A0A077ZBX6_TRITR Loading...

Class A rhodopsin-like G-protein coupled receptor GPRfmr

AlphaFold DB , UniProt , Accession A0A077ZBX6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 351 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.9	Very low	38.5	Very low	243 Å²	243	160.7 Å²	160.7	100%	1.197	83%	0.825	S	S	*	*				0	81.2	0	-158.8	174.7	-173.3	0	0	107.4
2	I	36.6	Very low	39.2	Very low	175 Å²	175	165.8 Å²	165.8	90%	0.897	83%	0.825	S	S	*	*			trans	-90.1	112.2	-175.8	-61	172.8	0	0	0	107.1
3	K	34.7	Very low	39.9	Very low	199 Å²	199	161 Å²	161	87%	0.865	82%	0.818	S	S	*	*			trans	-153.4	104	170.7	-125.6	-176.8	-174	179.2	0	108.8
4	M	39.8	Very low	41.1	Very low	189 Å²	189	156 Å²	156	93%	0.931	81%	0.813	S	S	*	*			trans	177.2	79.7	134.3	-98.1	178.1	173	0	0	108.5
5	D	34.3	Very low	42.3	Very low	155 Å²	155	154.1 Å²	154.1	83%	0.829	81%	0.81	S	S	*	*			trans	-101	102.3	156.6	-105.7	-26.9	0	0	0	107.4
6	R	40.2	Very low	44.1	Very low	232 Å²	232	151.4 Å²	151.4	88%	0.875	81%	0.805	S	S	*	*			trans	-154.2	59.9	157.3	-74.1	-159.7	-178	172.8	-0.5	109.8	V8	R6-V8 PolarHBondContact O-N 3.02Å; R6-V8 VanDerWaalsContact O-N 3.11Å
7	T	37.5	Very low	46.3	Very low	119 Å²	119	147.4 Å²	147.4	73%	0.73	78%	0.782	S	S	*	*			trans	-74.4	91.3	151.6	37.9	0	0	0	0	106.9	N9	T7-N9 PolarHBondContact O-N 3.33Å
8	V	38.3	Very low	48.5	Very low	120 Å²	120	145.5 Å²	145.5	73%	0.727	77%	0.772	S	S	*	*			trans	-64.3	87.3	165.2	177.3	0	0	0	0	106.3	R6 S10	R6-V8 PolarHBondContact O-N 3.02Å; R6-V8 VanDerWaalsContact O-N 3.11Å; V8-S10 PolarHBondContact O-N 3.32Å
9	N	35.4	Very low	50.5	Low	138 Å²	138	148.1 Å²	148.1	74%	0.738	77%	0.77	S	S	*	*			trans	-69	75	161	-86.1	-8	0	0	0	107.2	T7 T11	T7-N9 PolarHBondContact O-N 3.33Å; N9-T11 PolarHBondContact O-N 3.33Å
10	S	42.7	Very low	52.4	Low	77 Å²	77	141.5 Å²	141.5	54%	0.538	74%	0.737	S	S	.	*			trans	-65.7	78.4	156.3	160.1	0	0	0	0	106.5	V8 R12	V8-S10 PolarHBondContact O-N 3.32Å; S10-R12 PolarHBondContact O-N 3.18Å
11	T	43.3	Very low	53.7	Low	121 Å²	121	140.6 Å²	140.6	74%	0.742	73%	0.733	S	S	*	*			trans	-61	85	149.7	39.6	0	0	0	0	105.4	N9 S13	N9-T11 PolarHBondContact O-N 3.33Å; T11-S13 PolarHBondContact O-N 3.13Å
12	R	47	Very low	55.3	Low	221 Å²	221	130.9 Å²	130.9	83%	0.834	68%	0.684	S	S	*	*			trans	-56.3	98.7	153.4	-77.5	-179.6	-179.4	179.5	-0.4	103.2	S10 A14	S10-R12 PolarHBondContact O-N 3.18Å; R12-A14 PolarHBondContact O-N 2.98Å
13	S	48.3	Very low	57	Low	104 Å²	104	127.7 Å²	127.7	73%	0.727	67%	0.669	S	S	*	*			trans	-48.7	102.8	161.3	33.6	0	0	0	0	104.9	T11 V15	T11-S13 PolarHBondContact O-N 3.13Å; S13-V15 VanDerWaalsContact C-N 3.26Å; S13-V15 PolarHBondContact O-N 3.02Å
14	A	56.5	Low	58.9	Low	91 Å²	91	122.3 Å²	122.3	75%	0.752	66%	0.655	S	S	*	*			trans	-59.8	103.7	169.7	0	0	0	0	0	103.9	R12 P16	R12-A14 PolarHBondContact O-N 2.98Å; A14-P16 WeakPolarHBondContact O-CD 3.33Å
15	V	59.6	Low	61	Low	127 Å²	127	116.5 Å²	116.5	77%	0.77	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-52.6	120.6	172	178.3	0	0	0	0	104.8	S13 M17	S13-V15 VanDerWaalsContact C-N 3.26Å; S13-V15 PolarHBondContact O-N 3.02Å; V15-M17 PolarHBondContact O-N 3.17Å; V15-M17 VanDerWaalsContact O-N 3.13Å
16	P	70.7	Confident	63.6	Low	111 Å²	111	113.3 Å²	113.3	72%	0.721	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-54.3	125.6	-177.9	-19.7	27.9	0	0	0	108.3	A14 D18	A14-P16 WeakPolarHBondContact O-CD 3.33Å; P16-D18 PolarHBondContact O-N 2.87Å
17	M	81.5	Confident	66.1	Low	84 Å²	84	112.9 Å²	112.9	41%	0.414	60%	0.604	S	S	.	*	P	Polyproline II helix	trans	-67	132.7	174.3	-178.1	-179.5	-75.9	0	0	108.5	V15 P179 W181 T188	V15-M17 PolarHBondContact O-N 3.17Å; V15-M17 VanDerWaalsContact O-N 3.13Å; M17-P179 HydrophobicContact CE-CB 3.81Å; M17-P179 HydrophobicContact CE-CG 4.15Å; M17-P179 HydrophobicContact SD-CB 4.4Å; M17-W181 HydrophobicContact SD-CB 4.29Å; M17-T188 HydrophobicContact CE-CG2 3.94Å; M17-T188 HydrophobicContact SD-CG2 3.86Å
18	D	85.1	Confident	68.8	Low	113 Å²	113	110.7 Å²	110.7	60%	0.604	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-61.3	148.5	177.1	-68	-38.9	0	0	0	111.1	P16 C180 W181	P16-D18 PolarHBondContact O-N 2.87Å; D18-C180 CarbonylContact O-C 3.41Å; D18-C180 WeakPolarHBondContact O-CA 3.44Å; D18-C180 VanDerWaalsContact O-CB 3.26Å; D18-C180 WeakPolarHBondContact O-CB 3.2Å; D18-W181 PolarHBondContact O-N 2.91Å
19	R	87.8	Confident	71.4	Confident	194 Å²	194	105.8 Å²	105.8	73%	0.732	56%	0.556	S	S	*	*	B	Isolated β-bridge	trans	-81.4	135.2	175.1	-66.9	-177.9	-179.4	-175.8	0.9	109.8
20	C	87.4	Confident	74.2	Confident	16 Å²	16	102.1 Å²	102.1	11%	0.108	53%	0.533	C	S	.	.	P	Polyproline II helix	trans	-66.9	137.1	173	-49.1	0	0	0	0	109.9	H22 C180 W181	C20-H22 WeakPolarHBondContact CB-NE2 3.46Å; C20-H22 PolarHBondContact O-N 3.25Å; C20-C180 VanDerWaalsContact CA-SG 3.57Å; C20-C180 HydrophobicContact CB-CB 4.03Å; C20-C180 WeakPolarHBondContact CB-SG 3.42Å; C20-C180 WeakPolarHBondContact SG-CB 3.24Å; C20-C180 PolarHBondContact SG-O 3.45Å; C20-C180 VanDerWaalsContact SG-O 3.36Å; C20-C180 CovalentContact SG-SG 2.03Å; C20-C180 PolarHBondContact SG-SG 3.09Å; C20-W181 PolarHBondContact N-O 2.85Å
21	N	79.4	Confident	76.8	Confident	123 Å²	123	102.5 Å²	102.5	66%	0.658	53%	0.529	S	S	*	.			trans	-95.7	89	171.9	-167.9	15.6	0	0	0	110.1	N23	N21-N23 PolarHBondContact ND2-ND2 3.4Å; N21-N23 PolarHBondContact O-N 3.38Å; N21-N23 VanDerWaalsContact O-N 3.09Å; N21-N23 PolarHBondContact OD1-ND2 3.37Å; N21-N23 PolarHBondContact OD1-OD1 3.09Å
22	H	75.3	Confident	79.4	Confident	39 Å²	39	97.4 Å²	97.4	18%	0.181	50%	0.497	C	S	.	.			trans	-83.2	63.1	172.7	-64.7	-62.9	0	0	0	110	C20 E94 M102 S182 V184	C20-H22 WeakPolarHBondContact CB-NE2 3.46Å; C20-H22 PolarHBondContact O-N 3.25Å; H22-E94 WeakPolarHBondContact CA-OE1 3.34Å; H22-E94 WeakPolarHBondContact CB-OE1 3.22Å; H22-E94 IonicContact CG-OE1 3.9Å; H22-E94 IonicContact ND1-OE1 3.48Å; H22-E94 PolarHBondContact ND1-OE1 3.25Å; H22-E94 IonicContact ND1-OE2 2.67Å; H22-M102 VanDerWaalsContact CE1-CE 3.43Å; H22-M102 WeakPolarHBondContact CE1-CE 3.3Å; H22-M102 VanDerWaalsContact ND1-CE 3.3Å; H22-M102 WeakPolarHBondContact ND1-CE 2.97Å; H22-S182 PolarHBondContact CD2-OG 3.23Å; H22-S182 VanDerWaalsContact NE2-CB 3.31Å; H22-S182 WeakPolarHBondContact NE2-CB 3.4Å; H22-S182 PolarHBondContact NE2-OG 2.9Å; H22-V184 HydrophobicContact CB-CG2 4.03Å
23	N	72.7	Confident	81.7	Confident	108 Å²	108	88.8 Å²	88.8	58%	0.578	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-85.6	125.1	168.2	-78.2	-13	0	0	0	107.5	N21 Y25	N21-N23 PolarHBondContact ND2-ND2 3.4Å; N21-N23 PolarHBondContact O-N 3.38Å; N21-N23 VanDerWaalsContact O-N 3.09Å; N21-N23 PolarHBondContact OD1-ND2 3.37Å; N21-N23 PolarHBondContact OD1-OD1 3.09Å; N23-Y25 PolarHBondContact O-N 2.98Å
24	P	74.8	Confident	84	Confident	87 Å²	87	85 Å²	85	57%	0.565	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-56.9	145.9	170.8	25.9	-32.9	0	0	0	108.6	D26	P24-D26 PolarHBondContact O-N 2.87Å
25	Y	82.9	Confident	86	Confident	66 Å²	66	85 Å²	85	26%	0.259	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-55.6	140.9	171.6	-75.3	-82.4	0	0	0	108.9	N23 R33 A91 E94	N23-Y25 PolarHBondContact O-N 2.98Å; Y25-R33 PolarHBondContact OH-NH1 3.01Å; Y25-A91 HydrophobicContact CD2-CB 3.95Å; Y25-A91 VanDerWaalsContact CE2-CA 3.43Å; Y25-A91 HydrophobicContact CE2-CB 3.98Å; Y25-A91 HydrophobicContact CG-CB 4.49Å; Y25-E94 HydrophobicContact CE2-CB 4.32Å
26	D	89.3	Confident	87.8	Confident	89 Å²	89	80.8 Å²	80.8	48%	0.476	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-59.9	154.6	172.2	77.8	149.9	0	0	0	109.6	P24 F28 S29 F30	P24-D26 PolarHBondContact O-N 2.87Å; D26-F28 PolarHBondContact O-N 2.92Å; D26-S29 PolarHBondContact O-N 3.22Å; D26-S29 VanDerWaalsContact O-N 3.17Å; D26-S29 WeakPolarHBondContact OD2-CA 3.22Å; D26-S29 WeakPolarHBondContact OD2-CB 3.36Å; D26-S29 PolarHBondContact OD2-N 3.29Å; D26-S29 PolarHBondContact OD2-OG 3.43Å; D26-F30 PolarHBondContact O-N 3.2Å
27	R	92.1	Very high	89.1	Confident	222 Å²	222	75.7 Å²	75.7	84%	0.838	37%	0.37	S	S	*	.	H	α-helix	trans	-55.5	-34.2	-174.9	-71.3	-174.9	-179.6	176.8	0.8	112	I31	R27-I31 WeakPolarHBondContact O-CB 3.5Å; R27-I31 WeakPolarHBondContact O-CD1 3.49Å; R27-I31 WeakPolarHBondContact O-CG1 3.49Å; R27-I31 PolarHBondContact O-N 3.37Å; R27-I31 VanDerWaalsContact O-N 3.08Å
28	F	94	Very high	89.9	Confident	73 Å²	73	73.1 Å²	73.1	32%	0.32	36%	0.359	S	S	.	.	H	α-helix	trans	-66.2	-54.5	178.5	179.7	-102	0	0	0	111.9	D26 F30 I31 I32 T283 E286 I287	D26-F28 PolarHBondContact O-N 2.92Å; F28-F30 VanDerWaalsContact C-N 3.28Å; F28-F30 PolarHBondContact O-N 3.2Å; F28-I31 PolarHBondContact O-N 3.34Å; F28-I32 HydrophobicContact CD1-CG1 4.44Å; F28-I32 HydrophobicContact CE1-CG1 4.02Å; F28-I32 HydrophobicContact CE2-CD1 4.28Å; F28-I32 HydrophobicContact CE2-CG1 4.1Å; F28-I32 HydrophobicContact CZ-CD1 4.23Å; F28-I32 HydrophobicContact CZ-CG1 3.84Å; F28-I32 WeakPolarHBondContact O-CG1 3.39Å; F28-I32 PolarHBondContact O-N 3.33Å; F28-T283 HydrophobicContact CD1-CG2 4.37Å; F28-T283 HydrophobicContact CE1-CG2 3.66Å; F28-T283 HydrophobicContact CZ-CG2 3.81Å; F28-E286 HydrophobicContact CE1-CB 3.86Å; F28-E286 HydrophobicContact CE1-CG 4.34Å; F28-I287 HydrophobicContact CZ-CD1 4.29Å; F28-I287 HydrophobicContact CZ-CG1 3.99Å
29	S	93.6	Very high	90.6	Very high	17 Å²	17	71.2 Å²	71.2	12%	0.119	35%	0.352	C	S	.	.	H	α-helix	trans	-61.5	-38.1	179.1	-55.7	0	0	0	0	111.4	D26 I32 R33	D26-S29 PolarHBondContact O-N 3.22Å; D26-S29 VanDerWaalsContact O-N 3.17Å; D26-S29 WeakPolarHBondContact OD2-CA 3.22Å; D26-S29 WeakPolarHBondContact OD2-CB 3.36Å; D26-S29 PolarHBondContact OD2-N 3.29Å; D26-S29 PolarHBondContact OD2-OG 3.43Å; S29-I32 PolarHBondContact O-N 3.35Å; S29-R33 VanDerWaalsContact O-CB 3.23Å; S29-R33 WeakPolarHBondContact O-CB 3.43Å; S29-R33 WeakPolarHBondContact O-CG 3.35Å; S29-R33 PolarHBondContact O-N 3.13Å
30	F	94.8	Very high	91.1	Very high	61 Å²	61	63.4 Å²	63.4	27%	0.268	33%	0.325	S	S	.	.	H	α-helix	trans	-62.4	-45.9	176.4	-175.2	-95.8	0	0	0	112.1	D26 F28 I32 V34 A91 E95	D26-F30 PolarHBondContact O-N 3.2Å; F28-F30 VanDerWaalsContact C-N 3.28Å; F28-F30 PolarHBondContact O-N 3.2Å; F30-I32 PolarHBondContact O-N 3.47Å; F30-V34 HydrophobicContact CD2-CG2 3.89Å; F30-V34 HydrophobicContact CE1-CB 4.38Å; F30-V34 HydrophobicContact CE2-CB 4.22Å; F30-V34 HydrophobicContact CE2-CG2 3.61Å; F30-V34 HydrophobicContact CG-CG2 4.5Å; F30-V34 HydrophobicContact CZ-CB 4.13Å; F30-V34 HydrophobicContact CZ-CG1 4.19Å; F30-V34 HydrophobicContact CZ-CG2 4.02Å; F30-V34 WeakPolarHBondContact O-CB 3.17Å; F30-V34 PolarHBondContact O-N 2.97Å; F30-A91 HydrophobicContact CD2-CB 4.44Å; F30-E95 HydrophobicContact CD2-CG 3.87Å; F30-E95 HydrophobicContact CE2-CB 4.2Å; F30-E95 HydrophobicContact CE2-CG 3.56Å; F30-E95 HydrophobicContact CZ-CG 4.38Å
31	I	96.6	Very high	91.6	Very high	86 Å²	86	63 Å²	63	44%	0.441	32%	0.322	S	S	.	.	I	π-helix	trans	-59.7	-47.9	176.2	-71.9	166.6	0	0	0	110.4	R27 F28 V35 C36	R27-I31 WeakPolarHBondContact O-CB 3.5Å; R27-I31 WeakPolarHBondContact O-CD1 3.49Å; R27-I31 WeakPolarHBondContact O-CG1 3.49Å; R27-I31 PolarHBondContact O-N 3.37Å; R27-I31 VanDerWaalsContact O-N 3.08Å; F28-I31 PolarHBondContact O-N 3.34Å; I31-V35 HydrophobicContact CG2-CB 4.32Å; I31-V35 CarbonylContact O-C 3.59Å; I31-V35 WeakPolarHBondContact O-CA 3.21Å; I31-V35 VanDerWaalsContact O-CB 3.25Å; I31-V35 WeakPolarHBondContact O-CB 3.32Å; I31-V35 PolarHBondContact O-N 3.21Å; I31-C36 PolarHBondContact O-N 2.9Å
32	I	97.3	Very high	92.5	Very high	14 Å²	14	62 Å²	62	7%	0.072	32%	0.315	C	S	.	.	I	π-helix	trans	-62.4	-54.5	179.4	-65	-54.1	0	0	0	111	F28 S29 F30 V34 C36 I37 E286 L290	F28-I32 HydrophobicContact CD1-CG1 4.44Å; F28-I32 HydrophobicContact CE1-CG1 4.02Å; F28-I32 HydrophobicContact CE2-CD1 4.28Å; F28-I32 HydrophobicContact CE2-CG1 4.1Å; F28-I32 HydrophobicContact CZ-CD1 4.23Å; F28-I32 HydrophobicContact CZ-CG1 3.84Å; F28-I32 WeakPolarHBondContact O-CG1 3.39Å; F28-I32 PolarHBondContact O-N 3.33Å; S29-I32 PolarHBondContact O-N 3.35Å; F30-I32 PolarHBondContact O-N 3.47Å; I32-V34 PolarHBondContact O-N 3.33Å; I32-C36 WeakPolarHBondContact O-CB 3.35Å; I32-C36 PolarHBondContact O-N 3.25Å; I32-I37 HydrophobicContact CG2-CD1 4.33Å; I32-I37 WeakPolarHBondContact O-CG1 3.4Å; I32-I37 PolarHBondContact O-N 2.93Å; I32-E286 HydrophobicContact CB-CB 4.45Å; I32-E286 HydrophobicContact CG1-CB 4.42Å; I32-E286 HydrophobicContact CG2-CB 4.15Å; I32-E286 WeakPolarHBondContact CG2-O 3.46Å; I32-L290 HydrophobicContact CD1-CD2 4.21Å; I32-L290 HydrophobicContact CG2-CB 4.18Å
33	R	96.8	Very high	93.6	Very high	39 Å²	39	64 Å²	64	15%	0.147	32%	0.324	C	S	.	.	I	π-helix	trans	-70.1	-30.1	-172	-66.1	179.4	177.9	-154.7	4.4	113.9	Y25 S29 L87 S88 A91 E286	Y25-R33 PolarHBondContact OH-NH1 3.01Å; S29-R33 VanDerWaalsContact O-CB 3.23Å; S29-R33 WeakPolarHBondContact O-CB 3.43Å; S29-R33 WeakPolarHBondContact O-CG 3.35Å; S29-R33 PolarHBondContact O-N 3.13Å; R33-L87 HydrophobicContact CG-CB 4.23Å; R33-S88 VanDerWaalsContact O-CB 3.29Å; R33-S88 WeakPolarHBondContact O-CB 3.48Å; R33-S88 PolarHBondContact O-OG 3.31Å; R33-A91 HydrophobicContact CB-CB 4.13Å; R33-E286 VanDerWaalsContact CG-OE2 3.28Å; R33-E286 WeakPolarHBondContact CG-OE2 3.19Å; R33-E286 IonicContact CZ-OE1 3.9Å; R33-E286 VanDerWaalsContact CZ-OE1 3.28Å; R33-E286 IonicContact CZ-OE2 3.06Å; R33-E286 IonicContact NE-OE1 2.89Å; R33-E286 PolarHBondContact NE-OE1 3.41Å; R33-E286 IonicContact NE-OE2 3.66Å; R33-E286 PolarHBondContact NE-OE2 3.32Å; R33-E286 IonicContact NH2-OE1 3.73Å; R33-E286 PolarHBondContact NH2-OE1 2.94Å; R33-E286 IonicContact NH2-OE2 3.94Å
34	V	97	Very high	94.8	Very high	26 Å²	26	58.9 Å²	58.9	16%	0.158	30%	0.296	C	S	.	.	I	π-helix	trans	-108.1	-60	-176.8	-174.9	0	0	0	0	111	F30 I32 C36 V38 A91 I92	F30-V34 HydrophobicContact CD2-CG2 3.89Å; F30-V34 HydrophobicContact CE1-CB 4.38Å; F30-V34 HydrophobicContact CE2-CB 4.22Å; F30-V34 HydrophobicContact CE2-CG2 3.61Å; F30-V34 HydrophobicContact CG-CG2 4.5Å; F30-V34 HydrophobicContact CZ-CB 4.13Å; F30-V34 HydrophobicContact CZ-CG1 4.19Å; F30-V34 HydrophobicContact CZ-CG2 4.02Å; F30-V34 WeakPolarHBondContact O-CB 3.17Å; F30-V34 PolarHBondContact O-N 2.97Å; I32-V34 PolarHBondContact O-N 3.33Å; V34-C36 PolarHBondContact O-N 2.85Å; V34-V38 VanDerWaalsContact O-CB 3.25Å; V34-V38 WeakPolarHBondContact O-CB 3.18Å; V34-V38 WeakPolarHBondContact O-CG2 3.37Å; V34-V38 PolarHBondContact O-N 3.18Å; V34-A91 HydrophobicContact CG2-CB 3.72Å; V34-I92 HydrophobicContact CG1-CD1 4.34Å; V34-I92 HydrophobicContact CG1-CG1 4.04Å; V34-I92 HydrophobicContact CG2-CG1 3.87Å
35	V	97.4	Very high	96	Very high	89 Å²	89	57 Å²	57	54%	0.539	28%	0.281	S	S	.	.	I	π-helix	trans	-69.1	-36.3	-172.3	-176.8	0	0	0	0	111.9	I31 P39	I31-V35 HydrophobicContact CG2-CB 4.32Å; I31-V35 CarbonylContact O-C 3.59Å; I31-V35 WeakPolarHBondContact O-CA 3.21Å; I31-V35 VanDerWaalsContact O-CB 3.25Å; I31-V35 WeakPolarHBondContact O-CB 3.32Å; I31-V35 PolarHBondContact O-N 3.21Å; V35-P39 VanDerWaalsContact O-CD 3.28Å; V35-P39 WeakPolarHBondContact O-CD 3.37Å; V35-P39 VanDerWaalsContact O-CG 3.3Å; V35-P39 WeakPolarHBondContact O-CG 3.35Å
36	C	97.9	Very high	96.7	Very high	40 Å²	40	58.9 Å²	58.9	27%	0.27	30%	0.295	S	S	.	.	I	π-helix	trans	-92.5	-53.2	179.9	-60.4	0	0	0	0	112.9	I31 I32 V34 P39 I40 L290	I31-C36 PolarHBondContact O-N 2.9Å; I32-C36 WeakPolarHBondContact O-CB 3.35Å; I32-C36 PolarHBondContact O-N 3.25Å; V34-C36 PolarHBondContact O-N 2.85Å; C36-P39 WeakPolarHBondContact O-CD 3.37Å; C36-I40 WeakPolarHBondContact O-CD1 3.5Å; C36-I40 VanDerWaalsContact O-CG1 3.31Å; C36-I40 WeakPolarHBondContact O-CG1 3.27Å; C36-I40 PolarHBondContact O-N 2.91Å; C36-L290 HydrophobicContact CB-CD1 3.65Å; C36-L290 HydrophobicContact CB-CD2 4.43Å
37	I	98.1	Very high	97.1	Very high	4 Å²	4	54.7 Å²	54.7	2%	0.021	27%	0.273	C	S	.	.	H	α-helix	trans	-68.1	-40.6	-172.8	-72.3	-179.9	0	0	0	112.4	I32 I40 V41 L87 S88 L290	I32-I37 HydrophobicContact CG2-CD1 4.33Å; I32-I37 WeakPolarHBondContact O-CG1 3.4Å; I32-I37 PolarHBondContact O-N 2.93Å; I37-I40 WeakPolarHBondContact O-CB 3.3Å; I37-I40 PolarHBondContact O-N 3.49Å; I37-I40 VanDerWaalsContact O-N 3.14Å; I37-V41 HydrophobicContact CG2-CG2 3.9Å; I37-V41 WeakPolarHBondContact O-CG2 3.3Å; I37-V41 PolarHBondContact O-N 2.95Å; I37-L87 HydrophobicContact CD1-CD1 3.73Å; I37-S88 WeakPolarHBondContact CG2-OG 3.31Å; I37-L290 HydrophobicContact CG1-CD1 3.85Å
38	V	98.3	Very high	97.4	Very high	30 Å²	30	44.1 Å²	44.1	18%	0.182	23%	0.233	C	C	.	.	H	α-helix	trans	-61.5	-48.2	-175.9	175.2	0	0	0	0	112.3	V34 I40 V41 I42 F84 I92	V34-V38 VanDerWaalsContact O-CB 3.25Å; V34-V38 WeakPolarHBondContact O-CB 3.18Å; V34-V38 WeakPolarHBondContact O-CG2 3.37Å; V34-V38 PolarHBondContact O-N 3.18Å; V38-I40 VanDerWaalsContact C-N 3.3Å; V38-I40 PolarHBondContact O-N 3.29Å; V38-V41 PolarHBondContact O-N 2.9Å; V38-I42 HydrophobicContact CG1-CD1 3.94Å; V38-I42 HydrophobicContact CG1-CG1 4.49Å; V38-I42 WeakPolarHBondContact O-CG1 3.35Å; V38-I42 PolarHBondContact O-N 3.48Å; V38-F84 HydrophobicContact CG2-CD2 4.35Å; V38-F84 HydrophobicContact CG2-CE2 4.42Å; V38-I92 HydrophobicContact CG2-CD1 4.4Å
39	P	98.4	Very high	97.6	Very high	72 Å²	72	45 Å²	45	47%	0.468	24%	0.24	S	C	.	.	H	α-helix	trans	-58.5	-39.4	173.1	-27.5	36.4	0	0	0	113.7	V35 C36 I42 F43	V35-P39 VanDerWaalsContact O-CD 3.28Å; V35-P39 WeakPolarHBondContact O-CD 3.37Å; V35-P39 VanDerWaalsContact O-CG 3.3Å; V35-P39 WeakPolarHBondContact O-CG 3.35Å; C36-P39 WeakPolarHBondContact O-CD 3.37Å; P39-I42 PolarHBondContact O-N 2.98Å; P39-F43 VanDerWaalsContact O-CB 3.32Å; P39-F43 WeakPolarHBondContact O-CB 3.23Å; P39-F43 PolarHBondContact O-N 3.47Å
40	I	98.4	Very high	97.8	Very high	31 Å²	31	48 Å²	48	16%	0.159	25%	0.254	C	S	.	.	H	α-helix	trans	-63.5	-41.7	177.2	-70.7	167	0	0	0	110.9	C36 I37 V38 G44 L290 G293 I294 S297	C36-I40 WeakPolarHBondContact O-CD1 3.5Å; C36-I40 VanDerWaalsContact O-CG1 3.31Å; C36-I40 WeakPolarHBondContact O-CG1 3.27Å; C36-I40 PolarHBondContact O-N 2.91Å; I37-I40 WeakPolarHBondContact O-CB 3.3Å; I37-I40 PolarHBondContact O-N 3.49Å; I37-I40 VanDerWaalsContact O-N 3.14Å; V38-I40 VanDerWaalsContact C-N 3.3Å; V38-I40 PolarHBondContact O-N 3.29Å; I40-G44 WeakPolarHBondContact O-CA 3.42Å; I40-G44 PolarHBondContact O-N 3.38Å; I40-L290 HydrophobicContact CD1-CD1 3.39Å; I40-L290 HydrophobicContact CD1-CG 4.47Å; I40-G293 WeakPolarHBondContact CG2-O 3.36Å; I40-I294 HydrophobicContact CD1-CD1 4.4Å; I40-I294 HydrophobicContact CD1-CG1 3.78Å; I40-S297 WeakPolarHBondContact CG2-OG 3.35Å
41	V	98.6	Very high	97.9	Very high	8 Å²	8	45 Å²	45	5%	0.048	24%	0.241	C	C	.	.	H	α-helix	trans	-62.4	-51.3	175.2	170.1	0	0	0	0	110.4	I37 V38 F43 G44 L45 L80 F84	I37-V41 HydrophobicContact CG2-CG2 3.9Å; I37-V41 WeakPolarHBondContact O-CG2 3.3Å; I37-V41 PolarHBondContact O-N 2.95Å; V38-V41 PolarHBondContact O-N 2.9Å; V41-F43 PolarHBondContact O-N 2.87Å; V41-G44 PolarHBondContact O-N 2.79Å; V41-L45 HydrophobicContact CG1-CD1 3.81Å; V41-L45 HydrophobicContact CG1-CG 4.14Å; V41-L45 WeakPolarHBondContact O-CB 3.4Å; V41-L45 VanDerWaalsContact O-CG 3.22Å; V41-L45 WeakPolarHBondContact O-CG 3.33Å; V41-L45 PolarHBondContact O-N 3.09Å; V41-L80 HydrophobicContact CG1-CB 4.43Å; V41-L80 HydrophobicContact CG2-CD2 4.39Å; V41-L80 WeakPolarHBondContact CG2-O 3.5Å; V41-F84 HydrophobicContact CG1-CB 4.17Å; V41-F84 HydrophobicContact CG2-CB 4.34Å
42	I	98.4	Very high	98	Very high	100 Å²	100	42.2 Å²	42.2	51%	0.513	23%	0.227	S	C	.	.	H	α-helix	trans	-58.3	-49.7	-179.5	-66.1	168.2	0	0	0	110.5	V38 P39 L46	V38-I42 HydrophobicContact CG1-CD1 3.94Å; V38-I42 HydrophobicContact CG1-CG1 4.49Å; V38-I42 WeakPolarHBondContact O-CG1 3.35Å; V38-I42 PolarHBondContact O-N 3.48Å; P39-I42 PolarHBondContact O-N 2.98Å; I42-L46 HydrophobicContact CG2-CD1 4.44Å; I42-L46 WeakPolarHBondContact O-CG 3.41Å; I42-L46 PolarHBondContact O-N 3.1Å
43	F	98.6	Very high	98	Very high	82 Å²	82	43.9 Å²	43.9	36%	0.36	24%	0.24	S	C	.	.	H	α-helix	trans	-61.1	-47.5	177.5	172.3	-100.9	0	0	0	111.7	P39 V41 L45 L46 A47 I300 F301	P39-F43 VanDerWaalsContact O-CB 3.32Å; P39-F43 WeakPolarHBondContact O-CB 3.23Å; P39-F43 PolarHBondContact O-N 3.47Å; V41-F43 PolarHBondContact O-N 2.87Å; F43-L45 PolarHBondContact O-N 2.79Å; F43-L46 PolarHBondContact O-N 3.17Å; F43-A47 HydrophobicContact CE1-CB 4.26Å; F43-A47 HydrophobicContact CZ-CB 4.29Å; F43-A47 VanDerWaalsContact O-CB 3.27Å; F43-A47 WeakPolarHBondContact O-CB 3.24Å; F43-A47 PolarHBondContact O-N 2.95Å; F43-I300 HydrophobicContact CE1-CG2 4.21Å; F43-I300 HydrophobicContact CZ-CG2 3.78Å; F43-F301 AromaticContact CE1-CE2 3.59Å; F43-F301 HydrophobicContact CE1-CE2 3.59Å; F43-F301 AromaticContact CE1-CZ 3.85Å; F43-F301 HydrophobicContact CE1-CZ 3.85Å; F43-F301 HydrophobicContact CE2-CZ 4.13Å; F43-F301 HydrophobicContact CZ-CE1 4.18Å; F43-F301 AromaticContact CZ-CE2 3.53Å; F43-F301 HydrophobicContact CZ-CE2 3.53Å; F43-F301 AromaticContact CZ-CZ 3.31Å; F43-F301 HydrophobicContact CZ-CZ 3.31Å
44	G	98.7	Very high	97.9	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-64.6	-37.7	-177.8	0	0	0	0	0	113.3	I40 V41 A47 N48 S297	I40-G44 WeakPolarHBondContact O-CA 3.42Å; I40-G44 PolarHBondContact O-N 3.38Å; V41-G44 PolarHBondContact O-N 2.79Å; G44-A47 PolarHBondContact O-N 2.87Å; G44-N48 WeakPolarHBondContact O-CB 3.45Å; G44-N48 PolarHBondContact O-N 3.44Å; G44-N48 PolarHBondContact O-ND2 2.7Å; G44-S297 VanDerWaalsContact CA-CB 3.41Å
45	L	98.7	Very high	97.9	Very high	47 Å²	47	40.9 Å²	40.9	25%	0.246	23%	0.226	C	C	.	.	H	α-helix	trans	-62.1	-48.4	174.6	-71	175.5	0	0	0	110.5	V41 F43 N48 I49 L77 L80	V41-L45 HydrophobicContact CG1-CD1 3.81Å; V41-L45 HydrophobicContact CG1-CG 4.14Å; V41-L45 WeakPolarHBondContact O-CB 3.4Å; V41-L45 VanDerWaalsContact O-CG 3.22Å; V41-L45 WeakPolarHBondContact O-CG 3.33Å; V41-L45 PolarHBondContact O-N 3.09Å; F43-L45 PolarHBondContact O-N 2.79Å; L45-N48 PolarHBondContact O-N 3.34Å; L45-I49 WeakPolarHBondContact O-CD1 3.41Å; L45-I49 WeakPolarHBondContact O-CG1 3.03Å; L45-I49 PolarHBondContact O-N 3.16Å; L45-L77 HydrophobicContact CB-CD2 4.38Å; L45-L77 HydrophobicContact CD2-CD2 3.59Å; L45-L80 HydrophobicContact CD2-CB 4.18Å
46	L	98.1	Very high	97.8	Very high	106 Å²	106	45 Å²	45	56%	0.555	23%	0.231	S	C	*	.	H	α-helix	trans	-62.4	-46.9	176.8	-66	174.2	0	0	0	111.7	I42 F43 N48 I49 I50	I42-L46 HydrophobicContact CG2-CD1 4.44Å; I42-L46 WeakPolarHBondContact O-CG 3.41Å; I42-L46 PolarHBondContact O-N 3.1Å; F43-L46 PolarHBondContact O-N 3.17Å; L46-N48 PolarHBondContact O-N 3.28Å; L46-I49 PolarHBondContact O-N 3Å; L46-I50 VanDerWaalsContact O-CG1 3.3Å; L46-I50 WeakPolarHBondContact O-CG1 3.36Å; L46-I50 PolarHBondContact O-N 3.39Å
47	A	98	Very high	97.6	Very high	2 Å²	2	44.7 Å²	44.7	2%	0.017	23%	0.226	C	C	.	.	H	α-helix	trans	-59.2	-44.3	180	0	0	0	0	0	112	F43 G44 I50 N51 I300	F43-A47 HydrophobicContact CE1-CB 4.26Å; F43-A47 HydrophobicContact CZ-CB 4.29Å; F43-A47 VanDerWaalsContact O-CB 3.27Å; F43-A47 WeakPolarHBondContact O-CB 3.24Å; F43-A47 PolarHBondContact O-N 2.95Å; G44-A47 PolarHBondContact O-N 2.87Å; A47-I50 WeakPolarHBondContact O-CB 3.27Å; A47-I50 PolarHBondContact O-N 3.42Å; A47-N51 PolarHBondContact O-N 3.49Å; A47-N51 PolarHBondContact O-ND2 3.14Å; A47-N51 PolarHBondContact O-OD1 3.43Å; A47-I300 HydrophobicContact CB-CB 4.09Å; A47-I300 HydrophobicContact CB-CD1 4.15Å; A47-I300 HydrophobicContact CB-CG2 3.73Å
48	N	98.5	Very high	97.2	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-74.5	-32.3	-179.6	-76.6	-56.8	0	0	0	113.4	G44 L45 L46 I50 N51 I52 L77 S296	G44-N48 WeakPolarHBondContact O-CB 3.45Å; G44-N48 PolarHBondContact O-N 3.44Å; G44-N48 PolarHBondContact O-ND2 2.7Å; L45-N48 PolarHBondContact O-N 3.34Å; L46-N48 PolarHBondContact O-N 3.28Å; N48-I50 VanDerWaalsContact C-N 3.31Å; N48-I50 PolarHBondContact O-N 3.02Å; N48-N51 WeakPolarHBondContact O-CB 3.43Å; N48-N51 PolarHBondContact O-N 2.92Å; N48-N51 PolarHBondContact OD1-ND2 3.02Å; N48-I52 VanDerWaalsContact O-CG1 3.27Å; N48-I52 WeakPolarHBondContact O-CG1 3.44Å; N48-I52 PolarHBondContact O-N 3.13Å; N48-L77 HydrophobicContact CB-CD2 3.64Å; N48-L77 HydrophobicContact CB-CG 3.82Å; N48-S296 PolarHBondContact ND2-O 3.27Å
49	I	98.2	Very high	96.6	Very high	91 Å²	91	48.6 Å²	48.6	47%	0.467	25%	0.251	S	S	.	.	H	α-helix	trans	-61.6	-42.5	169.6	-69.4	165	0	0	0	110.5	L45 L46 S53 L77	L45-I49 WeakPolarHBondContact O-CD1 3.41Å; L45-I49 WeakPolarHBondContact O-CG1 3.03Å; L45-I49 PolarHBondContact O-N 3.16Å; L46-I49 PolarHBondContact O-N 3Å; I49-S53 WeakPolarHBondContact O-CB 3.35Å; I49-S53 PolarHBondContact O-N 3.39Å; I49-S53 PolarHBondContact O-OG 3.24Å; I49-L77 HydrophobicContact CG1-CD1 4.45Å; I49-L77 HydrophobicContact CG1-CD2 4.3Å
50	I	96.9	Very high	96.2	Very high	79 Å²	79	45.3 Å²	45.3	41%	0.405	23%	0.23	S	C	.	.	H	α-helix	trans	-62.5	-47.4	174	-67.6	165.5	0	0	0	110.2	L46 A47 N48 I52 S53 V54 I300	L46-I50 VanDerWaalsContact O-CG1 3.3Å; L46-I50 WeakPolarHBondContact O-CG1 3.36Å; L46-I50 PolarHBondContact O-N 3.39Å; A47-I50 WeakPolarHBondContact O-CB 3.27Å; A47-I50 PolarHBondContact O-N 3.42Å; N48-I50 VanDerWaalsContact C-N 3.31Å; N48-I50 PolarHBondContact O-N 3.02Å; I50-I52 PolarHBondContact O-N 2.9Å; I50-S53 WeakPolarHBondContact O-CB 3.38Å; I50-S53 PolarHBondContact O-N 2.79Å; I50-S53 VanDerWaalsContact O-N 3.17Å; I50-V54 HydrophobicContact CG2-CG2 4.01Å; I50-V54 WeakPolarHBondContact O-CB 3.48Å; I50-V54 WeakPolarHBondContact O-CG2 3.43Å; I50-V54 PolarHBondContact O-N 3.01Å; I50-I300 HydrophobicContact CB-CD1 4.41Å; I50-I300 HydrophobicContact CG2-CD1 4.15Å
51	N	97.8	Very high	95.7	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-54.4	-51.7	178	-69.5	-25	0	0	0	111.7	A47 N48 S53 V54 F55 S73 Y303 Y310	A47-N51 PolarHBondContact O-N 3.49Å; A47-N51 PolarHBondContact O-ND2 3.14Å; A47-N51 PolarHBondContact O-OD1 3.43Å; N48-N51 WeakPolarHBondContact O-CB 3.43Å; N48-N51 PolarHBondContact O-N 2.92Å; N48-N51 PolarHBondContact OD1-ND2 3.02Å; N51-S53 VanDerWaalsContact C-N 3.32Å; N51-S53 PolarHBondContact O-N 3.34Å; N51-V54 PolarHBondContact O-N 3.41Å; N51-F55 HydrophobicContact CB-CD2 4.17Å; N51-F55 HydrophobicContact CB-CE2 4Å; N51-F55 WeakPolarHBondContact O-CB 3.33Å; N51-F55 WeakPolarHBondContact O-CD2 3.15Å; N51-F55 WeakPolarHBondContact O-CG 3.45Å; N51-F55 PolarHBondContact O-N 3.08Å; N51-S73 VanDerWaalsContact CB-OG 3.3Å; N51-S73 WeakPolarHBondContact CB-OG 3.4Å; N51-Y303 HydrophobicContact CB-CE2 4.4Å; N51-Y303 WeakPolarHBondContact OD1-CD2 3.46Å; N51-Y310 PolarHBondContact OD1-OH 3.04Å
52	I	98.1	Very high	95.1	Very high	27 Å²	27	55.4 Å²	55.4	14%	0.138	28%	0.279	C	S	.	.	H	α-helix	trans	-56.9	-47.8	178	-67.8	164.4	0	0	0	110.5	N48 I50 V54 F55 R56 I70 V74 L77	N48-I52 VanDerWaalsContact O-CG1 3.27Å; N48-I52 WeakPolarHBondContact O-CG1 3.44Å; N48-I52 PolarHBondContact O-N 3.13Å; I50-I52 PolarHBondContact O-N 2.9Å; I52-V54 VanDerWaalsContact C-N 3.32Å; I52-V54 PolarHBondContact O-N 3.39Å; I52-F55 PolarHBondContact O-N 3.44Å; I52-R56 HydrophobicContact CG2-CG 4.42Å; I52-R56 WeakPolarHBondContact O-CB 3.25Å; I52-R56 VanDerWaalsContact O-CG 3.22Å; I52-R56 WeakPolarHBondContact O-CG 3.49Å; I52-R56 PolarHBondContact O-N 2.84Å; I52-I70 HydrophobicContact CG2-CG2 4.49Å; I52-V74 HydrophobicContact CD1-CG2 3.65Å; I52-V74 HydrophobicContact CG1-CG2 4.18Å; I52-L77 HydrophobicContact CD1-CD1 3.65Å
53	S	96.3	Very high	94.6	Very high	49 Å²	49	52.7 Å²	52.7	34%	0.343	27%	0.269	S	S	.	.	H	α-helix	trans	-60.3	-43.1	-179.8	-58	0	0	0	0	111.9	I49 I50 N51 H57 Y317	I49-S53 WeakPolarHBondContact O-CB 3.35Å; I49-S53 PolarHBondContact O-N 3.39Å; I49-S53 PolarHBondContact O-OG 3.24Å; I50-S53 WeakPolarHBondContact O-CB 3.38Å; I50-S53 PolarHBondContact O-N 2.79Å; I50-S53 VanDerWaalsContact O-N 3.17Å; N51-S53 VanDerWaalsContact C-N 3.32Å; N51-S53 PolarHBondContact O-N 3.34Å; S53-H57 PolarHBondContact O-N 2.93Å; S53-Y317 PolarHBondContact O-OH 3.22Å
54	V	96.1	Very high	94.2	Very high	1 Å²	1	50 Å²	50	1%	0.006	26%	0.259	C	S	.	.	H	α-helix	trans	-70	-46.9	-179	171.9	0	0	0	0	111.5	I50 N51 I52 R56 H57 M60 Y310 V313 C314 Y317	I50-V54 HydrophobicContact CG2-CG2 4.01Å; I50-V54 WeakPolarHBondContact O-CB 3.48Å; I50-V54 WeakPolarHBondContact O-CG2 3.43Å; I50-V54 PolarHBondContact O-N 3.01Å; N51-V54 PolarHBondContact O-N 3.41Å; I52-V54 VanDerWaalsContact C-N 3.32Å; I52-V54 PolarHBondContact O-N 3.39Å; V54-R56 VanDerWaalsContact C-N 3.31Å; V54-R56 PolarHBondContact O-N 3.27Å; V54-H57 WeakPolarHBondContact O-CB 3.31Å; V54-H57 PolarHBondContact O-N 3.29Å; V54-H57 VanDerWaalsContact O-N 3.14Å; V54-M60 WeakPolarHBondContact O-CG 3.47Å; V54-Y310 HydrophobicContact CB-CD2 4.2Å; V54-Y310 HydrophobicContact CB-CE2 3.86Å; V54-Y310 HydrophobicContact CG1-CD2 3.32Å; V54-Y310 HydrophobicContact CG1-CE2 3.5Å; V54-Y310 HydrophobicContact CG1-CG 3.96Å; V54-Y310 HydrophobicContact CG2-CE2 4.37Å; V54-V313 HydrophobicContact CB-CG1 4.27Å; V54-V313 HydrophobicContact CG1-CB 4.02Å; V54-V313 HydrophobicContact CG1-CG1 3.82Å; V54-V313 HydrophobicContact CG2-CG1 4.3Å; V54-C314 WeakPolarHBondContact CG2-SG 3.4Å; V54-Y317 HydrophobicContact CG2-CD2 4.12Å; V54-Y317 HydrophobicContact CG2-CE2 4.36Å
55	F	95.7	Very high	93.8	Very high	1 Å²	1	50.1 Å²	50.1	0%	0.004	26%	0.26	C	S	.	.	H	α-helix	trans	-69.4	-28.7	-178.9	-69.8	-55.6	0	0	0	113.1	N51 I52 H57 M60 N66 L69 I70 Y303 Y310	N51-F55 HydrophobicContact CB-CD2 4.17Å; N51-F55 HydrophobicContact CB-CE2 4Å; N51-F55 WeakPolarHBondContact O-CB 3.33Å; N51-F55 WeakPolarHBondContact O-CD2 3.15Å; N51-F55 WeakPolarHBondContact O-CG 3.45Å; N51-F55 PolarHBondContact O-N 3.08Å; I52-F55 PolarHBondContact O-N 3.44Å; F55-H57 VanDerWaalsContact C-N 3.26Å; F55-H57 PolarHBondContact O-N 3.29Å; F55-M60 HydrophobicContact CD1-CE 3.62Å; F55-M60 HydrophobicContact CE1-CE 3.68Å; F55-M60 WeakPolarHBondContact O-CB 3.3Å; F55-N66 HydrophobicContact CB-CB 4.42Å; F55-N66 HydrophobicContact CD1-CB 4.05Å; F55-L69 HydrophobicContact CD1-CB 4.39Å; F55-L69 HydrophobicContact CD1-CD1 4.28Å; F55-L69 HydrophobicContact CD2-CB 3.92Å; F55-L69 HydrophobicContact CE1-CB 4.2Å; F55-L69 HydrophobicContact CE1-CD1 3.57Å; F55-L69 HydrophobicContact CE2-CB 3.71Å; F55-L69 HydrophobicContact CE2-CD1 4.33Å; F55-L69 HydrophobicContact CG-CB 4.28Å; F55-L69 HydrophobicContact CZ-CB 3.88Å; F55-L69 HydrophobicContact CZ-CD1 3.61Å; F55-L69 HydrophobicContact CZ-CG 4.36Å; F55-I70 HydrophobicContact CB-CD1 3.91Å; F55-I70 HydrophobicContact CB-CG1 3.42Å; F55-I70 VanDerWaalsContact CB-CG1 3.42Å; F55-I70 HydrophobicContact CG-CG1 4.39Å; F55-Y303 AromaticContact CE2-CD2 3.86Å; F55-Y303 HydrophobicContact CE2-CD2 3.86Å; F55-Y303 HydrophobicContact CE2-CE1 4.38Å; F55-Y303 AromaticContact CE2-CE2 3.55Å; F55-Y303 HydrophobicContact CE2-CE2 3.55Å; F55-Y303 HydrophobicContact CE2-CG 4.45Å; F55-Y303 AromaticContact CE2-CZ 3.85Å; F55-Y303 AromaticContact CZ-CD1 3.89Å; F55-Y303 HydrophobicContact CZ-CD1 3.89Å; F55-Y303 AromaticContact CZ-CD2 3.7Å; F55-Y303 HydrophobicContact CZ-CD2 3.7Å; F55-Y303 AromaticContact CZ-CE1 3.83Å; F55-Y303 HydrophobicContact CZ-CE1 3.83Å; F55-Y303 AromaticContact CZ-CE2 3.7Å; F55-Y303 HydrophobicContact CZ-CE2 3.7Å; F55-Y303 AromaticContact CZ-CG 3.82Å; F55-Y303 HydrophobicContact CZ-CG 3.82Å; F55-Y303 AromaticContact CZ-CZ 3.78Å; F55-Y310 AromaticContact CE1-CD2 3.88Å; F55-Y310 HydrophobicContact CE1-CD2 3.88Å; F55-Y310 HydrophobicContact CE1-CE2 4.34Å; F55-Y310 HydrophobicContact CE2-CE2 4.18Å; F55-Y310 AromaticContact CZ-CD2 3.85Å; F55-Y310 HydrophobicContact CZ-CD2 3.85Å; F55-Y310 AromaticContact CZ-CE2 3.92Å; F55-Y310 HydrophobicContact CZ-CE2 3.92Å
56	R	95.1	Very high	93.5	Very high	175 Å²	175	48.4 Å²	48.4	66%	0.66	25%	0.251	S	S	*	.	H	α-helix	trans	-72.6	-17.7	172.7	-73.4	-178.9	70.5	-173.7	2.6	113.6	I52 V54 I70	I52-R56 HydrophobicContact CG2-CG 4.42Å; I52-R56 WeakPolarHBondContact O-CB 3.25Å; I52-R56 VanDerWaalsContact O-CG 3.22Å; I52-R56 WeakPolarHBondContact O-CG 3.49Å; I52-R56 PolarHBondContact O-N 2.84Å; V54-R56 VanDerWaalsContact C-N 3.31Å; V54-R56 PolarHBondContact O-N 3.27Å; R56-I70 HydrophobicContact CG-CD1 3.71Å; R56-I70 HydrophobicContact CG-CG1 4.36Å
57	H	94	Very high	93.3	Very high	33 Å²	33	47.5 Å²	47.5	15%	0.153	24%	0.24	C	C	.	.	S	Bend	trans	-57.5	144.5	-179.4	-170.9	-99.8	0	0	0	111.5	S53 V54 F55 R59 M60 R61 V313 Y317	S53-H57 PolarHBondContact O-N 2.93Å; V54-H57 WeakPolarHBondContact O-CB 3.31Å; V54-H57 PolarHBondContact O-N 3.29Å; V54-H57 VanDerWaalsContact O-N 3.14Å; F55-H57 VanDerWaalsContact C-N 3.26Å; F55-H57 PolarHBondContact O-N 3.29Å; H57-R59 PolarHBondContact ND1-N 3.29Å; H57-R59 PolarHBondContact O-N 3.14Å; H57-M60 PolarHBondContact O-N 3.14Å; H57-R61 PolarHBondContact O-N 3.13Å; H57-V313 HydrophobicContact CB-CG1 3.67Å; H57-V313 HydrophobicContact CB-CG2 4.48Å; H57-Y317 HydrophobicContact CB-CE2 4.45Å
58	A	89.7	Confident	93.2	Very high	65 Å²	65	48 Å²	48	54%	0.537	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-32.7	-173.8	0	0	0	0	0	113.8	M60	A58-M60 VanDerWaalsContact C-N 3.33Å
59	R	86.9	Confident	93.1	Very high	51 Å²	51	48 Å²	48	19%	0.192	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-20.3	177.7	-65.8	179.5	173	-159.9	-18.5	114.5	H57 V313 T335 E339	H57-R59 PolarHBondContact ND1-N 3.29Å; H57-R59 PolarHBondContact O-N 3.14Å; R59-V313 HydrophobicContact CB-CG2 4.27Å; R59-T335 PolarHBondContact NH2-O 2.95Å; R59-E339 IonicContact CZ-OE1 3.83Å; R59-E339 IonicContact NH2-OE1 2.79Å; R59-E339 PolarHBondContact NH2-OE1 3.45Å
60	M	89.4	Confident	93	Very high	4 Å²	4	44.7 Å²	44.7	2%	0.02	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-40.7	-177.4	-66	-65.7	-77.6	0	0	111.1	V54 F55 H57 A58 S62 S63 N66 K309 Y310 V313	V54-M60 WeakPolarHBondContact O-CG 3.47Å; F55-M60 HydrophobicContact CD1-CE 3.62Å; F55-M60 HydrophobicContact CE1-CE 3.68Å; F55-M60 WeakPolarHBondContact O-CB 3.3Å; H57-M60 PolarHBondContact O-N 3.14Å; A58-M60 VanDerWaalsContact C-N 3.33Å; M60-S62 PolarHBondContact O-N 2.84Å; M60-S63 PolarHBondContact O-N 3.22Å; M60-S63 VanDerWaalsContact O-N 3.07Å; M60-N66 PolarHBondContact O-ND2 3.03Å; M60-K309 HydrophobicContact SD-CB 3.44Å; M60-K309 WeakPolarHBondContact SD-CB 3.5Å; M60-Y310 HydrophobicContact CE-CD2 4.37Å; M60-V313 HydrophobicContact CG-CG2 4.13Å
61	R	88.5	Confident	93.1	Very high	157 Å²	157	41.3 Å²	41.3	59%	0.592	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-13.9	-174	75.4	-179.1	-169.4	161.7	4.5	115.8	H57 S63	H57-R61 PolarHBondContact O-N 3.13Å; R61-S63 VanDerWaalsContact C-N 3.28Å
62	S	85.7	Confident	93	Very high	93 Å²	93	41.4 Å²	41.4	65%	0.65	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-24.6	175.9	55.9	0	0	0	0	113.1	M60	M60-S62 PolarHBondContact O-N 2.84Å
63	S	88	Confident	93	Very high	43 Å²	43	40.1 Å²	40.1	30%	0.301	20%	0.203	S	C	.	.	S	Bend	trans	-86.1	120.7	172.8	-173.8	0	0	0	0	110.1	M60 R61 V65 N66	M60-S63 PolarHBondContact O-N 3.22Å; M60-S63 VanDerWaalsContact O-N 3.07Å; R61-S63 VanDerWaalsContact C-N 3.28Å; S63-V65 PolarHBondContact O-N 2.85Å; S63-N66 WeakPolarHBondContact O-CB 3.47Å; S63-N66 PolarHBondContact O-N 3.25Å
64	V	89.4	Confident	93.1	Very high	26 Å²	26	40 Å²	40	16%	0.158	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-34.2	-179.4	-175.2	0	0	0	0	111.9	N66 W67 V153	V64-N66 PolarHBondContact O-N 3.2Å; V64-W67 WeakPolarHBondContact O-CB 3.19Å; V64-W67 PolarHBondContact O-N 2.98Å; V64-W67 VanDerWaalsContact O-N 3.12Å; V64-V153 HydrophobicContact CG1-CB 3.66Å; V64-V153 HydrophobicContact CG1-CG1 3.85Å; V64-V153 HydrophobicContact CG1-CG2 3.38Å
65	V	90.3	Very high	93.3	Very high	3 Å²	3	40 Å²	40	2%	0.018	20%	0.2	C	C	.	.	H	α-helix	trans	-54.8	-36.2	176.7	179.1	0	0	0	0	112.3	S63 W67 Y68 L69 H133 L247	S63-V65 PolarHBondContact O-N 2.85Å; V65-W67 PolarHBondContact O-N 3.03Å; V65-Y68 WeakPolarHBondContact O-CB 3.43Å; V65-Y68 PolarHBondContact O-N 3.4Å; V65-L69 HydrophobicContact CG1-CD1 4.43Å; V65-L69 HydrophobicContact CG1-CG 4.45Å; V65-L69 PolarHBondContact O-N 3.35Å; V65-H133 WeakPolarHBondContact CG2-CE1 3.34Å; V65-H133 WeakPolarHBondContact CG2-ND1 3.45Å; V65-L247 HydrophobicContact CG1-CD1 3.86Å; V65-L247 HydrophobicContact CG1-CD2 4.22Å
66	N	93.1	Very high	93.4	Very high	11 Å²	11	40 Å²	40	6%	0.059	20%	0.2	C	C	.	.	H	α-helix	trans	-67.3	-19.3	-175.5	-68.6	-19.4	0	0	0	112.7	F55 M60 S63 V64 L69 I70	F55-N66 HydrophobicContact CB-CB 4.42Å; F55-N66 HydrophobicContact CD1-CB 4.05Å; M60-N66 PolarHBondContact O-ND2 3.03Å; S63-N66 WeakPolarHBondContact O-CB 3.47Å; S63-N66 PolarHBondContact O-N 3.25Å; V64-N66 PolarHBondContact O-N 3.2Å; N66-L69 PolarHBondContact O-N 2.94Å; N66-I70 VanDerWaalsContact O-CG1 3.28Å; N66-I70 WeakPolarHBondContact O-CG1 3.41Å; N66-I70 PolarHBondContact O-N 2.79Å
67	W	94.5	Very high	93.5	Very high	87 Å²	87	33.4 Å²	33.4	33%	0.33	18%	0.177	S	C	.	.	H	α-helix	trans	-66.4	-38.7	171.3	-72.1	99.8	0	0	0	112.3	V64 V65 I70 A71 V153 L157	V64-W67 WeakPolarHBondContact O-CB 3.19Å; V64-W67 PolarHBondContact O-N 2.98Å; V64-W67 VanDerWaalsContact O-N 3.12Å; V65-W67 PolarHBondContact O-N 3.03Å; W67-I70 HydrophobicContact CE3-CD1 4.38Å; W67-I70 PolarHBondContact O-N 3.46Å; W67-A71 PolarHBondContact O-N 3.28Å; W67-V153 HydrophobicContact CB-CG1 4.35Å; W67-L157 HydrophobicContact CB-CD1 4.02Å
68	Y	95.3	Very high	93.8	Very high	11 Å²	11	34.2 Å²	34.2	4%	0.043	18%	0.183	C	C	.	.	H	α-helix	trans	-66.8	-39.2	172.1	-65.8	-78.7	0	0	0	111.9	V65 I70 A71 L72 M126 M129 V130 H133 V153 V156 L157	V65-Y68 WeakPolarHBondContact O-CB 3.43Å; V65-Y68 PolarHBondContact O-N 3.4Å; Y68-I70 VanDerWaalsContact C-N 3.3Å; Y68-I70 PolarHBondContact O-N 3.06Å; Y68-A71 PolarHBondContact O-N 3.39Å; Y68-L72 WeakPolarHBondContact O-CB 3.44Å; Y68-L72 PolarHBondContact O-N 3.33Å; Y68-M126 HydrophobicContact CD1-SD 3.99Å; Y68-M129 HydrophobicContact CD1-CB 4Å; Y68-M129 HydrophobicContact CE1-CB 3.61Å; Y68-V130 HydrophobicContact CD1-CG2 4.39Å; Y68-V130 HydrophobicContact CD2-CG2 4.43Å; Y68-V130 HydrophobicContact CG-CG2 3.82Å; Y68-H133 HydrophobicContact CE2-CB 4.14Å; Y68-H133 AromaticContact CE2-CD2 3.85Å; Y68-V153 HydrophobicContact CD2-CG1 4.08Å; Y68-V153 HydrophobicContact CE1-CG1 4.3Å; Y68-V153 HydrophobicContact CE2-CB 4.35Å; Y68-V153 HydrophobicContact CE2-CG1 3.49Å; Y68-V153 VanDerWaalsContact CE2-CG1 3.49Å; Y68-V153 HydrophobicContact CE2-CG2 3.96Å; Y68-V156 HydrophobicContact CE1-CG1 4.18Å; Y68-L157 HydrophobicContact CD1-CD2 3.53Å; Y68-L157 HydrophobicContact CE1-CD2 3.87Å; Y68-L157 HydrophobicContact CG-CD2 4.3Å
69	L	95.5	Very high	94.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-67	-31.8	178.2	-58.4	179.1	0	0	0	112.4	F55 V65 N66 L72 S73 V130 M246 L247 I250 Y303	F55-L69 HydrophobicContact CD1-CB 4.39Å; F55-L69 HydrophobicContact CD1-CD1 4.28Å; F55-L69 HydrophobicContact CD2-CB 3.92Å; F55-L69 HydrophobicContact CE1-CB 4.2Å; F55-L69 HydrophobicContact CE1-CD1 3.57Å; F55-L69 HydrophobicContact CE2-CB 3.71Å; F55-L69 HydrophobicContact CE2-CD1 4.33Å; F55-L69 HydrophobicContact CG-CB 4.28Å; F55-L69 HydrophobicContact CZ-CB 3.88Å; F55-L69 HydrophobicContact CZ-CD1 3.61Å; F55-L69 HydrophobicContact CZ-CG 4.36Å; V65-L69 HydrophobicContact CG1-CD1 4.43Å; V65-L69 HydrophobicContact CG1-CG 4.45Å; V65-L69 PolarHBondContact O-N 3.35Å; N66-L69 PolarHBondContact O-N 2.94Å; L69-L72 HydrophobicContact CD2-CD2 4.46Å; L69-S73 WeakPolarHBondContact O-CB 3.33Å; L69-S73 PolarHBondContact O-N 2.99Å; L69-S73 PolarHBondContact O-OG 3.41Å; L69-V130 HydrophobicContact CD2-CG2 4.46Å; L69-M246 HydrophobicContact CD1-CE 3.58Å; L69-L247 HydrophobicContact CD1-CD2 4.41Å; L69-L247 HydrophobicContact CD2-CD2 3.88Å; L69-I250 HydrophobicContact CD2-CD1 4.08Å; L69-Y303 HydrophobicContact CD1-CE1 4.15Å; L69-Y303 HydrophobicContact CD2-CE1 4.14Å
70	I	97.1	Very high	94.7	Very high	22 Å²	22	29.1 Å²	29.1	11%	0.113	15%	0.151	C	C	.	.	H	α-helix	trans	-63.9	-51.9	169	-68.8	162.2	0	0	0	109.8	I52 F55 R56 N66 W67 Y68 L72 S73 V74	I52-I70 HydrophobicContact CG2-CG2 4.49Å; F55-I70 HydrophobicContact CB-CD1 3.91Å; F55-I70 HydrophobicContact CB-CG1 3.42Å; F55-I70 VanDerWaalsContact CB-CG1 3.42Å; F55-I70 HydrophobicContact CG-CG1 4.39Å; R56-I70 HydrophobicContact CG-CD1 3.71Å; R56-I70 HydrophobicContact CG-CG1 4.36Å; N66-I70 VanDerWaalsContact O-CG1 3.28Å; N66-I70 WeakPolarHBondContact O-CG1 3.41Å; N66-I70 PolarHBondContact O-N 2.79Å; W67-I70 HydrophobicContact CE3-CD1 4.38Å; W67-I70 PolarHBondContact O-N 3.46Å; Y68-I70 VanDerWaalsContact C-N 3.3Å; Y68-I70 PolarHBondContact O-N 3.06Å; I70-L72 VanDerWaalsContact C-N 3.31Å; I70-L72 PolarHBondContact O-N 3.39Å; I70-S73 WeakPolarHBondContact O-CB 3.35Å; I70-S73 PolarHBondContact O-N 3.05Å; I70-S73 VanDerWaalsContact O-N 3.12Å; I70-V74 HydrophobicContact CG2-CG2 4.44Å; I70-V74 WeakPolarHBondContact O-CG2 3.34Å; I70-V74 PolarHBondContact O-N 2.74Å
71	A	97.8	Very high	95.1	Very high	8 Å²	8	33.7 Å²	33.7	7%	0.066	17%	0.174	C	C	.	.	H	α-helix	trans	-59.5	-42	179.8	0	0	0	0	0	111.9	W67 Y68 S73 V74 S75 W122 M126 L157	W67-A71 PolarHBondContact O-N 3.28Å; Y68-A71 PolarHBondContact O-N 3.39Å; A71-S73 PolarHBondContact O-N 3.37Å; A71-V74 PolarHBondContact O-N 3.41Å; A71-V74 VanDerWaalsContact O-N 3.16Å; A71-S75 PolarHBondContact O-N 2.87Å; A71-S75 PolarHBondContact O-OG 2.87Å; A71-W122 HydrophobicContact CB-CZ2 3.9Å; A71-M126 HydrophobicContact CB-CG 4.03Å; A71-M126 HydrophobicContact CB-SD 3.52Å; A71-M126 VanDerWaalsContact CB-SD 3.52Å; A71-L157 HydrophobicContact CB-CD2 3.84Å
72	L	97.1	Very high	95.6	Very high	2 Å²	2	26.4 Å²	26.4	1%	0.01	15%	0.148	C	C	.	.	H	α-helix	trans	-58.2	-45.5	173.4	-177.5	63.7	0	0	0	111.6	Y68 L69 I70 V74 S75 D76 S123 M126 I250	Y68-L72 WeakPolarHBondContact O-CB 3.44Å; Y68-L72 PolarHBondContact O-N 3.33Å; L69-L72 HydrophobicContact CD2-CD2 4.46Å; I70-L72 VanDerWaalsContact C-N 3.31Å; I70-L72 PolarHBondContact O-N 3.39Å; L72-V74 VanDerWaalsContact C-N 3.31Å; L72-V74 PolarHBondContact O-N 3.17Å; L72-S75 VanDerWaalsContact CA-OG 3.31Å; L72-S75 WeakPolarHBondContact CA-OG 3.14Å; L72-S75 PolarHBondContact O-N 2.91Å; L72-S75 PolarHBondContact O-OG 3.5Å; L72-D76 WeakPolarHBondContact O-CB 3.41Å; L72-D76 PolarHBondContact O-N 2.92Å; L72-S123 WeakPolarHBondContact CD1-OG 3.5Å; L72-M126 HydrophobicContact CB-CB 4.05Å; L72-M126 HydrophobicContact CB-CG 4.49Å; L72-M126 HydrophobicContact CD1-CB 3.94Å; L72-I250 HydrophobicContact CD2-CG2 4.3Å
73	S	98.4	Very high	96.1	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-65.1	-35.2	177.1	-53.7	0	0	0	0	112	N51 L69 I70 A71 L77	N51-S73 VanDerWaalsContact CB-OG 3.3Å; N51-S73 WeakPolarHBondContact CB-OG 3.4Å; L69-S73 WeakPolarHBondContact O-CB 3.33Å; L69-S73 PolarHBondContact O-N 2.99Å; L69-S73 PolarHBondContact O-OG 3.41Å; I70-S73 WeakPolarHBondContact O-CB 3.35Å; I70-S73 PolarHBondContact O-N 3.05Å; I70-S73 VanDerWaalsContact O-N 3.12Å; A71-S73 PolarHBondContact O-N 3.37Å; S73-L77 WeakPolarHBondContact O-CG 3.35Å; S73-L77 PolarHBondContact O-N 2.63Å; S73-L77 VanDerWaalsContact O-N 3.15Å
74	V	98.4	Very high	96.6	Very high	48 Å²	48	23.8 Å²	23.8	29%	0.291	12%	0.123	S	C	.	.	H	α-helix	trans	-70	-44.1	175.8	177.6	0	0	0	0	110.8	I52 I70 A71 L72 D76 L77 I78 W122	I52-V74 HydrophobicContact CD1-CG2 3.65Å; I52-V74 HydrophobicContact CG1-CG2 4.18Å; I70-V74 HydrophobicContact CG2-CG2 4.44Å; I70-V74 WeakPolarHBondContact O-CG2 3.34Å; I70-V74 PolarHBondContact O-N 2.74Å; A71-V74 PolarHBondContact O-N 3.41Å; A71-V74 VanDerWaalsContact O-N 3.16Å; L72-V74 VanDerWaalsContact C-N 3.31Å; L72-V74 PolarHBondContact O-N 3.17Å; V74-D76 VanDerWaalsContact C-N 3.29Å; V74-D76 PolarHBondContact O-N 3.49Å; V74-L77 WeakPolarHBondContact O-CB 3.47Å; V74-L77 PolarHBondContact O-N 3.07Å; V74-I78 PolarHBondContact O-N 2.99Å; V74-W122 HydrophobicContact CB-CH2 4.08Å; V74-W122 HydrophobicContact CB-CZ3 4.14Å; V74-W122 HydrophobicContact CG1-CH2 3.85Å; V74-W122 HydrophobicContact CG1-CZ3 3.69Å
75	S	98.4	Very high	97	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-61.4	-39.7	175.3	55.7	0	0	0	0	111.7	A71 L72 L77 I78 V79 G119 W122 S123	A71-S75 PolarHBondContact O-N 2.87Å; A71-S75 PolarHBondContact O-OG 2.87Å; L72-S75 VanDerWaalsContact CA-OG 3.31Å; L72-S75 WeakPolarHBondContact CA-OG 3.14Å; L72-S75 PolarHBondContact O-N 2.91Å; L72-S75 PolarHBondContact O-OG 3.5Å; S75-L77 VanDerWaalsContact C-N 3.34Å; S75-L77 PolarHBondContact O-N 2.94Å; S75-I78 WeakPolarHBondContact O-CB 3.38Å; S75-I78 PolarHBondContact O-N 3.46Å; S75-I78 VanDerWaalsContact O-N 3.09Å; S75-V79 WeakPolarHBondContact O-CG2 3.35Å; S75-V79 PolarHBondContact O-N 3.41Å; S75-G119 WeakPolarHBondContact CB-O 3.48Å; S75-W122 VanDerWaalsContact CB-CE3 3.49Å; S75-S123 VanDerWaalsContact OG-CA 3.31Å; S75-S123 WeakPolarHBondContact OG-CA 3.49Å; S75-S123 WeakPolarHBondContact OG-CB 3.43Å
76	D	98.3	Very high	97.3	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-65.3	-34.7	177.7	-75.1	-20.2	0	0	0	112.4	L72 V74 I78 V79 L80 S123 S296 N299	L72-D76 WeakPolarHBondContact O-CB 3.41Å; L72-D76 PolarHBondContact O-N 2.92Å; V74-D76 VanDerWaalsContact C-N 3.29Å; V74-D76 PolarHBondContact O-N 3.49Å; D76-I78 VanDerWaalsContact C-N 3.3Å; D76-I78 PolarHBondContact O-N 3.14Å; D76-V79 PolarHBondContact O-N 2.8Å; D76-L80 WeakPolarHBondContact O-CB 3.46Å; D76-L80 VanDerWaalsContact O-CG 3.23Å; D76-L80 WeakPolarHBondContact O-CG 3.12Å; D76-L80 PolarHBondContact O-N 3.03Å; D76-S123 PolarHBondContact OD1-OG 3.42Å; D76-S296 WeakPolarHBondContact CB-O 3.4Å; D76-S296 PolarHBondContact OD1-OG 3.19Å; D76-N299 PolarHBondContact OD2-ND2 3.4Å
77	L	98.7	Very high	97.4	Very high	37 Å²	37	25.4 Å²	25.4	19%	0.194	13%	0.13	C	C	.	.	H	α-helix	trans	-59.9	-40.9	170.9	-70.9	173.9	0	0	0	111.9	L45 N48 I49 I52 S73 V74 S75 L81	L45-L77 HydrophobicContact CB-CD2 4.38Å; L45-L77 HydrophobicContact CD2-CD2 3.59Å; N48-L77 HydrophobicContact CB-CD2 3.64Å; N48-L77 HydrophobicContact CB-CG 3.82Å; I49-L77 HydrophobicContact CG1-CD1 4.45Å; I49-L77 HydrophobicContact CG1-CD2 4.3Å; I52-L77 HydrophobicContact CD1-CD1 3.65Å; S73-L77 WeakPolarHBondContact O-CG 3.35Å; S73-L77 PolarHBondContact O-N 2.63Å; S73-L77 VanDerWaalsContact O-N 3.15Å; V74-L77 WeakPolarHBondContact O-CB 3.47Å; V74-L77 PolarHBondContact O-N 3.07Å; S75-L77 VanDerWaalsContact C-N 3.34Å; S75-L77 PolarHBondContact O-N 2.94Å; L77-L81 WeakPolarHBondContact O-CB 3.3Å; L77-L81 PolarHBondContact O-N 3.5Å
78	I	98.4	Very high	97.5	Very high	51 Å²	51	21.2 Å²	21.2	26%	0.262	12%	0.115	S	C	.	.	H	α-helix	trans	-66.3	-44.1	177.9	-60	171.5	0	0	0	110.1	V74 S75 D76 L80 L81 G82 I115 W122	V74-I78 PolarHBondContact O-N 2.99Å; S75-I78 WeakPolarHBondContact O-CB 3.38Å; S75-I78 PolarHBondContact O-N 3.46Å; S75-I78 VanDerWaalsContact O-N 3.09Å; D76-I78 VanDerWaalsContact C-N 3.3Å; D76-I78 PolarHBondContact O-N 3.14Å; I78-L80 PolarHBondContact O-N 3.41Å; I78-L81 PolarHBondContact O-N 3.1Å; I78-G82 PolarHBondContact O-N 3.35Å; I78-I115 HydrophobicContact CG2-CG2 3.69Å; I78-I115 WeakPolarHBondContact CG2-O 3.42Å; I78-W122 HydrophobicContact CD1-CE3 4.24Å; I78-W122 HydrophobicContact CD1-CZ3 4.14Å
79	V	98.1	Very high	97.6	Very high	9 Å²	9	21.5 Å²	21.5	6%	0.055	12%	0.117	C	C	.	.	H	α-helix	trans	-59.5	-47.3	176.8	174.4	0	0	0	0	111.1	S75 D76 G82 A83 G119 Q120 V292	S75-V79 WeakPolarHBondContact O-CG2 3.35Å; S75-V79 PolarHBondContact O-N 3.41Å; D76-V79 PolarHBondContact O-N 2.8Å; V79-G82 PolarHBondContact O-N 3.4Å; V79-A83 WeakPolarHBondContact O-CB 3.43Å; V79-A83 PolarHBondContact O-N 3.23Å; V79-G119 VanDerWaalsContact CG2-C 3.42Å; V79-Q120 HydrophobicContact CG2-CB 4.09Å; V79-Q120 VanDerWaalsContact CG2-N 3.34Å; V79-V292 HydrophobicContact CG1-CG1 4.02Å
80	L	98.5	Very high	97.6	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-67.4	-41.8	-178	-68.2	167.3	0	0	0	112.5	V41 L45 D76 I78 G82 A83 F84	V41-L80 HydrophobicContact CG1-CB 4.43Å; V41-L80 HydrophobicContact CG2-CD2 4.39Å; V41-L80 WeakPolarHBondContact CG2-O 3.5Å; L45-L80 HydrophobicContact CD2-CB 4.18Å; D76-L80 WeakPolarHBondContact O-CB 3.46Å; D76-L80 VanDerWaalsContact O-CG 3.23Å; D76-L80 WeakPolarHBondContact O-CG 3.12Å; D76-L80 PolarHBondContact O-N 3.03Å; I78-L80 PolarHBondContact O-N 3.41Å; L80-G82 VanDerWaalsContact C-N 3.33Å; L80-A83 PolarHBondContact O-N 3.32Å; L80-F84 PolarHBondContact O-N 2.93Å; L80-F84 VanDerWaalsContact O-N 3.12Å
81	L	98.2	Very high	97.4	Very high	99 Å²	99	20.8 Å²	20.8	52%	0.518	11%	0.113	S	C	.	.	H	α-helix	trans	-63.7	-42.8	174.6	-163.6	87.8	0	0	0	110.8	L77 I78 F84 C85	L77-L81 WeakPolarHBondContact O-CB 3.3Å; L77-L81 PolarHBondContact O-N 3.5Å; I78-L81 PolarHBondContact O-N 3.1Å; L81-F84 PolarHBondContact O-N 3.38Å; L81-C85 WeakPolarHBondContact O-CB 3.45Å; L81-C85 PolarHBondContact O-N 3.21Å; L81-C85 PolarHBondContact O-SG 3.3Å
82	G	97.9	Very high	97.3	Very high	4 Å²	4	23.2 Å²	23.2	4%	0.041	13%	0.125	C	C	.	.	H	α-helix	trans	-59.4	-46.3	174.6	0	0	0	0	0	112.6	I78 V79 L80 F84 C85 M86	I78-G82 PolarHBondContact O-N 3.35Å; V79-G82 PolarHBondContact O-N 3.4Å; L80-G82 VanDerWaalsContact C-N 3.33Å; G82-F84 VanDerWaalsContact C-N 3.34Å; G82-F84 PolarHBondContact O-N 3.46Å; G82-C85 PolarHBondContact O-N 3.36Å; G82-M86 VanDerWaalsContact O-CB 3.28Å; G82-M86 WeakPolarHBondContact O-CB 3.4Å; G82-M86 VanDerWaalsContact O-CG 3.29Å; G82-M86 WeakPolarHBondContact O-CG 3.37Å; G82-M86 PolarHBondContact O-N 3.02Å
83	A	97.4	Very high	97.2	Very high	16 Å²	16	23.3 Å²	23.3	13%	0.132	13%	0.125	C	C	.	.	H	α-helix	trans	-59.1	-43.4	177.6	0	0	0	0	0	111.9	V79 L80 L87	V79-A83 WeakPolarHBondContact O-CB 3.43Å; V79-A83 PolarHBondContact O-N 3.23Å; L80-A83 PolarHBondContact O-N 3.32Å; A83-L87 WeakPolarHBondContact O-CB 3.39Å; A83-L87 WeakPolarHBondContact O-CG 3.27Å; A83-L87 PolarHBondContact O-N 3.07Å
84	F	98.3	Very high	96.9	Very high	66 Å²	66	25.5 Å²	25.5	29%	0.289	14%	0.136	S	C	.	.	I	π-helix	trans	-61.4	-51.3	173.9	175.1	-98	0	0	0	111.7	V38 V41 L80 L81 G82 M86 S88 L89 I92	V38-F84 HydrophobicContact CG2-CD2 4.35Å; V38-F84 HydrophobicContact CG2-CE2 4.42Å; V41-F84 HydrophobicContact CG1-CB 4.17Å; V41-F84 HydrophobicContact CG2-CB 4.34Å; L80-F84 PolarHBondContact O-N 2.93Å; L80-F84 VanDerWaalsContact O-N 3.12Å; L81-F84 PolarHBondContact O-N 3.38Å; G82-F84 VanDerWaalsContact C-N 3.34Å; G82-F84 PolarHBondContact O-N 3.46Å; F84-M86 VanDerWaalsContact C-N 3.31Å; F84-M86 PolarHBondContact O-N 2.98Å; F84-S88 PolarHBondContact O-N 3.36Å; F84-S88 VanDerWaalsContact O-N 3.14Å; F84-L89 HydrophobicContact CE1-CB 4.16Å; F84-L89 HydrophobicContact CZ-CB 4.39Å; F84-L89 WeakPolarHBondContact O-CB 3.03Å; F84-L89 PolarHBondContact O-N 3.18Å; F84-I92 HydrophobicContact CE2-CD1 4.37Å
85	C	97.8	Very high	96.6	Very high	16 Å²	16	28 Å²	28	11%	0.108	14%	0.144	C	C	.	.	I	π-helix	trans	-65.2	-32.1	-177	-75.6	0	0	0	0	113.8	L81 G82 P90 T108 T112	L81-C85 WeakPolarHBondContact O-CB 3.45Å; L81-C85 PolarHBondContact O-N 3.21Å; L81-C85 PolarHBondContact O-SG 3.3Å; G82-C85 PolarHBondContact O-N 3.36Å; C85-P90 WeakPolarHBondContact O-CD 3.49Å; C85-T108 HydrophobicContact CB-CG2 3.83Å; C85-T112 HydrophobicContact CB-CG2 3.72Å; C85-T112 WeakPolarHBondContact CB-OG1 3.32Å
86	M	95.7	Very high	96.3	Very high	38 Å²	38	30.2 Å²	30.2	19%	0.187	16%	0.16	C	C	.	.	I	π-helix	trans	-91	-30	-177.5	-70.5	177.3	56.1	0	0	114.1	G82 F84 Y113 A116	G82-M86 VanDerWaalsContact O-CB 3.28Å; G82-M86 WeakPolarHBondContact O-CB 3.4Å; G82-M86 VanDerWaalsContact O-CG 3.29Å; G82-M86 WeakPolarHBondContact O-CG 3.37Å; G82-M86 PolarHBondContact O-N 3.02Å; F84-M86 VanDerWaalsContact C-N 3.31Å; F84-M86 PolarHBondContact O-N 2.98Å; M86-Y113 HydrophobicContact CE-CD2 3.6Å; M86-Y113 HydrophobicContact CE-CE2 4.41Å; M86-Y113 VanDerWaalsContact SD-CA 3.59Å; M86-Y113 HydrophobicContact SD-CD2 4.35Å; M86-A116 HydrophobicContact SD-CB 3.47Å; M86-A116 WeakPolarHBondContact SD-CB 3.33Å
87	L	95.4	Very high	95.9	Very high	19 Å²	19	32.3 Å²	32.3	10%	0.099	18%	0.181	C	C	.	.	I	π-helix	trans	-114.9	-58.6	-170.5	-52.6	176.8	0	0	0	111.5	R33 I37 A83 A91 N289	R33-L87 HydrophobicContact CG-CB 4.23Å; I37-L87 HydrophobicContact CD1-CD1 3.73Å; A83-L87 WeakPolarHBondContact O-CB 3.39Å; A83-L87 WeakPolarHBondContact O-CG 3.27Å; A83-L87 PolarHBondContact O-N 3.07Å; L87-A91 PolarHBondContact O-N 3.03Å; L87-N289 HydrophobicContact CD1-CB 3.81Å
88	S	97.3	Very high	95.6	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.195	C	C	.	.	I	π-helix	trans	-72.8	-44.5	-174.1	-51.1	0	0	0	0	112.6	R33 I37 F84 A91 I92	R33-S88 VanDerWaalsContact O-CB 3.29Å; R33-S88 WeakPolarHBondContact O-CB 3.48Å; R33-S88 PolarHBondContact O-OG 3.31Å; I37-S88 WeakPolarHBondContact CG2-OG 3.31Å; F84-S88 PolarHBondContact O-N 3.36Å; F84-S88 VanDerWaalsContact O-N 3.14Å; S88-A91 PolarHBondContact O-N 3.46Å; S88-I92 WeakPolarHBondContact O-CB 3.27Å; S88-I92 VanDerWaalsContact O-CG1 3.25Å; S88-I92 WeakPolarHBondContact O-CG1 3.49Å; S88-I92 PolarHBondContact O-N 3.23Å
89	L	97	Very high	95.4	Very high	17 Å²	17	34.2 Å²	34.2	9%	0.089	19%	0.191	C	C	.	.	H	α-helix	trans	-63.1	-45.1	-176.3	177.6	66.1	0	0	0	112.1	F84 I92 S93 L101 F104 A105 T108	F84-L89 HydrophobicContact CE1-CB 4.16Å; F84-L89 HydrophobicContact CZ-CB 4.39Å; F84-L89 WeakPolarHBondContact O-CB 3.03Å; F84-L89 PolarHBondContact O-N 3.18Å; L89-I92 PolarHBondContact O-N 3.18Å; L89-S93 VanDerWaalsContact O-CB 3.28Å; L89-S93 WeakPolarHBondContact O-CB 3.47Å; L89-S93 PolarHBondContact O-N 3.28Å; L89-S93 PolarHBondContact O-OG 3.06Å; L89-L101 HydrophobicContact CD1-CD1 4.46Å; L89-F104 HydrophobicContact CD2-CD1 4.33Å; L89-F104 HydrophobicContact CD2-CE1 4.09Å; L89-A105 HydrophobicContact CD2-CB 4.27Å; L89-A105 HydrophobicContact CG-CB 3.85Å; L89-T108 HydrophobicContact CD2-CG2 3.99Å
90	P	94.6	Very high	95.3	Very high	6 Å²	6	37.2 Å²	37.2	4%	0.039	22%	0.217	C	C	.	.	H	α-helix	trans	-61.4	-39.1	171.7	-26.9	37.5	0	0	0	113.8	C85 S93 E94 A105	C85-P90 WeakPolarHBondContact O-CD 3.49Å; P90-S93 WeakPolarHBondContact CA-OG 3.44Å; P90-S93 PolarHBondContact O-N 3.22Å; P90-S93 PolarHBondContact O-OG 3.41Å; P90-S93 VanDerWaalsContact O-OG 3.06Å; P90-E94 PolarHBondContact O-N 2.91Å; P90-E94 VanDerWaalsContact O-N 3.09Å; P90-A105 HydrophobicContact CG-CB 4.46Å
91	A	94.7	Very high	95.1	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-65.9	-41.7	177.6	0	0	0	0	0	112.7	Y25 F30 R33 V34 L87 S88 E95	Y25-A91 HydrophobicContact CD2-CB 3.95Å; Y25-A91 VanDerWaalsContact CE2-CA 3.43Å; Y25-A91 HydrophobicContact CE2-CB 3.98Å; Y25-A91 HydrophobicContact CG-CB 4.49Å; F30-A91 HydrophobicContact CD2-CB 4.44Å; R33-A91 HydrophobicContact CB-CB 4.13Å; V34-A91 HydrophobicContact CG2-CB 3.72Å; L87-A91 PolarHBondContact O-N 3.03Å; S88-A91 PolarHBondContact O-N 3.46Å; A91-E95 PolarHBondContact O-N 3.05Å
92	I	95.7	Very high	94.9	Very high	60 Å²	60	35.4 Å²	35.4	31%	0.308	21%	0.207	S	C	.	.	H	α-helix	trans	-69.1	-39.8	176.7	-66.9	164.2	0	0	0	110.9	V34 V38 F84 S88 L89 S96	V34-I92 HydrophobicContact CG1-CD1 4.34Å; V34-I92 HydrophobicContact CG1-CG1 4.04Å; V34-I92 HydrophobicContact CG2-CG1 3.87Å; V38-I92 HydrophobicContact CG2-CD1 4.4Å; F84-I92 HydrophobicContact CE2-CD1 4.37Å; S88-I92 WeakPolarHBondContact O-CB 3.27Å; S88-I92 VanDerWaalsContact O-CG1 3.25Å; S88-I92 WeakPolarHBondContact O-CG1 3.49Å; S88-I92 PolarHBondContact O-N 3.23Å; L89-I92 PolarHBondContact O-N 3.18Å; I92-S96 WeakPolarHBondContact O-CB 3.3Å; I92-S96 PolarHBondContact O-N 3.46Å
93	S	94.7	Very high	94.8	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.021	21%	0.214	C	C	.	.	H	α-helix	trans	-71.4	-36.7	-175.7	69.2	0	0	0	0	113.1	L89 P90 S96 M102 A105	L89-S93 VanDerWaalsContact O-CB 3.28Å; L89-S93 WeakPolarHBondContact O-CB 3.47Å; L89-S93 PolarHBondContact O-N 3.28Å; L89-S93 PolarHBondContact O-OG 3.06Å; P90-S93 WeakPolarHBondContact CA-OG 3.44Å; P90-S93 PolarHBondContact O-N 3.22Å; P90-S93 PolarHBondContact O-OG 3.41Å; P90-S93 VanDerWaalsContact O-OG 3.06Å; S93-S96 PolarHBondContact O-N 3.01Å; S93-S96 PolarHBondContact O-OG 3.12Å; S93-S96 VanDerWaalsContact O-OG 3.07Å; S93-M102 WeakPolarHBondContact O-CG 3.28Å; S93-A105 VanDerWaalsContact OG-CB 3.27Å; S93-A105 WeakPolarHBondContact OG-CB 3.4Å
94	E	91.6	Very high	94.8	Very high	47 Å²	47	41.8 Å²	41.8	22%	0.22	23%	0.233	C	C	.	.	H	α-helix	trans	-64.6	-47.6	175.2	-167	73.7	-142.4	0	0	110.6	H22 Y25 P90 S96 G97 M102	H22-E94 WeakPolarHBondContact CA-OE1 3.34Å; H22-E94 WeakPolarHBondContact CB-OE1 3.22Å; H22-E94 IonicContact CG-OE1 3.9Å; H22-E94 IonicContact ND1-OE1 3.48Å; H22-E94 PolarHBondContact ND1-OE1 3.25Å; H22-E94 IonicContact ND1-OE2 2.67Å; Y25-E94 HydrophobicContact CE2-CB 4.32Å; P90-E94 PolarHBondContact O-N 2.91Å; P90-E94 VanDerWaalsContact O-N 3.09Å; E94-S96 VanDerWaalsContact C-N 3.28Å; E94-S96 PolarHBondContact O-N 3.36Å; E94-G97 PolarHBondContact O-N 3.29Å; E94-M102 HydrophobicContact CG-CE 4.37Å; E94-M102 WeakPolarHBondContact OE1-CE 3.41Å; E94-M102 WeakPolarHBondContact OE2-CE 3.26Å
95	E	91.1	Very high	94.7	Very high	100 Å²	100	38.6 Å²	38.6	47%	0.467	22%	0.219	S	C	.	.	H	α-helix	trans	-69.3	-22.2	179.1	-73.5	-66.3	156.6	0	0	113.6	F30 A91 G97	F30-E95 HydrophobicContact CD2-CG 3.87Å; F30-E95 HydrophobicContact CE2-CB 4.2Å; F30-E95 HydrophobicContact CE2-CG 3.56Å; F30-E95 HydrophobicContact CZ-CG 4.38Å; A91-E95 PolarHBondContact O-N 3.05Å; E95-G97 PolarHBondContact O-N 2.83Å
96	S	92.6	Very high	94.6	Very high	47 Å²	47	38.9 Å²	38.9	33%	0.329	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-18.4	180	83.9	0	0	0	0	113.1	I92 S93 E94 I98	I92-S96 WeakPolarHBondContact O-CB 3.3Å; I92-S96 PolarHBondContact O-N 3.46Å; S93-S96 PolarHBondContact O-N 3.01Å; S93-S96 PolarHBondContact O-OG 3.12Å; S93-S96 VanDerWaalsContact O-OG 3.07Å; E94-S96 VanDerWaalsContact C-N 3.28Å; E94-S96 PolarHBondContact O-N 3.36Å; S96-I98 PolarHBondContact O-N 3.43Å; S96-I98 WeakPolarHBondContact OG-CB 3.22Å; S96-I98 PolarHBondContact OG-N 3.46Å
97	G	89.5	Confident	94.6	Very high	43 Å²	43	41.5 Å²	41.5	44%	0.443	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.9	17.8	-175.5	0	0	0	0	0	114.1	E94 E95 Y185	E94-G97 PolarHBondContact O-N 3.29Å; E95-G97 PolarHBondContact O-N 2.83Å; G97-Y185 WeakPolarHBondContact CA-OH 3.45Å; G97-Y185 WeakPolarHBondContact O-CE1 3.33Å; G97-Y185 PolarHBondContact O-OH 3.5Å
98	I	94.1	Very high	94.6	Very high	93 Å²	93	41.8 Å²	41.8	48%	0.477	23%	0.234	S	C	.	.			trans	-107.8	101.5	-176.3	-56.2	174.8	0	0	0	109.4	S96 A100 L101 M102	S96-I98 PolarHBondContact O-N 3.43Å; S96-I98 WeakPolarHBondContact OG-CB 3.22Å; S96-I98 PolarHBondContact OG-N 3.46Å; I98-A100 VanDerWaalsContact C-N 3.26Å; I98-A100 HydrophobicContact CG2-CB 4.34Å; I98-A100 PolarHBondContact O-N 3.43Å; I98-A100 VanDerWaalsContact O-N 3.14Å; I98-L101 HydrophobicContact CB-CB 4.03Å; I98-L101 HydrophobicContact CG2-CB 4.07Å; I98-L101 WeakPolarHBondContact O-CB 3.32Å; I98-L101 PolarHBondContact O-N 3.27Å; I98-M102 WeakPolarHBondContact O-CG 3.35Å; I98-M102 PolarHBondContact O-N 2.86Å
99	L	93.1	Very high	94.6	Very high	35 Å²	35	44 Å²	44	18%	0.183	24%	0.244	C	C	.	.	H	α-helix	trans	-51.8	-40.2	-179.1	177.7	61.2	0	0	0	114	L101 M102 N103 Y185 T187 A189	L99-L101 VanDerWaalsContact C-N 3.32Å; L99-L101 PolarHBondContact O-N 3.48Å; L99-M102 PolarHBondContact O-N 3.49Å; L99-N103 WeakPolarHBondContact O-CB 3.38Å; L99-N103 PolarHBondContact O-N 3.33Å; L99-Y185 HydrophobicContact CB-CD1 4.25Å; L99-Y185 HydrophobicContact CB-CD2 4.12Å; L99-Y185 HydrophobicContact CB-CE1 4.36Å; L99-Y185 HydrophobicContact CB-CE2 4.25Å; L99-Y185 HydrophobicContact CB-CG 4.13Å; L99-Y185 HydrophobicContact CD1-CD2 3.88Å; L99-Y185 HydrophobicContact CD1-CE2 4.25Å; L99-Y185 HydrophobicContact CD1-CG 4.48Å; L99-Y185 HydrophobicContact CD2-CD2 4.49Å; L99-Y185 HydrophobicContact CD2-CG 4.3Å; L99-Y185 HydrophobicContact CG-CD2 4.38Å; L99-T187 HydrophobicContact CD2-CG2 3.31Å; L99-A189 HydrophobicContact CD1-CB 3.51Å
100	A	95.7	Very high	94.5	Very high	73 Å²	73	46.4 Å²	46.4	60%	0.603	25%	0.252	S	S	*	.	H	α-helix	trans	-62.9	-38.5	178.1	0	0	0	0	0	112.4	I98 F104	I98-A100 VanDerWaalsContact C-N 3.26Å; I98-A100 HydrophobicContact CG2-CB 4.34Å; I98-A100 PolarHBondContact O-N 3.43Å; I98-A100 VanDerWaalsContact O-N 3.14Å; A100-F104 VanDerWaalsContact O-CB 3.31Å; A100-F104 WeakPolarHBondContact O-CB 3.32Å; A100-F104 PolarHBondContact O-N 2.97Å
101	L	95.7	Very high	94.4	Very high	53 Å²	53	53.4 Å²	53.4	28%	0.277	28%	0.278	S	S	.	.	H	α-helix	trans	-71.8	-36.9	177.6	-173.2	61.1	0	0	0	111.2	L89 I98 L99 F104 A105	L89-L101 HydrophobicContact CD1-CD1 4.46Å; I98-L101 HydrophobicContact CB-CB 4.03Å; I98-L101 HydrophobicContact CG2-CB 4.07Å; I98-L101 WeakPolarHBondContact O-CB 3.32Å; I98-L101 PolarHBondContact O-N 3.27Å; L99-L101 VanDerWaalsContact C-N 3.32Å; L99-L101 PolarHBondContact O-N 3.48Å; L101-F104 HydrophobicContact CD1-CD1 4.32Å; L101-F104 PolarHBondContact O-N 2.93Å; L101-A105 WeakPolarHBondContact O-CB 3.32Å; L101-A105 PolarHBondContact O-N 2.92Å
102	M	93.9	Very high	94.5	Very high	8 Å²	8	54.5 Å²	54.5	4%	0.039	28%	0.284	C	S	.	.	H	α-helix	trans	-63	-50.3	174.9	-61.6	171.1	73.7	0	0	111.4	H22 S93 E94 I98 L99 F104 A105 C106 Y185	H22-M102 VanDerWaalsContact CE1-CE 3.43Å; H22-M102 WeakPolarHBondContact CE1-CE 3.3Å; H22-M102 VanDerWaalsContact ND1-CE 3.3Å; H22-M102 WeakPolarHBondContact ND1-CE 2.97Å; S93-M102 WeakPolarHBondContact O-CG 3.28Å; E94-M102 HydrophobicContact CG-CE 4.37Å; E94-M102 WeakPolarHBondContact OE1-CE 3.41Å; E94-M102 WeakPolarHBondContact OE2-CE 3.26Å; I98-M102 WeakPolarHBondContact O-CG 3.35Å; I98-M102 PolarHBondContact O-N 2.86Å; L99-M102 PolarHBondContact O-N 3.49Å; M102-F104 VanDerWaalsContact C-N 3.31Å; M102-F104 PolarHBondContact O-N 3.06Å; M102-A105 WeakPolarHBondContact O-CB 3.35Å; M102-A105 PolarHBondContact O-N 3.4Å; M102-A105 VanDerWaalsContact O-N 3.12Å; M102-C106 PolarHBondContact O-N 3.38Å; M102-C106 PolarHBondContact O-SG 3.38Å; M102-C106 VanDerWaalsContact O-SG 3.4Å; M102-Y185 HydrophobicContact CE-CE2 4.25Å; M102-Y185 HydrophobicContact SD-CE2 3.57Å; M102-Y185 VanDerWaalsContact SD-CE2 3.57Å; M102-Y185 PolarHBondContact SD-OH 3.38Å
103	N	95.6	Very high	94.5	Very high	34 Å²	34	53 Å²	53	18%	0.182	28%	0.275	C	S	.	.	H	α-helix	trans	-58.6	-45.1	175.6	-72.2	-21	0	0	0	110.9	L99 A105 C106 F107 V190	L99-N103 WeakPolarHBondContact O-CB 3.38Å; L99-N103 PolarHBondContact O-N 3.33Å; N103-A105 VanDerWaalsContact C-N 3.34Å; N103-A105 PolarHBondContact O-N 3.13Å; N103-C106 PolarHBondContact O-N 2.93Å; N103-F107 WeakPolarHBondContact O-CD2 3.15Å; N103-F107 PolarHBondContact O-N 3.39Å; N103-V190 PolarHBondContact OD1-N 3.23Å
104	F	96.9	Very high	94.6	Very high	119 Å²	119	52.8 Å²	52.8	52%	0.522	27%	0.274	S	S	.	.	H	α-helix	trans	-59.1	-43.1	175.2	176	-101.3	0	0	0	112.3	L89 A100 L101 M102 F107 T108	L89-F104 HydrophobicContact CD2-CD1 4.33Å; L89-F104 HydrophobicContact CD2-CE1 4.09Å; A100-F104 VanDerWaalsContact O-CB 3.31Å; A100-F104 WeakPolarHBondContact O-CB 3.32Å; A100-F104 PolarHBondContact O-N 2.97Å; L101-F104 HydrophobicContact CD1-CD1 4.32Å; L101-F104 PolarHBondContact O-N 2.93Å; M102-F104 VanDerWaalsContact C-N 3.31Å; M102-F104 PolarHBondContact O-N 3.06Å; F104-F107 PolarHBondContact O-N 3.06Å; F104-T108 VanDerWaalsContact O-CB 3.28Å; F104-T108 WeakPolarHBondContact O-CB 3.45Å; F104-T108 PolarHBondContact O-N 3.21Å; F104-T108 PolarHBondContact O-OG1 2.87Å
105	A	96.8	Very high	94.9	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-62	-45.1	177	0	0	0	0	0	111.7	L89 P90 S93 L101 M102 N103 T108 Q109	L89-A105 HydrophobicContact CD2-CB 4.27Å; L89-A105 HydrophobicContact CG-CB 3.85Å; P90-A105 HydrophobicContact CG-CB 4.46Å; S93-A105 VanDerWaalsContact OG-CB 3.27Å; S93-A105 WeakPolarHBondContact OG-CB 3.4Å; L101-A105 WeakPolarHBondContact O-CB 3.32Å; L101-A105 PolarHBondContact O-N 2.92Å; M102-A105 WeakPolarHBondContact O-CB 3.35Å; M102-A105 PolarHBondContact O-N 3.4Å; M102-A105 VanDerWaalsContact O-N 3.12Å; N103-A105 VanDerWaalsContact C-N 3.34Å; N103-A105 PolarHBondContact O-N 3.13Å; A105-T108 PolarHBondContact O-N 3.06Å; A105-Q109 VanDerWaalsContact O-CB 3.27Å; A105-Q109 WeakPolarHBondContact O-CB 3.22Å; A105-Q109 PolarHBondContact O-N 2.85Å
106	C	95.3	Very high	95.2	Very high	22 Å²	22	50 Å²	50	15%	0.149	26%	0.264	C	S	.	.	H	α-helix	trans	-62.3	-44.7	177.5	-66.4	0	0	0	0	112.7	M102 N103 Q109 R110 V190 V192	M102-C106 PolarHBondContact O-N 3.38Å; M102-C106 PolarHBondContact O-SG 3.38Å; M102-C106 VanDerWaalsContact O-SG 3.4Å; N103-C106 PolarHBondContact O-N 2.93Å; C106-Q109 PolarHBondContact O-N 3.05Å; C106-R110 PolarHBondContact O-N 2.82Å; C106-R110 VanDerWaalsContact O-N 3.11Å; C106-V190 HydrophobicContact CB-CG1 4.39Å; C106-V190 PolarHBondContact SG-O 2.94Å; C106-V192 HydrophobicContact CB-CG2 3.81Å
107	F	95.6	Very high	95.4	Very high	93 Å²	93	48.6 Å²	48.6	41%	0.408	25%	0.253	S	S	.	.	H	α-helix	trans	-63	-43.8	174.9	-75.3	-62.1	0	0	0	111.7	N103 F104 R110 W111 T177 V190	N103-F107 WeakPolarHBondContact O-CD2 3.15Å; N103-F107 PolarHBondContact O-N 3.39Å; F104-F107 PolarHBondContact O-N 3.06Å; F107-R110 PolarHBondContact O-N 3.16Å; F107-W111 VanDerWaalsContact O-CD1 3.31Å; F107-W111 PolarHBondContact O-N 3.48Å; F107-T177 HydrophobicContact CD1-CG2 3.96Å; F107-T177 HydrophobicContact CE1-CG2 4.21Å; F107-V190 HydrophobicContact CE1-CG1 4.38Å; F107-V190 HydrophobicContact CE2-CB 4.45Å; F107-V190 HydrophobicContact CE2-CG1 4.37Å; F107-V190 HydrophobicContact CE2-CG2 4.05Å; F107-V190 HydrophobicContact CZ-CB 4.48Å; F107-V190 HydrophobicContact CZ-CG1 4.07Å; F107-V190 HydrophobicContact CZ-CG2 3.94Å
108	T	96.3	Very high	95.8	Very high	25 Å²	25	47.5 Å²	47.5	15%	0.153	24%	0.237	C	C	.	.	H	α-helix	trans	-61.6	-45.8	177.3	-58.2	0	0	0	0	110.9	C85 L89 F104 A105 R110 W111 T112	C85-T108 HydrophobicContact CB-CG2 3.83Å; L89-T108 HydrophobicContact CD2-CG2 3.99Å; F104-T108 VanDerWaalsContact O-CB 3.28Å; F104-T108 WeakPolarHBondContact O-CB 3.45Å; F104-T108 PolarHBondContact O-N 3.21Å; F104-T108 PolarHBondContact O-OG1 2.87Å; A105-T108 PolarHBondContact O-N 3.06Å; T108-R110 PolarHBondContact O-N 3.09Å; T108-W111 PolarHBondContact O-N 3.27Å; T108-T112 HydrophobicContact CG2-CG2 3.91Å; T108-T112 VanDerWaalsContact O-CB 3.31Å; T108-T112 WeakPolarHBondContact O-CB 3.47Å; T108-T112 VanDerWaalsContact O-CG2 3.29Å; T108-T112 WeakPolarHBondContact O-CG2 3.46Å; T108-T112 PolarHBondContact O-N 3.12Å; T108-T112 PolarHBondContact O-OG1 3.18Å
109	Q	95.6	Very high	96	Very high	47 Å²	47	43 Å²	43	22%	0.22	21%	0.214	C	C	.	.	H	α-helix	trans	-57.8	-45.3	178.7	-179	-179.6	-9.4	0	0	111.9	A105 C106 W111 T112 Y113 V192	A105-Q109 VanDerWaalsContact O-CB 3.27Å; A105-Q109 WeakPolarHBondContact O-CB 3.22Å; A105-Q109 PolarHBondContact O-N 2.85Å; C106-Q109 PolarHBondContact O-N 3.05Å; Q109-W111 PolarHBondContact O-N 2.87Å; Q109-T112 PolarHBondContact O-OG1 3.49Å; Q109-Y113 WeakPolarHBondContact O-CB 3.37Å; Q109-Y113 PolarHBondContact O-N 3.32Å; Q109-V192 HydrophobicContact CB-CG2 4.47Å; Q109-V192 HydrophobicContact CG-CG2 4.48Å
110	R	95	Very high	96.1	Very high	66 Å²	66	42.6 Å²	42.6	25%	0.249	21%	0.211	C	C	.	.	H	α-helix	trans	-55.6	-50.6	177.5	174.8	179.8	179.8	157.6	8	112.5	C106 F107 T108 I175 T177	C106-R110 PolarHBondContact O-N 2.82Å; C106-R110 VanDerWaalsContact O-N 3.11Å; F107-R110 PolarHBondContact O-N 3.16Å; T108-R110 PolarHBondContact O-N 3.09Å; R110-I175 HydrophobicContact CG-CG2 4.48Å; R110-I175 PolarHBondContact NE-O 3.43Å; R110-T177 HydrophobicContact CB-CG2 4.1Å; R110-T177 VanDerWaalsContact NH1-N 3.19Å; R110-T177 PolarHBondContact NH1-OG1 3.44Å
111	W	94	Very high	96.2	Very high	154 Å²	154	39.3 Å²	39.3	58%	0.583	18%	0.183	S	C	*	.	H	α-helix	trans	-76.9	-35.9	-175.3	-73.1	104.7	0	0	0	112.7	F107 T108 Q109 W172	F107-W111 VanDerWaalsContact O-CD1 3.31Å; F107-W111 PolarHBondContact O-N 3.48Å; T108-W111 PolarHBondContact O-N 3.27Å; Q109-W111 PolarHBondContact O-N 2.87Å; W111-W172 AromaticContact CE3-CD1 3.74Å; W111-W172 AromaticContact CE3-NE1 3.71Å; W111-W172 AromaticContact CZ3-CD1 3.91Å
112	T	96.3	Very high	96.3	Very high	22 Å²	22	37.9 Å²	37.9	14%	0.135	17%	0.174	C	C	.	.	H	α-helix	trans	-76.3	-22.5	-179.2	55.7	0	0	0	0	113	C85 T108 Q109 A114 I115 A116	C85-T112 HydrophobicContact CB-CG2 3.72Å; C85-T112 WeakPolarHBondContact CB-OG1 3.32Å; T108-T112 HydrophobicContact CG2-CG2 3.91Å; T108-T112 VanDerWaalsContact O-CB 3.31Å; T108-T112 WeakPolarHBondContact O-CB 3.47Å; T108-T112 VanDerWaalsContact O-CG2 3.29Å; T108-T112 WeakPolarHBondContact O-CG2 3.46Å; T108-T112 PolarHBondContact O-N 3.12Å; T108-T112 PolarHBondContact O-OG1 3.18Å; Q109-T112 PolarHBondContact O-OG1 3.49Å; T112-A114 PolarHBondContact O-N 3.09Å; T112-I115 PolarHBondContact O-N 3.29Å; T112-A116 VanDerWaalsContact O-CB 3.31Å; T112-A116 WeakPolarHBondContact O-CB 3.31Å; T112-A116 PolarHBondContact O-N 3.31Å
113	Y	96.2	Very high	96.4	Very high	28 Å²	28	37.7 Å²	37.7	11%	0.11	17%	0.173	C	C	.	.	H	α-helix	trans	-49.9	-56.4	175.8	170.8	-112.9	0	0	0	113.5	M86 Q109 I115 A116 L117 R171 E174 I175 M208	M86-Y113 HydrophobicContact CE-CD2 3.6Å; M86-Y113 HydrophobicContact CE-CE2 4.41Å; M86-Y113 VanDerWaalsContact SD-CA 3.59Å; M86-Y113 HydrophobicContact SD-CD2 4.35Å; Q109-Y113 WeakPolarHBondContact O-CB 3.37Å; Q109-Y113 PolarHBondContact O-N 3.32Å; Y113-I115 PolarHBondContact O-N 3.34Å; Y113-A116 PolarHBondContact O-N 3.49Å; Y113-L117 HydrophobicContact CD2-CD1 4.1Å; Y113-L117 HydrophobicContact CE1-CD1 4.07Å; Y113-L117 HydrophobicContact CE2-CD1 3.52Å; Y113-L117 HydrophobicContact CE2-CG 4.33Å; Y113-L117 WeakPolarHBondContact O-CG 3.13Å; Y113-L117 PolarHBondContact O-N 2.95Å; Y113-R171 HydrophobicContact CD1-CB 4.27Å; Y113-R171 HydrophobicContact CE1-CB 3.89Å; Y113-R171 PolarHBondContact OH-NH1 3.32Å; Y113-E174 HydrophobicContact CE1-CB 4.27Å; Y113-E174 WeakPolarHBondContact CE1-OE2 3.48Å; Y113-E174 PolarHBondContact OH-OE2 2.89Å; Y113-I175 HydrophobicContact CD1-CD1 3.47Å; Y113-I175 VanDerWaalsContact CD1-CD1 3.47Å; Y113-I175 HydrophobicContact CD1-CG1 3.96Å; Y113-I175 HydrophobicContact CD2-CD1 3.83Å; Y113-I175 HydrophobicContact CE1-CD1 3.66Å; Y113-I175 HydrophobicContact CE1-CG1 3.97Å; Y113-I175 HydrophobicContact CE2-CD1 4.01Å; Y113-I175 HydrophobicContact CG-CD1 3.56Å; Y113-M208 WeakPolarHBondContact OH-CE 3.34Å
114	A	96.8	Very high	96.4	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-65.2	-39.8	179.1	0	0	0	0	0	112	T112 L117 I118 R171 W172	T112-A114 PolarHBondContact O-N 3.09Å; A114-L117 PolarHBondContact O-N 3.07Å; A114-I118 WeakPolarHBondContact O-CD1 3.3Å; A114-I118 VanDerWaalsContact O-CG1 3.23Å; A114-I118 WeakPolarHBondContact O-CG1 3.28Å; A114-I118 PolarHBondContact O-N 3.2Å; A114-R171 HydrophobicContact CB-CB 3.77Å; A114-W172 HydrophobicContact CB-CD2 3.42Å; A114-W172 VanDerWaalsContact CB-CD2 3.42Å; A114-W172 VanDerWaalsContact CB-CE2 3.45Å; A114-W172 HydrophobicContact CB-CE3 3.84Å; A114-W172 HydrophobicContact CB-CG 3.74Å; A114-W172 HydrophobicContact CB-CH2 4.32Å; A114-W172 HydrophobicContact CB-CZ2 3.93Å; A114-W172 HydrophobicContact CB-CZ3 4.27Å
115	I	97.4	Very high	96.4	Very high	76 Å²	76	31.5 Å²	31.5	39%	0.39	15%	0.15	S	C	.	.	H	α-helix	trans	-63.8	-43.5	-179.8	-64.2	171.2	0	0	0	111.1	I78 T112 Y113 I118 G119 W172	I78-I115 HydrophobicContact CG2-CG2 3.69Å; I78-I115 WeakPolarHBondContact CG2-O 3.42Å; T112-I115 PolarHBondContact O-N 3.29Å; Y113-I115 PolarHBondContact O-N 3.34Å; I115-I118 PolarHBondContact O-N 2.94Å; I115-G119 PolarHBondContact O-N 2.91Å; I115-W172 HydrophobicContact CG1-CZ2 3.94Å
116	A	97.1	Very high	96.3	Very high	11 Å²	11	31.5 Å²	31.5	9%	0.091	15%	0.15	C	C	.	.	H	α-helix	trans	-61	-45.5	177.9	0	0	0	0	0	110.9	M86 T112 Y113 G119 Q120	M86-A116 HydrophobicContact SD-CB 3.47Å; M86-A116 WeakPolarHBondContact SD-CB 3.33Å; T112-A116 VanDerWaalsContact O-CB 3.31Å; T112-A116 WeakPolarHBondContact O-CB 3.31Å; T112-A116 PolarHBondContact O-N 3.31Å; Y113-A116 PolarHBondContact O-N 3.49Å; A116-G119 PolarHBondContact O-N 3.05Å; A116-Q120 WeakPolarHBondContact O-CB 3.33Å; A116-Q120 PolarHBondContact O-N 3.04Å
117	L	96.5	Very high	96.2	Very high	19 Å²	19	30.6 Å²	30.6	10%	0.099	14%	0.144	C	C	.	.	H	α-helix	trans	-66.3	-37.3	177.2	-68.4	176.5	0	0	0	112.6	Y113 A114 Q120 T121 R171 Y212	Y113-L117 HydrophobicContact CD2-CD1 4.1Å; Y113-L117 HydrophobicContact CE1-CD1 4.07Å; Y113-L117 HydrophobicContact CE2-CD1 3.52Å; Y113-L117 HydrophobicContact CE2-CG 4.33Å; Y113-L117 WeakPolarHBondContact O-CG 3.13Å; Y113-L117 PolarHBondContact O-N 2.95Å; A114-L117 PolarHBondContact O-N 3.07Å; L117-Q120 PolarHBondContact O-N 3.32Å; L117-T121 PolarHBondContact O-N 3.17Å; L117-T121 PolarHBondContact O-OG1 3.39Å; L117-T121 VanDerWaalsContact O-OG1 3.06Å; L117-R171 HydrophobicContact CD1-CB 4.4Å; L117-R171 HydrophobicContact CD1-CG 3.83Å; L117-Y212 HydrophobicContact CD2-CE2 4.44Å
118	I	98.1	Very high	96.1	Very high	19 Å²	19	26.8 Å²	26.8	10%	0.097	13%	0.128	C	C	.	.	H	α-helix	trans	-60	-47.6	171.2	-69.5	163.1	0	0	0	110.5	A114 I115 Q120 T121 W122 F165 N168 W172	A114-I118 WeakPolarHBondContact O-CD1 3.3Å; A114-I118 VanDerWaalsContact O-CG1 3.23Å; A114-I118 WeakPolarHBondContact O-CG1 3.28Å; A114-I118 PolarHBondContact O-N 3.2Å; I115-I118 PolarHBondContact O-N 2.94Å; I118-Q120 VanDerWaalsContact C-N 3.28Å; I118-Q120 PolarHBondContact O-N 3.37Å; I118-T121 PolarHBondContact O-N 3.42Å; I118-W122 VanDerWaalsContact O-CB 3.29Å; I118-W122 WeakPolarHBondContact O-CB 3.44Å; I118-W122 PolarHBondContact O-N 3.27Å; I118-F165 HydrophobicContact CD1-CD2 3.9Å; I118-F165 HydrophobicContact CD1-CE2 4.46Å; I118-N168 HydrophobicContact CD1-CB 4.37Å; I118-N168 HydrophobicContact CG1-CB 3.51Å; I118-W172 HydrophobicContact CD1-CH2 3.31Å; I118-W172 HydrophobicContact CD1-CZ2 4.22Å; I118-W172 HydrophobicContact CD1-CZ3 3.67Å
119	G	97.9	Very high	95.9	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-57.2	-43.7	175.3	0	0	0	0	0	111.7	S75 V79 I115 A116 W122 S123	S75-G119 WeakPolarHBondContact CB-O 3.48Å; V79-G119 VanDerWaalsContact CG2-C 3.42Å; I115-G119 PolarHBondContact O-N 2.91Å; A116-G119 PolarHBondContact O-N 3.05Å; G119-W122 PolarHBondContact O-N 3.2Å; G119-S123 WeakPolarHBondContact O-CB 3.33Å; G119-S123 PolarHBondContact O-N 3.45Å
120	Q	96.3	Very high	95.6	Very high	26 Å²	26	26.5 Å²	26.5	12%	0.121	13%	0.126	C	C	.	.	H	α-helix	trans	-65.3	-51.8	179.7	-162.1	-171.8	28.5	0	0	111.4	V79 A116 L117 I118 W122 S123 V124 Y212 M216	V79-Q120 HydrophobicContact CG2-CB 4.09Å; V79-Q120 VanDerWaalsContact CG2-N 3.34Å; A116-Q120 WeakPolarHBondContact O-CB 3.33Å; A116-Q120 PolarHBondContact O-N 3.04Å; L117-Q120 PolarHBondContact O-N 3.32Å; I118-Q120 VanDerWaalsContact C-N 3.28Å; I118-Q120 PolarHBondContact O-N 3.37Å; Q120-W122 PolarHBondContact O-N 3.09Å; Q120-S123 WeakPolarHBondContact O-CB 3.21Å; Q120-S123 PolarHBondContact O-N 3.14Å; Q120-S123 VanDerWaalsContact O-N 3.08Å; Q120-V124 WeakPolarHBondContact O-CG2 3.33Å; Q120-V124 PolarHBondContact O-N 3.28Å; Q120-Y212 PolarHBondContact OE1-OH 3.35Å; Q120-Y212 VanDerWaalsContact OE1-OH 3.09Å; Q120-M216 HydrophobicContact CB-CE 4.18Å; Q120-M216 HydrophobicContact CG-CE 3.69Å
121	T	96.9	Very high	95.3	Very high	4 Å²	4	23.8 Å²	23.8	3%	0.025	12%	0.117	C	C	.	.	H	α-helix	trans	-58.1	-37.7	176.6	-56.8	0	0	0	0	111.4	L117 I118 G125 F163 F167 N168 M216	L117-T121 PolarHBondContact O-N 3.17Å; L117-T121 PolarHBondContact O-OG1 3.39Å; L117-T121 VanDerWaalsContact O-OG1 3.06Å; I118-T121 PolarHBondContact O-N 3.42Å; T121-G125 PolarHBondContact O-N 3.36Å; T121-F163 HydrophobicContact CG2-CE1 4.3Å; T121-F167 HydrophobicContact CG2-CD1 4.2Å; T121-N168 PolarHBondContact OG1-ND2 2.82Å; T121-M216 HydrophobicContact CG2-SD 4.06Å; T121-M216 PolarHBondContact OG1-SD 3.46Å; T121-M216 VanDerWaalsContact OG1-SD 3.38Å
122	W	98	Very high	95	Very high	23 Å²	23	18.1 Å²	18.1	9%	0.087	10%	0.1	C	C	.	.	H	α-helix	trans	-67.5	-41.1	176.5	-168.9	29.2	0	0	0	112	A71 V74 S75 I78 I118 G119 Q120 G125 M126 I161 S164	A71-W122 HydrophobicContact CB-CZ2 3.9Å; V74-W122 HydrophobicContact CB-CH2 4.08Å; V74-W122 HydrophobicContact CB-CZ3 4.14Å; V74-W122 HydrophobicContact CG1-CH2 3.85Å; V74-W122 HydrophobicContact CG1-CZ3 3.69Å; S75-W122 VanDerWaalsContact CB-CE3 3.49Å; I78-W122 HydrophobicContact CD1-CE3 4.24Å; I78-W122 HydrophobicContact CD1-CZ3 4.14Å; I118-W122 VanDerWaalsContact O-CB 3.29Å; I118-W122 WeakPolarHBondContact O-CB 3.44Å; I118-W122 PolarHBondContact O-N 3.27Å; G119-W122 PolarHBondContact O-N 3.2Å; Q120-W122 PolarHBondContact O-N 3.09Å; W122-G125 PolarHBondContact O-N 3.02Å; W122-M126 WeakPolarHBondContact O-CB 3.4Å; W122-M126 VanDerWaalsContact O-CG 3.29Å; W122-M126 WeakPolarHBondContact O-CG 3.22Å; W122-M126 PolarHBondContact O-N 3.34Å; W122-I161 HydrophobicContact CD2-CB 4.29Å; W122-I161 HydrophobicContact CD2-CD1 4.35Å; W122-I161 HydrophobicContact CD2-CG1 4.17Å; W122-I161 HydrophobicContact CE3-CD1 4.22Å; W122-I161 HydrophobicContact CE3-CG1 4.4Å; W122-I161 HydrophobicContact CH2-CD1 3.89Å; W122-I161 HydrophobicContact CZ2-CB 4.25Å; W122-I161 HydrophobicContact CZ2-CD1 4Å; W122-I161 HydrophobicContact CZ2-CG1 4.42Å; W122-I161 HydrophobicContact CZ3-CD1 3.99Å; W122-S164 VanDerWaalsContact CA-OG 3.29Å; W122-S164 WeakPolarHBondContact CA-OG 3.48Å; W122-S164 PolarHBondContact N-OG 2.87Å
123	S	96.9	Very high	94.6	Very high	3 Å²	3	17.7 Å²	17.7	2%	0.021	10%	0.096	C	C	.	.	H	α-helix	trans	-61.8	-45	175.1	-175.3	0	0	0	0	112.2	L72 S75 D76 G119 Q120 M126 T127	L72-S123 WeakPolarHBondContact CD1-OG 3.5Å; S75-S123 VanDerWaalsContact OG-CA 3.31Å; S75-S123 WeakPolarHBondContact OG-CA 3.49Å; S75-S123 WeakPolarHBondContact OG-CB 3.43Å; D76-S123 PolarHBondContact OD1-OG 3.42Å; G119-S123 WeakPolarHBondContact O-CB 3.33Å; G119-S123 PolarHBondContact O-N 3.45Å; Q120-S123 WeakPolarHBondContact O-CB 3.21Å; Q120-S123 PolarHBondContact O-N 3.14Å; Q120-S123 VanDerWaalsContact O-N 3.08Å; S123-M126 PolarHBondContact O-N 3.38Å; S123-T127 PolarHBondContact O-N 2.94Å; S123-T127 PolarHBondContact O-OG1 3.43Å
124	V	95.4	Very high	94	Very high	6 Å²	6	18.9 Å²	18.9	4%	0.036	10%	0.101	C	C	.	.	H	α-helix	trans	-58.6	-50.5	172.6	177.3	0	0	0	0	110.6	Q120 M126 T127 V128 M216 P220 F254	Q120-V124 WeakPolarHBondContact O-CG2 3.33Å; Q120-V124 PolarHBondContact O-N 3.28Å; V124-M126 VanDerWaalsContact C-N 3.3Å; V124-M126 PolarHBondContact O-N 2.95Å; V124-T127 WeakPolarHBondContact O-CB 3.38Å; V124-T127 PolarHBondContact O-N 2.77Å; V124-T127 VanDerWaalsContact O-N 3.1Å; V124-V128 PolarHBondContact O-N 2.79Å; V124-M216 HydrophobicContact CB-CE 4.48Å; V124-M216 HydrophobicContact CB-SD 4.43Å; V124-M216 HydrophobicContact CG2-CE 3.51Å; V124-M216 HydrophobicContact CG2-SD 4.02Å; V124-P220 HydrophobicContact CG1-CB 4.02Å; V124-P220 HydrophobicContact CG1-CG 3.44Å; V124-P220 VanDerWaalsContact CG1-CG 3.44Å; V124-F254 HydrophobicContact CB-CE2 4.27Å; V124-F254 HydrophobicContact CB-CZ 4.12Å; V124-F254 HydrophobicContact CG1-CE2 4.45Å; V124-F254 HydrophobicContact CG1-CZ 3.82Å; V124-F254 HydrophobicContact CG2-CE2 3.68Å; V124-F254 HydrophobicContact CG2-CZ 3.68Å
125	G	95.5	Very high	93.3	Very high	17 Å²	17	20.9 Å²	20.9	18%	0.175	11%	0.108	C	C	.	.	H	α-helix	trans	-57.7	-42.3	178.9	0	0	0	0	0	112.1	T121 W122 V128 M129	T121-G125 PolarHBondContact O-N 3.36Å; W122-G125 PolarHBondContact O-N 3.02Å; G125-V128 PolarHBondContact O-N 3.35Å; G125-M129 WeakPolarHBondContact O-CB 3.35Å; G125-M129 WeakPolarHBondContact O-CG 3.38Å; G125-M129 PolarHBondContact O-N 2.98Å
126	M	94.9	Very high	92.7	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-63	-42.4	175.3	-72.6	-55.4	97.7	0	0	112.1	Y68 A71 L72 W122 S123 V124 V128 M129 V130 L157 T160	Y68-M126 HydrophobicContact CD1-SD 3.99Å; A71-M126 HydrophobicContact CB-CG 4.03Å; A71-M126 HydrophobicContact CB-SD 3.52Å; A71-M126 VanDerWaalsContact CB-SD 3.52Å; L72-M126 HydrophobicContact CB-CB 4.05Å; L72-M126 HydrophobicContact CB-CG 4.49Å; L72-M126 HydrophobicContact CD1-CB 3.94Å; W122-M126 WeakPolarHBondContact O-CB 3.4Å; W122-M126 VanDerWaalsContact O-CG 3.29Å; W122-M126 WeakPolarHBondContact O-CG 3.22Å; W122-M126 PolarHBondContact O-N 3.34Å; S123-M126 PolarHBondContact O-N 3.38Å; V124-M126 VanDerWaalsContact C-N 3.3Å; V124-M126 PolarHBondContact O-N 2.95Å; M126-V128 VanDerWaalsContact C-N 3.34Å; M126-V128 PolarHBondContact O-N 2.84Å; M126-M129 PolarHBondContact O-N 3.23Å; M126-V130 WeakPolarHBondContact O-CB 3.49Å; M126-V130 WeakPolarHBondContact O-CG2 3.45Å; M126-V130 PolarHBondContact O-N 3.39Å; M126-L157 HydrophobicContact CE-CD2 3.94Å; M126-L157 HydrophobicContact SD-CD2 3.41Å; M126-L157 WeakPolarHBondContact SD-CD2 3.42Å; M126-T160 VanDerWaalsContact CE-CB 3.46Å; M126-T160 HydrophobicContact CE-CG2 3.79Å; M126-T160 WeakPolarHBondContact CE-OG1 3.44Å
127	T	93.3	Very high	92	Very high	3 Å²	3	20.8 Å²	20.8	2%	0.018	11%	0.11	C	C	.	.	H	α-helix	trans	-61	-43.3	177.6	-58.3	0	0	0	0	111.6	S123 V124 S131 L224 V251 F254	S123-T127 PolarHBondContact O-N 2.94Å; S123-T127 PolarHBondContact O-OG1 3.43Å; V124-T127 WeakPolarHBondContact O-CB 3.38Å; V124-T127 PolarHBondContact O-N 2.77Å; V124-T127 VanDerWaalsContact O-N 3.1Å; T127-S131 WeakPolarHBondContact O-CB 3.31Å; T127-S131 PolarHBondContact O-N 3.19Å; T127-S131 PolarHBondContact O-OG 3.15Å; T127-L224 HydrophobicContact CG2-CD1 4.3Å; T127-V251 HydrophobicContact CG2-CG2 4.21Å; T127-F254 HydrophobicContact CG2-CB 4.01Å; T127-F254 HydrophobicContact CG2-CD1 4.13Å; T127-F254 HydrophobicContact CG2-CD2 4.32Å; T127-F254 HydrophobicContact CG2-CG 3.87Å
128	V	93.1	Very high	91.1	Very high	13 Å²	13	22.3 Å²	22.3	8%	0.079	12%	0.12	C	C	.	.	H	α-helix	trans	-64.3	-49.7	174.5	175.1	0	0	0	0	110.9	V124 G125 M126 V130 S131 T132 P220 L223	V124-V128 PolarHBondContact O-N 2.79Å; G125-V128 PolarHBondContact O-N 3.35Å; M126-V128 VanDerWaalsContact C-N 3.34Å; M126-V128 PolarHBondContact O-N 2.84Å; V128-V130 PolarHBondContact O-N 2.84Å; V128-S131 WeakPolarHBondContact O-CB 3.38Å; V128-S131 PolarHBondContact O-N 2.83Å; V128-S131 VanDerWaalsContact O-N 3.11Å; V128-T132 WeakPolarHBondContact O-CB 3.3Å; V128-T132 PolarHBondContact O-N 3.41Å; V128-T132 PolarHBondContact O-OG1 2.93Å; V128-T132 VanDerWaalsContact O-OG1 3.04Å; V128-P220 HydrophobicContact CG2-CB 3.78Å; V128-P220 HydrophobicContact CG2-CG 4.04Å; V128-L223 HydrophobicContact CG1-CD1 4Å
129	M	92.8	Very high	90.3	Very high	63 Å²	63	23.8 Å²	23.8	31%	0.31	13%	0.131	S	C	.	.	H	α-helix	trans	-64.6	-39.1	-176.4	-68.1	-59	145.9	0	0	113	Y68 G125 M126 S131 H133 V156 T160	Y68-M129 HydrophobicContact CD1-CB 4Å; Y68-M129 HydrophobicContact CE1-CB 3.61Å; G125-M129 WeakPolarHBondContact O-CB 3.35Å; G125-M129 WeakPolarHBondContact O-CG 3.38Å; G125-M129 PolarHBondContact O-N 2.98Å; M126-M129 PolarHBondContact O-N 3.23Å; M129-S131 VanDerWaalsContact C-N 3.3Å; M129-S131 PolarHBondContact O-N 2.77Å; M129-H133 VanDerWaalsContact O-CB 3.22Å; M129-H133 WeakPolarHBondContact O-CB 3.46Å; M129-H133 PolarHBondContact O-N 3.16Å; M129-V156 HydrophobicContact CG-CG1 4.18Å; M129-V156 HydrophobicContact SD-CG1 4.03Å; M129-T160 HydrophobicContact CE-CG2 4.38Å; M129-T160 HydrophobicContact CG-CG2 3.9Å
130	V	90.2	Very high	89.7	Confident	4 Å²	4	29.2 Å²	29.2	2%	0.024	15%	0.153	C	C	.	.	H	α-helix	trans	-57.3	-46.8	171.8	163.7	0	0	0	0	110.9	Y68 L69 M126 V128 H133 R134 L247	Y68-V130 HydrophobicContact CD1-CG2 4.39Å; Y68-V130 HydrophobicContact CD2-CG2 4.43Å; Y68-V130 HydrophobicContact CG-CG2 3.82Å; L69-V130 HydrophobicContact CD2-CG2 4.46Å; M126-V130 WeakPolarHBondContact O-CB 3.49Å; M126-V130 WeakPolarHBondContact O-CG2 3.45Å; M126-V130 PolarHBondContact O-N 3.39Å; V128-V130 PolarHBondContact O-N 2.84Å; V130-H133 PolarHBondContact O-N 3.25Å; V130-R134 WeakPolarHBondContact O-CG 3.29Å; V130-R134 PolarHBondContact O-N 2.74Å; V130-R134 VanDerWaalsContact O-N 3.09Å; V130-L247 HydrophobicContact CG1-CB 4.24Å; V130-L247 HydrophobicContact CG1-CD1 4.21Å; V130-L247 HydrophobicContact CG1-CD2 3.61Å; V130-L247 HydrophobicContact CG1-CG 4.19Å
131	S	87.3	Confident	89.1	Confident	8 Å²	8	31.2 Å²	31.2	6%	0.056	17%	0.168	C	C	.	.	H	α-helix	trans	-66.8	-45.9	-177.2	-58.4	0	0	0	0	111.2	T127 V128 M129 R134 Y135 L224 V251	T127-S131 WeakPolarHBondContact O-CB 3.31Å; T127-S131 PolarHBondContact O-N 3.19Å; T127-S131 PolarHBondContact O-OG 3.15Å; V128-S131 WeakPolarHBondContact O-CB 3.38Å; V128-S131 PolarHBondContact O-N 2.83Å; V128-S131 VanDerWaalsContact O-N 3.11Å; M129-S131 VanDerWaalsContact C-N 3.3Å; M129-S131 PolarHBondContact O-N 2.77Å; S131-R134 CarbonylContact O-C 3.56Å; S131-R134 PolarHBondContact O-N 2.94Å; S131-R134 VanDerWaalsContact O-N 3.09Å; S131-Y135 PolarHBondContact O-N 3.01Å; S131-L224 WeakPolarHBondContact OG-CD2 3.43Å; S131-V251 WeakPolarHBondContact OG-CG2 3.42Å
132	T	88.3	Confident	88.6	Confident	36 Å²	36	39.1 Å²	39.1	22%	0.221	20%	0.202	C	C	.	.	H	α-helix	trans	-59.2	-47.3	174.2	-61.1	0	0	0	0	111.3	V128 R134 Y135 F136	V128-T132 WeakPolarHBondContact O-CB 3.3Å; V128-T132 PolarHBondContact O-N 3.41Å; V128-T132 PolarHBondContact O-OG1 2.93Å; V128-T132 VanDerWaalsContact O-OG1 3.04Å; T132-R134 PolarHBondContact O-N 3.12Å; T132-R134 VanDerWaalsContact O-N 3.17Å; T132-Y135 WeakPolarHBondContact O-CB 3.35Å; T132-Y135 PolarHBondContact O-N 3.47Å; T132-Y135 VanDerWaalsContact O-N 3.16Å; T132-F136 HydrophobicContact CG2-CD2 3.71Å; T132-F136 HydrophobicContact CG2-CE2 3.48Å; T132-F136 VanDerWaalsContact CG2-CE2 3.48Å; T132-F136 VanDerWaalsContact O-CD2 3.24Å; T132-F136 WeakPolarHBondContact O-CD2 3.33Å; T132-F136 PolarHBondContact O-N 2.75Å
133	H	87.9	Confident	88.1	Confident	13 Å²	13	41.9 Å²	41.9	6%	0.06	22%	0.218	C	C	.	.	H	α-helix	trans	-59	-29.1	175.8	176.7	-81.4	0	0	0	112.7	V65 Y68 M129 V130 G137 C148	V65-H133 WeakPolarHBondContact CG2-CE1 3.34Å; V65-H133 WeakPolarHBondContact CG2-ND1 3.45Å; Y68-H133 HydrophobicContact CE2-CB 4.14Å; Y68-H133 AromaticContact CE2-CD2 3.85Å; M129-H133 VanDerWaalsContact O-CB 3.22Å; M129-H133 WeakPolarHBondContact O-CB 3.46Å; M129-H133 PolarHBondContact O-N 3.16Å; V130-H133 PolarHBondContact O-N 3.25Å; H133-G137 PolarHBondContact O-N 2.89Å; H133-C148 PolarHBondContact CD2-SG 3.48Å; H133-C148 VanDerWaalsContact NE2-CB 3.33Å; H133-C148 WeakPolarHBondContact NE2-CB 3.17Å
134	R	83.1	Confident	87.6	Confident	53 Å²	53	42.2 Å²	42.2	20%	0.2	22%	0.221	C	C	.	.	H	α-helix	trans	-82.5	-38.7	173.7	-64.3	-64.2	66.7	-149.9	-17.7	114.2	V130 S131 T132 F136 G137 V138 L247	V130-R134 WeakPolarHBondContact O-CG 3.29Å; V130-R134 PolarHBondContact O-N 2.74Å; V130-R134 VanDerWaalsContact O-N 3.09Å; S131-R134 CarbonylContact O-C 3.56Å; S131-R134 PolarHBondContact O-N 2.94Å; S131-R134 VanDerWaalsContact O-N 3.09Å; T132-R134 PolarHBondContact O-N 3.12Å; T132-R134 VanDerWaalsContact O-N 3.17Å; R134-F136 VanDerWaalsContact C-N 3.34Å; R134-F136 PolarHBondContact O-N 3.35Å; R134-G137 PolarHBondContact O-N 3.4Å; R134-V138 WeakPolarHBondContact O-CG2 3.38Å; R134-V138 PolarHBondContact O-N 3.45Å; R134-V138 VanDerWaalsContact O-N 3.09Å; R134-L247 HydrophobicContact CG-CD1 3.29Å
135	Y	82.6	Confident	87.1	Confident	42 Å²	42	49.3 Å²	49.3	17%	0.165	25%	0.254	C	S	.	.	H	α-helix	trans	-55.1	-51.5	171.3	179.3	-103.6	0	0	0	111	S131 T132 G137 V138 C139 Y140 I227 N230	S131-Y135 PolarHBondContact O-N 3.01Å; T132-Y135 WeakPolarHBondContact O-CB 3.35Å; T132-Y135 PolarHBondContact O-N 3.47Å; T132-Y135 VanDerWaalsContact O-N 3.16Å; Y135-G137 VanDerWaalsContact C-N 3.3Å; Y135-G137 PolarHBondContact O-N 3.07Å; Y135-V138 PolarHBondContact O-N 3.14Å; Y135-V138 VanDerWaalsContact O-N 3.12Å; Y135-C139 HydrophobicContact CE1-CB 4.46Å; Y135-C139 HydrophobicContact CE2-CB 4.14Å; Y135-C139 WeakPolarHBondContact CE2-SG 3.47Å; Y135-C139 PolarHBondContact O-N 3.22Å; Y135-Y140 HydrophobicContact CE1-CD2 4.34Å; Y135-Y140 AromaticContact CE1-CE2 3.83Å; Y135-Y140 HydrophobicContact CE1-CE2 3.83Å; Y135-I227 HydrophobicContact CD2-CB 4.36Å; Y135-I227 HydrophobicContact CD2-CG1 4.11Å; Y135-I227 HydrophobicContact CD2-CG2 4.03Å; Y135-I227 HydrophobicContact CG-CG1 4.06Å; Y135-I227 HydrophobicContact CG-CG2 4.32Å; Y135-N230 HydrophobicContact CE2-CB 4.09Å; Y135-N230 PolarHBondContact OH-ND2 2.89Å
136	F	85.1	Confident	86.7	Confident	61 Å²	61	57.4 Å²	57.4	27%	0.268	28%	0.279	S	S	.	.	H	α-helix	trans	-58.1	-41.6	175.5	-81.1	-71.7	0	0	0	112.8	T132 R134 V138 Y140 A144	T132-F136 HydrophobicContact CG2-CD2 3.71Å; T132-F136 HydrophobicContact CG2-CE2 3.48Å; T132-F136 VanDerWaalsContact CG2-CE2 3.48Å; T132-F136 VanDerWaalsContact O-CD2 3.24Å; T132-F136 WeakPolarHBondContact O-CD2 3.33Å; T132-F136 PolarHBondContact O-N 2.75Å; R134-F136 VanDerWaalsContact C-N 3.34Å; R134-F136 PolarHBondContact O-N 3.35Å; F136-V138 PolarHBondContact O-N 2.97Å; F136-Y140 HydrophobicContact CD1-CD2 4.08Å; F136-Y140 HydrophobicContact CE1-CD2 4.42Å; F136-Y140 CarbonylContact O-C 3.59Å; F136-Y140 VanDerWaalsContact O-CA 3.3Å; F136-Y140 WeakPolarHBondContact O-CA 3.41Å; F136-Y140 PolarHBondContact O-N 3.19Å; F136-Y140 VanDerWaalsContact O-O 3.05Å; F136-A144 HydrophobicContact CB-CB 4.33Å
137	G	82.6	Confident	86.3	Confident	23 Å²	23	64.1 Å²	64.1	24%	0.237	30%	0.304	C	S	.	.	H	α-helix	trans	-66.2	-22.4	179.7	0	0	0	0	0	115	H133 R134 Y135	H133-G137 PolarHBondContact O-N 2.89Å; R134-G137 PolarHBondContact O-N 3.4Å; Y135-G137 VanDerWaalsContact C-N 3.3Å; Y135-G137 PolarHBondContact O-N 3.07Å
138	V	77.9	Confident	85.9	Confident	52 Å²	52	65.2 Å²	65.2	32%	0.315	31%	0.312	S	S	.	.	H	α-helix	trans	-97.3	-54.3	179.5	175.3	0	0	0	0	110.2	R134 Y135 F136	R134-V138 WeakPolarHBondContact O-CG2 3.38Å; R134-V138 PolarHBondContact O-N 3.45Å; R134-V138 VanDerWaalsContact O-N 3.09Å; Y135-V138 PolarHBondContact O-N 3.14Å; Y135-V138 VanDerWaalsContact O-N 3.12Å; F136-V138 PolarHBondContact O-N 2.97Å
139	C	80.9	Confident	85.8	Confident	50 Å²	50	67 Å²	67	34%	0.338	32%	0.323	S	S	.	.	H	α-helix	trans	-81.3	-24	-173.1	-58.6	0	0	0	0	113.3	Y135	Y135-C139 HydrophobicContact CE1-CB 4.46Å; Y135-C139 HydrophobicContact CE2-CB 4.14Å; Y135-C139 WeakPolarHBondContact CE2-SG 3.47Å; Y135-C139 PolarHBondContact O-N 3.22Å
140	Y	83.8	Confident	85.6	Confident	114 Å²	114	66.7 Å²	66.7	45%	0.447	33%	0.327	S	S	.	.			trans	-139.1	60.8	-176.4	-55.6	-77.3	0	0	0	112.1	Y135 F136 F142 L143 A144	Y135-Y140 HydrophobicContact CE1-CD2 4.34Å; Y135-Y140 AromaticContact CE1-CE2 3.83Å; Y135-Y140 HydrophobicContact CE1-CE2 3.83Å; F136-Y140 HydrophobicContact CD1-CD2 4.08Å; F136-Y140 HydrophobicContact CE1-CD2 4.42Å; F136-Y140 CarbonylContact O-C 3.59Å; F136-Y140 VanDerWaalsContact O-CA 3.3Å; F136-Y140 WeakPolarHBondContact O-CA 3.41Å; F136-Y140 PolarHBondContact O-N 3.19Å; F136-Y140 VanDerWaalsContact O-O 3.05Å; Y140-F142 VanDerWaalsContact C-N 3.31Å; Y140-F142 PolarHBondContact O-N 2.88Å; Y140-L143 PolarHBondContact O-N 3.33Å; Y140-A144 PolarHBondContact O-N 3.05Å
141	P	84.5	Confident	85.6	Confident	68 Å²	68	74 Å²	74	44%	0.442	36%	0.361	S	S	.	.	H	α-helix	trans	-57.3	-38.8	-169.9	21.8	-33.7	0	0	0	113.7	A144 Q145	P141-A144 PolarHBondContact O-N 3.38Å; P141-Q145 PolarHBondContact O-N 3.08Å
142	F	87.4	Confident	85.9	Confident	170 Å²	170	78.1 Å²	78.1	75%	0.746	38%	0.378	S	S	*	.	H	α-helix	trans	-67.4	-39.4	177.8	-61.1	-68.7	0	0	0	113	Y140	Y140-F142 VanDerWaalsContact C-N 3.31Å; Y140-F142 PolarHBondContact O-N 2.88Å
143	L	87.5	Confident	86.1	Confident	80 Å²	80	76.5 Å²	76.5	42%	0.419	37%	0.368	S	S	.	.	H	α-helix	trans	-69.6	-39.4	174.2	-90.6	64.9	0	0	0	110.7	Y140 Q145 R146 W147	Y140-L143 PolarHBondContact O-N 3.33Å; L143-Q145 VanDerWaalsContact C-N 3.3Å; L143-Q145 PolarHBondContact O-N 3.37Å; L143-R146 PolarHBondContact O-N 3.08Å; L143-W147 WeakPolarHBondContact O-CB 3.34Å; L143-W147 PolarHBondContact O-N 3.31Å
144	A	85	Confident	86.4	Confident	10 Å²	10	80.2 Å²	80.2	8%	0.083	38%	0.384	C	S	.	.	H	α-helix	trans	-58.5	-42.6	176.5	0	0	0	0	0	111.4	F136 Y140 P141 R146 W147 C148	F136-A144 HydrophobicContact CB-CB 4.33Å; Y140-A144 PolarHBondContact O-N 3.05Å; P141-A144 PolarHBondContact O-N 3.38Å; A144-R146 PolarHBondContact O-N 3.44Å; A144-W147 PolarHBondContact O-N 2.98Å; A144-C148 WeakPolarHBondContact O-CA 3.39Å; A144-C148 WeakPolarHBondContact O-CB 3.28Å; A144-C148 PolarHBondContact O-N 3.19Å
145	Q	84.7	Confident	87	Confident	155 Å²	155	84.4 Å²	84.4	72%	0.724	40%	0.404	S	S	*	.	H	α-helix	trans	-57.8	-33.6	175.4	-170.7	175.1	1.3	0	0	112.7	P141 L143	P141-Q145 PolarHBondContact O-N 3.08Å; L143-Q145 VanDerWaalsContact C-N 3.3Å; L143-Q145 PolarHBondContact O-N 3.37Å
146	R	87.9	Confident	87.6	Confident	187 Å²	187	84.4 Å²	84.4	71%	0.706	41%	0.408	S	S	*	.	H	α-helix	trans	-84	-33.2	179.5	-166.4	179.7	178.1	-178.3	-0.4	113.5	L143 A144 K152	L143-R146 PolarHBondContact O-N 3.08Å; A144-R146 PolarHBondContact O-N 3.44Å; R146-K152 PolarHBondContact O-NZ 2.94Å
147	W	85.4	Confident	88.2	Confident	141 Å²	141	82.6 Å²	82.6	53%	0.534	40%	0.401	S	S	.	.	H	α-helix	trans	-105.3	-23.8	-169.4	-72.7	17.3	0	0	0	113.8	L143 A144 T149 K152	L143-W147 WeakPolarHBondContact O-CB 3.34Å; L143-W147 PolarHBondContact O-N 3.31Å; A144-W147 PolarHBondContact O-N 2.98Å; W147-T149 VanDerWaalsContact C-N 3.31Å; W147-T149 PolarHBondContact O-N 3.41Å; W147-K152 WeakPolarHBondContact O-CD 3.46Å
148	C	86.1	Confident	88.9	Confident	26 Å²	26	89.3 Å²	89.3	18%	0.176	42%	0.421	C	S	.	.			trans	-95.4	38.1	-179.3	-63	0	0	0	0	112.6	H133 A144	H133-C148 PolarHBondContact CD2-SG 3.48Å; H133-C148 VanDerWaalsContact NE2-CB 3.33Å; H133-C148 WeakPolarHBondContact NE2-CB 3.17Å; A144-C148 WeakPolarHBondContact O-CA 3.39Å; A144-C148 WeakPolarHBondContact O-CB 3.28Å; A144-C148 PolarHBondContact O-N 3.19Å
149	T	89.7	Confident	89.9	Confident	50 Å²	50	89.6 Å²	89.6	31%	0.307	42%	0.424	S	S	.	.			trans	-78.3	154.1	175.1	66.9	0	0	0	0	110.8	W147 E151 K152 V153	W147-T149 VanDerWaalsContact C-N 3.31Å; W147-T149 PolarHBondContact O-N 3.41Å; T149-E151 PolarHBondContact O-N 2.98Å; T149-K152 PolarHBondContact O-N 3.29Å; T149-K152 WeakPolarHBondContact OG1-CG 3.4Å; T149-V153 WeakPolarHBondContact O-CG2 3.13Å; T149-V153 PolarHBondContact O-N 2.92Å
150	S	88.7	Confident	90.6	Very high	58 Å²	58	88 Å²	88	41%	0.406	41%	0.413	S	S	.	.	H	α-helix	trans	-56.3	-35.6	-177.8	-58.8	0	0	0	0	113.8	K154	S150-K154 VanDerWaalsContact O-CG 3.3Å; S150-K154 WeakPolarHBondContact O-CG 3.04Å; S150-K154 PolarHBondContact O-N 2.95Å; S150-K154 VanDerWaalsContact O-N 3.14Å
151	E	91.3	Very high	91.3	Very high	158 Å²	158	85.7 Å²	85.7	74%	0.738	41%	0.407	S	S	*	.	H	α-helix	trans	-69.1	-47.1	179.4	-67.2	172.1	-177.1	0	0	111.8	T149 V153 K154 F155	T149-E151 PolarHBondContact O-N 2.98Å; E151-V153 VanDerWaalsContact C-N 3.33Å; E151-V153 PolarHBondContact O-N 2.85Å; E151-K154 PolarHBondContact O-N 3.44Å; E151-F155 PolarHBondContact O-N 2.73Å; E151-F155 VanDerWaalsContact O-N 3.1Å
152	K	93	Very high	92	Very high	93 Å²	93	84.7 Å²	84.7	40%	0.404	41%	0.405	S	S	.	.	H	α-helix	trans	-65.1	-38.9	177.9	-68.3	179.6	179.2	179.3	0	111.6	R146 W147 T149 F155 V156	R146-K152 PolarHBondContact O-NZ 2.94Å; W147-K152 WeakPolarHBondContact O-CD 3.46Å; T149-K152 PolarHBondContact O-N 3.29Å; T149-K152 WeakPolarHBondContact OG1-CG 3.4Å; K152-F155 WeakPolarHBondContact O-CB 3.41Å; K152-F155 PolarHBondContact O-N 2.92Å; K152-V156 WeakPolarHBondContact O-CG2 3.44Å; K152-V156 PolarHBondContact O-N 2.95Å
153	V	93.6	Very high	92.5	Very high	3 Å²	3	81.4 Å²	81.4	2%	0.018	39%	0.391	C	S	.	.	H	α-helix	trans	-63.7	-42.8	176	166.7	0	0	0	0	111.5	V64 W67 Y68 T149 E151 F155 V156 L157	V64-V153 HydrophobicContact CG1-CB 3.66Å; V64-V153 HydrophobicContact CG1-CG1 3.85Å; V64-V153 HydrophobicContact CG1-CG2 3.38Å; W67-V153 HydrophobicContact CB-CG1 4.35Å; Y68-V153 HydrophobicContact CD2-CG1 4.08Å; Y68-V153 HydrophobicContact CE1-CG1 4.3Å; Y68-V153 HydrophobicContact CE2-CB 4.35Å; Y68-V153 HydrophobicContact CE2-CG1 3.49Å; Y68-V153 VanDerWaalsContact CE2-CG1 3.49Å; Y68-V153 HydrophobicContact CE2-CG2 3.96Å; T149-V153 WeakPolarHBondContact O-CG2 3.13Å; T149-V153 PolarHBondContact O-N 2.92Å; E151-V153 VanDerWaalsContact C-N 3.33Å; E151-V153 PolarHBondContact O-N 2.85Å; V153-F155 VanDerWaalsContact C-N 3.3Å; V153-F155 PolarHBondContact O-N 3.15Å; V153-V156 PolarHBondContact O-N 3.45Å; V153-L157 HydrophobicContact CG1-CD1 4.45Å; V153-L157 HydrophobicContact CG1-CG 4.48Å; V153-L157 WeakPolarHBondContact O-CG 3.46Å; V153-L157 PolarHBondContact O-N 3.21Å
154	K	93.7	Very high	93	Very high	91 Å²	91	77.7 Å²	77.7	40%	0.396	37%	0.371	S	S	.	.	H	α-helix	trans	-58.7	-42.5	173.6	-71.9	171	-174.2	179	0	112	S150 E151 V156 L157 Y158	S150-K154 VanDerWaalsContact O-CG 3.3Å; S150-K154 WeakPolarHBondContact O-CG 3.04Å; S150-K154 PolarHBondContact O-N 2.95Å; S150-K154 VanDerWaalsContact O-N 3.14Å; E151-K154 PolarHBondContact O-N 3.44Å; K154-V156 PolarHBondContact O-N 2.88Å; K154-L157 WeakPolarHBondContact O-CB 3.38Å; K154-L157 PolarHBondContact O-N 3.48Å; K154-Y158 HydrophobicContact CB-CE2 4.38Å; K154-Y158 WeakPolarHBondContact O-CD2 3.48Å; K154-Y158 PolarHBondContact O-N 3.3Å
155	F	95.9	Very high	93.6	Very high	140 Å²	140	81.7 Å²	81.7	61%	0.614	39%	0.387	S	S	*	.	H	α-helix	trans	-58.8	-46.8	174.6	179.6	-101	0	0	0	111.9	E151 K152 V153 L157 Y158 C159	E151-F155 PolarHBondContact O-N 2.73Å; E151-F155 VanDerWaalsContact O-N 3.1Å; K152-F155 WeakPolarHBondContact O-CB 3.41Å; K152-F155 PolarHBondContact O-N 2.92Å; V153-F155 VanDerWaalsContact C-N 3.3Å; V153-F155 PolarHBondContact O-N 3.15Å; F155-L157 VanDerWaalsContact C-N 3.29Å; F155-L157 PolarHBondContact O-N 2.96Å; F155-Y158 PolarHBondContact O-N 3.14Å; F155-Y158 VanDerWaalsContact O-N 3.11Å; F155-C159 VanDerWaalsContact CE1-SG 3.51Å; F155-C159 VanDerWaalsContact CZ-SG 3.54Å; F155-C159 PolarHBondContact O-N 3.46Å; F155-C159 PolarHBondContact O-SG 3.39Å; F155-C159 VanDerWaalsContact O-SG 3.36Å
156	V	95.7	Very high	94.2	Very high	43 Å²	43	79.7 Å²	79.7	26%	0.261	38%	0.381	S	S	.	.	H	α-helix	trans	-58.5	-39.9	174.8	173.2	0	0	0	0	111.8	Y68 M129 K152 V153 K154 Y158 C159 T160	Y68-V156 HydrophobicContact CE1-CG1 4.18Å; M129-V156 HydrophobicContact CG-CG1 4.18Å; M129-V156 HydrophobicContact SD-CG1 4.03Å; K152-V156 WeakPolarHBondContact O-CG2 3.44Å; K152-V156 PolarHBondContact O-N 2.95Å; V153-V156 PolarHBondContact O-N 3.45Å; K154-V156 PolarHBondContact O-N 2.88Å; V156-Y158 PolarHBondContact O-N 3.32Å; V156-C159 PolarHBondContact O-N 3Å; V156-T160 HydrophobicContact CG1-CG2 4.32Å; V156-T160 WeakPolarHBondContact O-CB 3.48Å; V156-T160 WeakPolarHBondContact O-CG2 3.23Å; V156-T160 PolarHBondContact O-N 3.45Å; V156-T160 PolarHBondContact O-OG1 3.04Å
157	L	97.1	Very high	94.7	Very high	22 Å²	22	71.8 Å²	71.8	12%	0.115	35%	0.352	C	S	.	.	H	α-helix	trans	-62.5	-41.1	175.6	-65.6	177.9	0	0	0	112.1	W67 Y68 A71 M126 V153 K154 F155 T160 I161	W67-L157 HydrophobicContact CB-CD1 4.02Å; Y68-L157 HydrophobicContact CD1-CD2 3.53Å; Y68-L157 HydrophobicContact CE1-CD2 3.87Å; Y68-L157 HydrophobicContact CG-CD2 4.3Å; A71-L157 HydrophobicContact CB-CD2 3.84Å; M126-L157 HydrophobicContact CE-CD2 3.94Å; M126-L157 HydrophobicContact SD-CD2 3.41Å; M126-L157 WeakPolarHBondContact SD-CD2 3.42Å; V153-L157 HydrophobicContact CG1-CD1 4.45Å; V153-L157 HydrophobicContact CG1-CG 4.48Å; V153-L157 WeakPolarHBondContact O-CG 3.46Å; V153-L157 PolarHBondContact O-N 3.21Å; K154-L157 WeakPolarHBondContact O-CB 3.38Å; K154-L157 PolarHBondContact O-N 3.48Å; F155-L157 VanDerWaalsContact C-N 3.29Å; F155-L157 PolarHBondContact O-N 2.96Å; L157-T160 WeakPolarHBondContact CA-OG1 3.45Å; L157-T160 PolarHBondContact O-OG1 2.86Å; L157-I161 WeakPolarHBondContact O-CG2 3.18Å; L157-I161 PolarHBondContact O-N 3.47Å
158	Y	97.4	Very high	95.3	Very high	165 Å²	165	65.1 Å²	65.1	65%	0.647	33%	0.326	S	S	*	.	H	α-helix	trans	-67.6	-40.4	175.2	-67.6	-57.4	0	0	0	112.5	K154 F155 V156 T160 I161 A162	K154-Y158 HydrophobicContact CB-CE2 4.38Å; K154-Y158 WeakPolarHBondContact O-CD2 3.48Å; K154-Y158 PolarHBondContact O-N 3.3Å; F155-Y158 PolarHBondContact O-N 3.14Å; F155-Y158 VanDerWaalsContact O-N 3.11Å; V156-Y158 PolarHBondContact O-N 3.32Å; Y158-T160 PolarHBondContact O-N 3.19Å; Y158-I161 VanDerWaalsContact O-CG2 3.23Å; Y158-I161 WeakPolarHBondContact O-CG2 3.45Å; Y158-A162 VanDerWaalsContact O-CB 3.27Å; Y158-A162 WeakPolarHBondContact O-CB 3.36Å; Y158-A162 PolarHBondContact O-N 3.4Å
159	C	97.6	Very high	95.8	Very high	58 Å²	58	67.9 Å²	67.9	39%	0.392	34%	0.339	S	S	.	.	H	α-helix	trans	-64.3	-40.2	177.3	-67.4	0	0	0	0	112.4	F155 V156 A162 F163	F155-C159 VanDerWaalsContact CE1-SG 3.51Å; F155-C159 VanDerWaalsContact CZ-SG 3.54Å; F155-C159 PolarHBondContact O-N 3.46Å; F155-C159 PolarHBondContact O-SG 3.39Å; F155-C159 VanDerWaalsContact O-SG 3.36Å; V156-C159 PolarHBondContact O-N 3Å; C159-A162 PolarHBondContact O-N 3.01Å; C159-F163 WeakPolarHBondContact O-CB 3.24Å; C159-F163 PolarHBondContact O-N 3.41Å
160	T	97.3	Very high	96.1	Very high	15 Å²	15	67.4 Å²	67.4	9%	0.092	34%	0.337	C	S	.	.	H	α-helix	trans	-70.9	-40	-177.9	45.2	0	0	0	0	113	M126 M129 V156 L157 Y158 S164	M126-T160 VanDerWaalsContact CE-CB 3.46Å; M126-T160 HydrophobicContact CE-CG2 3.79Å; M126-T160 WeakPolarHBondContact CE-OG1 3.44Å; M129-T160 HydrophobicContact CE-CG2 4.38Å; M129-T160 HydrophobicContact CG-CG2 3.9Å; V156-T160 HydrophobicContact CG1-CG2 4.32Å; V156-T160 WeakPolarHBondContact O-CB 3.48Å; V156-T160 WeakPolarHBondContact O-CG2 3.23Å; V156-T160 PolarHBondContact O-N 3.45Å; V156-T160 PolarHBondContact O-OG1 3.04Å; L157-T160 WeakPolarHBondContact CA-OG1 3.45Å; L157-T160 PolarHBondContact O-OG1 2.86Å; Y158-T160 PolarHBondContact O-N 3.19Å; T160-S164 WeakPolarHBondContact O-CB 3.48Å; T160-S164 PolarHBondContact O-N 2.86Å; T160-S164 PolarHBondContact O-OG 2.96Å
161	I	98	Very high	96.4	Very high	66 Å²	66	65 Å²	65	34%	0.338	32%	0.319	S	S	.	.	H	α-helix	trans	-67.3	-40.6	172.6	-170	173	0	0	0	111.2	W122 L157 Y158 F163 S164 F165	W122-I161 HydrophobicContact CD2-CB 4.29Å; W122-I161 HydrophobicContact CD2-CD1 4.35Å; W122-I161 HydrophobicContact CD2-CG1 4.17Å; W122-I161 HydrophobicContact CE3-CD1 4.22Å; W122-I161 HydrophobicContact CE3-CG1 4.4Å; W122-I161 HydrophobicContact CH2-CD1 3.89Å; W122-I161 HydrophobicContact CZ2-CB 4.25Å; W122-I161 HydrophobicContact CZ2-CD1 4Å; W122-I161 HydrophobicContact CZ2-CG1 4.42Å; W122-I161 HydrophobicContact CZ3-CD1 3.99Å; L157-I161 WeakPolarHBondContact O-CG2 3.18Å; L157-I161 PolarHBondContact O-N 3.47Å; Y158-I161 VanDerWaalsContact O-CG2 3.23Å; Y158-I161 WeakPolarHBondContact O-CG2 3.45Å; I161-F163 PolarHBondContact O-N 2.87Å; I161-S164 PolarHBondContact O-N 2.95Å; I161-F165 PolarHBondContact O-N 2.94Å
162	A	98.4	Very high	96.6	Very high	48 Å²	48	60.7 Å²	60.7	40%	0.397	30%	0.296	S	S	.	.	H	α-helix	trans	-62	-44.6	176.2	0	0	0	0	0	111.6	Y158 C159 S164 F165 L166	Y158-A162 VanDerWaalsContact O-CB 3.27Å; Y158-A162 WeakPolarHBondContact O-CB 3.36Å; Y158-A162 PolarHBondContact O-N 3.4Å; C159-A162 PolarHBondContact O-N 3.01Å; A162-S164 PolarHBondContact O-N 2.93Å; A162-F165 PolarHBondContact O-N 3.49Å; A162-L166 WeakPolarHBondContact O-CB 3.39Å; A162-L166 VanDerWaalsContact O-CG 3.29Å; A162-L166 WeakPolarHBondContact O-CG 3.45Å; A162-L166 PolarHBondContact O-N 3.11Å
163	F	98.1	Very high	96.8	Very high	101 Å²	101	58.5 Å²	58.5	44%	0.443	30%	0.295	S	S	.	.	H	α-helix	trans	-58.6	-47.6	173	173.7	-97.3	0	0	0	111.4	T121 C159 I161 F165 L166 F167 V215	T121-F163 HydrophobicContact CG2-CE1 4.3Å; C159-F163 WeakPolarHBondContact O-CB 3.24Å; C159-F163 PolarHBondContact O-N 3.41Å; I161-F163 PolarHBondContact O-N 2.87Å; F163-F165 VanDerWaalsContact C-N 3.27Å; F163-F165 PolarHBondContact O-N 3.46Å; F163-L166 PolarHBondContact O-N 2.9Å; F163-F167 HydrophobicContact CE1-CB 4.29Å; F163-F167 HydrophobicContact CE1-CG 4.4Å; F163-F167 HydrophobicContact CZ-CB 4.24Å; F163-F167 HydrophobicContact CZ-CD2 4.04Å; F163-F167 HydrophobicContact CZ-CG 4.21Å; F163-F167 WeakPolarHBondContact O-CB 3.25Å; F163-F167 PolarHBondContact O-N 3.29Å; F163-V215 HydrophobicContact CE1-CG1 3.94Å; F163-V215 HydrophobicContact CZ-CG1 4.04Å
164	S	98.3	Very high	96.8	Very high	1 Å²	1	58.3 Å²	58.3	1%	0.007	29%	0.294	C	S	.	.	H	α-helix	trans	-60.2	-38.9	-179.3	-55.2	0	0	0	0	112.1	W122 T160 I161 A162 N168	W122-S164 VanDerWaalsContact CA-OG 3.29Å; W122-S164 WeakPolarHBondContact CA-OG 3.48Å; W122-S164 PolarHBondContact N-OG 2.87Å; T160-S164 WeakPolarHBondContact O-CB 3.48Å; T160-S164 PolarHBondContact O-N 2.86Å; T160-S164 PolarHBondContact O-OG 2.96Å; I161-S164 PolarHBondContact O-N 2.95Å; A162-S164 PolarHBondContact O-N 2.93Å; S164-N168 WeakPolarHBondContact O-CB 3.36Å; S164-N168 PolarHBondContact O-N 3.42Å; S164-N168 PolarHBondContact O-ND2 3Å
165	F	98.1	Very high	96.9	Very high	94 Å²	94	55.3 Å²	55.3	41%	0.412	28%	0.282	S	S	.	.	H	α-helix	trans	-66.8	-52.6	174.4	-178.3	-91.4	0	0	0	112.1	I118 I161 A162 F163 F167 N168 L169 W172	I118-F165 HydrophobicContact CD1-CD2 3.9Å; I118-F165 HydrophobicContact CD1-CE2 4.46Å; I161-F165 PolarHBondContact O-N 2.94Å; A162-F165 PolarHBondContact O-N 3.49Å; F163-F165 VanDerWaalsContact C-N 3.27Å; F163-F165 PolarHBondContact O-N 3.46Å; F165-F167 VanDerWaalsContact C-N 3.34Å; F165-F167 PolarHBondContact O-N 3.08Å; F165-N168 CarbonylContact O-C 3.48Å; F165-N168 PolarHBondContact O-N 3.12Å; F165-L169 HydrophobicContact CE1-CD1 3.84Å; F165-L169 HydrophobicContact CZ-CD1 3.97Å; F165-L169 PolarHBondContact O-N 3.32Å; F165-W172 HydrophobicContact CD2-CH2 4.27Å; F165-W172 HydrophobicContact CD2-CZ3 4.45Å; F165-W172 AromaticContact CE2-CH2 3.69Å; F165-W172 HydrophobicContact CE2-CH2 3.69Å; F165-W172 AromaticContact CE2-CZ3 3.9Å; F165-W172 HydrophobicContact CE2-CZ3 3.9Å; F165-W172 HydrophobicContact CZ-CH2 4.39Å; F165-W172 HydrophobicContact CZ-CZ3 4.24Å
166	L	98	Very high	96.8	Very high	113 Å²	113	52.7 Å²	52.7	59%	0.592	27%	0.272	S	S	*	.	H	α-helix	trans	-63.4	-40.9	-178.1	-69.4	173.2	0	0	0	112	A162 F163 N168 L169	A162-L166 WeakPolarHBondContact O-CB 3.39Å; A162-L166 VanDerWaalsContact O-CG 3.29Å; A162-L166 WeakPolarHBondContact O-CG 3.45Å; A162-L166 PolarHBondContact O-N 3.11Å; F163-L166 PolarHBondContact O-N 2.9Å; L166-N168 VanDerWaalsContact C-N 3.29Å; L166-N168 PolarHBondContact O-N 2.92Å; L166-L169 WeakPolarHBondContact O-CB 3.34Å; L166-L169 PolarHBondContact O-N 3.5Å
167	F	97.6	Very high	96.8	Very high	22 Å²	22	52.1 Å²	52.1	10%	0.096	27%	0.268	C	S	.	.	H	α-helix	trans	-61	-39.2	178.7	-176.7	-106.8	0	0	0	112.1	T121 F163 F165 Y207 C211 Y212 V215	T121-F167 HydrophobicContact CG2-CD1 4.2Å; F163-F167 HydrophobicContact CE1-CB 4.29Å; F163-F167 HydrophobicContact CE1-CG 4.4Å; F163-F167 HydrophobicContact CZ-CB 4.24Å; F163-F167 HydrophobicContact CZ-CD2 4.04Å; F163-F167 HydrophobicContact CZ-CG 4.21Å; F163-F167 WeakPolarHBondContact O-CB 3.25Å; F163-F167 PolarHBondContact O-N 3.29Å; F165-F167 VanDerWaalsContact C-N 3.34Å; F165-F167 PolarHBondContact O-N 3.08Å; F167-Y207 HydrophobicContact CE2-CE2 4.34Å; F167-Y207 HydrophobicContact CZ-CE2 4.42Å; F167-Y207 WeakPolarHBondContact O-CE2 3.16Å; F167-Y207 PolarHBondContact O-OH 3.39Å; F167-C211 VanDerWaalsContact CE2-SG 3.56Å; F167-Y212 HydrophobicContact CE1-CD2 4.09Å; F167-V215 HydrophobicContact CE1-CB 4.31Å; F167-V215 HydrophobicContact CE1-CG1 4.14Å; F167-V215 HydrophobicContact CE2-CB 4.2Å; F167-V215 HydrophobicContact CE2-CG1 4.37Å; F167-V215 HydrophobicContact CE2-CG2 3.78Å; F167-V215 HydrophobicContact CZ-CB 3.82Å; F167-V215 HydrophobicContact CZ-CG1 4.06Å; F167-V215 HydrophobicContact CZ-CG2 3.89Å
168	N	97.7	Very high	96.6	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-97	4.5	-179	-70.8	-73.7	0	0	0	113.5	I118 T121 S164 F165 L166 P170 R171	I118-N168 HydrophobicContact CD1-CB 4.37Å; I118-N168 HydrophobicContact CG1-CB 3.51Å; T121-N168 PolarHBondContact OG1-ND2 2.82Å; S164-N168 WeakPolarHBondContact O-CB 3.36Å; S164-N168 PolarHBondContact O-N 3.42Å; S164-N168 PolarHBondContact O-ND2 3Å; F165-N168 CarbonylContact O-C 3.48Å; F165-N168 PolarHBondContact O-N 3.12Å; L166-N168 VanDerWaalsContact C-N 3.29Å; L166-N168 PolarHBondContact O-N 2.92Å; N168-P170 VanDerWaalsContact C-CD 3.41Å; N168-P170 VanDerWaalsContact C-N 3.31Å; N168-R171 HydrophobicContact CB-CG 3.91Å; N168-R171 WeakPolarHBondContact O-CB 3.46Å; N168-R171 WeakPolarHBondContact O-CG 3.34Å; N168-R171 PolarHBondContact O-N 2.83Å
169	L	96.4	Very high	96.5	Very high	85 Å²	85	48.3 Å²	48.3	45%	0.445	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-55.2	-40.3	178.8	-171.2	67.7	0	0	0	113.1	F165 L166 R171 W172	F165-L169 HydrophobicContact CE1-CD1 3.84Å; F165-L169 HydrophobicContact CZ-CD1 3.97Å; F165-L169 PolarHBondContact O-N 3.32Å; L166-L169 WeakPolarHBondContact O-CB 3.34Å; L166-L169 PolarHBondContact O-N 3.5Å; L169-R171 PolarHBondContact O-N 2.84Å; L169-W172 HydrophobicContact CD1-CE3 4.11Å; L169-W172 HydrophobicContact CD1-CZ3 4.06Å
170	P	96	Very high	96.4	Very high	40 Å²	40	45.6 Å²	45.6	26%	0.26	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-60.7	-23.5	175.5	-25.8	37.4	0	0	0	114.4	N168 W172 A173 M197 Y203 Y207	N168-P170 VanDerWaalsContact C-CD 3.41Å; N168-P170 VanDerWaalsContact C-N 3.31Å; P170-W172 PolarHBondContact O-N 3.5Å; P170-A173 WeakPolarHBondContact O-CB 3.45Å; P170-A173 PolarHBondContact O-N 2.93Å; P170-M197 HydrophobicContact CB-CE 3.99Å; P170-Y203 HydrophobicContact CB-CE2 4.32Å; P170-Y203 VanDerWaalsContact CB-OH 3.25Å; P170-Y203 WeakPolarHBondContact CB-OH 3.42Å; P170-Y207 HydrophobicContact CB-CE1 4.46Å; P170-Y207 HydrophobicContact CG-CE2 4.46Å
171	R	96	Very high	96.3	Very high	7 Å²	7	49.4 Å²	49.4	3%	0.026	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-59.9	-31.1	-175.3	-59.3	-63.6	178.9	153.3	-19.2	113.2	Y113 A114 L117 N168 L169 A173 E174 Y207 M208 Y212	Y113-R171 HydrophobicContact CD1-CB 4.27Å; Y113-R171 HydrophobicContact CE1-CB 3.89Å; Y113-R171 PolarHBondContact OH-NH1 3.32Å; A114-R171 HydrophobicContact CB-CB 3.77Å; L117-R171 HydrophobicContact CD1-CB 4.4Å; L117-R171 HydrophobicContact CD1-CG 3.83Å; N168-R171 HydrophobicContact CB-CG 3.91Å; N168-R171 WeakPolarHBondContact O-CB 3.46Å; N168-R171 WeakPolarHBondContact O-CG 3.34Å; N168-R171 PolarHBondContact O-N 2.83Å; L169-R171 PolarHBondContact O-N 2.84Å; R171-A173 PolarHBondContact O-N 3.32Å; R171-E174 VanDerWaalsContact CD-CD 3.41Å; R171-E174 WeakPolarHBondContact CD-OE1 3.46Å; R171-E174 WeakPolarHBondContact CD-OE2 3.48Å; R171-E174 IonicContact CZ-OE1 3.92Å; R171-E174 IonicContact NE-OE1 3.28Å; R171-E174 IonicContact NE-OE2 2.98Å; R171-E174 IonicContact NH1-OE2 3.99Å; R171-E174 PolarHBondContact O-N 2.99Å; R171-Y207 VanDerWaalsContact NE-CE1 3.33Å; R171-Y207 PolarHBondContact NE-OH 2.64Å; R171-Y207 VanDerWaalsContact NE-OH 3.13Å; R171-M208 VanDerWaalsContact CZ-SD 3.53Å; R171-M208 PolarHBondContact NH1-SD 3.4Å; R171-M208 PolarHBondContact NH2-SD 3.12Å; R171-M208 VanDerWaalsContact NH2-SD 3.4Å; R171-Y212 VanDerWaalsContact NH2-CD2 3.27Å
172	W	95.5	Very high	96	Very high	67 Å²	67	46.2 Å²	46.2	25%	0.254	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-64.5	-24.7	175	-85.2	-71.9	0	0	0	113.6	W111 A114 I115 I118 F165 L169 P170	W111-W172 AromaticContact CE3-CD1 3.74Å; W111-W172 AromaticContact CE3-NE1 3.71Å; W111-W172 AromaticContact CZ3-CD1 3.91Å; A114-W172 HydrophobicContact CB-CD2 3.42Å; A114-W172 VanDerWaalsContact CB-CD2 3.42Å; A114-W172 VanDerWaalsContact CB-CE2 3.45Å; A114-W172 HydrophobicContact CB-CE3 3.84Å; A114-W172 HydrophobicContact CB-CG 3.74Å; A114-W172 HydrophobicContact CB-CH2 4.32Å; A114-W172 HydrophobicContact CB-CZ2 3.93Å; A114-W172 HydrophobicContact CB-CZ3 4.27Å; I115-W172 HydrophobicContact CG1-CZ2 3.94Å; I118-W172 HydrophobicContact CD1-CH2 3.31Å; I118-W172 HydrophobicContact CD1-CZ2 4.22Å; I118-W172 HydrophobicContact CD1-CZ3 3.67Å; F165-W172 HydrophobicContact CD2-CH2 4.27Å; F165-W172 HydrophobicContact CD2-CZ3 4.45Å; F165-W172 AromaticContact CE2-CH2 3.69Å; F165-W172 HydrophobicContact CE2-CH2 3.69Å; F165-W172 AromaticContact CE2-CZ3 3.9Å; F165-W172 HydrophobicContact CE2-CZ3 3.9Å; F165-W172 HydrophobicContact CZ-CH2 4.39Å; F165-W172 HydrophobicContact CZ-CZ3 4.24Å; L169-W172 HydrophobicContact CD1-CE3 4.11Å; L169-W172 HydrophobicContact CD1-CZ3 4.06Å; P170-W172 PolarHBondContact O-N 3.5Å
173	A	95.6	Very high	95.6	Very high	47 Å²	47	48.6 Å²	48.6	39%	0.388	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-93.8	-3.3	179.1	0	0	0	0	0	113	P170 R171 S195 M197	P170-A173 WeakPolarHBondContact O-CB 3.45Å; P170-A173 PolarHBondContact O-N 2.93Å; R171-A173 PolarHBondContact O-N 3.32Å; A173-S195 WeakPolarHBondContact O-CB 3.49Å; A173-S195 PolarHBondContact O-OG 2.96Å; A173-M197 HydrophobicContact CB-SD 3.93Å
174	E	94.8	Very high	95.2	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-25.9	-177.6	-69.5	178.5	168.2	0	0	113.9	Y113 R171 S195 R198 Y203 M208	Y113-E174 HydrophobicContact CE1-CB 4.27Å; Y113-E174 WeakPolarHBondContact CE1-OE2 3.48Å; Y113-E174 PolarHBondContact OH-OE2 2.89Å; R171-E174 VanDerWaalsContact CD-CD 3.41Å; R171-E174 WeakPolarHBondContact CD-OE1 3.46Å; R171-E174 WeakPolarHBondContact CD-OE2 3.48Å; R171-E174 IonicContact CZ-OE1 3.92Å; R171-E174 IonicContact NE-OE1 3.28Å; R171-E174 IonicContact NE-OE2 2.98Å; R171-E174 IonicContact NH1-OE2 3.99Å; R171-E174 PolarHBondContact O-N 2.99Å; E174-S195 WeakPolarHBondContact CA-OG 3.31Å; E174-S195 PolarHBondContact O-N 3.44Å; E174-S195 PolarHBondContact O-OG 3.27Å; E174-R198 HydrophobicContact CB-CB 4.22Å; E174-R198 WeakPolarHBondContact O-CB 3.29Å; E174-Y203 HydrophobicContact CG-CE1 4Å; E174-Y203 WeakPolarHBondContact OE1-CE1 3.5Å; E174-Y203 PolarHBondContact OE1-OH 3.17Å; E174-M208 HydrophobicContact CG-CE 4.46Å; E174-M208 WeakPolarHBondContact OE1-CE 3.13Å; E174-M208 WeakPolarHBondContact OE2-CE 3.41Å
175	I	94.9	Very high	94.8	Very high	27 Å²	27	51.6 Å²	51.6	14%	0.138	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	131.6	-172.7	-60.5	-173	0	0	0	109.5	R110 Y113 V192	R110-I175 HydrophobicContact CG-CG2 4.48Å; R110-I175 PolarHBondContact NE-O 3.43Å; Y113-I175 HydrophobicContact CD1-CD1 3.47Å; Y113-I175 VanDerWaalsContact CD1-CD1 3.47Å; Y113-I175 HydrophobicContact CD1-CG1 3.96Å; Y113-I175 HydrophobicContact CD2-CD1 3.83Å; Y113-I175 HydrophobicContact CE1-CD1 3.66Å; Y113-I175 HydrophobicContact CE1-CG1 3.97Å; Y113-I175 HydrophobicContact CE2-CD1 4.01Å; Y113-I175 HydrophobicContact CG-CD1 3.56Å; I175-V192 HydrophobicContact CG2-CG1 3.17Å
176	E	95	Very high	94.6	Very high	86 Å²	86	52.9 Å²	52.9	40%	0.402	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	163.2	177.8	-65.9	176.9	-159.5	0	0	110.9	V192 V193 S195	E176-V192 WeakPolarHBondContact O-CA 3.45Å; E176-V193 HydrophobicContact CB-CG2 3.98Å; E176-V193 PolarHBondContact N-O 2.91Å; E176-V193 PolarHBondContact O-N 3.04Å; E176-S195 VanDerWaalsContact OE1-CB 3.24Å; E176-S195 WeakPolarHBondContact OE1-CB 2.95Å
177	T	94.6	Very high	94.4	Very high	31 Å²	31	50 Å²	50	19%	0.19	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	121.9	172.6	44.4	0	0	0	0	107.7	F107 R110 V190 H191	F107-T177 HydrophobicContact CD1-CG2 3.96Å; F107-T177 HydrophobicContact CE1-CG2 4.21Å; R110-T177 HydrophobicContact CB-CG2 4.1Å; R110-T177 VanDerWaalsContact NH1-N 3.19Å; R110-T177 PolarHBondContact NH1-OG1 3.44Å; T177-V190 HydrophobicContact CG2-CG1 3.98Å; T177-H191 WeakPolarHBondContact CA-O 3.45Å
178	A	94.2	Very high	94.2	Very high	27 Å²	27	52.5 Å²	52.5	22%	0.223	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	144.4	-179	0	0	0	0	0	110.9	H191 V193	A178-H191 PolarHBondContact N-O 3.5Å; A178-H191 PolarHBondContact O-N 3.02Å; A178-H191 PolarHBondContact O-ND1 3.32Å; A178-V193 HydrophobicContact CB-CG1 4.12Å; A178-V193 HydrophobicContact CB-CG2 3.85Å
179	P	95.1	Very high	94.1	Very high	79 Å²	79	52.6 Å²	52.6	51%	0.513	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	138.9	173.2	31.5	-34.5	0	0	0	110	M17 A189	M17-P179 HydrophobicContact CE-CB 3.81Å; M17-P179 HydrophobicContact CE-CG 4.15Å; M17-P179 HydrophobicContact SD-CB 4.4Å; P179-A189 CarbonylContact C-O 3.6Å; P179-A189 WeakPolarHBondContact CA-O 3.37Å
180	C	94.1	Very high	93.9	Very high	1 Å²	1	50 Å²	50	1%	0.007	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	156.4	173.8	60.9	0	0	0	0	110.6	D18 C20 T188 A189 H191	D18-C180 CarbonylContact O-C 3.41Å; D18-C180 WeakPolarHBondContact O-CA 3.44Å; D18-C180 VanDerWaalsContact O-CB 3.26Å; D18-C180 WeakPolarHBondContact O-CB 3.2Å; C20-C180 VanDerWaalsContact CA-SG 3.57Å; C20-C180 HydrophobicContact CB-CB 4.03Å; C20-C180 WeakPolarHBondContact CB-SG 3.42Å; C20-C180 WeakPolarHBondContact SG-CB 3.24Å; C20-C180 PolarHBondContact SG-O 3.45Å; C20-C180 VanDerWaalsContact SG-O 3.36Å; C20-C180 CovalentContact SG-SG 2.03Å; C20-C180 PolarHBondContact SG-SG 3.09Å; C180-T188 CarbonylContact O-C 3.59Å; C180-T188 WeakPolarHBondContact O-CA 3.45Å; C180-A189 PolarHBondContact N-O 3.47Å; C180-A189 PolarHBondContact O-N 3.3Å; C180-H191 WeakPolarHBondContact CB-ND1 3.47Å; C180-H191 PolarHBondContact SG-ND1 3.23Å; C180-H191 VanDerWaalsContact SG-ND1 3.45Å
181	W	95.2	Very high	93.7	Very high	95 Å²	95	50.5 Å²	50.5	36%	0.36	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	119.4	175.3	-175.7	-98.2	0	0	0	110.7	M17 D18 C20 N183 N186 T188	M17-W181 HydrophobicContact SD-CB 4.29Å; D18-W181 PolarHBondContact O-N 2.91Å; C20-W181 PolarHBondContact N-O 2.85Å; W181-N183 PolarHBondContact NE1-OD1 3.19Å; W181-N186 WeakPolarHBondContact CZ2-OD1 3.25Å; W181-T188 HydrophobicContact CE3-CG2 4.17Å; W181-T188 HydrophobicContact CZ3-CG2 4.38Å
182	S	92.4	Very high	93.6	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	117.2	175.4	-179.1	0	0	0	0	110.7	H22 V184 Y185 N186 T187	H22-S182 PolarHBondContact CD2-OG 3.23Å; H22-S182 VanDerWaalsContact NE2-CB 3.31Å; H22-S182 WeakPolarHBondContact NE2-CB 3.4Å; H22-S182 PolarHBondContact NE2-OG 2.9Å; S182-V184 VanDerWaalsContact C-N 3.28Å; S182-V184 PolarHBondContact OG-N 2.93Å; S182-Y185 VanDerWaalsContact OG-CD2 3.3Å; S182-Y185 WeakPolarHBondContact OG-CD2 3.39Å; S182-Y185 PolarHBondContact OG-N 3.17Å; S182-N186 WeakPolarHBondContact O-CA 3.36Å; S182-N186 PolarHBondContact O-N 3.24Å; S182-T187 WeakPolarHBondContact CB-O 3.29Å; S182-T187 PolarHBondContact N-O 3.1Å; S182-T187 PolarHBondContact O-N 3.34Å
183	N	90.3	Very high	93.5	Very high	98 Å²	98	50.8 Å²	50.8	52%	0.524	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-25.1	172.4	-66.4	-34.3	0	0	0	112.5	W181	W181-N183 PolarHBondContact NE1-OD1 3.19Å
184	V	89.2	Confident	93.4	Very high	99 Å²	99	52 Å²	52	60%	0.6	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-43.7	-179.3	-179.8	0	0	0	0	110.4	H22 S182	H22-V184 HydrophobicContact CB-CG2 4.03Å; S182-V184 VanDerWaalsContact C-N 3.28Å; S182-V184 PolarHBondContact OG-N 2.93Å
185	Y	91.2	Very high	93.4	Very high	65 Å²	65	52.1 Å²	52.1	26%	0.255	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-2	-179.2	-56.2	-68.8	0	0	0	113.8	G97 L99 M102 S182 T187	G97-Y185 WeakPolarHBondContact CA-OH 3.45Å; G97-Y185 WeakPolarHBondContact O-CE1 3.33Å; G97-Y185 PolarHBondContact O-OH 3.5Å; L99-Y185 HydrophobicContact CB-CD1 4.25Å; L99-Y185 HydrophobicContact CB-CD2 4.12Å; L99-Y185 HydrophobicContact CB-CE1 4.36Å; L99-Y185 HydrophobicContact CB-CE2 4.25Å; L99-Y185 HydrophobicContact CB-CG 4.13Å; L99-Y185 HydrophobicContact CD1-CD2 3.88Å; L99-Y185 HydrophobicContact CD1-CE2 4.25Å; L99-Y185 HydrophobicContact CD1-CG 4.48Å; L99-Y185 HydrophobicContact CD2-CD2 4.49Å; L99-Y185 HydrophobicContact CD2-CG 4.3Å; L99-Y185 HydrophobicContact CG-CD2 4.38Å; M102-Y185 HydrophobicContact CE-CE2 4.25Å; M102-Y185 HydrophobicContact SD-CE2 3.57Å; M102-Y185 VanDerWaalsContact SD-CE2 3.57Å; M102-Y185 PolarHBondContact SD-OH 3.38Å; S182-Y185 VanDerWaalsContact OG-CD2 3.3Å; S182-Y185 WeakPolarHBondContact OG-CD2 3.39Å; S182-Y185 PolarHBondContact OG-N 3.17Å; Y185-T187 PolarHBondContact O-N 2.96Å
186	N	92.6	Very high	93.4	Very high	121 Å²	121	59.5 Å²	59.5	65%	0.647	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	41	-177.2	-164.2	39	0	0	0	113.4	W181 S182	W181-N186 WeakPolarHBondContact CZ2-OD1 3.25Å; S182-N186 WeakPolarHBondContact O-CA 3.36Å; S182-N186 PolarHBondContact O-N 3.24Å
187	T	94.2	Very high	93.3	Very high	54 Å²	54	58.9 Å²	58.9	33%	0.331	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	174	-175.5	-168.3	0	0	0	0	111.1	L99 S182 Y185	L99-T187 HydrophobicContact CD2-CG2 3.31Å; S182-T187 WeakPolarHBondContact CB-O 3.29Å; S182-T187 PolarHBondContact N-O 3.1Å; S182-T187 PolarHBondContact O-N 3.34Å; Y185-T187 PolarHBondContact O-N 2.96Å
188	T	94.2	Very high	93.2	Very high	73 Å²	73	59.7 Å²	59.7	45%	0.448	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	127.8	174.3	55.1	0	0	0	0	110.7	M17 C180 W181	M17-T188 HydrophobicContact CE-CG2 3.94Å; M17-T188 HydrophobicContact SD-CG2 3.86Å; C180-T188 CarbonylContact O-C 3.59Å; C180-T188 WeakPolarHBondContact O-CA 3.45Å; W181-T188 HydrophobicContact CE3-CG2 4.17Å; W181-T188 HydrophobicContact CZ3-CG2 4.38Å
189	A	94	Very high	93.1	Very high	3 Å²	3	64.8 Å²	64.8	3%	0.025	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	177.2	170	0	0	0	0	0	109.9	L99 P179 C180	L99-A189 HydrophobicContact CD1-CB 3.51Å; P179-A189 CarbonylContact C-O 3.6Å; P179-A189 WeakPolarHBondContact CA-O 3.37Å; C180-A189 PolarHBondContact N-O 3.47Å; C180-A189 PolarHBondContact O-N 3.3Å
190	V	93.6	Very high	93.1	Very high	31 Å²	31	64.9 Å²	64.9	19%	0.188	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	139.3	177	-179.7	0	0	0	0	108.6	N103 C106 F107 T177	N103-V190 PolarHBondContact OD1-N 3.23Å; C106-V190 HydrophobicContact CB-CG1 4.39Å; C106-V190 PolarHBondContact SG-O 2.94Å; F107-V190 HydrophobicContact CE1-CG1 4.38Å; F107-V190 HydrophobicContact CE2-CB 4.45Å; F107-V190 HydrophobicContact CE2-CG1 4.37Å; F107-V190 HydrophobicContact CE2-CG2 4.05Å; F107-V190 HydrophobicContact CZ-CB 4.48Å; F107-V190 HydrophobicContact CZ-CG1 4.07Å; F107-V190 HydrophobicContact CZ-CG2 3.94Å; T177-V190 HydrophobicContact CG2-CG1 3.98Å
191	H	91.8	Very high	93	Very high	50 Å²	50	68.7 Å²	68.7	23%	0.231	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	160.8	172.5	70.7	-58.2	0	0	0	110.5	T177 A178 C180 V193	T177-H191 WeakPolarHBondContact CA-O 3.45Å; A178-H191 PolarHBondContact N-O 3.5Å; A178-H191 PolarHBondContact O-N 3.02Å; A178-H191 PolarHBondContact O-ND1 3.32Å; C180-H191 WeakPolarHBondContact CB-ND1 3.47Å; C180-H191 PolarHBondContact SG-ND1 3.23Å; C180-H191 VanDerWaalsContact SG-ND1 3.45Å; H191-V193 WeakPolarHBondContact CD2-CG1 3.23Å; H191-V193 WeakPolarHBondContact NE2-CG1 3.4Å
192	V	93.8	Very high	92.9	Very high	40 Å²	40	69.4 Å²	69.4	24%	0.242	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	127.1	179.5	-179.3	0	0	0	0	109	C106 Q109 I175 E176	C106-V192 HydrophobicContact CB-CG2 3.81Å; Q109-V192 HydrophobicContact CB-CG2 4.47Å; Q109-V192 HydrophobicContact CG-CG2 4.48Å; I175-V192 HydrophobicContact CG2-CG1 3.17Å; E176-V192 WeakPolarHBondContact O-CA 3.45Å
193	V	93.5	Very high	93	Very high	40 Å²	40	71 Å²	71	24%	0.242	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	153.3	179.8	-62.5	0	0	0	0	111.1	E176 A178 H191	E176-V193 HydrophobicContact CB-CG2 3.98Å; E176-V193 PolarHBondContact N-O 2.91Å; E176-V193 PolarHBondContact O-N 3.04Å; A178-V193 HydrophobicContact CB-CG1 4.12Å; A178-V193 HydrophobicContact CB-CG2 3.85Å; H191-V193 WeakPolarHBondContact CD2-CG1 3.23Å; H191-V193 WeakPolarHBondContact NE2-CG1 3.4Å
194	T	93.5	Very high	93	Very high	71 Å²	71	68.6 Å²	68.6	44%	0.436	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	137.5	170.5	56.7	0	0	0	0	110.3	R198 Q199	T194-R198 HydrophobicContact CG2-CG 3.93Å; T194-Q199 PolarHBondContact OG1-NE2 2.99Å
195	S	94.7	Very high	93.1	Very high	3 Å²	3	66.4 Å²	66.4	2%	0.021	35%	0.349	C	S	.	.			trans	-73.8	167.3	175.9	75.7	0	0	0	0	112.8	A173 E174 E176 M197 R198 Q199	A173-S195 WeakPolarHBondContact O-CB 3.49Å; A173-S195 PolarHBondContact O-OG 2.96Å; E174-S195 WeakPolarHBondContact CA-OG 3.31Å; E174-S195 PolarHBondContact O-N 3.44Å; E174-S195 PolarHBondContact O-OG 3.27Å; E176-S195 VanDerWaalsContact OE1-CB 3.24Å; E176-S195 WeakPolarHBondContact OE1-CB 2.95Å; S195-M197 PolarHBondContact O-N 2.7Å; S195-M197 PolarHBondContact OG-N 2.96Å; S195-R198 PolarHBondContact O-N 3.43Å; S195-R198 VanDerWaalsContact O-N 3.09Å; S195-R198 PolarHBondContact OG-N 3.11Å; S195-Q199 WeakPolarHBondContact O-CG 3.41Å; S195-Q199 PolarHBondContact O-N 3.42Å
196	K	94.5	Very high	93.2	Very high	182 Å²	182	65.9 Å²	65.9	79%	0.791	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-30.7	171.7	-65.4	-179.2	-178.7	177.6	0	112.7	N200	K196-N200 PolarHBondContact O-N 3.37Å
197	M	93.5	Very high	93.2	Very high	74 Å²	74	61.5 Å²	61.5	37%	0.365	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-44.4	176.3	-178.4	171.6	176.9	0	0	110.9	P170 A173 S195 Q199 N200 Y203	P170-M197 HydrophobicContact CB-CE 3.99Å; A173-M197 HydrophobicContact CB-SD 3.93Å; S195-M197 PolarHBondContact O-N 2.7Å; S195-M197 PolarHBondContact OG-N 2.96Å; M197-Q199 VanDerWaalsContact C-N 3.29Å; M197-Q199 PolarHBondContact O-N 3Å; M197-N200 WeakPolarHBondContact O-CB 3.34Å; M197-N200 PolarHBondContact O-N 2.85Å; M197-Y203 HydrophobicContact CE-CD2 3.65Å; M197-Y203 HydrophobicContact CE-CE1 4.45Å; M197-Y203 HydrophobicContact CE-CE2 3.17Å; M197-Y203 HydrophobicContact CE-CG 4.45Å; M197-Y203 HydrophobicContact CG-CD1 4.16Å; M197-Y203 HydrophobicContact CG-CD2 4.25Å; M197-Y203 HydrophobicContact CG-CE1 4.26Å; M197-Y203 HydrophobicContact CG-CE2 4.35Å; M197-Y203 HydrophobicContact CG-CG 4.14Å; M197-Y203 VanDerWaalsContact O-CD1 3.26Å; M197-Y203 WeakPolarHBondContact O-CD1 3.4Å
198	R	92.6	Very high	92.9	Very high	47 Å²	47	59.6 Å²	59.6	18%	0.177	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-32.9	176.8	-179.7	59.9	172.3	150.9	-3	112.6	E174 T194 S195 N200 M208	E174-R198 HydrophobicContact CB-CB 4.22Å; E174-R198 WeakPolarHBondContact O-CB 3.29Å; T194-R198 HydrophobicContact CG2-CG 3.93Å; S195-R198 PolarHBondContact O-N 3.43Å; S195-R198 VanDerWaalsContact O-N 3.09Å; S195-R198 PolarHBondContact OG-N 3.11Å; R198-N200 VanDerWaalsContact C-N 3.32Å; R198-M208 VanDerWaalsContact CZ-SD 3.58Å; R198-M208 PolarHBondContact NH1-SD 3.5Å
199	Q	92	Very high	92.6	Very high	134 Å²	134	59.6 Å²	59.6	63%	0.626	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-12.7	177.4	-68.9	175.4	-10.9	0	0	113.9	T194 S195 M197 S201	T194-Q199 PolarHBondContact OG1-NE2 2.99Å; S195-Q199 WeakPolarHBondContact O-CG 3.41Å; S195-Q199 PolarHBondContact O-N 3.42Å; M197-Q199 VanDerWaalsContact C-N 3.29Å; M197-Q199 PolarHBondContact O-N 3Å; Q199-S201 PolarHBondContact O-N 3.13Å
200	N	94.4	Very high	92.4	Very high	82 Å²	82	64 Å²	64	44%	0.439	34%	0.339	S	S	.	.			trans	-72	115.8	175.9	-176.5	-48.2	0	0	0	109.9	K196 M197 R198 T202 Y203 Y204	K196-N200 PolarHBondContact O-N 3.37Å; M197-N200 WeakPolarHBondContact O-CB 3.34Å; M197-N200 PolarHBondContact O-N 2.85Å; R198-N200 VanDerWaalsContact C-N 3.32Å; N200-T202 VanDerWaalsContact C-N 3.31Å; N200-T202 PolarHBondContact O-N 2.88Å; N200-T202 WeakPolarHBondContact OD1-CB 3.43Å; N200-T202 PolarHBondContact OD1-N 3.06Å; N200-Y203 PolarHBondContact O-N 3.08Å; N200-Y203 VanDerWaalsContact O-N 3.14Å; N200-Y203 PolarHBondContact OD1-N 2.84Å; N200-Y204 PolarHBondContact O-N 2.97Å
201	S	91.3	Very high	92.4	Very high	80 Å²	80	64.8 Å²	64.8	56%	0.559	35%	0.345	S	S	*	.	H	α-helix	trans	-55.5	-41.1	-178.2	176.9	0	0	0	0	113	Q199 Y203 Y204 V205	Q199-S201 PolarHBondContact O-N 3.13Å; S201-Y203 PolarHBondContact O-N 3.48Å; S201-Y204 PolarHBondContact O-N 2.89Å; S201-V205 WeakPolarHBondContact O-CG2 3.07Å; S201-V205 PolarHBondContact O-N 3.34Å
202	T	94	Very high	92.4	Very high	110 Å²	110	63.4 Å²	63.4	68%	0.675	34%	0.338	S	S	*	.	H	α-helix	trans	-63.2	-44.2	178.3	-51.9	0	0	0	0	111.8	N200 A206	N200-T202 VanDerWaalsContact C-N 3.31Å; N200-T202 PolarHBondContact O-N 2.88Å; N200-T202 WeakPolarHBondContact OD1-CB 3.43Å; N200-T202 PolarHBondContact OD1-N 3.06Å; T202-A206 WeakPolarHBondContact O-CB 3.34Å; T202-A206 PolarHBondContact O-N 3.26Å
203	Y	94.2	Very high	92.2	Very high	35 Å²	35	62.6 Å²	62.6	14%	0.137	33%	0.333	C	S	.	.	H	α-helix	trans	-63.6	-46.7	176.4	174.3	-98.3	0	0	0	111.1	P170 E174 M197 N200 S201 Y207	P170-Y203 HydrophobicContact CB-CE2 4.32Å; P170-Y203 VanDerWaalsContact CB-OH 3.25Å; P170-Y203 WeakPolarHBondContact CB-OH 3.42Å; E174-Y203 HydrophobicContact CG-CE1 4Å; E174-Y203 WeakPolarHBondContact OE1-CE1 3.5Å; E174-Y203 PolarHBondContact OE1-OH 3.17Å; M197-Y203 HydrophobicContact CE-CD2 3.65Å; M197-Y203 HydrophobicContact CE-CE1 4.45Å; M197-Y203 HydrophobicContact CE-CE2 3.17Å; M197-Y203 HydrophobicContact CE-CG 4.45Å; M197-Y203 HydrophobicContact CG-CD1 4.16Å; M197-Y203 HydrophobicContact CG-CD2 4.25Å; M197-Y203 HydrophobicContact CG-CE1 4.26Å; M197-Y203 HydrophobicContact CG-CE2 4.35Å; M197-Y203 HydrophobicContact CG-CG 4.14Å; M197-Y203 VanDerWaalsContact O-CD1 3.26Å; M197-Y203 WeakPolarHBondContact O-CD1 3.4Å; N200-Y203 PolarHBondContact O-N 3.08Å; N200-Y203 VanDerWaalsContact O-N 3.14Å; N200-Y203 PolarHBondContact OD1-N 2.84Å; S201-Y203 PolarHBondContact O-N 3.48Å; Y203-Y207 HydrophobicContact CE1-CD1 4.11Å; Y203-Y207 AromaticContact CE2-CD1 3.81Å; Y203-Y207 HydrophobicContact CE2-CD1 3.81Å; Y203-Y207 AromaticContact CE2-CG 3.99Å; Y203-Y207 HydrophobicContact CE2-CG 3.99Å; Y203-Y207 AromaticContact CZ-CD1 3.44Å; Y203-Y207 VanDerWaalsContact CZ-CD1 3.44Å; Y203-Y207 WeakPolarHBondContact O-CB 3.28Å; Y203-Y207 PolarHBondContact O-N 3.08Å; Y203-Y207 WeakPolarHBondContact OH-CD1 3.22Å; Y203-Y207 VanDerWaalsContact OH-CE1 3.25Å; Y203-Y207 WeakPolarHBondContact OH-CE1 3.18Å
204	Y	90.6	Very high	92.1	Very high	46 Å²	46	63.7 Å²	63.7	18%	0.18	34%	0.34	C	S	.	.	I	π-helix	trans	-56.6	-53.8	178.6	-178.2	-82	0	0	0	111.2	N200 S201 M208 M209 E268	N200-Y204 PolarHBondContact O-N 2.97Å; S201-Y204 PolarHBondContact O-N 2.89Å; Y204-M208 WeakPolarHBondContact O-CA 3.35Å; Y204-M208 WeakPolarHBondContact O-CB 3.39Å; Y204-M208 PolarHBondContact O-N 3.19Å; Y204-M209 PolarHBondContact O-N 3.47Å; Y204-E268 WeakPolarHBondContact OH-CG 3.35Å; Y204-E268 PolarHBondContact OH-OE1 3.36Å
205	V	90.3	Very high	92.1	Very high	53 Å²	53	61.8 Å²	61.8	32%	0.321	33%	0.328	S	S	.	.	I	π-helix	trans	-66.2	-50.7	-178.3	175.6	0	0	0	0	111.4	S201 M209 I210	S201-V205 WeakPolarHBondContact O-CG2 3.07Å; S201-V205 PolarHBondContact O-N 3.34Å; V205-M209 WeakPolarHBondContact O-CB 3.38Å; V205-M209 PolarHBondContact O-N 2.93Å; V205-I210 HydrophobicContact CG1-CD1 4.02Å; V205-I210 WeakPolarHBondContact O-CG1 3.47Å; V205-I210 PolarHBondContact O-N 3.46Å
206	A	93	Very high	91.9	Very high	54 Å²	54	61.6 Å²	61.6	45%	0.446	33%	0.327	S	S	.	.	I	π-helix	trans	-67.3	-46.3	-173.1	0	0	0	0	0	112.7	T202 C211	T202-A206 WeakPolarHBondContact O-CB 3.34Å; T202-A206 PolarHBondContact O-N 3.26Å; A206-C211 VanDerWaalsContact O-CB 3.3Å; A206-C211 WeakPolarHBondContact O-CB 3.15Å; A206-C211 PolarHBondContact O-N 3.36Å; A206-C211 VanDerWaalsContact O-N 3.08Å
207	Y	93.4	Very high	91.6	Very high	29 Å²	29	53 Å²	53	11%	0.114	29%	0.289	C	S	.	.	I	π-helix	trans	-93.5	-48.7	-173	175.6	-103.2	0	0	0	112.7	F167 P170 R171 Y203 C211 Y212	F167-Y207 HydrophobicContact CE2-CE2 4.34Å; F167-Y207 HydrophobicContact CZ-CE2 4.42Å; F167-Y207 WeakPolarHBondContact O-CE2 3.16Å; F167-Y207 PolarHBondContact O-OH 3.39Å; P170-Y207 HydrophobicContact CB-CE1 4.46Å; P170-Y207 HydrophobicContact CG-CE2 4.46Å; R171-Y207 VanDerWaalsContact NE-CE1 3.33Å; R171-Y207 PolarHBondContact NE-OH 2.64Å; R171-Y207 VanDerWaalsContact NE-OH 3.13Å; Y203-Y207 HydrophobicContact CE1-CD1 4.11Å; Y203-Y207 AromaticContact CE2-CD1 3.81Å; Y203-Y207 HydrophobicContact CE2-CD1 3.81Å; Y203-Y207 AromaticContact CE2-CG 3.99Å; Y203-Y207 HydrophobicContact CE2-CG 3.99Å; Y203-Y207 AromaticContact CZ-CD1 3.44Å; Y203-Y207 VanDerWaalsContact CZ-CD1 3.44Å; Y203-Y207 WeakPolarHBondContact O-CB 3.28Å; Y203-Y207 PolarHBondContact O-N 3.08Å; Y203-Y207 WeakPolarHBondContact OH-CD1 3.22Å; Y203-Y207 VanDerWaalsContact OH-CE1 3.25Å; Y203-Y207 WeakPolarHBondContact OH-CE1 3.18Å; Y207-C211 HydrophobicContact CD2-CB 4.43Å; Y207-C211 WeakPolarHBondContact O-CB 3.29Å; Y207-Y212 WeakPolarHBondContact O-CB 3.47Å; Y207-Y212 PolarHBondContact O-N 3.1Å
208	M	88.5	Confident	91.3	Very high	15 Å²	15	50.5 Å²	50.5	7%	0.074	28%	0.283	C	S	.	.	I	π-helix	trans	-80.8	-43.2	-174.5	-81.7	-101.5	-152.9	0	0	113	Y113 R171 E174 R198 Y204 Y212	Y113-M208 WeakPolarHBondContact OH-CE 3.34Å; R171-M208 VanDerWaalsContact CZ-SD 3.53Å; R171-M208 PolarHBondContact NH1-SD 3.4Å; R171-M208 PolarHBondContact NH2-SD 3.12Å; R171-M208 VanDerWaalsContact NH2-SD 3.4Å; E174-M208 HydrophobicContact CG-CE 4.46Å; E174-M208 WeakPolarHBondContact OE1-CE 3.13Å; E174-M208 WeakPolarHBondContact OE2-CE 3.41Å; R198-M208 VanDerWaalsContact CZ-SD 3.58Å; R198-M208 PolarHBondContact NH1-SD 3.5Å; Y204-M208 WeakPolarHBondContact O-CA 3.35Å; Y204-M208 WeakPolarHBondContact O-CB 3.39Å; Y204-M208 PolarHBondContact O-N 3.19Å; M208-Y212 WeakPolarHBondContact O-CB 3.48Å
209	M	86.8	Confident	91.1	Very high	72 Å²	72	52.2 Å²	52.2	36%	0.355	29%	0.294	S	S	.	.	I	π-helix	trans	-83.8	-49	-178.3	-172.9	179.6	155.2	0	0	111.9	Y204 V205 T213 A269	Y204-M209 PolarHBondContact O-N 3.47Å; V205-M209 WeakPolarHBondContact O-CB 3.38Å; V205-M209 PolarHBondContact O-N 2.93Å; M209-T213 WeakPolarHBondContact O-CB 3.43Å; M209-T213 PolarHBondContact O-OG1 3.38Å; M209-A269 HydrophobicContact CE-CB 3.26Å; M209-A269 HydrophobicContact CG-CB 4.24Å; M209-A269 HydrophobicContact SD-CB 3.7Å
210	I	90.9	Very high	90.9	Very high	96 Å²	96	46 Å²	46	49%	0.492	27%	0.266	S	S	.	.	I	π-helix	trans	-86.2	-58.3	-174.7	-62.6	169.4	0	0	0	111.5	V205 T214	V205-I210 HydrophobicContact CG1-CD1 4.02Å; V205-I210 WeakPolarHBondContact O-CG1 3.47Å; V205-I210 PolarHBondContact O-N 3.46Å; I210-T214 VanDerWaalsContact O-CB 3.28Å; I210-T214 WeakPolarHBondContact O-CB 3.44Å; I210-T214 PolarHBondContact O-N 2.97Å; I210-T214 PolarHBondContact O-OG1 3.08Å
211	C	93	Very high	90.4	Very high	47 Å²	47	44.4 Å²	44.4	32%	0.318	26%	0.255	S	S	.	.	I	π-helix	trans	-67.7	-51.8	-170.2	-165.3	0	0	0	0	112.2	F167 A206 Y207 T213 T214 V215	F167-C211 VanDerWaalsContact CE2-SG 3.56Å; A206-C211 VanDerWaalsContact O-CB 3.3Å; A206-C211 WeakPolarHBondContact O-CB 3.15Å; A206-C211 PolarHBondContact O-N 3.36Å; A206-C211 VanDerWaalsContact O-N 3.08Å; Y207-C211 HydrophobicContact CD2-CB 4.43Å; Y207-C211 WeakPolarHBondContact O-CB 3.29Å; C211-T213 PolarHBondContact O-N 3.48Å; C211-T214 PolarHBondContact O-N 2.83Å; C211-V215 WeakPolarHBondContact O-CG2 3.33Å; C211-V215 PolarHBondContact O-N 2.92Å
212	Y	91.7	Very high	90.2	Very high	22 Å²	22	46 Å²	46	9%	0.086	26%	0.257	C	S	.	.	H	α-helix	trans	-60.2	-46.3	177.6	178.9	-92.4	0	0	0	111.8	L117 Q120 F167 R171 Y207 M208 T214 V215 M216 F217	L117-Y212 HydrophobicContact CD2-CE2 4.44Å; Q120-Y212 PolarHBondContact OE1-OH 3.35Å; Q120-Y212 VanDerWaalsContact OE1-OH 3.09Å; F167-Y212 HydrophobicContact CE1-CD2 4.09Å; R171-Y212 VanDerWaalsContact NH2-CD2 3.27Å; Y207-Y212 WeakPolarHBondContact O-CB 3.47Å; Y207-Y212 PolarHBondContact O-N 3.1Å; M208-Y212 WeakPolarHBondContact O-CB 3.48Å; Y212-T214 VanDerWaalsContact C-N 3.31Å; Y212-T214 PolarHBondContact O-N 2.94Å; Y212-V215 PolarHBondContact O-N 3.3Å; Y212-M216 HydrophobicContact CD1-CG 4.36Å; Y212-M216 HydrophobicContact CD2-CG 3.76Å; Y212-M216 HydrophobicContact CE1-CB 4.37Å; Y212-M216 HydrophobicContact CE1-CG 4.13Å; Y212-M216 HydrophobicContact CE2-CE 4.41Å; Y212-M216 HydrophobicContact CE2-CG 3.52Å; Y212-M216 HydrophobicContact CE2-SD 4.37Å; Y212-M216 HydrophobicContact CG-CG 4.18Å; Y212-M216 VanDerWaalsContact O-CB 3.28Å; Y212-M216 WeakPolarHBondContact O-CB 3.17Å; Y212-M216 WeakPolarHBondContact O-CG 3.36Å; Y212-M216 PolarHBondContact O-N 2.9Å; Y212-F217 HydrophobicContact CD1-CE2 4.48Å; Y212-F217 HydrophobicContact CE1-CE2 4.01Å
213	T	90.3	Very high	89.9	Confident	22 Å²	22	44.1 Å²	44.1	14%	0.135	24%	0.242	C	C	.	.	H	α-helix	trans	-60.4	-41.7	177.2	-59.2	0	0	0	0	112.1	M209 C211 F217 G218 F262	M209-T213 WeakPolarHBondContact O-CB 3.43Å; M209-T213 PolarHBondContact O-OG1 3.38Å; C211-T213 PolarHBondContact O-N 3.48Å; T213-F217 HydrophobicContact CG2-CD2 4.22Å; T213-F217 CarbonylContact O-C 3.56Å; T213-F217 WeakPolarHBondContact O-CA 3.47Å; T213-F217 WeakPolarHBondContact O-CB 3.27Å; T213-F217 PolarHBondContact O-N 2.85Å; T213-G218 PolarHBondContact O-N 3.43Å; T213-F262 HydrophobicContact CG2-CD2 3.96Å; T213-F262 HydrophobicContact CG2-CE2 3.69Å
214	T	91.6	Very high	89.4	Confident	64 Å²	64	42.6 Å²	42.6	39%	0.393	24%	0.236	S	C	.	.	I	π-helix	trans	-65.4	-45.3	178.5	-58.8	0	0	0	0	111.7	I210 C211 Y212 G218 I219	I210-T214 VanDerWaalsContact O-CB 3.28Å; I210-T214 WeakPolarHBondContact O-CB 3.44Å; I210-T214 PolarHBondContact O-N 2.97Å; I210-T214 PolarHBondContact O-OG1 3.08Å; C211-T214 PolarHBondContact O-N 2.83Å; Y212-T214 VanDerWaalsContact C-N 3.31Å; Y212-T214 PolarHBondContact O-N 2.94Å; T214-G218 CarbonylContact O-C 3.52Å; T214-G218 WeakPolarHBondContact O-CA 3.23Å; T214-G218 PolarHBondContact O-N 3.22Å; T214-I219 HydrophobicContact CG2-CD1 4.06Å; T214-I219 HydrophobicContact CG2-CG1 4.05Å; T214-I219 PolarHBondContact O-N 2.88Å
215	V	92.1	Very high	88.9	Confident	30 Å²	30	42.6 Å²	42.6	18%	0.182	24%	0.243	C	C	.	.	I	π-helix	trans	-73.9	-40.3	-176.6	170.8	0	0	0	0	112.2	F163 F167 C211 Y212 P220	F163-V215 HydrophobicContact CE1-CG1 3.94Å; F163-V215 HydrophobicContact CZ-CG1 4.04Å; F167-V215 HydrophobicContact CE1-CB 4.31Å; F167-V215 HydrophobicContact CE1-CG1 4.14Å; F167-V215 HydrophobicContact CE2-CB 4.2Å; F167-V215 HydrophobicContact CE2-CG1 4.37Å; F167-V215 HydrophobicContact CE2-CG2 3.78Å; F167-V215 HydrophobicContact CZ-CB 3.82Å; F167-V215 HydrophobicContact CZ-CG1 4.06Å; F167-V215 HydrophobicContact CZ-CG2 3.89Å; C211-V215 WeakPolarHBondContact O-CG2 3.33Å; C211-V215 PolarHBondContact O-N 2.92Å; Y212-V215 PolarHBondContact O-N 3.3Å; V215-P220 WeakPolarHBondContact O-CD 3.32Å; V215-P220 VanDerWaalsContact O-CG 3.27Å; V215-P220 WeakPolarHBondContact O-CG 3.28Å
216	M	91.4	Very high	88.6	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.252	C	S	.	.	I	π-helix	trans	-86.4	-30.3	-174.8	-65.9	-64.4	-73.5	0	0	113.1	Q120 T121 V124 Y212 P220	Q120-M216 HydrophobicContact CB-CE 4.18Å; Q120-M216 HydrophobicContact CG-CE 3.69Å; T121-M216 HydrophobicContact CG2-SD 4.06Å; T121-M216 PolarHBondContact OG1-SD 3.46Å; T121-M216 VanDerWaalsContact OG1-SD 3.38Å; V124-M216 HydrophobicContact CB-CE 4.48Å; V124-M216 HydrophobicContact CB-SD 4.43Å; V124-M216 HydrophobicContact CG2-CE 3.51Å; V124-M216 HydrophobicContact CG2-SD 4.02Å; Y212-M216 HydrophobicContact CD1-CG 4.36Å; Y212-M216 HydrophobicContact CD2-CG 3.76Å; Y212-M216 HydrophobicContact CE1-CB 4.37Å; Y212-M216 HydrophobicContact CE1-CG 4.13Å; Y212-M216 HydrophobicContact CE2-CE 4.41Å; Y212-M216 HydrophobicContact CE2-CG 3.52Å; Y212-M216 HydrophobicContact CE2-SD 4.37Å; Y212-M216 HydrophobicContact CG-CG 4.18Å; Y212-M216 VanDerWaalsContact O-CB 3.28Å; Y212-M216 WeakPolarHBondContact O-CB 3.17Å; Y212-M216 WeakPolarHBondContact O-CG 3.36Å; Y212-M216 PolarHBondContact O-N 2.9Å; M216-P220 WeakPolarHBondContact O-CG 3.5Å
217	F	87.2	Confident	87.9	Confident	1 Å²	1	43 Å²	43	0%	0.004	24%	0.235	C	C	.	.	I	π-helix	trans	-123.8	-55.8	-176.4	-48.8	-71.5	0	0	0	112.4	Y212 T213 I219 P220 F221 N258 A261 F262 N265	Y212-F217 HydrophobicContact CD1-CE2 4.48Å; Y212-F217 HydrophobicContact CE1-CE2 4.01Å; T213-F217 HydrophobicContact CG2-CD2 4.22Å; T213-F217 CarbonylContact O-C 3.56Å; T213-F217 WeakPolarHBondContact O-CA 3.47Å; T213-F217 WeakPolarHBondContact O-CB 3.27Å; T213-F217 PolarHBondContact O-N 2.85Å; F217-I219 PolarHBondContact O-N 3.27Å; F217-P220 WeakPolarHBondContact O-CD 3.35Å; F217-F221 HydrophobicContact CB-CD2 4.13Å; F217-F221 HydrophobicContact CB-CE2 4.26Å; F217-F221 AromaticContact CD1-CE2 3.98Å; F217-F221 HydrophobicContact CD1-CE2 3.98Å; F217-F221 VanDerWaalsContact O-CB 3.22Å; F217-F221 WeakPolarHBondContact O-CB 3.25Å; F217-F221 WeakPolarHBondContact O-CD2 3.48Å; F217-F221 PolarHBondContact O-N 3.14Å; F217-N258 HydrophobicContact CD1-CB 4.46Å; F217-N258 HydrophobicContact CE1-CB 4.18Å; F217-N258 WeakPolarHBondContact CE1-O 3.46Å; F217-A261 HydrophobicContact CE1-CB 3.76Å; F217-A261 HydrophobicContact CZ-CB 3.67Å; F217-F262 HydrophobicContact CB-CB 4.05Å; F217-F262 HydrophobicContact CB-CD2 3.29Å; F217-F262 HydrophobicContact CB-CE2 3.96Å; F217-F262 HydrophobicContact CB-CG 3.91Å; F217-F262 HydrophobicContact CD1-CB 3.7Å; F217-F262 HydrophobicContact CD1-CD2 4.46Å; F217-F262 HydrophobicContact CD1-CG 4.49Å; F217-F262 HydrophobicContact CD2-CB 4.26Å; F217-F262 AromaticContact CD2-CD2 3.88Å; F217-F262 HydrophobicContact CD2-CD2 3.88Å; F217-F262 HydrophobicContact CE1-CB 4.22Å; F217-F262 HydrophobicContact CG-CB 3.73Å; F217-F262 AromaticContact CG-CD2 3.64Å; F217-F262 HydrophobicContact CG-CD2 3.64Å; F217-F262 HydrophobicContact CG-CG 4.09Å; F217-N265 VanDerWaalsContact CE2-ND2 3.29Å; F217-N265 WeakPolarHBondContact CE2-ND2 3.2Å
218	G	87	Confident	86.8	Confident	22 Å²	22	45 Å²	45	23%	0.227	25%	0.246	C	C	.	.	I	π-helix	trans	-52.8	-59	-173.8	0	0	0	0	0	113.5	T213 T214 L222	T213-G218 PolarHBondContact O-N 3.43Å; T214-G218 CarbonylContact O-C 3.52Å; T214-G218 WeakPolarHBondContact O-CA 3.23Å; T214-G218 PolarHBondContact O-N 3.22Å; G218-L222 VanDerWaalsContact O-CB 3.31Å; G218-L222 WeakPolarHBondContact O-CB 3.47Å; G218-L222 WeakPolarHBondContact O-CD1 3.28Å; G218-L222 WeakPolarHBondContact O-CG 3.29Å; G218-L222 PolarHBondContact O-N 2.94Å; G218-L222 VanDerWaalsContact O-N 3.11Å
219	I	88.6	Confident	86.1	Confident	82 Å²	82	49.5 Å²	49.5	42%	0.421	27%	0.27	S	S	.	.	H	α-helix	trans	-66.3	-51	-179.2	-66.9	169.3	0	0	0	111.4	T214 F217 F221 L222 L223	T214-I219 HydrophobicContact CG2-CD1 4.06Å; T214-I219 HydrophobicContact CG2-CG1 4.05Å; T214-I219 PolarHBondContact O-N 2.88Å; F217-I219 PolarHBondContact O-N 3.27Å; I219-F221 PolarHBondContact O-N 3.42Å; I219-L222 PolarHBondContact O-N 3.41Å; I219-L223 HydrophobicContact CG2-CD1 3.49Å; I219-L223 VanDerWaalsContact CG2-CD1 3.49Å; I219-L223 HydrophobicContact CG2-CG 4.07Å; I219-L223 WeakPolarHBondContact O-CB 3.29Å; I219-L223 VanDerWaalsContact O-CG 3.29Å; I219-L223 WeakPolarHBondContact O-CG 3.48Å; I219-L223 PolarHBondContact O-N 2.84Å
220	P	87.8	Confident	85.3	Confident	4 Å²	4	50.4 Å²	50.4	3%	0.026	28%	0.276	C	S	.	.	H	α-helix	trans	-59.9	-46	179.4	-27.3	37.2	0	0	0	113.3	V124 V128 V215 M216 F217 L222 L224 F254	V124-P220 HydrophobicContact CG1-CB 4.02Å; V124-P220 HydrophobicContact CG1-CG 3.44Å; V124-P220 VanDerWaalsContact CG1-CG 3.44Å; V128-P220 HydrophobicContact CG2-CB 3.78Å; V128-P220 HydrophobicContact CG2-CG 4.04Å; V215-P220 WeakPolarHBondContact O-CD 3.32Å; V215-P220 VanDerWaalsContact O-CG 3.27Å; V215-P220 WeakPolarHBondContact O-CG 3.28Å; M216-P220 WeakPolarHBondContact O-CG 3.5Å; F217-P220 WeakPolarHBondContact O-CD 3.35Å; P220-L222 PolarHBondContact O-N 3.37Å; P220-L224 HydrophobicContact CB-CD1 4.38Å; P220-L224 WeakPolarHBondContact O-CB 3.4Å; P220-L224 WeakPolarHBondContact O-CD1 3.28Å; P220-L224 WeakPolarHBondContact O-CG 3.39Å; P220-L224 PolarHBondContact O-N 3.22Å; P220-F254 HydrophobicContact CB-CE1 4.25Å
221	F	85.5	Confident	83.9	Confident	49 Å²	49	47.3 Å²	47.3	22%	0.215	26%	0.259	C	S	.	.	H	α-helix	trans	-63.4	-45.3	179.9	-83.1	-108.9	0	0	0	111.4	F217 I219 S225 L255 N258	F217-F221 HydrophobicContact CB-CD2 4.13Å; F217-F221 HydrophobicContact CB-CE2 4.26Å; F217-F221 AromaticContact CD1-CE2 3.98Å; F217-F221 HydrophobicContact CD1-CE2 3.98Å; F217-F221 VanDerWaalsContact O-CB 3.22Å; F217-F221 WeakPolarHBondContact O-CB 3.25Å; F217-F221 WeakPolarHBondContact O-CD2 3.48Å; F217-F221 PolarHBondContact O-N 3.14Å; I219-F221 PolarHBondContact O-N 3.42Å; F221-S225 WeakPolarHBondContact O-CB 3.41Å; F221-S225 PolarHBondContact O-N 2.8Å; F221-S225 PolarHBondContact O-OG 2.86Å; F221-L255 HydrophobicContact CB-CD2 4.37Å; F221-L255 HydrophobicContact CD1-CD2 3.57Å; F221-L255 HydrophobicContact CD2-CD2 3.96Å; F221-L255 HydrophobicContact CE1-CB 4.34Å; F221-L255 HydrophobicContact CE1-CD2 3.7Å; F221-L255 HydrophobicContact CE2-CD2 4.1Å; F221-L255 HydrophobicContact CG-CD2 3.71Å; F221-L255 HydrophobicContact CZ-CD2 3.98Å; F221-N258 HydrophobicContact CE2-CB 4.34Å; F221-N258 HydrophobicContact CZ-CB 4.43Å
222	L	86.8	Confident	82.1	Confident	113 Å²	113	49 Å²	49	59%	0.592	27%	0.268	S	S	*	.	H	α-helix	trans	-64.8	-48.8	178.3	-69.1	173.9	0	0	0	111.7	G218 I219 P220 S225 L226	G218-L222 VanDerWaalsContact O-CB 3.31Å; G218-L222 WeakPolarHBondContact O-CB 3.47Å; G218-L222 WeakPolarHBondContact O-CD1 3.28Å; G218-L222 WeakPolarHBondContact O-CG 3.29Å; G218-L222 PolarHBondContact O-N 2.94Å; G218-L222 VanDerWaalsContact O-N 3.11Å; I219-L222 PolarHBondContact O-N 3.41Å; P220-L222 PolarHBondContact O-N 3.37Å; L222-S225 PolarHBondContact O-OG 3.25Å; L222-L226 WeakPolarHBondContact O-CB 3.21Å; L222-L226 WeakPolarHBondContact O-CG 3.39Å; L222-L226 PolarHBondContact O-N 3.42Å
223	L	87	Confident	80.4	Confident	71 Å²	71	56.6 Å²	56.6	37%	0.372	30%	0.304	S	S	.	.	H	α-helix	trans	-64.3	-45.3	-179.7	-70.1	179.2	0	0	0	112	V128 I219 I227	V128-L223 HydrophobicContact CG1-CD1 4Å; I219-L223 HydrophobicContact CG2-CD1 3.49Å; I219-L223 VanDerWaalsContact CG2-CD1 3.49Å; I219-L223 HydrophobicContact CG2-CG 4.07Å; I219-L223 WeakPolarHBondContact O-CB 3.29Å; I219-L223 VanDerWaalsContact O-CG 3.29Å; I219-L223 WeakPolarHBondContact O-CG 3.48Å; I219-L223 PolarHBondContact O-N 2.84Å; L223-I227 WeakPolarHBondContact O-CB 3.5Å; L223-I227 WeakPolarHBondContact O-CD1 3.45Å; L223-I227 WeakPolarHBondContact O-CG1 3.29Å; L223-I227 PolarHBondContact O-N 3.24Å
224	L	84.2	Confident	78.8	Confident	2 Å²	2	61 Å²	61	1%	0.01	33%	0.327	C	S	.	.	H	α-helix	trans	-68.5	-38.8	-178.1	-65.5	172.3	0	0	0	111.8	T127 S131 P220 Q228 V251 F254 L255	T127-L224 HydrophobicContact CG2-CD1 4.3Å; S131-L224 WeakPolarHBondContact OG-CD2 3.43Å; P220-L224 HydrophobicContact CB-CD1 4.38Å; P220-L224 WeakPolarHBondContact O-CB 3.4Å; P220-L224 WeakPolarHBondContact O-CD1 3.28Å; P220-L224 WeakPolarHBondContact O-CG 3.39Å; P220-L224 PolarHBondContact O-N 3.22Å; L224-Q228 WeakPolarHBondContact O-CB 3.33Å; L224-Q228 PolarHBondContact O-N 2.93Å; L224-Q228 VanDerWaalsContact O-N 3.08Å; L224-V251 HydrophobicContact CB-CG1 3.86Å; L224-V251 HydrophobicContact CD1-CG1 4.08Å; L224-V251 HydrophobicContact CD2-CG1 3.92Å; L224-V251 HydrophobicContact CD2-CG2 3.92Å; L224-V251 HydrophobicContact CG-CG1 4.15Å; L224-F254 HydrophobicContact CD1-CD1 3.92Å; L224-F254 HydrophobicContact CD1-CE1 4.15Å; L224-L255 HydrophobicContact CB-CD1 4.38Å; L224-L255 HydrophobicContact CB-CD2 4.42Å; L224-L255 HydrophobicContact CD1-CD2 4.12Å; L224-L255 HydrophobicContact CD1-CG 4.48Å
225	S	80.2	Confident	77	Confident	47 Å²	47	67.7 Å²	67.7	33%	0.329	35%	0.345	S	S	.	.	H	α-helix	trans	-66.4	-46.9	175.4	59.3	0	0	0	0	112	F221 L222 I227 Q228 L229	F221-S225 WeakPolarHBondContact O-CB 3.41Å; F221-S225 PolarHBondContact O-N 2.8Å; F221-S225 PolarHBondContact O-OG 2.86Å; L222-S225 PolarHBondContact O-OG 3.25Å; S225-I227 PolarHBondContact O-N 3.33Å; S225-Q228 PolarHBondContact O-N 3.37Å; S225-Q228 VanDerWaalsContact O-N 3.08Å; S225-L229 WeakPolarHBondContact O-CG 3.23Å; S225-L229 PolarHBondContact O-N 2.73Å
226	L	83.4	Confident	75.1	Confident	97 Å²	97	77.5 Å²	77.5	51%	0.508	38%	0.379	S	S	.	.	H	α-helix	trans	-60.5	-44.2	176.9	-69.9	173.1	0	0	0	112.1	L222 Q228 L229 N230	L222-L226 WeakPolarHBondContact O-CB 3.21Å; L222-L226 WeakPolarHBondContact O-CG 3.39Å; L222-L226 PolarHBondContact O-N 3.42Å; L226-Q228 PolarHBondContact O-N 2.92Å; L226-L229 PolarHBondContact O-N 3.23Å; L226-N230 PolarHBondContact O-N 2.97Å
227	I	78.1	Confident	73.2	Confident	17 Å²	17	84.8 Å²	84.8	9%	0.087	41%	0.413	C	S	.	.	H	α-helix	trans	-59.7	-36.5	175.6	-73	166.8	0	0	0	111.1	Y135 L223 S225	Y135-I227 HydrophobicContact CD2-CB 4.36Å; Y135-I227 HydrophobicContact CD2-CG1 4.11Å; Y135-I227 HydrophobicContact CD2-CG2 4.03Å; Y135-I227 HydrophobicContact CG-CG1 4.06Å; Y135-I227 HydrophobicContact CG-CG2 4.32Å; L223-I227 WeakPolarHBondContact O-CB 3.5Å; L223-I227 WeakPolarHBondContact O-CD1 3.45Å; L223-I227 WeakPolarHBondContact O-CG1 3.29Å; L223-I227 PolarHBondContact O-N 3.24Å; S225-I227 PolarHBondContact O-N 3.33Å
228	Q	71.5	Confident	71.5	Confident	71 Å²	71	86.7 Å²	86.7	33%	0.332	42%	0.424	S	S	.	.	H	α-helix	trans	-78.9	-34.5	-178.7	-172.1	55.8	33.6	0	0	112.7	L224 S225 L226 K231	L224-Q228 WeakPolarHBondContact O-CB 3.33Å; L224-Q228 PolarHBondContact O-N 2.93Å; L224-Q228 VanDerWaalsContact O-N 3.08Å; S225-Q228 PolarHBondContact O-N 3.37Å; S225-Q228 VanDerWaalsContact O-N 3.08Å; L226-Q228 PolarHBondContact O-N 2.92Å; Q228-K231 PolarHBondContact O-N 3.32Å
229	L	73.1	Confident	69.6	Low	111 Å²	111	96.2 Å²	96.2	58%	0.581	45%	0.453	S	S	*	.	H	α-helix	trans	-66.2	-43.5	174.4	-69.5	172.8	0	0	0	111.4	S225 L226 K231 T232	S225-L229 WeakPolarHBondContact O-CG 3.23Å; S225-L229 PolarHBondContact O-N 2.73Å; L226-L229 PolarHBondContact O-N 3.23Å; L229-K231 PolarHBondContact O-N 2.84Å; L229-T232 PolarHBondContact O-N 2.97Å; L229-T232 VanDerWaalsContact O-N 3.13Å; L229-T232 PolarHBondContact O-OG1 3.48Å
230	N	69.6	Low	67.9	Low	90 Å²	90	100.2 Å²	100.2	48%	0.481	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-64.8	-15.4	178.8	-74.6	2	0	0	0	113.8	Y135 L226	Y135-N230 HydrophobicContact CE2-CB 4.09Å; Y135-N230 PolarHBondContact OH-ND2 2.89Å; L226-N230 PolarHBondContact O-N 2.97Å
231	K	62.1	Low	66.7	Low	31 Å²	31	104.5 Å²	104.5	14%	0.135	49%	0.493	C	S	.	.	G	3₁₀ helix	trans	-77.3	-18.7	176	-79.2	179	-177.2	165.9	0	114	Q228 L229 E233	Q228-K231 PolarHBondContact O-N 3.32Å; L229-K231 PolarHBondContact O-N 2.84Å; K231-E233 PolarHBondContact O-N 3.35Å
232	T	55.5	Low	65.8	Low	84 Å²	84	107.4 Å²	107.4	52%	0.515	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-69.3	-16.7	-172.1	48.9	0	0	0	0	113.8	L229	L229-T232 PolarHBondContact O-N 2.97Å; L229-T232 VanDerWaalsContact O-N 3.13Å; L229-T232 PolarHBondContact O-OG1 3.48Å
233	E	55.6	Low	64.8	Low	181 Å²	181	104.9 Å²	104.9	85%	0.846	50%	0.495	S	S	*	.	S	Bend	trans	-82.8	-30.2	-178.9	-77.6	-176.3	150.4	0	0	114.1	K231 R235	K231-E233 PolarHBondContact O-N 3.35Å; E233-R235 PolarHBondContact O-N 2.93Å
234	D	56	Low	64.2	Low	113 Å²	113	101.9 Å²	101.9	60%	0.604	48%	0.48	S	S	*	.			trans	-103.2	69.1	-179.6	-104.4	-32.6	0	0	0	113.4	R236 V238	D234-R236 PolarHBondContact O-N 3.5Å; D234-V238 WeakPolarHBondContact O-CG2 3.27Å
235	R	53.5	Low	64.1	Low	205 Å²	205	105.1 Å²	105.1	77%	0.774	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-12.7	-178.9	-68.4	-171.6	-174.1	-163.6	2.2	115	E233	E233-R235 PolarHBondContact O-N 2.93Å
236	R	52.2	Low	64.4	Low	236 Å²	236	103 Å²	103	89%	0.891	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-33.1	-170.1	-73.4	-175.8	177.9	-172	0.8	114.4	D234	D234-R236 PolarHBondContact O-N 3.5Å
237	E	52.7	Low	64.5	Low	153 Å²	153	98.6 Å²	98.6	72%	0.715	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-23.6	179	-103.5	-174.7	163.7	0	0	114.3	R239 E240	E237-R239 PolarHBondContact O-N 3.36Å; E237-E240 PolarHBondContact O-N 3.11Å
238	V	50.8	Low	64.7	Low	42 Å²	42	98.9 Å²	98.9	26%	0.255	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-25.9	-178.6	175.7	0	0	0	0	112.3	D234 E240	D234-V238 WeakPolarHBondContact O-CG2 3.27Å; V238-E240 PolarHBondContact O-N 3.35Å
239	R	47.9	Very low	65.6	Low	221 Å²	221	96.5 Å²	96.5	83%	0.834	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-24.1	-177.4	-170.8	157.1	68	-177.2	2.3	113.7	E237	E237-R239 PolarHBondContact O-N 3.36Å
240	E	51.7	Low	66.4	Low	167 Å²	167	91.5 Å²	91.5	78%	0.78	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-20.2	-172.4	-65.4	-164.9	158.7	0	0	114.5	E237 V238 K242	E237-E240 PolarHBondContact O-N 3.11Å; V238-E240 PolarHBondContact O-N 3.35Å; E240-K242 PolarHBondContact O-N 3.46Å
241	N	64.1	Low	67.2	Low	94 Å²	94	87.7 Å²	87.7	50%	0.503	41%	0.407	S	S	.	.			trans	-97.8	84.3	-175.3	-75.8	-34.6	0	0	0	112.5	T243 T244 L245	N241-T243 PolarHBondContact O-N 2.9Å; N241-T244 WeakPolarHBondContact CB-OG1 3.5Å; N241-T244 WeakPolarHBondContact O-CA 3.44Å; N241-T244 WeakPolarHBondContact O-CB 3.33Å; N241-T244 PolarHBondContact O-N 3.44Å; N241-L245 PolarHBondContact O-N 3.02Å
242	K	66.5	Low	68.5	Low	110 Å²	110	90.1 Å²	90.1	48%	0.478	42%	0.421	S	S	.	.	H	α-helix	trans	-49	-31	170.4	-68.2	-176.8	177.4	177.5	0	113.5	E240 L245 M246 F306 I308	E240-K242 PolarHBondContact O-N 3.46Å; K242-L245 PolarHBondContact O-N 3.37Å; K242-M246 PolarHBondContact O-N 3.44Å; K242-F306 WeakPolarHBondContact CB-O 3.45Å; K242-I308 HydrophobicContact CD-CD1 4.09Å; K242-I308 HydrophobicContact CD-CG1 4.4Å
243	T	64	Low	70.3	Confident	60 Å²	60	87.4 Å²	87.4	37%	0.368	40%	0.403	S	S	.	.	H	α-helix	trans	-65.4	-35.4	174	-45.4	0	0	0	0	112.4	N241 M246 L247	N241-T243 PolarHBondContact O-N 2.9Å; T243-M246 HydrophobicContact CG2-CE 4.29Å; T243-M246 WeakPolarHBondContact O-CB 3.46Å; T243-L247 VanDerWaalsContact O-CG 3.3Å; T243-L247 WeakPolarHBondContact O-CG 3.31Å; T243-L247 PolarHBondContact O-N 3.03Å
244	T	75.8	Confident	71.9	Confident	8 Å²	8	78.9 Å²	78.9	5%	0.049	36%	0.363	C	S	.	.	H	α-helix	trans	-68.4	-41.2	175.5	-56.9	0	0	0	0	110.8	N241 M246 L247 V248	N241-T244 WeakPolarHBondContact CB-OG1 3.5Å; N241-T244 WeakPolarHBondContact O-CA 3.44Å; N241-T244 WeakPolarHBondContact O-CB 3.33Å; N241-T244 PolarHBondContact O-N 3.44Å; T244-M246 VanDerWaalsContact C-N 3.33Å; T244-M246 PolarHBondContact O-N 3.38Å; T244-L247 PolarHBondContact O-N 2.88Å; T244-V248 WeakPolarHBondContact O-CG2 3.37Å; T244-V248 PolarHBondContact O-N 3.06Å
245	L	81.2	Confident	73.5	Confident	69 Å²	69	75.2 Å²	75.2	36%	0.361	34%	0.343	S	S	.	.	H	α-helix	trans	-61.1	-41.5	175.8	-65.5	174.4	0	0	0	112.1	N241 K242 L247 V248 A249 F306	N241-L245 PolarHBondContact O-N 3.02Å; K242-L245 PolarHBondContact O-N 3.37Å; L245-L247 VanDerWaalsContact C-N 3.3Å; L245-L247 PolarHBondContact O-N 3.18Å; L245-V248 PolarHBondContact O-N 2.82Å; L245-A249 WeakPolarHBondContact O-CB 3.23Å; L245-A249 PolarHBondContact O-N 3.31Å; L245-F306 HydrophobicContact CB-CD1 3.69Å; L245-F306 HydrophobicContact CB-CE1 3.82Å; L245-F306 HydrophobicContact CB-CG 4.48Å; L245-F306 HydrophobicContact CD1-CE1 4.49Å
246	M	86.7	Confident	75.3	Confident	2 Å²	2	70.4 Å²	70.4	1%	0.01	33%	0.332	C	S	.	.	H	α-helix	trans	-53.3	-47.7	174.4	-171.5	-175.8	77	0	0	111.7	L69 K242 T243 T244 A249 I250 I302 Y303 F306	L69-M246 HydrophobicContact CD1-CE 3.58Å; K242-M246 PolarHBondContact O-N 3.44Å; T243-M246 HydrophobicContact CG2-CE 4.29Å; T243-M246 WeakPolarHBondContact O-CB 3.46Å; T244-M246 VanDerWaalsContact C-N 3.33Å; T244-M246 PolarHBondContact O-N 3.38Å; M246-A249 PolarHBondContact O-N 3.3Å; M246-I250 WeakPolarHBondContact O-CG1 3.44Å; M246-I250 PolarHBondContact O-N 3.45Å; M246-I250 VanDerWaalsContact O-N 3.1Å; M246-I302 HydrophobicContact CG-CG2 3.95Å; M246-I302 WeakPolarHBondContact O-CG2 3.14Å; M246-Y303 HydrophobicContact CE-CD1 4.22Å; M246-Y303 HydrophobicContact CE-CE1 4.31Å; M246-Y303 HydrophobicContact CG-CD1 3.92Å; M246-Y303 HydrophobicContact CG-CE1 4.46Å; M246-Y303 HydrophobicContact SD-CD1 3.57Å; M246-Y303 VanDerWaalsContact SD-CD1 3.57Å; M246-Y303 HydrophobicContact SD-CE1 4.23Å; M246-F306 HydrophobicContact CB-CB 3.58Å; M246-F306 HydrophobicContact CB-CD2 4.49Å; M246-F306 HydrophobicContact CB-CG 4.23Å; M246-F306 HydrophobicContact CG-CB 4.03Å
247	L	84.8	Confident	77.3	Confident	6 Å²	6	59.6 Å²	59.6	3%	0.031	29%	0.292	C	S	.	.	H	α-helix	trans	-75.8	-34.3	-174.5	-56.4	167.9	0	0	0	111.5	V65 L69 V130 R134 T243 T244 L245 A249 I250 V251	V65-L247 HydrophobicContact CG1-CD1 3.86Å; V65-L247 HydrophobicContact CG1-CD2 4.22Å; L69-L247 HydrophobicContact CD1-CD2 4.41Å; L69-L247 HydrophobicContact CD2-CD2 3.88Å; V130-L247 HydrophobicContact CG1-CB 4.24Å; V130-L247 HydrophobicContact CG1-CD1 4.21Å; V130-L247 HydrophobicContact CG1-CD2 3.61Å; V130-L247 HydrophobicContact CG1-CG 4.19Å; R134-L247 HydrophobicContact CG-CD1 3.29Å; T243-L247 VanDerWaalsContact O-CG 3.3Å; T243-L247 WeakPolarHBondContact O-CG 3.31Å; T243-L247 PolarHBondContact O-N 3.03Å; T244-L247 PolarHBondContact O-N 2.88Å; L245-L247 VanDerWaalsContact C-N 3.3Å; L245-L247 PolarHBondContact O-N 3.18Å; L247-A249 VanDerWaalsContact C-N 3.31Å; L247-A249 PolarHBondContact O-N 2.76Å; L247-I250 HydrophobicContact CD2-CD1 3.96Å; L247-I250 PolarHBondContact O-N 2.87Å; L247-V251 VanDerWaalsContact O-CG2 3.32Å; L247-V251 WeakPolarHBondContact O-CG2 2.91Å; L247-V251 PolarHBondContact O-N 3.39Å
248	V	84.1	Confident	79	Confident	22 Å²	22	52.4 Å²	52.4	13%	0.133	26%	0.258	C	S	.	.	H	α-helix	trans	-60.3	-42.8	169.8	171.5	0	0	0	0	110.8	T244 L245 I250 V251 I252	T244-V248 WeakPolarHBondContact O-CG2 3.37Å; T244-V248 PolarHBondContact O-N 3.06Å; L245-V248 PolarHBondContact O-N 2.82Å; V248-I250 PolarHBondContact O-N 3.07Å; V248-V251 PolarHBondContact O-N 3.24Å; V248-I252 HydrophobicContact CG1-CD1 3.75Å; V248-I252 HydrophobicContact CG1-CG1 4.4Å; V248-I252 WeakPolarHBondContact O-CG1 3.06Å; V248-I252 PolarHBondContact O-N 3.34Å
249	A	89	Confident	80.9	Confident	22 Å²	22	52.5 Å²	52.5	18%	0.182	26%	0.261	C	S	.	.	H	α-helix	trans	-63.7	-40	177	0	0	0	0	0	112.5	L245 M246 L247 V251 I252 M253 I302 F306	L245-A249 WeakPolarHBondContact O-CB 3.23Å; L245-A249 PolarHBondContact O-N 3.31Å; M246-A249 PolarHBondContact O-N 3.3Å; L247-A249 VanDerWaalsContact C-N 3.31Å; L247-A249 PolarHBondContact O-N 2.76Å; A249-V251 VanDerWaalsContact C-N 3.33Å; A249-V251 PolarHBondContact O-N 3.45Å; A249-I252 PolarHBondContact O-N 3.09Å; A249-M253 WeakPolarHBondContact O-CB 3.46Å; A249-M253 PolarHBondContact O-N 2.85Å; A249-I302 HydrophobicContact CB-CD1 4.36Å; A249-I302 HydrophobicContact CB-CG2 3.72Å; A249-F306 HydrophobicContact CB-CD2 4.24Å; A249-F306 HydrophobicContact CB-CE2 3.59Å; A249-F306 HydrophobicContact CB-CZ 4.23Å
250	I	89.9	Confident	83	Confident	5 Å²	5	43.6 Å²	43.6	3%	0.026	23%	0.23	C	C	.	.	H	α-helix	trans	-60.6	-44.7	174.7	-63.2	167.6	0	0	0	110.4	L69 L72 M246 L247 V248 M253 F254 I302 Y303	L69-I250 HydrophobicContact CD2-CD1 4.08Å; L72-I250 HydrophobicContact CD2-CG2 4.3Å; M246-I250 WeakPolarHBondContact O-CG1 3.44Å; M246-I250 PolarHBondContact O-N 3.45Å; M246-I250 VanDerWaalsContact O-N 3.1Å; L247-I250 HydrophobicContact CD2-CD1 3.96Å; L247-I250 PolarHBondContact O-N 2.87Å; V248-I250 PolarHBondContact O-N 3.07Å; I250-M253 PolarHBondContact O-N 3.42Å; I250-F254 WeakPolarHBondContact O-CB 3.19Å; I250-F254 PolarHBondContact O-N 3.47Å; I250-I302 HydrophobicContact CG1-CD1 3.98Å; I250-I302 HydrophobicContact CG1-CG2 3.99Å; I250-Y303 HydrophobicContact CD1-CD1 4.43Å; I250-Y303 HydrophobicContact CD1-CE1 3.51Å; I250-Y303 HydrophobicContact CG1-CE1 4.41Å
251	V	87.7	Confident	84.9	Confident	11 Å²	11	36.1 Å²	36.1	7%	0.067	20%	0.196	C	C	.	.	H	α-helix	trans	-62.1	-45.9	178.4	167.9	0	0	0	0	111.7	T127 S131 L224 L247 V248 A249 F254 L255	T127-V251 HydrophobicContact CG2-CG2 4.21Å; S131-V251 WeakPolarHBondContact OG-CG2 3.42Å; L224-V251 HydrophobicContact CB-CG1 3.86Å; L224-V251 HydrophobicContact CD1-CG1 4.08Å; L224-V251 HydrophobicContact CD2-CG1 3.92Å; L224-V251 HydrophobicContact CD2-CG2 3.92Å; L224-V251 HydrophobicContact CG-CG1 4.15Å; L247-V251 VanDerWaalsContact O-CG2 3.32Å; L247-V251 WeakPolarHBondContact O-CG2 2.91Å; L247-V251 PolarHBondContact O-N 3.39Å; V248-V251 PolarHBondContact O-N 3.24Å; A249-V251 VanDerWaalsContact C-N 3.33Å; A249-V251 PolarHBondContact O-N 3.45Å; V251-F254 WeakPolarHBondContact O-CB 3.11Å; V251-F254 PolarHBondContact O-N 2.53Å; V251-L255 HydrophobicContact CG1-CD1 4Å; V251-L255 HydrophobicContact CG1-CG 4.43Å; V251-L255 VanDerWaalsContact O-CG 3.28Å; V251-L255 WeakPolarHBondContact O-CG 3.42Å; V251-L255 PolarHBondContact O-N 2.84Å
252	I	89.3	Confident	86.1	Confident	81 Å²	81	34.8 Å²	34.8	42%	0.415	19%	0.186	S	C	.	.	H	α-helix	trans	-62.8	-45.4	178.4	-68.8	168.4	0	0	0	110.4	V248 A249 F254 L255 I256	V248-I252 HydrophobicContact CG1-CD1 3.75Å; V248-I252 HydrophobicContact CG1-CG1 4.4Å; V248-I252 WeakPolarHBondContact O-CG1 3.06Å; V248-I252 PolarHBondContact O-N 3.34Å; A249-I252 PolarHBondContact O-N 3.09Å; I252-F254 VanDerWaalsContact C-N 3.32Å; I252-F254 PolarHBondContact O-N 2.8Å; I252-L255 PolarHBondContact O-N 2.8Å; I252-I256 HydrophobicContact CG2-CD1 3.68Å; I252-I256 HydrophobicContact CG2-CG1 4.4Å; I252-I256 VanDerWaalsContact O-CG1 3.29Å; I252-I256 WeakPolarHBondContact O-CG1 3.17Å; I252-I256 PolarHBondContact O-N 3.49Å
253	M	92.3	Very high	87.2	Confident	28 Å²	28	33.3 Å²	33.3	14%	0.138	18%	0.183	C	C	.	.	H	α-helix	trans	-58.9	-45	176.2	-177.2	-178.1	73.5	0	0	111.4	A249 I250 I256 C257 N295 A298 N299 I302	A249-M253 WeakPolarHBondContact O-CB 3.46Å; A249-M253 PolarHBondContact O-N 2.85Å; I250-M253 PolarHBondContact O-N 3.42Å; M253-I256 PolarHBondContact O-N 3.01Å; M253-C257 WeakPolarHBondContact O-CB 2.97Å; M253-C257 PolarHBondContact O-N 3.16Å; M253-C257 PolarHBondContact O-SG 3.01Å; M253-N295 WeakPolarHBondContact CE-O 3.41Å; M253-A298 HydrophobicContact CE-CB 4.47Å; M253-A298 HydrophobicContact SD-CB 3.65Å; M253-N299 WeakPolarHBondContact CE-OD1 3.36Å; M253-I302 HydrophobicContact CB-CD1 4.15Å; M253-I302 HydrophobicContact CE-CD1 3.79Å; M253-I302 HydrophobicContact SD-CD1 3.63Å
254	F	90	Very high	88.4	Confident	1 Å²	1	30.8 Å²	30.8	0%	0.004	17%	0.167	C	C	.	.	H	α-helix	trans	-58.3	-49.2	176.2	173.2	-92.9	0	0	0	111.8	V124 T127 P220 L224 I250 V251 I252 I256 C257 N258 N295	V124-F254 HydrophobicContact CB-CE2 4.27Å; V124-F254 HydrophobicContact CB-CZ 4.12Å; V124-F254 HydrophobicContact CG1-CE2 4.45Å; V124-F254 HydrophobicContact CG1-CZ 3.82Å; V124-F254 HydrophobicContact CG2-CE2 3.68Å; V124-F254 HydrophobicContact CG2-CZ 3.68Å; T127-F254 HydrophobicContact CG2-CB 4.01Å; T127-F254 HydrophobicContact CG2-CD1 4.13Å; T127-F254 HydrophobicContact CG2-CD2 4.32Å; T127-F254 HydrophobicContact CG2-CG 3.87Å; P220-F254 HydrophobicContact CB-CE1 4.25Å; L224-F254 HydrophobicContact CD1-CD1 3.92Å; L224-F254 HydrophobicContact CD1-CE1 4.15Å; I250-F254 WeakPolarHBondContact O-CB 3.19Å; I250-F254 PolarHBondContact O-N 3.47Å; V251-F254 WeakPolarHBondContact O-CB 3.11Å; V251-F254 PolarHBondContact O-N 2.53Å; I252-F254 VanDerWaalsContact C-N 3.32Å; I252-F254 PolarHBondContact O-N 2.8Å; F254-I256 PolarHBondContact O-N 3.06Å; F254-C257 PolarHBondContact O-N 2.79Å; F254-N258 WeakPolarHBondContact CD2-ND2 3.4Å; F254-N258 WeakPolarHBondContact CE2-ND2 3.26Å; F254-N258 HydrophobicContact CZ-CB 4.3Å; F254-N258 WeakPolarHBondContact O-CB 3.41Å; F254-N258 PolarHBondContact O-N 3.38Å; F254-N258 PolarHBondContact O-ND2 3.16Å; F254-N295 WeakPolarHBondContact CA-OD1 3.48Å
255	L	89	Confident	88.9	Confident	36 Å²	36	31.8 Å²	31.8	19%	0.188	17%	0.172	C	C	.	.	H	α-helix	trans	-62.4	-42.9	-179.7	-69.3	172.1	0	0	0	111.8	F221 L224 V251 I252 S259	F221-L255 HydrophobicContact CB-CD2 4.37Å; F221-L255 HydrophobicContact CD1-CD2 3.57Å; F221-L255 HydrophobicContact CD2-CD2 3.96Å; F221-L255 HydrophobicContact CE1-CB 4.34Å; F221-L255 HydrophobicContact CE1-CD2 3.7Å; F221-L255 HydrophobicContact CE2-CD2 4.1Å; F221-L255 HydrophobicContact CG-CD2 3.71Å; F221-L255 HydrophobicContact CZ-CD2 3.98Å; L224-L255 HydrophobicContact CB-CD1 4.38Å; L224-L255 HydrophobicContact CB-CD2 4.42Å; L224-L255 HydrophobicContact CD1-CD2 4.12Å; L224-L255 HydrophobicContact CD1-CG 4.48Å; V251-L255 HydrophobicContact CG1-CD1 4Å; V251-L255 HydrophobicContact CG1-CG 4.43Å; V251-L255 VanDerWaalsContact O-CG 3.28Å; V251-L255 WeakPolarHBondContact O-CG 3.42Å; V251-L255 PolarHBondContact O-N 2.84Å; I252-L255 PolarHBondContact O-N 2.8Å; L255-S259 VanDerWaalsContact O-CB 3.28Å; L255-S259 WeakPolarHBondContact O-CB 3.29Å; L255-S259 PolarHBondContact O-N 2.89Å
256	I	91.9	Very high	89	Confident	105 Å²	105	32 Å²	32	54%	0.538	17%	0.173	S	C	.	.	H	α-helix	trans	-65	-45	178.1	-67.5	168	0	0	0	111	I252 M253 F254 S259	I252-I256 HydrophobicContact CG2-CD1 3.68Å; I252-I256 HydrophobicContact CG2-CG1 4.4Å; I252-I256 VanDerWaalsContact O-CG1 3.29Å; I252-I256 WeakPolarHBondContact O-CG1 3.17Å; I252-I256 PolarHBondContact O-N 3.49Å; M253-I256 PolarHBondContact O-N 3.01Å; F254-I256 PolarHBondContact O-N 3.06Å; I256-S259 PolarHBondContact O-OG 3.4Å
257	C	93	Very high	88.9	Confident	8 Å²	8	33.5 Å²	33.5	5%	0.054	18%	0.181	C	C	.	.	H	α-helix	trans	-74.2	-30.6	-175.8	-64	0	0	0	0	112.7	M253 F254 L291 N295	M253-C257 WeakPolarHBondContact O-CB 2.97Å; M253-C257 PolarHBondContact O-N 3.16Å; M253-C257 PolarHBondContact O-SG 3.01Å; F254-C257 PolarHBondContact O-N 2.79Å; C257-L291 HydrophobicContact CB-CB 4.15Å; C257-L291 WeakPolarHBondContact CB-O 3.45Å; C257-L291 WeakPolarHBondContact O-CB 3.49Å; C257-N295 HydrophobicContact CB-CB 3.62Å
258	N	89.5	Confident	88.9	Confident	2 Å²	2	35.6 Å²	35.6	1%	0.011	19%	0.19	C	C	.	.	H	α-helix	trans	-92	-8.2	180	-70.5	-92	0	0	0	113.1	F217 F221 F254 L260 A261 F262	F217-N258 HydrophobicContact CD1-CB 4.46Å; F217-N258 HydrophobicContact CE1-CB 4.18Å; F217-N258 WeakPolarHBondContact CE1-O 3.46Å; F221-N258 HydrophobicContact CE2-CB 4.34Å; F221-N258 HydrophobicContact CZ-CB 4.43Å; F254-N258 WeakPolarHBondContact CD2-ND2 3.4Å; F254-N258 WeakPolarHBondContact CE2-ND2 3.26Å; F254-N258 HydrophobicContact CZ-CB 4.3Å; F254-N258 WeakPolarHBondContact O-CB 3.41Å; F254-N258 PolarHBondContact O-N 3.38Å; F254-N258 PolarHBondContact O-ND2 3.16Å; N258-L260 VanDerWaalsContact C-N 3.31Å; N258-L260 PolarHBondContact O-N 2.94Å; N258-A261 PolarHBondContact O-N 3.27Å; N258-F262 PolarHBondContact O-N 3.35Å; N258-F262 VanDerWaalsContact O-N 3.13Å
259	S	90.3	Very high	88.6	Confident	44 Å²	44	36 Å²	36	31%	0.308	20%	0.196	S	C	.	.	H	α-helix	trans	-64.8	-36	-179.7	60.5	0	0	0	0	112.3	L255 I256 F262 I263	L255-S259 VanDerWaalsContact O-CB 3.28Å; L255-S259 WeakPolarHBondContact O-CB 3.29Å; L255-S259 PolarHBondContact O-N 2.89Å; I256-S259 PolarHBondContact O-OG 3.4Å; S259-F262 WeakPolarHBondContact O-CB 3.44Å; S259-F262 PolarHBondContact O-N 3.24Å; S259-I263 WeakPolarHBondContact O-CG1 3.48Å; S259-I263 PolarHBondContact O-N 2.86Å
260	L	92.6	Very high	88.2	Confident	34 Å²	34	40.2 Å²	40.2	18%	0.178	22%	0.215	C	C	.	.	H	α-helix	trans	-68.1	-42.7	178.3	-167.2	60	0	0	0	111.2	N258 F262 I263 D264 S284 I287 L291	N258-L260 VanDerWaalsContact C-N 3.31Å; N258-L260 PolarHBondContact O-N 2.94Å; L260-F262 PolarHBondContact O-N 2.78Å; L260-I263 CarbonylContact O-C 3.58Å; L260-I263 WeakPolarHBondContact O-CA 3.31Å; L260-I263 WeakPolarHBondContact O-CB 3.43Å; L260-I263 PolarHBondContact O-N 3.43Å; L260-D264 PolarHBondContact O-N 2.67Å; L260-S284 WeakPolarHBondContact CD1-OG 3.28Å; L260-I287 HydrophobicContact CD2-CB 3.81Å; L260-I287 HydrophobicContact CD2-CG2 3.52Å; L260-L291 HydrophobicContact CB-CD1 3.93Å; L260-L291 HydrophobicContact CD2-CD1 3.97Å
261	A	91	Very high	87.4	Confident	10 Å²	10	41.8 Å²	41.8	8%	0.083	22%	0.223	C	C	.	.	H	α-helix	trans	-58.8	-36.3	174.5	0	0	0	0	0	112.5	F217 N258 N265 S288	F217-A261 HydrophobicContact CE1-CB 3.76Å; F217-A261 HydrophobicContact CZ-CB 3.67Å; N258-A261 PolarHBondContact O-N 3.27Å; A261-N265 PolarHBondContact O-N 3.21Å; A261-N265 VanDerWaalsContact O-N 3.16Å; A261-N265 PolarHBondContact O-ND2 3.12Å; A261-S288 WeakPolarHBondContact CA-OG 3.47Å; A261-S288 VanDerWaalsContact CB-OG 3.26Å; A261-S288 WeakPolarHBondContact CB-OG 3.49Å; A261-S288 PolarHBondContact N-OG 2.56Å
262	F	88.8	Confident	86.5	Confident	66 Å²	66	48.9 Å²	48.9	29%	0.289	26%	0.255	S	S	.	.	H	α-helix	trans	-64.9	-45.1	172.7	177.5	-117.2	0	0	0	112.1	T213 F217 N258 S259 L260 D264 N265 I266	T213-F262 HydrophobicContact CG2-CD2 3.96Å; T213-F262 HydrophobicContact CG2-CE2 3.69Å; F217-F262 HydrophobicContact CB-CB 4.05Å; F217-F262 HydrophobicContact CB-CD2 3.29Å; F217-F262 HydrophobicContact CB-CE2 3.96Å; F217-F262 HydrophobicContact CB-CG 3.91Å; F217-F262 HydrophobicContact CD1-CB 3.7Å; F217-F262 HydrophobicContact CD1-CD2 4.46Å; F217-F262 HydrophobicContact CD1-CG 4.49Å; F217-F262 HydrophobicContact CD2-CB 4.26Å; F217-F262 AromaticContact CD2-CD2 3.88Å; F217-F262 HydrophobicContact CD2-CD2 3.88Å; F217-F262 HydrophobicContact CE1-CB 4.22Å; F217-F262 HydrophobicContact CG-CB 3.73Å; F217-F262 AromaticContact CG-CD2 3.64Å; F217-F262 HydrophobicContact CG-CD2 3.64Å; F217-F262 HydrophobicContact CG-CG 4.09Å; N258-F262 PolarHBondContact O-N 3.35Å; N258-F262 VanDerWaalsContact O-N 3.13Å; S259-F262 WeakPolarHBondContact O-CB 3.44Å; S259-F262 PolarHBondContact O-N 3.24Å; L260-F262 PolarHBondContact O-N 2.78Å; F262-D264 VanDerWaalsContact C-N 3.33Å; F262-D264 PolarHBondContact O-N 3.06Å; F262-N265 PolarHBondContact O-N 3.38Å; F262-I266 HydrophobicContact CD1-CD1 4.02Å; F262-I266 HydrophobicContact CE1-CD1 3.53Å; F262-I266 HydrophobicContact CE2-CD1 4.16Å; F262-I266 HydrophobicContact CZ-CD1 3.63Å; F262-I266 HydrophobicContact CZ-CG1 4.43Å; F262-I266 PolarHBondContact O-N 3.06Å
263	I	89.5	Confident	85.3	Confident	79 Å²	79	51.9 Å²	51.9	41%	0.405	27%	0.272	S	S	.	.	H	α-helix	trans	-62.2	-41.4	176.7	-66.9	165.1	0	0	0	110.6	S259 L260 N265 I266 I267	S259-I263 WeakPolarHBondContact O-CG1 3.48Å; S259-I263 PolarHBondContact O-N 2.86Å; L260-I263 CarbonylContact O-C 3.58Å; L260-I263 WeakPolarHBondContact O-CA 3.31Å; L260-I263 WeakPolarHBondContact O-CB 3.43Å; L260-I263 PolarHBondContact O-N 3.43Å; I263-N265 VanDerWaalsContact C-N 3.33Å; I263-N265 PolarHBondContact O-N 3.5Å; I263-I266 CarbonylContact O-C 3.6Å; I263-I266 WeakPolarHBondContact O-CA 3.27Å; I263-I266 WeakPolarHBondContact O-CB 3.44Å; I263-I266 PolarHBondContact O-N 2.98Å; I263-I267 HydrophobicContact CG2-CD1 3.72Å; I263-I267 HydrophobicContact CG2-CG1 4.17Å; I263-I267 WeakPolarHBondContact O-CG1 3.43Å; I263-I267 PolarHBondContact O-N 3.2Å
264	D	90	Very high	84.3	Confident	7 Å²	7	54.7 Å²	54.7	4%	0.037	29%	0.288	C	S	.	.	H	α-helix	trans	-59.6	-43.7	177.7	-63.3	-33.2	0	0	0	111.5	L260 F262 I266 I267 E268 Y281 S284 V285 S288	L260-D264 PolarHBondContact O-N 2.67Å; F262-D264 VanDerWaalsContact C-N 3.33Å; F262-D264 PolarHBondContact O-N 3.06Å; D264-I266 VanDerWaalsContact C-N 3.27Å; D264-I266 PolarHBondContact O-N 3.46Å; D264-I267 PolarHBondContact O-N 2.91Å; D264-E268 WeakPolarHBondContact O-CB 3.11Å; D264-E268 PolarHBondContact O-N 3.38Å; D264-Y281 HydrophobicContact CB-CE2 4.25Å; D264-S284 WeakPolarHBondContact OD1-CB 3.36Å; D264-S284 PolarHBondContact OD1-OG 2.93Å; D264-V285 HydrophobicContact CB-CG2 4.28Å; D264-S288 WeakPolarHBondContact OD2-CB 3.34Å; D264-S288 PolarHBondContact OD2-OG 3.09Å
265	N	85.7	Confident	83.5	Confident	30 Å²	30	65.2 Å²	65.2	16%	0.16	33%	0.327	C	S	.	.	H	α-helix	trans	-62.9	-33.8	175.6	-78.8	-76.4	0	0	0	112.2	F217 A261 F262 I263 A269	F217-N265 VanDerWaalsContact CE2-ND2 3.29Å; F217-N265 WeakPolarHBondContact CE2-ND2 3.2Å; A261-N265 PolarHBondContact O-N 3.21Å; A261-N265 VanDerWaalsContact O-N 3.16Å; A261-N265 PolarHBondContact O-ND2 3.12Å; F262-N265 PolarHBondContact O-N 3.38Å; I263-N265 VanDerWaalsContact C-N 3.33Å; I263-N265 PolarHBondContact O-N 3.5Å; N265-A269 WeakPolarHBondContact O-CB 3.15Å; N265-A269 PolarHBondContact O-N 2.92Å
266	I	83.9	Confident	82.8	Confident	72 Å²	72	68.1 Å²	68.1	37%	0.369	35%	0.351	S	S	.	.	H	α-helix	trans	-70.6	-42.6	173.5	-64.8	168.3	0	0	0	110.7	F262 I263 D264 A269 L270	F262-I266 HydrophobicContact CD1-CD1 4.02Å; F262-I266 HydrophobicContact CE1-CD1 3.53Å; F262-I266 HydrophobicContact CE2-CD1 4.16Å; F262-I266 HydrophobicContact CZ-CD1 3.63Å; F262-I266 HydrophobicContact CZ-CG1 4.43Å; F262-I266 PolarHBondContact O-N 3.06Å; I263-I266 CarbonylContact O-C 3.6Å; I263-I266 WeakPolarHBondContact O-CA 3.27Å; I263-I266 WeakPolarHBondContact O-CB 3.44Å; I263-I266 PolarHBondContact O-N 2.98Å; D264-I266 VanDerWaalsContact C-N 3.27Å; D264-I266 PolarHBondContact O-N 3.46Å; I266-A269 WeakPolarHBondContact O-CB 3.27Å; I266-A269 PolarHBondContact O-N 3.46Å; I266-L270 HydrophobicContact CG2-CD1 3.89Å; I266-L270 HydrophobicContact CG2-CG 4.45Å; I266-L270 VanDerWaalsContact O-CG 3.29Å; I266-L270 WeakPolarHBondContact O-CG 3.47Å; I266-L270 PolarHBondContact O-N 2.9Å; I266-L270 VanDerWaalsContact O-N 3.09Å
267	I	84.9	Confident	82.2	Confident	34 Å²	34	65.8 Å²	65.8	17%	0.174	34%	0.339	C	S	.	.	H	α-helix	trans	-63.3	-44.7	177.8	-67.7	170.1	0	0	0	110.2	I263 D264 A269 L270 M271 Y281	I263-I267 HydrophobicContact CG2-CD1 3.72Å; I263-I267 HydrophobicContact CG2-CG1 4.17Å; I263-I267 WeakPolarHBondContact O-CG1 3.43Å; I263-I267 PolarHBondContact O-N 3.2Å; D264-I267 PolarHBondContact O-N 2.91Å; I267-A269 VanDerWaalsContact C-N 3.28Å; I267-A269 PolarHBondContact O-N 3.32Å; I267-L270 CarbonylContact O-C 3.59Å; I267-L270 PolarHBondContact O-N 3.34Å; I267-M271 HydrophobicContact CG2-CE 4.42Å; I267-M271 VanDerWaalsContact O-CB 3.31Å; I267-M271 WeakPolarHBondContact O-CB 3.32Å; I267-M271 PolarHBondContact O-N 3.35Å; I267-Y281 HydrophobicContact CB-CD2 4.25Å; I267-Y281 HydrophobicContact CG2-CD2 3.85Å; I267-Y281 HydrophobicContact CG2-CG 4.32Å
268	E	84.4	Confident	81.7	Confident	50 Å²	50	69 Å²	69	23%	0.234	35%	0.353	C	S	.	.	H	α-helix	trans	-57.2	-43.8	176.8	-165.6	-179.5	177.3	0	0	110.7	Y204 D264 L270 M271 Y281	Y204-E268 WeakPolarHBondContact OH-CG 3.35Å; Y204-E268 PolarHBondContact OH-OE1 3.36Å; D264-E268 WeakPolarHBondContact O-CB 3.11Å; D264-E268 PolarHBondContact O-N 3.38Å; E268-L270 VanDerWaalsContact C-N 3.29Å; E268-L270 PolarHBondContact O-N 3.32Å; E268-M271 PolarHBondContact O-N 2.96Å; E268-Y281 HydrophobicContact CB-CE2 3.8Å; E268-Y281 VanDerWaalsContact CD-OH 3.27Å; E268-Y281 HydrophobicContact CG-CE2 4.34Å; E268-Y281 PolarHBondContact OE2-OH 3.28Å
269	A	78.4	Confident	81.5	Confident	31 Å²	31	74.9 Å²	74.9	26%	0.256	39%	0.385	S	S	.	.	H	α-helix	trans	-63.6	-29.1	175.5	0	0	0	0	0	114.6	M209 N265 I266 I267	M209-A269 HydrophobicContact CE-CB 3.26Å; M209-A269 HydrophobicContact CG-CB 4.24Å; M209-A269 HydrophobicContact SD-CB 3.7Å; N265-A269 WeakPolarHBondContact O-CB 3.15Å; N265-A269 PolarHBondContact O-N 2.92Å; I266-A269 WeakPolarHBondContact O-CB 3.27Å; I266-A269 PolarHBondContact O-N 3.46Å; I267-A269 VanDerWaalsContact C-N 3.28Å; I267-A269 PolarHBondContact O-N 3.32Å
270	L	79.3	Confident	81.3	Confident	111 Å²	111	77.7 Å²	77.7	58%	0.581	40%	0.395	S	S	*	.	H	α-helix	trans	-93.9	-12.1	179	-64	173.1	0	0	0	112.8	I266 I267 E268	I266-L270 HydrophobicContact CG2-CD1 3.89Å; I266-L270 HydrophobicContact CG2-CG 4.45Å; I266-L270 VanDerWaalsContact O-CG 3.29Å; I266-L270 WeakPolarHBondContact O-CG 3.47Å; I266-L270 PolarHBondContact O-N 2.9Å; I266-L270 VanDerWaalsContact O-N 3.09Å; I267-L270 CarbonylContact O-C 3.59Å; I267-L270 PolarHBondContact O-N 3.34Å; E268-L270 VanDerWaalsContact C-N 3.29Å; E268-L270 PolarHBondContact O-N 3.32Å
271	M	73.8	Confident	81.1	Confident	37 Å²	37	77.6 Å²	77.6	18%	0.182	39%	0.393	C	S	.	.	H	α-helix	trans	-76.1	-21.7	-173	178.1	174.7	-77.5	0	0	113.3	I267 E268 D273 N274 L277 E278 Y281	I267-M271 HydrophobicContact CG2-CE 4.42Å; I267-M271 VanDerWaalsContact O-CB 3.31Å; I267-M271 WeakPolarHBondContact O-CB 3.32Å; I267-M271 PolarHBondContact O-N 3.35Å; E268-M271 PolarHBondContact O-N 2.96Å; M271-D273 PolarHBondContact O-N 3.5Å; M271-N274 PolarHBondContact O-N 3.23Å; M271-L277 HydrophobicContact CE-CB 3.92Å; M271-L277 WeakPolarHBondContact CE-O 3.31Å; M271-E278 VanDerWaalsContact CE-CA 3.4Å; M271-E278 HydrophobicContact CE-CB 4.33Å; M271-Y281 HydrophobicContact CE-CD1 4.03Å; M271-Y281 HydrophobicContact CE-CG 3.76Å; M271-Y281 HydrophobicContact SD-CD1 4.26Å; M271-Y281 HydrophobicContact SD-CG 4.49Å
272	E	68.8	Low	81	Confident	160 Å²	160	83.4 Å²	83.4	75%	0.748	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	-23.3	178	-72.5	-167.9	162.5	0	0	112.4
273	D	65	Low	81.2	Confident	144 Å²	144	83 Å²	83	77%	0.77	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-17.1	178.8	-65.6	-37.4	0	0	0	116.6	M271	M271-D273 PolarHBondContact O-N 3.5Å
274	N	69.9	Low	81.3	Confident	88 Å²	88	80 Å²	80	47%	0.471	40%	0.403	S	S	.	.			trans	-143.7	101.3	-166.3	-79.1	-43.1	0	0	0	116.3	M271 S276 L277	M271-N274 PolarHBondContact O-N 3.23Å; N274-S276 PolarHBondContact O-N 3.5Å; N274-S276 VanDerWaalsContact O-N 3.16Å; N274-L277 HydrophobicContact CB-CD1 4.31Å; N274-L277 HydrophobicContact CB-CG 4.46Å; N274-L277 PolarHBondContact O-N 2.85Å
275	R	72.9	Confident	81.5	Confident	221 Å²	221	81.3 Å²	81.3	83%	0.834	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-61.6	-21.9	174.6	-61.3	-161.8	-157.1	-165.2	5.8	115	L277 E278	R275-L277 PolarHBondContact O-N 2.8Å; R275-E278 WeakPolarHBondContact O-CB 3.29Å; R275-E278 PolarHBondContact O-N 3.27Å; R275-E278 VanDerWaalsContact O-N 3.12Å
276	S	74.6	Confident	81.9	Confident	97 Å²	97	80.3 Å²	80.3	68%	0.678	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-64.3	-20.9	179.4	55.2	0	0	0	0	113.3	N274	N274-S276 PolarHBondContact O-N 3.5Å; N274-S276 VanDerWaalsContact O-N 3.16Å
277	L	79.3	Confident	82.5	Confident	57 Å²	57	80 Å²	80	30%	0.298	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-86.5	-8.2	178.2	-63.6	176.4	0	0	0	113.1	M271 N274 R275 N279 I280 Y281	M271-L277 HydrophobicContact CE-CB 3.92Å; M271-L277 WeakPolarHBondContact CE-O 3.31Å; N274-L277 HydrophobicContact CB-CD1 4.31Å; N274-L277 HydrophobicContact CB-CG 4.46Å; N274-L277 PolarHBondContact O-N 2.85Å; R275-L277 PolarHBondContact O-N 2.8Å; L277-N279 PolarHBondContact O-N 3.45Å; L277-I280 HydrophobicContact CD2-CD1 4.33Å; L277-I280 PolarHBondContact O-N 3.39Å; L277-Y281 WeakPolarHBondContact O-CB 3.49Å; L277-Y281 PolarHBondContact O-N 3.07Å
278	E	83.4	Confident	83	Confident	74 Å²	74	78.7 Å²	78.7	35%	0.346	40%	0.397	S	S	.	.	H	α-helix	trans	-57	-50.9	-172.9	-171.6	173.2	178.5	0	0	112.5	M271 R275 I280 Y281 Y282	M271-E278 VanDerWaalsContact CE-CA 3.4Å; M271-E278 HydrophobicContact CE-CB 4.33Å; R275-E278 WeakPolarHBondContact O-CB 3.29Å; R275-E278 PolarHBondContact O-N 3.27Å; R275-E278 VanDerWaalsContact O-N 3.12Å; E278-I280 VanDerWaalsContact C-N 3.35Å; E278-I280 PolarHBondContact O-N 3.09Å; E278-Y281 PolarHBondContact O-N 3.06Å; E278-Y282 HydrophobicContact CG-CD2 3.81Å; E278-Y282 HydrophobicContact CG-CE2 3.33Å; E278-Y282 WeakPolarHBondContact O-CD2 3.23Å; E278-Y282 PolarHBondContact O-N 2.78Å
279	N	84.5	Confident	83.6	Confident	126 Å²	126	78.9 Å²	78.9	67%	0.674	40%	0.4	S	S	*	.	H	α-helix	trans	-65.1	-37.9	178.9	-70.3	-10.7	0	0	0	112.8	L277 T283	L277-N279 PolarHBondContact O-N 3.45Å; N279-T283 WeakPolarHBondContact O-CB 3.41Å; N279-T283 PolarHBondContact O-N 3.43Å; N279-T283 VanDerWaalsContact O-N 3.09Å; N279-T283 PolarHBondContact O-OG1 2.79Å
280	I	86.2	Confident	84.5	Confident	104 Å²	104	78.7 Å²	78.7	53%	0.533	39%	0.394	S	S	.	.	H	α-helix	trans	-66.3	-44.5	179.5	-62.3	176.5	0	0	0	109.4	L277 E278 T283 S284	L277-I280 HydrophobicContact CD2-CD1 4.33Å; L277-I280 PolarHBondContact O-N 3.39Å; E278-I280 VanDerWaalsContact C-N 3.35Å; E278-I280 PolarHBondContact O-N 3.09Å; I280-T283 PolarHBondContact O-N 2.97Å; I280-S284 VanDerWaalsContact O-CB 3.23Å; I280-S284 WeakPolarHBondContact O-CB 3.29Å; I280-S284 PolarHBondContact O-N 3.17Å
281	Y	89.4	Confident	85.3	Confident	32 Å²	32	75.5 Å²	75.5	13%	0.125	38%	0.378	C	S	.	.	H	α-helix	trans	-60.5	-52.3	177.2	173.2	-109.5	0	0	0	112.1	D264 I267 E268 M271 L277 E278 T283 S284 V285	D264-Y281 HydrophobicContact CB-CE2 4.25Å; I267-Y281 HydrophobicContact CB-CD2 4.25Å; I267-Y281 HydrophobicContact CG2-CD2 3.85Å; I267-Y281 HydrophobicContact CG2-CG 4.32Å; E268-Y281 HydrophobicContact CB-CE2 3.8Å; E268-Y281 VanDerWaalsContact CD-OH 3.27Å; E268-Y281 HydrophobicContact CG-CE2 4.34Å; E268-Y281 PolarHBondContact OE2-OH 3.28Å; M271-Y281 HydrophobicContact CE-CD1 4.03Å; M271-Y281 HydrophobicContact CE-CG 3.76Å; M271-Y281 HydrophobicContact SD-CD1 4.26Å; M271-Y281 HydrophobicContact SD-CG 4.49Å; L277-Y281 WeakPolarHBondContact O-CB 3.49Å; L277-Y281 PolarHBondContact O-N 3.07Å; E278-Y281 PolarHBondContact O-N 3.06Å; Y281-T283 VanDerWaalsContact C-N 3.3Å; Y281-T283 PolarHBondContact O-N 3.44Å; Y281-S284 WeakPolarHBondContact O-CB 3.28Å; Y281-S284 PolarHBondContact O-N 3.42Å; Y281-S284 VanDerWaalsContact O-N 3.07Å; Y281-V285 HydrophobicContact CD1-CG2 4.47Å; Y281-V285 HydrophobicContact CD2-CG2 4.04Å; Y281-V285 HydrophobicContact CE1-CG2 4.12Å; Y281-V285 HydrophobicContact CE2-CG2 3.62Å; Y281-V285 HydrophobicContact CG-CG2 4.44Å; Y281-V285 WeakPolarHBondContact O-CG2 3.19Å; Y281-V285 PolarHBondContact O-N 3.14Å
282	Y	89.2	Confident	86.4	Confident	131 Å²	131	74.5 Å²	74.5	51%	0.514	37%	0.373	S	S	.	.	H	α-helix	trans	-60.4	-41.5	179.7	-72	-54.2	0	0	0	112.1	E278 S284 V285 E286	E278-Y282 HydrophobicContact CG-CD2 3.81Å; E278-Y282 HydrophobicContact CG-CE2 3.33Å; E278-Y282 WeakPolarHBondContact O-CD2 3.23Å; E278-Y282 PolarHBondContact O-N 2.78Å; Y282-S284 VanDerWaalsContact C-N 3.33Å; Y282-S284 PolarHBondContact O-N 2.9Å; Y282-V285 PolarHBondContact O-N 3.04Å; Y282-E286 WeakPolarHBondContact O-CG 3.4Å; Y282-E286 PolarHBondContact O-N 2.83Å
283	T	91.5	Very high	87.7	Confident	59 Å²	59	67 Å²	67	36%	0.362	34%	0.34	S	S	.	.	H	α-helix	trans	-61.3	-43.9	174.6	-55.7	0	0	0	0	111.3	F28 N279 I280 Y281 E286 I287	F28-T283 HydrophobicContact CD1-CG2 4.37Å; F28-T283 HydrophobicContact CE1-CG2 3.66Å; F28-T283 HydrophobicContact CZ-CG2 3.81Å; N279-T283 WeakPolarHBondContact O-CB 3.41Å; N279-T283 PolarHBondContact O-N 3.43Å; N279-T283 VanDerWaalsContact O-N 3.09Å; N279-T283 PolarHBondContact O-OG1 2.79Å; I280-T283 PolarHBondContact O-N 2.97Å; Y281-T283 VanDerWaalsContact C-N 3.3Å; Y281-T283 PolarHBondContact O-N 3.44Å; T283-E286 PolarHBondContact O-N 3.42Å; T283-I287 HydrophobicContact CG2-CD1 4.24Å; T283-I287 WeakPolarHBondContact O-CG1 3.38Å; T283-I287 PolarHBondContact O-N 2.64Å
284	S	93.1	Very high	89.2	Confident	16 Å²	16	63 Å²	63	11%	0.112	32%	0.318	C	S	.	.	H	α-helix	trans	-64	-43.3	179.7	-167.8	0	0	0	0	111.9	L260 D264 I280 Y281 Y282 E286 I287 S288	L260-S284 WeakPolarHBondContact CD1-OG 3.28Å; D264-S284 WeakPolarHBondContact OD1-CB 3.36Å; D264-S284 PolarHBondContact OD1-OG 2.93Å; I280-S284 VanDerWaalsContact O-CB 3.23Å; I280-S284 WeakPolarHBondContact O-CB 3.29Å; I280-S284 PolarHBondContact O-N 3.17Å; Y281-S284 WeakPolarHBondContact O-CB 3.28Å; Y281-S284 PolarHBondContact O-N 3.42Å; Y281-S284 VanDerWaalsContact O-N 3.07Å; Y282-S284 VanDerWaalsContact C-N 3.33Å; Y282-S284 PolarHBondContact O-N 2.9Å; S284-E286 VanDerWaalsContact C-N 3.34Å; S284-E286 PolarHBondContact O-N 2.92Å; S284-I287 PolarHBondContact O-N 3.18Å; S284-I287 VanDerWaalsContact O-N 3.16Å; S284-S288 WeakPolarHBondContact O-CB 3.31Å; S284-S288 PolarHBondContact O-N 3.23Å
285	V	93.8	Very high	90.5	Very high	33 Å²	33	59.2 Å²	59.2	20%	0.2	30%	0.297	C	S	.	.	H	α-helix	trans	-59.4	-41.2	176.6	169.6	0	0	0	0	111.9	D264 Y281 Y282 S288 N289	D264-V285 HydrophobicContact CB-CG2 4.28Å; Y281-V285 HydrophobicContact CD1-CG2 4.47Å; Y281-V285 HydrophobicContact CD2-CG2 4.04Å; Y281-V285 HydrophobicContact CE1-CG2 4.12Å; Y281-V285 HydrophobicContact CE2-CG2 3.62Å; Y281-V285 HydrophobicContact CG-CG2 4.44Å; Y281-V285 WeakPolarHBondContact O-CG2 3.19Å; Y281-V285 PolarHBondContact O-N 3.14Å; Y282-V285 PolarHBondContact O-N 3.04Å; V285-S288 WeakPolarHBondContact O-CB 3.44Å; V285-S288 PolarHBondContact O-N 3.12Å; V285-N289 WeakPolarHBondContact O-CB 3.34Å; V285-N289 PolarHBondContact O-N 3.46Å; V285-N289 PolarHBondContact O-ND2 3.31Å; V285-N289 VanDerWaalsContact O-ND2 3.12Å
286	E	94.4	Very high	91.7	Very high	10 Å²	10	48.8 Å²	48.8	5%	0.047	26%	0.258	C	S	.	.	H	α-helix	trans	-63.6	-44.3	175.9	-66.9	-58.3	140.7	0	0	111.8	F28 I32 R33 Y282 T283 S284 S288 N289 L290	F28-E286 HydrophobicContact CE1-CB 3.86Å; F28-E286 HydrophobicContact CE1-CG 4.34Å; I32-E286 HydrophobicContact CB-CB 4.45Å; I32-E286 HydrophobicContact CG1-CB 4.42Å; I32-E286 HydrophobicContact CG2-CB 4.15Å; I32-E286 WeakPolarHBondContact CG2-O 3.46Å; R33-E286 VanDerWaalsContact CG-OE2 3.28Å; R33-E286 WeakPolarHBondContact CG-OE2 3.19Å; R33-E286 IonicContact CZ-OE1 3.9Å; R33-E286 VanDerWaalsContact CZ-OE1 3.28Å; R33-E286 IonicContact CZ-OE2 3.06Å; R33-E286 IonicContact NE-OE1 2.89Å; R33-E286 PolarHBondContact NE-OE1 3.41Å; R33-E286 IonicContact NE-OE2 3.66Å; R33-E286 PolarHBondContact NE-OE2 3.32Å; R33-E286 IonicContact NH2-OE1 3.73Å; R33-E286 PolarHBondContact NH2-OE1 2.94Å; R33-E286 IonicContact NH2-OE2 3.94Å; Y282-E286 WeakPolarHBondContact O-CG 3.4Å; Y282-E286 PolarHBondContact O-N 2.83Å; T283-E286 PolarHBondContact O-N 3.42Å; S284-E286 VanDerWaalsContact C-N 3.34Å; S284-E286 PolarHBondContact O-N 2.92Å; E286-S288 VanDerWaalsContact C-N 3.31Å; E286-S288 PolarHBondContact O-N 3.45Å; E286-N289 PolarHBondContact O-N 2.74Å; E286-L290 PolarHBondContact O-N 2.89Å; E286-L290 VanDerWaalsContact O-N 3.08Å
287	I	96.1	Very high	92.8	Very high	66 Å²	66	44.4 Å²	44.4	34%	0.338	23%	0.228	S	C	.	.	H	α-helix	trans	-64.9	-39.1	177	-62.6	169.3	0	0	0	110.6	F28 L260 T283 S284 L290 L291	F28-I287 HydrophobicContact CZ-CD1 4.29Å; F28-I287 HydrophobicContact CZ-CG1 3.99Å; L260-I287 HydrophobicContact CD2-CB 3.81Å; L260-I287 HydrophobicContact CD2-CG2 3.52Å; T283-I287 HydrophobicContact CG2-CD1 4.24Å; T283-I287 WeakPolarHBondContact O-CG1 3.38Å; T283-I287 PolarHBondContact O-N 2.64Å; S284-I287 PolarHBondContact O-N 3.18Å; S284-I287 VanDerWaalsContact O-N 3.16Å; I287-L290 WeakPolarHBondContact O-CB 3.33Å; I287-L290 PolarHBondContact O-N 3.38Å; I287-L291 HydrophobicContact CG2-CD1 4.41Å; I287-L291 WeakPolarHBondContact O-CG 3.43Å; I287-L291 PolarHBondContact O-N 3.43Å
288	S	95.9	Very high	93.6	Very high	5 Å²	5	42.4 Å²	42.4	4%	0.035	22%	0.219	C	C	.	.	H	α-helix	trans	-63.5	-46.7	178.9	-172.3	0	0	0	0	111.9	A261 D264 S284 V285 E286 L290 L291 V292	A261-S288 WeakPolarHBondContact CA-OG 3.47Å; A261-S288 VanDerWaalsContact CB-OG 3.26Å; A261-S288 WeakPolarHBondContact CB-OG 3.49Å; A261-S288 PolarHBondContact N-OG 2.56Å; D264-S288 WeakPolarHBondContact OD2-CB 3.34Å; D264-S288 PolarHBondContact OD2-OG 3.09Å; S284-S288 WeakPolarHBondContact O-CB 3.31Å; S284-S288 PolarHBondContact O-N 3.23Å; V285-S288 WeakPolarHBondContact O-CB 3.44Å; V285-S288 PolarHBondContact O-N 3.12Å; E286-S288 VanDerWaalsContact C-N 3.31Å; E286-S288 PolarHBondContact O-N 3.45Å; S288-L290 VanDerWaalsContact C-N 3.3Å; S288-L290 PolarHBondContact O-N 3Å; S288-L291 WeakPolarHBondContact O-CB 3.16Å; S288-L291 PolarHBondContact O-N 2.83Å; S288-L291 VanDerWaalsContact O-N 3.15Å; S288-V292 WeakPolarHBondContact O-CG2 3.01Å; S288-V292 PolarHBondContact O-N 3.06Å
289	N	95.7	Very high	94.2	Very high	54 Å²	54	39 Å²	39	29%	0.289	20%	0.203	S	C	.	.	H	α-helix	trans	-60.9	-38.9	173.3	-74.7	-37.6	0	0	0	112.3	L87 V285 E286 V292 G293	L87-N289 HydrophobicContact CD1-CB 3.81Å; V285-N289 WeakPolarHBondContact O-CB 3.34Å; V285-N289 PolarHBondContact O-N 3.46Å; V285-N289 PolarHBondContact O-ND2 3.31Å; V285-N289 VanDerWaalsContact O-ND2 3.12Å; E286-N289 PolarHBondContact O-N 2.74Å; N289-V292 PolarHBondContact O-N 3.42Å; N289-G293 PolarHBondContact O-N 3.35Å; N289-G293 VanDerWaalsContact O-N 3.08Å
290	L	97.1	Very high	94.8	Very high	28 Å²	28	34 Å²	34	15%	0.147	18%	0.177	C	C	.	.	H	α-helix	trans	-61.3	-46.2	173.4	179.7	68.4	0	0	0	111.5	I32 C36 I37 I40 E286 I287 S288 V292 G293 I294	I32-L290 HydrophobicContact CD1-CD2 4.21Å; I32-L290 HydrophobicContact CG2-CB 4.18Å; C36-L290 HydrophobicContact CB-CD1 3.65Å; C36-L290 HydrophobicContact CB-CD2 4.43Å; I37-L290 HydrophobicContact CG1-CD1 3.85Å; I40-L290 HydrophobicContact CD1-CD1 3.39Å; I40-L290 HydrophobicContact CD1-CG 4.47Å; E286-L290 PolarHBondContact O-N 2.89Å; E286-L290 VanDerWaalsContact O-N 3.08Å; I287-L290 WeakPolarHBondContact O-CB 3.33Å; I287-L290 PolarHBondContact O-N 3.38Å; S288-L290 VanDerWaalsContact C-N 3.3Å; S288-L290 PolarHBondContact O-N 3Å; L290-V292 VanDerWaalsContact C-N 3.33Å; L290-V292 PolarHBondContact O-N 3.32Å; L290-G293 PolarHBondContact O-N 2.89Å; L290-G293 VanDerWaalsContact O-N 3.14Å; L290-I294 HydrophobicContact CG-CD1 4.21Å; L290-I294 WeakPolarHBondContact O-CG1 3.28Å; L290-I294 PolarHBondContact O-N 3.19Å
291	L	97.2	Very high	95.3	Very high	44 Å²	44	35.2 Å²	35.2	23%	0.23	18%	0.178	C	C	.	.	H	α-helix	trans	-61.4	-40	177.7	-71.9	174.3	0	0	0	112.1	C257 L260 I287 S288 G293 I294 N295	C257-L291 HydrophobicContact CB-CB 4.15Å; C257-L291 WeakPolarHBondContact CB-O 3.45Å; C257-L291 WeakPolarHBondContact O-CB 3.49Å; L260-L291 HydrophobicContact CB-CD1 3.93Å; L260-L291 HydrophobicContact CD2-CD1 3.97Å; I287-L291 HydrophobicContact CG2-CD1 4.41Å; I287-L291 WeakPolarHBondContact O-CG 3.43Å; I287-L291 PolarHBondContact O-N 3.43Å; S288-L291 WeakPolarHBondContact O-CB 3.16Å; S288-L291 PolarHBondContact O-N 2.83Å; S288-L291 VanDerWaalsContact O-N 3.15Å; L291-G293 VanDerWaalsContact C-N 3.32Å; L291-G293 PolarHBondContact O-N 3.17Å; L291-I294 PolarHBondContact O-N 3.36Å; L291-N295 WeakPolarHBondContact O-CB 3.42Å; L291-N295 PolarHBondContact O-N 2.72Å
292	V	95.7	Very high	95.5	Very high	15 Å²	15	34.6 Å²	34.6	9%	0.091	18%	0.177	C	C	.	.	H	α-helix	trans	-60.4	-43	173.6	172.6	0	0	0	0	110.9	V79 S288 N289 L290 I294 N295 S296	V79-V292 HydrophobicContact CG1-CG1 4.02Å; S288-V292 WeakPolarHBondContact O-CG2 3.01Å; S288-V292 PolarHBondContact O-N 3.06Å; N289-V292 PolarHBondContact O-N 3.42Å; L290-V292 VanDerWaalsContact C-N 3.33Å; L290-V292 PolarHBondContact O-N 3.32Å; V292-I294 PolarHBondContact O-N 3.19Å; V292-N295 WeakPolarHBondContact O-CB 3.45Å; V292-N295 PolarHBondContact O-N 2.97Å; V292-S296 PolarHBondContact O-N 3.03Å; V292-S296 VanDerWaalsContact O-N 3.12Å
293	G	97.1	Very high	95.7	Very high	4 Å²	4	28.3 Å²	28.3	4%	0.041	15%	0.152	C	C	.	.	H	α-helix	trans	-62.3	-39.4	174.3	0	0	0	0	0	113.4	I40 N289 L290 L291 S296 S297	I40-G293 WeakPolarHBondContact CG2-O 3.36Å; N289-G293 PolarHBondContact O-N 3.35Å; N289-G293 VanDerWaalsContact O-N 3.08Å; L290-G293 PolarHBondContact O-N 2.89Å; L290-G293 VanDerWaalsContact O-N 3.14Å; L291-G293 VanDerWaalsContact C-N 3.32Å; L291-G293 PolarHBondContact O-N 3.17Å; G293-S296 PolarHBondContact O-N 3.42Å; G293-S297 WeakPolarHBondContact O-CB 3.41Å; G293-S297 PolarHBondContact O-N 3.29Å; G293-S297 PolarHBondContact O-OG 3.49Å
294	I	97.2	Very high	95.8	Very high	60 Å²	60	27.9 Å²	27.9	31%	0.308	15%	0.151	S	C	.	.	H	α-helix	trans	-64.3	-46.4	175	-67.4	170.9	0	0	0	110.4	I40 L290 L291 V292 S296 S297 A298	I40-I294 HydrophobicContact CD1-CD1 4.4Å; I40-I294 HydrophobicContact CD1-CG1 3.78Å; L290-I294 HydrophobicContact CG-CD1 4.21Å; L290-I294 WeakPolarHBondContact O-CG1 3.28Å; L290-I294 PolarHBondContact O-N 3.19Å; L291-I294 PolarHBondContact O-N 3.36Å; V292-I294 PolarHBondContact O-N 3.19Å; I294-S296 VanDerWaalsContact C-N 3.29Å; I294-S296 PolarHBondContact O-N 3.19Å; I294-S297 PolarHBondContact O-N 3.33Å; I294-S297 PolarHBondContact O-OG 2.81Å; I294-S297 VanDerWaalsContact O-OG 3.05Å; I294-A298 HydrophobicContact CG2-CB 4.36Å; I294-A298 VanDerWaalsContact O-CB 3.26Å; I294-A298 WeakPolarHBondContact O-CB 3.22Å; I294-A298 PolarHBondContact O-N 2.67Å
295	N	96.1	Very high	95.7	Very high	8 Å²	8	34.4 Å²	34.4	4%	0.043	18%	0.177	C	C	.	.	H	α-helix	trans	-55.9	-44	178.6	-178.3	54.7	0	0	0	112.2	M253 F254 C257 L291 V292 S297	M253-N295 WeakPolarHBondContact CE-O 3.41Å; F254-N295 WeakPolarHBondContact CA-OD1 3.48Å; C257-N295 HydrophobicContact CB-CB 3.62Å; L291-N295 WeakPolarHBondContact O-CB 3.42Å; L291-N295 PolarHBondContact O-N 2.72Å; V292-N295 WeakPolarHBondContact O-CB 3.45Å; V292-N295 PolarHBondContact O-N 2.97Å; N295-S297 VanDerWaalsContact C-N 3.27Å; N295-S297 PolarHBondContact O-N 3.35Å
296	S	97.5	Very high	95.5	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.014	18%	0.178	C	C	.	.	H	α-helix	trans	-76.3	-8.2	179.6	-71.4	0	0	0	0	114.3	N48 D76 V292 G293 I294	N48-S296 PolarHBondContact ND2-O 3.27Å; D76-S296 WeakPolarHBondContact CB-O 3.4Å; D76-S296 PolarHBondContact OD1-OG 3.19Å; V292-S296 PolarHBondContact O-N 3.03Å; V292-S296 VanDerWaalsContact O-N 3.12Å; G293-S296 PolarHBondContact O-N 3.42Å; I294-S296 VanDerWaalsContact C-N 3.29Å; I294-S296 PolarHBondContact O-N 3.19Å
297	S	97.8	Very high	95.2	Very high	5 Å²	5	35.4 Å²	35.4	4%	0.035	18%	0.181	C	C	.	.	H	α-helix	trans	-112.4	-26.5	-179.2	59.5	0	0	0	0	114	I40 G44 G293 I294 N295 N299	I40-S297 WeakPolarHBondContact CG2-OG 3.35Å; G44-S297 VanDerWaalsContact CA-CB 3.41Å; G293-S297 WeakPolarHBondContact O-CB 3.41Å; G293-S297 PolarHBondContact O-N 3.29Å; G293-S297 PolarHBondContact O-OG 3.49Å; I294-S297 PolarHBondContact O-N 3.33Å; I294-S297 PolarHBondContact O-OG 2.81Å; I294-S297 VanDerWaalsContact O-OG 3.05Å; N295-S297 VanDerWaalsContact C-N 3.27Å; N295-S297 PolarHBondContact O-N 3.35Å; S297-N299 PolarHBondContact O-N 2.93Å
298	A	97	Very high	94.8	Very high	14 Å²	14	36.1 Å²	36.1	12%	0.116	18%	0.184	C	C	.	.	H	α-helix	trans	-83.6	-8.5	-169.4	0	0	0	0	0	115.2	M253 I294 I300 F301	M253-A298 HydrophobicContact CE-CB 4.47Å; M253-A298 HydrophobicContact SD-CB 3.65Å; I294-A298 HydrophobicContact CG2-CB 4.36Å; I294-A298 VanDerWaalsContact O-CB 3.26Å; I294-A298 WeakPolarHBondContact O-CB 3.22Å; I294-A298 PolarHBondContact O-N 2.67Å; A298-I300 PolarHBondContact O-N 2.88Å; A298-F301 HydrophobicContact CB-CD2 4.18Å; A298-F301 WeakPolarHBondContact O-CB 3.19Å; A298-F301 WeakPolarHBondContact O-CD2 3.13Å; A298-F301 PolarHBondContact O-N 3.06Å
299	N	95.9	Very high	94.5	Very high	3 Å²	3	41.8 Å²	41.8	2%	0.016	21%	0.208	C	C	.	.	H	α-helix	trans	-52	-34.8	-178.5	-85.1	-33.5	0	0	0	113.8	D76 M253 S297 F301 I302 Y303	D76-N299 PolarHBondContact OD2-ND2 3.4Å; M253-N299 WeakPolarHBondContact CE-OD1 3.36Å; S297-N299 PolarHBondContact O-N 2.93Å; N299-F301 VanDerWaalsContact C-N 3.28Å; N299-F301 PolarHBondContact O-N 3Å; N299-I302 PolarHBondContact O-N 3.09Å; N299-Y303 HydrophobicContact CB-CD2 4.47Å; N299-Y303 HydrophobicContact CB-CE2 3.7Å; N299-Y303 WeakPolarHBondContact O-CD2 3.04Å; N299-Y303 PolarHBondContact O-N 2.68Å
300	I	96.3	Very high	94.3	Very high	22 Å²	22	39.2 Å²	39.2	11%	0.113	19%	0.194	C	C	.	.	H	α-helix	trans	-58.6	-36.5	177.4	-172.9	158.1	0	0	0	113.3	F43 A47 I50 A298 Y303 C304 Y310	F43-I300 HydrophobicContact CE1-CG2 4.21Å; F43-I300 HydrophobicContact CZ-CG2 3.78Å; A47-I300 HydrophobicContact CB-CB 4.09Å; A47-I300 HydrophobicContact CB-CD1 4.15Å; A47-I300 HydrophobicContact CB-CG2 3.73Å; I50-I300 HydrophobicContact CB-CD1 4.41Å; I50-I300 HydrophobicContact CG2-CD1 4.15Å; A298-I300 PolarHBondContact O-N 2.88Å; I300-Y303 PolarHBondContact O-N 3.13Å; I300-C304 WeakPolarHBondContact O-CB 3.2Å; I300-C304 PolarHBondContact O-N 2.59Å; I300-C304 PolarHBondContact O-SG 3.44Å; I300-C304 VanDerWaalsContact O-SG 3.41Å; I300-Y310 HydrophobicContact CG1-CE1 4.47Å; I300-Y310 WeakPolarHBondContact CG1-OH 3.44Å
301	F	96.4	Very high	94.1	Very high	128 Å²	128	42.9 Å²	42.9	56%	0.561	21%	0.206	S	C	*	.	H	α-helix	trans	-66.7	-42.3	179.6	-62.7	-64.5	0	0	0	110.8	F43 A298 N299 C304 F305	F43-F301 AromaticContact CE1-CE2 3.59Å; F43-F301 HydrophobicContact CE1-CE2 3.59Å; F43-F301 AromaticContact CE1-CZ 3.85Å; F43-F301 HydrophobicContact CE1-CZ 3.85Å; F43-F301 HydrophobicContact CE2-CZ 4.13Å; F43-F301 HydrophobicContact CZ-CE1 4.18Å; F43-F301 AromaticContact CZ-CE2 3.53Å; F43-F301 HydrophobicContact CZ-CE2 3.53Å; F43-F301 AromaticContact CZ-CZ 3.31Å; F43-F301 HydrophobicContact CZ-CZ 3.31Å; A298-F301 HydrophobicContact CB-CD2 4.18Å; A298-F301 WeakPolarHBondContact O-CB 3.19Å; A298-F301 WeakPolarHBondContact O-CD2 3.13Å; A298-F301 PolarHBondContact O-N 3.06Å; N299-F301 VanDerWaalsContact C-N 3.28Å; N299-F301 PolarHBondContact O-N 3Å; F301-C304 PolarHBondContact O-N 2.96Å; F301-F305 WeakPolarHBondContact O-CB 3Å; F301-F305 PolarHBondContact O-N 3.29Å
302	I	94.3	Very high	93.9	Very high	19 Å²	19	42.5 Å²	42.5	10%	0.097	20%	0.204	C	C	.	.	H	α-helix	trans	-62.1	-46	176.1	-59.5	176.2	0	0	0	110.1	M246 A249 I250 M253 N299 C304 F305 F306	M246-I302 HydrophobicContact CG-CG2 3.95Å; M246-I302 WeakPolarHBondContact O-CG2 3.14Å; A249-I302 HydrophobicContact CB-CD1 4.36Å; A249-I302 HydrophobicContact CB-CG2 3.72Å; I250-I302 HydrophobicContact CG1-CD1 3.98Å; I250-I302 HydrophobicContact CG1-CG2 3.99Å; M253-I302 HydrophobicContact CB-CD1 4.15Å; M253-I302 HydrophobicContact CE-CD1 3.79Å; M253-I302 HydrophobicContact SD-CD1 3.63Å; N299-I302 PolarHBondContact O-N 3.09Å; I302-C304 PolarHBondContact O-N 3.3Å; I302-F305 PolarHBondContact O-N 2.89Å; I302-F306 HydrophobicContact CG2-CD2 3.76Å; I302-F306 HydrophobicContact CG2-CE2 4.19Å; I302-F306 WeakPolarHBondContact O-CD2 3.35Å; I302-F306 PolarHBondContact O-N 3.43Å
303	Y	94.1	Very high	93.8	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62.6	-44.7	178.5	-56.7	-36.3	0	0	0	112.4	N51 F55 L69 M246 I250 N299 I300 F305 S307 Y310	N51-Y303 HydrophobicContact CB-CE2 4.4Å; N51-Y303 WeakPolarHBondContact OD1-CD2 3.46Å; F55-Y303 AromaticContact CE2-CD2 3.86Å; F55-Y303 HydrophobicContact CE2-CD2 3.86Å; F55-Y303 HydrophobicContact CE2-CE1 4.38Å; F55-Y303 AromaticContact CE2-CE2 3.55Å; F55-Y303 HydrophobicContact CE2-CE2 3.55Å; F55-Y303 HydrophobicContact CE2-CG 4.45Å; F55-Y303 AromaticContact CE2-CZ 3.85Å; F55-Y303 AromaticContact CZ-CD1 3.89Å; F55-Y303 HydrophobicContact CZ-CD1 3.89Å; F55-Y303 AromaticContact CZ-CD2 3.7Å; F55-Y303 HydrophobicContact CZ-CD2 3.7Å; F55-Y303 AromaticContact CZ-CE1 3.83Å; F55-Y303 HydrophobicContact CZ-CE1 3.83Å; F55-Y303 AromaticContact CZ-CE2 3.7Å; F55-Y303 HydrophobicContact CZ-CE2 3.7Å; F55-Y303 AromaticContact CZ-CG 3.82Å; F55-Y303 HydrophobicContact CZ-CG 3.82Å; F55-Y303 AromaticContact CZ-CZ 3.78Å; L69-Y303 HydrophobicContact CD1-CE1 4.15Å; L69-Y303 HydrophobicContact CD2-CE1 4.14Å; M246-Y303 HydrophobicContact CE-CD1 4.22Å; M246-Y303 HydrophobicContact CE-CE1 4.31Å; M246-Y303 HydrophobicContact CG-CD1 3.92Å; M246-Y303 HydrophobicContact CG-CE1 4.46Å; M246-Y303 HydrophobicContact SD-CD1 3.57Å; M246-Y303 VanDerWaalsContact SD-CD1 3.57Å; M246-Y303 HydrophobicContact SD-CE1 4.23Å; I250-Y303 HydrophobicContact CD1-CD1 4.43Å; I250-Y303 HydrophobicContact CD1-CE1 3.51Å; I250-Y303 HydrophobicContact CG1-CE1 4.41Å; N299-Y303 HydrophobicContact CB-CD2 4.47Å; N299-Y303 HydrophobicContact CB-CE2 3.7Å; N299-Y303 WeakPolarHBondContact O-CD2 3.04Å; N299-Y303 PolarHBondContact O-N 2.68Å; I300-Y303 PolarHBondContact O-N 3.13Å; Y303-F305 VanDerWaalsContact C-N 3.32Å; Y303-F305 PolarHBondContact O-N 3.4Å; Y303-S307 WeakPolarHBondContact O-CA 3.3Å; Y303-S307 VanDerWaalsContact O-CB 3.31Å; Y303-S307 WeakPolarHBondContact O-CB 3.37Å; Y303-S307 PolarHBondContact O-N 3.42Å; Y303-Y310 AromaticContact CD2-CE2 3.93Å; Y303-Y310 HydrophobicContact CD2-CE2 3.93Å; Y303-Y310 HydrophobicContact CG-CD2 4.33Å; Y303-Y310 HydrophobicContact CG-CE2 4.15Å
304	C	93.2	Very high	93.6	Very high	49 Å²	49	42.9 Å²	42.9	33%	0.331	21%	0.207	S	C	.	.	H	α-helix	trans	-60.5	-41	175.5	-80.9	0	0	0	0	112.2	I300 F301 I302 R311	I300-C304 WeakPolarHBondContact O-CB 3.2Å; I300-C304 PolarHBondContact O-N 2.59Å; I300-C304 PolarHBondContact O-SG 3.44Å; I300-C304 VanDerWaalsContact O-SG 3.41Å; F301-C304 PolarHBondContact O-N 2.96Å; I302-C304 PolarHBondContact O-N 3.3Å; C304-R311 WeakPolarHBondContact O-CD 3.3Å; C304-R311 VanDerWaalsContact O-CG 3.24Å; C304-R311 WeakPolarHBondContact O-CG 3.43Å; C304-R311 PolarHBondContact O-NE 3.4Å
305	F	91.7	Very high	93.4	Very high	153 Å²	153	45.8 Å²	45.8	67%	0.671	22%	0.217	S	C	*	.	H	α-helix	trans	-71	-49.5	-177.4	-168.4	-96.1	0	0	0	112	F301 I302 Y303	F301-F305 WeakPolarHBondContact O-CB 3Å; F301-F305 PolarHBondContact O-N 3.29Å; I302-F305 PolarHBondContact O-N 2.89Å; Y303-F305 VanDerWaalsContact C-N 3.32Å; Y303-F305 PolarHBondContact O-N 3.4Å
306	F	88.1	Confident	93.1	Very high	51 Å²	51	45.5 Å²	45.5	22%	0.224	22%	0.216	C	C	.	.	H	α-helix	trans	-94.2	-30.1	-170.4	-68	-74.6	0	0	0	114.4	K242 L245 M246 A249 I302	K242-F306 WeakPolarHBondContact CB-O 3.45Å; L245-F306 HydrophobicContact CB-CD1 3.69Å; L245-F306 HydrophobicContact CB-CE1 3.82Å; L245-F306 HydrophobicContact CB-CG 4.48Å; L245-F306 HydrophobicContact CD1-CE1 4.49Å; M246-F306 HydrophobicContact CB-CB 3.58Å; M246-F306 HydrophobicContact CB-CD2 4.49Å; M246-F306 HydrophobicContact CB-CG 4.23Å; M246-F306 HydrophobicContact CG-CB 4.03Å; A249-F306 HydrophobicContact CB-CD2 4.24Å; A249-F306 HydrophobicContact CB-CE2 3.59Å; A249-F306 HydrophobicContact CB-CZ 4.23Å; I302-F306 HydrophobicContact CG2-CD2 3.76Å; I302-F306 HydrophobicContact CG2-CE2 4.19Å; I302-F306 WeakPolarHBondContact O-CD2 3.35Å; I302-F306 PolarHBondContact O-N 3.43Å
307	S	88.7	Confident	92.8	Very high	13 Å²	13	48.9 Å²	48.9	9%	0.091	23%	0.228	C	C	.	.			trans	-100.1	108.9	-172.4	-178.5	0	0	0	0	113.3	Y303 Y310 R311	Y303-S307 WeakPolarHBondContact O-CA 3.3Å; Y303-S307 VanDerWaalsContact O-CB 3.31Å; Y303-S307 WeakPolarHBondContact O-CB 3.37Å; Y303-S307 PolarHBondContact O-N 3.42Å; S307-Y310 VanDerWaalsContact CB-CB 3.48Å; S307-Y310 PolarHBondContact O-N 3.11Å; S307-Y310 VanDerWaalsContact OG-CB 3.25Å; S307-Y310 WeakPolarHBondContact OG-CB 3.18Å; S307-Y310 PolarHBondContact OG-N 3.3Å; S307-Y310 VanDerWaalsContact OG-N 3.14Å; S307-R311 PolarHBondContact O-N 3.42Å; S307-R311 VanDerWaalsContact O-N 3.08Å
308	I	87.9	Confident	92.4	Very high	81 Å²	81	54.5 Å²	54.5	42%	0.415	25%	0.252	S	S	.	.	H	α-helix	trans	-63.6	-43.2	174.3	-58.6	174	0	0	0	110.6	K242 Y310 R311 I312	K242-I308 HydrophobicContact CD-CD1 4.09Å; K242-I308 HydrophobicContact CD-CG1 4.4Å; I308-Y310 VanDerWaalsContact C-N 3.32Å; I308-Y310 PolarHBondContact O-N 3.19Å; I308-R311 PolarHBondContact O-N 3.39Å; I308-I312 HydrophobicContact CG2-CD1 3.91Å; I308-I312 HydrophobicContact CG2-CG1 4.46Å; I308-I312 WeakPolarHBondContact O-CG1 3.42Å; I308-I312 PolarHBondContact O-N 3.19Å
309	K	89	Confident	92.1	Very high	124 Å²	124	56.9 Å²	56.9	54%	0.539	26%	0.26	S	S	.	.	H	α-helix	trans	-62.4	-41.9	179.6	-64.2	-175.2	179.8	179.1	0	111.1	M60 I312 V313	M60-K309 HydrophobicContact SD-CB 3.44Å; M60-K309 WeakPolarHBondContact SD-CB 3.5Å; K309-I312 PolarHBondContact O-N 3.26Å; K309-V313 WeakPolarHBondContact O-CG2 3.05Å; K309-V313 PolarHBondContact O-N 2.95Å; K309-V313 VanDerWaalsContact O-N 3.13Å
310	Y	92.3	Very high	91.7	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-58.5	-52.4	174.4	-175.3	-87.6	0	0	0	110.8	N51 V54 F55 M60 I300 Y303 S307 I308 I312 V313 C314	N51-Y310 PolarHBondContact OD1-OH 3.04Å; V54-Y310 HydrophobicContact CB-CD2 4.2Å; V54-Y310 HydrophobicContact CB-CE2 3.86Å; V54-Y310 HydrophobicContact CG1-CD2 3.32Å; V54-Y310 HydrophobicContact CG1-CE2 3.5Å; V54-Y310 HydrophobicContact CG1-CG 3.96Å; V54-Y310 HydrophobicContact CG2-CE2 4.37Å; F55-Y310 AromaticContact CE1-CD2 3.88Å; F55-Y310 HydrophobicContact CE1-CD2 3.88Å; F55-Y310 HydrophobicContact CE1-CE2 4.34Å; F55-Y310 HydrophobicContact CE2-CE2 4.18Å; F55-Y310 AromaticContact CZ-CD2 3.85Å; F55-Y310 HydrophobicContact CZ-CD2 3.85Å; F55-Y310 AromaticContact CZ-CE2 3.92Å; F55-Y310 HydrophobicContact CZ-CE2 3.92Å; M60-Y310 HydrophobicContact CE-CD2 4.37Å; I300-Y310 HydrophobicContact CG1-CE1 4.47Å; I300-Y310 WeakPolarHBondContact CG1-OH 3.44Å; Y303-Y310 AromaticContact CD2-CE2 3.93Å; Y303-Y310 HydrophobicContact CD2-CE2 3.93Å; Y303-Y310 HydrophobicContact CG-CD2 4.33Å; Y303-Y310 HydrophobicContact CG-CE2 4.15Å; S307-Y310 VanDerWaalsContact CB-CB 3.48Å; S307-Y310 PolarHBondContact O-N 3.11Å; S307-Y310 VanDerWaalsContact OG-CB 3.25Å; S307-Y310 WeakPolarHBondContact OG-CB 3.18Å; S307-Y310 PolarHBondContact OG-N 3.3Å; S307-Y310 VanDerWaalsContact OG-N 3.14Å; I308-Y310 VanDerWaalsContact C-N 3.32Å; I308-Y310 PolarHBondContact O-N 3.19Å; Y310-I312 VanDerWaalsContact C-N 3.32Å; Y310-I312 PolarHBondContact O-N 3.16Å; Y310-V313 PolarHBondContact O-N 2.9Å; Y310-V313 VanDerWaalsContact O-N 3.14Å; Y310-C314 VanDerWaalsContact CD1-SG 3.52Å; Y310-C314 WeakPolarHBondContact CE1-SG 3.29Å; Y310-C314 VanDerWaalsContact CZ-SG 3.51Å; Y310-C314 PolarHBondContact O-N 2.94Å; Y310-C314 PolarHBondContact O-SG 3.43Å
311	R	93.3	Very high	91.3	Very high	105 Å²	105	67.2 Å²	67.2	40%	0.396	31%	0.306	S	S	.	.	H	α-helix	trans	-56.7	-41.2	178	-76.5	-172	-76	-178	-4.1	113.8	C304 S307 I308 K315	C304-R311 WeakPolarHBondContact O-CD 3.3Å; C304-R311 VanDerWaalsContact O-CG 3.24Å; C304-R311 WeakPolarHBondContact O-CG 3.43Å; C304-R311 PolarHBondContact O-NE 3.4Å; S307-R311 PolarHBondContact O-N 3.42Å; S307-R311 VanDerWaalsContact O-N 3.08Å; I308-R311 PolarHBondContact O-N 3.39Å; R311-K315 WeakPolarHBondContact O-CB 3.31Å; R311-K315 VanDerWaalsContact O-CG 3.3Å; R311-K315 WeakPolarHBondContact O-CG 3.35Å; R311-K315 PolarHBondContact O-N 3.12Å
312	I	92	Very high	90.9	Very high	36 Å²	36	66.9 Å²	66.9	19%	0.185	31%	0.309	C	S	.	.	H	α-helix	trans	-61.3	-49.4	177.7	-70.8	166	0	0	0	109.9	I308 K309 Y310 K315 Q316 L334 V338	I308-I312 HydrophobicContact CG2-CD1 3.91Å; I308-I312 HydrophobicContact CG2-CG1 4.46Å; I308-I312 WeakPolarHBondContact O-CG1 3.42Å; I308-I312 PolarHBondContact O-N 3.19Å; K309-I312 PolarHBondContact O-N 3.26Å; Y310-I312 VanDerWaalsContact C-N 3.32Å; Y310-I312 PolarHBondContact O-N 3.16Å; I312-K315 PolarHBondContact O-N 3.35Å; I312-Q316 WeakPolarHBondContact O-CG 3.37Å; I312-Q316 PolarHBondContact O-N 2.61Å; I312-L334 HydrophobicContact CG2-CD2 4.25Å; I312-L334 HydrophobicContact CG2-CG 4.22Å; I312-V338 HydrophobicContact CD1-CG2 3.95Å; I312-V338 HydrophobicContact CG2-CG2 4.08Å
313	V	92.8	Very high	90.2	Very high	1 Å²	1	67.5 Å²	67.5	1%	0.006	32%	0.321	C	S	.	.	H	α-helix	trans	-66.7	-41.6	-179.1	174.8	0	0	0	0	111.1	V54 H57 R59 M60 K309 Y310 K315 Q316 Y317	V54-V313 HydrophobicContact CB-CG1 4.27Å; V54-V313 HydrophobicContact CG1-CB 4.02Å; V54-V313 HydrophobicContact CG1-CG1 3.82Å; V54-V313 HydrophobicContact CG2-CG1 4.3Å; H57-V313 HydrophobicContact CB-CG1 3.67Å; H57-V313 HydrophobicContact CB-CG2 4.48Å; R59-V313 HydrophobicContact CB-CG2 4.27Å; M60-V313 HydrophobicContact CG-CG2 4.13Å; K309-V313 WeakPolarHBondContact O-CG2 3.05Å; K309-V313 PolarHBondContact O-N 2.95Å; K309-V313 VanDerWaalsContact O-N 3.13Å; Y310-V313 PolarHBondContact O-N 2.9Å; Y310-V313 VanDerWaalsContact O-N 3.14Å; V313-K315 PolarHBondContact O-N 3.05Å; V313-Q316 WeakPolarHBondContact O-CB 3.34Å; V313-Q316 PolarHBondContact O-N 2.99Å; V313-Q316 VanDerWaalsContact O-N 3.13Å; V313-Y317 HydrophobicContact CG1-CD2 3.71Å; V313-Y317 HydrophobicContact CG1-CE2 3.46Å; V313-Y317 VanDerWaalsContact CG1-CE2 3.46Å; V313-Y317 VanDerWaalsContact O-CD2 3.27Å; V313-Y317 WeakPolarHBondContact O-CD2 3.42Å; V313-Y317 PolarHBondContact O-N 2.85Å
314	C	93.7	Very high	89.8	Confident	26 Å²	26	69.5 Å²	69.5	18%	0.176	34%	0.341	C	S	.	.	H	α-helix	trans	-58.2	-46	173.7	-68.9	0	0	0	0	112.1	V54 Y310 Q316 Y317 F318	V54-C314 WeakPolarHBondContact CG2-SG 3.4Å; Y310-C314 VanDerWaalsContact CD1-SG 3.52Å; Y310-C314 WeakPolarHBondContact CE1-SG 3.29Å; Y310-C314 VanDerWaalsContact CZ-SG 3.51Å; Y310-C314 PolarHBondContact O-N 2.94Å; Y310-C314 PolarHBondContact O-SG 3.43Å; C314-Q316 VanDerWaalsContact C-N 3.29Å; C314-Q316 PolarHBondContact O-N 3.45Å; C314-Y317 PolarHBondContact O-N 3.28Å; C314-F318 WeakPolarHBondContact O-CB 3.16Å; C314-F318 PolarHBondContact O-N 3.09Å
315	K	92.3	Very high	89.5	Confident	121 Å²	121	76 Å²	76	53%	0.526	36%	0.364	S	S	.	.	H	α-helix	trans	-60	-39.1	175.1	-76.1	179.4	177.9	-170.2	0	111.9	R311 I312 V313 F318 F319 L334	R311-K315 WeakPolarHBondContact O-CB 3.31Å; R311-K315 VanDerWaalsContact O-CG 3.3Å; R311-K315 WeakPolarHBondContact O-CG 3.35Å; R311-K315 PolarHBondContact O-N 3.12Å; I312-K315 PolarHBondContact O-N 3.35Å; V313-K315 PolarHBondContact O-N 3.05Å; K315-F318 PolarHBondContact O-N 3.32Å; K315-F319 HydrophobicContact CB-CE2 4.29Å; K315-F319 WeakPolarHBondContact O-CB 3.3Å; K315-F319 WeakPolarHBondContact O-CD2 3.37Å; K315-F319 WeakPolarHBondContact O-CG 3.37Å; K315-F319 PolarHBondContact O-N 3.38Å; K315-L334 HydrophobicContact CB-CD2 4.04Å
316	Q	90.5	Very high	89.3	Confident	3 Å²	3	75.7 Å²	75.7	1%	0.014	36%	0.362	C	S	.	.	H	α-helix	trans	-62.7	-44.7	175.4	-70.2	175	-19.6	0	0	112.2	I312 V313 C314 R320 A331 L334 T335	I312-Q316 WeakPolarHBondContact O-CG 3.37Å; I312-Q316 PolarHBondContact O-N 2.61Å; V313-Q316 WeakPolarHBondContact O-CB 3.34Å; V313-Q316 PolarHBondContact O-N 2.99Å; V313-Q316 VanDerWaalsContact O-N 3.13Å; C314-Q316 VanDerWaalsContact C-N 3.29Å; C314-Q316 PolarHBondContact O-N 3.45Å; Q316-R320 WeakPolarHBondContact O-CB 2.92Å; Q316-R320 VanDerWaalsContact O-CG 3.23Å; Q316-R320 WeakPolarHBondContact O-CG 3.13Å; Q316-R320 PolarHBondContact O-N 2.96Å; Q316-A331 HydrophobicContact CB-CB 4.44Å; Q316-L334 HydrophobicContact CG-CD2 3.89Å; Q316-L334 HydrophobicContact CG-CG 4.38Å; Q316-T335 PolarHBondContact NE2-OG1 3.08Å
317	Y	90.7	Very high	89.2	Confident	72 Å²	72	73.3 Å²	73.3	28%	0.282	35%	0.352	S	S	.	.	H	α-helix	trans	-63.8	-46.3	175	-79.6	-68.7	0	0	0	111.7	S53 V54 H57 V313 C314 F319 R320 I321	S53-Y317 PolarHBondContact O-OH 3.22Å; V54-Y317 HydrophobicContact CG2-CD2 4.12Å; V54-Y317 HydrophobicContact CG2-CE2 4.36Å; H57-Y317 HydrophobicContact CB-CE2 4.45Å; V313-Y317 HydrophobicContact CG1-CD2 3.71Å; V313-Y317 HydrophobicContact CG1-CE2 3.46Å; V313-Y317 VanDerWaalsContact CG1-CE2 3.46Å; V313-Y317 VanDerWaalsContact O-CD2 3.27Å; V313-Y317 WeakPolarHBondContact O-CD2 3.42Å; V313-Y317 PolarHBondContact O-N 2.85Å; C314-Y317 PolarHBondContact O-N 3.28Å; Y317-F319 PolarHBondContact O-N 3.12Å; Y317-R320 PolarHBondContact O-N 3.48Å; Y317-R320 VanDerWaalsContact O-N 3.14Å; Y317-I321 WeakPolarHBondContact O-CB 3.43Å; Y317-I321 VanDerWaalsContact O-CG1 3.3Å; Y317-I321 WeakPolarHBondContact O-CG1 3.25Å; Y317-I321 PolarHBondContact O-N 2.95Å
318	F	90.4	Very high	89.1	Confident	123 Å²	123	80.2 Å²	80.2	54%	0.539	38%	0.376	S	S	.	.	H	α-helix	trans	-55.9	-49.7	176.8	-176.9	-91.2	0	0	0	111.8	C314 K315 R320 I321 L322	C314-F318 WeakPolarHBondContact O-CB 3.16Å; C314-F318 PolarHBondContact O-N 3.09Å; K315-F318 PolarHBondContact O-N 3.32Å; F318-R320 VanDerWaalsContact C-N 3.34Å; F318-R320 PolarHBondContact O-N 3.24Å; F318-I321 PolarHBondContact O-N 3.41Å; F318-L322 HydrophobicContact CD1-CD1 4.42Å; F318-L322 HydrophobicContact CD2-CD1 3.63Å; F318-L322 HydrophobicContact CE1-CD1 4.02Å; F318-L322 HydrophobicContact CE2-CD1 3.17Å; F318-L322 HydrophobicContact CG-CD1 4.25Å; F318-L322 HydrophobicContact CZ-CD1 3.38Å; F318-L322 PolarHBondContact O-N 3.3Å
319	F	90.6	Very high	89.1	Confident	64 Å²	64	80.6 Å²	80.6	28%	0.281	38%	0.379	S	S	.	.	H	α-helix	trans	-63.3	-37.3	176.9	-67.4	-35	0	0	0	112.9	K315 Y317 G323 G327 N330 A331 L334	K315-F319 HydrophobicContact CB-CE2 4.29Å; K315-F319 WeakPolarHBondContact O-CB 3.3Å; K315-F319 WeakPolarHBondContact O-CD2 3.37Å; K315-F319 WeakPolarHBondContact O-CG 3.37Å; K315-F319 PolarHBondContact O-N 3.38Å; Y317-F319 PolarHBondContact O-N 3.12Å; F319-G323 WeakPolarHBondContact O-CA 3.41Å; F319-G323 PolarHBondContact O-N 2.55Å; F319-G327 WeakPolarHBondContact CB-O 3.31Å; F319-G327 CarbonylContact O-C 3.57Å; F319-G327 VanDerWaalsContact O-CA 3.27Å; F319-G327 WeakPolarHBondContact O-CA 3.41Å; F319-N330 HydrophobicContact CD2-CB 4.1Å; F319-N330 HydrophobicContact CE2-CB 4.37Å; F319-N330 HydrophobicContact CG-CB 4.34Å; F319-A331 HydrophobicContact CB-CB 4.22Å; F319-L334 HydrophobicContact CE2-CD2 4.39Å
320	R	87.7	Confident	89.1	Confident	113 Å²	113	76.5 Å²	76.5	43%	0.426	36%	0.363	S	S	.	.	H	α-helix	trans	-69.3	-35.3	178.1	-76.5	176.4	-179.6	-168.2	3.2	113.2	Q316 Y317 F318 R328 A331	Q316-R320 WeakPolarHBondContact O-CB 2.92Å; Q316-R320 VanDerWaalsContact O-CG 3.23Å; Q316-R320 WeakPolarHBondContact O-CG 3.13Å; Q316-R320 PolarHBondContact O-N 2.96Å; Y317-R320 PolarHBondContact O-N 3.48Å; Y317-R320 VanDerWaalsContact O-N 3.14Å; F318-R320 VanDerWaalsContact C-N 3.34Å; F318-R320 PolarHBondContact O-N 3.24Å; R320-R328 HydrophobicContact CG-CG 4.49Å; R320-A331 HydrophobicContact CG-CB 3.91Å
321	I	88.3	Confident	88.7	Confident	130 Å²	130	76.5 Å²	76.5	67%	0.667	36%	0.363	S	S	*	.	H	α-helix	trans	-81.4	-50.2	-177.4	-66	168.3	0	0	0	110.4	Y317 F318	Y317-I321 WeakPolarHBondContact O-CB 3.43Å; Y317-I321 VanDerWaalsContact O-CG1 3.3Å; Y317-I321 WeakPolarHBondContact O-CG1 3.25Å; Y317-I321 PolarHBondContact O-N 2.95Å; F318-I321 PolarHBondContact O-N 3.41Å
322	L	87	Confident	88.4	Confident	120 Å²	120	79.8 Å²	79.8	63%	0.628	38%	0.375	S	S	*	.	H	α-helix	trans	-95.4	-26.2	-171.3	-65.5	174	0	0	0	114.3	F318 G324	F318-L322 HydrophobicContact CD1-CD1 4.42Å; F318-L322 HydrophobicContact CD2-CD1 3.63Å; F318-L322 HydrophobicContact CE1-CD1 4.02Å; F318-L322 HydrophobicContact CE2-CD1 3.17Å; F318-L322 HydrophobicContact CG-CD1 4.25Å; F318-L322 HydrophobicContact CZ-CD1 3.38Å; F318-L322 PolarHBondContact O-N 3.3Å; L322-G324 PolarHBondContact O-N 2.86Å
323	G	80.7	Confident	88.2	Confident	33 Å²	33	83.3 Å²	83.3	34%	0.34	39%	0.391	S	S	.	.	S	Bend	trans	-89.6	3.3	-170	0	0	0	0	0	115.6	F319 F326 G327	F319-G323 WeakPolarHBondContact O-CA 3.41Å; F319-G323 PolarHBondContact O-N 2.55Å; G323-F326 PolarHBondContact O-N 3.17Å; G323-G327 PolarHBondContact O-N 2.92Å
324	G	85.9	Confident	87.9	Confident	41 Å²	41	85.1 Å²	85.1	42%	0.423	40%	0.4	S	S	.	.	H	α-helix	trans	55.6	-139.3	-178.8	0	0	0	0	0	113.2	L322 R328	L322-G324 PolarHBondContact O-N 2.86Å; G324-R328 WeakPolarHBondContact O-CG 3.02Å; G324-R328 PolarHBondContact O-N 2.86Å; G324-R328 VanDerWaalsContact O-N 3.16Å
325	K	86.3	Confident	87.5	Confident	187 Å²	187	85.2 Å²	85.2	81%	0.813	40%	0.4	S	S	*	.	H	α-helix	trans	-61.8	-42.7	177.2	-72.5	-174.2	-178.6	178.1	0	112.2	R328 L329	K325-R328 PolarHBondContact O-N 3.18Å; K325-L329 PolarHBondContact O-N 2.77Å
326	F	88.1	Confident	87.2	Confident	145 Å²	145	83.3 Å²	83.3	64%	0.636	40%	0.399	S	S	*	.	H	α-helix	trans	-66.6	-43.8	-178.5	-173.4	-107.5	0	0	0	112.1	G323 R328 L329 N330	G323-F326 PolarHBondContact O-N 3.17Å; F326-R328 VanDerWaalsContact C-N 3.31Å; F326-R328 PolarHBondContact O-N 2.03Å; F326-L329 WeakPolarHBondContact O-CB 3.25Å; F326-L329 PolarHBondContact O-N 3.45Å; F326-L329 VanDerWaalsContact O-N 3.09Å; F326-N330 WeakPolarHBondContact CE1-ND2 3.38Å; F326-N330 PolarHBondContact O-N 3.36Å
327	G	85.7	Confident	87.1	Confident	1 Å²	1	88.4 Å²	88.4	1%	0.01	43%	0.425	C	S	.	.	H	α-helix	trans	-63.3	-34.2	174.6	0	0	0	0	0	113.4	F319 G323 L329 N330 A331	F319-G327 WeakPolarHBondContact CB-O 3.31Å; F319-G327 CarbonylContact O-C 3.57Å; F319-G327 VanDerWaalsContact O-CA 3.27Å; F319-G327 WeakPolarHBondContact O-CA 3.41Å; G323-G327 PolarHBondContact O-N 2.92Å; G327-L329 VanDerWaalsContact C-N 3.31Å; G327-L329 PolarHBondContact O-N 2.99Å; G327-N330 PolarHBondContact O-N 3.29Å; G327-A331 WeakPolarHBondContact O-CB 3.1Å; G327-A331 PolarHBondContact O-N 2.86Å
328	R	85.6	Confident	86.7	Confident	158 Å²	158	87.1 Å²	87.1	60%	0.596	43%	0.425	S	S	*	.	H	α-helix	trans	-64.3	-35.9	172.3	-72	175.4	-175.1	-173.4	2.6	112.3	R320 G324 K325 F326 R332	R320-R328 HydrophobicContact CG-CG 4.49Å; G324-R328 WeakPolarHBondContact O-CG 3.02Å; G324-R328 PolarHBondContact O-N 2.86Å; G324-R328 VanDerWaalsContact O-N 3.16Å; K325-R328 PolarHBondContact O-N 3.18Å; F326-R328 VanDerWaalsContact C-N 3.31Å; F326-R328 PolarHBondContact O-N 2.03Å; R328-R332 WeakPolarHBondContact O-CG 3.35Å; R328-R332 PolarHBondContact O-N 3.38Å
329	L	87.8	Confident	86.4	Confident	89 Å²	89	85.5 Å²	85.5	47%	0.466	42%	0.419	S	S	.	.	H	α-helix	trans	-65.1	-51.6	172.3	-68.9	164.8	0	0	0	110.5	K325 F326 G327 A331 R332 E333	K325-L329 PolarHBondContact O-N 2.77Å; F326-L329 WeakPolarHBondContact O-CB 3.25Å; F326-L329 PolarHBondContact O-N 3.45Å; F326-L329 VanDerWaalsContact O-N 3.09Å; G327-L329 VanDerWaalsContact C-N 3.31Å; G327-L329 PolarHBondContact O-N 2.99Å; L329-A331 VanDerWaalsContact C-N 3.25Å; L329-A331 PolarHBondContact O-N 3.23Å; L329-R332 CarbonylContact O-C 3.59Å; L329-R332 WeakPolarHBondContact O-CA 3.49Å; L329-R332 WeakPolarHBondContact O-CB 3.45Å; L329-R332 PolarHBondContact O-N 3.23Å; L329-E333 PolarHBondContact O-N 3.3Å
330	N	88.4	Confident	86.1	Confident	38 Å²	38	84.7 Å²	84.7	20%	0.203	42%	0.421	C	S	.	.	H	α-helix	trans	-57.2	-37.6	177.6	-65.6	-9.5	0	0	0	112.6	F319 F326 G327 E333 L334	F319-N330 HydrophobicContact CD2-CB 4.1Å; F319-N330 HydrophobicContact CE2-CB 4.37Å; F319-N330 HydrophobicContact CG-CB 4.34Å; F326-N330 WeakPolarHBondContact CE1-ND2 3.38Å; F326-N330 PolarHBondContact O-N 3.36Å; G327-N330 PolarHBondContact O-N 3.29Å; N330-E333 PolarHBondContact O-N 2.93Å; N330-L334 WeakPolarHBondContact O-CB 3.49Å; N330-L334 PolarHBondContact O-N 2.82Å
331	A	85.5	Confident	85.8	Confident	0 Å²	0	88.2 Å²	88.2	0%	0	44%	0.435	C	S	.	.	H	α-helix	trans	-66.7	-36.7	175.5	0	0	0	0	0	112.5	Q316 F319 R320 G327 L329 T335	Q316-A331 HydrophobicContact CB-CB 4.44Å; F319-A331 HydrophobicContact CB-CB 4.22Å; R320-A331 HydrophobicContact CG-CB 3.91Å; G327-A331 WeakPolarHBondContact O-CB 3.1Å; G327-A331 PolarHBondContact O-N 2.86Å; L329-A331 VanDerWaalsContact C-N 3.25Å; L329-A331 PolarHBondContact O-N 3.23Å; A331-T335 WeakPolarHBondContact O-CB 3.39Å; A331-T335 PolarHBondContact O-N 3.17Å; A331-T335 VanDerWaalsContact O-N 3.1Å; A331-T335 PolarHBondContact O-OG1 2.89Å
332	R	86.3	Confident	85.2	Confident	174 Å²	174	89.6 Å²	89.6	66%	0.657	43%	0.433	S	S	*	.	H	α-helix	trans	-69.8	-43.6	174.5	-73.1	174.8	179.1	-173.8	-0.8	111	R328 L329 L334 T335 T336	R328-R332 WeakPolarHBondContact O-CG 3.35Å; R328-R332 PolarHBondContact O-N 3.38Å; L329-R332 CarbonylContact O-C 3.59Å; L329-R332 WeakPolarHBondContact O-CA 3.49Å; L329-R332 WeakPolarHBondContact O-CB 3.45Å; L329-R332 PolarHBondContact O-N 3.23Å; R332-L334 PolarHBondContact O-N 3.06Å; R332-T335 WeakPolarHBondContact O-CA 3.22Å; R332-T335 WeakPolarHBondContact O-CB 3.46Å; R332-T335 PolarHBondContact O-N 3.23Å; R332-T336 PolarHBondContact O-N 2.88Å; R332-T336 PolarHBondContact O-OG1 3.32Å
333	E	88.1	Confident	84.9	Confident	111 Å²	111	88 Å²	88	52%	0.519	43%	0.425	S	S	.	.	H	α-helix	trans	-61.4	-44.2	175.2	-70.2	176.8	179.1	0	0	112	L329 N330 T335 T336 L337	L329-E333 PolarHBondContact O-N 3.3Å; N330-E333 PolarHBondContact O-N 2.93Å; E333-T335 PolarHBondContact O-N 2.88Å; E333-T336 WeakPolarHBondContact CA-OG1 3.4Å; E333-T336 PolarHBondContact O-N 2.86Å; E333-T336 PolarHBondContact O-OG1 3.14Å; E333-L337 WeakPolarHBondContact O-CB 3.18Å; E333-L337 VanDerWaalsContact O-CG 3.24Å; E333-L337 WeakPolarHBondContact O-CG 3.19Å; E333-L337 PolarHBondContact O-N 3.18Å
334	L	86.8	Confident	84.9	Confident	38 Å²	38	93.8 Å²	93.8	20%	0.199	44%	0.436	C	S	.	.	H	α-helix	trans	-62.3	-29.2	173.2	-176.8	59.6	0	0	0	111.8	I312 K315 Q316 F319 N330 R332 V338	I312-L334 HydrophobicContact CG2-CD2 4.25Å; I312-L334 HydrophobicContact CG2-CG 4.22Å; K315-L334 HydrophobicContact CB-CD2 4.04Å; Q316-L334 HydrophobicContact CG-CD2 3.89Å; Q316-L334 HydrophobicContact CG-CG 4.38Å; F319-L334 HydrophobicContact CE2-CD2 4.39Å; N330-L334 WeakPolarHBondContact O-CB 3.49Å; N330-L334 PolarHBondContact O-N 2.82Å; R332-L334 PolarHBondContact O-N 3.06Å; L334-V338 HydrophobicContact CD1-CG2 4.31Å; L334-V338 WeakPolarHBondContact O-CB 3.26Å; L334-V338 WeakPolarHBondContact O-CG2 3.43Å; L334-V338 PolarHBondContact O-N 3.04Å
335	T	85	Confident	84.4	Confident	29 Å²	29	97.6 Å²	97.6	18%	0.178	44%	0.443	C	S	.	.	H	α-helix	trans	-67.6	-52.7	175.1	-59	0	0	0	0	110.2	R59 Q316 A331 R332 E333 V338 E339	R59-T335 PolarHBondContact NH2-O 2.95Å; Q316-T335 PolarHBondContact NE2-OG1 3.08Å; A331-T335 WeakPolarHBondContact O-CB 3.39Å; A331-T335 PolarHBondContact O-N 3.17Å; A331-T335 VanDerWaalsContact O-N 3.1Å; A331-T335 PolarHBondContact O-OG1 2.89Å; R332-T335 WeakPolarHBondContact O-CA 3.22Å; R332-T335 WeakPolarHBondContact O-CB 3.46Å; R332-T335 PolarHBondContact O-N 3.23Å; E333-T335 PolarHBondContact O-N 2.88Å; T335-V338 PolarHBondContact O-N 3.41Å; T335-E339 VanDerWaalsContact CG2-OE1 3.31Å; T335-E339 WeakPolarHBondContact CG2-OE1 3.41Å; T335-E339 PolarHBondContact O-N 2.82Å; T335-E339 VanDerWaalsContact O-N 3.09Å
336	T	86.4	Confident	83.9	Confident	81 Å²	81	96.1 Å²	96.1	50%	0.497	43%	0.432	S	S	.	.	H	α-helix	trans	-66.3	-38.1	-178.7	57.3	0	0	0	0	112.8	R332 E333 V338 E339 S340	R332-T336 PolarHBondContact O-N 2.88Å; R332-T336 PolarHBondContact O-OG1 3.32Å; E333-T336 WeakPolarHBondContact CA-OG1 3.4Å; E333-T336 PolarHBondContact O-N 2.86Å; E333-T336 PolarHBondContact O-OG1 3.14Å; T336-V338 VanDerWaalsContact C-N 3.31Å; T336-V338 PolarHBondContact O-N 3.01Å; T336-E339 PolarHBondContact O-N 2.98Å; T336-S340 WeakPolarHBondContact O-CB 3.26Å; T336-S340 PolarHBondContact O-N 2.94Å; T336-S340 PolarHBondContact O-OG 3.2Å
337	L	87	Confident	83.6	Confident	109 Å²	109	95.4 Å²	95.4	57%	0.571	43%	0.43	S	S	*	.	H	α-helix	trans	-62	-37.6	175.8	-74.8	173.3	0	0	0	112.6	E333 S340 R341	E333-L337 WeakPolarHBondContact O-CB 3.18Å; E333-L337 VanDerWaalsContact O-CG 3.24Å; E333-L337 WeakPolarHBondContact O-CG 3.19Å; E333-L337 PolarHBondContact O-N 3.18Å; L337-S340 PolarHBondContact O-OG 3.09Å; L337-R341 WeakPolarHBondContact O-CB 3.18Å; L337-R341 PolarHBondContact O-N 3.27Å
338	V	83.6	Confident	83.3	Confident	45 Å²	45	98.3 Å²	98.3	27%	0.273	45%	0.451	S	S	.	.	H	α-helix	trans	-74.9	-40.9	178.8	171.5	0	0	0	0	111.2	I312 L334 T335 T336 R341 Y342	I312-V338 HydrophobicContact CD1-CG2 3.95Å; I312-V338 HydrophobicContact CG2-CG2 4.08Å; L334-V338 HydrophobicContact CD1-CG2 4.31Å; L334-V338 WeakPolarHBondContact O-CB 3.26Å; L334-V338 WeakPolarHBondContact O-CG2 3.43Å; L334-V338 PolarHBondContact O-N 3.04Å; T335-V338 PolarHBondContact O-N 3.41Å; T336-V338 VanDerWaalsContact C-N 3.31Å; T336-V338 PolarHBondContact O-N 3.01Å; V338-R341 PolarHBondContact O-N 3.21Å; V338-Y342 PolarHBondContact O-N 3.43Å
339	E	83.2	Confident	82.8	Confident	90 Å²	90	95.8 Å²	95.8	42%	0.421	45%	0.453	S	S	.	.	H	α-helix	trans	-63.5	-47.8	176.5	-80.8	156.2	-158.5	0	0	111.4	R59 T335 T336 R341 Y342 D343	R59-E339 IonicContact CZ-OE1 3.83Å; R59-E339 IonicContact NH2-OE1 2.79Å; R59-E339 PolarHBondContact NH2-OE1 3.45Å; T335-E339 VanDerWaalsContact CG2-OE1 3.31Å; T335-E339 WeakPolarHBondContact CG2-OE1 3.41Å; T335-E339 PolarHBondContact O-N 2.82Å; T335-E339 VanDerWaalsContact O-N 3.09Å; T336-E339 PolarHBondContact O-N 2.98Å; E339-R341 VanDerWaalsContact C-N 3.27Å; E339-R341 PolarHBondContact O-N 2.59Å; E339-Y342 CarbonylContact O-C 3.01Å; E339-Y342 WeakPolarHBondContact O-CA 3.05Å; E339-Y342 WeakPolarHBondContact O-CB 3.24Å; E339-Y342 PolarHBondContact O-N 2.92Å; E339-D343 PolarHBondContact O-N 3.31Å
340	S	85.2	Confident	82.2	Confident	46 Å²	46	99.5 Å²	99.5	32%	0.322	47%	0.465	S	S	.	.	H	α-helix	trans	-61.4	-31.4	175.2	62.6	0	0	0	0	113.8	T336 L337 R344	T336-S340 WeakPolarHBondContact O-CB 3.26Å; T336-S340 PolarHBondContact O-N 2.94Å; T336-S340 PolarHBondContact O-OG 3.2Å; L337-S340 PolarHBondContact O-OG 3.09Å; S340-R344 WeakPolarHBondContact O-CB 3.41Å; S340-R344 WeakPolarHBondContact O-CG 3.41Å; S340-R344 PolarHBondContact O-N 3.46Å; S340-R344 PolarHBondContact O-NE 3.27Å; S340-R344 VanDerWaalsContact O-NE 3.13Å
341	R	81.6	Confident	81	Confident	188 Å²	188	108 Å²	108	71%	0.709	50%	0.504	S	S	*	.	H	α-helix	trans	-69.8	-39.1	171.9	-175.2	180	-84	-175.5	-5.3	111.3	L337 V338 E339 H345	L337-R341 WeakPolarHBondContact O-CB 3.18Å; L337-R341 PolarHBondContact O-N 3.27Å; V338-R341 PolarHBondContact O-N 3.21Å; E339-R341 VanDerWaalsContact C-N 3.27Å; E339-R341 PolarHBondContact O-N 2.59Å; R341-H345 PolarHBondContact O-N 2.97Å; R341-H345 VanDerWaalsContact O-N 3.13Å
342	Y	75.5	Confident	80.8	Confident	159 Å²	159	113.5 Å²	113.5	62%	0.624	53%	0.529	S	S	*	.	H	α-helix	trans	-68	-42.4	178.1	-160.1	-94.4	0	0	0	111.9	V338 E339 H345 R346	V338-Y342 PolarHBondContact O-N 3.43Å; E339-Y342 CarbonylContact O-C 3.01Å; E339-Y342 WeakPolarHBondContact O-CA 3.05Å; E339-Y342 WeakPolarHBondContact O-CB 3.24Å; E339-Y342 PolarHBondContact O-N 2.92Å; Y342-H345 PolarHBondContact O-N 3.29Å; Y342-R346 WeakPolarHBondContact O-CB 3.08Å; Y342-R346 PolarHBondContact O-N 2.84Å
343	D	79.9	Confident	80.5	Confident	86 Å²	86	110.3 Å²	110.3	46%	0.46	52%	0.522	S	S	.	.	H	α-helix	trans	-65.2	-43.1	177.8	-70	-28.1	0	0	0	112	E339 H345 R346 Q347	E339-D343 PolarHBondContact O-N 3.31Å; D343-H345 VanDerWaalsContact C-N 3.33Å; D343-H345 PolarHBondContact O-N 3.49Å; D343-R346 PolarHBondContact O-N 2.85Å; D343-Q347 WeakPolarHBondContact O-CG 3.38Å; D343-Q347 PolarHBondContact O-N 2.81Å
344	R	81	Confident	80.1	Confident	155 Å²	155	110.2 Å²	110.2	59%	0.585	52%	0.522	S	S	*	.	H	α-helix	trans	-58.6	-43.3	172.9	-79.2	-177.1	-70.1	-162.8	-1.9	112.3	S340 R346 Q347 S348	S340-R344 WeakPolarHBondContact O-CB 3.41Å; S340-R344 WeakPolarHBondContact O-CG 3.41Å; S340-R344 PolarHBondContact O-N 3.46Å; S340-R344 PolarHBondContact O-NE 3.27Å; S340-R344 VanDerWaalsContact O-NE 3.13Å; R344-R346 VanDerWaalsContact C-N 3.35Å; R344-Q347 PolarHBondContact O-N 3.28Å; R344-S348 PolarHBondContact O-N 3.21Å
345	H	75.1	Confident	79.7	Confident	120 Å²	120	114.5 Å²	114.5	56%	0.556	54%	0.542	S	S	*	.	H	α-helix	trans	-66.5	-37.1	176.8	-170.9	58.5	0	0	0	112.2	R341 Y342 D343 Q347 S348 V349	R341-H345 PolarHBondContact O-N 2.97Å; R341-H345 VanDerWaalsContact O-N 3.13Å; Y342-H345 PolarHBondContact O-N 3.29Å; D343-H345 VanDerWaalsContact C-N 3.33Å; D343-H345 PolarHBondContact O-N 3.49Å; H345-Q347 VanDerWaalsContact C-N 3.31Å; H345-Q347 PolarHBondContact O-N 3.13Å; H345-S348 PolarHBondContact O-N 2.82Å; H345-S348 PolarHBondContact O-OG 2.82Å; H345-V349 WeakPolarHBondContact O-CG2 3.36Å; H345-V349 PolarHBondContact O-N 3.11Å
346	R	75.4	Confident	79.4	Confident	156 Å²	156	119.8 Å²	119.8	59%	0.589	56%	0.564	S	S	*	*	H	α-helix	trans	-67.2	-33	175.9	-166	179.9	-175.2	-169.7	1.1	112.4	Y342 D343 R344 K350	Y342-R346 WeakPolarHBondContact O-CB 3.08Å; Y342-R346 PolarHBondContact O-N 2.84Å; D343-R346 PolarHBondContact O-N 2.85Å; R344-R346 VanDerWaalsContact C-N 3.35Å; R346-K350 WeakPolarHBondContact O-CG 3.39Å
347	Q	81.5	Confident	78.9	Confident	130 Å²	130	122.4 Å²	122.4	61%	0.607	57%	0.569	S	S	*	*	H	α-helix	trans	-70.1	-42	173.3	-73.2	175.6	-13.8	0	0	111.6	D343 R344 H345 V349 K350 Q351	D343-Q347 WeakPolarHBondContact O-CG 3.38Å; D343-Q347 PolarHBondContact O-N 2.81Å; R344-Q347 PolarHBondContact O-N 3.28Å; H345-Q347 VanDerWaalsContact C-N 3.31Å; H345-Q347 PolarHBondContact O-N 3.13Å; Q347-V349 VanDerWaalsContact C-N 3.28Å; Q347-V349 PolarHBondContact O-N 2.81Å; Q347-K350 PolarHBondContact O-N 2.81Å; Q347-Q351 PolarHBondContact O-N 2.84Å
348	S	80	Confident	78.3	Confident	63 Å²	63	123.4 Å²	123.4	44%	0.441	57%	0.569	S	S	.	*	H	α-helix	trans	-68.8	-20.7	179.6	68.3	0	0	0	0	114.7	R344 H345	R344-S348 PolarHBondContact O-N 3.21Å; H345-S348 PolarHBondContact O-N 2.82Å; H345-S348 PolarHBondContact O-OG 2.82Å
349	V	75	Confident	77.9	Confident	104 Å²	104	129.4 Å²	129.4	63%	0.63	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-17.9	175.5	173.3	0	0	0	0	112	H345 Q347	H345-V349 WeakPolarHBondContact O-CG2 3.36Å; H345-V349 PolarHBondContact O-N 3.11Å; Q347-V349 VanDerWaalsContact C-N 3.28Å; Q347-V349 PolarHBondContact O-N 2.81Å
350	K	74.8	Confident	77.5	Confident	167 Å²	167	132.7 Å²	132.7	73%	0.726	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-23.3	177.9	-78.5	-177.3	172	-168.2	0	113.4	R346 Q347	R346-K350 WeakPolarHBondContact O-CG 3.39Å; Q347-K350 PolarHBondContact O-N 2.81Å
351	Q	65	Low	76.8	Confident	218 Å²	218	140.5 Å²	140.5	100%	1.019	63%	0.631	S	S	*	*			trans	-82.2	0	166.7	-69.7	180	-28.4	0	0	108.6	Q347	Q347-Q351 PolarHBondContact O-N 2.84Å

Retrieved 351 of 351 residues in 124.6 ms (Link to these results)

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