.5	176.2	0	0	0	0	110.1	A261 L262 R348 H354 I357	A261-V351 HydrophobicContact CB-CG2 3.86Å; L262-V351 HydrophobicContact CD2-CG2 4.35Å; R348-V351 HydrophobicContact CB-CG2 4.05Å; V351-H354 PolarHBondContact O-CE1 3.3Å; V351-I357 HydrophobicContact CG1-CD1 3.32Å
352	Q	89.5	Confident	79.1	Confident	133 Å²	133	65.4 Å²	65.4	62%	0.621	39%	0.388	S	S	*	.			trans	-104.4	-58.4	-178.7	-53.6	-57.5	-55.1	0	0	110.8	D258 G350 H354	D258-Q352 PolarHBondContact OD1-N 3.37Å; G350-Q352 PolarHBondContact O-NE2 2.8Å; Q352-H354 PolarHBondContact O-N 3.19Å; Q352-H354 PolarHBondContact O-ND1 3.37Å
353	D	92.1	Very high	80.5	Confident	65 Å²	65	68.5 Å²	68.5	35%	0.348	40%	0.398	S	S	.	.			trans	-95.8	72.8	-175	-166.8	-9	0	0	0	112.7	D258 T355 R356 I357	D258-D353 PolarHBondContact OD1-N 2.93Å; D353-T355 VanDerWaalsContact C-N 3.32Å; D353-T355 PolarHBondContact O-N 2.87Å; D353-R356 HydrophobicContact CB-CB 4.22Å; D353-R356 PolarHBondContact O-N 3.44Å; D353-R356 VanDerWaalsContact OD1-CB 3.31Å; D353-R356 WeakPolarHBondContact OD1-CB 3.28Å; D353-R356 PolarHBondContact OD1-N 3.29Å; D353-R356 WeakPolarHBondContact OD2-CB 3.41Å; D353-I357 WeakPolarHBondContact O-CD1 3.35Å; D353-I357 WeakPolarHBondContact O-CG1 3.45Å; D353-I357 PolarHBondContact O-N 3.2Å
354	H	91.4	Very high	82.8	Confident	62 Å²	62	63.3 Å²	63.3	29%	0.287	36%	0.361	S	S	.	.	H	α-helix	trans	-58	-42.5	180	-65.7	80.4	0	0	0	112.6	V351 Q352 R356 I357 E358	V351-H354 PolarHBondContact O-CE1 3.3Å; Q352-H354 PolarHBondContact O-N 3.19Å; Q352-H354 PolarHBondContact O-ND1 3.37Å; H354-R356 VanDerWaalsContact C-N 3.35Å; H354-R356 PolarHBondContact O-N 3.27Å; H354-I357 PolarHBondContact O-N 3.05Å; H354-E358 WeakPolarHBondContact O-CB 3.26Å; H354-E358 PolarHBondContact O-N 2.93Å
355	T	92.8	Very high	85	Confident	107 Å²	107	61.2 Å²	61.2	66%	0.656	35%	0.346	S	S	*	.	H	α-helix	trans	-60.1	-44.4	-178.6	-52.3	0	0	0	0	111.6	D353 A359	D353-T355 VanDerWaalsContact C-N 3.32Å; D353-T355 PolarHBondContact O-N 2.87Å; T355-A359 WeakPolarHBondContact O-CB 3.22Å; T355-A359 PolarHBondContact O-N 3.34Å
356	R	94.9	Very high	87.3	Confident	104 Å²	104	60.3 Å²	60.3	39%	0.392	34%	0.338	S	S	.	.	H	α-helix	trans	-67.9	-40.1	179.2	-178.1	177.5	177.2	116.4	4.5	112	E253 L254 D353 H354 A359 L360	E253-R356 PolarHBondContact O-NH2 2.8Å; L254-R356 HydrophobicContact CD2-CG 3.89Å; D353-R356 HydrophobicContact CB-CB 4.22Å; D353-R356 PolarHBondContact O-N 3.44Å; D353-R356 VanDerWaalsContact OD1-CB 3.31Å; D353-R356 WeakPolarHBondContact OD1-CB 3.28Å; D353-R356 PolarHBondContact OD1-N 3.29Å; D353-R356 WeakPolarHBondContact OD2-CB 3.41Å; H354-R356 VanDerWaalsContact C-N 3.35Å; H354-R356 PolarHBondContact O-N 3.27Å; R356-A359 PolarHBondContact O-N 2.7Å; R356-L360 WeakPolarHBondContact O-CG 3.32Å; R356-L360 PolarHBondContact O-N 3.39Å; R356-L360 VanDerWaalsContact O-N 3.13Å
357	I	95.2	Very high	89.6	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-66.2	-44.2	178.7	-67.6	161.9	0	0	0	110.4	L254 D258 L262 P341 V351 D353 H354 A359 L360 Q361	L254-I357 HydrophobicContact CD1-CG1 4.2Å; L254-I357 HydrophobicContact CD2-CG1 4.03Å; D258-I357 HydrophobicContact CB-CD1 4.32Å; L262-I357 HydrophobicContact CD1-CD1 4.05Å; L262-I357 HydrophobicContact CD1-CG1 4.23Å; L262-I357 HydrophobicContact CD2-CD1 4.28Å; L262-I357 HydrophobicContact CD2-CG2 4.16Å; L262-I357 HydrophobicContact CG-CD1 4.36Å; P341-I357 HydrophobicContact CB-CB 4.49Å; P341-I357 HydrophobicContact CB-CG2 4.11Å; V351-I357 HydrophobicContact CG1-CD1 3.32Å; D353-I357 WeakPolarHBondContact O-CD1 3.35Å; D353-I357 WeakPolarHBondContact O-CG1 3.45Å; D353-I357 PolarHBondContact O-N 3.2Å; H354-I357 PolarHBondContact O-N 3.05Å; I357-A359 PolarHBondContact O-N 3.35Å; I357-L360 PolarHBondContact O-N 2.81Å; I357-Q361 PolarHBondContact O-N 3.44Å
358	E	94.3	Very high	91.6	Very high	100 Å²	100	54.2 Å²	54.2	47%	0.467	29%	0.293	S	S	.	.	H	α-helix	trans	-58.6	-45.7	174.9	-171.2	173.9	-162.5	0	0	111.1	P341 H354 L360 Q361 D362	P341-E358 HydrophobicContact CG-CB 4.29Å; H354-E358 WeakPolarHBondContact O-CB 3.26Å; H354-E358 PolarHBondContact O-N 2.93Å; E358-L360 VanDerWaalsContact C-N 3.3Å; E358-L360 PolarHBondContact O-N 3.49Å; E358-Q361 CarbonylContact O-C 3.6Å; E358-Q361 WeakPolarHBondContact O-CB 3.37Å; E358-Q361 PolarHBondContact O-N 3.1Å; E358-D362 WeakPolarHBondContact O-CB 3.2Å; E358-D362 PolarHBondContact O-N 3.29Å
359	A	96.2	Very high	93	Very high	58 Å²	58	57.1 Å²	57.1	48%	0.479	31%	0.306	S	S	.	.	H	α-helix	trans	-60.4	-36.3	176.8	0	0	0	0	0	113.4	T355 R356 I357 K363	T355-A359 WeakPolarHBondContact O-CB 3.22Å; T355-A359 PolarHBondContact O-N 3.34Å; R356-A359 PolarHBondContact O-N 2.7Å; I357-A359 PolarHBondContact O-N 3.35Å; A359-K363 PolarHBondContact O-N 2.85Å
360	L	97.1	Very high	94.3	Very high	30 Å²	30	53 Å²	53	16%	0.157	28%	0.281	C	S	.	.	H	α-helix	trans	-69.1	-41.9	173.4	-67.9	174.5	0	0	0	111.4	L254 L339 R356 I357 E358 K363 L364	L254-L360 HydrophobicContact CD1-CD1 4.4Å; L254-L360 HydrophobicContact CD2-CD1 4.01Å; L254-L360 HydrophobicContact CG-CD1 4.32Å; L339-L360 HydrophobicContact CD1-CB 3.99Å; L339-L360 HydrophobicContact CD2-CD1 4.22Å; R356-L360 WeakPolarHBondContact O-CG 3.32Å; R356-L360 PolarHBondContact O-N 3.39Å; R356-L360 VanDerWaalsContact O-N 3.13Å; I357-L360 PolarHBondContact O-N 2.81Å; E358-L360 VanDerWaalsContact C-N 3.3Å; E358-L360 PolarHBondContact O-N 3.49Å; L360-K363 PolarHBondContact O-N 3.44Å; L360-L364 WeakPolarHBondContact O-CG 3.3Å; L360-L364 PolarHBondContact O-N 2.97Å
361	Q	96.4	Very high	95.2	Very high	32 Å²	32	51.5 Å²	51.5	15%	0.15	26%	0.262	C	S	.	.	H	α-helix	trans	-64.4	-41.3	178.2	-158.6	-174.8	41.2	0	0	112.3	I336 L339 S340 I357 E358 L364 S365	I336-Q361 HydrophobicContact CG2-CG 3.96Å; I336-Q361 PolarHBondContact O-NE2 3.22Å; L339-Q361 VanDerWaalsContact O-CB 3.25Å; L339-Q361 WeakPolarHBondContact O-CB 3.21Å; L339-Q361 VanDerWaalsContact O-CG 3.23Å; L339-Q361 WeakPolarHBondContact O-CG 3.06Å; L339-Q361 PolarHBondContact O-NE2 3.02Å; S340-Q361 VanDerWaalsContact CA-NE2 3.34Å; I357-Q361 PolarHBondContact O-N 3.44Å; E358-Q361 CarbonylContact O-C 3.6Å; E358-Q361 WeakPolarHBondContact O-CB 3.37Å; E358-Q361 PolarHBondContact O-N 3.1Å; Q361-L364 PolarHBondContact O-N 2.88Å; Q361-S365 WeakPolarHBondContact O-CB 3.36Å; Q361-S365 PolarHBondContact O-N 3.25Å; Q361-S365 PolarHBondContact O-OG 3.25Å
362	D	96.4	Very high	95.5	Very high	79 Å²	79	51.5 Å²	51.5	42%	0.422	26%	0.262	S	S	.	.	H	α-helix	trans	-60.6	-46	177.8	-80.3	-16.6	0	0	0	110.9	E358 L364 S365 E366	E358-D362 WeakPolarHBondContact O-CB 3.2Å; E358-D362 PolarHBondContact O-N 3.29Å; D362-L364 VanDerWaalsContact C-N 3.3Å; D362-L364 PolarHBondContact O-N 3.2Å; D362-S365 CarbonylContact O-C 3.6Å; D362-S365 WeakPolarHBondContact O-CB 3.22Å; D362-S365 PolarHBondContact O-N 3.35Å; D362-S365 VanDerWaalsContact O-N 3.09Å; D362-E366 WeakPolarHBondContact O-CG 3.29Å; D362-E366 PolarHBondContact O-N 3.04Å
363	K	97.6	Very high	95.7	Very high	77 Å²	77	52.7 Å²	52.7	34%	0.335	26%	0.26	S	S	.	.	H	α-helix	trans	-59.5	-40.7	176.9	-171.9	178.3	-176.9	179.2	0	112.5	E131 A359 L360 T367	E131-K363 WeakPolarHBondContact OE1-CE 3.31Å; E131-K363 IonicContact OE1-NZ 3.24Å; E131-K363 PolarHBondContact OE1-NZ 3.21Å; A359-K363 PolarHBondContact O-N 2.85Å; L360-K363 PolarHBondContact O-N 3.44Å; K363-T367 WeakPolarHBondContact O-CB 3.47Å; K363-T367 PolarHBondContact O-N 3.46Å; K363-T367 PolarHBondContact O-OG1 3.36Å
364	L	98.3	Very high	95.7	Very high	9 Å²	9	52.5 Å²	52.5	5%	0.047	26%	0.259	C	S	.	.	H	α-helix	trans	-67.5	-40.1	174.9	-68.4	174.6	0	0	0	111.8	V135 L139 I248 L332 A335 I336 L339 L360 Q361 D362 T367 L368	V135-L364 HydrophobicContact CG1-CD2 3.68Å; L139-L364 HydrophobicContact CD1-CD2 3.96Å; I248-L364 HydrophobicContact CG2-CD1 4.42Å; L332-L364 HydrophobicContact CD2-CD2 4.14Å; A335-L364 HydrophobicContact CB-CD1 3.69Å; A335-L364 HydrophobicContact CB-CD2 4.47Å; I336-L364 HydrophobicContact CD1-CB 4.39Å; I336-L364 HydrophobicContact CG1-CB 3.69Å; L339-L364 HydrophobicContact CD1-CD1 3.54Å; L360-L364 WeakPolarHBondContact O-CG 3.3Å; L360-L364 PolarHBondContact O-N 2.97Å; Q361-L364 PolarHBondContact O-N 2.88Å; D362-L364 VanDerWaalsContact C-N 3.3Å; D362-L364 PolarHBondContact O-N 3.2Å; L364-T367 WeakPolarHBondContact O-CB 3.42Å; L364-T367 PolarHBondContact O-N 3.18Å; L364-L368 WeakPolarHBondContact O-CB 3.39Å; L364-L368 PolarHBondContact O-N 3.01Å
365	S	97.4	Very high	95.8	Very high	11 Å²	11	53.5 Å²	53.5	8%	0.077	26%	0.264	C	S	.	.	H	α-helix	trans	-64.2	-43.2	177.8	-64.2	0	0	0	0	112	Q361 D362 T367 L368 Q369 Y383	Q361-S365 WeakPolarHBondContact O-CB 3.36Å; Q361-S365 PolarHBondContact O-N 3.25Å; Q361-S365 PolarHBondContact O-OG 3.25Å; D362-S365 CarbonylContact O-C 3.6Å; D362-S365 WeakPolarHBondContact O-CB 3.22Å; D362-S365 PolarHBondContact O-N 3.35Å; D362-S365 VanDerWaalsContact O-N 3.09Å; S365-T367 VanDerWaalsContact C-N 3.35Å; S365-L368 PolarHBondContact O-N 2.96Å; S365-Q369 VanDerWaalsContact O-CG 3.31Å; S365-Q369 WeakPolarHBondContact O-CG 3.34Å; S365-Q369 PolarHBondContact O-N 3.13Å; S365-Q369 PolarHBondContact O-NE2 3.31Å; S365-Y383 WeakPolarHBondContact CB-OH 3.33Å
366	E	97.3	Very high	95.7	Very high	117 Å²	117	50.5 Å²	50.5	55%	0.547	24%	0.242	S	C	.	.	H	α-helix	trans	-62.6	-42	173.3	-72.9	179.4	176.3	0	0	111.8	D362 Q369 A370	D362-E366 WeakPolarHBondContact O-CG 3.29Å; D362-E366 PolarHBondContact O-N 3.04Å; E366-Q369 PolarHBondContact O-N 3.44Å; E366-A370 WeakPolarHBondContact O-CB 3.45Å; E366-A370 PolarHBondContact O-N 3.08Å
367	T	98.3	Very high	94.7	Very high	3 Å²	3	51.4 Å²	51.4	2%	0.018	26%	0.261	C	S	.	.	H	α-helix	trans	-61.5	-46.4	176.4	-59.6	0	0	0	0	111	Q132 I136 L332 K363 L364 S365 A370 Y371	Q132-T367 HydrophobicContact CB-CG2 4.03Å; Q132-T367 HydrophobicContact CG-CG2 4.13Å; I136-T367 HydrophobicContact CD1-CG2 3.79Å; I136-T367 HydrophobicContact CG1-CG2 3.69Å; L332-T367 HydrophobicContact CD1-CG2 4.35Å; L332-T367 HydrophobicContact CD2-CG2 4.01Å; K363-T367 WeakPolarHBondContact O-CB 3.47Å; K363-T367 PolarHBondContact O-N 3.46Å; K363-T367 PolarHBondContact O-OG1 3.36Å; L364-T367 WeakPolarHBondContact O-CB 3.42Å; L364-T367 PolarHBondContact O-N 3.18Å; S365-T367 VanDerWaalsContact C-N 3.35Å; T367-A370 PolarHBondContact O-N 2.72Å; T367-Y371 PolarHBondContact O-N 3.07Å
368	L	97.8	Very high	93.7	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-61.8	-46.4	176.2	177.8	58.8	0	0	0	112.2	E329 L332 I336 L364 S365 A370 Y371 I372 Y383 M386	E329-L368 HydrophobicContact CB-CD1 4.13Å; E329-L368 HydrophobicContact CG-CD1 4.07Å; L332-L368 HydrophobicContact CB-CB 4.22Å; L332-L368 HydrophobicContact CB-CD1 4.07Å; L332-L368 HydrophobicContact CD1-CB 3.97Å; L332-L368 HydrophobicContact CD1-CD1 3.88Å; I336-L368 HydrophobicContact CD1-CB 4.28Å; I336-L368 HydrophobicContact CD1-CD2 3.76Å; L364-L368 WeakPolarHBondContact O-CB 3.39Å; L364-L368 PolarHBondContact O-N 3.01Å; S365-L368 PolarHBondContact O-N 2.96Å; L368-A370 VanDerWaalsContact C-N 3.29Å; L368-A370 PolarHBondContact O-N 2.88Å; L368-Y371 PolarHBondContact O-N 3.39Å; L368-I372 HydrophobicContact CD1-CD1 3.81Å; L368-I372 HydrophobicContact CD1-CG1 4.08Å; L368-I372 HydrophobicContact CG-CD1 3.8Å; L368-I372 HydrophobicContact CG-CG1 4.47Å; L368-I372 VanDerWaalsContact O-CG1 3.31Å; L368-I372 WeakPolarHBondContact O-CG1 3.34Å; L368-I372 PolarHBondContact O-N 3.19Å; L368-Y383 HydrophobicContact CD2-CD2 3.95Å; L368-Y383 HydrophobicContact CD2-CE2 3.98Å; L368-Y383 HydrophobicContact CG-CD2 4.08Å; L368-Y383 HydrophobicContact CG-CE2 4.31Å; L368-M386 HydrophobicContact CD1-CE 3.79Å; L368-M386 HydrophobicContact CD1-SD 4.22Å; L368-M386 HydrophobicContact CD2-CE 3.65Å; L368-M386 HydrophobicContact CD2-SD 4.2Å; L368-M386 HydrophobicContact CG-CE 4.31Å
369	Q	95.9	Very high	92.8	Very high	62 Å²	62	51.5 Å²	51.5	29%	0.29	29%	0.29	S	S	.	.	H	α-helix	trans	-62.2	-37.9	176.8	-71.6	178	64.2	0	0	112.2	S365 E366 R373 Y383	S365-Q369 VanDerWaalsContact O-CG 3.31Å; S365-Q369 WeakPolarHBondContact O-CG 3.34Å; S365-Q369 PolarHBondContact O-N 3.13Å; S365-Q369 PolarHBondContact O-NE2 3.31Å; E366-Q369 PolarHBondContact O-N 3.44Å; Q369-R373 WeakPolarHBondContact O-CB 3.27Å; Q369-R373 VanDerWaalsContact O-CG 3.28Å; Q369-R373 WeakPolarHBondContact O-CG 3.33Å; Q369-R373 PolarHBondContact O-N 2.84Å; Q369-R373 PolarHBondContact O-NE 3.29Å; Q369-Y383 HydrophobicContact CG-CD1 3.94Å; Q369-Y383 HydrophobicContact CG-CD2 3.39Å; Q369-Y383 HydrophobicContact CG-CE1 4.01Å; Q369-Y383 HydrophobicContact CG-CE2 3.46Å; Q369-Y383 VanDerWaalsContact CG-CE2 3.46Å; Q369-Y383 HydrophobicContact CG-CG 3.64Å
370	A	95.4	Very high	91.9	Very high	14 Å²	14	57.6 Å²	57.6	12%	0.116	31%	0.308	C	S	.	.	H	α-helix	trans	-65.2	-43.1	176.1	0	0	0	0	0	111.7	L128 E366 T367 L368 R373 L374	L128-A370 HydrophobicContact CD2-CB 3.69Å; E366-A370 WeakPolarHBondContact O-CB 3.45Å; E366-A370 PolarHBondContact O-N 3.08Å; T367-A370 PolarHBondContact O-N 2.72Å; L368-A370 VanDerWaalsContact C-N 3.29Å; L368-A370 PolarHBondContact O-N 2.88Å; A370-R373 PolarHBondContact O-N 3.34Å; A370-L374 PolarHBondContact O-N 3.07Å
371	Y	96.9	Very high	91.7	Very high	11 Å²	11	61.7 Å²	61.7	4%	0.043	33%	0.33	C	S	.	.	H	α-helix	trans	-61.5	-50.2	175.4	-174.7	-83.3	0	0	0	111.4	L128 I136 H326 E328 E329 T367 L368 R373 L374 H375	L128-Y371 HydrophobicContact CD1-CD2 4.12Å; I136-Y371 HydrophobicContact CD1-CD2 3.74Å; I136-Y371 HydrophobicContact CD1-CG 4.38Å; H326-Y371 HydrophobicContact CB-CE1 4.15Å; H326-Y371 AromaticContact ND1-CE1 3.54Å; H326-Y371 AromaticContact ND1-CZ 3.72Å; H326-Y371 PolarHBondContact ND1-OH 3.2Å; E328-Y371 HydrophobicContact CB-CD2 4.16Å; E328-Y371 HydrophobicContact CB-CE1 4.15Å; E328-Y371 HydrophobicContact CB-CE2 3.61Å; E328-Y371 HydrophobicContact CG-CE2 3.69Å; E328-Y371 PolarHBondContact OE1-OH 2.79Å; E328-Y371 PolarHBondContact OE2-OH 3.3Å; E329-Y371 HydrophobicContact CG-CD1 3.6Å; E329-Y371 HydrophobicContact CG-CE1 3.63Å; T367-Y371 PolarHBondContact O-N 3.07Å; L368-Y371 PolarHBondContact O-N 3.39Å; Y371-R373 VanDerWaalsContact C-N 3.32Å; Y371-R373 PolarHBondContact O-N 2.94Å; Y371-L374 PolarHBondContact O-N 3.33Å; Y371-H375 HydrophobicContact CD1-CB 4.39Å; Y371-H375 AromaticContact CD1-CD2 3.92Å; Y371-H375 AromaticContact CD2-CD2 3.59Å; Y371-H375 AromaticContact CD2-NE2 3.93Å; Y371-H375 HydrophobicContact CE1-CB 3.97Å; Y371-H375 AromaticContact CE1-CD2 3.75Å; Y371-H375 AromaticContact CE1-CG 3.94Å; Y371-H375 AromaticContact CE2-CD2 3.46Å; Y371-H375 VanDerWaalsContact CE2-CD2 3.46Å; Y371-H375 WeakPolarHBondContact CE2-CD2 3.39Å; Y371-H375 AromaticContact CE2-NE2 3.62Å; Y371-H375 AromaticContact CG-CD2 3.84Å; Y371-H375 AromaticContact CZ-CD2 3.53Å; Y371-H375 AromaticContact CZ-CG 3.84Å; Y371-H375 AromaticContact CZ-NE2 4Å; Y371-H375 PolarHBondContact O-CD2 3.46Å; Y371-H375 VanDerWaalsContact O-CD2 3.32Å; Y371-H375 PolarHBondContact O-N 3.28Å
372	I	95.3	Very high	91.6	Very high	8 Å²	8	61 Å²	61	4%	0.041	33%	0.326	C	S	.	.	H	α-helix	trans	-57.5	-45.4	178.7	-70	166.2	0	0	0	111.1	E329 L368 L374 H375 H376 L382 Y383 M386	E329-I372 VanDerWaalsContact OE1-CG1 3.31Å; E329-I372 WeakPolarHBondContact OE1-CG1 3.45Å; L368-I372 HydrophobicContact CD1-CD1 3.81Å; L368-I372 HydrophobicContact CD1-CG1 4.08Å; L368-I372 HydrophobicContact CG-CD1 3.8Å; L368-I372 HydrophobicContact CG-CG1 4.47Å; L368-I372 VanDerWaalsContact O-CG1 3.31Å; L368-I372 WeakPolarHBondContact O-CG1 3.34Å; L368-I372 PolarHBondContact O-N 3.19Å; I372-L374 PolarHBondContact O-N 3.45Å; I372-H375 PolarHBondContact O-N 3.1Å; I372-H376 HydrophobicContact CG2-CB 4.36Å; I372-H376 WeakPolarHBondContact O-CA 3.27Å; I372-H376 WeakPolarHBondContact O-CB 3.42Å; I372-H376 PolarHBondContact O-N 2.94Å; I372-L382 HydrophobicContact CD1-CG 4.36Å; I372-L382 HydrophobicContact CG1-CD2 4.23Å; I372-L382 HydrophobicContact CG2-CB 4.14Å; I372-L382 HydrophobicContact CG2-CD2 4.18Å; I372-Y383 HydrophobicContact CD1-CD2 4.14Å; I372-M386 HydrophobicContact CD1-SD 3.81Å
373	R	92.1	Very high	91.6	Very high	158 Å²	158	60 Å²	60	60%	0.596	32%	0.317	S	S	*	.	H	α-helix	trans	-60.1	-32.2	178.9	-78.9	-174.2	-64.4	-101.9	1.2	112.9	Q369 A370 Y371	Q369-R373 WeakPolarHBondContact O-CB 3.27Å; Q369-R373 VanDerWaalsContact O-CG 3.28Å; Q369-R373 WeakPolarHBondContact O-CG 3.33Å; Q369-R373 PolarHBondContact O-N 2.84Å; Q369-R373 PolarHBondContact O-NE 3.29Å; A370-R373 PolarHBondContact O-N 3.34Å; Y371-R373 VanDerWaalsContact C-N 3.32Å; Y371-R373 PolarHBondContact O-N 2.94Å
374	L	93.3	Very high	91.5	Very high	61 Å²	61	59 Å²	59	32%	0.319	32%	0.324	S	S	.	.	H	α-helix	trans	-81.7	-42.2	-179	-176.2	58.8	0	0	0	112.2	P126 L128 A370 Y371 I372	P126-L374 HydrophobicContact CB-CD1 4.5Å; P126-L374 HydrophobicContact CG-CD1 4.29Å; P126-L374 WeakPolarHBondContact O-CD1 3.42Å; L128-L374 HydrophobicContact CG-CD2 4.15Å; A370-L374 PolarHBondContact O-N 3.07Å; Y371-L374 PolarHBondContact O-N 3.33Å; I372-L374 PolarHBondContact O-N 3.45Å
375	H	92.8	Very high	91.4	Very high	83 Å²	83	64.1 Å²	64.1	38%	0.384	35%	0.345	S	S	.	.	H	α-helix	trans	-99	-18.6	-169.2	-68.7	-79.8	0	0	0	114.3	Y371 I372 P377	Y371-H375 HydrophobicContact CD1-CB 4.39Å; Y371-H375 AromaticContact CD1-CD2 3.92Å; Y371-H375 AromaticContact CD2-CD2 3.59Å; Y371-H375 AromaticContact CD2-NE2 3.93Å; Y371-H375 HydrophobicContact CE1-CB 3.97Å; Y371-H375 AromaticContact CE1-CD2 3.75Å; Y371-H375 AromaticContact CE1-CG 3.94Å; Y371-H375 AromaticContact CE2-CD2 3.46Å; Y371-H375 VanDerWaalsContact CE2-CD2 3.46Å; Y371-H375 WeakPolarHBondContact CE2-CD2 3.39Å; Y371-H375 AromaticContact CE2-NE2 3.62Å; Y371-H375 AromaticContact CG-CD2 3.84Å; Y371-H375 AromaticContact CZ-CD2 3.53Å; Y371-H375 AromaticContact CZ-CG 3.84Å; Y371-H375 AromaticContact CZ-NE2 4Å; Y371-H375 PolarHBondContact O-CD2 3.46Å; Y371-H375 VanDerWaalsContact O-CD2 3.32Å; Y371-H375 PolarHBondContact O-N 3.28Å; I372-H375 PolarHBondContact O-N 3.1Å; H375-P377 VanDerWaalsContact C-CD 3.43Å; H375-P377 WeakPolarHBondContact O-CD 3.45Å
376	H	90.2	Very high	91.4	Very high	43 Å²	43	63.6 Å²	63.6	20%	0.199	34%	0.342	C	S	.	.			trans	-123.2	69.8	178.5	-63.1	-82	0	0	0	112.1	H326 E329 I372 G378 G379 L382	H326-H376 AromaticContact CD2-NE2 3.99Å; H326-H376 AromaticContact CE1-CE1 3.85Å; H326-H376 AromaticContact CE1-NE2 3.68Å; H326-H376 AromaticContact ND1-NE2 3.94Å; H326-H376 AromaticContact NE2-CE1 3.53Å; H326-H376 AromaticContact NE2-NE2 3.72Å; E329-H376 VanDerWaalsContact CD-NE2 3.29Å; E329-H376 IonicContact OE1-CD2 3.37Å; E329-H376 PolarHBondContact OE1-CD2 2.95Å; E329-H376 IonicContact OE1-NE2 3.28Å; E329-H376 PolarHBondContact OE1-NE2 3.06Å; E329-H376 IonicContact OE2-CE1 3.72Å; E329-H376 IonicContact OE2-NE2 3.69Å; E329-H376 PolarHBondContact OE2-NE2 3.33Å; E329-H376 VanDerWaalsContact OE2-NE2 3.11Å; I372-H376 HydrophobicContact CG2-CB 4.36Å; I372-H376 WeakPolarHBondContact O-CA 3.27Å; I372-H376 WeakPolarHBondContact O-CB 3.42Å; I372-H376 PolarHBondContact O-N 2.94Å; H376-G378 PolarHBondContact O-N 3.17Å; H376-G379 PolarHBondContact O-N 3.31Å; H376-L382 HydrophobicContact CB-CD2 4.36Å
377	P	75.1	Confident	91.3	Very high	123 Å²	123	60.8 Å²	60.8	80%	0.799	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	94	175.4	26.6	-32.3	0	0	0	110.4	H375	H375-P377 VanDerWaalsContact C-CD 3.43Å; H375-P377 WeakPolarHBondContact O-CD 3.45Å
378	G	73	Confident	91.1	Very high	79 Å²	79	65.8 Å²	65.8	81%	0.814	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	126.3	-12.6	-173.1	0	0	0	0	0	114	H376 Q380	H376-G378 PolarHBondContact O-N 3.17Å; G378-Q380 PolarHBondContact O-N 2.92Å
379	G	75.5	Confident	91.1	Very high	24 Å²	24	67.1 Å²	67.1	25%	0.247	36%	0.359	C	S	.	.			trans	-77.8	41.7	175.7	0	0	0	0	0	113.7	H376 L381 L382	H376-G379 PolarHBondContact O-N 3.31Å; G379-L381 PolarHBondContact O-N 2.87Å; G379-L382 VanDerWaalsContact O-CB 3.29Å; G379-L382 WeakPolarHBondContact O-CB 3.22Å; G379-L382 PolarHBondContact O-N 3.26Å
380	Q	77.3	Confident	91	Very high	186 Å²	186	65.1 Å²	65.1	87%	0.869	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-23.6	-169.7	-165.9	160.9	6.7	0	0	113.8	G378	G378-Q380 PolarHBondContact O-N 2.92Å
381	L	92.6	Very high	90.9	Very high	116 Å²	116	66.7 Å²	66.7	61%	0.607	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	2.6	177.2	-58.5	178.2	0	0	0	113.6	G379 A384 K385	G379-L381 PolarHBondContact O-N 2.87Å; L381-A384 PolarHBondContact O-N 3.42Å; L381-K385 VanDerWaalsContact O-CG 3.3Å; L381-K385 WeakPolarHBondContact O-CG 3.26Å; L381-K385 PolarHBondContact O-N 3.3Å
382	L	95.7	Very high	90.7	Very high	16 Å²	16	68.6 Å²	68.6	8%	0.084	37%	0.374	C	S	.	.	H	α-helix	trans	-61.9	-48.2	-176	-179.9	57.9	0	0	0	111.1	L323 L325 I372 H376 G379 A384 K385 M386	L323-L382 HydrophobicContact CB-CD1 4.33Å; L323-L382 HydrophobicContact CD2-CD1 4.5Å; L325-L382 HydrophobicContact CD2-CD1 4.01Å; I372-L382 HydrophobicContact CD1-CG 4.36Å; I372-L382 HydrophobicContact CG1-CD2 4.23Å; I372-L382 HydrophobicContact CG2-CB 4.14Å; I372-L382 HydrophobicContact CG2-CD2 4.18Å; H376-L382 HydrophobicContact CB-CD2 4.36Å; G379-L382 VanDerWaalsContact O-CB 3.29Å; G379-L382 WeakPolarHBondContact O-CB 3.22Å; G379-L382 PolarHBondContact O-N 3.26Å; L382-A384 PolarHBondContact O-N 3.47Å; L382-K385 WeakPolarHBondContact O-CB 3.19Å; L382-K385 PolarHBondContact O-N 3.38Å; L382-K385 VanDerWaalsContact O-N 3.13Å; L382-M386 HydrophobicContact CD1-CG 4.3Å; L382-M386 HydrophobicContact CD1-SD 4.45Å; L382-M386 HydrophobicContact CG-CG 4.5Å; L382-M386 HydrophobicContact CG-SD 4.16Å; L382-M386 WeakPolarHBondContact O-CG 3.29Å; L382-M386 PolarHBondContact O-N 2.8Å
383	Y	95.7	Very high	90.7	Very high	58 Å²	58	68.2 Å²	68.2	23%	0.227	37%	0.372	C	S	.	.	H	α-helix	trans	-55.1	-50	176.2	179.7	-102.8	0	0	0	111.7	S365 L368 Q369 I372 K385 M386 I387	S365-Y383 WeakPolarHBondContact CB-OH 3.33Å; L368-Y383 HydrophobicContact CD2-CD2 3.95Å; L368-Y383 HydrophobicContact CD2-CE2 3.98Å; L368-Y383 HydrophobicContact CG-CD2 4.08Å; L368-Y383 HydrophobicContact CG-CE2 4.31Å; Q369-Y383 HydrophobicContact CG-CD1 3.94Å; Q369-Y383 HydrophobicContact CG-CD2 3.39Å; Q369-Y383 HydrophobicContact CG-CE1 4.01Å; Q369-Y383 HydrophobicContact CG-CE2 3.46Å; Q369-Y383 VanDerWaalsContact CG-CE2 3.46Å; Q369-Y383 HydrophobicContact CG-CG 3.64Å; I372-Y383 HydrophobicContact CD1-CD2 4.14Å; Y383-K385 VanDerWaalsContact C-N 3.31Å; Y383-K385 PolarHBondContact O-N 2.84Å; Y383-M386 WeakPolarHBondContact O-CB 3.48Å; Y383-M386 PolarHBondContact O-N 3.2Å; Y383-M386 VanDerWaalsContact O-N 3.1Å; Y383-I387 HydrophobicContact CD1-CG1 4.21Å; Y383-I387 HydrophobicContact CD2-CG1 4.45Å; Y383-I387 HydrophobicContact CE1-CD1 4.47Å; Y383-I387 HydrophobicContact CE1-CG1 3.77Å; Y383-I387 HydrophobicContact CE2-CD1 4Å; Y383-I387 HydrophobicContact CE2-CG1 4.04Å; Y383-I387 WeakPolarHBondContact O-CG1 3.39Å; Y383-I387 PolarHBondContact O-N 2.84Å
384	A	95.7	Very high	90.7	Very high	57 Å²	57	63 Å²	63	47%	0.471	35%	0.353	S	S	.	.	H	α-helix	trans	-59.7	-40.6	178.4	0	0	0	0	0	112.4	L381 L382 I387 Q388	L381-A384 PolarHBondContact O-N 3.42Å; L382-A384 PolarHBondContact O-N 3.47Å; A384-I387 PolarHBondContact O-N 3.42Å; A384-Q388 WeakPolarHBondContact O-CB 3.25Å; A384-Q388 PolarHBondContact O-N 3.38Å
385	K	96.8	Very high	90.6	Very high	116 Å²	116	63.8 Å²	63.8	50%	0.504	36%	0.363	S	S	.	.	H	α-helix	trans	-65.3	-36.4	175.5	-71.8	173.5	-179.4	-179	0	112.6	L323 L381 L382 Y383 K389	L323-K385 HydrophobicContact CD2-CB 3.81Å; L323-K385 HydrophobicContact CD2-CD 3.98Å; L323-K385 HydrophobicContact CD2-CG 4.47Å; L381-K385 VanDerWaalsContact O-CG 3.3Å; L381-K385 WeakPolarHBondContact O-CG 3.26Å; L381-K385 PolarHBondContact O-N 3.3Å; L382-K385 WeakPolarHBondContact O-CB 3.19Å; L382-K385 PolarHBondContact O-N 3.38Å; L382-K385 VanDerWaalsContact O-N 3.13Å; Y383-K385 VanDerWaalsContact C-N 3.31Å; Y383-K385 PolarHBondContact O-N 2.84Å; K385-K389 PolarHBondContact O-N 2.98Å
386	M	97.1	Very high	90.7	Very high	0 Å²	0	60 Å²	60	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-67.5	-45	175.1	-68.7	174.9	70.2	0	0	111.4	L323 L325 E329 L333 L368 I372 L382 Y383 Q388 K389 L390	L323-M386 HydrophobicContact CD1-CG 4.06Å; L325-M386 HydrophobicContact CD1-CE 4.08Å; L325-M386 HydrophobicContact CD2-CE 4.12Å; L325-M386 HydrophobicContact CD2-CG 3.86Å; L325-M386 HydrophobicContact CD2-SD 3.76Å; E329-M386 HydrophobicContact CB-CE 3.87Å; E329-M386 HydrophobicContact CB-SD 4.45Å; E329-M386 VanDerWaalsContact O-CE 3.29Å; E329-M386 WeakPolarHBondContact O-CE 3.3Å; L333-M386 HydrophobicContact CB-CE 3.89Å; L333-M386 HydrophobicContact CD1-CB 4.11Å; L333-M386 HydrophobicContact CD1-CE 4.32Å; L333-M386 HydrophobicContact CD2-CB 4.38Å; L333-M386 HydrophobicContact CD2-CE 4.12Å; L333-M386 HydrophobicContact CG-CE 4.35Å; L368-M386 HydrophobicContact CD1-CE 3.79Å; L368-M386 HydrophobicContact CD1-SD 4.22Å; L368-M386 HydrophobicContact CD2-CE 3.65Å; L368-M386 HydrophobicContact CD2-SD 4.2Å; L368-M386 HydrophobicContact CG-CE 4.31Å; I372-M386 HydrophobicContact CD1-SD 3.81Å; L382-M386 HydrophobicContact CD1-CG 4.3Å; L382-M386 HydrophobicContact CD1-SD 4.45Å; L382-M386 HydrophobicContact CG-CG 4.5Å; L382-M386 HydrophobicContact CG-SD 4.16Å; L382-M386 WeakPolarHBondContact O-CG 3.29Å; L382-M386 PolarHBondContact O-N 2.8Å; Y383-M386 WeakPolarHBondContact O-CB 3.48Å; Y383-M386 PolarHBondContact O-N 3.2Å; Y383-M386 VanDerWaalsContact O-N 3.1Å; M386-Q388 VanDerWaalsContact C-N 3.3Å; M386-Q388 PolarHBondContact O-N 3.08Å; M386-K389 VanDerWaalsContact O-CB 3.31Å; M386-K389 WeakPolarHBondContact O-CB 3.45Å; M386-K389 PolarHBondContact O-N 3.04Å; M386-L390 PolarHBondContact O-N 2.83Å
387	I	94.6	Very high	90.9	Very high	58 Å²	58	59.1 Å²	59.1	30%	0.297	34%	0.342	S	S	.	.	H	α-helix	trans	-64	-37	176.1	-60.2	-53	0	0	0	111.3	Y383 A384 K389 L390 A391	Y383-I387 HydrophobicContact CD1-CG1 4.21Å; Y383-I387 HydrophobicContact CD2-CG1 4.45Å; Y383-I387 HydrophobicContact CE1-CD1 4.47Å; Y383-I387 HydrophobicContact CE1-CG1 3.77Å; Y383-I387 HydrophobicContact CE2-CD1 4Å; Y383-I387 HydrophobicContact CE2-CG1 4.04Å; Y383-I387 WeakPolarHBondContact O-CG1 3.39Å; Y383-I387 PolarHBondContact O-N 2.84Å; A384-I387 PolarHBondContact O-N 3.42Å; I387-K389 PolarHBondContact O-N 3.18Å; I387-L390 HydrophobicContact CD1-CD1 4.17Å; I387-L390 WeakPolarHBondContact O-CA 3.47Å; I387-L390 WeakPolarHBondContact O-CB 3.45Å; I387-L390 PolarHBondContact O-N 3.05Å; I387-A391 PolarHBondContact O-N 3.24Å
388	Q	95.3	Very high	91.7	Very high	108 Å²	108	59.1 Å²	59.1	51%	0.505	33%	0.332	S	S	.	.	H	α-helix	trans	-58.1	-32.4	172.4	-175.9	59.8	58.9	0	0	112.2	A384 M386 L390 A391 D392	A384-Q388 WeakPolarHBondContact O-CB 3.25Å; A384-Q388 PolarHBondContact O-N 3.38Å; M386-Q388 VanDerWaalsContact C-N 3.3Å; M386-Q388 PolarHBondContact O-N 3.08Å; Q388-L390 VanDerWaalsContact C-N 3.29Å; Q388-L390 PolarHBondContact O-N 3.36Å; Q388-A391 WeakPolarHBondContact O-CB 3.09Å; Q388-A391 PolarHBondContact O-N 3.12Å; Q388-D392 PolarHBondContact NE2-OD1 3.13Å; Q388-D392 PolarHBondContact O-N 3.38Å
389	K	96.6	Very high	92.7	Very high	28 Å²	28	57 Å²	57	12%	0.122	30%	0.301	C	S	.	.	H	α-helix	trans	-66.7	-30.4	174.2	-67.6	-69	156.4	-150.1	0	112.8	F316 L320 L323 K385 M386 I387 A391 D392 L393	F316-K389 HydrophobicContact CD2-CD 3.89Å; F316-K389 HydrophobicContact CE2-CB 3.92Å; F316-K389 HydrophobicContact CE2-CD 3.91Å; F316-K389 HydrophobicContact CE2-CG 4.48Å; F316-K389 WeakPolarHBondContact CE2-O 3.34Å; L320-K389 HydrophobicContact CD1-CG 4.4Å; L323-K389 HydrophobicContact CD1-CG 4.1Å; K385-K389 PolarHBondContact O-N 2.98Å; M386-K389 VanDerWaalsContact O-CB 3.31Å; M386-K389 WeakPolarHBondContact O-CB 3.45Å; M386-K389 PolarHBondContact O-N 3.04Å; I387-K389 PolarHBondContact O-N 3.18Å; K389-A391 VanDerWaalsContact C-N 3.33Å; K389-D392 IonicContact NZ-OD2 2.73Å; K389-D392 PolarHBondContact NZ-OD2 2.88Å; K389-D392 PolarHBondContact O-N 2.86Å; K389-L393 WeakPolarHBondContact O-CG 3.46Å; K389-L393 PolarHBondContact O-N 3.49Å; K389-L393 VanDerWaalsContact O-N 3.14Å
390	L	94.8	Very high	93.6	Very high	21 Å²	21	56.5 Å²	56.5	11%	0.11	29%	0.292	C	S	.	.	H	α-helix	trans	-68.7	-33.9	172.5	-56.8	-173.9	0	0	0	112	L273 L333 I336 C337 M386 I387 Q388 L393 R394	L273-L390 HydrophobicContact CD1-CD2 4.25Å; L333-L390 HydrophobicContact CD1-CD1 3.92Å; L333-L390 HydrophobicContact CD1-CD2 3.61Å; L333-L390 HydrophobicContact CD1-CG 3.71Å; L333-L390 HydrophobicContact CG-CD2 3.98Å; I336-L390 HydrophobicContact CB-CD1 4.4Å; I336-L390 HydrophobicContact CG2-CD1 3.61Å; C337-L390 HydrophobicContact CB-CD2 3.7Å; M386-L390 PolarHBondContact O-N 2.83Å; I387-L390 HydrophobicContact CD1-CD1 4.17Å; I387-L390 WeakPolarHBondContact O-CA 3.47Å; I387-L390 WeakPolarHBondContact O-CB 3.45Å; I387-L390 PolarHBondContact O-N 3.05Å; Q388-L390 VanDerWaalsContact C-N 3.29Å; Q388-L390 PolarHBondContact O-N 3.36Å; L390-L393 HydrophobicContact CD2-CD1 4.04Å; L390-L393 WeakPolarHBondContact O-CB 3.41Å; L390-L393 PolarHBondContact O-N 3.44Å; L390-R394 PolarHBondContact O-N 3.44Å
391	A	92.2	Very high	94.4	Very high	47 Å²	47	49.7 Å²	49.7	39%	0.388	27%	0.265	S	S	.	.	H	α-helix	trans	-67.2	-43.4	172.9	0	0	0	0	0	111.7	I387 Q388 K389 L393 R394	I387-A391 PolarHBondContact O-N 3.24Å; Q388-A391 WeakPolarHBondContact O-CB 3.09Å; Q388-A391 PolarHBondContact O-N 3.12Å; K389-A391 VanDerWaalsContact C-N 3.33Å; A391-L393 PolarHBondContact O-N 2.82Å; A391-R394 WeakPolarHBondContact O-CB 3.47Å; A391-R394 PolarHBondContact O-N 3.41Å; A391-R394 VanDerWaalsContact O-N 3.08Å
392	D	93.7	Very high	94.4	Very high	51 Å²	51	48.6 Å²	48.6	27%	0.273	26%	0.255	S	S	.	.	H	α-helix	trans	-56.5	-36.2	174.6	-62.4	-11.1	0	0	0	111.4	F316 Q388 K389 R394 L396	F316-D392 HydrophobicContact CD2-CB 3.98Å; Q388-D392 PolarHBondContact NE2-OD1 3.13Å; Q388-D392 PolarHBondContact O-N 3.38Å; K389-D392 IonicContact NZ-OD2 2.73Å; K389-D392 PolarHBondContact NZ-OD2 2.88Å; K389-D392 PolarHBondContact O-N 2.86Å; D392-R394 VanDerWaalsContact C-N 3.34Å; D392-R394 PolarHBondContact O-N 3.2Å; D392-L396 PolarHBondContact O-N 2.81Å
393	L	94.7	Very high	94.3	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-67.2	-29.4	178	-74.4	167.9	0	0	0	113.7	E269 M272 L273 F316 K389 L390 A391 L396 N397	E269-L393 HydrophobicContact CB-CB 4.18Å; E269-L393 HydrophobicContact CB-CD1 4.19Å; E269-L393 HydrophobicContact CB-CD2 4.35Å; E269-L393 HydrophobicContact CB-CG 4.47Å; E269-L393 HydrophobicContact CG-CB 4.06Å; M272-L393 HydrophobicContact CB-CD2 3.84Å; M272-L393 HydrophobicContact SD-CD2 4.19Å; L273-L393 HydrophobicContact CD1-CD1 3.6Å; L273-L393 HydrophobicContact CD2-CD1 4.03Å; L273-L393 HydrophobicContact CG-CD1 3.55Å; F316-L393 HydrophobicContact CD2-CD2 4.32Å; F316-L393 HydrophobicContact CD2-CG 4.35Å; F316-L393 HydrophobicContact CE1-CD2 3.96Å; F316-L393 HydrophobicContact CE2-CD1 4.07Å; F316-L393 HydrophobicContact CE2-CD2 3.72Å; F316-L393 HydrophobicContact CE2-CG 3.58Å; F316-L393 HydrophobicContact CZ-CD1 3.96Å; F316-L393 HydrophobicContact CZ-CD2 3.51Å; F316-L393 HydrophobicContact CZ-CG 3.75Å; K389-L393 WeakPolarHBondContact O-CG 3.46Å; K389-L393 PolarHBondContact O-N 3.49Å; K389-L393 VanDerWaalsContact O-N 3.14Å; L390-L393 HydrophobicContact CD2-CD1 4.04Å; L390-L393 WeakPolarHBondContact O-CB 3.41Å; L390-L393 PolarHBondContact O-N 3.44Å; A391-L393 PolarHBondContact O-N 2.82Å; L393-L396 HydrophobicContact CD2-CD1 4.11Å; L393-L396 PolarHBondContact O-N 3.27Å; L393-N397 VanDerWaalsContact O-CB 3.29Å; L393-N397 WeakPolarHBondContact O-CB 3.05Å; L393-N397 PolarHBondContact O-N 3.1Å
394	R	91.3	Very high	94.1	Very high	49 Å²	49	46.2 Å²	46.2	19%	0.185	25%	0.245	C	C	.	.	H	α-helix	trans	-63	-47.7	177.5	-62	-53	-169.8	132.1	0.2	111.2	E269 S340 L390 A391 D392 L396 N397 E398	E269-R394 WeakPolarHBondContact OE1-CD 3.44Å; E269-R394 IonicContact OE1-NE 2.99Å; S340-R394 PolarHBondContact OG-NH2 3.26Å; L390-R394 PolarHBondContact O-N 3.44Å; A391-R394 WeakPolarHBondContact O-CB 3.47Å; A391-R394 PolarHBondContact O-N 3.41Å; A391-R394 VanDerWaalsContact O-N 3.08Å; D392-R394 VanDerWaalsContact C-N 3.34Å; D392-R394 PolarHBondContact O-N 3.2Å; R394-L396 VanDerWaalsContact C-N 3.32Å; R394-L396 PolarHBondContact O-N 2.89Å; R394-N397 WeakPolarHBondContact O-CB 3.47Å; R394-N397 PolarHBondContact O-N 2.92Å; R394-E398 WeakPolarHBondContact O-CG 3.46Å; R394-E398 PolarHBondContact O-N 3.41Å
395	S	92.1	Very high	93.9	Very high	77 Å²	77	49.5 Å²	49.5	54%	0.538	25%	0.245	S	C	.	.	H	α-helix	trans	-64.1	-37.3	175.9	-55.4	0	0	0	0	112.4	E399	S395-E399 PolarHBondContact O-N 3.3Å; S395-E399 VanDerWaalsContact O-N 3.11Å
396	L	95.1	Very high	93.6	Very high	4 Å²	4	47.7 Å²	47.7	2%	0.021	25%	0.247	C	C	.	.	H	α-helix	trans	-64	-40.4	174	-78.4	167.7	0	0	0	112.4	M272 L309 P312 L313 F316 D392 L393 R394 H400	M272-L396 HydrophobicContact CE-CB 4.28Å; M272-L396 HydrophobicContact SD-CB 3.82Å; M272-L396 HydrophobicContact SD-CD1 4.13Å; M272-L396 HydrophobicContact SD-CG 4.43Å; L309-L396 HydrophobicContact CD1-CD2 4.01Å; P312-L396 HydrophobicContact CB-CD2 3.76Å; P312-L396 HydrophobicContact CB-CG 4.49Å; L313-L396 HydrophobicContact CB-CD2 3.95Å; L313-L396 HydrophobicContact CD1-CD1 4.48Å; F316-L396 HydrophobicContact CB-CD1 3.77Å; F316-L396 HydrophobicContact CD1-CD1 4.32Å; F316-L396 HydrophobicContact CD2-CD1 4.19Å; F316-L396 HydrophobicContact CG-CD1 3.83Å; D392-L396 PolarHBondContact O-N 2.81Å; L393-L396 HydrophobicContact CD2-CD1 4.11Å; L393-L396 PolarHBondContact O-N 3.27Å; R394-L396 VanDerWaalsContact C-N 3.32Å; R394-L396 PolarHBondContact O-N 2.89Å; L396-H400 VanDerWaalsContact O-CB 3.22Å; L396-H400 WeakPolarHBondContact O-CB 3.23Å; L396-H400 PolarHBondContact O-N 3.02Å
397	N	93.3	Very high	93.2	Very high	23 Å²	23	48.2 Å²	48.2	12%	0.123	25%	0.25	C	S	.	.	H	α-helix	trans	-66.9	-42.7	178.8	-172.5	14.2	0	0	0	111.7	S265 I268 E269 L393 R394 H400 S401	S265-N397 PolarHBondContact O-ND2 3.32Å; I268-N397 HydrophobicContact CG2-CB 4.27Å; I268-N397 WeakPolarHBondContact CG2-OD1 3.33Å; E269-N397 HydrophobicContact CG-CB 3.93Å; E269-N397 PolarHBondContact OE1-ND2 2.98Å; L393-N397 VanDerWaalsContact O-CB 3.29Å; L393-N397 WeakPolarHBondContact O-CB 3.05Å; L393-N397 PolarHBondContact O-N 3.1Å; R394-N397 WeakPolarHBondContact O-CB 3.47Å; R394-N397 PolarHBondContact O-N 2.92Å; N397-H400 PolarHBondContact O-N 3.31Å; N397-S401 VanDerWaalsContact O-CB 3.26Å; N397-S401 WeakPolarHBondContact O-CB 3.12Å; N397-S401 PolarHBondContact O-N 3.48Å; N397-S401 PolarHBondContact O-OG 2.83Å
398	E	92.3	Very high	92.9	Very high	124 Å²	124	46.8 Å²	46.8	58%	0.579	25%	0.245	S	C	*	.	H	α-helix	trans	-59.1	-49	174.3	-73.7	172.9	-168.5	0	0	111.9	R394 S401 K402	R394-E398 WeakPolarHBondContact O-CG 3.46Å; R394-E398 PolarHBondContact O-N 3.41Å; E398-S401 PolarHBondContact O-N 2.91Å; E398-K402 PolarHBondContact O-N 3.31Å
399	E	94.6	Very high	92.5	Very high	34 Å²	34	49 Å²	49	16%	0.159	25%	0.253	C	S	.	.	H	α-helix	trans	-68.4	-39.7	179.8	-174.6	54.8	-143.5	0	0	111.6	E308 L309 S395 S401 K402 Q403	E308-E399 HydrophobicContact CB-CG 4.36Å; L309-E399 HydrophobicContact CB-CG 4Å; L309-E399 HydrophobicContact CD1-CB 4.22Å; L309-E399 HydrophobicContact CD1-CG 4.27Å; S395-E399 PolarHBondContact O-N 3.3Å; S395-E399 VanDerWaalsContact O-N 3.11Å; E399-S401 VanDerWaalsContact C-N 3.34Å; E399-S401 PolarHBondContact O-N 3.02Å; E399-K402 PolarHBondContact O-N 2.75Å; E399-K402 IonicContact OE1-NZ 2.83Å; E399-K402 PolarHBondContact OE1-NZ 3.22Å; E399-K402 IonicContact OE2-NZ 3.64Å; E399-K402 PolarHBondContact OE2-NZ 2.85Å; E399-Q403 WeakPolarHBondContact O-CG 3.36Å; E399-Q403 PolarHBondContact O-N 3.31Å; E399-Q403 WeakPolarHBondContact OE1-CG 3.35Å; E399-Q403 PolarHBondContact OE1-NE2 3.22Å
400	H	94.9	Very high	92.1	Very high	13 Å²	13	51.5 Å²	51.5	6%	0.06	27%	0.266	C	S	.	.	H	α-helix	trans	-57.6	-47.5	171.6	169.7	-92	0	0	0	111.1	M272 L309 L396 N397 K402 Q403 Y404 F425	M272-H400 HydrophobicContact CE-CB 4.35Å; L309-H400 HydrophobicContact CD1-CB 4.08Å; L309-H400 HydrophobicContact CD2-CB 4.25Å; L396-H400 VanDerWaalsContact O-CB 3.22Å; L396-H400 WeakPolarHBondContact O-CB 3.23Å; L396-H400 PolarHBondContact O-N 3.02Å; N397-H400 PolarHBondContact O-N 3.31Å; H400-K402 VanDerWaalsContact C-N 3.32Å; H400-K402 PolarHBondContact O-N 2.9Å; H400-Q403 PolarHBondContact O-N 3.14Å; H400-Y404 WeakPolarHBondContact O-CB 3.42Å; H400-Y404 PolarHBondContact O-N 3.39Å; H400-F425 AromaticContact CE1-CD2 3.81Å; H400-F425 AromaticContact CE1-CE2 3.89Å
401	S	92.8	Very high	91.7	Very high	43 Å²	43	55 Å²	55	30%	0.301	29%	0.289	S	S	.	.	H	α-helix	trans	-64.4	-35	180	-62.7	0	0	0	0	112.4	N397 E398 E399 R405	N397-S401 VanDerWaalsContact O-CB 3.26Å; N397-S401 WeakPolarHBondContact O-CB 3.12Å; N397-S401 PolarHBondContact O-N 3.48Å; N397-S401 PolarHBondContact O-OG 2.83Å; E398-S401 PolarHBondContact O-N 2.91Å; E399-S401 VanDerWaalsContact C-N 3.34Å; E399-S401 PolarHBondContact O-N 3.02Å; S401-R405 WeakPolarHBondContact O-CB 3.44Å; S401-R405 VanDerWaalsContact O-CG 3.32Å; S401-R405 WeakPolarHBondContact O-CG 3.38Å; S401-R405 PolarHBondContact O-N 3.28Å; S401-R405 VanDerWaalsContact O-N 3.12Å; S401-R405 PolarHBondContact O-NE 3.33Å
402	K	92.9	Very high	91.5	Very high	94 Å²	94	57.4 Å²	57.4	41%	0.409	29%	0.293	S	S	.	.	H	α-helix	trans	-63.8	-50.3	172.3	173.7	177.5	146.7	-125.7	0	111.4	E308 E398 E399 H400 R405 S406	E308-K402 IonicContact OE2-NZ 2.89Å; E308-K402 PolarHBondContact OE2-NZ 3.39Å; E398-K402 PolarHBondContact O-N 3.31Å; E399-K402 PolarHBondContact O-N 2.75Å; E399-K402 IonicContact OE1-NZ 2.83Å; E399-K402 PolarHBondContact OE1-NZ 3.22Å; E399-K402 IonicContact OE2-NZ 3.64Å; E399-K402 PolarHBondContact OE2-NZ 2.85Å; H400-K402 VanDerWaalsContact C-N 3.32Å; H400-K402 PolarHBondContact O-N 2.9Å; K402-R405 PolarHBondContact O-N 3.3Å; K402-S406 PolarHBondContact O-N 3.31Å
403	Q	93.4	Very high	91.3	Very high	13 Å²	13	55.2 Å²	55.2	6%	0.061	28%	0.281	C	S	.	.	H	α-helix	trans	-68.2	-41.2	-179.4	-65.8	-173.3	17.7	0	0	112.2	H305 T306 E399 H400 R405 S406 L407	H305-Q403 VanDerWaalsContact CA-OE1 3.25Å; H305-Q403 PolarHBondContact ND1-OE1 3.08Å; T306-Q403 PolarHBondContact OG1-NE2 3.26Å; E399-Q403 WeakPolarHBondContact O-CG 3.36Å; E399-Q403 PolarHBondContact O-N 3.31Å; E399-Q403 WeakPolarHBondContact OE1-CG 3.35Å; E399-Q403 PolarHBondContact OE1-NE2 3.22Å; H400-Q403 PolarHBondContact O-N 3.14Å; Q403-R405 VanDerWaalsContact C-N 3.33Å; Q403-R405 PolarHBondContact O-N 3.19Å; Q403-S406 WeakPolarHBondContact O-CB 3.48Å; Q403-S406 PolarHBondContact O-N 3.27Å; Q403-S406 VanDerWaalsContact O-N 3.16Å; Q403-L407 WeakPolarHBondContact O-CG 3.12Å; Q403-L407 PolarHBondContact O-N 2.98Å
404	Y	92.7	Very high	91	Very high	11 Å²	11	56.8 Å²	56.8	4%	0.043	29%	0.291	C	S	.	.	H	α-helix	trans	-58.7	-43.1	176	176.7	-95.2	0	0	0	112.4	H400 L407 S408 L417 V421 L422 F425	H400-Y404 WeakPolarHBondContact O-CB 3.42Å; H400-Y404 PolarHBondContact O-N 3.39Å; Y404-L407 PolarHBondContact O-N 2.8Å; Y404-S408 WeakPolarHBondContact O-CB 3.48Å; Y404-S408 PolarHBondContact O-N 3.27Å; Y404-S408 PolarHBondContact O-OG 2.99Å; Y404-L417 HydrophobicContact CE2-CD1 3.75Å; Y404-V421 HydrophobicContact CE2-CG1 3.73Å; Y404-V421 PolarHBondContact OH-O 3.35Å; Y404-L422 WeakPolarHBondContact OH-CA 3.4Å; Y404-F425 HydrophobicContact CD1-CB 3.83Å; Y404-F425 HydrophobicContact CD2-CB 4.28Å; Y404-F425 VanDerWaalsContact CE1-C 3.42Å; Y404-F425 HydrophobicContact CE1-CB 3.59Å; Y404-F425 VanDerWaalsContact CE1-O 3.25Å; Y404-F425 WeakPolarHBondContact CE1-O 3.31Å; Y404-F425 HydrophobicContact CE2-CB 4.05Å; Y404-F425 HydrophobicContact CE2-CD2 4.42Å; Y404-F425 HydrophobicContact CG-CB 4.17Å
405	R	91.2	Very high	91	Very high	126 Å²	126	62.3 Å²	62.3	48%	0.475	32%	0.321	S	S	.	.	H	α-helix	trans	-58.2	-49.6	173.5	-80.3	-176.4	-67.3	174.4	-1.7	111.1	S401 K402 Q403 L407 S408 F409	S401-R405 WeakPolarHBondContact O-CB 3.44Å; S401-R405 VanDerWaalsContact O-CG 3.32Å; S401-R405 WeakPolarHBondContact O-CG 3.38Å; S401-R405 PolarHBondContact O-N 3.28Å; S401-R405 VanDerWaalsContact O-N 3.12Å; S401-R405 PolarHBondContact O-NE 3.33Å; K402-R405 PolarHBondContact O-N 3.3Å; Q403-R405 VanDerWaalsContact C-N 3.33Å; Q403-R405 PolarHBondContact O-N 3.19Å; R405-L407 VanDerWaalsContact C-N 3.28Å; R405-L407 PolarHBondContact O-N 3.16Å; R405-S408 WeakPolarHBondContact CA-OG 3.39Å; R405-S408 PolarHBondContact O-N 3.45Å; R405-S408 PolarHBondContact O-OG 3.3Å; R405-F409 HydrophobicContact CB-CD2 4.31Å; R405-F409 HydrophobicContact CB-CE2 4.03Å; R405-F409 WeakPolarHBondContact O-CD2 2.84Å; R405-F409 PolarHBondContact O-N 3.45Å
406	S	89.4	Confident	90.9	Very high	78 Å²	78	60.5 Å²	60.5	55%	0.545	31%	0.305	S	S	.	.	H	α-helix	trans	-54	-45.1	177.2	-167.3	0	0	0	0	112.4	K402 Q403	K402-S406 PolarHBondContact O-N 3.31Å; Q403-S406 WeakPolarHBondContact O-CB 3.48Å; Q403-S406 PolarHBondContact O-N 3.27Å; Q403-S406 VanDerWaalsContact O-N 3.16Å
407	L	88.7	Confident	90.9	Very high	11 Å²	11	61.2 Å²	61.2	6%	0.058	31%	0.308	C	S	.	.	H	α-helix	trans	-66.8	-48.1	177.8	-66.9	170.5	0	0	0	112.2	F224 Q403 Y404 R405 F409 Q410 H413	F224-L407 HydrophobicContact CD2-CD2 3.76Å; F224-L407 HydrophobicContact CE2-CD2 3.24Å; F224-L407 HydrophobicContact CZ-CD2 3.98Å; Q403-L407 WeakPolarHBondContact O-CG 3.12Å; Q403-L407 PolarHBondContact O-N 2.98Å; Y404-L407 PolarHBondContact O-N 2.8Å; R405-L407 VanDerWaalsContact C-N 3.28Å; R405-L407 PolarHBondContact O-N 3.16Å; L407-F409 VanDerWaalsContact C-N 3.32Å; L407-F409 PolarHBondContact O-N 3.41Å; L407-Q410 PolarHBondContact O-N 3Å; L407-H413 WeakPolarHBondContact O-CB 3.47Å
408	S	89	Confident	90.9	Very high	28 Å²	28	60.9 Å²	60.9	20%	0.196	31%	0.307	C	S	.	.	H	α-helix	trans	-73.4	-19.2	-174.1	55.9	0	0	0	0	114.3	Y404 R405 Q410 S414	Y404-S408 WeakPolarHBondContact O-CB 3.48Å; Y404-S408 PolarHBondContact O-N 3.27Å; Y404-S408 PolarHBondContact O-OG 2.99Å; R405-S408 WeakPolarHBondContact CA-OG 3.39Å; R405-S408 PolarHBondContact O-N 3.45Å; R405-S408 PolarHBondContact O-OG 3.3Å; S408-Q410 VanDerWaalsContact C-N 3.29Å; S408-S414 WeakPolarHBondContact O-CB 3.46Å
409	F	87.8	Confident	91.1	Very high	154 Å²	154	60 Å²	60	68%	0.675	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-22.2	172.8	-83	-61.9	0	0	0	113.4	R405 L407 P411	R405-F409 HydrophobicContact CB-CD2 4.31Å; R405-F409 HydrophobicContact CB-CE2 4.03Å; R405-F409 WeakPolarHBondContact O-CD2 2.84Å; R405-F409 PolarHBondContact O-N 3.45Å; L407-F409 VanDerWaalsContact C-N 3.32Å; L407-F409 PolarHBondContact O-N 3.41Å; F409-P411 WeakPolarHBondContact O-CD 3.33Å
410	Q	87.9	Confident	91.1	Very high	81 Å²	81	60 Å²	60	38%	0.379	31%	0.313	S	S	.	.	S	Bend	trans	-85.8	119.4	177.2	-61.8	-167.8	4.3	0	0	110	L407 S408 E412 H413 S414	L407-Q410 PolarHBondContact O-N 3Å; S408-Q410 VanDerWaalsContact C-N 3.29Å; Q410-E412 VanDerWaalsContact C-N 3.3Å; Q410-E412 PolarHBondContact O-N 3.24Å; Q410-H413 HydrophobicContact CB-CB 4.35Å; Q410-H413 PolarHBondContact O-N 2.83Å; Q410-H413 VanDerWaalsContact O-N 3.08Å; Q410-H413 PolarHBondContact OE1-CE1 3.45Å; Q410-H413 PolarHBondContact OE1-ND1 3.23Å; Q410-S414 WeakPolarHBondContact O-CB 3.21Å; Q410-S414 PolarHBondContact O-N 3.27Å
411	P	86.9	Confident	91.2	Very high	93 Å²	93	59.6 Å²	59.6	60%	0.604	31%	0.312	S	S	*	.	H	α-helix	trans	-56.4	-40.6	-176.2	-27.2	35.6	0	0	0	113.5	F409 H413 S414 M415	F409-P411 WeakPolarHBondContact O-CD 3.33Å; P411-H413 PolarHBondContact O-N 3.01Å; P411-S414 PolarHBondContact O-N 3.22Å; P411-M415 VanDerWaalsContact O-CG 3.27Å; P411-M415 WeakPolarHBondContact O-CG 3.32Å; P411-M415 PolarHBondContact O-N 2.78Å; P411-M415 VanDerWaalsContact O-N 3.1Å
412	E	88.1	Confident	91.2	Very high	99 Å²	99	60.4 Å²	60.4	46%	0.463	31%	0.312	S	S	.	.	H	α-helix	trans	-61.1	-31.2	178.7	59	-102.8	-149.2	0	0	113.9	Q410 Q416	Q410-E412 VanDerWaalsContact C-N 3.3Å; Q410-E412 PolarHBondContact O-N 3.24Å; E412-Q416 WeakPolarHBondContact O-CG 3.48Å; E412-Q416 PolarHBondContact O-NE2 2.84Å
413	H	88.9	Confident	91.3	Very high	5 Å²	5	61.9 Å²	61.9	2%	0.023	32%	0.321	C	S	.	.	H	α-helix	trans	-89.6	-40.5	-178.8	-60.8	162.1	0	0	0	110.8	S222 F224 L227 L407 Q410 P411 M415 Q416 L417	S222-H413 PolarHBondContact O-NE2 3.12Å; F224-H413 AromaticContact CD2-CD2 3.85Å; F224-H413 AromaticContact CD2-CE1 3.48Å; F224-H413 VanDerWaalsContact CD2-CE1 3.48Å; F224-H413 WeakPolarHBondContact CD2-CE1 3.39Å; F224-H413 AromaticContact CD2-CG 3.91Å; F224-H413 AromaticContact CD2-ND1 3.65Å; F224-H413 AromaticContact CD2-NE2 3.58Å; F224-H413 AromaticContact CE2-CE1 3.12Å; F224-H413 WeakPolarHBondContact CE2-CE1 3.35Å; F224-H413 AromaticContact CE2-ND1 3.39Å; F224-H413 WeakPolarHBondContact CE2-ND1 3.24Å; F224-H413 AromaticContact CE2-NE2 3.69Å; L227-H413 HydrophobicContact CD2-CB 3.83Å; L407-H413 WeakPolarHBondContact O-CB 3.47Å; Q410-H413 HydrophobicContact CB-CB 4.35Å; Q410-H413 PolarHBondContact O-N 2.83Å; Q410-H413 VanDerWaalsContact O-N 3.08Å; Q410-H413 PolarHBondContact OE1-CE1 3.45Å; Q410-H413 PolarHBondContact OE1-ND1 3.23Å; P411-H413 PolarHBondContact O-N 3.01Å; H413-M415 VanDerWaalsContact C-N 3.26Å; H413-M415 PolarHBondContact O-N 3.41Å; H413-Q416 WeakPolarHBondContact O-CB 3.45Å; H413-Q416 PolarHBondContact O-N 2.93Å; H413-L417 PolarHBondContact O-N 3.04Å
414	S	88.9	Confident	91.2	Very high	32 Å²	32	62 Å²	62	22%	0.224	32%	0.322	C	S	.	.	H	α-helix	trans	-56.8	-39.8	175.6	-168.5	0	0	0	0	112.1	S408 Q410 P411 Q416 L417	S408-S414 WeakPolarHBondContact O-CB 3.46Å; Q410-S414 WeakPolarHBondContact O-CB 3.21Å; Q410-S414 PolarHBondContact O-N 3.27Å; P411-S414 PolarHBondContact O-N 3.22Å; S414-Q416 PolarHBondContact O-N 3.29Å; S414-L417 WeakPolarHBondContact O-CB 3.48Å; S414-L417 PolarHBondContact O-N 3.47Å; S414-L417 VanDerWaalsContact O-N 3.17Å
415	M	89.5	Confident	91.1	Very high	165 Å²	165	62.9 Å²	62.9	81%	0.813	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-15.6	175.4	-72	-178	70	0	0	114.4	P411 H413	P411-M415 VanDerWaalsContact O-CG 3.27Å; P411-M415 WeakPolarHBondContact O-CG 3.32Å; P411-M415 PolarHBondContact O-N 2.78Å; P411-M415 VanDerWaalsContact O-N 3.1Å; H413-M415 VanDerWaalsContact C-N 3.26Å; H413-M415 PolarHBondContact O-N 3.41Å
416	Q	91.4	Very high	90.7	Very high	40 Å²	40	58.1 Å²	58.1	19%	0.187	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-20.3	177.7	-62.3	174.2	38.5	0	0	112.5	R158 L227 P228 E412 H413 S414	R158-Q416 PolarHBondContact NH1-O 3.11Å; R158-Q416 VanDerWaalsContact NH1-O 3.09Å; R158-Q416 PolarHBondContact NH2-O 2.99Å; L227-Q416 HydrophobicContact CD2-CB 4.22Å; L227-Q416 HydrophobicContact CG-CB 4.34Å; P228-Q416 HydrophobicContact CG-CB 4.18Å; P228-Q416 HydrophobicContact CG-CG 4.29Å; E412-Q416 WeakPolarHBondContact O-CG 3.48Å; E412-Q416 PolarHBondContact O-NE2 2.84Å; H413-Q416 WeakPolarHBondContact O-CB 3.45Å; H413-Q416 PolarHBondContact O-N 2.93Å; S414-Q416 PolarHBondContact O-N 3.29Å
417	L	93.8	Very high	89.5	Confident	19 Å²	19	58 Å²	58	10%	0.099	32%	0.316	C	S	.	.	S	Bend	trans	-72.4	151	176.9	-60.8	177.7	0	0	0	111.2	L227 A231 Y404 H413 S414 V421 L422	L227-L417 HydrophobicContact CD1-CD2 3.76Å; L227-L417 HydrophobicContact CG-CD2 4.41Å; A231-L417 HydrophobicContact CB-CD2 4.06Å; Y404-L417 HydrophobicContact CE2-CD1 3.75Å; H413-L417 PolarHBondContact O-N 3.04Å; S414-L417 WeakPolarHBondContact O-CB 3.48Å; S414-L417 PolarHBondContact O-N 3.47Å; S414-L417 VanDerWaalsContact O-N 3.17Å; L417-V421 HydrophobicContact CB-CG1 4.47Å; L417-V421 HydrophobicContact CD2-CG1 4.2Å; L417-L422 HydrophobicContact CB-CD1 4.46Å; L417-L422 HydrophobicContact CB-CD2 4.18Å; L417-L422 HydrophobicContact CB-CG 4.04Å; L417-L422 HydrophobicContact CD1-CD2 3.77Å; L417-L422 HydrophobicContact CD1-CG 4.48Å
418	T	94.8	Very high	87.5	Confident	15 Å²	15	65.5 Å²	65.5	9%	0.092	35%	0.35	C	S	.	.			trans	-80.2	152.7	175.3	73.1	0	0	0	0	110.6	A231 D232 S235 L420 V421 L422	A231-T418 HydrophobicContact CB-CG2 4.38Å; D232-T418 WeakPolarHBondContact OD1-CG2 3.46Å; S235-T418 WeakPolarHBondContact CB-OG1 3.36Å; S235-T418 PolarHBondContact OG-OG1 2.96Å; T418-L420 PolarHBondContact O-N 2.85Å; T418-V421 PolarHBondContact O-N 2.65Å; T418-V421 VanDerWaalsContact OG1-CG2 3.28Å; T418-V421 WeakPolarHBondContact OG1-CG2 2.97Å; T418-V421 PolarHBondContact OG1-N 2.92Å; T418-L422 PolarHBondContact O-N 3.06Å
419	P	95.2	Very high	84.8	Confident	107 Å²	107	70.2 Å²	70.2	70%	0.695	38%	0.377	S	S	*	.	H	α-helix	trans	-54.6	-37.8	177.1	-27.9	35.5	0	0	0	113.5	L422 E423	P419-L422 PolarHBondContact O-N 3.42Å; P419-E423 WeakPolarHBondContact O-CB 3.46Å; P419-E423 PolarHBondContact O-N 2.83Å
420	L	95.9	Very high	81.9	Confident	33 Å²	33	71.4 Å²	71.4	17%	0.173	41%	0.405	C	S	.	.	H	α-helix	trans	-68.3	-37.2	179	-178.1	61.8	0	0	0	112.5	I238 Q239 T418 L422 E423 V424	I238-L420 HydrophobicContact CB-CD2 4.09Å; I238-L420 HydrophobicContact CB-CG 4.4Å; I238-L420 HydrophobicContact CD1-CG 4.49Å; I238-L420 HydrophobicContact CG2-CD1 4.07Å; I238-L420 HydrophobicContact CG2-CD2 3.76Å; I238-L420 HydrophobicContact CG2-CG 3.84Å; Q239-L420 HydrophobicContact CG-CD2 3.51Å; T418-L420 PolarHBondContact O-N 2.85Å; L420-L422 VanDerWaalsContact C-N 3.34Å; L420-E423 PolarHBondContact O-N 2.89Å; L420-V424 HydrophobicContact CD1-CG2 3.94Å; L420-V424 HydrophobicContact CG-CG2 4.47Å; L420-V424 WeakPolarHBondContact O-CB 3.32Å; L420-V424 WeakPolarHBondContact O-CG2 3.28Å; L420-V424 PolarHBondContact O-N 3.01Å
421	V	95.8	Very high	81.7	Confident	5 Å²	5	70.9 Å²	70.9	3%	0.03	41%	0.406	C	S	.	.	H	α-helix	trans	-64.3	-43.8	174.3	168.2	0	0	0	0	110.2	V234 I238 Y404 L417 T418 F425	V234-V421 HydrophobicContact CB-CG2 4.25Å; V234-V421 HydrophobicContact CG1-CG2 3.9Å; I238-V421 HydrophobicContact CD1-CG2 4.13Å; Y404-V421 HydrophobicContact CE2-CG1 3.73Å; Y404-V421 PolarHBondContact OH-O 3.35Å; L417-V421 HydrophobicContact CB-CG1 4.47Å; L417-V421 HydrophobicContact CD2-CG1 4.2Å; T418-V421 PolarHBondContact O-N 2.65Å; T418-V421 VanDerWaalsContact OG1-CG2 3.28Å; T418-V421 WeakPolarHBondContact OG1-CG2 2.97Å; T418-V421 PolarHBondContact OG1-N 2.92Å; V421-F425 HydrophobicContact CG1-CD2 4.1Å; V421-F425 PolarHBondContact O-N 3.01Å
422	L	94.1	Very high	81.4	Confident	60 Å²	60	69.7 Å²	69.7	31%	0.314	40%	0.396	S	S	.	.	H	α-helix	trans	-61.2	-42	174.7	-68.7	168.5	0	0	0	112.5	Y404 L417 T418 P419 L420 G426	Y404-L422 WeakPolarHBondContact OH-CA 3.4Å; L417-L422 HydrophobicContact CB-CD1 4.46Å; L417-L422 HydrophobicContact CB-CD2 4.18Å; L417-L422 HydrophobicContact CB-CG 4.04Å; L417-L422 HydrophobicContact CD1-CD2 3.77Å; L417-L422 HydrophobicContact CD1-CG 4.48Å; T418-L422 PolarHBondContact O-N 3.06Å; P419-L422 PolarHBondContact O-N 3.42Å; L420-L422 VanDerWaalsContact C-N 3.34Å; L422-G426 WeakPolarHBondContact O-CA 3.29Å; L422-G426 PolarHBondContact O-N 3.23Å
423	E	93.1	Very high	81	Confident	125 Å²	125	68.1 Å²	68.1	58%	0.584	39%	0.392	S	S	*	.	H	α-helix	trans	-68.6	-40.2	-179.5	-175.4	-176.2	159.8	0	0	113	K264 P419 L420	K264-E423 WeakPolarHBondContact CE-O 3.45Å; K264-E423 PolarHBondContact NZ-O 3.47Å; P419-E423 WeakPolarHBondContact O-CB 3.46Å; P419-E423 PolarHBondContact O-N 2.83Å; L420-E423 PolarHBondContact O-N 2.89Å
424	V	91.9	Very high	80.5	Confident	15 Å²	15	71.8 Å²	71.8	9%	0.091	41%	0.414	C	S	.	.	H	α-helix	trans	-82.5	-42.2	-174	173.8	0	0	0	0	112.1	I238 A267 L420	I238-V424 HydrophobicContact CD1-CB 4.12Å; I238-V424 HydrophobicContact CD1-CG1 4.23Å; I238-V424 HydrophobicContact CD1-CG2 4.39Å; I238-V424 HydrophobicContact CG2-CG2 3.87Å; A267-V424 HydrophobicContact CB-CG1 3.93Å; L420-V424 HydrophobicContact CD1-CG2 3.94Å; L420-V424 HydrophobicContact CG-CG2 4.47Å; L420-V424 WeakPolarHBondContact O-CB 3.32Å; L420-V424 WeakPolarHBondContact O-CG2 3.28Å; L420-V424 PolarHBondContact O-N 3.01Å
425	F	91	Very high	80	Confident	29 Å²	29	74.3 Å²	74.3	13%	0.127	43%	0.426	C	S	.	.	H	α-helix	trans	-102.5	-12.7	-177.8	-57.9	-37.1	0	0	0	114	V234 I238 A267 I268 H400 Y404 V421 S427	V234-F425 HydrophobicContact CG1-CE2 3.64Å; V234-F425 HydrophobicContact CG1-CZ 4.35Å; I238-F425 HydrophobicContact CD1-CE2 4.04Å; I238-F425 HydrophobicContact CD1-CZ 4.11Å; I238-F425 HydrophobicContact CG1-CZ 4.4Å; A267-F425 HydrophobicContact CB-CE1 4.1Å; A267-F425 HydrophobicContact CB-CZ 4.43Å; I268-F425 HydrophobicContact CB-CE1 3.9Å; I268-F425 HydrophobicContact CB-CZ 3.82Å; I268-F425 HydrophobicContact CD1-CZ 4.18Å; I268-F425 HydrophobicContact CG1-CZ 4.49Å; I268-F425 HydrophobicContact CG2-CE1 4.49Å; H400-F425 AromaticContact CE1-CD2 3.81Å; H400-F425 AromaticContact CE1-CE2 3.89Å; Y404-F425 HydrophobicContact CD1-CB 3.83Å; Y404-F425 HydrophobicContact CD2-CB 4.28Å; Y404-F425 VanDerWaalsContact CE1-C 3.42Å; Y404-F425 HydrophobicContact CE1-CB 3.59Å; Y404-F425 VanDerWaalsContact CE1-O 3.25Å; Y404-F425 WeakPolarHBondContact CE1-O 3.31Å; Y404-F425 HydrophobicContact CE2-CB 4.05Å; Y404-F425 HydrophobicContact CE2-CD2 4.42Å; Y404-F425 HydrophobicContact CG-CB 4.17Å; V421-F425 HydrophobicContact CG1-CD2 4.1Å; V421-F425 PolarHBondContact O-N 3.01Å; F425-S427 PolarHBondContact O-N 3Å
426	G	81.7	Confident	79.4	Confident	26 Å²	26	68.3 Å²	68.3	27%	0.268	40%	0.4	S	S	.	.	S	Bend	trans	-69.3	128.8	169.8	0	0	0	0	0	110.6	L422	L422-G426 WeakPolarHBondContact O-CA 3.29Å; L422-G426 PolarHBondContact O-N 3.23Å
427	S	64.3	Low	78.5	Confident	76 Å²	76	70.3 Å²	70.3	53%	0.531	42%	0.415	S	S	.	.			trans	-65.5	144.8	163.2	38.1	0	0	0	0	109.7	F425 V429	F425-S427 PolarHBondContact O-N 3Å; S427-V429 VanDerWaalsContact C-N 3.3Å; S427-V429 PolarHBondContact O-N 3.38Å
428	E	47	Very low	77.3	Confident	168 Å²	168	74.2 Å²	74.2	79%	0.785	44%	0.439	S	S	*	.			trans	-59.1	99.1	162.5	-69.6	-177	-179.3	0	0	107.4	S430	E428-S430 VanDerWaalsContact C-N 3.32Å; E428-S430 PolarHBondContact O-N 2.82Å
429	V	33.7	Very low	75.9	Confident	127 Å²	127	79.2 Å²	79.2	77%	0.77	47%	0.468	S	S	*	.			trans	-71.3	98.2	167.1	-176.1	0	0	0	0	105.1	S427	S427-V429 VanDerWaalsContact C-N 3.3Å; S427-V429 PolarHBondContact O-N 3.38Å
430	S	27.3	Very low	74.1	Confident	179 Å²	179	76.6 Å²	76.6	100%	1.252	45%	0.448	S	S	*	.			trans	-114.2	0	160.9	-71.7	0	0	0	0	109.3	E428	E428-S430 VanDerWaalsContact C-N 3.32Å; E428-S430 PolarHBondContact O-N 2.82Å

Retrieved 430 of 430 residues in 696 ms (Link to these results)

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