A0A2K5U8E9_MACFA Loading...

Uncoupling protein 3

AlphaFold DB , UniProt , Accession A0A2K5U8E9, Species MACFA (Macaca fascicularis, Crab-eating macaque), Gene UCP3, Length 312 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	34.4	Very low	36.6	Very low	242 Å²	242	125.8 Å²	125.8	100%	1.192	73%	0.733	S	S	*	*				0	100.4	0	-79.2	170.1	165.1	0	0	108.5
2	V	28.4	Very low	38.4	Very low	133 Å²	133	123.8 Å²	123.8	81%	0.806	72%	0.723	S	S	*	*			trans	-131.3	80	162.4	-176.4	0	0	0	0	105.1	L4	V2-L4 PolarHBondContact O-N 3.17Å; V2-L4 VanDerWaalsContact O-N 3.11Å
3	G	33.2	Very low	39.8	Very low	78 Å²	78	121.3 Å²	121.3	80%	0.804	70%	0.702	S	S	*	*			trans	-68.3	102	171	0	0	0	0	0	107.7	K5	G3-K5 PolarHBondContact O-N 2.67Å
4	L	31.6	Very low	41.1	Very low	151 Å²	151	116.5 Å²	116.5	79%	0.791	68%	0.684	S	S	*	*			trans	-67.2	104.5	167.4	-78.3	163.4	0	0	0	107.2	V2	V2-L4 PolarHBondContact O-N 3.17Å; V2-L4 VanDerWaalsContact O-N 3.11Å
5	K	29.5	Very low	42.6	Very low	190 Å²	190	112.7 Å²	112.7	83%	0.826	66%	0.663	S	S	*	*			trans	-51.1	127.8	170	-143.6	172.8	-175.3	178.8	0	107.8	G3 S7	G3-K5 PolarHBondContact O-N 2.67Å; K5-S7 PolarHBondContact O-N 3.14Å
6	P	35.1	Very low	43.8	Very low	93 Å²	93	111.8 Å²	111.8	60%	0.604	65%	0.648	S	S	*	*			trans	-64.2	111.7	174.2	26.1	-30.3	0	0	0	107.4	D8	P6-D8 PolarHBondContact O-N 3.42Å
7	S	34.5	Very low	45	Very low	70 Å²	70	109.1 Å²	109.1	49%	0.49	63%	0.627	S	S	.	*			trans	-65.2	115	168.6	19	0	0	0	0	108.2	K5 V9	K5-S7 PolarHBondContact O-N 3.14Å; S7-V9 PolarHBondContact O-N 3.04Å
8	D	36.4	Very low	46.2	Very low	156 Å²	156	109.3 Å²	109.3	83%	0.834	63%	0.625	S	S	*	*			trans	-69.2	57.7	178.3	-74.2	-47.3	0	0	0	112.4	P6	P6-D8 PolarHBondContact O-N 3.42Å
9	V	41.8	Very low	47.3	Very low	110 Å²	110	103.9 Å²	103.9	67%	0.667	60%	0.596	S	S	*	*			trans	-111.7	103.5	164.2	-165.5	0	0	0	0	106.9	S7 P11	S7-V9 PolarHBondContact O-N 3.04Å; V9-P11 WeakPolarHBondContact O-CD 3.49Å; V9-P11 VanDerWaalsContact O-N 3.11Å
10	P	44.8	Very low	48	Very low	100 Å²	100	100.8 Å²	100.8	65%	0.649	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-58.1	122.3	177.7	22.7	-30.6	0	0	0	107.6	T12	P10-T12 PolarHBondContact O-N 3.25Å
11	P	52.3	Low	48.8	Very low	61 Å²	61	96.7 Å²	96.7	40%	0.396	56%	0.563	S	S	.	*	P	Polyproline II helix	trans	-59	130.6	-177.1	6.3	-10.8	0	0	0	108.4	V9 M13 V15 K16	V9-P11 WeakPolarHBondContact O-CD 3.49Å; V9-P11 VanDerWaalsContact O-N 3.11Å; P11-M13 PolarHBondContact O-N 2.89Å; P11-V15 HydrophobicContact CB-CB 4.43Å; P11-V15 HydrophobicContact CB-CG1 4.4Å; P11-K16 HydrophobicContact CB-CG 4.01Å; P11-K16 HydrophobicContact CG-CD 4.34Å; P11-K16 VanDerWaalsContact CG-CE 3.41Å; P11-K16 HydrophobicContact CG-CG 3.98Å; P11-K16 VanDerWaalsContact O-CE 3.23Å; P11-K16 WeakPolarHBondContact O-CE 3.47Å
12	T	58.6	Low	50.4	Low	101 Å²	101	88.7 Å²	88.7	62%	0.62	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-47.8	140.9	179.5	-43.9	0	0	0	0	109.1	P10 A14 V15 K16	P10-T12 PolarHBondContact O-N 3.25Å; T12-A14 PolarHBondContact O-N 2.87Å; T12-V15 WeakPolarHBondContact O-CA 3.32Å; T12-V15 PolarHBondContact O-N 3.25Å; T12-K16 PolarHBondContact O-N 3.07Å; T12-K16 VanDerWaalsContact O-N 3.16Å
13	M	56.3	Low	52	Low	92 Å²	92	82.4 Å²	82.4	45%	0.453	49%	0.49	S	S	.	.	H	α-helix	trans	-52.2	-32.5	-175.5	-66.6	-163.2	65.5	0	0	113	P11 K16 F17 I96 D100	P11-M13 PolarHBondContact O-N 2.89Å; M13-K16 PolarHBondContact O-N 3.33Å; M13-F17 VanDerWaalsContact O-CB 3.32Å; M13-F17 WeakPolarHBondContact O-CB 3.43Å; M13-F17 PolarHBondContact O-N 3.34Å; M13-I96 HydrophobicContact CE-CG2 4.39Å; M13-D100 WeakPolarHBondContact CE-OD2 3.34Å
14	A	57.8	Low	53.5	Low	54 Å²	54	78.8 Å²	78.8	45%	0.446	45%	0.452	S	S	.	.	H	α-helix	trans	-62.1	-40.5	172.8	0	0	0	0	0	113.9	T12 F17 L18	T12-A14 PolarHBondContact O-N 2.87Å; A14-F17 WeakPolarHBondContact O-CB 3.41Å; A14-F17 PolarHBondContact O-N 3.05Å; A14-L18 WeakPolarHBondContact O-CB 3.46Å; A14-L18 PolarHBondContact O-N 3.45Å
15	V	64.5	Low	55.2	Low	60 Å²	60	73.5 Å²	73.5	36%	0.364	43%	0.427	S	S	.	.	H	α-helix	trans	-71.6	-39.4	178.2	179.2	0	0	0	0	110.7	P11 T12 F17 G19 L301	P11-V15 HydrophobicContact CB-CB 4.43Å; P11-V15 HydrophobicContact CB-CG1 4.4Å; T12-V15 WeakPolarHBondContact O-CA 3.32Å; T12-V15 PolarHBondContact O-N 3.25Å; V15-F17 VanDerWaalsContact C-N 3.31Å; V15-F17 PolarHBondContact O-N 3.01Å; V15-G19 WeakPolarHBondContact O-CA 3.12Å; V15-G19 PolarHBondContact O-N 2.82Å; V15-L301 HydrophobicContact CG1-CD1 3.72Å; V15-L301 HydrophobicContact CG1-CD2 4.39Å
16	K	62.2	Low	57.2	Low	97 Å²	97	69.6 Å²	69.6	42%	0.422	41%	0.41	S	S	.	.	H	α-helix	trans	-63.3	-39.1	171.9	-68	-179.3	179.2	171.9	0	111.4	P11 T12 M13 A20	P11-K16 HydrophobicContact CB-CG 4.01Å; P11-K16 HydrophobicContact CG-CD 4.34Å; P11-K16 VanDerWaalsContact CG-CE 3.41Å; P11-K16 HydrophobicContact CG-CG 3.98Å; P11-K16 VanDerWaalsContact O-CE 3.23Å; P11-K16 WeakPolarHBondContact O-CE 3.47Å; T12-K16 PolarHBondContact O-N 3.07Å; T12-K16 VanDerWaalsContact O-N 3.16Å; M13-K16 PolarHBondContact O-N 3.33Å; K16-A20 WeakPolarHBondContact O-CB 3.27Å; K16-A20 PolarHBondContact O-N 2.95Å
17	F	63.8	Low	58.5	Low	67 Å²	67	65.1 Å²	65.1	29%	0.294	38%	0.382	S	S	.	.	H	α-helix	trans	-65.4	-58.3	177.7	179.8	-126.1	0	0	0	112.9	M13 A14 V15 G19 A20 G21 A92 I96	M13-F17 VanDerWaalsContact O-CB 3.32Å; M13-F17 WeakPolarHBondContact O-CB 3.43Å; M13-F17 PolarHBondContact O-N 3.34Å; A14-F17 WeakPolarHBondContact O-CB 3.41Å; A14-F17 PolarHBondContact O-N 3.05Å; V15-F17 VanDerWaalsContact C-N 3.31Å; V15-F17 PolarHBondContact O-N 3.01Å; F17-G19 PolarHBondContact O-N 3.25Å; F17-A20 PolarHBondContact O-N 3.35Å; F17-G21 WeakPolarHBondContact O-CA 3.4Å; F17-G21 PolarHBondContact O-N 2.86Å; F17-A92 HydrophobicContact CD2-CB 4.32Å; F17-A92 HydrophobicContact CE2-CB 3.7Å; F17-I96 HydrophobicContact CB-CD1 3.26Å; F17-I96 HydrophobicContact CD2-CB 4.38Å; F17-I96 HydrophobicContact CD2-CD1 3.14Å; F17-I96 HydrophobicContact CD2-CG1 3.85Å; F17-I96 HydrophobicContact CE2-CD1 4.14Å; F17-I96 HydrophobicContact CE2-CG1 4.44Å; F17-I96 HydrophobicContact CG-CD1 3.5Å; F17-I96 VanDerWaalsContact CG-CD1 3.5Å
18	L	66.8	Low	60	Low	113 Å²	113	62 Å²	62	59%	0.592	36%	0.359	S	S	*	.	H	α-helix	trans	-61.6	-38.4	-179.6	-89.1	142.6	0	0	0	109.9	A14 T22	A14-L18 WeakPolarHBondContact O-CB 3.46Å; A14-L18 PolarHBondContact O-N 3.45Å; L18-T22 VanDerWaalsContact O-CB 3.31Å; L18-T22 WeakPolarHBondContact O-CB 3.36Å; L18-T22 WeakPolarHBondContact O-CG2 3.46Å; L18-T22 PolarHBondContact O-N 3.48Å; L18-T22 PolarHBondContact O-OG1 3.39Å
19	G	65.8	Low	61.7	Low	7 Å²	7	57.3 Å²	57.3	7%	0.072	33%	0.334	C	S	.	.	H	α-helix	trans	-68.6	-49.7	178.4	0	0	0	0	0	113.8	V15 F17 T22 A23 L297	V15-G19 WeakPolarHBondContact O-CA 3.12Å; V15-G19 PolarHBondContact O-N 2.82Å; F17-G19 PolarHBondContact O-N 3.25Å; G19-T22 PolarHBondContact O-OG1 3.15Å; G19-A23 WeakPolarHBondContact O-CB 3.48Å; G19-A23 PolarHBondContact O-N 3.16Å; G19-L297 WeakPolarHBondContact O-CD2 3.17Å
20	A	61.2	Low	63	Low	40 Å²	40	56.5 Å²	56.5	33%	0.331	33%	0.325	S	S	.	.	H	α-helix	trans	-69.3	-35.9	178	0	0	0	0	0	112.3	K16 F17 A24	K16-A20 WeakPolarHBondContact O-CB 3.27Å; K16-A20 PolarHBondContact O-N 2.95Å; F17-A20 PolarHBondContact O-N 3.35Å; A20-A24 WeakPolarHBondContact O-CB 3.3Å; A20-A24 PolarHBondContact O-N 3.27Å
21	G	65.6	Low	63.9	Low	16 Å²	16	51.9 Å²	51.9	17%	0.165	30%	0.295	C	S	.	.	H	α-helix	trans	-66.9	-48.4	178.2	0	0	0	0	0	112.3	F17 A24 C25	F17-G21 WeakPolarHBondContact O-CA 3.4Å; F17-G21 PolarHBondContact O-N 2.86Å; G21-A24 PolarHBondContact O-N 2.88Å; G21-C25 WeakPolarHBondContact O-CB 3.46Å; G21-C25 PolarHBondContact O-N 3.42Å; G21-C25 PolarHBondContact O-SG 3.26Å
22	T	67.8	Low	64.6	Low	73 Å²	73	49 Å²	49	45%	0.448	28%	0.276	S	S	.	.	H	α-helix	trans	-65.9	-42.4	176.2	53.3	0	0	0	0	111.9	L18 G19 A24 C25 F26	L18-T22 VanDerWaalsContact O-CB 3.31Å; L18-T22 WeakPolarHBondContact O-CB 3.36Å; L18-T22 WeakPolarHBondContact O-CG2 3.46Å; L18-T22 PolarHBondContact O-N 3.48Å; L18-T22 PolarHBondContact O-OG1 3.39Å; G19-T22 PolarHBondContact O-OG1 3.15Å; T22-A24 VanDerWaalsContact C-N 3.31Å; T22-A24 PolarHBondContact O-N 3.25Å; T22-C25 PolarHBondContact O-N 2.84Å; T22-F26 WeakPolarHBondContact O-CB 3.33Å; T22-F26 PolarHBondContact O-N 2.76Å
23	A	63	Low	64.9	Low	2 Å²	2	45.3 Å²	45.3	2%	0.017	25%	0.254	C	S	.	.	H	α-helix	trans	-60.8	-40.7	175.5	0	0	0	0	0	111.9	G19 F26 A27 T293	G19-A23 WeakPolarHBondContact O-CB 3.48Å; G19-A23 PolarHBondContact O-N 3.16Å; A23-F26 PolarHBondContact O-N 3.45Å; A23-A27 WeakPolarHBondContact O-CB 3.44Å; A23-A27 PolarHBondContact O-N 3.02Å; A23-T293 HydrophobicContact CB-CG2 3.7Å
24	A	64.1	Low	65.3	Low	2 Å²	2	43 Å²	43	2%	0.017	24%	0.244	C	C	.	.	H	α-helix	trans	-74.4	-36.2	179.3	0	0	0	0	0	113.2	A20 G21 T22 F26 A27 D28 Q88	A20-A24 WeakPolarHBondContact O-CB 3.3Å; A20-A24 PolarHBondContact O-N 3.27Å; G21-A24 PolarHBondContact O-N 2.88Å; T22-A24 VanDerWaalsContact C-N 3.31Å; T22-A24 PolarHBondContact O-N 3.25Å; A24-F26 VanDerWaalsContact C-N 3.28Å; A24-F26 PolarHBondContact O-N 3.28Å; A24-A27 PolarHBondContact O-N 3.46Å; A24-D28 VanDerWaalsContact O-CB 3.29Å; A24-D28 WeakPolarHBondContact O-CB 3.48Å; A24-D28 PolarHBondContact O-N 3.47Å; A24-Q88 HydrophobicContact CB-CG 3.79Å
25	C	67.8	Low	65.6	Low	39 Å²	39	41.1 Å²	41.1	26%	0.264	23%	0.226	S	C	.	.	H	α-helix	trans	-62.3	-38.6	171.3	-72.3	0	0	0	0	111.6	G21 T22 L29 L85	G21-C25 WeakPolarHBondContact O-CB 3.46Å; G21-C25 PolarHBondContact O-N 3.42Å; G21-C25 PolarHBondContact O-SG 3.26Å; T22-C25 PolarHBondContact O-N 2.84Å; C25-L29 WeakPolarHBondContact O-CB 3.43Å; C25-L29 PolarHBondContact O-N 2.59Å; C25-L85 HydrophobicContact CB-CD2 3.66Å
26	F	70.3	Confident	65.5	Low	108 Å²	108	38.6 Å²	38.6	47%	0.474	21%	0.21	S	C	.	.	H	α-helix	trans	-71.1	-40.8	176.5	-167.4	-101	0	0	0	112.3	T22 A23 A24 L29 L30 T293	T22-F26 WeakPolarHBondContact O-CB 3.33Å; T22-F26 PolarHBondContact O-N 2.76Å; A23-F26 PolarHBondContact O-N 3.45Å; A24-F26 VanDerWaalsContact C-N 3.28Å; A24-F26 PolarHBondContact O-N 3.28Å; F26-L29 WeakPolarHBondContact O-CB 3.16Å; F26-L29 PolarHBondContact O-N 2.7Å; F26-L30 HydrophobicContact CD1-CD1 3.95Å; F26-L30 HydrophobicContact CE1-CD1 3.56Å; F26-L30 HydrophobicContact CE1-CG 4.32Å; F26-L30 HydrophobicContact CZ-CD1 4.23Å; F26-L30 PolarHBondContact O-N 2.89Å; F26-L30 VanDerWaalsContact O-N 3.17Å; F26-T293 HydrophobicContact CB-CG2 4.49Å; F26-T293 HydrophobicContact CD1-CG2 4.11Å
27	A	62.1	Low	65.5	Low	0 Å²	0	34 Å²	34	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61.3	-47.8	173.4	0	0	0	0	0	111.2	A23 A24 L29 L30 T31 V289	A23-A27 WeakPolarHBondContact O-CB 3.44Å; A23-A27 PolarHBondContact O-N 3.02Å; A24-A27 PolarHBondContact O-N 3.46Å; A27-L29 VanDerWaalsContact C-N 3.27Å; A27-L29 PolarHBondContact O-N 3.38Å; A27-L30 PolarHBondContact O-N 2.72Å; A27-L30 VanDerWaalsContact O-N 3.1Å; A27-T31 PolarHBondContact O-N 3.26Å; A27-T31 PolarHBondContact O-OG1 3.23Å; A27-V289 HydrophobicContact CB-CB 4.42Å; A27-V289 HydrophobicContact CB-CG1 3.74Å
28	D	67.9	Low	65.4	Low	3 Å²	3	31.8 Å²	31.8	2%	0.016	18%	0.181	C	C	.	.	H	α-helix	trans	-61.3	-35.6	177.6	-82.7	11.4	0	0	0	111.5	A24 F32 R87 W286	A24-D28 VanDerWaalsContact O-CB 3.29Å; A24-D28 WeakPolarHBondContact O-CB 3.48Å; A24-D28 PolarHBondContact O-N 3.47Å; D28-F32 WeakPolarHBondContact O-CA 3.32Å; D28-F32 WeakPolarHBondContact O-CB 3.09Å; D28-F32 PolarHBondContact O-N 2.93Å; D28-R87 IonicContact OD2-NH2 3.17Å; D28-R87 PolarHBondContact OD2-NH2 3.43Å; D28-W286 PolarHBondContact OD1-NE1 3.11Å
29	L	71.7	Confident	65.1	Low	59 Å²	59	28 Å²	28	31%	0.309	16%	0.162	S	C	.	.	H	α-helix	trans	-62.1	-41.3	174.4	-176	71.4	0	0	0	112.2	C25 F26 A27 Y78 L81	C25-L29 WeakPolarHBondContact O-CB 3.43Å; C25-L29 PolarHBondContact O-N 2.59Å; F26-L29 WeakPolarHBondContact O-CB 3.16Å; F26-L29 PolarHBondContact O-N 2.7Å; A27-L29 VanDerWaalsContact C-N 3.27Å; A27-L29 PolarHBondContact O-N 3.38Å; L29-Y78 HydrophobicContact CD1-CD1 4.25Å; L29-Y78 HydrophobicContact CD1-CE1 3.96Å; L29-L81 HydrophobicContact CD1-CD1 3.83Å; L29-L81 HydrophobicContact CD1-CD2 3.45Å; L29-L81 VanDerWaalsContact CD1-CD2 3.45Å; L29-L81 HydrophobicContact CD1-CG 4.28Å
30	L	68.5	Low	64.8	Low	92 Å²	92	28.6 Å²	28.6	48%	0.482	16%	0.162	S	C	.	.	H	α-helix	trans	-77.7	-35.8	-179.4	-69.4	176	0	0	0	112.7	F26 A27 P33 V289	F26-L30 HydrophobicContact CD1-CD1 3.95Å; F26-L30 HydrophobicContact CE1-CD1 3.56Å; F26-L30 HydrophobicContact CE1-CG 4.32Å; F26-L30 HydrophobicContact CZ-CD1 4.23Å; F26-L30 PolarHBondContact O-N 2.89Å; F26-L30 VanDerWaalsContact O-N 3.17Å; A27-L30 PolarHBondContact O-N 2.72Å; A27-L30 VanDerWaalsContact O-N 3.1Å; L30-P33 WeakPolarHBondContact O-CD 3.24Å; L30-V289 HydrophobicContact CD1-CG1 3.97Å
31	T	64.4	Low	64.7	Low	3 Å²	3	28.9 Å²	28.9	2%	0.018	16%	0.158	C	C	.	.	H	α-helix	trans	-89	-7.7	-179.6	59.9	0	0	0	0	113.2	A27 P33 L34 D35 W286	A27-T31 PolarHBondContact O-N 3.26Å; A27-T31 PolarHBondContact O-OG1 3.23Å; T31-P33 VanDerWaalsContact C-CD 3.46Å; T31-L34 WeakPolarHBondContact O-CB 3.25Å; T31-L34 PolarHBondContact O-N 3.32Å; T31-D35 PolarHBondContact O-N 2.9Å; T31-W286 HydrophobicContact CG2-CB 4.4Å
32	F	67.6	Low	64.1	Low	1 Å²	1	31.4 Å²	31.4	0%	0.004	17%	0.165	C	C	.	.	H	α-helix	trans	-53.5	-43.9	-179.1	-146.1	-97.9	0	0	0	114	D28 L34 D35 T36 P77 G80 L81	D28-F32 WeakPolarHBondContact O-CA 3.32Å; D28-F32 WeakPolarHBondContact O-CB 3.09Å; D28-F32 PolarHBondContact O-N 2.93Å; F32-L34 VanDerWaalsContact C-N 3.26Å; F32-L34 PolarHBondContact O-N 3.34Å; F32-D35 PolarHBondContact O-N 3.29Å; F32-T36 PolarHBondContact O-N 3.27Å; F32-T36 PolarHBondContact O-OG1 3.43Å; F32-T36 VanDerWaalsContact O-OG1 3.04Å; F32-P77 WeakPolarHBondContact CD1-O 3.39Å; F32-G80 VanDerWaalsContact CZ-O 3.3Å; F32-G80 WeakPolarHBondContact CZ-O 3.32Å; F32-L81 HydrophobicContact CB-CD1 4.39Å; F32-L81 HydrophobicContact CD1-CB 4.48Å; F32-L81 HydrophobicContact CD2-CD1 3.84Å; F32-L81 HydrophobicContact CE1-CB 4.34Å; F32-L81 HydrophobicContact CE2-CD1 4.32Å; F32-L81 HydrophobicContact CG-CD1 4Å; F32-L81 VanDerWaalsContact CZ-CA 3.49Å; F32-L81 HydrophobicContact CZ-CB 4.4Å; F32-L81 VanDerWaalsContact CZ-N 3.3Å
33	P	63.2	Low	63.4	Low	23 Å²	23	29.9 Å²	29.9	15%	0.149	15%	0.154	C	C	.	.	H	α-helix	trans	-61.7	-34.1	177.7	-23.2	35.1	0	0	0	112.9	L30 T31 A37 P77	L30-P33 WeakPolarHBondContact O-CD 3.24Å; T31-P33 VanDerWaalsContact C-CD 3.46Å; P33-A37 VanDerWaalsContact O-CB 3.26Å; P33-A37 WeakPolarHBondContact O-CB 3.32Å; P33-A37 PolarHBondContact O-N 3.02Å; P33-P77 HydrophobicContact CB-CB 4.2Å; P33-P77 HydrophobicContact CG-CB 4.41Å
34	L	65.1	Low	62.5	Low	45 Å²	45	33.2 Å²	33.2	24%	0.236	17%	0.17	C	C	.	.	H	α-helix	trans	-72.1	-40.2	176.5	-68.3	167.7	0	0	0	111.5	T31 F32 A37 K38 V61 I65	T31-L34 WeakPolarHBondContact O-CB 3.25Å; T31-L34 PolarHBondContact O-N 3.32Å; F32-L34 VanDerWaalsContact C-N 3.26Å; F32-L34 PolarHBondContact O-N 3.34Å; L34-A37 PolarHBondContact O-N 2.96Å; L34-K38 WeakPolarHBondContact O-CB 3.47Å; L34-K38 PolarHBondContact O-N 3.01Å; L34-V61 HydrophobicContact CD2-CG1 3.59Å; L34-I65 HydrophobicContact CD2-CD1 4.07Å
35	D	64.2	Low	61.8	Low	14 Å²	14	36.4 Å²	36.4	8%	0.075	20%	0.202	C	C	.	.	H	α-helix	trans	-61	-47.5	173.9	-85.3	-11.1	0	0	0	111.1	T31 F32 A37 K38 V39 R282	T31-D35 PolarHBondContact O-N 2.9Å; F32-D35 PolarHBondContact O-N 3.29Å; D35-A37 VanDerWaalsContact C-N 3.33Å; D35-A37 PolarHBondContact O-N 3.12Å; D35-K38 PolarHBondContact O-N 3.03Å; D35-V39 WeakPolarHBondContact O-CG2 3.11Å; D35-V39 PolarHBondContact O-N 2.98Å; D35-R282 VanDerWaalsContact OD1-CD 3.23Å; D35-R282 WeakPolarHBondContact OD1-CD 3.35Å; D35-R282 IonicContact OD1-CZ 2.89Å; D35-R282 IonicContact OD1-NE 2.84Å; D35-R282 IonicContact OD1-NH1 3.44Å; D35-R282 PolarHBondContact OD1-NH1 3.46Å; D35-R282 IonicContact OD2-NH1 3.45Å
36	T	62.2	Low	60.7	Low	6 Å²	6	37 Å²	37	4%	0.037	20%	0.201	C	C	.	.	H	α-helix	trans	-62.9	-40.9	177.2	-52	0	0	0	0	111.1	F32 K38 R40 M68 P77	F32-T36 PolarHBondContact O-N 3.27Å; F32-T36 PolarHBondContact O-OG1 3.43Å; F32-T36 VanDerWaalsContact O-OG1 3.04Å; T36-K38 PolarHBondContact O-N 3.35Å; T36-R40 WeakPolarHBondContact O-CB 3.39Å; T36-R40 VanDerWaalsContact O-CG 3.29Å; T36-R40 WeakPolarHBondContact O-CG 3.34Å; T36-R40 PolarHBondContact O-N 2.69Å; T36-R40 VanDerWaalsContact O-N 3.11Å; T36-M68 HydrophobicContact CG2-CE 3.47Å; T36-M68 VanDerWaalsContact CG2-CE 3.47Å; T36-P77 PolarHBondContact OG1-O 3.45Å
37	A	61.9	Low	59.3	Low	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63.1	-39.9	175.8	0	0	0	0	0	112.8	P33 L34 D35 R40 L41 V61 I65	P33-A37 VanDerWaalsContact O-CB 3.26Å; P33-A37 WeakPolarHBondContact O-CB 3.32Å; P33-A37 PolarHBondContact O-N 3.02Å; L34-A37 PolarHBondContact O-N 2.96Å; D35-A37 VanDerWaalsContact C-N 3.33Å; D35-A37 PolarHBondContact O-N 3.12Å; A37-R40 PolarHBondContact O-N 3.09Å; A37-L41 WeakPolarHBondContact O-CG 3.44Å; A37-L41 PolarHBondContact O-N 2.89Å; A37-V61 HydrophobicContact CB-CG1 4.01Å; A37-I65 HydrophobicContact CB-CD1 4.19Å; A37-I65 HydrophobicContact CB-CG1 3.82Å
38	K	63.4	Low	58.3	Low	21 Å²	21	39.9 Å²	39.9	9%	0.091	23%	0.227	C	C	.	.	H	α-helix	trans	-66.3	-50	178.3	179.4	178.9	176.2	-178.9	0	111.7	L34 D35 T36 R40 L41 Q42 S279	L34-K38 WeakPolarHBondContact O-CB 3.47Å; L34-K38 PolarHBondContact O-N 3.01Å; D35-K38 PolarHBondContact O-N 3.03Å; T36-K38 PolarHBondContact O-N 3.35Å; K38-R40 PolarHBondContact O-N 3.12Å; K38-L41 PolarHBondContact O-N 2.94Å; K38-Q42 VanDerWaalsContact CE-NE2 3.3Å; K38-Q42 HydrophobicContact CG-CG 4.43Å; K38-Q42 WeakPolarHBondContact O-CG 3.21Å; K38-Q42 PolarHBondContact O-N 3.02Å; K38-S279 WeakPolarHBondContact CE-OG 3.44Å; K38-S279 PolarHBondContact NZ-OG 3Å
39	V	59.9	Low	57	Low	33 Å²	33	45 Å²	45	20%	0.2	26%	0.258	C	S	.	.	H	α-helix	trans	-58.7	-38.5	179.9	173.8	0	0	0	0	110	D35 Q42 I43	D35-V39 WeakPolarHBondContact O-CG2 3.11Å; D35-V39 PolarHBondContact O-N 2.98Å; V39-Q42 PolarHBondContact O-N 3.21Å; V39-I43 HydrophobicContact CG1-CD1 3.63Å; V39-I43 WeakPolarHBondContact O-CD1 3.45Å; V39-I43 VanDerWaalsContact O-CG1 3.25Å; V39-I43 WeakPolarHBondContact O-CG1 3.21Å; V39-I43 PolarHBondContact O-N 3.31Å; V39-I43 VanDerWaalsContact O-N 3.09Å
40	R	59.2	Low	55.4	Low	20 Å²	20	44.7 Å²	44.7	8%	0.075	26%	0.264	C	S	.	.	H	α-helix	trans	-66.1	-45	175.4	-73.9	-175.2	178.5	-152	5.5	113.8	T36 A37 K38 Q42 I43 Q44 E72	T36-R40 WeakPolarHBondContact O-CB 3.39Å; T36-R40 VanDerWaalsContact O-CG 3.29Å; T36-R40 WeakPolarHBondContact O-CG 3.34Å; T36-R40 PolarHBondContact O-N 2.69Å; T36-R40 VanDerWaalsContact O-N 3.11Å; A37-R40 PolarHBondContact O-N 3.09Å; K38-R40 PolarHBondContact O-N 3.12Å; R40-Q42 VanDerWaalsContact C-N 3.25Å; R40-Q42 PolarHBondContact O-N 2.97Å; R40-I43 PolarHBondContact O-N 3.47Å; R40-Q44 PolarHBondContact O-N 3.31Å; R40-E72 IonicContact CZ-OE1 2.81Å; R40-E72 IonicContact CZ-OE2 2.71Å; R40-E72 IonicContact NH1-OE1 3.92Å; R40-E72 PolarHBondContact NH1-OE1 2.97Å; R40-E72 IonicContact NH1-OE2 3.92Å; R40-E72 PolarHBondContact NH1-OE2 3.42Å; R40-E72 IonicContact NH2-OE1 3.75Å; R40-E72 PolarHBondContact NH2-OE1 3.28Å; R40-E72 IonicContact NH2-OE2 2.92Å; R40-E72 PolarHBondContact NH2-OE2 3.07Å
41	L	59.8	Low	54	Low	47 Å²	47	48.1 Å²	48.1	25%	0.246	28%	0.277	C	S	.	.	H	α-helix	trans	-63.2	-33	176.1	-78.7	166.4	0	0	0	112.5	A37 K38 V61 T64	A37-L41 WeakPolarHBondContact O-CG 3.44Å; A37-L41 PolarHBondContact O-N 2.89Å; K38-L41 PolarHBondContact O-N 2.94Å; L41-V61 HydrophobicContact CD1-CG2 4.05Å; L41-T64 HydrophobicContact CD1-CG2 4.17Å; L41-T64 HydrophobicContact CD2-CG2 3.76Å; L41-T64 HydrophobicContact CG-CG2 3.79Å
42	Q	52.5	Low	52.6	Low	68 Å²	68	53.7 Å²	53.7	32%	0.318	31%	0.312	S	S	.	.	H	α-helix	trans	-71.2	-41.2	177.9	-72.9	-178.7	-36.6	0	0	111.9	K38 V39 R40 Q44	K38-Q42 VanDerWaalsContact CE-NE2 3.3Å; K38-Q42 HydrophobicContact CG-CG 4.43Å; K38-Q42 WeakPolarHBondContact O-CG 3.21Å; K38-Q42 PolarHBondContact O-N 3.02Å; V39-Q42 PolarHBondContact O-N 3.21Å; R40-Q42 VanDerWaalsContact C-N 3.25Å; R40-Q42 PolarHBondContact O-N 2.97Å; Q42-Q44 VanDerWaalsContact C-N 3.31Å; Q42-Q44 PolarHBondContact O-N 2.68Å
43	I	53.2	Low	51.2	Low	42 Å²	42	56 Å²	56	22%	0.215	33%	0.33	C	S	.	.	H	α-helix	trans	-75.3	-19.3	-178.3	-64.9	167.8	0	0	0	112.8	V39 R40 G45 E46 A146	V39-I43 HydrophobicContact CG1-CD1 3.63Å; V39-I43 WeakPolarHBondContact O-CD1 3.45Å; V39-I43 VanDerWaalsContact O-CG1 3.25Å; V39-I43 WeakPolarHBondContact O-CG1 3.21Å; V39-I43 PolarHBondContact O-N 3.31Å; V39-I43 VanDerWaalsContact O-N 3.09Å; R40-I43 PolarHBondContact O-N 3.47Å; I43-G45 PolarHBondContact O-N 3.46Å; I43-E46 WeakPolarHBondContact CA-OE2 3.14Å; I43-E46 PolarHBondContact O-N 3.32Å; I43-A146 HydrophobicContact CD1-CB 4.31Å
44	Q	44.6	Very low	49.9	Very low	72 Å²	72	67 Å²	67	34%	0.336	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-12.5	-176.2	-151.8	-173.9	-6.4	0	0	114.6	R40 Q42 V56 Y58	R40-Q44 PolarHBondContact O-N 3.31Å; Q42-Q44 VanDerWaalsContact C-N 3.31Å; Q42-Q44 PolarHBondContact O-N 2.68Å; Q44-V56 PolarHBondContact NE2-O 2.95Å; Q44-Y58 HydrophobicContact CG-CD2 4.17Å
45	G	47.7	Very low	48.8	Very low	68 Å²	68	71.8 Å²	71.8	70%	0.701	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-5.6	176.2	0	0	0	0	0	115.3	I43	I43-G45 PolarHBondContact O-N 3.46Å
46	E	44.7	Very low	47.9	Very low	52 Å²	52	74.1 Å²	74.1	24%	0.243	41%	0.408	C	S	.	.	S	Bend	trans	-107.5	3.2	-162	-76.2	156.4	149.5	0	0	113.9	I43 N247	I43-E46 WeakPolarHBondContact CA-OE2 3.14Å; I43-E46 PolarHBondContact O-N 3.32Å; E46-N247 HydrophobicContact CB-CB 4.39Å; E46-N247 WeakPolarHBondContact CB-ND2 3.45Å; E46-N247 HydrophobicContact CG-CB 4.08Å; E46-N247 WeakPolarHBondContact OE1-CB 3.41Å; E46-N247 WeakPolarHBondContact OE2-CB 3.36Å; E46-N247 PolarHBondContact OE2-ND2 3.36Å
47	N	41.2	Very low	47	Very low	78 Å²	78	81.8 Å²	81.8	42%	0.417	44%	0.444	S	S	.	.			trans	-126.1	105.4	178.3	-124.7	-24.2	0	0	0	112.7	V49 A50	N47-V49 PolarHBondContact O-N 3.14Å; N47-A50 HydrophobicContact CB-CB 4.18Å; N47-A50 PolarHBondContact O-N 3.13Å
48	P	41.3	Very low	46.4	Very low	91 Å²	91	83.4 Å²	83.4	59%	0.591	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-21.2	178.5	24	-31.1	0	0	0	113.2	A50 Q51 T52	P48-A50 VanDerWaalsContact C-N 3.35Å; P48-Q51 PolarHBondContact O-N 3.24Å; P48-T52 PolarHBondContact O-OG1 3.34Å
49	V	39.9	Very low	45.7	Very low	110 Å²	110	92.6 Å²	92.6	67%	0.667	48%	0.484	S	S	*	.	H	α-helix	trans	-72.6	-28.6	176.1	-176.4	0	0	0	0	112	N47 Q51 T52	N47-V49 PolarHBondContact O-N 3.14Å; V49-Q51 VanDerWaalsContact C-N 3.27Å; V49-Q51 PolarHBondContact O-N 3.43Å; V49-T52 PolarHBondContact O-N 3.46Å
50	A	39.8	Very low	45.6	Very low	53 Å²	53	93 Å²	93	44%	0.438	50%	0.495	S	S	.	.	H	α-helix	trans	-77.4	-12.4	175.7	0	0	0	0	0	113	N47 P48	N47-A50 HydrophobicContact CB-CB 4.18Å; N47-A50 PolarHBondContact O-N 3.13Å; P48-A50 VanDerWaalsContact C-N 3.35Å
51	Q	37.5	Very low	45.6	Very low	164 Å²	164	93.6 Å²	93.6	77%	0.766	50%	0.501	S	S	*	.	H	α-helix	trans	-78.5	-26.2	172.4	-71.7	-173.9	-34.8	0	0	112.5	P48 V49	P48-Q51 PolarHBondContact O-N 3.24Å; V49-Q51 VanDerWaalsContact C-N 3.27Å; V49-Q51 PolarHBondContact O-N 3.43Å
52	T	35.6	Very low	45.6	Very low	120 Å²	120	98.1 Å²	98.1	74%	0.736	53%	0.525	S	S	*	.	H	α-helix	trans	-81.8	-33	-177.5	-24.2	0	0	0	0	112.2	P48 V49	P48-T52 PolarHBondContact O-OG1 3.34Å; V49-T52 PolarHBondContact O-N 3.46Å
53	A	38.6	Very low	46	Very low	48 Å²	48	96.2 Å²	96.2	40%	0.397	52%	0.524	S	S	.	.	S	Bend	trans	-84.4	116.2	167.8	0	0	0	0	0	108.5	L55	A53-L55 HydrophobicContact CB-CD1 4.19Å; A53-L55 PolarHBondContact O-N 3.49Å
54	R	36.5	Very low	46.5	Very low	255 Å²	255	94.3 Å²	94.3	96%	0.962	51%	0.514	S	S	*	.			trans	-63.5	41.5	176.5	-70.4	178.4	170.5	171.3	-3	114	V56	R54-V56 PolarHBondContact O-N 2.81Å
55	L	41.3	Very low	47.4	Very low	146 Å²	146	92.6 Å²	92.6	76%	0.764	51%	0.507	S	S	*	.			trans	-91.3	96.4	-177.9	-85.8	156.7	0	0	0	109.7	A53	A53-L55 HydrophobicContact CB-CD1 4.19Å; A53-L55 PolarHBondContact O-N 3.49Å
56	V	44.9	Very low	48.2	Very low	62 Å²	62	95.4 Å²	95.4	38%	0.376	51%	0.505	S	S	.	.			trans	53.8	94.7	158.5	-165.9	0	0	0	0	115.5	Q44 R54 Y58 T67	Q44-V56 PolarHBondContact NE2-O 2.95Å; R54-V56 PolarHBondContact O-N 2.81Å; V56-Y58 HydrophobicContact CG1-CD1 4.3Å; V56-Y58 HydrophobicContact CG1-CE1 4.33Å; V56-Y58 PolarHBondContact O-N 3.32Å; V56-T67 HydrophobicContact CG1-CG2 3.86Å
57	Q	43.7	Very low	49.1	Very low	167 Å²	167	94.7 Å²	94.7	78%	0.78	50%	0.504	S	S	*	.			trans	-65.7	97.8	158.6	-80.7	-178.2	-24.8	0	0	109.6	R59	Q57-R59 PolarHBondContact O-N 3.45Å
58	Y	49.5	Very low	50.2	Low	34 Å²	34	91.1 Å²	91.1	13%	0.133	49%	0.485	C	S	.	.			trans	-56.2	109	166.2	-68.8	-62.7	0	0	0	111.4	Q44 V56 T64 T67	Q44-Y58 HydrophobicContact CG-CD2 4.17Å; V56-Y58 HydrophobicContact CG1-CD1 4.3Å; V56-Y58 HydrophobicContact CG1-CE1 4.33Å; V56-Y58 PolarHBondContact O-N 3.32Å; Y58-T64 HydrophobicContact CD1-CG2 3.46Å; Y58-T64 VanDerWaalsContact CD1-CG2 3.46Å; Y58-T64 HydrophobicContact CE1-CG2 4.4Å; Y58-T64 HydrophobicContact CG-CG2 3.56Å; Y58-T67 HydrophobicContact CE1-CG2 4.07Å
59	R	47.8	Very low	51.4	Low	214 Å²	214	89 Å²	89	81%	0.808	47%	0.471	S	S	*	.			trans	-97.3	101.8	173.3	-79.9	-174.8	163.7	-167.1	-4.1	110	Q57	Q57-R59 PolarHBondContact O-N 3.45Å
60	G	57.3	Low	52.6	Low	42 Å²	42	94.3 Å²	94.3	43%	0.433	48%	0.479	S	S	.	.	H	α-helix	trans	72.3	173.8	172.8	0	0	0	0	0	115.1	T64	G60-T64 VanDerWaalsContact O-CG2 3.24Å; G60-T64 WeakPolarHBondContact O-CG2 3.38Å; G60-T64 PolarHBondContact O-N 3.04Å; G60-T64 PolarHBondContact O-OG1 3.11Å
61	V	59.1	Low	53.8	Low	32 Å²	32	96.2 Å²	96.2	19%	0.194	49%	0.485	C	S	.	.	H	α-helix	trans	-70.2	-32.5	-171.9	-173.1	0	0	0	0	112.7	L34 A37 L41 T64 I65 P278	L34-V61 HydrophobicContact CD2-CG1 3.59Å; A37-V61 HydrophobicContact CB-CG1 4.01Å; L41-V61 HydrophobicContact CD1-CG2 4.05Å; V61-T64 PolarHBondContact O-OG1 3.44Å; V61-I65 HydrophobicContact CG1-CD1 4.24Å; V61-I65 VanDerWaalsContact O-CD1 3.3Å; V61-I65 WeakPolarHBondContact O-CD1 3.46Å; V61-I65 VanDerWaalsContact O-CG1 3.22Å; V61-I65 WeakPolarHBondContact O-CG1 3.3Å; V61-I65 PolarHBondContact O-N 3Å; V61-P278 HydrophobicContact CG2-CB 4.23Å
62	L	61.5	Low	55.1	Low	143 Å²	143	91.1 Å²	91.1	75%	0.749	46%	0.461	S	S	*	.	H	α-helix	trans	-81.7	-35.6	179.5	-67	172.1	0	0	0	112	T64 I65 L66	L62-T64 VanDerWaalsContact C-N 3.33Å; L62-T64 PolarHBondContact O-N 3.01Å; L62-I65 PolarHBondContact O-N 3.37Å; L62-L66 WeakPolarHBondContact O-CB 3.27Å; L62-L66 PolarHBondContact O-N 2.96Å
63	G	60.9	Low	56.6	Low	28 Å²	28	86.9 Å²	86.9	29%	0.289	44%	0.441	S	S	.	.	H	α-helix	trans	-65.8	-35.5	175.9	0	0	0	0	0	112.5	T67	G63-T67 VanDerWaalsContact O-CB 3.32Å; G63-T67 WeakPolarHBondContact O-CB 3.39Å; G63-T67 PolarHBondContact O-N 3.18Å; G63-T67 PolarHBondContact O-OG1 3.49Å
64	T	63.7	Low	57.9	Low	1 Å²	1	91.1 Å²	91.1	1%	0.006	46%	0.456	C	S	.	.	H	α-helix	trans	-66.7	-45.7	174.3	50.5	0	0	0	0	112.7	L41 Y58 G60 V61 L62 T67 M68	L41-T64 HydrophobicContact CD1-CG2 4.17Å; L41-T64 HydrophobicContact CD2-CG2 3.76Å; L41-T64 HydrophobicContact CG-CG2 3.79Å; Y58-T64 HydrophobicContact CD1-CG2 3.46Å; Y58-T64 VanDerWaalsContact CD1-CG2 3.46Å; Y58-T64 HydrophobicContact CE1-CG2 4.4Å; Y58-T64 HydrophobicContact CG-CG2 3.56Å; G60-T64 VanDerWaalsContact O-CG2 3.24Å; G60-T64 WeakPolarHBondContact O-CG2 3.38Å; G60-T64 PolarHBondContact O-N 3.04Å; G60-T64 PolarHBondContact O-OG1 3.11Å; V61-T64 PolarHBondContact O-OG1 3.44Å; L62-T64 VanDerWaalsContact C-N 3.33Å; L62-T64 PolarHBondContact O-N 3.01Å; T64-T67 PolarHBondContact O-N 3.26Å; T64-M68 WeakPolarHBondContact O-CB 3.41Å; T64-M68 PolarHBondContact O-N 2.99Å
65	I	61.8	Low	59.2	Low	37 Å²	37	83.8 Å²	83.8	19%	0.19	44%	0.443	C	S	.	.	H	α-helix	trans	-63.2	-45.7	179.2	-67.2	168.3	0	0	0	110.2	L34 A37 V61 L62 M68 V69	L34-I65 HydrophobicContact CD2-CD1 4.07Å; A37-I65 HydrophobicContact CB-CD1 4.19Å; A37-I65 HydrophobicContact CB-CG1 3.82Å; V61-I65 HydrophobicContact CG1-CD1 4.24Å; V61-I65 VanDerWaalsContact O-CD1 3.3Å; V61-I65 WeakPolarHBondContact O-CD1 3.46Å; V61-I65 VanDerWaalsContact O-CG1 3.22Å; V61-I65 WeakPolarHBondContact O-CG1 3.3Å; V61-I65 PolarHBondContact O-N 3Å; L62-I65 PolarHBondContact O-N 3.37Å; I65-M68 PolarHBondContact O-N 3.36Å; I65-V69 WeakPolarHBondContact O-CG2 3.29Å; I65-V69 PolarHBondContact O-N 2.94Å
66	L	64.5	Low	60.2	Low	126 Å²	126	77.2 Å²	77.2	66%	0.66	41%	0.409	S	S	*	.	H	α-helix	trans	-64.6	-43.6	-179.9	-164.7	81.7	0	0	0	111.9	L62 M68 R70	L62-L66 WeakPolarHBondContact O-CB 3.27Å; L62-L66 PolarHBondContact O-N 2.96Å; L66-M68 VanDerWaalsContact C-N 3.35Å; L66-R70 WeakPolarHBondContact O-CB 3.39Å; L66-R70 PolarHBondContact O-N 2.84Å; L66-R70 VanDerWaalsContact O-N 3.12Å
67	T	65.3	Low	61.1	Low	38 Å²	38	74.6 Å²	74.6	23%	0.233	39%	0.393	C	S	.	.	H	α-helix	trans	-62.7	-44.9	176.4	-54.1	0	0	0	0	110.2	V56 Y58 G63 T64 V69 R70 T71	V56-T67 HydrophobicContact CG1-CG2 3.86Å; Y58-T67 HydrophobicContact CE1-CG2 4.07Å; G63-T67 VanDerWaalsContact O-CB 3.32Å; G63-T67 WeakPolarHBondContact O-CB 3.39Å; G63-T67 PolarHBondContact O-N 3.18Å; G63-T67 PolarHBondContact O-OG1 3.49Å; T64-T67 PolarHBondContact O-N 3.26Å; T67-V69 PolarHBondContact O-N 3.36Å; T67-R70 CarbonylContact O-C 3.55Å; T67-R70 PolarHBondContact O-N 3.45Å; T67-R70 VanDerWaalsContact O-N 3.09Å; T67-T71 HydrophobicContact CG2-CG2 4.05Å; T67-T71 WeakPolarHBondContact O-CG2 3.48Å; T67-T71 PolarHBondContact O-N 3.46Å; T67-T71 PolarHBondContact O-OG1 2.9Å
68	M	62.7	Low	62.1	Low	2 Å²	2	71.2 Å²	71.2	1%	0.01	37%	0.374	C	S	.	.	H	α-helix	trans	-59.5	-47.7	179.5	177.5	-165.3	-82.2	0	0	112.3	T36 T64 I65 L66 R70 T71 E72 P77	T36-M68 HydrophobicContact CG2-CE 3.47Å; T36-M68 VanDerWaalsContact CG2-CE 3.47Å; T64-M68 WeakPolarHBondContact O-CB 3.41Å; T64-M68 PolarHBondContact O-N 2.99Å; I65-M68 PolarHBondContact O-N 3.36Å; L66-M68 VanDerWaalsContact C-N 3.35Å; M68-R70 PolarHBondContact O-N 2.98Å; M68-T71 PolarHBondContact O-N 3.02Å; M68-E72 WeakPolarHBondContact O-CB 3.45Å; M68-E72 PolarHBondContact O-N 3.48Å; M68-P77 VanDerWaalsContact SD-CA 3.55Å; M68-P77 HydrophobicContact SD-CB 3.57Å; M68-P77 VanDerWaalsContact SD-CB 3.57Å; M68-P77 HydrophobicContact SD-CG 4.16Å
69	V	67.9	Low	62.7	Low	48 Å²	48	72.2 Å²	72.2	29%	0.291	38%	0.382	S	S	.	.	H	α-helix	trans	-60.6	-36.1	177.2	169.3	0	0	0	0	110.8	I65 T67 G73 L74	I65-V69 WeakPolarHBondContact O-CG2 3.29Å; I65-V69 PolarHBondContact O-N 2.94Å; T67-V69 PolarHBondContact O-N 3.36Å; V69-G73 CarbonylContact O-C 3.57Å; V69-G73 VanDerWaalsContact O-CA 3.3Å; V69-G73 WeakPolarHBondContact O-CA 3.42Å; V69-G73 PolarHBondContact O-N 3.22Å; V69-L74 HydrophobicContact CG1-CD2 3.46Å; V69-L74 VanDerWaalsContact CG1-CD2 3.46Å; V69-L74 HydrophobicContact CG1-CG 4.08Å
70	R	65.4	Low	63.5	Low	221 Å²	221	62.3 Å²	62.3	83%	0.834	35%	0.346	S	S	*	.	H	α-helix	trans	-78.8	-31.8	-178	-163	174.5	-176.4	160.8	1.4	113.8	L66 T67 M68	L66-R70 WeakPolarHBondContact O-CB 3.39Å; L66-R70 PolarHBondContact O-N 2.84Å; L66-R70 VanDerWaalsContact O-N 3.12Å; T67-R70 CarbonylContact O-C 3.55Å; T67-R70 PolarHBondContact O-N 3.45Å; T67-R70 VanDerWaalsContact O-N 3.09Å; M68-R70 PolarHBondContact O-N 2.98Å
71	T	64.6	Low	64	Low	92 Å²	92	61.7 Å²	61.7	56%	0.564	33%	0.333	S	S	*	.	H	α-helix	trans	-96.5	-34	-176.8	55.6	0	0	0	0	113.6	T67 M68	T67-T71 HydrophobicContact CG2-CG2 4.05Å; T67-T71 WeakPolarHBondContact O-CG2 3.48Å; T67-T71 PolarHBondContact O-N 3.46Å; T67-T71 PolarHBondContact O-OG1 2.9Å; M68-T71 PolarHBondContact O-N 3.02Å
72	E	64.1	Low	64.5	Low	58 Å²	58	64.9 Å²	64.9	27%	0.271	35%	0.352	S	S	.	.	H	α-helix	trans	-116.9	-7.3	-172.3	-60.7	171.4	-155.7	0	0	113.2	R40 M68 S76	R40-E72 IonicContact CZ-OE1 2.81Å; R40-E72 IonicContact CZ-OE2 2.71Å; R40-E72 IonicContact NH1-OE1 3.92Å; R40-E72 PolarHBondContact NH1-OE1 2.97Å; R40-E72 IonicContact NH1-OE2 3.92Å; R40-E72 PolarHBondContact NH1-OE2 3.42Å; R40-E72 IonicContact NH2-OE1 3.75Å; R40-E72 PolarHBondContact NH2-OE1 3.28Å; R40-E72 IonicContact NH2-OE2 2.92Å; R40-E72 PolarHBondContact NH2-OE2 3.07Å; M68-E72 WeakPolarHBondContact O-CB 3.45Å; M68-E72 PolarHBondContact O-N 3.48Å; E72-S76 WeakPolarHBondContact CB-OG 3.18Å; E72-S76 PolarHBondContact OE2-OG 3.31Å
73	G	68.1	Low	64.7	Low	31 Å²	31	58.1 Å²	58.1	32%	0.32	32%	0.317	S	S	.	.			trans	91.6	167.1	179.4	0	0	0	0	0	114.7	V69 C75 S76	V69-G73 CarbonylContact O-C 3.57Å; V69-G73 VanDerWaalsContact O-CA 3.3Å; V69-G73 WeakPolarHBondContact O-CA 3.42Å; V69-G73 PolarHBondContact O-N 3.22Å; G73-C75 VanDerWaalsContact C-N 3.29Å; G73-C75 PolarHBondContact O-N 3.23Å; G73-S76 WeakPolarHBondContact O-CB 3.42Å; G73-S76 PolarHBondContact O-N 3.44Å; G73-S76 VanDerWaalsContact O-N 3.15Å
74	L	64.7	Low	65.1	Low	136 Å²	136	56.8 Å²	56.8	71%	0.712	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-27.2	-173	-72.6	161.8	0	0	0	114.2	V69 P77	V69-L74 HydrophobicContact CG1-CD2 3.46Å; V69-L74 VanDerWaalsContact CG1-CD2 3.46Å; V69-L74 HydrophobicContact CG1-CG 4.08Å; L74-P77 WeakPolarHBondContact O-CD 3.42Å; L74-P77 WeakPolarHBondContact O-CG 3.33Å
75	C	63.4	Low	65.4	Low	102 Å²	102	59.5 Å²	59.5	69%	0.689	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-13.1	178.5	-64.3	0	0	0	0	113.4	G73 Y78	G73-C75 VanDerWaalsContact C-N 3.29Å; G73-C75 PolarHBondContact O-N 3.23Å; C75-Y78 PolarHBondContact O-N 3.47Å; C75-Y78 VanDerWaalsContact O-N 3.16Å
76	S	63.5	Low	65.9	Low	7 Å²	7	61.3 Å²	61.3	5%	0.049	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-59.1	-40.9	-179.4	-160.9	0	0	0	0	115.2	E72 G73 Y78 N79	E72-S76 WeakPolarHBondContact CB-OG 3.18Å; E72-S76 PolarHBondContact OE2-OG 3.31Å; G73-S76 WeakPolarHBondContact O-CB 3.42Å; G73-S76 PolarHBondContact O-N 3.44Å; G73-S76 VanDerWaalsContact O-N 3.15Å; S76-Y78 PolarHBondContact O-N 3.12Å; S76-Y78 VanDerWaalsContact O-N 3.13Å; S76-N79 WeakPolarHBondContact O-CB 3.22Å; S76-N79 PolarHBondContact O-N 3.22Å; S76-N79 PolarHBondContact O-ND2 3.01Å
77	P	63.9	Low	66.3	Low	7 Å²	7	57.7 Å²	57.7	5%	0.045	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-59.4	-25.7	177	16.3	-29.3	0	0	0	113.9	F32 P33 T36 M68 L74	F32-P77 WeakPolarHBondContact CD1-O 3.39Å; P33-P77 HydrophobicContact CB-CB 4.2Å; P33-P77 HydrophobicContact CG-CB 4.41Å; T36-P77 PolarHBondContact OG1-O 3.45Å; M68-P77 VanDerWaalsContact SD-CA 3.55Å; M68-P77 HydrophobicContact SD-CB 3.57Å; M68-P77 VanDerWaalsContact SD-CB 3.57Å; M68-P77 HydrophobicContact SD-CG 4.16Å; L74-P77 WeakPolarHBondContact O-CD 3.42Å; L74-P77 WeakPolarHBondContact O-CG 3.33Å
78	Y	64.9	Low	66.4	Low	97 Å²	97	57 Å²	57	38%	0.38	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-86.5	-2.1	179.2	-65.8	-81	0	0	0	113.6	L29 C75 S76 G80 L81	L29-Y78 HydrophobicContact CD1-CD1 4.25Å; L29-Y78 HydrophobicContact CD1-CE1 3.96Å; C75-Y78 PolarHBondContact O-N 3.47Å; C75-Y78 VanDerWaalsContact O-N 3.16Å; S76-Y78 PolarHBondContact O-N 3.12Å; S76-Y78 VanDerWaalsContact O-N 3.13Å; Y78-G80 PolarHBondContact O-N 3.24Å; Y78-G80 VanDerWaalsContact O-N 3.14Å; Y78-L81 HydrophobicContact CD1-CD2 4.15Å; Y78-L81 WeakPolarHBondContact O-CB 3.45Å; Y78-L81 PolarHBondContact O-N 2.71Å
79	N	62.6	Low	66.7	Low	54 Å²	54	63.2 Å²	63.2	29%	0.289	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	118.2	174.6	-75.9	-35.6	0	0	0	110.3	S76 F144 I148	S76-N79 WeakPolarHBondContact O-CB 3.22Å; S76-N79 PolarHBondContact O-N 3.22Å; S76-N79 PolarHBondContact O-ND2 3.01Å; N79-F144 HydrophobicContact CB-CE1 4.47Å; N79-I148 HydrophobicContact CB-CD1 3.61Å
80	G	63.5	Low	66.8	Low	6 Å²	6	62.8 Å²	62.8	6%	0.062	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	98.8	0.1	-173.5	0	0	0	0	0	114.4	F32 Y78 V82 A83 G84	F32-G80 VanDerWaalsContact CZ-O 3.3Å; F32-G80 WeakPolarHBondContact CZ-O 3.32Å; Y78-G80 PolarHBondContact O-N 3.24Å; Y78-G80 VanDerWaalsContact O-N 3.14Å; G80-V82 PolarHBondContact O-N 3.25Å; G80-A83 WeakPolarHBondContact O-CB 3.42Å; G80-A83 PolarHBondContact O-N 2.67Å; G80-A83 VanDerWaalsContact O-N 3.11Å; G80-G84 PolarHBondContact O-N 3.42Å
81	L	68.9	Low	66.9	Low	30 Å²	30	55.5 Å²	55.5	16%	0.157	30%	0.301	C	S	.	.	H	α-helix	trans	-54.8	-42	174.9	177.3	69.9	0	0	0	111.5	L29 F32 Y78 A83 G84 L85	L29-L81 HydrophobicContact CD1-CD1 3.83Å; L29-L81 HydrophobicContact CD1-CD2 3.45Å; L29-L81 VanDerWaalsContact CD1-CD2 3.45Å; L29-L81 HydrophobicContact CD1-CG 4.28Å; F32-L81 HydrophobicContact CB-CD1 4.39Å; F32-L81 HydrophobicContact CD1-CB 4.48Å; F32-L81 HydrophobicContact CD2-CD1 3.84Å; F32-L81 HydrophobicContact CE1-CB 4.34Å; F32-L81 HydrophobicContact CE2-CD1 4.32Å; F32-L81 HydrophobicContact CG-CD1 4Å; F32-L81 VanDerWaalsContact CZ-CA 3.49Å; F32-L81 HydrophobicContact CZ-CB 4.4Å; F32-L81 VanDerWaalsContact CZ-N 3.3Å; Y78-L81 HydrophobicContact CD1-CD2 4.15Å; Y78-L81 WeakPolarHBondContact O-CB 3.45Å; Y78-L81 PolarHBondContact O-N 2.71Å; L81-A83 VanDerWaalsContact C-N 3.31Å; L81-A83 PolarHBondContact O-N 3.49Å; L81-G84 CarbonylContact O-C 3.56Å; L81-G84 WeakPolarHBondContact O-CA 3.3Å; L81-G84 PolarHBondContact O-N 3.44Å; L81-L85 HydrophobicContact CD1-CD1 4.37Å; L81-L85 HydrophobicContact CD1-CG 4.26Å; L81-L85 HydrophobicContact CD2-CD1 4.33Å; L81-L85 HydrophobicContact CG-CD1 3.93Å; L81-L85 HydrophobicContact CG-CG 4.25Å; L81-L85 WeakPolarHBondContact O-CG 3.24Å; L81-L85 PolarHBondContact O-N 2.96Å
82	V	69.3	Low	66.9	Low	99 Å²	99	51.9 Å²	51.9	60%	0.6	28%	0.281	S	S	*	.	H	α-helix	trans	-58.7	-42.3	177.9	179.7	0	0	0	0	111.4	G80 G84 L85 Q86	G80-V82 PolarHBondContact O-N 3.25Å; V82-G84 VanDerWaalsContact C-N 3.33Å; V82-G84 PolarHBondContact O-N 3.21Å; V82-L85 PolarHBondContact O-N 3.06Å; V82-Q86 VanDerWaalsContact O-CB 3.29Å; V82-Q86 WeakPolarHBondContact O-CB 3.38Å; V82-Q86 PolarHBondContact O-N 3.31Å
83	A	65.9	Low	67	Low	0 Å²	0	52 Å²	52	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-66.8	-35.3	174.9	0	0	0	0	0	111.9	G80 L81 R87 T137 K141 T162	G80-A83 WeakPolarHBondContact O-CB 3.42Å; G80-A83 PolarHBondContact O-N 2.67Å; G80-A83 VanDerWaalsContact O-N 3.11Å; L81-A83 VanDerWaalsContact C-N 3.31Å; L81-A83 PolarHBondContact O-N 3.49Å; A83-R87 WeakPolarHBondContact O-CB 3.22Å; A83-R87 PolarHBondContact O-N 2.78Å; A83-T137 WeakPolarHBondContact O-CG2 3.26Å; A83-K141 HydrophobicContact CB-CB 4.04Å; A83-K141 HydrophobicContact CB-CG 4.29Å; A83-T162 HydrophobicContact CB-CG2 3.84Å
84	G	68	Low	66.9	Low	1 Å²	1	51.7 Å²	51.7	1%	0.01	28%	0.278	C	S	.	.	H	α-helix	trans	-64.3	-47.4	173.5	0	0	0	0	0	113.3	G80 L81 V82 R87 Q88	G80-G84 PolarHBondContact O-N 3.42Å; L81-G84 CarbonylContact O-C 3.56Å; L81-G84 WeakPolarHBondContact O-CA 3.3Å; L81-G84 PolarHBondContact O-N 3.44Å; V82-G84 VanDerWaalsContact C-N 3.33Å; V82-G84 PolarHBondContact O-N 3.21Å; G84-R87 WeakPolarHBondContact O-CB 3.42Å; G84-R87 PolarHBondContact O-N 3.44Å; G84-Q88 PolarHBondContact O-N 3.47Å
85	L	71.3	Confident	66.7	Low	58 Å²	58	52.6 Å²	52.6	30%	0.304	27%	0.272	S	S	.	.	H	α-helix	trans	-64.6	-42.8	176.9	-70.1	170.9	0	0	0	111.3	C25 L81 V82 R87 Q88 M89	C25-L85 HydrophobicContact CB-CD2 3.66Å; L81-L85 HydrophobicContact CD1-CD1 4.37Å; L81-L85 HydrophobicContact CD1-CG 4.26Å; L81-L85 HydrophobicContact CD2-CD1 4.33Å; L81-L85 HydrophobicContact CG-CD1 3.93Å; L81-L85 HydrophobicContact CG-CG 4.25Å; L81-L85 WeakPolarHBondContact O-CG 3.24Å; L81-L85 PolarHBondContact O-N 2.96Å; V82-L85 PolarHBondContact O-N 3.06Å; L85-R87 VanDerWaalsContact C-N 3.33Å; L85-R87 PolarHBondContact O-N 3.43Å; L85-Q88 PolarHBondContact O-N 3.17Å; L85-M89 WeakPolarHBondContact O-CB 3.46Å; L85-M89 PolarHBondContact O-N 3.34Å
86	Q	72.2	Confident	66.7	Low	75 Å²	75	50.3 Å²	50.3	35%	0.35	25%	0.253	S	S	.	.	H	α-helix	trans	-59.7	-43.6	174.6	-177.7	177.7	-16	0	0	111.3	V82 Q88 M89 S90 T137 Y166	V82-Q86 VanDerWaalsContact O-CB 3.29Å; V82-Q86 WeakPolarHBondContact O-CB 3.38Å; V82-Q86 PolarHBondContact O-N 3.31Å; Q86-Q88 VanDerWaalsContact C-N 3.34Å; Q86-Q88 PolarHBondContact O-N 2.96Å; Q86-M89 PolarHBondContact O-N 2.9Å; Q86-S90 WeakPolarHBondContact O-CB 3.4Å; Q86-S90 PolarHBondContact O-N 3.03Å; Q86-S90 PolarHBondContact O-OG 3.45Å; Q86-S90 VanDerWaalsContact O-OG 3.07Å; Q86-T137 HydrophobicContact CB-CG2 4.26Å; Q86-T137 HydrophobicContact CG-CG2 4.12Å; Q86-Y166 PolarHBondContact NE2-OH 3.43Å
87	R	71.9	Confident	66.6	Low	50 Å²	50	52.2 Å²	52.2	19%	0.189	27%	0.273	C	S	.	.	H	α-helix	trans	-58.5	-47.3	174.7	-178.3	-159.5	66.4	77.2	4.3	111	D28 A83 G84 L85 M89 S90 F91 T137 D138	D28-R87 IonicContact OD2-NH2 3.17Å; D28-R87 PolarHBondContact OD2-NH2 3.43Å; A83-R87 WeakPolarHBondContact O-CB 3.22Å; A83-R87 PolarHBondContact O-N 2.78Å; G84-R87 WeakPolarHBondContact O-CB 3.42Å; G84-R87 PolarHBondContact O-N 3.44Å; L85-R87 VanDerWaalsContact C-N 3.33Å; L85-R87 PolarHBondContact O-N 3.43Å; R87-M89 VanDerWaalsContact C-N 3.35Å; R87-S90 PolarHBondContact O-N 3.21Å; R87-F91 VanDerWaalsContact O-CB 3.28Å; R87-F91 WeakPolarHBondContact O-CB 3.43Å; R87-F91 PolarHBondContact O-N 2.96Å; R87-T137 HydrophobicContact CB-CG2 3.9Å; R87-D138 WeakPolarHBondContact CD-OD1 3.42Å; R87-D138 WeakPolarHBondContact CG-OD1 3.19Å
88	Q	67.7	Low	66.7	Low	22 Å²	22	54.1 Å²	54.1	10%	0.103	28%	0.283	C	S	.	.	H	α-helix	trans	-66.3	-39.2	-177.8	-165.3	61	14.9	0	0	112	A24 G84 L85 Q86 F91 A92	A24-Q88 HydrophobicContact CB-CG 3.79Å; G84-Q88 PolarHBondContact O-N 3.47Å; L85-Q88 PolarHBondContact O-N 3.17Å; Q86-Q88 VanDerWaalsContact C-N 3.34Å; Q86-Q88 PolarHBondContact O-N 2.96Å; Q88-F91 PolarHBondContact O-N 3.01Å; Q88-A92 VanDerWaalsContact O-CB 3.27Å; Q88-A92 WeakPolarHBondContact O-CB 3.29Å; Q88-A92 PolarHBondContact O-N 3.1Å
89	M	69.5	Low	66.5	Low	133 Å²	133	55 Å²	55	66%	0.655	29%	0.286	S	S	*	.	H	α-helix	trans	-65.1	-47.6	176	-166.7	166.1	176.7	0	0	111.4	L85 Q86 R87 F91 A92 S93	L85-M89 WeakPolarHBondContact O-CB 3.46Å; L85-M89 PolarHBondContact O-N 3.34Å; Q86-M89 PolarHBondContact O-N 2.9Å; R87-M89 VanDerWaalsContact C-N 3.35Å; M89-F91 PolarHBondContact O-N 3.37Å; M89-A92 PolarHBondContact O-N 3.31Å; M89-S93 WeakPolarHBondContact O-CB 3.47Å; M89-S93 PolarHBondContact O-N 3.03Å; M89-S93 PolarHBondContact O-OG 3.19Å; M89-S93 VanDerWaalsContact O-OG 3.1Å
90	S	69.2	Low	66.4	Low	39 Å²	39	55.2 Å²	55.2	27%	0.273	29%	0.287	S	S	.	.	H	α-helix	trans	-60.3	-45.1	175.2	-63.8	0	0	0	0	112	Q86 R87 A92 S93 I94	Q86-S90 WeakPolarHBondContact O-CB 3.4Å; Q86-S90 PolarHBondContact O-N 3.03Å; Q86-S90 PolarHBondContact O-OG 3.45Å; Q86-S90 VanDerWaalsContact O-OG 3.07Å; R87-S90 PolarHBondContact O-N 3.21Å; S90-A92 PolarHBondContact O-N 3.04Å; S90-S93 PolarHBondContact O-N 3.02Å; S90-I94 WeakPolarHBondContact O-CD1 3.22Å; S90-I94 VanDerWaalsContact O-CG1 3.29Å; S90-I94 WeakPolarHBondContact O-CG1 3.49Å; S90-I94 PolarHBondContact O-N 2.92Å
91	F	67	Low	66.4	Low	69 Å²	69	58 Å²	58	30%	0.303	31%	0.306	S	S	.	.	H	α-helix	trans	-64.3	-42.2	179.8	-166.9	-97.1	0	0	0	111.8	R87 Q88 M89 R95 A130	R87-F91 VanDerWaalsContact O-CB 3.28Å; R87-F91 WeakPolarHBondContact O-CB 3.43Å; R87-F91 PolarHBondContact O-N 2.96Å; Q88-F91 PolarHBondContact O-N 3.01Å; M89-F91 PolarHBondContact O-N 3.37Å; F91-R95 WeakPolarHBondContact O-CB 3.31Å; F91-R95 PolarHBondContact O-N 3.49Å; F91-A130 HydrophobicContact CE2-CB 4.25Å
92	A	64.6	Low	66.1	Low	16 Å²	16	57.2 Å²	57.2	13%	0.132	30%	0.302	C	S	.	.	H	α-helix	trans	-65	-44.9	175.8	0	0	0	0	0	111.5	F17 Q88 M89 S90 I94 R95 I96	F17-A92 HydrophobicContact CD2-CB 4.32Å; F17-A92 HydrophobicContact CE2-CB 3.7Å; Q88-A92 VanDerWaalsContact O-CB 3.27Å; Q88-A92 WeakPolarHBondContact O-CB 3.29Å; Q88-A92 PolarHBondContact O-N 3.1Å; M89-A92 PolarHBondContact O-N 3.31Å; S90-A92 PolarHBondContact O-N 3.04Å; A92-I94 PolarHBondContact O-N 3.11Å; A92-R95 PolarHBondContact O-N 3.26Å; A92-I96 WeakPolarHBondContact O-CG1 3.47Å; A92-I96 PolarHBondContact O-N 3.5Å
93	S	66.8	Low	65.6	Low	59 Å²	59	57.8 Å²	57.8	41%	0.413	30%	0.297	S	S	.	.	H	α-helix	trans	-60.2	-45	177.7	-68.9	0	0	0	0	112.2	M89 S90 I96 G97	M89-S93 WeakPolarHBondContact O-CB 3.47Å; M89-S93 PolarHBondContact O-N 3.03Å; M89-S93 PolarHBondContact O-OG 3.19Å; M89-S93 VanDerWaalsContact O-OG 3.1Å; S90-S93 PolarHBondContact O-N 3.02Å; S93-I96 PolarHBondContact O-N 3.29Å; S93-G97 PolarHBondContact O-N 3.36Å
94	I	66.8	Low	65.5	Low	25 Å²	25	65 Å²	65	13%	0.128	33%	0.33	C	S	.	.	H	α-helix	trans	-69.8	-43.6	179	-66	157.6	0	0	0	110.8	S90 A92 I96 G97 L98 A130 C133	S90-I94 WeakPolarHBondContact O-CD1 3.22Å; S90-I94 VanDerWaalsContact O-CG1 3.29Å; S90-I94 WeakPolarHBondContact O-CG1 3.49Å; S90-I94 PolarHBondContact O-N 2.92Å; A92-I94 PolarHBondContact O-N 3.11Å; I94-I96 PolarHBondContact O-N 3.17Å; I94-G97 PolarHBondContact O-N 3.39Å; I94-L98 HydrophobicContact CG2-CB 4.36Å; I94-L98 HydrophobicContact CG2-CD1 4.21Å; I94-L98 HydrophobicContact CG2-CD2 4.26Å; I94-L98 WeakPolarHBondContact O-CB 3.29Å; I94-L98 PolarHBondContact O-N 3.41Å; I94-A130 HydrophobicContact CG2-CB 3.87Å; I94-C133 HydrophobicContact CD1-CB 3.39Å; I94-C133 HydrophobicContact CG1-CB 4.41Å
95	R	60.6	Low	65.3	Low	155 Å²	155	70.6 Å²	70.6	59%	0.585	36%	0.364	S	S	*	.	H	α-helix	trans	-61.1	-31	178.5	-173.9	177.2	179.4	-179.5	3.3	111.8	F91 A92 Y99	F91-R95 WeakPolarHBondContact O-CB 3.31Å; F91-R95 PolarHBondContact O-N 3.49Å; A92-R95 PolarHBondContact O-N 3.26Å; R95-Y99 WeakPolarHBondContact O-CB 3.44Å; R95-Y99 PolarHBondContact O-N 3.38Å
96	I	61.9	Low	64.7	Low	55 Å²	55	71.3 Å²	71.3	28%	0.282	36%	0.363	S	S	.	.	H	α-helix	trans	-87	-41.6	177	-64.1	-154.8	0	0	0	112.1	M13 F17 A92 S93 I94	M13-I96 HydrophobicContact CE-CG2 4.39Å; F17-I96 HydrophobicContact CB-CD1 3.26Å; F17-I96 HydrophobicContact CD2-CB 4.38Å; F17-I96 HydrophobicContact CD2-CD1 3.14Å; F17-I96 HydrophobicContact CD2-CG1 3.85Å; F17-I96 HydrophobicContact CE2-CD1 4.14Å; F17-I96 HydrophobicContact CE2-CG1 4.44Å; F17-I96 HydrophobicContact CG-CD1 3.5Å; F17-I96 VanDerWaalsContact CG-CD1 3.5Å; A92-I96 WeakPolarHBondContact O-CG1 3.47Å; A92-I96 PolarHBondContact O-N 3.5Å; S93-I96 PolarHBondContact O-N 3.29Å; I94-I96 PolarHBondContact O-N 3.17Å
97	G	63.1	Low	64	Low	46 Å²	46	70.8 Å²	70.8	47%	0.474	37%	0.365	S	S	.	.	H	α-helix	trans	-69.5	-39	-179.2	0	0	0	0	0	113.6	S93 I94	S93-G97 PolarHBondContact O-N 3.36Å; I94-G97 PolarHBondContact O-N 3.39Å
98	L	64.9	Low	63	Low	48 Å²	48	72.8 Å²	72.8	25%	0.251	39%	0.385	S	S	.	.	H	α-helix	trans	-96.2	-24.3	-175.3	-90.3	74.6	0	0	0	113.9	I94 D100 S101 V102 M129	I94-L98 HydrophobicContact CG2-CB 4.36Å; I94-L98 HydrophobicContact CG2-CD1 4.21Å; I94-L98 HydrophobicContact CG2-CD2 4.26Å; I94-L98 WeakPolarHBondContact O-CB 3.29Å; I94-L98 PolarHBondContact O-N 3.41Å; L98-D100 PolarHBondContact O-N 3.28Å; L98-S101 PolarHBondContact O-N 3.39Å; L98-V102 WeakPolarHBondContact O-CB 3.4Å; L98-V102 VanDerWaalsContact O-CG2 3.27Å; L98-V102 WeakPolarHBondContact O-CG2 3.25Å; L98-V102 PolarHBondContact O-N 3.06Å; L98-M129 HydrophobicContact CD2-CB 3.87Å; L98-M129 HydrophobicContact CD2-CE 3.41Å; L98-M129 VanDerWaalsContact CD2-CE 3.41Å; L98-M129 HydrophobicContact CD2-CG 4.48Å; L98-M129 HydrophobicContact CD2-SD 3.84Å
99	Y	60.3	Low	61.8	Low	115 Å²	115	81.7 Å²	81.7	45%	0.451	43%	0.426	S	S	.	.	H	α-helix	trans	-64.3	-41	-172.8	-177.7	-97.9	0	0	0	112.3	R95 K103	R95-Y99 WeakPolarHBondContact O-CB 3.44Å; R95-Y99 PolarHBondContact O-N 3.38Å; Y99-K103 HydrophobicContact CE1-CD 4.17Å; Y99-K103 WeakPolarHBondContact O-CB 3.39Å; Y99-K103 PolarHBondContact O-N 3.36Å
100	D	61.3	Low	60.8	Low	59 Å²	59	79.3 Å²	79.3	32%	0.316	44%	0.436	S	S	.	.	H	α-helix	trans	-69.9	-39.5	177.1	-67.3	-36	0	0	0	111.9	M13 L98 K103 Q104	M13-D100 WeakPolarHBondContact CE-OD2 3.34Å; L98-D100 PolarHBondContact O-N 3.28Å; D100-K103 PolarHBondContact O-N 2.92Å; D100-Q104 WeakPolarHBondContact O-CB 3.27Å; D100-Q104 VanDerWaalsContact O-CG 3.26Å; D100-Q104 WeakPolarHBondContact O-CG 3.02Å; D100-Q104 PolarHBondContact O-N 2.92Å
101	S	63.4	Low	59.7	Low	64 Å²	64	80.1 Å²	80.1	45%	0.448	45%	0.445	S	S	.	.	H	α-helix	trans	-63.2	-44.2	175.6	-56.3	0	0	0	0	112.1	L98 Q104 V105	L98-S101 PolarHBondContact O-N 3.39Å; S101-Q104 PolarHBondContact O-N 3.09Å; S101-V105 VanDerWaalsContact O-CG2 3.32Å; S101-V105 WeakPolarHBondContact O-CG2 3.34Å; S101-V105 PolarHBondContact O-N 3.43Å; S101-V105 VanDerWaalsContact O-N 3.13Å
102	V	63.4	Low	58.7	Low	13 Å²	13	85.5 Å²	85.5	8%	0.079	48%	0.477	C	S	.	.	H	α-helix	trans	-69.7	-40	177.4	-179.9	0	0	0	0	110.4	L98 Q104 V105 Y106 A122 T126 M129	L98-V102 WeakPolarHBondContact O-CB 3.4Å; L98-V102 VanDerWaalsContact O-CG2 3.27Å; L98-V102 WeakPolarHBondContact O-CG2 3.25Å; L98-V102 PolarHBondContact O-N 3.06Å; V102-Q104 VanDerWaalsContact C-N 3.3Å; V102-Q104 PolarHBondContact O-N 3.19Å; V102-V105 PolarHBondContact O-N 3Å; V102-Y106 HydrophobicContact CG1-CD2 3.64Å; V102-Y106 HydrophobicContact CG1-CE2 3.81Å; V102-Y106 WeakPolarHBondContact O-CD2 3.12Å; V102-Y106 PolarHBondContact O-N 2.88Å; V102-Y106 VanDerWaalsContact O-N 3.07Å; V102-A122 HydrophobicContact CG1-CB 4.38Å; V102-T126 VanDerWaalsContact CB-OG1 3.31Å; V102-T126 WeakPolarHBondContact CB-OG1 3.33Å; V102-T126 WeakPolarHBondContact CG1-OG1 3.46Å; V102-M129 HydrophobicContact CG2-SD 4.45Å
103	K	58.8	Low	57.9	Low	111 Å²	111	89.3 Å²	89.3	48%	0.483	50%	0.503	S	S	.	.	H	α-helix	trans	-62.4	-37.1	176.8	-170.9	176.7	179.7	-173.4	0	112.3	Y99 D100 Y106 T107	Y99-K103 HydrophobicContact CE1-CD 4.17Å; Y99-K103 WeakPolarHBondContact O-CB 3.39Å; Y99-K103 PolarHBondContact O-N 3.36Å; D100-K103 PolarHBondContact O-N 2.92Å; K103-Y106 PolarHBondContact O-N 3.4Å; K103-T107 VanDerWaalsContact O-CB 3.25Å; K103-T107 WeakPolarHBondContact O-CB 3.41Å; K103-T107 PolarHBondContact O-N 2.91Å; K103-T107 PolarHBondContact O-OG1 3.48Å
104	Q	62	Low	57.3	Low	151 Å²	151	88.2 Å²	88.2	71%	0.706	50%	0.495	S	S	*	.	H	α-helix	trans	-67.8	-36.3	174.6	-76.9	176.1	-8.2	0	0	112.8	D100 S101 V102	D100-Q104 WeakPolarHBondContact O-CB 3.27Å; D100-Q104 VanDerWaalsContact O-CG 3.26Å; D100-Q104 WeakPolarHBondContact O-CG 3.02Å; D100-Q104 PolarHBondContact O-N 2.92Å; S101-Q104 PolarHBondContact O-N 3.09Å; V102-Q104 VanDerWaalsContact C-N 3.3Å; V102-Q104 PolarHBondContact O-N 3.19Å
105	V	64.9	Low	57.1	Low	119 Å²	119	90.5 Å²	90.5	72%	0.721	51%	0.513	S	S	*	.	H	α-helix	trans	-68.1	-35.3	176.2	171	0	0	0	0	111.9	S101 V102	S101-V105 VanDerWaalsContact O-CG2 3.32Å; S101-V105 WeakPolarHBondContact O-CG2 3.34Å; S101-V105 PolarHBondContact O-N 3.43Å; S101-V105 VanDerWaalsContact O-N 3.13Å; V102-V105 PolarHBondContact O-N 3Å
106	Y	59.3	Low	57.4	Low	73 Å²	73	86.9 Å²	86.9	29%	0.286	51%	0.505	S	S	.	.	H	α-helix	trans	-93.2	-14.9	-177.4	-80.6	-85.6	0	0	0	114.8	V102 K103 P108 T118 L121 A122 T125	V102-Y106 HydrophobicContact CG1-CD2 3.64Å; V102-Y106 HydrophobicContact CG1-CE2 3.81Å; V102-Y106 WeakPolarHBondContact O-CD2 3.12Å; V102-Y106 PolarHBondContact O-N 2.88Å; V102-Y106 VanDerWaalsContact O-N 3.07Å; K103-Y106 PolarHBondContact O-N 3.4Å; Y106-P108 VanDerWaalsContact O-CD 3.29Å; Y106-P108 WeakPolarHBondContact O-CD 3.42Å; Y106-T118 HydrophobicContact CD1-CG2 4.22Å; Y106-T118 VanDerWaalsContact O-CG2 3.27Å; Y106-T118 WeakPolarHBondContact O-CG2 3.29Å; Y106-L121 HydrophobicContact CD1-CB 4.5Å; Y106-L121 HydrophobicContact CE1-CB 3.96Å; Y106-A122 HydrophobicContact CD1-CB 4.3Å; Y106-A122 HydrophobicContact CD2-CB 3.79Å; Y106-A122 HydrophobicContact CE2-CB 4.42Å; Y106-A122 HydrophobicContact CG-CB 3.71Å; Y106-T125 HydrophobicContact CE2-CG2 4.42Å; Y106-T125 VanDerWaalsContact CE2-OG1 3.31Å; Y106-T125 WeakPolarHBondContact CE2-OG1 3.45Å; Y106-T125 WeakPolarHBondContact OH-CG2 3.2Å
107	T	57	Low	57.7	Low	64 Å²	64	88.6 Å²	88.6	39%	0.393	52%	0.518	S	S	.	.	S	Bend	trans	-109.2	93.5	178.2	-41.8	0	0	0	0	109.3	K103 Q109	K103-T107 VanDerWaalsContact O-CB 3.25Å; K103-T107 WeakPolarHBondContact O-CB 3.41Å; K103-T107 PolarHBondContact O-N 2.91Å; K103-T107 PolarHBondContact O-OG1 3.48Å; T107-Q109 PolarHBondContact O-N 3.01Å
108	P	51.2	Low	58	Low	92 Å²	92	88.6 Å²	88.6	60%	0.597	51%	0.509	S	S	*	.			trans	-60.3	138.4	168.1	24.5	-31	0	0	0	109.2	Y106 G110	Y106-P108 VanDerWaalsContact O-CD 3.29Å; Y106-P108 WeakPolarHBondContact O-CD 3.42Å; P108-G110 PolarHBondContact O-N 3.44Å
109	Q	41.8	Very low	58.1	Low	209 Å²	209	94.3 Å²	94.3	98%	0.977	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	106.6	177.3	-73.7	174.9	-20.8	0	0	109.5	T107	T107-Q109 PolarHBondContact O-N 3.01Å
110	G	48.4	Very low	58.6	Low	84 Å²	84	90.6 Å²	90.6	87%	0.866	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	126.5	7.9	167.8	0	0	0	0	0	119.1	P108	P108-G110 PolarHBondContact O-N 3.44Å
111	A	46.3	Very low	59.1	Low	56 Å²	56	92 Å²	92	46%	0.463	52%	0.522	S	S	.	.			trans	-109.2	101.4	175.8	0	0	0	0	0	112.6	S113	A111-S113 PolarHBondContact O-N 3.47Å; A111-S113 VanDerWaalsContact O-N 3.09Å
112	D	46.7	Very low	59.4	Low	182 Å²	182	89.7 Å²	89.7	97%	0.973	51%	0.507	S	S	*	.	S	Bend	trans	-70.2	6.8	175.5	-93.5	-30.8	0	0	0	114.5
113	S	46.1	Very low	59.5	Low	96 Å²	96	90.3 Å²	90.3	67%	0.671	52%	0.516	S	S	*	.			trans	-129.7	67.8	173.1	53.2	0	0	0	0	110.3	A111 S115	A111-S113 PolarHBondContact O-N 3.47Å; A111-S113 VanDerWaalsContact O-N 3.09Å; S113-S115 PolarHBondContact O-N 2.58Å
114	S	55	Low	60.2	Low	36 Å²	36	86.6 Å²	86.6	25%	0.252	50%	0.504	S	S	.	.			trans	-58.1	104.8	169.3	78.2	0	0	0	0	108.1	L116 R119	S114-L116 PolarHBondContact O-N 3.31Å; S114-R119 VanDerWaalsContact OG-CZ 3.31Å; S114-R119 PolarHBondContact OG-NE 3.5Å; S114-R119 PolarHBondContact OG-NH2 2.95Å; S114-R119 VanDerWaalsContact OG-NH2 3.12Å
115	S	62.4	Low	60.8	Low	73 Å²	73	81.6 Å²	81.6	51%	0.51	48%	0.483	S	S	.	.			trans	-54.2	140.4	179.2	-47.8	0	0	0	0	109	S113 T117 T118 R119	S113-S115 PolarHBondContact O-N 2.58Å; S115-T117 PolarHBondContact O-N 3.1Å; S115-T118 WeakPolarHBondContact O-CB 3.35Å; S115-T118 PolarHBondContact O-N 3.46Å; S115-R119 PolarHBondContact O-N 3.07Å
116	L	66.5	Low	61.1	Low	79 Å²	79	76.7 Å²	76.7	41%	0.414	45%	0.453	S	S	.	.	H	α-helix	trans	-41.1	-43	175.5	-124.2	102	0	0	0	111.5	S114 T118 R119 I120 V197 D201	S114-L116 PolarHBondContact O-N 3.31Å; L116-T118 PolarHBondContact O-N 3.36Å; L116-R119 WeakPolarHBondContact O-CB 3.44Å; L116-R119 PolarHBondContact O-N 2.9Å; L116-R119 VanDerWaalsContact O-N 3.16Å; L116-I120 HydrophobicContact CD2-CD1 4.26Å; L116-I120 VanDerWaalsContact O-CG1 3.3Å; L116-I120 WeakPolarHBondContact O-CG1 3.24Å; L116-I120 PolarHBondContact O-N 2.92Å; L116-V197 HydrophobicContact CD2-CG1 4.16Å; L116-D201 HydrophobicContact CD1-CB 4.43Å; L116-D201 VanDerWaalsContact CD1-OD2 3.28Å; L116-D201 WeakPolarHBondContact CD1-OD2 3.46Å; L116-D201 WeakPolarHBondContact CD2-OD2 2.95Å; L116-D201 WeakPolarHBondContact CG-OD2 3.12Å
117	T	68.4	Low	61.6	Low	91 Å²	91	73.6 Å²	73.6	56%	0.558	44%	0.444	S	S	*	.	H	α-helix	trans	-55.7	-42.5	177.6	-42.6	0	0	0	0	113.4	S115 I120 L121	S115-T117 PolarHBondContact O-N 3.1Å; T117-I120 PolarHBondContact O-N 3.44Å; T117-L121 HydrophobicContact CG2-CD1 4.16Å; T117-L121 WeakPolarHBondContact O-CB 3.28Å; T117-L121 VanDerWaalsContact O-CG 3.29Å; T117-L121 WeakPolarHBondContact O-CG 3.37Å; T117-L121 PolarHBondContact O-N 3.36Å
118	T	69.8	Low	62.5	Low	46 Å²	46	71.8 Å²	71.8	28%	0.282	44%	0.436	S	S	.	.	H	α-helix	trans	-68.3	-38.3	178.9	-52.1	0	0	0	0	111.1	Y106 S115 L116 L121 A122	Y106-T118 HydrophobicContact CD1-CG2 4.22Å; Y106-T118 VanDerWaalsContact O-CG2 3.27Å; Y106-T118 WeakPolarHBondContact O-CG2 3.29Å; S115-T118 WeakPolarHBondContact O-CB 3.35Å; S115-T118 PolarHBondContact O-N 3.46Å; L116-T118 PolarHBondContact O-N 3.36Å; T118-L121 PolarHBondContact O-N 2.89Å; T118-A122 VanDerWaalsContact O-CB 3.27Å; T118-A122 WeakPolarHBondContact O-CB 3.48Å; T118-A122 PolarHBondContact O-N 3.22Å
119	R	66.9	Low	63.7	Low	167 Å²	167	72 Å²	72	63%	0.63	43%	0.43	S	S	*	.	H	α-helix	trans	-66.5	-40.6	174.7	-65.6	-175.6	177.8	173.4	5.7	111.6	S114 S115 L116 G123	S114-R119 VanDerWaalsContact OG-CZ 3.31Å; S114-R119 PolarHBondContact OG-NE 3.5Å; S114-R119 PolarHBondContact OG-NH2 2.95Å; S114-R119 VanDerWaalsContact OG-NH2 3.12Å; S115-R119 PolarHBondContact O-N 3.07Å; L116-R119 WeakPolarHBondContact O-CB 3.44Å; L116-R119 PolarHBondContact O-N 2.9Å; L116-R119 VanDerWaalsContact O-N 3.16Å; R119-G123 PolarHBondContact O-N 3Å
120	I	70.2	Confident	65	Low	37 Å²	37	62.3 Å²	62.3	19%	0.19	39%	0.385	C	S	.	.	H	α-helix	trans	-64.1	-47.7	175.9	-67.8	165.9	0	0	0	110.2	L116 T117 A122 G123 C124 V197	L116-I120 HydrophobicContact CD2-CD1 4.26Å; L116-I120 VanDerWaalsContact O-CG1 3.3Å; L116-I120 WeakPolarHBondContact O-CG1 3.24Å; L116-I120 PolarHBondContact O-N 2.92Å; T117-I120 PolarHBondContact O-N 3.44Å; I120-A122 PolarHBondContact O-N 3.12Å; I120-G123 PolarHBondContact O-N 3.05Å; I120-C124 WeakPolarHBondContact O-CB 3.27Å; I120-C124 PolarHBondContact O-N 3.31Å; I120-C124 PolarHBondContact O-SG 3.27Å; I120-C124 VanDerWaalsContact O-SG 3.37Å; I120-V197 HydrophobicContact CD1-CG1 4.03Å; I120-V197 HydrophobicContact CG1-CB 4.2Å; I120-V197 HydrophobicContact CG1-CG1 3.77Å; I120-V197 HydrophobicContact CG1-CG2 4.4Å
121	L	72.1	Confident	66.2	Low	90 Å²	90	59 Å²	59	47%	0.471	35%	0.348	S	S	.	.	H	α-helix	trans	-62.1	-44.8	178.8	-74.9	168.3	0	0	0	111.7	Y106 T117 T118 G123 C124 T125	Y106-L121 HydrophobicContact CD1-CB 4.5Å; Y106-L121 HydrophobicContact CE1-CB 3.96Å; T117-L121 HydrophobicContact CG2-CD1 4.16Å; T117-L121 WeakPolarHBondContact O-CB 3.28Å; T117-L121 VanDerWaalsContact O-CG 3.29Å; T117-L121 WeakPolarHBondContact O-CG 3.37Å; T117-L121 PolarHBondContact O-N 3.36Å; T118-L121 PolarHBondContact O-N 2.89Å; L121-G123 VanDerWaalsContact C-N 3.35Å; L121-G123 PolarHBondContact O-N 3.44Å; L121-C124 PolarHBondContact O-N 2.92Å; L121-T125 WeakPolarHBondContact O-CG2 3.42Å; L121-T125 PolarHBondContact O-N 3.47Å; L121-T125 PolarHBondContact O-OG1 3.13Å
122	A	69.1	Low	67.7	Low	15 Å²	15	58.8 Å²	58.8	12%	0.124	34%	0.341	C	S	.	.	H	α-helix	trans	-62.9	-40	175	0	0	0	0	0	112.3	V102 Y106 T118 I120 T125 T126	V102-A122 HydrophobicContact CG1-CB 4.38Å; Y106-A122 HydrophobicContact CD1-CB 4.3Å; Y106-A122 HydrophobicContact CD2-CB 3.79Å; Y106-A122 HydrophobicContact CE2-CB 4.42Å; Y106-A122 HydrophobicContact CG-CB 3.71Å; T118-A122 VanDerWaalsContact O-CB 3.27Å; T118-A122 WeakPolarHBondContact O-CB 3.48Å; T118-A122 PolarHBondContact O-N 3.22Å; I120-A122 PolarHBondContact O-N 3.12Å; A122-T125 PolarHBondContact O-OG1 3.36Å; A122-T126 VanDerWaalsContact O-CB 3.31Å; A122-T126 WeakPolarHBondContact O-CB 3.36Å; A122-T126 PolarHBondContact O-N 2.79Å; A122-T126 PolarHBondContact O-OG1 3.04Å
123	G	67	Low	69.1	Low	26 Å²	26	53.9 Å²	53.9	27%	0.268	32%	0.321	S	S	.	.	H	α-helix	trans	-65.5	-43.1	175.7	0	0	0	0	0	112.5	R119 I120 L121 G127	R119-G123 PolarHBondContact O-N 3Å; I120-G123 PolarHBondContact O-N 3.05Å; L121-G123 VanDerWaalsContact C-N 3.35Å; L121-G123 PolarHBondContact O-N 3.44Å; G123-G127 WeakPolarHBondContact O-CA 3.48Å; G123-G127 PolarHBondContact O-N 3.43Å
124	C	72.9	Confident	70.3	Confident	33 Å²	33	49.5 Å²	49.5	22%	0.223	29%	0.29	C	S	.	.	H	α-helix	trans	-65.8	-42.9	176.8	-76.6	0	0	0	0	112.2	I120 L121 G127 A128	I120-C124 WeakPolarHBondContact O-CB 3.27Å; I120-C124 PolarHBondContact O-N 3.31Å; I120-C124 PolarHBondContact O-SG 3.27Å; I120-C124 VanDerWaalsContact O-SG 3.37Å; L121-C124 PolarHBondContact O-N 2.92Å; C124-G127 PolarHBondContact O-N 3.21Å; C124-A128 VanDerWaalsContact O-CB 3.32Å; C124-A128 WeakPolarHBondContact O-CB 3.27Å; C124-A128 PolarHBondContact O-N 3.12Å
125	T	74.7	Confident	71.4	Confident	45 Å²	45	47.8 Å²	47.8	28%	0.276	28%	0.278	S	S	.	.	H	α-helix	trans	-70.8	-44.6	178.7	50.9	0	0	0	0	112.4	Y106 L121 A122 G127 A128 M129	Y106-T125 HydrophobicContact CE2-CG2 4.42Å; Y106-T125 VanDerWaalsContact CE2-OG1 3.31Å; Y106-T125 WeakPolarHBondContact CE2-OG1 3.45Å; Y106-T125 WeakPolarHBondContact OH-CG2 3.2Å; L121-T125 WeakPolarHBondContact O-CG2 3.42Å; L121-T125 PolarHBondContact O-N 3.47Å; L121-T125 PolarHBondContact O-OG1 3.13Å; A122-T125 PolarHBondContact O-OG1 3.36Å; T125-G127 VanDerWaalsContact C-N 3.29Å; T125-G127 PolarHBondContact O-N 3.24Å; T125-A128 PolarHBondContact O-N 3.15Å; T125-M129 WeakPolarHBondContact O-CG 3.45Å; T125-M129 PolarHBondContact O-N 3.06Å
126	T	70.4	Confident	71.9	Confident	16 Å²	16	45.2 Å²	45.2	10%	0.098	26%	0.26	C	S	.	.	H	α-helix	trans	-59.4	-43.8	173	-50	0	0	0	0	110.7	V102 A122 A128 M129 A130	V102-T126 VanDerWaalsContact CB-OG1 3.31Å; V102-T126 WeakPolarHBondContact CB-OG1 3.33Å; V102-T126 WeakPolarHBondContact CG1-OG1 3.46Å; A122-T126 VanDerWaalsContact O-CB 3.31Å; A122-T126 WeakPolarHBondContact O-CB 3.36Å; A122-T126 PolarHBondContact O-N 2.79Å; A122-T126 PolarHBondContact O-OG1 3.04Å; T126-A128 PolarHBondContact O-N 2.64Å; T126-M129 PolarHBondContact O-N 3.23Å; T126-A130 VanDerWaalsContact O-CB 3.31Å; T126-A130 WeakPolarHBondContact O-CB 3.39Å; T126-A130 PolarHBondContact O-N 3.01Å
127	G	69.8	Low	72.3	Confident	9 Å²	9	41.8 Å²	41.8	9%	0.093	24%	0.242	C	C	.	.	H	α-helix	trans	-63.8	-39.1	178.4	0	0	0	0	0	113	G123 C124 T125 V131 N189	G123-G127 WeakPolarHBondContact O-CA 3.48Å; G123-G127 PolarHBondContact O-N 3.43Å; C124-G127 PolarHBondContact O-N 3.21Å; T125-G127 VanDerWaalsContact C-N 3.29Å; T125-G127 PolarHBondContact O-N 3.24Å; G127-V131 WeakPolarHBondContact O-CB 3.43Å; G127-V131 WeakPolarHBondContact O-CG2 3.49Å; G127-V131 PolarHBondContact O-N 2.66Å; G127-N189 WeakPolarHBondContact CA-ND2 3.36Å; G127-N189 PolarHBondContact O-ND2 2.9Å
128	A	76.8	Confident	72.4	Confident	26 Å²	26	39.4 Å²	39.4	22%	0.215	23%	0.226	C	C	.	.	H	α-helix	trans	-65.8	-46.1	176	0	0	0	0	0	111.6	C124 T125 T126 V131 T132 I186	C124-A128 VanDerWaalsContact O-CB 3.32Å; C124-A128 WeakPolarHBondContact O-CB 3.27Å; C124-A128 PolarHBondContact O-N 3.12Å; T125-A128 PolarHBondContact O-N 3.15Å; T126-A128 PolarHBondContact O-N 2.64Å; A128-V131 PolarHBondContact O-N 2.85Å; A128-T132 PolarHBondContact O-N 2.99Å; A128-T132 PolarHBondContact O-OG1 3.28Å; A128-I186 HydrophobicContact CB-CD1 4.4Å; A128-I186 HydrophobicContact CB-CG1 4.44Å; A128-I186 HydrophobicContact CB-CG2 3.89Å
129	M	75.9	Confident	72.5	Confident	95 Å²	95	37.7 Å²	37.7	47%	0.468	22%	0.215	S	C	.	.	H	α-helix	trans	-61.9	-45	176.2	-68.1	-179.7	78.6	0	0	111.5	L98 V102 T125 T126 V131 T132 C133	L98-M129 HydrophobicContact CD2-CB 3.87Å; L98-M129 HydrophobicContact CD2-CE 3.41Å; L98-M129 VanDerWaalsContact CD2-CE 3.41Å; L98-M129 HydrophobicContact CD2-CG 4.48Å; L98-M129 HydrophobicContact CD2-SD 3.84Å; V102-M129 HydrophobicContact CG2-SD 4.45Å; T125-M129 WeakPolarHBondContact O-CG 3.45Å; T125-M129 PolarHBondContact O-N 3.06Å; T126-M129 PolarHBondContact O-N 3.23Å; M129-V131 PolarHBondContact O-N 3.4Å; M129-T132 PolarHBondContact O-N 2.87Å; M129-C133 PolarHBondContact O-N 3.01Å; M129-C133 VanDerWaalsContact O-N 3.13Å
130	A	70.1	Confident	72.7	Confident	6 Å²	6	29.8 Å²	29.8	5%	0.05	19%	0.185	C	C	.	.	H	α-helix	trans	-59.5	-44.9	177.2	0	0	0	0	0	112.3	F91 I94 T126 C133 A134	F91-A130 HydrophobicContact CE2-CB 4.25Å; I94-A130 HydrophobicContact CG2-CB 3.87Å; T126-A130 VanDerWaalsContact O-CB 3.31Å; T126-A130 WeakPolarHBondContact O-CB 3.39Å; T126-A130 PolarHBondContact O-N 3.01Å; A130-C133 PolarHBondContact O-N 2.91Å; A130-A134 VanDerWaalsContact O-CB 3.24Å; A130-A134 WeakPolarHBondContact O-CB 3.36Å; A130-A134 PolarHBondContact O-N 3.21Å
131	V	73.8	Confident	72.8	Confident	14 Å²	14	29 Å²	29	9%	0.085	18%	0.181	C	C	.	.	H	α-helix	trans	-64.7	-40.4	177.3	168.5	0	0	0	0	111.2	G127 A128 M129 C133 A134 Q135 N185 I186 N189	G127-V131 WeakPolarHBondContact O-CB 3.43Å; G127-V131 WeakPolarHBondContact O-CG2 3.49Å; G127-V131 PolarHBondContact O-N 2.66Å; A128-V131 PolarHBondContact O-N 2.85Å; M129-V131 PolarHBondContact O-N 3.4Å; V131-C133 VanDerWaalsContact C-N 3.29Å; V131-C133 PolarHBondContact O-N 2.66Å; V131-A134 PolarHBondContact O-N 2.88Å; V131-Q135 WeakPolarHBondContact O-CA 3.39Å; V131-Q135 VanDerWaalsContact O-CB 3.27Å; V131-Q135 WeakPolarHBondContact O-CB 3.33Å; V131-Q135 PolarHBondContact O-N 3.44Å; V131-N185 HydrophobicContact CG1-CB 3.52Å; V131-I186 HydrophobicContact CB-CG1 4.09Å; V131-I186 HydrophobicContact CG1-CG1 3.76Å; V131-N189 HydrophobicContact CG2-CB 4.16Å
132	T	77.4	Confident	72.5	Confident	52 Å²	52	27.9 Å²	27.9	32%	0.319	18%	0.178	S	C	.	.	H	α-helix	trans	-66.2	-34.8	-177	-47.5	0	0	0	0	111.8	A128 M129 W179 T182	A128-T132 PolarHBondContact O-N 2.99Å; A128-T132 PolarHBondContact O-OG1 3.28Å; M129-T132 PolarHBondContact O-N 2.87Å; T132-W179 PolarHBondContact O-NE1 2.84Å; T132-W179 VanDerWaalsContact O-NE1 3.15Å; T132-T182 HydrophobicContact CG2-CG2 4.29Å
133	C	75.5	Confident	72.5	Confident	80 Å²	80	29.8 Å²	29.8	54%	0.541	18%	0.181	S	C	.	.	H	α-helix	trans	-79.2	-34.8	174.6	-66.8	0	0	0	0	113.1	I94 M129 A130 V131 P136	I94-C133 HydrophobicContact CD1-CB 3.39Å; I94-C133 HydrophobicContact CG1-CB 4.41Å; M129-C133 PolarHBondContact O-N 3.01Å; M129-C133 VanDerWaalsContact O-N 3.13Å; A130-C133 PolarHBondContact O-N 2.91Å; V131-C133 VanDerWaalsContact C-N 3.29Å; V131-C133 PolarHBondContact O-N 2.66Å; C133-P136 WeakPolarHBondContact O-CD 3.36Å
134	A	72.3	Confident	72.6	Confident	3 Å²	3	29.4 Å²	29.4	3%	0.025	17%	0.172	C	C	.	.	H	α-helix	trans	-81.2	-18.9	179	0	0	0	0	0	113.6	A130 V131 P136 T137 D138	A130-A134 VanDerWaalsContact O-CB 3.24Å; A130-A134 WeakPolarHBondContact O-CB 3.36Å; A130-A134 PolarHBondContact O-N 3.21Å; V131-A134 PolarHBondContact O-N 2.88Å; A134-P136 VanDerWaalsContact C-CD 3.44Å; A134-T137 PolarHBondContact O-N 2.98Å; A134-D138 PolarHBondContact O-N 3.03Å
135	Q	76.6	Confident	71.9	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-51.1	-46.4	-174.4	-172.1	72.4	4.6	0	0	114.5	V131 T137 D138 V139 K180 G181 T182 N185	V131-Q135 WeakPolarHBondContact O-CA 3.39Å; V131-Q135 VanDerWaalsContact O-CB 3.27Å; V131-Q135 WeakPolarHBondContact O-CB 3.33Å; V131-Q135 PolarHBondContact O-N 3.44Å; Q135-T137 PolarHBondContact O-N 2.91Å; Q135-D138 PolarHBondContact O-N 2.81Å; Q135-D138 VanDerWaalsContact O-N 3.12Å; Q135-V139 HydrophobicContact CG-CG2 4.25Å; Q135-V139 WeakPolarHBondContact O-CG2 3.39Å; Q135-V139 PolarHBondContact O-N 2.97Å; Q135-K180 PolarHBondContact NE2-O 2.9Å; Q135-G181 PolarHBondContact NE2-O 3.35Å; Q135-T182 WeakPolarHBondContact CG-OG1 3.47Å; Q135-T182 VanDerWaalsContact NE2-N 3.15Å; Q135-N185 VanDerWaalsContact CD-ND2 3.35Å; Q135-N185 PolarHBondContact NE2-ND2 2.96Å; Q135-N185 PolarHBondContact OE1-ND2 2.94Å
136	P	74.4	Confident	71.2	Confident	18 Å²	18	27.8 Å²	27.8	12%	0.117	16%	0.164	C	C	.	.	H	α-helix	trans	-58.9	-35.9	-178	-25.9	37.5	0	0	0	112.4	C133 A134 V140 Y166 L178 W179	C133-P136 WeakPolarHBondContact O-CD 3.36Å; A134-P136 VanDerWaalsContact C-CD 3.44Å; P136-V140 VanDerWaalsContact O-CG2 3.24Å; P136-V140 WeakPolarHBondContact O-CG2 3.16Å; P136-V140 PolarHBondContact O-N 2.89Å; P136-Y166 HydrophobicContact CB-CE1 4.23Å; P136-L178 HydrophobicContact CB-CB 4.16Å; P136-L178 HydrophobicContact CB-CD2 4.04Å; P136-W179 HydrophobicContact CG-CD2 4.45Å; P136-W179 HydrophobicContact CG-CH2 4.23Å; P136-W179 HydrophobicContact CG-CZ2 3.87Å
137	T	74.1	Confident	70.7	Confident	7 Å²	7	27.7 Å²	27.7	4%	0.043	16%	0.164	C	C	.	.	H	α-helix	trans	-72.8	-38.8	178.5	-49	0	0	0	0	111.9	A83 Q86 R87 A134 Q135 V140 K141 Y166	A83-T137 WeakPolarHBondContact O-CG2 3.26Å; Q86-T137 HydrophobicContact CB-CG2 4.26Å; Q86-T137 HydrophobicContact CG-CG2 4.12Å; R87-T137 HydrophobicContact CB-CG2 3.9Å; A134-T137 PolarHBondContact O-N 2.98Å; Q135-T137 PolarHBondContact O-N 2.91Å; T137-V140 PolarHBondContact O-N 3.03Å; T137-K141 WeakPolarHBondContact O-CB 3.18Å; T137-K141 PolarHBondContact O-N 2.89Å; T137-Y166 WeakPolarHBondContact CA-OH 3.48Å; T137-Y166 WeakPolarHBondContact CB-OH 3.1Å; T137-Y166 PolarHBondContact OG1-OH 2.97Å
138	D	71.3	Confident	70.1	Confident	41 Å²	41	28.1 Å²	28.1	22%	0.219	16%	0.164	C	C	.	.	H	α-helix	trans	-63.6	-43.9	176.7	-75.2	-20.2	0	0	0	111.7	R87 A134 Q135 V140 K141 V142	R87-D138 WeakPolarHBondContact CD-OD1 3.42Å; R87-D138 WeakPolarHBondContact CG-OD1 3.19Å; A134-D138 PolarHBondContact O-N 3.03Å; Q135-D138 PolarHBondContact O-N 2.81Å; Q135-D138 VanDerWaalsContact O-N 3.12Å; D138-V140 PolarHBondContact O-N 2.79Å; D138-K141 PolarHBondContact O-N 3.36Å; D138-V142 WeakPolarHBondContact O-CG2 3.38Å; D138-V142 PolarHBondContact O-N 2.78Å
139	V	71.2	Confident	68.9	Low	11 Å²	11	29.8 Å²	29.8	7%	0.067	17%	0.167	C	C	.	.	H	α-helix	trans	-62.4	-43.8	178.3	172.8	0	0	0	0	111.1	Q135 V142 R143 L178 K180	Q135-V139 HydrophobicContact CG-CG2 4.25Å; Q135-V139 WeakPolarHBondContact O-CG2 3.39Å; Q135-V139 PolarHBondContact O-N 2.97Å; V139-V142 PolarHBondContact O-N 3.5Å; V139-R143 HydrophobicContact CG1-CG 4.41Å; V139-R143 WeakPolarHBondContact O-CB 3.49Å; V139-R143 WeakPolarHBondContact O-CG 3.45Å; V139-R143 PolarHBondContact O-N 2.98Å; V139-L178 WeakPolarHBondContact CG2-O 3.34Å; V139-K180 WeakPolarHBondContact CG2-O 3.49Å
140	V	71.6	Confident	67.6	Low	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-65.6	-43.6	178.3	171.3	0	0	0	0	111.1	P136 T137 D138 V142 R143 F144 T162 A165 Y166 I169	P136-V140 VanDerWaalsContact O-CG2 3.24Å; P136-V140 WeakPolarHBondContact O-CG2 3.16Å; P136-V140 PolarHBondContact O-N 2.89Å; T137-V140 PolarHBondContact O-N 3.03Å; D138-V140 PolarHBondContact O-N 2.79Å; V140-V142 PolarHBondContact O-N 2.86Å; V140-R143 PolarHBondContact O-N 3.48Å; V140-F144 WeakPolarHBondContact O-CB 3.4Å; V140-F144 PolarHBondContact O-N 3.04Å; V140-T162 HydrophobicContact CG1-CG2 3.8Å; V140-A165 HydrophobicContact CG1-CB 3.85Å; V140-Y166 HydrophobicContact CB-CE1 4.39Å; V140-Y166 HydrophobicContact CB-CE2 4.23Å; V140-Y166 HydrophobicContact CG1-CD2 4.04Å; V140-Y166 HydrophobicContact CG1-CE2 3.98Å; V140-Y166 HydrophobicContact CG2-CD1 3.55Å; V140-Y166 HydrophobicContact CG2-CD2 4.08Å; V140-Y166 HydrophobicContact CG2-CE1 3.57Å; V140-Y166 HydrophobicContact CG2-CE2 4.08Å; V140-Y166 HydrophobicContact CG2-CG 3.81Å; V140-I169 HydrophobicContact CG2-CD1 3.85Å
141	K	71.4	Confident	66.4	Low	22 Å²	22	31.7 Å²	31.7	10%	0.096	18%	0.181	C	C	.	.	H	α-helix	trans	-58.1	-49.3	177.2	-176.4	-178.3	173.6	-175	0	111.1	A83 T137 D138 Q145	A83-K141 HydrophobicContact CB-CB 4.04Å; A83-K141 HydrophobicContact CB-CG 4.29Å; T137-K141 WeakPolarHBondContact O-CB 3.18Å; T137-K141 PolarHBondContact O-N 2.89Å; D138-K141 PolarHBondContact O-N 3.36Å; K141-Q145 WeakPolarHBondContact O-CB 3.44Å; K141-Q145 VanDerWaalsContact O-CG 3.27Å; K141-Q145 WeakPolarHBondContact O-CG 3.44Å; K141-Q145 PolarHBondContact O-N 2.91Å
142	V	67.2	Low	65.1	Low	66 Å²	66	35 Å²	35	40%	0.4	21%	0.206	S	C	.	.	H	α-helix	trans	-64.7	-46.4	-178.3	173.8	0	0	0	0	111.2	D138 V139 V140 Q145 A146	D138-V142 WeakPolarHBondContact O-CG2 3.38Å; D138-V142 PolarHBondContact O-N 2.78Å; V139-V142 PolarHBondContact O-N 3.5Å; V140-V142 PolarHBondContact O-N 2.86Å; V142-Q145 PolarHBondContact O-N 2.6Å; V142-A146 WeakPolarHBondContact O-CB 3.23Å; V142-A146 PolarHBondContact O-N 3.2Å
143	R	69.1	Low	63.5	Low	54 Å²	54	37.6 Å²	37.6	20%	0.204	23%	0.226	C	C	.	.	H	α-helix	trans	-68	-38.4	179.9	-72.2	179.4	179.1	-141.6	4.5	113	V139 V140 A146 S147 I169 E173	V139-R143 HydrophobicContact CG1-CG 4.41Å; V139-R143 WeakPolarHBondContact O-CB 3.49Å; V139-R143 WeakPolarHBondContact O-CG 3.45Å; V139-R143 PolarHBondContact O-N 2.98Å; V140-R143 PolarHBondContact O-N 3.48Å; R143-A146 PolarHBondContact O-N 2.67Å; R143-S147 WeakPolarHBondContact O-CB 3.32Å; R143-S147 PolarHBondContact O-N 2.91Å; R143-I169 HydrophobicContact CB-CD1 4.36Å; R143-E173 IonicContact CZ-OE1 2.76Å; R143-E173 IonicContact CZ-OE2 3.57Å; R143-E173 IonicContact NH1-OE1 3.75Å; R143-E173 PolarHBondContact NH1-OE1 3.35Å; R143-E173 IonicContact NH1-OE2 2.82Å; R143-E173 PolarHBondContact NH1-OE2 3.12Å; R143-E173 VanDerWaalsContact NH2-CD 3.3Å; R143-E173 IonicContact NH2-OE1 3.49Å; R143-E173 PolarHBondContact NH2-OE1 2.96Å; R143-E173 VanDerWaalsContact NH2-OE1 3.12Å; R143-E173 IonicContact NH2-OE2 3.33Å; R143-E173 PolarHBondContact NH2-OE2 3.41Å
144	F	68.1	Low	61.9	Low	18 Å²	18	37.8 Å²	37.8	8%	0.079	24%	0.241	C	C	.	.	H	α-helix	trans	-63.4	-47.6	176	-174.1	-102.6	0	0	0	110.5	N79 V140 A146 S147 I148 A165	N79-F144 HydrophobicContact CB-CE1 4.47Å; V140-F144 WeakPolarHBondContact O-CB 3.4Å; V140-F144 PolarHBondContact O-N 3.04Å; F144-A146 VanDerWaalsContact C-N 3.31Å; F144-A146 PolarHBondContact O-N 3.24Å; F144-S147 PolarHBondContact O-N 3.44Å; F144-S147 PolarHBondContact O-OG 3.48Å; F144-I148 HydrophobicContact CD1-CD1 3.78Å; F144-I148 HydrophobicContact CE1-CD1 3.47Å; F144-I148 VanDerWaalsContact CE1-CD1 3.47Å; F144-I148 HydrophobicContact CE1-CG1 4.48Å; F144-I148 HydrophobicContact CZ-CD1 3.97Å; F144-I148 WeakPolarHBondContact O-CG1 3.42Å; F144-I148 PolarHBondContact O-N 3.41Å; F144-A165 HydrophobicContact CD2-CB 4.33Å
145	Q	59.3	Low	60.4	Low	13 Å²	13	42.9 Å²	42.9	6%	0.061	28%	0.277	C	S	.	.	H	α-helix	trans	-61	-38.3	175.5	-73.3	-178.8	-11.3	0	0	112.7	K141 V142	K141-Q145 WeakPolarHBondContact O-CB 3.44Å; K141-Q145 VanDerWaalsContact O-CG 3.27Å; K141-Q145 WeakPolarHBondContact O-CG 3.44Å; K141-Q145 PolarHBondContact O-N 2.91Å; V142-Q145 PolarHBondContact O-N 2.6Å
146	A	59.9	Low	59.1	Low	32 Å²	32	49.2 Å²	49.2	26%	0.264	31%	0.31	S	S	.	.	H	α-helix	trans	-67.6	-39.9	175.4	0	0	0	0	0	112.8	I43 V142 R143 F144 I148 H149	I43-A146 HydrophobicContact CD1-CB 4.31Å; V142-A146 WeakPolarHBondContact O-CB 3.23Å; V142-A146 PolarHBondContact O-N 3.2Å; R143-A146 PolarHBondContact O-N 2.67Å; F144-A146 VanDerWaalsContact C-N 3.31Å; F144-A146 PolarHBondContact O-N 3.24Å; A146-I148 PolarHBondContact O-N 2.88Å; A146-H149 WeakPolarHBondContact O-CB 3.43Å; A146-H149 PolarHBondContact O-N 2.83Å
147	S	58.9	Low	58.2	Low	13 Å²	13	56.3 Å²	56.3	9%	0.091	34%	0.335	C	S	.	.	H	α-helix	trans	-66.5	-32.6	-178.7	71.9	0	0	0	0	114.2	R143 F144 H149 L150 G151 Y159	R143-S147 WeakPolarHBondContact O-CB 3.32Å; R143-S147 PolarHBondContact O-N 2.91Å; F144-S147 PolarHBondContact O-N 3.44Å; F144-S147 PolarHBondContact O-OG 3.48Å; S147-H149 PolarHBondContact O-N 3.37Å; S147-L150 PolarHBondContact O-N 3.41Å; S147-G151 PolarHBondContact O-N 3.41Å; S147-Y159 WeakPolarHBondContact OG-CD2 3.2Å
148	I	57.2	Low	57.6	Low	19 Å²	19	61.2 Å²	61.2	10%	0.097	36%	0.355	C	S	.	.	H	α-helix	trans	-63.6	-29.7	178.6	-70	164.2	0	0	0	110.8	N79 F144 A146 G151	N79-I148 HydrophobicContact CB-CD1 3.61Å; F144-I148 HydrophobicContact CD1-CD1 3.78Å; F144-I148 HydrophobicContact CE1-CD1 3.47Å; F144-I148 VanDerWaalsContact CE1-CD1 3.47Å; F144-I148 HydrophobicContact CE1-CG1 4.48Å; F144-I148 HydrophobicContact CZ-CD1 3.97Å; F144-I148 WeakPolarHBondContact O-CG1 3.42Å; F144-I148 PolarHBondContact O-N 3.41Å; A146-I148 PolarHBondContact O-N 2.88Å; I148-G151 PolarHBondContact O-N 2.63Å
149	H	51.1	Low	57.2	Low	60 Å²	60	60 Å²	60	28%	0.278	35%	0.348	S	S	.	.	H	α-helix	trans	-70	-41.8	179	-178.1	59.7	0	0	0	112.9	A146 S147 G151 S152	A146-H149 WeakPolarHBondContact O-CB 3.43Å; A146-H149 PolarHBondContact O-N 2.83Å; S147-H149 PolarHBondContact O-N 3.37Å; H149-G151 VanDerWaalsContact C-N 3.27Å; H149-G151 PolarHBondContact O-N 2.87Å; H149-S152 PolarHBondContact O-OG 2.99Å
150	L	50.3	Low	56.7	Low	125 Å²	125	64.9 Å²	64.9	65%	0.654	38%	0.382	S	S	*	.	H	α-helix	trans	-68.4	-27.6	176.3	-88.4	91.7	0	0	0	112.5	S147 S152	S147-L150 PolarHBondContact O-N 3.41Å; L150-S152 PolarHBondContact O-N 2.97Å; L150-S152 VanDerWaalsContact O-N 3.14Å
151	G	44.9	Very low	56.5	Low	16 Å²	16	65.9 Å²	65.9	17%	0.165	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	9.5	-176.8	0	0	0	0	0	116.2	S147 I148 H149 S153	S147-G151 PolarHBondContact O-N 3.41Å; I148-G151 PolarHBondContact O-N 2.63Å; H149-G151 VanDerWaalsContact C-N 3.27Å; H149-G151 PolarHBondContact O-N 2.87Å; G151-S153 PolarHBondContact O-N 3.22Å; G151-S153 VanDerWaalsContact O-N 3.17Å
152	S	45.8	Very low	56.4	Low	85 Å²	85	65.8 Å²	65.8	59%	0.594	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-14.4	178.9	-49.3	0	0	0	0	113.4	H149 L150	H149-S152 PolarHBondContact O-OG 2.99Å; L150-S152 PolarHBondContact O-N 2.97Å; L150-S152 VanDerWaalsContact O-N 3.14Å
153	S	43.2	Very low	56.7	Low	106 Å²	106	69.8 Å²	69.8	74%	0.741	41%	0.41	S	S	*	.	S	Bend	trans	-103.4	66.6	172	-67.3	0	0	0	0	111.1	G151 S155	G151-S153 PolarHBondContact O-N 3.22Å; G151-S153 VanDerWaalsContact O-N 3.17Å; S153-S155 PolarHBondContact O-N 3.43Å
154	G	41.7	Very low	57.1	Low	84 Å²	84	70.1 Å²	70.1	87%	0.866	42%	0.417	S	S	*	.	S	Bend	trans	55.2	-17.8	150.4	0	0	0	0	0	122.5
155	S	42.3	Very low	57.3	Low	110 Å²	110	69.3 Å²	69.3	77%	0.769	41%	0.413	S	S	*	.	S	Bend	trans	-140.9	-1.8	-164.7	-163	0	0	0	0	115.8	S153	S153-S155 PolarHBondContact O-N 3.43Å
156	D	47.5	Very low	58.1	Low	133 Å²	133	70.5 Å²	70.5	71%	0.711	42%	0.417	S	S	*	.			trans	-139.7	52.5	-172.9	-134.7	5	0	0	0	113.6	K158	D156-K158 PolarHBondContact O-N 3.37Å
157	R	55.9	Low	59	Low	168 Å²	168	78.2 Å²	78.2	63%	0.634	44%	0.439	S	S	*	.			trans	-69.1	99.1	164.9	-88.1	-176.4	163.5	-178.7	-4	108.4	Y159	R157-Y159 PolarHBondContact O-N 2.9Å; R157-Y159 VanDerWaalsContact O-N 3.07Å
158	K	61.1	Low	59.9	Low	109 Å²	109	79 Å²	79	47%	0.474	44%	0.444	S	S	.	.	S	Bend	trans	-57	-23	179.1	-171.7	168.2	177.7	173.2	0	114.1	D156 E172	D156-K158 PolarHBondContact O-N 3.37Å; K158-E172 WeakPolarHBondContact CE-OE2 3.3Å; K158-E172 IonicContact NZ-OE1 3.33Å; K158-E172 IonicContact NZ-OE2 3.46Å; K158-E172 PolarHBondContact NZ-OE2 2.86Å
159	Y	63.3	Low	60.7	Low	16 Å²	16	78.2 Å²	78.2	6%	0.063	44%	0.439	C	S	.	.			trans	-136.9	129.7	175.9	-49.1	-65.9	0	0	0	111.4	S147 R157 A165 T168	S147-Y159 WeakPolarHBondContact OG-CD2 3.2Å; R157-Y159 PolarHBondContact O-N 2.9Å; R157-Y159 VanDerWaalsContact O-N 3.07Å; Y159-A165 HydrophobicContact CD1-CB 3.86Å; Y159-A165 HydrophobicContact CD2-CB 4.29Å; Y159-A165 HydrophobicContact CE1-CB 4.41Å; Y159-A165 HydrophobicContact CG-CB 3.8Å; Y159-T168 HydrophobicContact CD1-CG2 4.2Å; Y159-T168 HydrophobicContact CE1-CG2 3.64Å
160	S	61.1	Low	62.1	Low	113 Å²	113	77.3 Å²	77.3	79%	0.79	44%	0.442	S	S	*	.	S	Bend	trans	-86.7	-13.6	177.7	-170.9	0	0	0	0	113.3	D164	S160-D164 PolarHBondContact N-OD2 3.5Å
161	G	68.2	Low	63.5	Low	22 Å²	22	82 Å²	82	23%	0.227	45%	0.451	C	S	.	.	S	Bend	trans	-173.3	172.7	178.9	0	0	0	0	0	113.2	M163 D164 A165	G161-M163 VanDerWaalsContact C-N 3.35Å; G161-M163 PolarHBondContact O-N 3.33Å; G161-D164 WeakPolarHBondContact O-CB 3.46Å; G161-D164 PolarHBondContact O-N 3.14Å; G161-A165 PolarHBondContact O-N 3.13Å
162	T	67.9	Low	65.1	Low	20 Å²	20	86.5 Å²	86.5	12%	0.123	47%	0.468	C	S	.	.	H	α-helix	trans	-61.1	-41.8	-178.9	-53.5	0	0	0	0	112.1	A83 V140 A165 Y166	A83-T162 HydrophobicContact CB-CG2 3.84Å; V140-T162 HydrophobicContact CG1-CG2 3.8Å; T162-A165 WeakPolarHBondContact O-CB 3.26Å; T162-A165 PolarHBondContact O-N 3.45Å; T162-Y166 HydrophobicContact CG2-CD2 4.16Å; T162-Y166 HydrophobicContact CG2-CE2 3.86Å; T162-Y166 WeakPolarHBondContact O-CD2 3.27Å; T162-Y166 PolarHBondContact O-N 2.71Å
163	M	73.7	Confident	66.4	Low	149 Å²	149	86.4 Å²	86.4	73%	0.734	46%	0.459	S	S	*	.	H	α-helix	trans	-67.7	-36.7	177.7	-167.9	62.8	69.5	0	0	112.4	G161 Y166 R167	G161-M163 VanDerWaalsContact C-N 3.35Å; G161-M163 PolarHBondContact O-N 3.33Å; M163-Y166 WeakPolarHBondContact O-CB 2.91Å; M163-Y166 PolarHBondContact O-N 2.87Å; M163-R167 PolarHBondContact O-N 3.11Å
164	D	77.8	Confident	68	Low	62 Å²	62	82.8 Å²	82.8	33%	0.332	44%	0.438	S	S	.	.	H	α-helix	trans	-66.9	-39.5	175.1	-173.3	39.1	0	0	0	110.9	S160 G161 Y166 R167 T168	S160-D164 PolarHBondContact N-OD2 3.5Å; G161-D164 WeakPolarHBondContact O-CB 3.46Å; G161-D164 PolarHBondContact O-N 3.14Å; D164-Y166 PolarHBondContact O-N 3.09Å; D164-R167 PolarHBondContact O-N 3.43Å; D164-T168 WeakPolarHBondContact O-CB 3.31Å; D164-T168 PolarHBondContact O-N 3.07Å; D164-T168 PolarHBondContact O-OG1 3.32Å
165	A	71.5	Confident	69.7	Low	0 Å²	0	83.6 Å²	83.6	0%	0	43%	0.426	C	S	.	.	H	α-helix	trans	-61.4	-43.4	171.7	0	0	0	0	0	112.5	V140 F144 Y159 G161 T162 R167 I169	V140-A165 HydrophobicContact CG1-CB 3.85Å; F144-A165 HydrophobicContact CD2-CB 4.33Å; Y159-A165 HydrophobicContact CD1-CB 3.86Å; Y159-A165 HydrophobicContact CD2-CB 4.29Å; Y159-A165 HydrophobicContact CE1-CB 4.41Å; Y159-A165 HydrophobicContact CG-CB 3.8Å; G161-A165 PolarHBondContact O-N 3.13Å; T162-A165 WeakPolarHBondContact O-CB 3.26Å; T162-A165 PolarHBondContact O-N 3.45Å; A165-R167 VanDerWaalsContact C-N 3.34Å; A165-R167 PolarHBondContact O-N 3.5Å; A165-I169 WeakPolarHBondContact O-CB 3.34Å; A165-I169 VanDerWaalsContact O-CD1 3.25Å; A165-I169 WeakPolarHBondContact O-CD1 3.42Å; A165-I169 WeakPolarHBondContact O-CG1 3.21Å; A165-I169 PolarHBondContact O-N 2.68Å
166	Y	76.5	Confident	71.2	Confident	39 Å²	39	89.1 Å²	89.1	15%	0.153	43%	0.43	C	S	.	.	H	α-helix	trans	-56.5	-48.4	173.1	-85.9	-76.4	0	0	0	111.8	Q86 P136 T137 V140 T162 M163 D164 A170 L178	Q86-Y166 PolarHBondContact NE2-OH 3.43Å; P136-Y166 HydrophobicContact CB-CE1 4.23Å; T137-Y166 WeakPolarHBondContact CA-OH 3.48Å; T137-Y166 WeakPolarHBondContact CB-OH 3.1Å; T137-Y166 PolarHBondContact OG1-OH 2.97Å; V140-Y166 HydrophobicContact CB-CE1 4.39Å; V140-Y166 HydrophobicContact CB-CE2 4.23Å; V140-Y166 HydrophobicContact CG1-CD2 4.04Å; V140-Y166 HydrophobicContact CG1-CE2 3.98Å; V140-Y166 HydrophobicContact CG2-CD1 3.55Å; V140-Y166 HydrophobicContact CG2-CD2 4.08Å; V140-Y166 HydrophobicContact CG2-CE1 3.57Å; V140-Y166 HydrophobicContact CG2-CE2 4.08Å; V140-Y166 HydrophobicContact CG2-CG 3.81Å; T162-Y166 HydrophobicContact CG2-CD2 4.16Å; T162-Y166 HydrophobicContact CG2-CE2 3.86Å; T162-Y166 WeakPolarHBondContact O-CD2 3.27Å; T162-Y166 PolarHBondContact O-N 2.71Å; M163-Y166 WeakPolarHBondContact O-CB 2.91Å; M163-Y166 PolarHBondContact O-N 2.87Å; D164-Y166 PolarHBondContact O-N 3.09Å; Y166-A170 VanDerWaalsContact O-CB 3.27Å; Y166-A170 WeakPolarHBondContact O-CB 3.48Å; Y166-A170 PolarHBondContact O-N 3.39Å; Y166-L178 HydrophobicContact CD1-CD2 3.84Å; Y166-L178 HydrophobicContact CE1-CD2 4.23Å
167	R	79.2	Confident	72.2	Confident	194 Å²	194	83 Å²	83	73%	0.732	40%	0.398	S	S	*	.	H	α-helix	trans	-66.5	-44.1	-177	-169.4	177.1	-173.6	173	1.5	112.1	M163 D164 A165 A170 R171	M163-R167 PolarHBondContact O-N 3.11Å; D164-R167 PolarHBondContact O-N 3.43Å; A165-R167 VanDerWaalsContact C-N 3.34Å; A165-R167 PolarHBondContact O-N 3.5Å; R167-A170 PolarHBondContact O-N 3.22Å; R167-R171 WeakPolarHBondContact O-CB 3.35Å; R167-R171 PolarHBondContact O-N 3.4Å
168	T	77.6	Confident	73	Confident	30 Å²	30	75.9 Å²	75.9	18%	0.184	37%	0.372	C	S	.	.	H	α-helix	trans	-69.6	-40.9	-178.1	-60.4	0	0	0	0	111.4	Y159 D164 R171 E172	Y159-T168 HydrophobicContact CD1-CG2 4.2Å; Y159-T168 HydrophobicContact CE1-CG2 3.64Å; D164-T168 WeakPolarHBondContact O-CB 3.31Å; D164-T168 PolarHBondContact O-N 3.07Å; D164-T168 PolarHBondContact O-OG1 3.32Å; T168-R171 PolarHBondContact O-N 3.04Å; T168-E172 HydrophobicContact CG2-CG 4.25Å; T168-E172 WeakPolarHBondContact CG2-OE1 3.31Å; T168-E172 WeakPolarHBondContact O-CB 3.35Å; T168-E172 WeakPolarHBondContact O-CG 3.31Å; T168-E172 PolarHBondContact O-N 3.47Å
169	I	75.3	Confident	73.8	Confident	1 Å²	1	75.6 Å²	75.6	1%	0.005	37%	0.369	C	S	.	.	H	α-helix	trans	-63.4	-44.8	174.1	-64.5	162.4	0	0	0	110.6	V140 R143 A165 R171 E173 L178	V140-I169 HydrophobicContact CG2-CD1 3.85Å; R143-I169 HydrophobicContact CB-CD1 4.36Å; A165-I169 WeakPolarHBondContact O-CB 3.34Å; A165-I169 VanDerWaalsContact O-CD1 3.25Å; A165-I169 WeakPolarHBondContact O-CD1 3.42Å; A165-I169 WeakPolarHBondContact O-CG1 3.21Å; A165-I169 PolarHBondContact O-N 2.68Å; I169-R171 VanDerWaalsContact C-N 3.25Å; I169-R171 PolarHBondContact O-N 3.43Å; I169-E173 PolarHBondContact O-N 2.9Å; I169-L178 HydrophobicContact CG2-CD1 3.88Å; I169-L178 HydrophobicContact CG2-CG 4.23Å
170	A	79.5	Confident	74	Confident	41 Å²	41	81.2 Å²	81.2	34%	0.339	39%	0.393	S	S	.	.	H	α-helix	trans	-63.6	-31.8	178.2	0	0	0	0	0	112.6	Y166 R167 G174 L178	Y166-A170 VanDerWaalsContact O-CB 3.27Å; Y166-A170 WeakPolarHBondContact O-CB 3.48Å; Y166-A170 PolarHBondContact O-N 3.39Å; R167-A170 PolarHBondContact O-N 3.22Å; A170-G174 CarbonylContact O-C 3.56Å; A170-G174 WeakPolarHBondContact O-CA 3.44Å; A170-G174 PolarHBondContact O-N 3.38Å; A170-L178 HydrophobicContact CB-CD1 4.02Å
171	R	80.8	Confident	74.2	Confident	223 Å²	223	76.8 Å²	76.8	84%	0.842	37%	0.365	S	S	*	.	H	α-helix	trans	-80.7	-40	179.2	-168.5	-179.7	-176.7	-164.8	0.3	113.1	R167 T168 I169	R167-R171 WeakPolarHBondContact O-CB 3.35Å; R167-R171 PolarHBondContact O-N 3.4Å; T168-R171 PolarHBondContact O-N 3.04Å; I169-R171 VanDerWaalsContact C-N 3.25Å; I169-R171 PolarHBondContact O-N 3.43Å
172	E	77.9	Confident	74.5	Confident	112 Å²	112	76.6 Å²	76.6	52%	0.523	36%	0.36	S	S	.	.	H	α-helix	trans	-82.6	-43.2	-176.6	-70.4	-177.6	-178.2	0	0	112.9	K158 T168	K158-E172 WeakPolarHBondContact CE-OE2 3.3Å; K158-E172 IonicContact NZ-OE1 3.33Å; K158-E172 IonicContact NZ-OE2 3.46Å; K158-E172 PolarHBondContact NZ-OE2 2.86Å; T168-E172 HydrophobicContact CG2-CG 4.25Å; T168-E172 WeakPolarHBondContact CG2-OE1 3.31Å; T168-E172 WeakPolarHBondContact O-CB 3.35Å; T168-E172 WeakPolarHBondContact O-CG 3.31Å; T168-E172 PolarHBondContact O-N 3.47Å
173	E	71.8	Confident	74.7	Confident	83 Å²	83	81.5 Å²	81.5	39%	0.388	39%	0.385	S	S	.	.	S	Bend	trans	-111.4	-1.2	-174.7	-68.6	-173.5	-156.5	0	0	113.5	R143 I169	R143-E173 IonicContact CZ-OE1 2.76Å; R143-E173 IonicContact CZ-OE2 3.57Å; R143-E173 IonicContact NH1-OE1 3.75Å; R143-E173 PolarHBondContact NH1-OE1 3.35Å; R143-E173 IonicContact NH1-OE2 2.82Å; R143-E173 PolarHBondContact NH1-OE2 3.12Å; R143-E173 VanDerWaalsContact NH2-CD 3.3Å; R143-E173 IonicContact NH2-OE1 3.49Å; R143-E173 PolarHBondContact NH2-OE1 2.96Å; R143-E173 VanDerWaalsContact NH2-OE1 3.12Å; R143-E173 IonicContact NH2-OE2 3.33Å; R143-E173 PolarHBondContact NH2-OE2 3.41Å; I169-E173 PolarHBondContact O-N 2.9Å
174	G	78.6	Confident	74.5	Confident	30 Å²	30	75.7 Å²	75.7	31%	0.309	36%	0.358	S	S	.	.			trans	73.5	176.9	-174.9	0	0	0	0	0	113.2	A170 R176 G177	A170-G174 CarbonylContact O-C 3.56Å; A170-G174 WeakPolarHBondContact O-CA 3.44Å; A170-G174 PolarHBondContact O-N 3.38Å; G174-R176 PolarHBondContact O-N 2.9Å; G174-G177 PolarHBondContact O-N 3.23Å
175	V	76.3	Confident	74.3	Confident	101 Å²	101	73.5 Å²	73.5	61%	0.612	35%	0.346	S	S	*	.	H	α-helix	trans	-56.2	-37	177.6	-178.8	0	0	0	0	110.7	G177 L178 W179	V175-G177 PolarHBondContact O-N 2.96Å; V175-L178 PolarHBondContact O-N 2.97Å; V175-L178 VanDerWaalsContact O-N 3.12Å; V175-W179 HydrophobicContact CG1-CE3 4.2Å; V175-W179 HydrophobicContact CG1-CH2 4.16Å; V175-W179 HydrophobicContact CG1-CZ3 3.42Å; V175-W179 VanDerWaalsContact CG1-CZ3 3.42Å; V175-W179 WeakPolarHBondContact O-CZ3 3.41Å
176	R	72.9	Confident	74.6	Confident	226 Å²	226	75.6 Å²	75.6	85%	0.853	36%	0.357	S	S	*	.	H	α-helix	trans	-64.3	-24	179.5	-148.1	173.2	-175.3	-179.7	0.8	113.4	G174 L178 W179 K180	G174-R176 PolarHBondContact O-N 2.9Å; R176-L178 VanDerWaalsContact C-N 3.3Å; R176-L178 PolarHBondContact O-N 3.37Å; R176-W179 PolarHBondContact O-N 2.91Å; R176-K180 PolarHBondContact O-N 3.34Å
177	G	69.6	Low	74.6	Confident	5 Å²	5	78.8 Å²	78.8	5%	0.052	37%	0.374	C	S	.	.	H	α-helix	trans	-63.9	-31.3	173.9	0	0	0	0	0	113.5	G174 V175 W179 K180	G174-G177 PolarHBondContact O-N 3.23Å; V175-G177 PolarHBondContact O-N 2.96Å; G177-W179 VanDerWaalsContact C-N 3.3Å; G177-W179 PolarHBondContact O-N 2.91Å; G177-K180 VanDerWaalsContact O-CB 3.22Å; G177-K180 WeakPolarHBondContact O-CB 3.4Å; G177-K180 PolarHBondContact O-N 3.47Å
178	L	73.6	Confident	74.4	Confident	17 Å²	17	72.6 Å²	72.6	9%	0.089	35%	0.351	C	S	.	.	H	α-helix	trans	-72	-24	178.3	-74.4	81.8	0	0	0	112.7	P136 V139 Y166 I169 A170 V175 R176	P136-L178 HydrophobicContact CB-CB 4.16Å; P136-L178 HydrophobicContact CB-CD2 4.04Å; V139-L178 WeakPolarHBondContact CG2-O 3.34Å; Y166-L178 HydrophobicContact CD1-CD2 3.84Å; Y166-L178 HydrophobicContact CE1-CD2 4.23Å; I169-L178 HydrophobicContact CG2-CD1 3.88Å; I169-L178 HydrophobicContact CG2-CG 4.23Å; A170-L178 HydrophobicContact CB-CD1 4.02Å; V175-L178 PolarHBondContact O-N 2.97Å; V175-L178 VanDerWaalsContact O-N 3.12Å; R176-L178 VanDerWaalsContact C-N 3.3Å; R176-L178 PolarHBondContact O-N 3.37Å
179	W	76.8	Confident	74.3	Confident	104 Å²	104	73 Å²	73	39%	0.394	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	8	174.9	-77	-92.8	0	0	0	113	T132 P136 V175 R176 G177 G181 T182	T132-W179 PolarHBondContact O-NE1 2.84Å; T132-W179 VanDerWaalsContact O-NE1 3.15Å; P136-W179 HydrophobicContact CG-CD2 4.45Å; P136-W179 HydrophobicContact CG-CH2 4.23Å; P136-W179 HydrophobicContact CG-CZ2 3.87Å; V175-W179 HydrophobicContact CG1-CE3 4.2Å; V175-W179 HydrophobicContact CG1-CH2 4.16Å; V175-W179 HydrophobicContact CG1-CZ3 3.42Å; V175-W179 VanDerWaalsContact CG1-CZ3 3.42Å; V175-W179 WeakPolarHBondContact O-CZ3 3.41Å; R176-W179 PolarHBondContact O-N 2.91Å; G177-W179 VanDerWaalsContact C-N 3.3Å; G177-W179 PolarHBondContact O-N 2.91Å; W179-G181 PolarHBondContact O-N 3.44Å; W179-T182 WeakPolarHBondContact CB-OG1 3.25Å; W179-T182 WeakPolarHBondContact O-CB 3.44Å; W179-T182 PolarHBondContact O-N 2.96Å; W179-T182 VanDerWaalsContact O-N 3.09Å; W179-T182 PolarHBondContact O-OG1 2.87Å
180	K	67.3	Low	74.3	Confident	134 Å²	134	74.5 Å²	74.5	58%	0.583	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	125.6	175.6	-163.6	172.5	-178.1	179	0	109.1	Q135 V139 R176 G177	Q135-K180 PolarHBondContact NE2-O 2.9Å; V139-K180 WeakPolarHBondContact CG2-O 3.49Å; R176-K180 PolarHBondContact O-N 3.34Å; G177-K180 VanDerWaalsContact O-CB 3.22Å; G177-K180 WeakPolarHBondContact O-CB 3.4Å; G177-K180 PolarHBondContact O-N 3.47Å
181	G	66.6	Low	74.2	Confident	19 Å²	19	75.6 Å²	75.6	20%	0.196	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.2	8.9	-176.4	0	0	0	0	0	115.8	Q135 W179 L183 P184 N185	Q135-G181 PolarHBondContact NE2-O 3.35Å; W179-G181 PolarHBondContact O-N 3.44Å; G181-L183 PolarHBondContact O-N 3.39Å; G181-P184 VanDerWaalsContact O-CD 3.31Å; G181-P184 WeakPolarHBondContact O-CD 3.27Å; G181-P184 VanDerWaalsContact O-CG 3.3Å; G181-P184 WeakPolarHBondContact O-CG 3.47Å; G181-N185 WeakPolarHBondContact O-CB 3.31Å; G181-N185 PolarHBondContact O-N 2.88Å; G181-N185 VanDerWaalsContact O-N 3.13Å
182	T	73.4	Confident	73.9	Confident	19 Å²	19	66.3 Å²	66.3	12%	0.117	33%	0.332	C	S	.	.	H	α-helix	trans	-59.6	-48.4	177.1	-53.1	0	0	0	0	111.1	T132 Q135 W179 N185 I186	T132-T182 HydrophobicContact CG2-CG2 4.29Å; Q135-T182 WeakPolarHBondContact CG-OG1 3.47Å; Q135-T182 VanDerWaalsContact NE2-N 3.15Å; W179-T182 WeakPolarHBondContact CB-OG1 3.25Å; W179-T182 WeakPolarHBondContact O-CB 3.44Å; W179-T182 PolarHBondContact O-N 2.96Å; W179-T182 VanDerWaalsContact O-N 3.09Å; W179-T182 PolarHBondContact O-OG1 2.87Å; T182-N185 WeakPolarHBondContact O-CB 3.17Å; T182-N185 PolarHBondContact O-N 3.29Å; T182-N185 VanDerWaalsContact O-N 3.14Å; T182-I186 HydrophobicContact CG2-CD1 3.72Å; T182-I186 HydrophobicContact CG2-CG1 4.21Å; T182-I186 WeakPolarHBondContact O-CG1 3.4Å; T182-I186 PolarHBondContact O-N 3.49Å
183	L	72.6	Confident	73.7	Confident	123 Å²	123	63.1 Å²	63.1	64%	0.644	32%	0.319	S	S	*	.	H	α-helix	trans	-58.4	-51.8	-178.9	-174	68.7	0	0	0	113	G181 N185 I186 M187	G181-L183 PolarHBondContact O-N 3.39Å; L183-N185 VanDerWaalsContact C-N 3.26Å; L183-N185 PolarHBondContact O-N 3.46Å; L183-I186 PolarHBondContact O-N 3.48Å; L183-M187 WeakPolarHBondContact O-CG 3.25Å; L183-M187 PolarHBondContact O-N 3.32Å
184	P	69.8	Low	73.7	Confident	27 Å²	27	61.4 Å²	61.4	18%	0.175	32%	0.315	C	S	.	.	H	α-helix	trans	-64.4	-29	176.1	20.6	-30.2	0	0	0	113.1	G181 R188	G181-P184 VanDerWaalsContact O-CD 3.31Å; G181-P184 WeakPolarHBondContact O-CD 3.27Å; G181-P184 VanDerWaalsContact O-CG 3.3Å; G181-P184 WeakPolarHBondContact O-CG 3.47Å; P184-R188 WeakPolarHBondContact O-CB 3.47Å; P184-R188 PolarHBondContact O-N 2.89Å
185	N	73.2	Confident	73.5	Confident	15 Å²	15	60.6 Å²	60.6	8%	0.08	31%	0.306	C	S	.	.	H	α-helix	trans	-68.8	-42.1	173.2	-79.1	-7.8	0	0	0	112.6	V131 Q135 G181 T182 L183 R188 N189 K242	V131-N185 HydrophobicContact CG1-CB 3.52Å; Q135-N185 VanDerWaalsContact CD-ND2 3.35Å; Q135-N185 PolarHBondContact NE2-ND2 2.96Å; Q135-N185 PolarHBondContact OE1-ND2 2.94Å; G181-N185 WeakPolarHBondContact O-CB 3.31Å; G181-N185 PolarHBondContact O-N 2.88Å; G181-N185 VanDerWaalsContact O-N 3.13Å; T182-N185 WeakPolarHBondContact O-CB 3.17Å; T182-N185 PolarHBondContact O-N 3.29Å; T182-N185 VanDerWaalsContact O-N 3.14Å; L183-N185 VanDerWaalsContact C-N 3.26Å; L183-N185 PolarHBondContact O-N 3.46Å; N185-R188 PolarHBondContact O-N 3.4Å; N185-N189 WeakPolarHBondContact O-CB 3.24Å; N185-N189 PolarHBondContact O-N 2.97Å; N185-K242 WeakPolarHBondContact OD1-CE 3.39Å; N185-K242 PolarHBondContact OD1-NZ 2.96Å
186	I	77.7	Confident	73.2	Confident	45 Å²	45	60 Å²	60	23%	0.231	30%	0.297	C	S	.	.	H	α-helix	trans	-63.4	-47.1	175.4	-67.6	173.2	0	0	0	110.1	A128 V131 T182 L183 R188 N189 A190	A128-I186 HydrophobicContact CB-CD1 4.4Å; A128-I186 HydrophobicContact CB-CG1 4.44Å; A128-I186 HydrophobicContact CB-CG2 3.89Å; V131-I186 HydrophobicContact CB-CG1 4.09Å; V131-I186 HydrophobicContact CG1-CG1 3.76Å; T182-I186 HydrophobicContact CG2-CD1 3.72Å; T182-I186 HydrophobicContact CG2-CG1 4.21Å; T182-I186 WeakPolarHBondContact O-CG1 3.4Å; T182-I186 PolarHBondContact O-N 3.49Å; L183-I186 PolarHBondContact O-N 3.48Å; I186-R188 PolarHBondContact O-N 3.42Å; I186-N189 PolarHBondContact O-N 3.42Å; I186-A190 WeakPolarHBondContact O-CB 3.17Å; I186-A190 PolarHBondContact O-N 2.91Å
187	M	75.9	Confident	73	Confident	105 Å²	105	51.3 Å²	51.3	52%	0.517	27%	0.268	S	S	.	.	H	α-helix	trans	-60.5	-45	178.5	-71.2	-176.3	81.5	0	0	112	L183 N189 A190 I191	L183-M187 WeakPolarHBondContact O-CG 3.25Å; L183-M187 PolarHBondContact O-N 3.32Å; M187-N189 VanDerWaalsContact C-N 3.34Å; M187-N189 PolarHBondContact O-N 2.94Å; M187-A190 PolarHBondContact O-N 3.4Å; M187-I191 VanDerWaalsContact O-CG1 3.31Å; M187-I191 WeakPolarHBondContact O-CG1 3.26Å; M187-I191 PolarHBondContact O-N 2.9Å
188	R	75.8	Confident	73.2	Confident	64 Å²	64	54.4 Å²	54.4	24%	0.242	29%	0.286	C	S	.	.	H	α-helix	trans	-56.4	-49.9	173.6	178.3	-148.4	159.1	110	11.5	110.8	P184 N185 I186 A190 I191 V192 V238 D239	P184-R188 WeakPolarHBondContact O-CB 3.47Å; P184-R188 PolarHBondContact O-N 2.89Å; N185-R188 PolarHBondContact O-N 3.4Å; I186-R188 PolarHBondContact O-N 3.42Å; R188-A190 VanDerWaalsContact C-N 3.3Å; R188-A190 PolarHBondContact O-N 3.43Å; R188-I191 PolarHBondContact O-N 3.4Å; R188-V192 HydrophobicContact CG-CG2 4.34Å; R188-V192 VanDerWaalsContact O-CG2 3.26Å; R188-V192 WeakPolarHBondContact O-CG2 3.28Å; R188-V192 PolarHBondContact O-N 2.99Å; R188-V238 HydrophobicContact CB-CG1 4.21Å; R188-V238 HydrophobicContact CG-CG1 4.35Å; R188-D239 VanDerWaalsContact CZ-CG 3.45Å; R188-D239 IonicContact CZ-OD1 2.7Å; R188-D239 IonicContact CZ-OD2 2.61Å; R188-D239 IonicContact NE-OD1 3.3Å; R188-D239 PolarHBondContact NE-OD1 3.19Å; R188-D239 IonicContact NH1-OD1 2.82Å; R188-D239 PolarHBondContact NH1-OD1 2.93Å; R188-D239 IonicContact NH1-OD2 3.3Å; R188-D239 PolarHBondContact NH1-OD2 3.27Å; R188-D239 IonicContact NH2-OD1 3.11Å; R188-D239 PolarHBondContact NH2-OD1 3.5Å; R188-D239 IonicContact NH2-OD2 3.41Å; R188-D239 PolarHBondContact NH2-OD2 3.05Å
189	N	74.7	Confident	73.2	Confident	39 Å²	39	54.6 Å²	54.6	21%	0.209	29%	0.288	C	S	.	.	H	α-helix	trans	-63.3	-38.2	-177.1	-160.9	25.8	0	0	0	111.9	G127 V131 N185 I186 M187 N193	G127-N189 WeakPolarHBondContact CA-ND2 3.36Å; G127-N189 PolarHBondContact O-ND2 2.9Å; V131-N189 HydrophobicContact CG2-CB 4.16Å; N185-N189 WeakPolarHBondContact O-CB 3.24Å; N185-N189 PolarHBondContact O-N 2.97Å; I186-N189 PolarHBondContact O-N 3.42Å; M187-N189 VanDerWaalsContact C-N 3.34Å; M187-N189 PolarHBondContact O-N 2.94Å; N189-N193 WeakPolarHBondContact O-CB 3.5Å; N189-N193 PolarHBondContact O-N 3.1Å; N189-N193 PolarHBondContact O-ND2 2.86Å
190	A	75.3	Confident	72.8	Confident	32 Å²	32	53 Å²	53	26%	0.264	28%	0.282	S	S	.	.	H	α-helix	trans	-62.9	-46.7	174.5	0	0	0	0	0	111.9	I186 M187 R188 V192 N193 C194	I186-A190 WeakPolarHBondContact O-CB 3.17Å; I186-A190 PolarHBondContact O-N 2.91Å; M187-A190 PolarHBondContact O-N 3.4Å; R188-A190 VanDerWaalsContact C-N 3.3Å; R188-A190 PolarHBondContact O-N 3.43Å; A190-V192 PolarHBondContact O-N 3.35Å; A190-N193 PolarHBondContact O-N 3.46Å; A190-C194 WeakPolarHBondContact O-CB 3.41Å; A190-C194 PolarHBondContact O-N 3.03Å; A190-C194 PolarHBondContact O-SG 2.68Å
191	I	77.9	Confident	72.9	Confident	64 Å²	64	48 Å²	48	33%	0.328	26%	0.262	S	S	.	.	H	α-helix	trans	-63.4	-44.2	179.5	-65.4	164.5	0	0	0	111	M187 R188 C194 A195 V234 V238	M187-I191 VanDerWaalsContact O-CG1 3.31Å; M187-I191 WeakPolarHBondContact O-CG1 3.26Å; M187-I191 PolarHBondContact O-N 2.9Å; R188-I191 PolarHBondContact O-N 3.4Å; I191-C194 PolarHBondContact O-N 3.2Å; I191-A195 WeakPolarHBondContact O-CB 3.43Å; I191-A195 PolarHBondContact O-N 3.49Å; I191-V234 HydrophobicContact CG2-CG1 4.47Å; I191-V238 HydrophobicContact CD1-CG1 4.02Å; I191-V238 HydrophobicContact CD1-CG2 3.78Å; I191-V238 HydrophobicContact CG2-CG2 4.08Å
192	V	74.5	Confident	73.3	Confident	29 Å²	29	51.4 Å²	51.4	18%	0.176	28%	0.275	C	S	.	.	H	α-helix	trans	-61.8	-49.3	178.2	174.4	0	0	0	0	110.8	R188 A190 C194 A195 E196 A235	R188-V192 HydrophobicContact CG-CG2 4.34Å; R188-V192 VanDerWaalsContact O-CG2 3.26Å; R188-V192 WeakPolarHBondContact O-CG2 3.28Å; R188-V192 PolarHBondContact O-N 2.99Å; A190-V192 PolarHBondContact O-N 3.35Å; V192-C194 PolarHBondContact O-N 3.48Å; V192-A195 PolarHBondContact O-N 3.33Å; V192-E196 WeakPolarHBondContact O-CB 3.27Å; V192-E196 PolarHBondContact O-N 2.99Å; V192-A235 HydrophobicContact CG2-CB 3.68Å
193	N	73.9	Confident	73.2	Confident	44 Å²	44	52.4 Å²	52.4	24%	0.235	28%	0.279	C	S	.	.	H	α-helix	trans	-60.9	-44.3	178.4	-88.4	-33.5	0	0	0	112	N189 A190 A195 E196 V197	N189-N193 WeakPolarHBondContact O-CB 3.5Å; N189-N193 PolarHBondContact O-N 3.1Å; N189-N193 PolarHBondContact O-ND2 2.86Å; A190-N193 PolarHBondContact O-N 3.46Å; N193-A195 PolarHBondContact O-N 3.05Å; N193-E196 PolarHBondContact O-N 3.13Å; N193-V197 VanDerWaalsContact O-CG2 3.31Å; N193-V197 WeakPolarHBondContact O-CG2 3.39Å; N193-V197 PolarHBondContact O-N 3.16Å
194	C	71.2	Confident	72.9	Confident	47 Å²	47	50.4 Å²	50.4	32%	0.318	27%	0.266	S	S	.	.	H	α-helix	trans	-60.9	-46.1	176.9	-73.7	0	0	0	0	111.4	A190 I191 V192 V198	A190-C194 WeakPolarHBondContact O-CB 3.41Å; A190-C194 PolarHBondContact O-N 3.03Å; A190-C194 PolarHBondContact O-SG 2.68Å; I191-C194 PolarHBondContact O-N 3.2Å; V192-C194 PolarHBondContact O-N 3.48Å; C194-V198 WeakPolarHBondContact O-CB 3.31Å; C194-V198 WeakPolarHBondContact O-CG2 3.22Å; C194-V198 PolarHBondContact O-N 2.87Å
195	A	74.6	Confident	73	Confident	13 Å²	13	54.9 Å²	54.9	11%	0.107	28%	0.284	C	S	.	.	H	α-helix	trans	-64.4	-41.6	179.2	0	0	0	0	0	112.1	I191 V192 N193 T199 A231 V234	I191-A195 WeakPolarHBondContact O-CB 3.43Å; I191-A195 PolarHBondContact O-N 3.49Å; V192-A195 PolarHBondContact O-N 3.33Å; N193-A195 PolarHBondContact O-N 3.05Å; A195-T199 WeakPolarHBondContact O-CB 3.38Å; A195-T199 PolarHBondContact O-N 3.17Å; A195-T199 PolarHBondContact O-OG1 3.4Å; A195-A231 HydrophobicContact CB-CB 4.37Å; A195-V234 HydrophobicContact CB-CB 4Å; A195-V234 HydrophobicContact CB-CG1 3.87Å; A195-V234 HydrophobicContact CB-CG2 4.46Å
196	E	69.7	Low	72.8	Confident	90 Å²	90	59.8 Å²	59.8	42%	0.421	30%	0.304	S	S	.	.	H	α-helix	trans	-63.4	-47.9	178.4	-172.4	176.1	171	0	0	111.7	V192 N193 T199 Y200 A231	V192-E196 WeakPolarHBondContact O-CB 3.27Å; V192-E196 PolarHBondContact O-N 2.99Å; N193-E196 PolarHBondContact O-N 3.13Å; E196-T199 PolarHBondContact O-N 3.48Å; E196-Y200 VanDerWaalsContact O-CB 3.22Å; E196-Y200 WeakPolarHBondContact O-CB 3.4Å; E196-Y200 PolarHBondContact O-N 2.61Å; E196-A231 HydrophobicContact CB-CB 4.04Å
197	V	70.1	Confident	72.2	Confident	42 Å²	42	59.5 Å²	59.5	26%	0.255	30%	0.303	S	S	.	.	H	α-helix	trans	-62.8	-51.3	179	173.3	0	0	0	0	111.1	L116 I120 N193 T199 Y200 D201	L116-V197 HydrophobicContact CD2-CG1 4.16Å; I120-V197 HydrophobicContact CD1-CG1 4.03Å; I120-V197 HydrophobicContact CG1-CB 4.2Å; I120-V197 HydrophobicContact CG1-CG1 3.77Å; I120-V197 HydrophobicContact CG1-CG2 4.4Å; N193-V197 VanDerWaalsContact O-CG2 3.31Å; N193-V197 WeakPolarHBondContact O-CG2 3.39Å; N193-V197 PolarHBondContact O-N 3.16Å; V197-T199 VanDerWaalsContact C-N 3.28Å; V197-T199 PolarHBondContact O-N 3.44Å; V197-Y200 PolarHBondContact O-N 3.41Å; V197-D201 WeakPolarHBondContact CG1-OD2 3.34Å; V197-D201 PolarHBondContact O-N 2.89Å
198	V	73.9	Confident	71.7	Confident	71 Å²	71	58 Å²	58	43%	0.43	30%	0.297	S	S	.	.	H	α-helix	trans	-59.2	-42.8	-179.3	171.5	0	0	0	0	110.9	C194 I202	C194-V198 WeakPolarHBondContact O-CB 3.31Å; C194-V198 WeakPolarHBondContact O-CG2 3.22Å; C194-V198 PolarHBondContact O-N 2.87Å; V198-I202 HydrophobicContact CG1-CD1 3.88Å; V198-I202 VanDerWaalsContact O-CG1 3.28Å; V198-I202 WeakPolarHBondContact O-CG1 3.33Å; V198-I202 PolarHBondContact O-N 3.35Å; V198-I202 VanDerWaalsContact O-N 3.14Å
199	T	73	Confident	71.1	Confident	21 Å²	21	60.7 Å²	60.7	13%	0.129	32%	0.316	C	S	.	.	H	α-helix	trans	-71.9	-37.3	-179.8	-41.6	0	0	0	0	111.6	A195 E196 V197 I202 L203 C230	A195-T199 WeakPolarHBondContact O-CB 3.38Å; A195-T199 PolarHBondContact O-N 3.17Å; A195-T199 PolarHBondContact O-OG1 3.4Å; E196-T199 PolarHBondContact O-N 3.48Å; V197-T199 VanDerWaalsContact C-N 3.28Å; V197-T199 PolarHBondContact O-N 3.44Å; T199-I202 PolarHBondContact O-N 2.89Å; T199-L203 HydrophobicContact CG2-CD1 3.42Å; T199-L203 VanDerWaalsContact CG2-CD1 3.42Å; T199-L203 WeakPolarHBondContact O-CB 3.43Å; T199-L203 WeakPolarHBondContact O-CD1 3.35Å; T199-L203 PolarHBondContact O-N 2.84Å; T199-C230 HydrophobicContact CG2-CB 3.3Å
200	Y	68.8	Low	70.5	Confident	69 Å²	69	67 Å²	67	27%	0.271	34%	0.338	S	S	.	.	H	α-helix	trans	-60.9	-44.9	175.9	-179.7	-92.9	0	0	0	111.7	E196 V197 L203 K204 A227	E196-Y200 VanDerWaalsContact O-CB 3.22Å; E196-Y200 WeakPolarHBondContact O-CB 3.4Å; E196-Y200 PolarHBondContact O-N 2.61Å; V197-Y200 PolarHBondContact O-N 3.41Å; Y200-L203 PolarHBondContact O-N 3.06Å; Y200-K204 HydrophobicContact CE1-CD 4.01Å; Y200-K204 WeakPolarHBondContact O-CB 3.12Å; Y200-K204 PolarHBondContact O-N 2.97Å; Y200-A227 HydrophobicContact CD2-CB 4.39Å
201	D	68.9	Low	69.5	Low	30 Å²	30	73.9 Å²	73.9	16%	0.16	37%	0.365	C	S	.	.	H	α-helix	trans	-67.3	-43	-179.4	-70.5	-38.8	0	0	0	111.5	L116 V197 L203 K204 E205	L116-D201 HydrophobicContact CD1-CB 4.43Å; L116-D201 VanDerWaalsContact CD1-OD2 3.28Å; L116-D201 WeakPolarHBondContact CD1-OD2 3.46Å; L116-D201 WeakPolarHBondContact CD2-OD2 2.95Å; L116-D201 WeakPolarHBondContact CG-OD2 3.12Å; V197-D201 WeakPolarHBondContact CG1-OD2 3.34Å; V197-D201 PolarHBondContact O-N 2.89Å; D201-L203 PolarHBondContact O-N 3.47Å; D201-K204 PolarHBondContact O-N 3.44Å; D201-E205 WeakPolarHBondContact O-CB 3.31Å; D201-E205 WeakPolarHBondContact O-CG 3.23Å; D201-E205 PolarHBondContact O-N 3.11Å
202	I	74.4	Confident	68.2	Low	91 Å²	91	77.3 Å²	77.3	47%	0.467	38%	0.383	S	S	.	.	H	α-helix	trans	-61	-45.2	173.8	-66.4	168	0	0	0	111.2	V198 T199 K204 K206	V198-I202 HydrophobicContact CG1-CD1 3.88Å; V198-I202 VanDerWaalsContact O-CG1 3.28Å; V198-I202 WeakPolarHBondContact O-CG1 3.33Å; V198-I202 PolarHBondContact O-N 3.35Å; V198-I202 VanDerWaalsContact O-N 3.14Å; T199-I202 PolarHBondContact O-N 2.89Å; I202-K204 VanDerWaalsContact C-N 3.34Å; I202-K206 WeakPolarHBondContact O-CB 3.29Å; I202-K206 VanDerWaalsContact O-CG 3.25Å; I202-K206 WeakPolarHBondContact O-CG 3.26Å; I202-K206 PolarHBondContact O-N 3.06Å
203	L	71.4	Confident	66.8	Low	40 Å²	40	79.2 Å²	79.2	21%	0.209	39%	0.392	C	S	.	.	H	α-helix	trans	-65.6	-38.9	178.3	-98.1	95.4	0	0	0	111.8	T199 Y200 D201 L207	T199-L203 HydrophobicContact CG2-CD1 3.42Å; T199-L203 VanDerWaalsContact CG2-CD1 3.42Å; T199-L203 WeakPolarHBondContact O-CB 3.43Å; T199-L203 WeakPolarHBondContact O-CD1 3.35Å; T199-L203 PolarHBondContact O-N 2.84Å; Y200-L203 PolarHBondContact O-N 3.06Å; D201-L203 PolarHBondContact O-N 3.47Å; L203-L207 WeakPolarHBondContact O-CB 3.48Å; L203-L207 PolarHBondContact O-N 3.49Å
204	K	67.2	Low	65.7	Low	81 Å²	81	82.5 Å²	82.5	35%	0.352	41%	0.414	S	S	.	.	H	α-helix	trans	-67.6	-46.9	-179.9	-173.2	-176.3	176.2	-168.4	0	111.1	Y200 D201 I202 K206 L207 L208	Y200-K204 HydrophobicContact CE1-CD 4.01Å; Y200-K204 WeakPolarHBondContact O-CB 3.12Å; Y200-K204 PolarHBondContact O-N 2.97Å; D201-K204 PolarHBondContact O-N 3.44Å; I202-K204 VanDerWaalsContact C-N 3.34Å; K204-K206 VanDerWaalsContact C-N 3.33Å; K204-K206 PolarHBondContact O-N 3.29Å; K204-L207 PolarHBondContact O-N 2.89Å; K204-L208 HydrophobicContact CG-CD1 3.95Å; K204-L208 WeakPolarHBondContact O-CB 2.85Å; K204-L208 VanDerWaalsContact O-CG 3.29Å; K204-L208 WeakPolarHBondContact O-CG 3.31Å; K204-L208 PolarHBondContact O-N 2.7Å
205	E	70	Confident	64.9	Low	120 Å²	120	85.5 Å²	85.5	56%	0.561	43%	0.427	S	S	*	.	H	α-helix	trans	-57.5	-47.2	174.8	-76.3	177.9	179.3	0	0	110.7	D201 L207 L208 D209	D201-E205 WeakPolarHBondContact O-CB 3.31Å; D201-E205 WeakPolarHBondContact O-CG 3.23Å; D201-E205 PolarHBondContact O-N 3.11Å; E205-L207 PolarHBondContact O-N 3.45Å; E205-L208 PolarHBondContact O-N 3.47Å; E205-D209 WeakPolarHBondContact O-CB 3.38Å; E205-D209 PolarHBondContact O-N 3.4Å
206	K	69.4	Low	64.2	Low	118 Å²	118	88.9 Å²	88.9	51%	0.513	44%	0.443	S	S	.	.	H	α-helix	trans	-65.9	-38.6	177.9	-67.2	-65.3	175.1	-160	0	113.2	I202 K204 Y210	I202-K206 WeakPolarHBondContact O-CB 3.29Å; I202-K206 VanDerWaalsContact O-CG 3.25Å; I202-K206 WeakPolarHBondContact O-CG 3.26Å; I202-K206 PolarHBondContact O-N 3.06Å; K204-K206 VanDerWaalsContact C-N 3.33Å; K204-K206 PolarHBondContact O-N 3.29Å; K206-Y210 WeakPolarHBondContact O-CB 3.47Å; K206-Y210 VanDerWaalsContact O-CD2 3.28Å; K206-Y210 WeakPolarHBondContact O-CD2 3.42Å; K206-Y210 PolarHBondContact O-N 2.95Å
207	L	65.3	Low	63.7	Low	39 Å²	39	92 Å²	92	20%	0.204	46%	0.455	C	S	.	.	H	α-helix	trans	-67.4	-36.4	177	-112.2	86.9	0	0	0	112.6	L203 K204 E205 L213 C219	L203-L207 WeakPolarHBondContact O-CB 3.48Å; L203-L207 PolarHBondContact O-N 3.49Å; K204-L207 PolarHBondContact O-N 2.89Å; E205-L207 PolarHBondContact O-N 3.45Å; L207-L213 HydrophobicContact CD2-CD1 4.14Å; L207-C219 HydrophobicContact CD2-CB 4.29Å; L207-C219 WeakPolarHBondContact CD2-SG 3.39Å
208	L	64.9	Low	63.4	Low	74 Å²	74	93.8 Å²	93.8	39%	0.387	47%	0.468	S	S	.	.	H	α-helix	trans	-72.9	-41.7	178.3	-70.9	171.1	0	0	0	111.8	K204 E205 Y210 H211	K204-L208 HydrophobicContact CG-CD1 3.95Å; K204-L208 WeakPolarHBondContact O-CB 2.85Å; K204-L208 VanDerWaalsContact O-CG 3.29Å; K204-L208 WeakPolarHBondContact O-CG 3.31Å; K204-L208 PolarHBondContact O-N 2.7Å; E205-L208 PolarHBondContact O-N 3.47Å; L208-Y210 VanDerWaalsContact C-N 3.35Å; L208-Y210 PolarHBondContact O-N 2.87Å; L208-H211 PolarHBondContact O-N 3.47Å
209	D	64.4	Low	62.8	Low	121 Å²	121	90.8 Å²	90.8	65%	0.647	45%	0.45	S	S	*	.	H	α-helix	trans	-64.1	-37.2	178.4	-82	-12.1	0	0	0	112.7	E205 H211	E205-D209 WeakPolarHBondContact O-CB 3.38Å; E205-D209 PolarHBondContact O-N 3.4Å; D209-H211 VanDerWaalsContact C-N 3.25Å; D209-H211 PolarHBondContact O-N 3.27Å
210	Y	62.3	Low	62.5	Low	170 Å²	170	93.3 Å²	93.3	67%	0.667	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	1	-178.5	-88.5	-75.8	0	0	0	114.1	K206 L208 L212	K206-Y210 WeakPolarHBondContact O-CB 3.47Å; K206-Y210 VanDerWaalsContact O-CD2 3.28Å; K206-Y210 WeakPolarHBondContact O-CD2 3.42Å; K206-Y210 PolarHBondContact O-N 2.95Å; L208-Y210 VanDerWaalsContact C-N 3.35Å; L208-Y210 PolarHBondContact O-N 2.87Å; Y210-L212 PolarHBondContact O-N 3.5Å
211	H	53	Low	62.4	Low	177 Å²	177	94.2 Å²	94.2	82%	0.819	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	21.5	178.1	-115.3	66.1	0	0	0	114.9	L208 D209	L208-H211 PolarHBondContact O-N 3.47Å; D209-H211 VanDerWaalsContact C-N 3.25Å; D209-H211 PolarHBondContact O-N 3.27Å
212	L	50.8	Low	62.3	Low	136 Å²	136	95.2 Å²	95.2	71%	0.712	48%	0.478	S	S	*	.			trans	-80.4	-20.6	-170.6	-109.8	131.1	0	0	0	112.5	Y210	Y210-L212 PolarHBondContact O-N 3.5Å
213	L	46.2	Very low	61.9	Low	70 Å²	70	91 Å²	91	37%	0.366	46%	0.456	S	S	.	.			trans	-151.4	126.9	178.3	-85.6	145.8	0	0	0	111.1	L207 C219	L207-L213 HydrophobicContact CD2-CD1 4.14Å; L213-C219 HydrophobicContact CB-CB 3.98Å; L213-C219 HydrophobicContact CD1-CB 4.38Å
214	T	49.9	Very low	61.6	Low	113 Å²	113	91 Å²	91	69%	0.693	46%	0.463	S	S	*	.			trans	-62.4	157.1	162.8	-22.6	0	0	0	0	110.1	N216	T214-N216 WeakPolarHBondContact O-CB 3.44Å; T214-N216 PolarHBondContact O-N 3.26Å; T214-N216 PolarHBondContact O-ND2 2.86Å
215	D	54.2	Low	61.7	Low	110 Å²	110	92 Å²	92	59%	0.588	47%	0.467	S	S	*	.	S	Bend	trans	-52.5	74.4	176.1	-90.1	-29.8	0	0	0	112.9	H220	D215-H220 IonicContact OD1-NE2 3.12Å
216	N	60.3	Low	61.7	Low	84 Å²	84	87.2 Å²	87.2	45%	0.449	45%	0.45	S	S	.	.			trans	-118.4	153.1	-177.6	-71.5	-57.8	0	0	0	109	T214 P218 C219 H220	T214-N216 WeakPolarHBondContact O-CB 3.44Å; T214-N216 PolarHBondContact O-N 3.26Å; T214-N216 PolarHBondContact O-ND2 2.86Å; N216-P218 VanDerWaalsContact C-N 3.26Å; N216-P218 VanDerWaalsContact O-N 3.08Å; N216-C219 VanDerWaalsContact O-CB 3.28Å; N216-C219 WeakPolarHBondContact O-CB 3.47Å; N216-C219 PolarHBondContact O-N 3.41Å; N216-H220 PolarHBondContact O-N 2.99Å
217	F	60	Low	61.6	Low	155 Å²	155	81.6 Å²	81.6	68%	0.68	43%	0.426	S	S	*	.	H	α-helix	trans	-43.5	-40.7	175.3	-102.5	-86.8	0	0	0	115.3	C219 F221	F217-C219 PolarHBondContact O-N 3.18Å; F217-F221 WeakPolarHBondContact O-CB 3.19Å; F217-F221 PolarHBondContact O-N 2.85Å; F217-F221 VanDerWaalsContact O-N 3.1Å
218	P	62.2	Low	61.6	Low	80 Å²	80	80.4 Å²	80.4	52%	0.519	42%	0.423	S	S	.	.	H	α-helix	trans	-67.6	-30.3	178.3	-20.4	33.8	0	0	0	114.2	N216 F221 A222	N216-P218 VanDerWaalsContact C-N 3.26Å; N216-P218 VanDerWaalsContact O-N 3.08Å; P218-F221 PolarHBondContact O-N 3.4Å; P218-A222 WeakPolarHBondContact O-CB 3.48Å; P218-A222 PolarHBondContact O-N 3.47Å
219	C	63.3	Low	62	Low	8 Å²	8	81.1 Å²	81.1	5%	0.054	42%	0.423	C	S	.	.	H	α-helix	trans	-66.8	-50.3	177.5	175.4	0	0	0	0	110.6	L207 L213 N216 F217 F221 A222 S223	L207-C219 HydrophobicContact CD2-CB 4.29Å; L207-C219 WeakPolarHBondContact CD2-SG 3.39Å; L213-C219 HydrophobicContact CB-CB 3.98Å; L213-C219 HydrophobicContact CD1-CB 4.38Å; N216-C219 VanDerWaalsContact O-CB 3.28Å; N216-C219 WeakPolarHBondContact O-CB 3.47Å; N216-C219 PolarHBondContact O-N 3.41Å; F217-C219 PolarHBondContact O-N 3.18Å; C219-F221 PolarHBondContact O-N 3.45Å; C219-A222 PolarHBondContact O-N 2.89Å; C219-S223 WeakPolarHBondContact O-CB 3.26Å; C219-S223 PolarHBondContact O-N 3.22Å; C219-S223 PolarHBondContact O-OG 3.5Å
220	H	65	Low	62.4	Low	73 Å²	73	77.6 Å²	77.6	34%	0.338	41%	0.408	S	S	.	.	H	α-helix	trans	-61.5	-33.2	174.4	-69.4	-65.3	0	0	0	112.7	D215 N216 S223 A224	D215-H220 IonicContact OD1-NE2 3.12Å; N216-H220 PolarHBondContact O-N 2.99Å; H220-S223 WeakPolarHBondContact CA-OG 3.36Å; H220-S223 PolarHBondContact O-OG 2.99Å; H220-S223 VanDerWaalsContact O-OG 3.14Å; H220-A224 WeakPolarHBondContact O-CB 3.47Å; H220-A224 PolarHBondContact O-N 2.94Å
221	F	66.8	Low	62.8	Low	88 Å²	88	69.7 Å²	69.7	39%	0.386	38%	0.378	S	S	.	.	H	α-helix	trans	-71.5	-47	177.6	-172	-94.1	0	0	0	112.2	F217 P218 C219 A224 F225 F291	F217-F221 WeakPolarHBondContact O-CB 3.19Å; F217-F221 PolarHBondContact O-N 2.85Å; F217-F221 VanDerWaalsContact O-N 3.1Å; P218-F221 PolarHBondContact O-N 3.4Å; C219-F221 PolarHBondContact O-N 3.45Å; F221-A224 PolarHBondContact O-N 3.26Å; F221-F225 WeakPolarHBondContact O-CB 3.31Å; F221-F225 PolarHBondContact O-N 3.48Å; F221-F291 HydrophobicContact CD2-CD1 4.24Å; F221-F291 HydrophobicContact CD2-CE1 4.01Å; F221-F291 HydrophobicContact CD2-CZ 4.33Å; F221-F291 HydrophobicContact CE2-CB 4.35Å; F221-F291 AromaticContact CE2-CD1 3.6Å; F221-F291 HydrophobicContact CE2-CD1 3.6Å; F221-F291 AromaticContact CE2-CD2 3.98Å; F221-F291 HydrophobicContact CE2-CD2 3.98Å; F221-F291 AromaticContact CE2-CE1 3.73Å; F221-F291 HydrophobicContact CE2-CE1 3.73Å; F221-F291 HydrophobicContact CE2-CE2 4.13Å; F221-F291 AromaticContact CE2-CG 3.72Å; F221-F291 HydrophobicContact CE2-CG 3.72Å; F221-F291 HydrophobicContact CE2-CZ 4Å; F221-F291 HydrophobicContact CZ-CD2 4.46Å; F221-F291 HydrophobicContact CZ-CG 4.4Å
222	A	67.3	Low	63.6	Low	51 Å²	51	62 Å²	62	42%	0.421	34%	0.343	S	S	.	.	H	α-helix	trans	-64.3	-41.4	178.5	0	0	0	0	0	111.8	P218 C219 F225 G226	P218-A222 WeakPolarHBondContact O-CB 3.48Å; P218-A222 PolarHBondContact O-N 3.47Å; C219-A222 PolarHBondContact O-N 2.89Å; A222-F225 PolarHBondContact O-N 3Å; A222-G226 PolarHBondContact O-N 3.46Å
223	S	65.3	Low	64.8	Low	2 Å²	2	57.5 Å²	57.5	1%	0.014	32%	0.321	C	S	.	.	H	α-helix	trans	-67.5	-42.3	176	61.7	0	0	0	0	112.1	C219 H220 F225 G226 A227	C219-S223 WeakPolarHBondContact O-CB 3.26Å; C219-S223 PolarHBondContact O-N 3.22Å; C219-S223 PolarHBondContact O-OG 3.5Å; H220-S223 WeakPolarHBondContact CA-OG 3.36Å; H220-S223 PolarHBondContact O-OG 2.99Å; H220-S223 VanDerWaalsContact O-OG 3.14Å; S223-F225 VanDerWaalsContact C-N 3.35Å; S223-F225 PolarHBondContact O-N 3.15Å; S223-G226 PolarHBondContact O-N 3.26Å; S223-A227 VanDerWaalsContact O-CB 3.23Å; S223-A227 WeakPolarHBondContact O-CB 3.4Å; S223-A227 PolarHBondContact O-N 2.82Å
224	A	64.9	Low	66.2	Low	42 Å²	42	57.8 Å²	57.8	35%	0.347	33%	0.325	S	S	.	.	H	α-helix	trans	-63.6	-38.7	174.5	0	0	0	0	0	112.5	H220 F221 G228	H220-A224 WeakPolarHBondContact O-CB 3.47Å; H220-A224 PolarHBondContact O-N 2.94Å; F221-A224 PolarHBondContact O-N 3.26Å; A224-G228 PolarHBondContact O-N 3.02Å
225	F	69.4	Low	67.2	Low	100 Å²	100	52.7 Å²	52.7	44%	0.439	30%	0.295	S	S	.	.	H	α-helix	trans	-68.4	-43.6	177.8	-166.5	-93.3	0	0	0	111.9	F221 A222 S223 G228 F229	F221-F225 WeakPolarHBondContact O-CB 3.31Å; F221-F225 PolarHBondContact O-N 3.48Å; A222-F225 PolarHBondContact O-N 3Å; S223-F225 VanDerWaalsContact C-N 3.35Å; S223-F225 PolarHBondContact O-N 3.15Å; F225-G228 PolarHBondContact O-N 3.3Å; F225-F229 PolarHBondContact O-N 3.47Å
226	G	69.9	Low	68	Low	20 Å²	20	47.8 Å²	47.8	21%	0.206	27%	0.269	C	S	.	.	H	α-helix	trans	-63.9	-42.6	174.4	0	0	0	0	0	112.5	A222 S223 F229 C230	A222-G226 PolarHBondContact O-N 3.46Å; S223-G226 PolarHBondContact O-N 3.26Å; G226-F229 PolarHBondContact O-N 3.37Å; G226-C230 PolarHBondContact O-N 2.7Å
227	A	67.4	Low	68.5	Low	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.3	-45.5	173.9	0	0	0	0	0	111.8	Y200 S223 F229 C230 A231	Y200-A227 HydrophobicContact CD2-CB 4.39Å; S223-A227 VanDerWaalsContact O-CB 3.23Å; S223-A227 WeakPolarHBondContact O-CB 3.4Å; S223-A227 PolarHBondContact O-N 2.82Å; A227-F229 VanDerWaalsContact C-N 3.34Å; A227-F229 PolarHBondContact O-N 2.83Å; A227-C230 PolarHBondContact O-N 2.97Å; A227-A231 VanDerWaalsContact O-CB 3.24Å; A227-A231 WeakPolarHBondContact O-CB 3.11Å; A227-A231 PolarHBondContact O-N 3.01Å
228	G	67.2	Low	69.1	Low	15 Å²	15	39.7 Å²	39.7	16%	0.155	24%	0.236	C	C	.	.	H	α-helix	trans	-61.9	-38.2	176	0	0	0	0	0	113.3	A224 F225 T232	A224-G228 PolarHBondContact O-N 3.02Å; F225-G228 PolarHBondContact O-N 3.3Å; G228-T232 WeakPolarHBondContact O-CB 3.32Å; G228-T232 PolarHBondContact O-N 2.9Å; G228-T232 PolarHBondContact O-OG1 2.88Å
229	F	73.3	Confident	69.5	Low	88 Å²	88	37 Å²	37	39%	0.386	22%	0.217	S	C	.	.	H	α-helix	trans	-62.3	-53.8	175.1	-177.7	-88.9	0	0	0	111.3	F225 G226 A227 A231 T232 V233 F280	F225-F229 PolarHBondContact O-N 3.47Å; G226-F229 PolarHBondContact O-N 3.37Å; A227-F229 VanDerWaalsContact C-N 3.34Å; A227-F229 PolarHBondContact O-N 2.83Å; F229-A231 PolarHBondContact O-N 3.45Å; F229-T232 WeakPolarHBondContact O-CB 3.25Å; F229-T232 PolarHBondContact O-N 3.13Å; F229-T232 VanDerWaalsContact O-N 3.12Å; F229-V233 HydrophobicContact CD1-CG2 4.23Å; F229-V233 HydrophobicContact CE1-CG2 3.85Å; F229-V233 HydrophobicContact CZ-CG2 4.28Å; F229-V233 WeakPolarHBondContact O-CG2 3.32Å; F229-V233 PolarHBondContact O-N 3.29Å; F229-F280 HydrophobicContact CD2-CD2 4.19Å; F229-F280 AromaticContact CD2-CE2 3.25Å; F229-F280 HydrophobicContact CD2-CE2 3.25Å; F229-F280 AromaticContact CD2-CZ 3.67Å; F229-F280 HydrophobicContact CD2-CZ 3.67Å; F229-F280 HydrophobicContact CE2-CD2 4.04Å; F229-F280 HydrophobicContact CE2-CE1 4.38Å; F229-F280 AromaticContact CE2-CE2 3.32Å; F229-F280 HydrophobicContact CE2-CE2 3.32Å; F229-F280 AromaticContact CE2-CZ 3.5Å; F229-F280 HydrophobicContact CE2-CZ 3.5Å; F229-F280 HydrophobicContact CG-CE2 4.47Å
230	C	72.1	Confident	69.7	Low	48 Å²	48	37.6 Å²	37.6	32%	0.324	22%	0.221	S	C	.	.	H	α-helix	trans	-63.4	-42	180	-69.2	0	0	0	0	112.2	T199 G226 A227 T232 V233 V234	T199-C230 HydrophobicContact CG2-CB 3.3Å; G226-C230 PolarHBondContact O-N 2.7Å; A227-C230 PolarHBondContact O-N 2.97Å; C230-T232 PolarHBondContact O-N 2.79Å; C230-V233 WeakPolarHBondContact O-CB 3.22Å; C230-V233 PolarHBondContact O-N 3.43Å; C230-V233 VanDerWaalsContact O-N 3.12Å; C230-V234 WeakPolarHBondContact O-CG2 3.27Å; C230-V234 PolarHBondContact O-N 2.74Å
231	A	70.4	Confident	69.8	Low	4 Å²	4	34.9 Å²	34.9	3%	0.033	21%	0.209	C	C	.	.	H	α-helix	trans	-57.4	-38.2	174.5	0	0	0	0	0	111.4	A195 E196 A227 F229 V234 A235	A195-A231 HydrophobicContact CB-CB 4.37Å; E196-A231 HydrophobicContact CB-CB 4.04Å; A227-A231 VanDerWaalsContact O-CB 3.24Å; A227-A231 WeakPolarHBondContact O-CB 3.11Å; A227-A231 PolarHBondContact O-N 3.01Å; F229-A231 PolarHBondContact O-N 3.45Å; A231-V234 PolarHBondContact O-N 2.87Å; A231-A235 WeakPolarHBondContact O-CB 3.23Å; A231-A235 PolarHBondContact O-N 2.93Å
232	T	69.2	Low	69.9	Low	14 Å²	14	32.7 Å²	32.7	9%	0.086	20%	0.199	C	C	.	.	H	α-helix	trans	-68.9	-38.5	177.4	-55.5	0	0	0	0	112.4	G228 F229 C230 V234 A235 S236 L283	G228-T232 WeakPolarHBondContact O-CB 3.32Å; G228-T232 PolarHBondContact O-N 2.9Å; G228-T232 PolarHBondContact O-OG1 2.88Å; F229-T232 WeakPolarHBondContact O-CB 3.25Å; F229-T232 PolarHBondContact O-N 3.13Å; F229-T232 VanDerWaalsContact O-N 3.12Å; C230-T232 PolarHBondContact O-N 2.79Å; T232-V234 VanDerWaalsContact C-N 3.35Å; T232-A235 PolarHBondContact O-N 2.69Å; T232-S236 WeakPolarHBondContact O-CB 3.45Å; T232-S236 PolarHBondContact O-N 3.02Å; T232-S236 PolarHBondContact O-OG 3.25Å; T232-L283 HydrophobicContact CG2-CD1 4.23Å; T232-L283 HydrophobicContact CG2-CD2 4.35Å; T232-L283 WeakPolarHBondContact OG1-CD2 3.35Å
233	V	76.6	Confident	69.7	Low	42 Å²	42	32.4 Å²	32.4	26%	0.255	19%	0.192	S	C	.	.	H	α-helix	trans	-61.1	-45.9	174.2	175.2	0	0	0	0	110.3	F229 C230 S236 P237 Y273 F276	F229-V233 HydrophobicContact CD1-CG2 4.23Å; F229-V233 HydrophobicContact CE1-CG2 3.85Å; F229-V233 HydrophobicContact CZ-CG2 4.28Å; F229-V233 WeakPolarHBondContact O-CG2 3.32Å; F229-V233 PolarHBondContact O-N 3.29Å; C230-V233 WeakPolarHBondContact O-CB 3.22Å; C230-V233 PolarHBondContact O-N 3.43Å; C230-V233 VanDerWaalsContact O-N 3.12Å; V233-S236 PolarHBondContact O-N 3.2Å; V233-P237 WeakPolarHBondContact O-CD 3.21Å; V233-Y273 HydrophobicContact CG1-CE1 4.43Å; V233-F276 HydrophobicContact CG2-CE2 3.96Å; V233-F276 HydrophobicContact CG2-CZ 4Å
234	V	75.4	Confident	69.7	Low	76 Å²	76	36.2 Å²	36.2	46%	0.461	21%	0.207	S	C	.	.	H	α-helix	trans	-69.2	-34	178.5	178.1	0	0	0	0	112.2	I191 A195 C230 A231 T232 P237	I191-V234 HydrophobicContact CG2-CG1 4.47Å; A195-V234 HydrophobicContact CB-CB 4Å; A195-V234 HydrophobicContact CB-CG1 3.87Å; A195-V234 HydrophobicContact CB-CG2 4.46Å; C230-V234 WeakPolarHBondContact O-CG2 3.27Å; C230-V234 PolarHBondContact O-N 2.74Å; A231-V234 PolarHBondContact O-N 2.87Å; T232-V234 VanDerWaalsContact C-N 3.35Å; V234-P237 WeakPolarHBondContact O-CD 3.44Å
235	A	71.4	Confident	69.8	Low	6 Å²	6	38.3 Å²	38.3	5%	0.05	21%	0.206	C	C	.	.	H	α-helix	trans	-77.7	-22.3	180	0	0	0	0	0	113.7	V192 A231 T232 V238 D239	V192-A235 HydrophobicContact CG2-CB 3.68Å; A231-A235 WeakPolarHBondContact O-CB 3.23Å; A231-A235 PolarHBondContact O-N 2.93Å; T232-A235 PolarHBondContact O-N 2.69Å; A235-V238 PolarHBondContact O-N 2.66Å; A235-D239 PolarHBondContact O-N 2.94Å
236	S	71.6	Confident	69.2	Low	8 Å²	8	37.6 Å²	37.6	6%	0.056	21%	0.205	C	C	.	.	H	α-helix	trans	-59.3	-45.9	-174	-68.8	0	0	0	0	113.7	T232 V233 V238 D239 V240 F276	T232-S236 WeakPolarHBondContact O-CB 3.45Å; T232-S236 PolarHBondContact O-N 3.02Å; T232-S236 PolarHBondContact O-OG 3.25Å; V233-S236 PolarHBondContact O-N 3.2Å; S236-V238 VanDerWaalsContact C-N 3.33Å; S236-V238 PolarHBondContact O-N 3.38Å; S236-D239 PolarHBondContact O-N 3.16Å; S236-V240 WeakPolarHBondContact O-CG2 3.49Å; S236-V240 PolarHBondContact O-N 3.4Å; S236-F276 WeakPolarHBondContact OG-CD2 3.33Å
237	P	70	Confident	68.6	Low	30 Å²	30	39.8 Å²	39.8	20%	0.195	21%	0.212	C	C	.	.	H	α-helix	trans	-59	-41.8	174.6	-25.4	34.7	0	0	0	113.4	V233 V234 D239 V240 V241 F272	V233-P237 WeakPolarHBondContact O-CD 3.21Å; V234-P237 WeakPolarHBondContact O-CD 3.44Å; P237-D239 VanDerWaalsContact C-N 3.33Å; P237-D239 PolarHBondContact O-N 3.37Å; P237-V240 PolarHBondContact O-N 3.48Å; P237-V241 WeakPolarHBondContact O-CG2 3.29Å; P237-V241 PolarHBondContact O-N 3.19Å; P237-F272 HydrophobicContact CB-CB 4.04Å; P237-F272 HydrophobicContact CB-CD1 3.71Å; P237-F272 HydrophobicContact CB-CG 4.19Å; P237-F272 HydrophobicContact CG-CB 4.27Å
238	V	72.6	Confident	67.8	Low	39 Å²	39	41.1 Å²	41.1	24%	0.236	22%	0.221	C	C	.	.	H	α-helix	trans	-65.2	-40.7	179.6	-177.3	0	0	0	0	110.6	R188 I191 A235 S236 V241 K242	R188-V238 HydrophobicContact CB-CG1 4.21Å; R188-V238 HydrophobicContact CG-CG1 4.35Å; I191-V238 HydrophobicContact CD1-CG1 4.02Å; I191-V238 HydrophobicContact CD1-CG2 3.78Å; I191-V238 HydrophobicContact CG2-CG2 4.08Å; A235-V238 PolarHBondContact O-N 2.66Å; S236-V238 VanDerWaalsContact C-N 3.33Å; S236-V238 PolarHBondContact O-N 3.38Å; V238-V241 PolarHBondContact O-N 3.37Å; V238-K242 VanDerWaalsContact O-CB 3.29Å; V238-K242 WeakPolarHBondContact O-CB 3.14Å; V238-K242 PolarHBondContact O-N 3.13Å
239	D	69.6	Low	67.3	Low	22 Å²	22	44.1 Å²	44.1	12%	0.118	24%	0.238	C	C	.	.	H	α-helix	trans	-63.3	-42.7	177.6	-78.7	1.9	0	0	0	111.7	R188 A235 S236 P237 K242 T243	R188-D239 VanDerWaalsContact CZ-CG 3.45Å; R188-D239 IonicContact CZ-OD1 2.7Å; R188-D239 IonicContact CZ-OD2 2.61Å; R188-D239 IonicContact NE-OD1 3.3Å; R188-D239 PolarHBondContact NE-OD1 3.19Å; R188-D239 IonicContact NH1-OD1 2.82Å; R188-D239 PolarHBondContact NH1-OD1 2.93Å; R188-D239 IonicContact NH1-OD2 3.3Å; R188-D239 PolarHBondContact NH1-OD2 3.27Å; R188-D239 IonicContact NH2-OD1 3.11Å; R188-D239 PolarHBondContact NH2-OD1 3.5Å; R188-D239 IonicContact NH2-OD2 3.41Å; R188-D239 PolarHBondContact NH2-OD2 3.05Å; A235-D239 PolarHBondContact O-N 2.94Å; S236-D239 PolarHBondContact O-N 3.16Å; P237-D239 VanDerWaalsContact C-N 3.33Å; P237-D239 PolarHBondContact O-N 3.37Å; D239-K242 PolarHBondContact O-N 3.47Å; D239-T243 WeakPolarHBondContact O-CG2 3.34Å; D239-T243 PolarHBondContact O-N 2.99Å; D239-T243 PolarHBondContact O-OG1 3.41Å; D239-T243 VanDerWaalsContact O-OG1 3.06Å
240	V	67.4	Low	66.5	Low	22 Å²	22	46.6 Å²	46.6	13%	0.133	26%	0.263	C	S	.	.	H	α-helix	trans	-65.3	-47	177.9	173.5	0	0	0	0	111.6	S236 P237 K242 T243 R244 M263 F272	S236-V240 WeakPolarHBondContact O-CG2 3.49Å; S236-V240 PolarHBondContact O-N 3.4Å; P237-V240 PolarHBondContact O-N 3.48Å; V240-K242 VanDerWaalsContact C-N 3.32Å; V240-K242 PolarHBondContact O-N 3.38Å; V240-T243 WeakPolarHBondContact CA-OG1 3.26Å; V240-T243 PolarHBondContact O-N 2.95Å; V240-T243 PolarHBondContact O-OG1 2.97Å; V240-R244 PolarHBondContact O-N 3.31Å; V240-M263 HydrophobicContact CG1-CE 3.8Å; V240-M263 HydrophobicContact CG1-SD 4.04Å; V240-F272 WeakPolarHBondContact CG2-O 3.5Å
241	V	68.6	Low	65.9	Low	15 Å²	15	47.9 Å²	47.9	9%	0.091	28%	0.284	C	S	.	.	H	α-helix	trans	-61.4	-43.2	178	173.5	0	0	0	0	110.7	P237 V238 R244 Y245 C259 M260 M263 F272	P237-V241 WeakPolarHBondContact O-CG2 3.29Å; P237-V241 PolarHBondContact O-N 3.19Å; V238-V241 PolarHBondContact O-N 3.37Å; V241-R244 PolarHBondContact O-N 3.26Å; V241-Y245 VanDerWaalsContact O-CB 3.27Å; V241-Y245 WeakPolarHBondContact O-CB 3.34Å; V241-Y245 PolarHBondContact O-N 2.98Å; V241-C259 HydrophobicContact CG1-CB 4.47Å; V241-M260 HydrophobicContact CG1-CB 4.45Å; V241-M260 HydrophobicContact CG2-CB 4.19Å; V241-M260 HydrophobicContact CG2-CG 4.29Å; V241-M263 HydrophobicContact CG2-CE 4.49Å; V241-F272 HydrophobicContact CG2-CD1 4.15Å; V241-F272 HydrophobicContact CG2-CE1 3.6Å
242	K	68.9	Low	65.6	Low	42 Å²	42	52.6 Å²	52.6	18%	0.183	31%	0.306	C	S	.	.	H	α-helix	trans	-60.8	-48.6	176.8	176.2	-172	159.5	-170.7	0	111.3	N185 V238 D239 V240 Y245 M246	N185-K242 WeakPolarHBondContact OD1-CE 3.39Å; N185-K242 PolarHBondContact OD1-NZ 2.96Å; V238-K242 VanDerWaalsContact O-CB 3.29Å; V238-K242 WeakPolarHBondContact O-CB 3.14Å; V238-K242 PolarHBondContact O-N 3.13Å; D239-K242 PolarHBondContact O-N 3.47Å; V240-K242 VanDerWaalsContact C-N 3.32Å; V240-K242 PolarHBondContact O-N 3.38Å; K242-Y245 PolarHBondContact O-N 3.43Å; K242-M246 HydrophobicContact CD-SD 4.35Å; K242-M246 WeakPolarHBondContact CE-SD 3.42Å; K242-M246 HydrophobicContact CG-CG 4.33Å; K242-M246 HydrophobicContact CG-SD 3.87Å; K242-M246 WeakPolarHBondContact O-CB 3.14Å; K242-M246 VanDerWaalsContact O-CG 3.26Å; K242-M246 WeakPolarHBondContact O-CG 3.42Å; K242-M246 PolarHBondContact O-N 2.97Å
243	T	63.2	Low	65.4	Low	45 Å²	45	53.3 Å²	53.3	28%	0.276	31%	0.307	S	S	.	.	H	α-helix	trans	-62.5	-44.6	-178.8	46.9	0	0	0	0	111.6	D239 V240 M246 N247	D239-T243 WeakPolarHBondContact O-CG2 3.34Å; D239-T243 PolarHBondContact O-N 2.99Å; D239-T243 PolarHBondContact O-OG1 3.41Å; D239-T243 VanDerWaalsContact O-OG1 3.06Å; V240-T243 WeakPolarHBondContact CA-OG1 3.26Å; V240-T243 PolarHBondContact O-N 2.95Å; V240-T243 PolarHBondContact O-OG1 2.97Å; T243-M246 PolarHBondContact O-N 3.49Å; T243-N247 PolarHBondContact O-N 3.25Å; T243-N247 VanDerWaalsContact O-N 3.12Å
244	R	65.2	Low	64.8	Low	83 Å²	83	58.6 Å²	58.6	31%	0.313	33%	0.333	S	S	.	.	H	α-helix	trans	-61.1	-48.9	176	-83.1	-75.5	-171.6	127.7	9.9	111.7	V240 V241 M246 N247 S248 M263 E267	V240-R244 PolarHBondContact O-N 3.31Å; V241-R244 PolarHBondContact O-N 3.26Å; R244-M246 VanDerWaalsContact C-N 3.32Å; R244-M246 PolarHBondContact O-N 3.23Å; R244-N247 PolarHBondContact O-N 2.98Å; R244-S248 WeakPolarHBondContact O-CB 3.46Å; R244-S248 PolarHBondContact O-N 2.93Å; R244-S248 PolarHBondContact O-OG 3.38Å; R244-M263 HydrophobicContact CG-SD 4.37Å; R244-E267 IonicContact CZ-OE1 3.78Å; R244-E267 VanDerWaalsContact CZ-OE1 3.3Å; R244-E267 IonicContact NH1-OE1 3.98Å; R244-E267 PolarHBondContact NH1-OE1 2.96Å; R244-E267 VanDerWaalsContact NH1-OE1 3.11Å; R244-E267 IonicContact NH2-OE1 2.87Å; R244-E267 PolarHBondContact NH2-OE1 3.47Å; R244-E267 IonicContact NH2-OE2 3.4Å; R244-E267 PolarHBondContact NH2-OE2 3.43Å
245	Y	65.6	Low	64.6	Low	85 Å²	85	57 Å²	57	33%	0.333	33%	0.325	S	S	.	.	H	α-helix	trans	-61.4	-41.3	179.3	-179.1	-101.6	0	0	0	111.9	V241 K242 N247	V241-Y245 VanDerWaalsContact O-CB 3.27Å; V241-Y245 WeakPolarHBondContact O-CB 3.34Å; V241-Y245 PolarHBondContact O-N 2.98Å; K242-Y245 PolarHBondContact O-N 3.43Å; Y245-N247 VanDerWaalsContact C-N 3.33Å; Y245-N247 PolarHBondContact O-N 2.89Å
246	M	57.7	Low	64.4	Low	86 Å²	86	59.2 Å²	59.2	42%	0.424	34%	0.339	S	S	.	.	H	α-helix	trans	-68.2	-29.1	-179.7	-76.4	-175.5	68.4	0	0	113.8	K242 T243 R244	K242-M246 HydrophobicContact CD-SD 4.35Å; K242-M246 WeakPolarHBondContact CE-SD 3.42Å; K242-M246 HydrophobicContact CG-CG 4.33Å; K242-M246 HydrophobicContact CG-SD 3.87Å; K242-M246 WeakPolarHBondContact O-CB 3.14Å; K242-M246 VanDerWaalsContact O-CG 3.26Å; K242-M246 WeakPolarHBondContact O-CG 3.42Å; K242-M246 PolarHBondContact O-N 2.97Å; T243-M246 PolarHBondContact O-N 3.49Å; R244-M246 VanDerWaalsContact C-N 3.32Å; R244-M246 PolarHBondContact O-N 3.23Å
247	N	57.7	Low	64.6	Low	65 Å²	65	64.2 Å²	64.2	35%	0.348	37%	0.365	S	S	.	.	H	α-helix	trans	-104.4	5.9	179.9	-148.9	15.3	0	0	0	114.7	E46 T243 R244 Y245	E46-N247 HydrophobicContact CB-CB 4.39Å; E46-N247 WeakPolarHBondContact CB-ND2 3.45Å; E46-N247 HydrophobicContact CG-CB 4.08Å; E46-N247 WeakPolarHBondContact OE1-CB 3.41Å; E46-N247 WeakPolarHBondContact OE2-CB 3.36Å; E46-N247 PolarHBondContact OE2-ND2 3.36Å; T243-N247 PolarHBondContact O-N 3.25Å; T243-N247 VanDerWaalsContact O-N 3.12Å; R244-N247 PolarHBondContact O-N 2.98Å; Y245-N247 VanDerWaalsContact C-N 3.33Å; Y245-N247 PolarHBondContact O-N 2.89Å
248	S	51.3	Low	64.9	Low	28 Å²	28	64.4 Å²	64.4	20%	0.196	36%	0.364	C	S	.	.	S	Bend	trans	-78.6	141.5	174.5	-62.9	0	0	0	0	111.2	R244 Y253	R244-S248 WeakPolarHBondContact O-CB 3.46Å; R244-S248 PolarHBondContact O-N 2.93Å; R244-S248 PolarHBondContact O-OG 3.38Å; S248-Y253 VanDerWaalsContact OG-CD2 3.31Å; S248-Y253 WeakPolarHBondContact OG-CD2 3.23Å; S248-Y253 WeakPolarHBondContact OG-CE2 3.26Å
249	P	56.5	Low	64.7	Low	79 Å²	79	62.6 Å²	62.6	51%	0.513	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-56.9	148.3	174.7	20.5	-32.1	0	0	0	112.1	G251 Q252	P249-G251 PolarHBondContact O-N 2.86Å; P249-G251 VanDerWaalsContact O-N 3.12Å; P249-Q252 HydrophobicContact CG-CB 4.36Å; P249-Q252 PolarHBondContact O-N 3.24Å
250	P	55.6	Low	64.9	Low	140 Å²	140	65.2 Å²	65.2	91%	0.909	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	119.2	-177.7	23.5	-32	0	0	0	110.4
251	G	60.1	Low	65.4	Low	74 Å²	74	69.3 Å²	69.3	76%	0.763	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	108.6	-9.9	178	0	0	0	0	0	116.1	P249	P249-G251 PolarHBondContact O-N 2.86Å; P249-G251 VanDerWaalsContact O-N 3.12Å
252	Q	63.8	Low	65.8	Low	103 Å²	103	71.7 Å²	71.7	48%	0.481	40%	0.395	S	S	.	.	S	Bend	trans	-76	-28.9	-178.7	-165.3	168.1	8.3	0	0	113.8	P249 K262	P249-Q252 HydrophobicContact CG-CB 4.36Å; P249-Q252 PolarHBondContact O-N 3.24Å; Q252-K262 PolarHBondContact O-NZ 3.49Å
253	Y	64.3	Low	66	Low	29 Å²	29	70 Å²	70	11%	0.114	39%	0.387	C	S	.	.			trans	-131.7	124.7	176.4	-61.8	-69.3	0	0	0	110.3	S248 C259 K262	S248-Y253 VanDerWaalsContact OG-CD2 3.31Å; S248-Y253 WeakPolarHBondContact OG-CD2 3.23Å; S248-Y253 WeakPolarHBondContact OG-CE2 3.26Å; Y253-C259 HydrophobicContact CD1-CB 3.63Å; Y253-C259 HydrophobicContact CD2-CB 4.28Å; Y253-C259 HydrophobicContact CE1-CB 4.04Å; Y253-C259 HydrophobicContact CG-CB 3.75Å; Y253-K262 HydrophobicContact CD1-CD 3.85Å; Y253-K262 HydrophobicContact CE1-CB 4.02Å; Y253-K262 HydrophobicContact CE1-CD 3.66Å; Y253-K262 HydrophobicContact CE1-CG 4.49Å
254	L	65.1	Low	66.8	Low	154 Å²	154	71.2 Å²	71.2	81%	0.806	40%	0.395	S	S	*	.	S	Bend	trans	-77.3	-30.7	178.7	-78.9	122.7	0	0	0	112.2	D258	L254-D258 PolarHBondContact N-OD2 3.29Å
255	S	69.8	Low	67.4	Low	42 Å²	42	71.2 Å²	71.2	29%	0.294	41%	0.412	S	S	.	.	S	Bend	trans	-148.3	160	179.3	67.5	0	0	0	0	111.7	L257 D258 C259	S255-L257 PolarHBondContact O-N 3.37Å; S255-D258 WeakPolarHBondContact O-CB 3.26Å; S255-D258 PolarHBondContact O-N 3.46Å; S255-D258 VanDerWaalsContact O-N 3.15Å; S255-D258 WeakPolarHBondContact OG-CB 3.37Å; S255-D258 PolarHBondContact OG-N 2.99Å; S255-C259 PolarHBondContact O-N 3.37Å
256	P	68.1	Low	67.9	Low	53 Å²	53	74.1 Å²	74.1	34%	0.344	43%	0.429	S	S	.	.	H	α-helix	trans	-57.6	-31.3	172.1	-23.4	33.4	0	0	0	112.7	C259 M260	P256-C259 WeakPolarHBondContact O-CB 3.48Å; P256-C259 PolarHBondContact O-N 2.81Å; P256-M260 PolarHBondContact O-N 2.94Å
257	L	75.1	Confident	68.4	Low	112 Å²	112	73 Å²	73	59%	0.586	42%	0.423	S	S	*	.	H	α-helix	trans	-72.2	-40	176.4	-63.9	175.6	0	0	0	111.8	S255 C259 M260 I261	S255-L257 PolarHBondContact O-N 3.37Å; L257-C259 VanDerWaalsContact C-N 3.3Å; L257-C259 PolarHBondContact O-N 3.34Å; L257-M260 HydrophobicContact CD2-CE 4.04Å; L257-M260 WeakPolarHBondContact O-CB 3.36Å; L257-M260 PolarHBondContact O-N 3.47Å; L257-I261 VanDerWaalsContact O-CG1 3.27Å; L257-I261 WeakPolarHBondContact O-CG1 3.31Å; L257-I261 PolarHBondContact O-N 3.07Å
258	D	76.2	Confident	69.3	Low	35 Å²	35	70.7 Å²	70.7	19%	0.187	42%	0.415	C	S	.	.	H	α-helix	trans	-62.6	-38.8	172.7	-179.6	39.2	0	0	0	111.1	L254 S255 K262	L254-D258 PolarHBondContact N-OD2 3.29Å; S255-D258 WeakPolarHBondContact O-CB 3.26Å; S255-D258 PolarHBondContact O-N 3.46Å; S255-D258 VanDerWaalsContact O-N 3.15Å; S255-D258 WeakPolarHBondContact OG-CB 3.37Å; S255-D258 PolarHBondContact OG-N 2.99Å; D258-K262 WeakPolarHBondContact O-CB 3.27Å; D258-K262 WeakPolarHBondContact O-CG 3.29Å; D258-K262 PolarHBondContact O-N 3.18Å; D258-K262 WeakPolarHBondContact OD1-CE 3.25Å; D258-K262 IonicContact OD1-NZ 3.28Å; D258-K262 PolarHBondContact OD1-NZ 3.16Å; D258-K262 IonicContact OD2-NZ 3.92Å; D258-K262 PolarHBondContact OD2-NZ 2.93Å
259	C	69.4	Low	70.4	Confident	0 Å²	0	74 Å²	74	0%	0	44%	0.435	C	S	.	.	H	α-helix	trans	-60.8	-48.8	171.4	-172.6	0	0	0	0	111.8	V241 Y253 S255 P256 L257 I261 K262 M263	V241-C259 HydrophobicContact CG1-CB 4.47Å; Y253-C259 HydrophobicContact CD1-CB 3.63Å; Y253-C259 HydrophobicContact CD2-CB 4.28Å; Y253-C259 HydrophobicContact CE1-CB 4.04Å; Y253-C259 HydrophobicContact CG-CB 3.75Å; S255-C259 PolarHBondContact O-N 3.37Å; P256-C259 WeakPolarHBondContact O-CB 3.48Å; P256-C259 PolarHBondContact O-N 2.81Å; L257-C259 VanDerWaalsContact C-N 3.3Å; L257-C259 PolarHBondContact O-N 3.34Å; C259-I261 PolarHBondContact O-N 2.89Å; C259-K262 PolarHBondContact O-N 3.37Å; C259-M263 VanDerWaalsContact O-CB 3.26Å; C259-M263 WeakPolarHBondContact O-CB 3.37Å; C259-M263 PolarHBondContact O-N 2.76Å
260	M	72.8	Confident	71	Confident	77 Å²	77	75 Å²	75	38%	0.379	44%	0.441	S	S	.	.	H	α-helix	trans	-59	-47.4	178.1	-174.8	-177.8	71.4	0	0	112.2	V241 P256 L257 M263 V264 F272	V241-M260 HydrophobicContact CG1-CB 4.45Å; V241-M260 HydrophobicContact CG2-CB 4.19Å; V241-M260 HydrophobicContact CG2-CG 4.29Å; P256-M260 PolarHBondContact O-N 2.94Å; L257-M260 HydrophobicContact CD2-CE 4.04Å; L257-M260 WeakPolarHBondContact O-CB 3.36Å; L257-M260 PolarHBondContact O-N 3.47Å; M260-M263 PolarHBondContact O-N 2.98Å; M260-V264 WeakPolarHBondContact O-CG2 3.39Å; M260-V264 PolarHBondContact O-N 3.04Å; M260-F272 HydrophobicContact CG-CE1 3.87Å; M260-F272 HydrophobicContact CG-CZ 3.78Å
261	I	78.5	Confident	71.5	Confident	108 Å²	108	68.5 Å²	68.5	55%	0.554	40%	0.398	S	S	*	.	H	α-helix	trans	-64.7	-46.9	-178.9	-67.5	164.5	0	0	0	110.7	L257 C259 M263 V264 A265	L257-I261 VanDerWaalsContact O-CG1 3.27Å; L257-I261 WeakPolarHBondContact O-CG1 3.31Å; L257-I261 PolarHBondContact O-N 3.07Å; C259-I261 PolarHBondContact O-N 2.89Å; I261-M263 VanDerWaalsContact C-N 3.27Å; I261-M263 PolarHBondContact O-N 2.92Å; I261-V264 PolarHBondContact O-N 3.18Å; I261-A265 WeakPolarHBondContact O-CB 3.34Å; I261-A265 PolarHBondContact O-N 2.85Å
262	K	76.4	Confident	71.8	Confident	66 Å²	66	65.9 Å²	65.9	29%	0.287	37%	0.366	S	S	.	.	H	α-helix	trans	-61.4	-36.7	175.4	-77.7	170.2	176.7	160.7	0	111.9	Q252 Y253 D258 C259 A265 Q266	Q252-K262 PolarHBondContact O-NZ 3.49Å; Y253-K262 HydrophobicContact CD1-CD 3.85Å; Y253-K262 HydrophobicContact CE1-CB 4.02Å; Y253-K262 HydrophobicContact CE1-CD 3.66Å; Y253-K262 HydrophobicContact CE1-CG 4.49Å; D258-K262 WeakPolarHBondContact O-CB 3.27Å; D258-K262 WeakPolarHBondContact O-CG 3.29Å; D258-K262 PolarHBondContact O-N 3.18Å; D258-K262 WeakPolarHBondContact OD1-CE 3.25Å; D258-K262 IonicContact OD1-NZ 3.28Å; D258-K262 PolarHBondContact OD1-NZ 3.16Å; D258-K262 IonicContact OD2-NZ 3.92Å; D258-K262 PolarHBondContact OD2-NZ 2.93Å; C259-K262 PolarHBondContact O-N 3.37Å; K262-A265 PolarHBondContact O-N 3.38Å; K262-Q266 VanDerWaalsContact O-CB 3.26Å; K262-Q266 WeakPolarHBondContact O-CB 3.31Å; K262-Q266 VanDerWaalsContact O-CG 3.29Å; K262-Q266 WeakPolarHBondContact O-CG 3.27Å; K262-Q266 PolarHBondContact O-N 2.89Å
263	M	72.9	Confident	72	Confident	6 Å²	6	66.4 Å²	66.4	3%	0.03	36%	0.364	C	S	.	.	H	α-helix	trans	-67.8	-42.1	178.3	-151.8	178	88.5	0	0	111.8	V240 V241 R244 C259 M260 I261 E267 G268 A271 F272	V240-M263 HydrophobicContact CG1-CE 3.8Å; V240-M263 HydrophobicContact CG1-SD 4.04Å; V241-M263 HydrophobicContact CG2-CE 4.49Å; R244-M263 HydrophobicContact CG-SD 4.37Å; C259-M263 VanDerWaalsContact O-CB 3.26Å; C259-M263 WeakPolarHBondContact O-CB 3.37Å; C259-M263 PolarHBondContact O-N 2.76Å; M260-M263 PolarHBondContact O-N 2.98Å; I261-M263 VanDerWaalsContact C-N 3.27Å; I261-M263 PolarHBondContact O-N 2.92Å; M263-E267 PolarHBondContact O-N 3.49Å; M263-G268 PolarHBondContact O-N 2.93Å; M263-A271 HydrophobicContact CE-CB 4.2Å; M263-A271 HydrophobicContact CG-CB 4.45Å; M263-F272 HydrophobicContact CE-CB 4.39Å; M263-F272 HydrophobicContact CE-CD1 3.26Å; M263-F272 HydrophobicContact CE-CD2 3.91Å; M263-F272 HydrophobicContact CE-CE1 3.27Å; M263-F272 HydrophobicContact CE-CE2 3.88Å; M263-F272 HydrophobicContact CE-CG 3.61Å; M263-F272 HydrophobicContact CE-CZ 3.59Å
264	V	80.3	Confident	71.7	Confident	70 Å²	70	71.4 Å²	71.4	42%	0.424	39%	0.387	S	S	.	.	H	α-helix	trans	-60.3	-47.4	171.7	176.6	0	0	0	0	110.5	M260 I261 G268 F272	M260-V264 WeakPolarHBondContact O-CG2 3.39Å; M260-V264 PolarHBondContact O-N 3.04Å; I261-V264 PolarHBondContact O-N 3.18Å; V264-G268 VanDerWaalsContact O-CA 3.27Å; V264-G268 WeakPolarHBondContact O-CA 3.34Å; V264-G268 PolarHBondContact O-N 3.06Å; V264-G268 VanDerWaalsContact O-N 3.13Å; V264-F272 HydrophobicContact CB-CE2 4.48Å; V264-F272 HydrophobicContact CG2-CE2 3.43Å; V264-F272 VanDerWaalsContact CG2-CE2 3.43Å; V264-F272 HydrophobicContact CG2-CZ 3.58Å
265	A	78.8	Confident	71.3	Confident	83 Å²	83	65.6 Å²	65.6	69%	0.686	36%	0.364	S	S	*	.	H	α-helix	trans	-69.2	-33.9	-174.4	0	0	0	0	0	113.4	I261 K262	I261-A265 WeakPolarHBondContact O-CB 3.34Å; I261-A265 PolarHBondContact O-N 2.85Å; K262-A265 PolarHBondContact O-N 3.38Å
266	Q	76	Confident	71	Confident	147 Å²	147	65.6 Å²	65.6	69%	0.687	36%	0.359	S	S	*	.	H	α-helix	trans	-98.1	-38	-174.2	-66	179.5	-11	0	0	113.8	K262	K262-Q266 VanDerWaalsContact O-CB 3.26Å; K262-Q266 WeakPolarHBondContact O-CB 3.31Å; K262-Q266 VanDerWaalsContact O-CG 3.29Å; K262-Q266 WeakPolarHBondContact O-CG 3.27Å; K262-Q266 PolarHBondContact O-N 2.89Å
267	E	68.8	Low	70.6	Confident	61 Å²	61	68.2 Å²	68.2	29%	0.285	37%	0.374	S	S	.	.	H	α-helix	trans	-114	-8.5	-174.1	-60.4	-167.7	-158.6	0	0	113.7	R244 M263 A271 K274	R244-E267 IonicContact CZ-OE1 3.78Å; R244-E267 VanDerWaalsContact CZ-OE1 3.3Å; R244-E267 IonicContact NH1-OE1 3.98Å; R244-E267 PolarHBondContact NH1-OE1 2.96Å; R244-E267 VanDerWaalsContact NH1-OE1 3.11Å; R244-E267 IonicContact NH2-OE1 2.87Å; R244-E267 PolarHBondContact NH2-OE1 3.47Å; R244-E267 IonicContact NH2-OE2 3.4Å; R244-E267 PolarHBondContact NH2-OE2 3.43Å; M263-E267 PolarHBondContact O-N 3.49Å; E267-A271 HydrophobicContact CB-CB 3.49Å; E267-A271 VanDerWaalsContact CB-CB 3.49Å; E267-K274 IonicContact OE2-NZ 2.92Å; E267-K274 PolarHBondContact OE2-NZ 2.88Å
268	G	76.5	Confident	69.9	Low	18 Å²	18	65 Å²	65	19%	0.186	36%	0.359	C	S	.	.			trans	78.5	172.9	-178.9	0	0	0	0	0	114.4	M263 V264 T270 A271	M263-G268 PolarHBondContact O-N 2.93Å; V264-G268 VanDerWaalsContact O-CA 3.27Å; V264-G268 WeakPolarHBondContact O-CA 3.34Å; V264-G268 PolarHBondContact O-N 3.06Å; V264-G268 VanDerWaalsContact O-N 3.13Å; G268-T270 PolarHBondContact O-N 3.4Å; G268-A271 VanDerWaalsContact O-CB 3.23Å; G268-A271 WeakPolarHBondContact O-CB 3.47Å; G268-A271 PolarHBondContact O-N 3.47Å; G268-A271 VanDerWaalsContact O-N 3.16Å
269	P	72.9	Confident	69.3	Low	96 Å²	96	64 Å²	64	62%	0.623	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-68.5	-20.3	-175.9	26.4	-34.1	0	0	0	113.8	A271 F272	P269-A271 PolarHBondContact O-N 3.06Å; P269-F272 WeakPolarHBondContact O-CD2 3.13Å; P269-F272 PolarHBondContact O-N 3.28Å
270	T	69.6	Low	69.1	Low	102 Å²	102	67.2 Å²	67.2	63%	0.626	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-71.1	-18.2	175.5	53.1	0	0	0	0	112.5	G268 F272 Y273 K274	G268-T270 PolarHBondContact O-N 3.4Å; T270-F272 VanDerWaalsContact C-N 3.28Å; T270-F272 PolarHBondContact O-N 3.12Å; T270-Y273 PolarHBondContact O-N 3.43Å; T270-K274 PolarHBondContact O-N 3.12Å
271	A	65.5	Low	68.7	Low	3 Å²	3	68.4 Å²	68.4	3%	0.025	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-63.7	-31.3	176.5	0	0	0	0	0	112.9	M263 E267 G268 P269 Y273 K274	M263-A271 HydrophobicContact CE-CB 4.2Å; M263-A271 HydrophobicContact CG-CB 4.45Å; E267-A271 HydrophobicContact CB-CB 3.49Å; E267-A271 VanDerWaalsContact CB-CB 3.49Å; G268-A271 VanDerWaalsContact O-CB 3.23Å; G268-A271 WeakPolarHBondContact O-CB 3.47Å; G268-A271 PolarHBondContact O-N 3.47Å; G268-A271 VanDerWaalsContact O-N 3.16Å; P269-A271 PolarHBondContact O-N 3.06Å; A271-Y273 PolarHBondContact O-N 3.05Å; A271-K274 WeakPolarHBondContact O-CB 3.43Å; A271-K274 PolarHBondContact O-N 3.27Å
272	F	66.9	Low	68.1	Low	18 Å²	18	66.7 Å²	66.7	8%	0.079	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-66.1	-20.9	177	-68.1	-82.7	0	0	0	113.7	P237 V240 V241 M260 M263 V264 P269 T270	P237-F272 HydrophobicContact CB-CB 4.04Å; P237-F272 HydrophobicContact CB-CD1 3.71Å; P237-F272 HydrophobicContact CB-CG 4.19Å; P237-F272 HydrophobicContact CG-CB 4.27Å; V240-F272 WeakPolarHBondContact CG2-O 3.5Å; V241-F272 HydrophobicContact CG2-CD1 4.15Å; V241-F272 HydrophobicContact CG2-CE1 3.6Å; M260-F272 HydrophobicContact CG-CE1 3.87Å; M260-F272 HydrophobicContact CG-CZ 3.78Å; M263-F272 HydrophobicContact CE-CB 4.39Å; M263-F272 HydrophobicContact CE-CD1 3.26Å; M263-F272 HydrophobicContact CE-CD2 3.91Å; M263-F272 HydrophobicContact CE-CE1 3.27Å; M263-F272 HydrophobicContact CE-CE2 3.88Å; M263-F272 HydrophobicContact CE-CG 3.61Å; M263-F272 HydrophobicContact CE-CZ 3.59Å; V264-F272 HydrophobicContact CB-CE2 4.48Å; V264-F272 HydrophobicContact CG2-CE2 3.43Å; V264-F272 VanDerWaalsContact CG2-CE2 3.43Å; V264-F272 HydrophobicContact CG2-CZ 3.58Å; P269-F272 WeakPolarHBondContact O-CD2 3.13Å; P269-F272 PolarHBondContact O-N 3.28Å; T270-F272 VanDerWaalsContact C-N 3.28Å; T270-F272 PolarHBondContact O-N 3.12Å
273	Y	67.2	Low	67.5	Low	114 Å²	114	65.7 Å²	65.7	45%	0.447	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-104.4	-0.5	178.7	-67	-84.9	0	0	0	112.7	V233 T270 A271 G275 F276	V233-Y273 HydrophobicContact CG1-CE1 4.43Å; T270-Y273 PolarHBondContact O-N 3.43Å; A271-Y273 PolarHBondContact O-N 3.05Å; Y273-G275 PolarHBondContact O-N 3.27Å; Y273-F276 HydrophobicContact CD1-CB 4.31Å; Y273-F276 HydrophobicContact CD1-CD2 4.2Å; Y273-F276 HydrophobicContact CD1-CG 4.34Å; Y273-F276 VanDerWaalsContact O-CB 3.26Å; Y273-F276 WeakPolarHBondContact O-CB 3.33Å; Y273-F276 PolarHBondContact O-N 2.84Å
274	K	59.1	Low	67	Low	134 Å²	134	66.3 Å²	66.3	58%	0.583	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	108.6	169	-76	-179.7	-177.3	167.5	0	108.5	E267 T270 A271	E267-K274 IonicContact OE2-NZ 2.92Å; E267-K274 PolarHBondContact OE2-NZ 2.88Å; T270-K274 PolarHBondContact O-N 3.12Å; A271-K274 WeakPolarHBondContact O-CB 3.43Å; A271-K274 PolarHBondContact O-N 3.27Å
275	G	57.5	Low	66.2	Low	32 Å²	32	64.5 Å²	64.5	33%	0.33	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.3	7	-174.6	0	0	0	0	0	114.8	Y273 P278 S279	Y273-G275 PolarHBondContact O-N 3.27Å; G275-P278 WeakPolarHBondContact O-CD 3.24Å; G275-P278 WeakPolarHBondContact O-CG 3.49Å; G275-S279 VanDerWaalsContact O-CB 3.31Å; G275-S279 WeakPolarHBondContact O-CB 3.44Å; G275-S279 PolarHBondContact O-N 3.41Å; G275-S279 VanDerWaalsContact O-N 3.13Å; G275-S279 PolarHBondContact O-OG 3Å
276	F	63.2	Low	65.7	Low	43 Å²	43	63.9 Å²	63.9	19%	0.189	34%	0.339	C	S	.	.	H	α-helix	trans	-58.4	-52.1	170.4	178.3	-100.8	0	0	0	111.2	V233 S236 Y273 S279 F280	V233-F276 HydrophobicContact CG2-CE2 3.96Å; V233-F276 HydrophobicContact CG2-CZ 4Å; S236-F276 WeakPolarHBondContact OG-CD2 3.33Å; Y273-F276 HydrophobicContact CD1-CB 4.31Å; Y273-F276 HydrophobicContact CD1-CD2 4.2Å; Y273-F276 HydrophobicContact CD1-CG 4.34Å; Y273-F276 VanDerWaalsContact O-CB 3.26Å; Y273-F276 WeakPolarHBondContact O-CB 3.33Å; Y273-F276 PolarHBondContact O-N 2.84Å; F276-S279 CarbonylContact O-C 3.56Å; F276-S279 WeakPolarHBondContact O-CA 3.1Å; F276-S279 WeakPolarHBondContact O-CB 3.5Å; F276-S279 PolarHBondContact O-N 2.86Å; F276-F280 HydrophobicContact CD1-CB 4.48Å; F276-F280 HydrophobicContact CE1-CB 4.16Å; F276-F280 HydrophobicContact CE1-CG 4.35Å; F276-F280 HydrophobicContact CZ-CB 4.21Å; F276-F280 HydrophobicContact CZ-CD2 4.35Å; F276-F280 HydrophobicContact CZ-CG 4.33Å; F276-F280 VanDerWaalsContact O-CB 3.29Å; F276-F280 WeakPolarHBondContact O-CB 3.48Å; F276-F280 PolarHBondContact O-N 3.41Å
277	T	60.2	Low	65.1	Low	107 Å²	107	58.5 Å²	58.5	66%	0.656	32%	0.315	S	S	*	.	H	α-helix	trans	-54.1	-51.8	-178.9	-48.3	0	0	0	0	113.8	S279 F280 L281	T277-S279 VanDerWaalsContact C-N 3.33Å; T277-S279 PolarHBondContact O-N 3.37Å; T277-F280 PolarHBondContact O-N 3.5Å; T277-L281 VanDerWaalsContact O-CB 3.31Å; T277-L281 WeakPolarHBondContact O-CB 3.27Å; T277-L281 PolarHBondContact O-N 2.87Å
278	P	58.9	Low	64.9	Low	44 Å²	44	59.5 Å²	59.5	29%	0.286	33%	0.325	S	S	.	.	H	α-helix	trans	-68.1	-30.3	176	23.1	-31.6	0	0	0	113.2	V61 G275 R282	V61-P278 HydrophobicContact CG2-CB 4.23Å; G275-P278 WeakPolarHBondContact O-CD 3.24Å; G275-P278 WeakPolarHBondContact O-CG 3.49Å; P278-R282 VanDerWaalsContact O-CB 3.27Å; P278-R282 WeakPolarHBondContact O-CB 3.31Å; P278-R282 PolarHBondContact O-N 3.28Å; P278-R282 VanDerWaalsContact O-N 3.1Å
279	S	63.2	Low	64.4	Low	15 Å²	15	60.4 Å²	60.4	11%	0.105	33%	0.327	C	S	.	.	H	α-helix	trans	-69.2	-42.8	174.6	-63.6	0	0	0	0	112.2	K38 G275 F276 T277 R282 L283	K38-S279 WeakPolarHBondContact CE-OG 3.44Å; K38-S279 PolarHBondContact NZ-OG 3Å; G275-S279 VanDerWaalsContact O-CB 3.31Å; G275-S279 WeakPolarHBondContact O-CB 3.44Å; G275-S279 PolarHBondContact O-N 3.41Å; G275-S279 VanDerWaalsContact O-N 3.13Å; G275-S279 PolarHBondContact O-OG 3Å; F276-S279 CarbonylContact O-C 3.56Å; F276-S279 WeakPolarHBondContact O-CA 3.1Å; F276-S279 WeakPolarHBondContact O-CB 3.5Å; F276-S279 PolarHBondContact O-N 2.86Å; T277-S279 VanDerWaalsContact C-N 3.33Å; T277-S279 PolarHBondContact O-N 3.37Å; S279-R282 PolarHBondContact O-N 2.94Å; S279-L283 WeakPolarHBondContact O-CB 3.35Å; S279-L283 PolarHBondContact O-N 3.44Å
280	F	66.9	Low	63.9	Low	68 Å²	68	58.5 Å²	58.5	30%	0.298	31%	0.31	S	S	.	.	H	α-helix	trans	-65.6	-46.9	176.2	-179.9	-109.3	0	0	0	111.4	F229 F276 T277 R282 L283 G284	F229-F280 HydrophobicContact CD2-CD2 4.19Å; F229-F280 AromaticContact CD2-CE2 3.25Å; F229-F280 HydrophobicContact CD2-CE2 3.25Å; F229-F280 AromaticContact CD2-CZ 3.67Å; F229-F280 HydrophobicContact CD2-CZ 3.67Å; F229-F280 HydrophobicContact CE2-CD2 4.04Å; F229-F280 HydrophobicContact CE2-CE1 4.38Å; F229-F280 AromaticContact CE2-CE2 3.32Å; F229-F280 HydrophobicContact CE2-CE2 3.32Å; F229-F280 AromaticContact CE2-CZ 3.5Å; F229-F280 HydrophobicContact CE2-CZ 3.5Å; F229-F280 HydrophobicContact CG-CE2 4.47Å; F276-F280 HydrophobicContact CD1-CB 4.48Å; F276-F280 HydrophobicContact CE1-CB 4.16Å; F276-F280 HydrophobicContact CE1-CG 4.35Å; F276-F280 HydrophobicContact CZ-CB 4.21Å; F276-F280 HydrophobicContact CZ-CD2 4.35Å; F276-F280 HydrophobicContact CZ-CG 4.33Å; F276-F280 VanDerWaalsContact O-CB 3.29Å; F276-F280 WeakPolarHBondContact O-CB 3.48Å; F276-F280 PolarHBondContact O-N 3.41Å; T277-F280 PolarHBondContact O-N 3.5Å; F280-R282 VanDerWaalsContact C-N 3.29Å; F280-R282 PolarHBondContact O-N 3.04Å; F280-L283 PolarHBondContact O-N 2.92Å; F280-G284 PolarHBondContact O-N 3.36Å
281	L	64.1	Low	63.6	Low	102 Å²	102	57.1 Å²	57.1	53%	0.534	30%	0.296	S	S	.	.	H	α-helix	trans	-60.5	-39.8	177.4	-160.9	83.8	0	0	0	111.6	T277 S285	T277-L281 VanDerWaalsContact O-CB 3.31Å; T277-L281 WeakPolarHBondContact O-CB 3.27Å; T277-L281 PolarHBondContact O-N 2.87Å; L281-S285 VanDerWaalsContact O-CB 3.25Å; L281-S285 WeakPolarHBondContact O-CB 3.35Å; L281-S285 PolarHBondContact O-N 3.39Å; L281-S285 PolarHBondContact O-OG 2.86Å
282	R	65.5	Low	63.6	Low	71 Å²	71	60.8 Å²	60.8	27%	0.268	32%	0.318	S	S	.	.	H	α-helix	trans	-65	-46.4	175.3	-173.1	-168	88.5	106.5	0.5	111.9	D35 P278 S279 F280 S285 W286	D35-R282 VanDerWaalsContact OD1-CD 3.23Å; D35-R282 WeakPolarHBondContact OD1-CD 3.35Å; D35-R282 IonicContact OD1-CZ 2.89Å; D35-R282 IonicContact OD1-NE 2.84Å; D35-R282 IonicContact OD1-NH1 3.44Å; D35-R282 PolarHBondContact OD1-NH1 3.46Å; D35-R282 IonicContact OD2-NH1 3.45Å; P278-R282 VanDerWaalsContact O-CB 3.27Å; P278-R282 WeakPolarHBondContact O-CB 3.31Å; P278-R282 PolarHBondContact O-N 3.28Å; P278-R282 VanDerWaalsContact O-N 3.1Å; S279-R282 PolarHBondContact O-N 2.94Å; F280-R282 VanDerWaalsContact C-N 3.29Å; F280-R282 PolarHBondContact O-N 3.04Å; R282-S285 WeakPolarHBondContact CA-OG 3.4Å; R282-S285 PolarHBondContact O-OG 3.46Å; R282-W286 VanDerWaalsContact O-CB 3.22Å; R282-W286 WeakPolarHBondContact O-CB 3.22Å; R282-W286 PolarHBondContact O-N 2.96Å
283	L	63.3	Low	63.5	Low	46 Å²	46	61.1 Å²	61.1	24%	0.241	32%	0.322	C	S	.	.	H	α-helix	trans	-70.5	-39.9	-177.1	-157.5	128.5	0	0	0	111.4	T232 S279 F280 N287	T232-L283 HydrophobicContact CG2-CD1 4.23Å; T232-L283 HydrophobicContact CG2-CD2 4.35Å; T232-L283 WeakPolarHBondContact OG1-CD2 3.35Å; S279-L283 WeakPolarHBondContact O-CB 3.35Å; S279-L283 PolarHBondContact O-N 3.44Å; F280-L283 PolarHBondContact O-N 2.92Å; L283-N287 WeakPolarHBondContact O-CB 3.3Å; L283-N287 PolarHBondContact O-N 3.05Å
284	G	63.1	Low	63.3	Low	18 Å²	18	60.1 Å²	60.1	19%	0.186	32%	0.317	C	S	.	.	H	α-helix	trans	-61.7	-50	172.3	0	0	0	0	0	112.2	F280 N287 V288	F280-G284 PolarHBondContact O-N 3.36Å; G284-N287 PolarHBondContact O-N 3.47Å; G284-V288 WeakPolarHBondContact O-CB 3.27Å; G284-V288 WeakPolarHBondContact O-CG2 3.29Å; G284-V288 PolarHBondContact O-N 2.92Å
285	S	64.1	Low	63.5	Low	33 Å²	33	57.9 Å²	57.9	23%	0.231	31%	0.309	C	S	.	.	H	α-helix	trans	-63.5	-43	177.8	53	0	0	0	0	112.6	L281 R282 V288 V289	L281-S285 VanDerWaalsContact O-CB 3.25Å; L281-S285 WeakPolarHBondContact O-CB 3.35Å; L281-S285 PolarHBondContact O-N 3.39Å; L281-S285 PolarHBondContact O-OG 2.86Å; R282-S285 WeakPolarHBondContact CA-OG 3.4Å; R282-S285 PolarHBondContact O-OG 3.46Å; S285-V288 PolarHBondContact O-N 3.48Å; S285-V289 WeakPolarHBondContact O-CB 3.4Å; S285-V289 VanDerWaalsContact O-CG2 3.25Å; S285-V289 WeakPolarHBondContact O-CG2 3.29Å; S285-V289 PolarHBondContact O-N 3.4Å
286	W	66.6	Low	64	Low	70 Å²	70	61.6 Å²	61.6	27%	0.265	32%	0.318	S	S	.	.	H	α-helix	trans	-62.3	-45.6	176.4	-175.3	86.7	0	0	0	112.1	D28 T31 R282 V289 M290	D28-W286 PolarHBondContact OD1-NE1 3.11Å; T31-W286 HydrophobicContact CG2-CB 4.4Å; R282-W286 VanDerWaalsContact O-CB 3.22Å; R282-W286 WeakPolarHBondContact O-CB 3.22Å; R282-W286 PolarHBondContact O-N 2.96Å; W286-V289 PolarHBondContact O-N 2.91Å; W286-M290 HydrophobicContact CH2-SD 3.43Å; W286-M290 WeakPolarHBondContact CH2-SD 3.38Å; W286-M290 HydrophobicContact CZ2-SD 4.06Å; W286-M290 HydrophobicContact CZ3-SD 3.72Å; W286-M290 VanDerWaalsContact O-CB 3.31Å; W286-M290 WeakPolarHBondContact O-CB 3.49Å; W286-M290 PolarHBondContact O-N 3.36Å
287	N	64.7	Low	64.2	Low	34 Å²	34	62.1 Å²	62.1	18%	0.182	32%	0.322	C	S	.	.	H	α-helix	trans	-61.6	-46.8	176	-85.7	-16.2	0	0	0	111.7	L283 G284 V289 M290 F291	L283-N287 WeakPolarHBondContact O-CB 3.3Å; L283-N287 PolarHBondContact O-N 3.05Å; G284-N287 PolarHBondContact O-N 3.47Å; N287-V289 VanDerWaalsContact C-N 3.35Å; N287-V289 PolarHBondContact O-N 3.1Å; N287-M290 PolarHBondContact O-N 3.32Å; N287-F291 WeakPolarHBondContact O-CB 3.41Å; N287-F291 VanDerWaalsContact O-CD2 3.23Å; N287-F291 WeakPolarHBondContact O-CD2 3.28Å; N287-F291 PolarHBondContact O-N 3.44Å
288	V	63.7	Low	64.4	Low	81 Å²	81	61.3 Å²	61.3	49%	0.491	31%	0.31	S	S	.	.	H	α-helix	trans	-58.5	-47.7	178.8	169.7	0	0	0	0	110.7	G284 S285 F291 V292	G284-V288 WeakPolarHBondContact O-CB 3.27Å; G284-V288 WeakPolarHBondContact O-CG2 3.29Å; G284-V288 PolarHBondContact O-N 2.92Å; S285-V288 PolarHBondContact O-N 3.48Å; V288-F291 PolarHBondContact O-N 3.4Å; V288-V292 HydrophobicContact CG1-CG2 4.33Å; V288-V292 WeakPolarHBondContact O-CB 3.44Å; V288-V292 WeakPolarHBondContact O-CG2 3.23Å; V288-V292 PolarHBondContact O-N 3.14Å
289	V	66.1	Low	64.8	Low	37 Å²	37	65.9 Å²	65.9	22%	0.224	32%	0.321	C	S	.	.	H	α-helix	trans	-65.8	-42.8	180	176.4	0	0	0	0	111.3	A27 L30 S285 W286 N287 F291 T293	A27-V289 HydrophobicContact CB-CB 4.42Å; A27-V289 HydrophobicContact CB-CG1 3.74Å; L30-V289 HydrophobicContact CD1-CG1 3.97Å; S285-V289 WeakPolarHBondContact O-CB 3.4Å; S285-V289 VanDerWaalsContact O-CG2 3.25Å; S285-V289 WeakPolarHBondContact O-CG2 3.29Å; S285-V289 PolarHBondContact O-N 3.4Å; W286-V289 PolarHBondContact O-N 2.91Å; N287-V289 VanDerWaalsContact C-N 3.35Å; N287-V289 PolarHBondContact O-N 3.1Å; V289-F291 PolarHBondContact O-N 2.99Å; V289-T293 VanDerWaalsContact O-CB 3.28Å; V289-T293 WeakPolarHBondContact O-CB 3.22Å; V289-T293 PolarHBondContact O-N 2.97Å; V289-T293 PolarHBondContact O-OG1 3.44Å
290	M	63.6	Low	65.1	Low	56 Å²	56	67.5 Å²	67.5	28%	0.276	34%	0.336	S	S	.	.	H	α-helix	trans	-59.5	-47.6	176.8	-177.9	-175.8	175.5	0	0	111.4	W286 N287 T293 Y294	W286-M290 HydrophobicContact CH2-SD 3.43Å; W286-M290 WeakPolarHBondContact CH2-SD 3.38Å; W286-M290 HydrophobicContact CZ2-SD 4.06Å; W286-M290 HydrophobicContact CZ3-SD 3.72Å; W286-M290 VanDerWaalsContact O-CB 3.31Å; W286-M290 WeakPolarHBondContact O-CB 3.49Å; W286-M290 PolarHBondContact O-N 3.36Å; N287-M290 PolarHBondContact O-N 3.32Å; M290-T293 PolarHBondContact O-N 2.95Å; M290-Y294 VanDerWaalsContact O-CB 3.26Å; M290-Y294 WeakPolarHBondContact O-CB 3.17Å; M290-Y294 PolarHBondContact O-N 3.18Å
291	F	61.7	Low	65.1	Low	74 Å²	74	67.6 Å²	67.6	33%	0.325	34%	0.339	S	S	.	.	H	α-helix	trans	-67.6	-45.8	-178.8	-87	-68.4	0	0	0	112.7	F221 N287 V288 V289 T293 Y294 E295	F221-F291 HydrophobicContact CD2-CD1 4.24Å; F221-F291 HydrophobicContact CD2-CE1 4.01Å; F221-F291 HydrophobicContact CD2-CZ 4.33Å; F221-F291 HydrophobicContact CE2-CB 4.35Å; F221-F291 AromaticContact CE2-CD1 3.6Å; F221-F291 HydrophobicContact CE2-CD1 3.6Å; F221-F291 AromaticContact CE2-CD2 3.98Å; F221-F291 HydrophobicContact CE2-CD2 3.98Å; F221-F291 AromaticContact CE2-CE1 3.73Å; F221-F291 HydrophobicContact CE2-CE1 3.73Å; F221-F291 HydrophobicContact CE2-CE2 4.13Å; F221-F291 AromaticContact CE2-CG 3.72Å; F221-F291 HydrophobicContact CE2-CG 3.72Å; F221-F291 HydrophobicContact CE2-CZ 4Å; F221-F291 HydrophobicContact CZ-CD2 4.46Å; F221-F291 HydrophobicContact CZ-CG 4.4Å; N287-F291 WeakPolarHBondContact O-CB 3.41Å; N287-F291 VanDerWaalsContact O-CD2 3.23Å; N287-F291 WeakPolarHBondContact O-CD2 3.28Å; N287-F291 PolarHBondContact O-N 3.44Å; V288-F291 PolarHBondContact O-N 3.4Å; V289-F291 PolarHBondContact O-N 2.99Å; F291-T293 VanDerWaalsContact C-N 3.29Å; F291-T293 PolarHBondContact O-N 2.85Å; F291-Y294 PolarHBondContact O-N 2.86Å; F291-E295 PolarHBondContact O-N 2.91Å
292	V	66.2	Low	65.3	Low	79 Å²	79	65.9 Å²	65.9	48%	0.479	33%	0.329	S	S	.	.	H	α-helix	trans	-59	-44.9	176.6	170.8	0	0	0	0	110.1	V288 E295 Q296	V288-V292 HydrophobicContact CG1-CG2 4.33Å; V288-V292 WeakPolarHBondContact O-CB 3.44Å; V288-V292 WeakPolarHBondContact O-CG2 3.23Å; V288-V292 PolarHBondContact O-N 3.14Å; V292-E295 PolarHBondContact O-N 2.98Å; V292-Q296 VanDerWaalsContact O-CG 3.27Å; V292-Q296 WeakPolarHBondContact O-CG 3.35Å; V292-Q296 PolarHBondContact O-N 2.63Å
293	T	64.7	Low	65.5	Low	26 Å²	26	69.7 Å²	69.7	16%	0.16	35%	0.348	C	S	.	.	H	α-helix	trans	-66.2	-43.5	179.8	-50.7	0	0	0	0	111.3	A23 F26 V289 M290 F291 E295 Q296 L297	A23-T293 HydrophobicContact CB-CG2 3.7Å; F26-T293 HydrophobicContact CB-CG2 4.49Å; F26-T293 HydrophobicContact CD1-CG2 4.11Å; V289-T293 VanDerWaalsContact O-CB 3.28Å; V289-T293 WeakPolarHBondContact O-CB 3.22Å; V289-T293 PolarHBondContact O-N 2.97Å; V289-T293 PolarHBondContact O-OG1 3.44Å; M290-T293 PolarHBondContact O-N 2.95Å; F291-T293 VanDerWaalsContact C-N 3.29Å; F291-T293 PolarHBondContact O-N 2.85Å; T293-E295 PolarHBondContact O-N 3.5Å; T293-Q296 PolarHBondContact O-N 2.95Å; T293-L297 WeakPolarHBondContact O-CB 3.28Å; T293-L297 PolarHBondContact O-N 3.44Å
294	Y	62.5	Low	66	Low	92 Å²	92	71.9 Å²	71.9	36%	0.361	36%	0.362	S	S	.	.	H	α-helix	trans	-62.2	-42.7	176.9	-179.4	-102.1	0	0	0	112.6	M290 F291 L297 K298	M290-Y294 VanDerWaalsContact O-CB 3.26Å; M290-Y294 WeakPolarHBondContact O-CB 3.17Å; M290-Y294 PolarHBondContact O-N 3.18Å; F291-Y294 PolarHBondContact O-N 2.86Å; Y294-L297 PolarHBondContact O-N 2.98Å; Y294-K298 WeakPolarHBondContact O-CB 3.41Å; Y294-K298 PolarHBondContact O-N 2.76Å
295	E	63.2	Low	66.2	Low	87 Å²	87	76 Å²	76	41%	0.407	38%	0.377	S	S	.	.	H	α-helix	trans	-63.6	-45.4	176.5	-82.5	-161.2	-170.3	0	0	112.4	F291 V292 T293 L297 K298 R299	F291-E295 PolarHBondContact O-N 2.91Å; V292-E295 PolarHBondContact O-N 2.98Å; T293-E295 PolarHBondContact O-N 3.5Å; E295-L297 VanDerWaalsContact C-N 3.28Å; E295-L297 PolarHBondContact O-N 3.12Å; E295-K298 PolarHBondContact O-N 3.37Å; E295-R299 WeakPolarHBondContact O-CB 3.09Å; E295-R299 VanDerWaalsContact O-CG 3.25Å; E295-R299 WeakPolarHBondContact O-CG 3.44Å; E295-R299 PolarHBondContact O-N 3.16Å; E295-R299 IonicContact OE2-CZ 2.7Å; E295-R299 IonicContact OE2-NE 2.69Å; E295-R299 IonicContact OE2-NH2 3.35Å; E295-R299 PolarHBondContact OE2-NH2 3.09Å
296	Q	69.7	Low	66.1	Low	110 Å²	110	79.3 Å²	79.3	51%	0.514	39%	0.39	S	S	.	.	H	α-helix	trans	-63.5	-39.4	178.3	-66.9	-62	-6.7	0	0	111.1	V292 T293 R299 A300	V292-Q296 VanDerWaalsContact O-CG 3.27Å; V292-Q296 WeakPolarHBondContact O-CG 3.35Å; V292-Q296 PolarHBondContact O-N 2.63Å; T293-Q296 PolarHBondContact O-N 2.95Å; Q296-R299 PolarHBondContact O-N 3.32Å; Q296-A300 WeakPolarHBondContact O-CB 3.43Å; Q296-A300 PolarHBondContact O-N 3.43Å
297	L	66.1	Low	66.1	Low	54 Å²	54	82.2 Å²	82.2	28%	0.283	41%	0.41	S	S	.	.	H	α-helix	trans	-67	-41.6	177.2	-149.5	83.4	0	0	0	112.2	G19 T293 Y294 E295 A300 L301	G19-L297 WeakPolarHBondContact O-CD2 3.17Å; T293-L297 WeakPolarHBondContact O-CB 3.28Å; T293-L297 PolarHBondContact O-N 3.44Å; Y294-L297 PolarHBondContact O-N 2.98Å; E295-L297 VanDerWaalsContact C-N 3.28Å; E295-L297 PolarHBondContact O-N 3.12Å; L297-A300 PolarHBondContact O-N 2.83Å; L297-L301 WeakPolarHBondContact O-CB 3.31Å; L297-L301 WeakPolarHBondContact O-CG 3.41Å; L297-L301 PolarHBondContact O-N 2.82Å
298	K	63.8	Low	65.9	Low	90 Å²	90	91.3 Å²	91.3	39%	0.391	44%	0.442	S	S	.	.	H	α-helix	trans	-61.9	-44.4	174	-174	-178.4	177.5	-174.1	0	111.2	Y294 E295 A300 L301 M302	Y294-K298 WeakPolarHBondContact O-CB 3.41Å; Y294-K298 PolarHBondContact O-N 2.76Å; E295-K298 PolarHBondContact O-N 3.37Å; K298-A300 VanDerWaalsContact C-N 3.33Å; K298-A300 PolarHBondContact O-N 3Å; K298-L301 PolarHBondContact O-N 3.21Å; K298-M302 VanDerWaalsContact O-CG 3.24Å; K298-M302 WeakPolarHBondContact O-CG 3.45Å; K298-M302 PolarHBondContact O-N 2.63Å
299	R	68.2	Low	65.8	Low	140 Å²	140	94.4 Å²	94.4	53%	0.528	45%	0.451	S	S	.	.	H	α-helix	trans	-62	-40.6	176.4	-70.9	174.5	-163.5	-158.7	8.4	111.6	E295 Q296 K303	E295-R299 WeakPolarHBondContact O-CB 3.09Å; E295-R299 VanDerWaalsContact O-CG 3.25Å; E295-R299 WeakPolarHBondContact O-CG 3.44Å; E295-R299 PolarHBondContact O-N 3.16Å; E295-R299 IonicContact OE2-CZ 2.7Å; E295-R299 IonicContact OE2-NE 2.69Å; E295-R299 IonicContact OE2-NH2 3.35Å; E295-R299 PolarHBondContact OE2-NH2 3.09Å; Q296-R299 PolarHBondContact O-N 3.32Å; R299-K303 WeakPolarHBondContact O-CG 3.21Å; R299-K303 PolarHBondContact O-N 2.99Å; R299-K303 VanDerWaalsContact O-N 3.07Å
300	A	70.1	Confident	64.8	Low	49 Å²	49	95.8 Å²	95.8	41%	0.405	46%	0.462	S	S	.	.	H	α-helix	trans	-65.5	-45.6	176.2	0	0	0	0	0	112	Q296 L297 K298 M302 K303 V304	Q296-A300 WeakPolarHBondContact O-CB 3.43Å; Q296-A300 PolarHBondContact O-N 3.43Å; L297-A300 PolarHBondContact O-N 2.83Å; K298-A300 VanDerWaalsContact C-N 3.33Å; K298-A300 PolarHBondContact O-N 3Å; A300-M302 PolarHBondContact O-N 2.89Å; A300-K303 WeakPolarHBondContact O-CB 3.43Å; A300-K303 PolarHBondContact O-N 3.47Å; A300-V304 WeakPolarHBondContact O-CG2 3.25Å; A300-V304 PolarHBondContact O-N 3.37Å
301	L	66.9	Low	64.3	Low	70 Å²	70	98.8 Å²	98.8	37%	0.366	49%	0.486	S	S	.	.	H	α-helix	trans	-61.9	-41.8	177.1	-75.4	166.3	0	0	0	112.4	V15 L297 K298 K303 V304 Q305	V15-L301 HydrophobicContact CG1-CD1 3.72Å; V15-L301 HydrophobicContact CG1-CD2 4.39Å; L297-L301 WeakPolarHBondContact O-CB 3.31Å; L297-L301 WeakPolarHBondContact O-CG 3.41Å; L297-L301 PolarHBondContact O-N 2.82Å; K298-L301 PolarHBondContact O-N 3.21Å; L301-K303 PolarHBondContact O-N 2.83Å; L301-V304 PolarHBondContact O-N 3.46Å; L301-Q305 PolarHBondContact O-N 3.03Å
302	M	67.4	Low	63.6	Low	67 Å²	67	108.7 Å²	108.7	33%	0.33	53%	0.529	S	S	.	.	H	α-helix	trans	-64.1	-39.4	175.4	-68.4	-73.1	-79.7	0	0	111.7	K298 A300 V304 Q305 M306	K298-M302 VanDerWaalsContact O-CG 3.24Å; K298-M302 WeakPolarHBondContact O-CG 3.45Å; K298-M302 PolarHBondContact O-N 2.63Å; A300-M302 PolarHBondContact O-N 2.89Å; M302-V304 VanDerWaalsContact C-N 3.35Å; M302-Q305 PolarHBondContact O-N 3.14Å; M302-M306 WeakPolarHBondContact O-CB 3.41Å; M302-M306 WeakPolarHBondContact O-CG 3.29Å; M302-M306 PolarHBondContact O-N 2.9Å
303	K	70.8	Confident	63.5	Low	151 Å²	151	110.2 Å²	110.2	66%	0.657	53%	0.532	S	S	*	.	H	α-helix	trans	-62.9	-41	173.3	-77.6	-179.2	179.3	-175.7	0	111.9	R299 A300 L301 M306 L307	R299-K303 WeakPolarHBondContact O-CG 3.21Å; R299-K303 PolarHBondContact O-N 2.99Å; R299-K303 VanDerWaalsContact O-N 3.07Å; A300-K303 WeakPolarHBondContact O-CB 3.43Å; A300-K303 PolarHBondContact O-N 3.47Å; L301-K303 PolarHBondContact O-N 2.83Å; K303-M306 PolarHBondContact O-N 3.27Å; K303-L307 WeakPolarHBondContact O-CB 3.41Å; K303-L307 VanDerWaalsContact O-CG 3.27Å; K303-L307 WeakPolarHBondContact O-CG 3.45Å; K303-L307 PolarHBondContact O-N 3.3Å
304	V	72.1	Confident	63.4	Low	91 Å²	91	114.6 Å²	114.6	55%	0.552	55%	0.551	S	S	*	*	H	α-helix	trans	-67.8	-38.2	177.7	172.1	0	0	0	0	111.7	A300 L301 M302 L307 R308	A300-V304 WeakPolarHBondContact O-CG2 3.25Å; A300-V304 PolarHBondContact O-N 3.37Å; L301-V304 PolarHBondContact O-N 3.46Å; M302-V304 VanDerWaalsContact C-N 3.35Å; V304-L307 PolarHBondContact O-N 2.86Å; V304-R308 WeakPolarHBondContact O-CB 3.47Å; V304-R308 PolarHBondContact O-N 3.35Å
305	Q	68.4	Low	63.4	Low	105 Å²	105	115.9 Å²	115.9	49%	0.491	56%	0.562	S	S	.	*	H	α-helix	trans	-65.4	-43.6	173.4	-78.7	177.4	-46.4	0	0	111.9	L301 M302 L307 R308 E309	L301-Q305 PolarHBondContact O-N 3.03Å; M302-Q305 PolarHBondContact O-N 3.14Å; Q305-L307 VanDerWaalsContact C-N 3.3Å; Q305-L307 PolarHBondContact O-N 3.2Å; Q305-R308 CarbonylContact O-C 3.58Å; Q305-R308 WeakPolarHBondContact O-CA 3.28Å; Q305-R308 PolarHBondContact O-N 3.31Å; Q305-E309 PolarHBondContact O-N 3.36Å
306	M	61.3	Low	63.5	Low	102 Å²	102	117.6 Å²	117.6	50%	0.502	57%	0.571	S	S	.	*	H	α-helix	trans	-62.3	-36	175.4	-70.2	-80.6	161.5	0	0	112.6	M302 K303 R308 S310	M302-M306 WeakPolarHBondContact O-CB 3.41Å; M302-M306 WeakPolarHBondContact O-CG 3.29Å; M302-M306 PolarHBondContact O-N 2.9Å; K303-M306 PolarHBondContact O-N 3.27Å; M306-R308 VanDerWaalsContact C-N 3.29Å; M306-S310 PolarHBondContact O-N 3.49Å; M306-S310 VanDerWaalsContact O-N 3.11Å; M306-S310 PolarHBondContact O-OG 3.46Å
307	L	66	Low	63.1	Low	131 Å²	131	118.1 Å²	118.1	69%	0.686	58%	0.575	S	S	*	*	H	α-helix	trans	-71.1	-22.2	173	-74.4	167.1	0	0	0	113.3	K303 V304 Q305 S310	K303-L307 WeakPolarHBondContact O-CB 3.41Å; K303-L307 VanDerWaalsContact O-CG 3.27Å; K303-L307 WeakPolarHBondContact O-CG 3.45Å; K303-L307 PolarHBondContact O-N 3.3Å; V304-L307 PolarHBondContact O-N 2.86Å; Q305-L307 VanDerWaalsContact C-N 3.3Å; Q305-L307 PolarHBondContact O-N 3.2Å; L307-S310 WeakPolarHBondContact CA-OG 3.28Å; L307-S310 PolarHBondContact O-OG 2.91Å
308	R	60.6	Low	62.9	Low	226 Å²	226	122.3 Å²	122.3	85%	0.853	59%	0.594	S	S	*	*	H	α-helix	trans	-89.7	-28.3	177.2	-172	169.1	-173.3	161.1	2.6	112.7	V304 Q305 M306	V304-R308 WeakPolarHBondContact O-CB 3.47Å; V304-R308 PolarHBondContact O-N 3.35Å; Q305-R308 CarbonylContact O-C 3.58Å; Q305-R308 WeakPolarHBondContact O-CA 3.28Å; Q305-R308 PolarHBondContact O-N 3.31Å; M306-R308 VanDerWaalsContact C-N 3.29Å
309	E	62.6	Low	62.8	Low	146 Å²	146	124.6 Å²	124.6	68%	0.682	61%	0.609	S	S	*	*	H	α-helix	trans	-89.6	-7.3	176.3	-72.3	-179	174.9	0	0	113.3	Q305 P311	Q305-E309 PolarHBondContact O-N 3.36Å; E309-P311 WeakPolarHBondContact O-CD 3.36Å
310	S	45.2	Very low	62.4	Low	65 Å²	65	123.5 Å²	123.5	46%	0.455	62%	0.615	S	S	.	*			trans	-76.9	105.8	167.6	17.5	0	0	0	0	108.3	M306 L307	M306-S310 PolarHBondContact O-N 3.49Å; M306-S310 VanDerWaalsContact O-N 3.11Å; M306-S310 PolarHBondContact O-OG 3.46Å; L307-S310 WeakPolarHBondContact CA-OG 3.28Å; L307-S310 PolarHBondContact O-OG 2.91Å
311	P	52.4	Low	61.7	Low	119 Å²	119	129.7 Å²	129.7	77%	0.773	63%	0.632	S	S	*	*			trans	-71.8	132.3	169.5	20.3	-5.3	0	0	0	107	E309	E309-P311 WeakPolarHBondContact O-CD 3.36Å
312	F	47.1	Very low	61.3	Low	283 Å²	283	135.1 Å²	135.1	100%	1.241	66%	0.656	S	S	*	*			trans	-64.3	0	151.8	-80.4	-85.4	0	0	0	109

Retrieved 312 of 312 residues in 871.6 ms (Link to these results)

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