A0A5K4FCE1_SCHMA Loading...

Dilute domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FCE1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 355 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45	Very low	56.3	Low	217 Å²	217	124.7 Å²	124.7	100%	1.069	64%	0.638	S	S	*	*				0	-11.7	0	-93	177.3	145.8	0	0	115.4
2	K	44.9	Very low	57.2	Low	182 Å²	182	124.3 Å²	124.3	79%	0.791	63%	0.632	S	S	*	*	H	α-helix	trans	-80.2	-17.6	176.9	-79.9	-177.9	174.3	-179.8	0	115.9
3	S	54.2	Low	57.9	Low	90 Å²	90	123.7 Å²	123.7	63%	0.629	62%	0.622	S	S	*	*	H	α-helix	trans	-82.1	-34.7	-172.4	54.4	0	0	0	0	114.5	N6 N7	S3-N6 PolarHBondContact O-N 2.94Å; S3-N7 PolarHBondContact O-N 3.42Å
4	S	52	Low	58.2	Low	70 Å²	70	119.9 Å²	119.9	49%	0.49	60%	0.604	S	S	.	*	H	α-helix	trans	-68	-40	178.9	56.3	0	0	0	0	112	N6 N7 E8	S4-N6 VanDerWaalsContact C-N 3.29Å; S4-N6 PolarHBondContact O-N 3.14Å; S4-N7 PolarHBondContact O-N 3.22Å; S4-E8 PolarHBondContact O-N 2.96Å; S4-E8 VanDerWaalsContact O-N 3.1Å
5	Q	50.5	Low	58.4	Low	126 Å²	126	115.7 Å²	115.7	59%	0.589	60%	0.595	S	S	*	*	H	α-helix	trans	-61.6	-34.3	176.5	-78.4	-178.1	-29.9	0	0	112.9	M9	Q5-M9 VanDerWaalsContact O-CB 3.29Å; Q5-M9 WeakPolarHBondContact O-CB 3.42Å; Q5-M9 WeakPolarHBondContact O-CG 3.32Å; Q5-M9 PolarHBondContact O-N 3.41Å
6	N	57.6	Low	58.8	Low	99 Å²	99	113.4 Å²	113.4	53%	0.529	58%	0.584	S	S	.	*	H	α-helix	trans	-72.5	-38	178.7	-80.4	-1.6	0	0	0	112.7	S3 S4 M9 Y10	S3-N6 PolarHBondContact O-N 2.94Å; S4-N6 VanDerWaalsContact C-N 3.29Å; S4-N6 PolarHBondContact O-N 3.14Å; N6-M9 WeakPolarHBondContact OD1-CE 3.5Å; N6-Y10 WeakPolarHBondContact O-CB 3.28Å; N6-Y10 PolarHBondContact O-N 2.81Å
7	N	59.8	Low	59.2	Low	119 Å²	119	111.3 Å²	111.3	64%	0.636	57%	0.573	S	S	*	*	H	α-helix	trans	-72.3	-37.8	178.8	-81.6	0.5	0	0	0	112.3	S3 S4 S11	S3-N7 PolarHBondContact O-N 3.42Å; S4-N7 PolarHBondContact O-N 3.22Å; N7-S11 VanDerWaalsContact O-CB 3.31Å; N7-S11 WeakPolarHBondContact O-CB 3.47Å; N7-S11 PolarHBondContact O-N 2.98Å; N7-S11 PolarHBondContact O-OG 3.13Å
8	E	65.3	Low	59.1	Low	138 Å²	138	109.3 Å²	109.3	65%	0.645	57%	0.571	S	S	*	*	H	α-helix	trans	-65.4	-47.6	171.1	-80.3	179.2	163.5	0	0	110.8	S4 Y10 S11 E12	S4-E8 PolarHBondContact O-N 2.96Å; S4-E8 VanDerWaalsContact O-N 3.1Å; E8-Y10 VanDerWaalsContact C-N 3.32Å; E8-Y10 PolarHBondContact O-N 3.1Å; E8-S11 PolarHBondContact O-N 3.26Å; E8-E12 WeakPolarHBondContact O-CB 3.39Å; E8-E12 PolarHBondContact O-N 3.24Å
9	M	64.7	Low	59.2	Low	112 Å²	112	108.1 Å²	108.1	55%	0.552	57%	0.565	S	S	*	*	H	α-helix	trans	-58.2	-41.2	176	-91.1	-166.3	-67.5	0	0	113	Q5 N6 F13	Q5-M9 VanDerWaalsContact O-CB 3.29Å; Q5-M9 WeakPolarHBondContact O-CB 3.42Å; Q5-M9 WeakPolarHBondContact O-CG 3.32Å; Q5-M9 PolarHBondContact O-N 3.41Å; N6-M9 WeakPolarHBondContact OD1-CE 3.5Å; M9-F13 WeakPolarHBondContact O-CB 3.45Å; M9-F13 PolarHBondContact O-N 3.12Å
10	Y	63	Low	59.4	Low	144 Å²	144	106.9 Å²	106.9	57%	0.565	56%	0.562	S	S	*	*	H	α-helix	trans	-72.3	-40.7	-179.2	-175.1	-107.2	0	0	0	112.2	N6 E8 F13 L14	N6-Y10 WeakPolarHBondContact O-CB 3.28Å; N6-Y10 PolarHBondContact O-N 2.81Å; E8-Y10 VanDerWaalsContact C-N 3.32Å; E8-Y10 PolarHBondContact O-N 3.1Å; Y10-F13 WeakPolarHBondContact O-CB 3.47Å; Y10-F13 PolarHBondContact O-N 3.07Å; Y10-L14 HydrophobicContact CD1-CD1 3.94Å; Y10-L14 HydrophobicContact CD1-CG 4.42Å; Y10-L14 HydrophobicContact CE1-CD1 3.38Å; Y10-L14 HydrophobicContact CE1-CG 4.05Å; Y10-L14 HydrophobicContact CE2-CG 4.42Å; Y10-L14 WeakPolarHBondContact O-CG 3.31Å; Y10-L14 PolarHBondContact O-N 2.91Å
11	S	62.1	Low	59.3	Low	75 Å²	75	105.5 Å²	105.5	52%	0.524	56%	0.557	S	S	.	*	H	α-helix	trans	-66.6	-41	175.8	-57.4	0	0	0	0	111.3	N7 E8 L14 A15	N7-S11 VanDerWaalsContact O-CB 3.31Å; N7-S11 WeakPolarHBondContact O-CB 3.47Å; N7-S11 PolarHBondContact O-N 2.98Å; N7-S11 PolarHBondContact O-OG 3.13Å; E8-S11 PolarHBondContact O-N 3.26Å; S11-L14 PolarHBondContact O-N 3.5Å; S11-A15 VanDerWaalsContact O-CB 3.28Å; S11-A15 WeakPolarHBondContact O-CB 3.38Å; S11-A15 PolarHBondContact O-N 3.28Å
12	E	67.2	Low	60	Low	120 Å²	120	97.6 Å²	97.6	56%	0.561	53%	0.527	S	S	*	.	H	α-helix	trans	-66.1	-39.5	174.3	-169.6	177.7	-173.1	0	0	111.2	E8 A15 N16	E8-E12 WeakPolarHBondContact O-CB 3.39Å; E8-E12 PolarHBondContact O-N 3.24Å; E12-A15 PolarHBondContact O-N 3.33Å; E12-N16 WeakPolarHBondContact O-CB 3.46Å; E12-N16 PolarHBondContact O-N 2.9Å; E12-N16 PolarHBondContact O-ND2 3.27Å
13	F	66.7	Low	60.8	Low	116 Å²	116	95.1 Å²	95.1	51%	0.509	52%	0.516	S	S	.	.	H	α-helix	trans	-60.9	-47.4	172.9	174.5	-103.3	0	0	0	112	M9 Y10 N16 I17	M9-F13 WeakPolarHBondContact O-CB 3.45Å; M9-F13 PolarHBondContact O-N 3.12Å; Y10-F13 WeakPolarHBondContact O-CB 3.47Å; Y10-F13 PolarHBondContact O-N 3.07Å; F13-N16 PolarHBondContact O-N 2.9Å; F13-I17 HydrophobicContact CD1-CD1 4.01Å; F13-I17 HydrophobicContact CD2-CD1 4.35Å; F13-I17 HydrophobicContact CE1-CD1 3.37Å; F13-I17 HydrophobicContact CE1-CG1 4.43Å; F13-I17 HydrophobicContact CE2-CD1 3.76Å; F13-I17 HydrophobicContact CE2-CG1 4.3Å; F13-I17 HydrophobicContact CG-CD1 4.47Å; F13-I17 HydrophobicContact CZ-CD1 3.25Å; F13-I17 HydrophobicContact CZ-CG1 4.25Å; F13-I17 WeakPolarHBondContact O-CG1 3.48Å; F13-I17 PolarHBondContact O-N 3.3Å
14	L	61.8	Low	61.1	Low	70 Å²	70	94.7 Å²	94.7	37%	0.366	51%	0.509	S	S	.	.	H	α-helix	trans	-66.2	-39.6	177.2	-73.2	-179.4	0	0	0	112.5	Y10 S11 I17 S18	Y10-L14 HydrophobicContact CD1-CD1 3.94Å; Y10-L14 HydrophobicContact CD1-CG 4.42Å; Y10-L14 HydrophobicContact CE1-CD1 3.38Å; Y10-L14 HydrophobicContact CE1-CG 4.05Å; Y10-L14 HydrophobicContact CE2-CG 4.42Å; Y10-L14 WeakPolarHBondContact O-CG 3.31Å; Y10-L14 PolarHBondContact O-N 2.91Å; S11-L14 PolarHBondContact O-N 3.5Å; L14-I17 PolarHBondContact O-N 3.35Å; L14-S18 VanDerWaalsContact O-CB 3.3Å; L14-S18 WeakPolarHBondContact O-CB 3.49Å; L14-S18 PolarHBondContact O-N 2.96Å; L14-S18 PolarHBondContact O-OG 3.28Å
15	A	61.9	Low	61.3	Low	57 Å²	57	94.7 Å²	94.7	47%	0.471	51%	0.509	S	S	.	.	H	α-helix	trans	-63.9	-42.6	174.5	0	0	0	0	0	111	S11 E12 S18 L19	S11-A15 VanDerWaalsContact O-CB 3.28Å; S11-A15 WeakPolarHBondContact O-CB 3.38Å; S11-A15 PolarHBondContact O-N 3.28Å; E12-A15 PolarHBondContact O-N 3.33Å; A15-S18 PolarHBondContact O-N 3Å; A15-L19 WeakPolarHBondContact O-CB 3.39Å; A15-L19 PolarHBondContact O-N 3.18Å
16	N	64.9	Low	61.8	Low	79 Å²	79	92.8 Å²	92.8	42%	0.422	51%	0.506	S	S	.	.	H	α-helix	trans	-66.1	-42.8	176.5	-78.4	-30	0	0	0	111.9	E12 F13 L19 V20	E12-N16 WeakPolarHBondContact O-CB 3.46Å; E12-N16 PolarHBondContact O-N 2.9Å; E12-N16 PolarHBondContact O-ND2 3.27Å; F13-N16 PolarHBondContact O-N 2.9Å; N16-L19 PolarHBondContact O-N 3.24Å; N16-V20 VanDerWaalsContact O-CB 3.31Å; N16-V20 WeakPolarHBondContact O-CB 3.36Å; N16-V20 WeakPolarHBondContact O-CG2 3.24Å; N16-V20 PolarHBondContact O-N 3.31Å
17	I	64.5	Low	61.7	Low	78 Å²	78	90.4 Å²	90.4	40%	0.4	50%	0.5	S	S	.	.	H	α-helix	trans	-61.1	-49.4	173.2	-75	-177	0	0	0	110.3	F13 L14 L19 V20 V21	F13-I17 HydrophobicContact CD1-CD1 4.01Å; F13-I17 HydrophobicContact CD2-CD1 4.35Å; F13-I17 HydrophobicContact CE1-CD1 3.37Å; F13-I17 HydrophobicContact CE1-CG1 4.43Å; F13-I17 HydrophobicContact CE2-CD1 3.76Å; F13-I17 HydrophobicContact CE2-CG1 4.3Å; F13-I17 HydrophobicContact CG-CD1 4.47Å; F13-I17 HydrophobicContact CZ-CD1 3.25Å; F13-I17 HydrophobicContact CZ-CG1 4.25Å; F13-I17 WeakPolarHBondContact O-CG1 3.48Å; F13-I17 PolarHBondContact O-N 3.3Å; L14-I17 PolarHBondContact O-N 3.35Å; I17-L19 VanDerWaalsContact C-N 3.29Å; I17-L19 PolarHBondContact O-N 3.05Å; I17-V20 PolarHBondContact O-N 3.5Å; I17-V21 HydrophobicContact CG2-CG2 4.07Å; I17-V21 WeakPolarHBondContact O-CB 3.33Å; I17-V21 WeakPolarHBondContact O-CG2 3.48Å; I17-V21 PolarHBondContact O-N 3.45Å
18	S	58.2	Low	61.5	Low	76 Å²	76	88.1 Å²	88.1	53%	0.531	49%	0.491	S	S	.	.	H	α-helix	trans	-60.8	-41.3	-179	-58.3	0	0	0	0	111.3	L14 A15 A22	L14-S18 VanDerWaalsContact O-CB 3.3Å; L14-S18 WeakPolarHBondContact O-CB 3.49Å; L14-S18 PolarHBondContact O-N 2.96Å; L14-S18 PolarHBondContact O-OG 3.28Å; A15-S18 PolarHBondContact O-N 3Å; S18-A22 VanDerWaalsContact O-CB 3.3Å; S18-A22 WeakPolarHBondContact O-CB 3.33Å; S18-A22 PolarHBondContact O-N 3.37Å
19	L	60.6	Low	61.1	Low	85 Å²	85	88.3 Å²	88.3	45%	0.445	49%	0.486	S	S	.	.	H	α-helix	trans	-67	-43	176.1	-175.6	66.5	0	0	0	112	A15 N16 I17 A22 K23	A15-L19 WeakPolarHBondContact O-CB 3.39Å; A15-L19 PolarHBondContact O-N 3.18Å; N16-L19 PolarHBondContact O-N 3.24Å; I17-L19 VanDerWaalsContact C-N 3.29Å; I17-L19 PolarHBondContact O-N 3.05Å; L19-A22 PolarHBondContact O-N 2.5Å; L19-K23 HydrophobicContact CD1-CD 4.48Å; L19-K23 HydrophobicContact CG-CD 4.11Å; L19-K23 VanDerWaalsContact O-CB 3.26Å; L19-K23 WeakPolarHBondContact O-CB 2.88Å; L19-K23 WeakPolarHBondContact O-CG 3.41Å; L19-K23 PolarHBondContact O-N 3.31Å
20	V	63.4	Low	60.3	Low	84 Å²	84	85.6 Å²	85.6	51%	0.509	47%	0.474	S	S	.	.	H	α-helix	trans	-65.4	-43.2	176.4	169.7	0	0	0	0	110.2	N16 I17 K23 V24	N16-V20 VanDerWaalsContact O-CB 3.31Å; N16-V20 WeakPolarHBondContact O-CB 3.36Å; N16-V20 WeakPolarHBondContact O-CG2 3.24Å; N16-V20 PolarHBondContact O-N 3.31Å; I17-V20 PolarHBondContact O-N 3.5Å; V20-K23 PolarHBondContact O-N 3.49Å; V20-V24 HydrophobicContact CG1-CG2 4.17Å; V20-V24 WeakPolarHBondContact O-CB 3.23Å; V20-V24 WeakPolarHBondContact O-CG2 3.32Å; V20-V24 PolarHBondContact O-N 3.16Å
21	V	57.7	Low	60	Low	78 Å²	78	83.9 Å²	83.9	47%	0.473	48%	0.478	S	S	.	.	H	α-helix	trans	-63.7	-43.2	177	170.8	0	0	0	0	111	I17 V24 S25	I17-V21 HydrophobicContact CG2-CG2 4.07Å; I17-V21 WeakPolarHBondContact O-CB 3.33Å; I17-V21 WeakPolarHBondContact O-CG2 3.48Å; I17-V21 PolarHBondContact O-N 3.45Å; V21-V24 PolarHBondContact O-N 2.93Å; V21-S25 VanDerWaalsContact O-CB 3.28Å; V21-S25 WeakPolarHBondContact O-CB 3.33Å; V21-S25 PolarHBondContact O-N 3.07Å; V21-S25 PolarHBondContact O-OG 3.31Å
22	A	58.5	Low	59.5	Low	51 Å²	51	86.4 Å²	86.4	42%	0.421	48%	0.476	S	S	.	.	H	α-helix	trans	-63.7	-46.6	174.2	0	0	0	0	0	111.5	S18 L19 V24 S25 V26	S18-A22 VanDerWaalsContact O-CB 3.3Å; S18-A22 WeakPolarHBondContact O-CB 3.33Å; S18-A22 PolarHBondContact O-N 3.37Å; L19-A22 PolarHBondContact O-N 2.5Å; A22-V24 PolarHBondContact O-N 3.03Å; A22-S25 PolarHBondContact O-N 2.87Å; A22-V26 WeakPolarHBondContact O-CB 3.47Å; A22-V26 VanDerWaalsContact O-CG2 3.3Å; A22-V26 WeakPolarHBondContact O-CG2 3.27Å; A22-V26 PolarHBondContact O-N 3.21Å
23	K	61.9	Low	58.9	Low	131 Å²	131	85.9 Å²	85.9	57%	0.57	47%	0.474	S	S	*	.	H	α-helix	trans	-60.4	-42.7	176.4	-77.8	174.4	178.2	176.8	0	112	L19 V20 A27	L19-K23 HydrophobicContact CD1-CD 4.48Å; L19-K23 HydrophobicContact CG-CD 4.11Å; L19-K23 VanDerWaalsContact O-CB 3.26Å; L19-K23 WeakPolarHBondContact O-CB 2.88Å; L19-K23 WeakPolarHBondContact O-CG 3.41Å; L19-K23 PolarHBondContact O-N 3.31Å; V20-K23 PolarHBondContact O-N 3.49Å; K23-A27 WeakPolarHBondContact O-CB 3.29Å; K23-A27 PolarHBondContact O-N 2.81Å
24	V	61.7	Low	58.2	Low	80 Å²	80	81.8 Å²	81.8	49%	0.485	46%	0.458	S	S	.	.	H	α-helix	trans	-67.5	-42.8	176.6	170.7	0	0	0	0	110.4	V20 V21 A22 V26 A27 V28	V20-V24 HydrophobicContact CG1-CG2 4.17Å; V20-V24 WeakPolarHBondContact O-CB 3.23Å; V20-V24 WeakPolarHBondContact O-CG2 3.32Å; V20-V24 PolarHBondContact O-N 3.16Å; V21-V24 PolarHBondContact O-N 2.93Å; A22-V24 PolarHBondContact O-N 3.03Å; V24-V26 PolarHBondContact O-N 2.91Å; V24-A27 PolarHBondContact O-N 3.28Å; V24-V28 HydrophobicContact CG1-CG2 4.05Å; V24-V28 VanDerWaalsContact O-CB 3.28Å; V24-V28 WeakPolarHBondContact O-CB 3.49Å; V24-V28 WeakPolarHBondContact O-CG2 3.49Å; V24-V28 PolarHBondContact O-N 3.42Å
25	S	56.2	Low	58.2	Low	70 Å²	70	81.3 Å²	81.3	49%	0.49	46%	0.459	S	S	.	.	H	α-helix	trans	-62.2	-44.2	178	-59.7	0	0	0	0	111.6	V21 A22 Y29	V21-S25 VanDerWaalsContact O-CB 3.28Å; V21-S25 WeakPolarHBondContact O-CB 3.33Å; V21-S25 PolarHBondContact O-N 3.07Å; V21-S25 PolarHBondContact O-OG 3.31Å; A22-S25 PolarHBondContact O-N 2.87Å; S25-Y29 VanDerWaalsContact O-CB 3.29Å; S25-Y29 WeakPolarHBondContact O-CB 3.48Å; S25-Y29 PolarHBondContact O-N 2.83Å
26	V	59.8	Low	58.5	Low	86 Å²	86	85 Å²	85	52%	0.521	48%	0.482	S	S	.	.	H	α-helix	trans	-66.5	-46	174.3	174.1	0	0	0	0	110.7	A22 V24 V28 Y29 L30	A22-V26 WeakPolarHBondContact O-CB 3.47Å; A22-V26 VanDerWaalsContact O-CG2 3.3Å; A22-V26 WeakPolarHBondContact O-CG2 3.27Å; A22-V26 PolarHBondContact O-N 3.21Å; V24-V26 PolarHBondContact O-N 2.91Å; V26-V28 PolarHBondContact O-N 2.96Å; V26-Y29 WeakPolarHBondContact O-CB 3.4Å; V26-Y29 PolarHBondContact O-N 2.76Å; V26-L30 HydrophobicContact CG1-CD1 3.85Å; V26-L30 HydrophobicContact CG1-CG 4.17Å; V26-L30 WeakPolarHBondContact O-CB 3.38Å; V26-L30 VanDerWaalsContact O-CG 3.25Å; V26-L30 WeakPolarHBondContact O-CG 3.45Å; V26-L30 PolarHBondContact O-N 3.46Å
27	A	57.1	Low	58.8	Low	49 Å²	49	86.4 Å²	86.4	41%	0.405	50%	0.498	S	S	.	.	H	α-helix	trans	-62.5	-42.6	179.2	0	0	0	0	0	112.2	K23 V24 L30 V31	K23-A27 WeakPolarHBondContact O-CB 3.29Å; K23-A27 PolarHBondContact O-N 2.81Å; V24-A27 PolarHBondContact O-N 3.28Å; A27-L30 PolarHBondContact O-N 2.92Å; A27-V31 WeakPolarHBondContact O-CB 3.35Å; A27-V31 VanDerWaalsContact O-CG2 3.25Å; A27-V31 WeakPolarHBondContact O-CG2 3.39Å; A27-V31 PolarHBondContact O-N 3.41Å
28	V	55.1	Low	58.6	Low	72 Å²	72	85.8 Å²	85.8	44%	0.436	49%	0.494	S	S	.	.	H	α-helix	trans	-64.4	-42.4	175.2	169.9	0	0	0	0	110.6	V24 V26 R32	V24-V28 HydrophobicContact CG1-CG2 4.05Å; V24-V28 VanDerWaalsContact O-CB 3.28Å; V24-V28 WeakPolarHBondContact O-CB 3.49Å; V24-V28 WeakPolarHBondContact O-CG2 3.49Å; V24-V28 PolarHBondContact O-N 3.42Å; V26-V28 PolarHBondContact O-N 2.96Å; V28-R32 WeakPolarHBondContact O-CB 3.24Å; V28-R32 WeakPolarHBondContact O-CG 3.33Å; V28-R32 PolarHBondContact O-N 2.85Å
29	Y	55.6	Low	59.2	Low	142 Å²	142	84.7 Å²	84.7	56%	0.557	49%	0.487	S	S	*	.	H	α-helix	trans	-60.5	-47.3	174.2	179.2	-96	0	0	0	111.4	S25 V26 R32 Q33	S25-Y29 VanDerWaalsContact O-CB 3.29Å; S25-Y29 WeakPolarHBondContact O-CB 3.48Å; S25-Y29 PolarHBondContact O-N 2.83Å; V26-Y29 WeakPolarHBondContact O-CB 3.4Å; V26-Y29 PolarHBondContact O-N 2.76Å; Y29-R32 PolarHBondContact O-N 3.49Å; Y29-Q33 HydrophobicContact CD1-CG 4.43Å; Y29-Q33 HydrophobicContact CE1-CG 4.07Å; Y29-Q33 HydrophobicContact CE2-CG 4.38Å; Y29-Q33 VanDerWaalsContact O-CG 3.31Å; Y29-Q33 WeakPolarHBondContact O-CG 3.44Å; Y29-Q33 PolarHBondContact O-N 2.99Å; Y29-Q33 VanDerWaalsContact O-N 3.11Å
30	L	49.2	Very low	59.2	Low	54 Å²	54	85.3 Å²	85.3	28%	0.283	50%	0.498	S	S	.	.	H	α-helix	trans	-63.9	-48.7	179.5	-70.6	178.2	0	0	0	111.9	V26 A27 R32 Q33 T34 F43 L47	V26-L30 HydrophobicContact CG1-CD1 3.85Å; V26-L30 HydrophobicContact CG1-CG 4.17Å; V26-L30 WeakPolarHBondContact O-CB 3.38Å; V26-L30 VanDerWaalsContact O-CG 3.25Å; V26-L30 WeakPolarHBondContact O-CG 3.45Å; V26-L30 PolarHBondContact O-N 3.46Å; A27-L30 PolarHBondContact O-N 2.92Å; L30-R32 PolarHBondContact O-N 3.29Å; L30-Q33 CarbonylContact O-C 3.59Å; L30-Q33 PolarHBondContact O-N 2.84Å; L30-T34 PolarHBondContact O-N 3.45Å; L30-T34 PolarHBondContact O-OG1 2.63Å; L30-T34 VanDerWaalsContact O-OG1 3.05Å; L30-F43 HydrophobicContact CB-CE1 4.21Å; L30-F43 VanDerWaalsContact O-CE1 3.26Å; L30-F43 WeakPolarHBondContact O-CE1 3.36Å; L30-L47 HydrophobicContact CB-CD1 4.42Å; L30-L47 HydrophobicContact CD1-CD1 3.79Å; L30-L47 HydrophobicContact CD2-CD1 3.56Å; L30-L47 HydrophobicContact CD2-CD2 4.09Å; L30-L47 HydrophobicContact CD2-CG 4.5Å; L30-L47 HydrophobicContact CG-CD1 4.1Å
31	V	56.2	Low	59.3	Low	108 Å²	108	88.1 Å²	88.1	66%	0.655	50%	0.501	S	S	*	.	H	α-helix	trans	-58.9	-36.3	177.3	170	0	0	0	0	111.6	A27 Q33 T34	A27-V31 WeakPolarHBondContact O-CB 3.35Å; A27-V31 VanDerWaalsContact O-CG2 3.25Å; A27-V31 WeakPolarHBondContact O-CG2 3.39Å; A27-V31 PolarHBondContact O-N 3.41Å; V31-Q33 VanDerWaalsContact C-N 3.34Å; V31-T34 WeakPolarHBondContact O-CB 3.14Å; V31-T34 PolarHBondContact O-N 3.36Å; V31-T34 PolarHBondContact O-OG1 3.32Å
32	R	52.2	Low	59.5	Low	128 Å²	128	88.3 Å²	88.3	48%	0.483	50%	0.499	S	S	.	.	H	α-helix	trans	-71.9	-26.4	176.5	-80	-173.1	172.9	-174.4	3.3	113.9	V28 Y29 L30	V28-R32 WeakPolarHBondContact O-CB 3.24Å; V28-R32 WeakPolarHBondContact O-CG 3.33Å; V28-R32 PolarHBondContact O-N 2.85Å; Y29-R32 PolarHBondContact O-N 3.49Å; L30-R32 PolarHBondContact O-N 3.29Å
33	Q	54.2	Low	59.7	Low	110 Å²	110	86.6 Å²	86.6	51%	0.514	48%	0.482	S	S	.	.	H	α-helix	trans	-89.1	-12.4	176.7	-64.7	-66.5	-11.9	0	0	112.4	Y29 L30 V31 P35 F43	Y29-Q33 HydrophobicContact CD1-CG 4.43Å; Y29-Q33 HydrophobicContact CE1-CG 4.07Å; Y29-Q33 HydrophobicContact CE2-CG 4.38Å; Y29-Q33 VanDerWaalsContact O-CG 3.31Å; Y29-Q33 WeakPolarHBondContact O-CG 3.44Å; Y29-Q33 PolarHBondContact O-N 2.99Å; Y29-Q33 VanDerWaalsContact O-N 3.11Å; L30-Q33 CarbonylContact O-C 3.59Å; L30-Q33 PolarHBondContact O-N 2.84Å; V31-Q33 VanDerWaalsContact C-N 3.34Å; Q33-P35 WeakPolarHBondContact O-CD 3.38Å; Q33-F43 HydrophobicContact CB-CZ 4.39Å
34	T	52.5	Low	59.7	Low	30 Å²	30	83.9 Å²	83.9	18%	0.184	48%	0.476	C	S	.	.	S	Bend	trans	-62.3	115.5	173.7	-50	0	0	0	0	109.5	L30 V31 S36 F43	L30-T34 PolarHBondContact O-N 3.45Å; L30-T34 PolarHBondContact O-OG1 2.63Å; L30-T34 VanDerWaalsContact O-OG1 3.05Å; V31-T34 WeakPolarHBondContact O-CB 3.14Å; V31-T34 PolarHBondContact O-N 3.36Å; V31-T34 PolarHBondContact O-OG1 3.32Å; T34-S36 PolarHBondContact O-N 2.8Å; T34-F43 HydrophobicContact CG2-CB 3.61Å; T34-F43 HydrophobicContact CG2-CD1 3.97Å; T34-F43 HydrophobicContact CG2-CD2 3.96Å; T34-F43 HydrophobicContact CG2-CG 3.58Å; T34-F43 WeakPolarHBondContact OG1-CD1 3.26Å; T34-F43 WeakPolarHBondContact OG1-CE1 3.34Å
35	P	60.7	Low	59.8	Low	59 Å²	59	86.5 Å²	86.5	38%	0.383	48%	0.477	S	S	.	.			trans	-57.9	136.2	172.6	-21.4	33.9	0	0	0	109.4	Q33 S37 I38	Q33-P35 WeakPolarHBondContact O-CD 3.38Å; P35-S37 PolarHBondContact O-N 3.48Å; P35-I38 HydrophobicContact CB-CD1 4.29Å; P35-I38 HydrophobicContact CB-CG1 4.32Å; P35-I38 HydrophobicContact CG-CD1 3.96Å; P35-I38 PolarHBondContact O-N 3.34Å
36	S	68.8	Low	60.4	Low	136 Å²	136	88 Å²	88	95%	0.951	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-13.1	-176.1	55.7	0	0	0	0	114.3	T34	T34-S36 PolarHBondContact O-N 2.8Å
37	S	70.2	Confident	60.4	Low	108 Å²	108	86.3 Å²	86.3	76%	0.755	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-9.8	176.1	53.9	0	0	0	0	114.5	P35	P35-S37 PolarHBondContact O-N 3.48Å
38	I	61.6	Low	60.9	Low	65 Å²	65	89.4 Å²	89.4	33%	0.333	47%	0.469	S	S	.	.	S	Bend	trans	-109.8	133.1	-175.3	-57.8	-177.7	0	0	0	109	P35 D42 F43	P35-I38 HydrophobicContact CB-CD1 4.29Å; P35-I38 HydrophobicContact CB-CG1 4.32Å; P35-I38 HydrophobicContact CG-CD1 3.96Å; P35-I38 PolarHBondContact O-N 3.34Å; I38-D42 HydrophobicContact CG2-CB 3.64Å; I38-F43 HydrophobicContact CG2-CB 3.95Å
39	S	70.8	Confident	61.5	Low	53 Å²	53	91 Å²	91	37%	0.371	48%	0.475	S	S	.	.			trans	-64.1	149.5	173.6	81.2	0	0	0	0	110.4	Y41 D42 F43	S39-Y41 PolarHBondContact O-N 3.02Å; S39-Y41 VanDerWaalsContact O-N 3.17Å; S39-D42 PolarHBondContact O-N 3.3Å; S39-D42 VanDerWaalsContact O-N 3.1Å; S39-D42 WeakPolarHBondContact OG-CB 3.48Å; S39-D42 PolarHBondContact OG-N 3.25Å; S39-D42 VanDerWaalsContact OG-N 3.09Å; S39-D42 PolarHBondContact OG-OD2 2.87Å; S39-F43 PolarHBondContact O-N 3.39Å
40	S	60.9	Low	62	Low	97 Å²	97	87.8 Å²	87.8	68%	0.678	47%	0.465	S	S	*	.	H	α-helix	trans	-55.8	-34.8	176.6	52	0	0	0	0	112.3	V44	S40-V44 VanDerWaalsContact O-CG2 3.3Å; S40-V44 WeakPolarHBondContact O-CG2 3.35Å; S40-V44 PolarHBondContact O-N 2.84Å
41	Y	63.9	Low	62.5	Low	144 Å²	144	92.2 Å²	92.2	57%	0.565	48%	0.479	S	S	*	.	H	α-helix	trans	-63.6	-49.6	174.7	-178.7	-96.2	0	0	0	112.3	S39 F43 V44 R45	S39-Y41 PolarHBondContact O-N 3.02Å; S39-Y41 VanDerWaalsContact O-N 3.17Å; Y41-F43 VanDerWaalsContact C-N 3.31Å; Y41-F43 PolarHBondContact O-N 2.73Å; Y41-V44 PolarHBondContact O-N 3.2Å; Y41-R45 PolarHBondContact O-N 3.39Å
42	D	62.4	Low	62.9	Low	81 Å²	81	92 Å²	92	43%	0.433	47%	0.472	S	S	.	.	H	α-helix	trans	-65.9	-34.9	-179.9	-64.3	-42.5	0	0	0	111.9	I38 S39 R45 F46	I38-D42 HydrophobicContact CG2-CB 3.64Å; S39-D42 PolarHBondContact O-N 3.3Å; S39-D42 VanDerWaalsContact O-N 3.1Å; S39-D42 WeakPolarHBondContact OG-CB 3.48Å; S39-D42 PolarHBondContact OG-N 3.25Å; S39-D42 VanDerWaalsContact OG-N 3.09Å; S39-D42 PolarHBondContact OG-OD2 2.87Å; D42-R45 WeakPolarHBondContact O-CB 3.48Å; D42-R45 PolarHBondContact O-N 2.96Å; D42-F46 WeakPolarHBondContact O-CB 3.38Å; D42-F46 PolarHBondContact O-N 2.83Å
43	F	62.3	Low	63.5	Low	16 Å²	16	92.9 Å²	92.9	7%	0.07	48%	0.476	C	S	.	.	H	α-helix	trans	-68.5	-40.9	175.8	-174.2	-108.7	0	0	0	112.5	L30 Q33 T34 I38 S39 Y41 R45 F46 L47	L30-F43 HydrophobicContact CB-CE1 4.21Å; L30-F43 VanDerWaalsContact O-CE1 3.26Å; L30-F43 WeakPolarHBondContact O-CE1 3.36Å; Q33-F43 HydrophobicContact CB-CZ 4.39Å; T34-F43 HydrophobicContact CG2-CB 3.61Å; T34-F43 HydrophobicContact CG2-CD1 3.97Å; T34-F43 HydrophobicContact CG2-CD2 3.96Å; T34-F43 HydrophobicContact CG2-CG 3.58Å; T34-F43 WeakPolarHBondContact OG1-CD1 3.26Å; T34-F43 WeakPolarHBondContact OG1-CE1 3.34Å; I38-F43 HydrophobicContact CG2-CB 3.95Å; S39-F43 PolarHBondContact O-N 3.39Å; Y41-F43 VanDerWaalsContact C-N 3.31Å; Y41-F43 PolarHBondContact O-N 2.73Å; F43-R45 VanDerWaalsContact C-N 3.33Å; F43-R45 PolarHBondContact O-N 3.46Å; F43-F46 HydrophobicContact CD2-CD1 4.43Å; F43-F46 HydrophobicContact CE2-CD1 4.41Å; F43-F46 WeakPolarHBondContact O-CB 3.45Å; F43-F46 PolarHBondContact O-N 3.42Å; F43-L47 HydrophobicContact CD1-CD1 3.87Å; F43-L47 HydrophobicContact CD1-CG 4.34Å; F43-L47 HydrophobicContact CE1-CD1 3.53Å; F43-L47 HydrophobicContact CE1-CD2 4.47Å; F43-L47 HydrophobicContact CE1-CG 4.05Å; F43-L47 HydrophobicContact CZ-CD1 4.11Å; F43-L47 HydrophobicContact CZ-CD2 4.22Å; F43-L47 HydrophobicContact CZ-CG 4.2Å; F43-L47 WeakPolarHBondContact O-CG 3.3Å; F43-L47 PolarHBondContact O-N 3.05Å
44	V	62.4	Low	63.8	Low	73 Å²	73	96.1 Å²	96.1	44%	0.442	48%	0.483	S	S	.	.	H	α-helix	trans	-62.1	-43.1	172.9	170.2	0	0	0	0	110.5	S40 Y41 F46 L47 Q48	S40-V44 VanDerWaalsContact O-CG2 3.3Å; S40-V44 WeakPolarHBondContact O-CG2 3.35Å; S40-V44 PolarHBondContact O-N 2.84Å; Y41-V44 PolarHBondContact O-N 3.2Å; V44-F46 VanDerWaalsContact C-N 3.32Å; V44-F46 PolarHBondContact O-N 3.38Å; V44-L47 PolarHBondContact O-N 3.11Å; V44-Q48 HydrophobicContact CG1-CG 4.44Å; V44-Q48 WeakPolarHBondContact O-CB 3.08Å; V44-Q48 WeakPolarHBondContact O-CG 3.28Å; V44-Q48 PolarHBondContact O-N 2.88Å
45	R	64.8	Low	64.4	Low	135 Å²	135	98 Å²	98	51%	0.509	49%	0.49	S	S	.	.	H	α-helix	trans	-59.6	-42.3	173.7	-119	-174.1	-169	-174.6	4.2	112.1	Y41 D42 F43 Q48 N49	Y41-R45 PolarHBondContact O-N 3.39Å; D42-R45 WeakPolarHBondContact O-CB 3.48Å; D42-R45 PolarHBondContact O-N 2.96Å; F43-R45 VanDerWaalsContact C-N 3.33Å; F43-R45 PolarHBondContact O-N 3.46Å; R45-Q48 PolarHBondContact O-N 3.1Å; R45-N49 WeakPolarHBondContact O-CB 3.49Å; R45-N49 VanDerWaalsContact O-CG 3.24Å; R45-N49 PolarHBondContact O-N 3.22Å
46	F	67.8	Low	64.7	Low	101 Å²	101	100.8 Å²	100.8	44%	0.443	50%	0.498	S	S	.	.	H	α-helix	trans	-60.7	-47.9	175.5	171	-96	0	0	0	111.5	D42 F43 V44 Q48 N49 Q50	D42-F46 WeakPolarHBondContact O-CB 3.38Å; D42-F46 PolarHBondContact O-N 2.83Å; F43-F46 HydrophobicContact CD2-CD1 4.43Å; F43-F46 HydrophobicContact CE2-CD1 4.41Å; F43-F46 WeakPolarHBondContact O-CB 3.45Å; F43-F46 PolarHBondContact O-N 3.42Å; V44-F46 VanDerWaalsContact C-N 3.32Å; V44-F46 PolarHBondContact O-N 3.38Å; F46-Q48 PolarHBondContact O-N 3.06Å; F46-N49 PolarHBondContact O-N 2.78Å; F46-Q50 HydrophobicContact CD1-CG 4.22Å; F46-Q50 HydrophobicContact CD2-CG 4.4Å; F46-Q50 HydrophobicContact CE1-CG 3.78Å; F46-Q50 HydrophobicContact CE2-CG 3.98Å; F46-Q50 HydrophobicContact CZ-CG 3.65Å; F46-Q50 WeakPolarHBondContact O-CG 3.28Å; F46-Q50 PolarHBondContact O-N 3.43Å
47	L	61	Low	64.5	Low	51 Å²	51	99 Å²	99	27%	0.267	47%	0.474	S	S	.	.	H	α-helix	trans	-62.7	-42.3	177.4	-70.4	172.4	0	0	0	112.4	L30 F43 V44 N49 Q50 Y51	L30-L47 HydrophobicContact CB-CD1 4.42Å; L30-L47 HydrophobicContact CD1-CD1 3.79Å; L30-L47 HydrophobicContact CD2-CD1 3.56Å; L30-L47 HydrophobicContact CD2-CD2 4.09Å; L30-L47 HydrophobicContact CD2-CG 4.5Å; L30-L47 HydrophobicContact CG-CD1 4.1Å; F43-L47 HydrophobicContact CD1-CD1 3.87Å; F43-L47 HydrophobicContact CD1-CG 4.34Å; F43-L47 HydrophobicContact CE1-CD1 3.53Å; F43-L47 HydrophobicContact CE1-CD2 4.47Å; F43-L47 HydrophobicContact CE1-CG 4.05Å; F43-L47 HydrophobicContact CZ-CD1 4.11Å; F43-L47 HydrophobicContact CZ-CD2 4.22Å; F43-L47 HydrophobicContact CZ-CG 4.2Å; F43-L47 WeakPolarHBondContact O-CG 3.3Å; F43-L47 PolarHBondContact O-N 3.05Å; V44-L47 PolarHBondContact O-N 3.11Å; L47-N49 VanDerWaalsContact C-N 3.32Å; L47-N49 PolarHBondContact O-N 3.07Å; L47-Q50 PolarHBondContact O-N 2.63Å; L47-Y51 WeakPolarHBondContact O-CB 3.45Å; L47-Y51 PolarHBondContact O-N 3.11Å
48	Q	67	Low	64	Low	115 Å²	115	98.8 Å²	98.8	54%	0.537	46%	0.46	S	S	.	.	H	α-helix	trans	-59.6	-44.7	174.9	-75.5	176.1	-22.6	0	0	110.8	V44 R45 F46 Q50 Y51 M52	V44-Q48 HydrophobicContact CG1-CG 4.44Å; V44-Q48 WeakPolarHBondContact O-CB 3.08Å; V44-Q48 WeakPolarHBondContact O-CG 3.28Å; V44-Q48 PolarHBondContact O-N 2.88Å; R45-Q48 PolarHBondContact O-N 3.1Å; F46-Q48 PolarHBondContact O-N 3.06Å; Q48-Q50 PolarHBondContact O-N 3.31Å; Q48-Y51 PolarHBondContact O-N 2.84Å; Q48-M52 WeakPolarHBondContact O-CB 3.45Å; Q48-M52 VanDerWaalsContact O-CG 3.27Å; Q48-M52 WeakPolarHBondContact O-CG 3.48Å; Q48-M52 PolarHBondContact O-N 2.95Å
49	N	67.3	Low	64.1	Low	106 Å²	106	101.4 Å²	101.4	57%	0.567	47%	0.471	S	S	*	.	H	α-helix	trans	-64.3	-39.8	175.9	-72.2	-11.2	0	0	0	112.4	R45 F46 L47 R53	R45-N49 WeakPolarHBondContact O-CB 3.49Å; R45-N49 VanDerWaalsContact O-CG 3.24Å; R45-N49 PolarHBondContact O-N 3.22Å; F46-N49 PolarHBondContact O-N 2.78Å; L47-N49 VanDerWaalsContact C-N 3.32Å; L47-N49 PolarHBondContact O-N 3.07Å; N49-R53 WeakPolarHBondContact O-CB 3.37Å; N49-R53 PolarHBondContact O-N 2.98Å
50	Q	65.3	Low	63.9	Low	73 Å²	73	101.7 Å²	101.7	34%	0.341	48%	0.476	S	S	.	.	H	α-helix	trans	-66.7	-38.4	175.7	-70.1	-63.9	-29.5	0	0	112.3	F46 L47 Q48 R54	F46-Q50 HydrophobicContact CD1-CG 4.22Å; F46-Q50 HydrophobicContact CD2-CG 4.4Å; F46-Q50 HydrophobicContact CE1-CG 3.78Å; F46-Q50 HydrophobicContact CE2-CG 3.98Å; F46-Q50 HydrophobicContact CZ-CG 3.65Å; F46-Q50 WeakPolarHBondContact O-CG 3.28Å; F46-Q50 PolarHBondContact O-N 3.43Å; L47-Q50 PolarHBondContact O-N 2.63Å; Q48-Q50 PolarHBondContact O-N 3.31Å; Q50-R54 WeakPolarHBondContact O-CB 3.42Å; Q50-R54 WeakPolarHBondContact O-CG 3.46Å; Q50-R54 PolarHBondContact O-N 2.96Å
51	Y	60.3	Low	63.8	Low	147 Å²	147	101.5 Å²	101.5	58%	0.576	47%	0.467	S	S	*	.	H	α-helix	trans	-66.4	-49.6	175.4	179.6	-91.2	0	0	0	111.3	L47 Q48 R53 R54 E55	L47-Y51 WeakPolarHBondContact O-CB 3.45Å; L47-Y51 PolarHBondContact O-N 3.11Å; Q48-Y51 PolarHBondContact O-N 2.84Å; Y51-R53 VanDerWaalsContact C-N 3.31Å; Y51-R53 PolarHBondContact O-N 3.41Å; Y51-R54 PolarHBondContact O-N 3.34Å; Y51-R54 VanDerWaalsContact O-N 3.15Å; Y51-E55 HydrophobicContact CD1-CG 4.31Å; Y51-E55 HydrophobicContact CE1-CG 3.73Å; Y51-E55 HydrophobicContact CE2-CG 4.28Å; Y51-E55 PolarHBondContact O-N 3.15Å
52	M	64.4	Low	63.6	Low	105 Å²	105	98.2 Å²	98.2	52%	0.517	46%	0.458	S	S	.	.	H	α-helix	trans	-56.4	-46.6	176.1	-72.8	-62.7	-61.5	0	0	111	Q48 R54 E55 E56	Q48-M52 WeakPolarHBondContact O-CB 3.45Å; Q48-M52 VanDerWaalsContact O-CG 3.27Å; Q48-M52 WeakPolarHBondContact O-CG 3.48Å; Q48-M52 PolarHBondContact O-N 2.95Å; M52-R54 PolarHBondContact O-N 3.16Å; M52-E55 PolarHBondContact O-N 3.37Å; M52-E56 WeakPolarHBondContact O-CB 3.44Å; M52-E56 WeakPolarHBondContact O-CG 3.39Å; M52-E56 PolarHBondContact O-N 3.36Å
53	R	64.6	Low	63.5	Low	145 Å²	145	98 Å²	98	55%	0.547	46%	0.458	S	S	.	.	H	α-helix	trans	-62.3	-39.5	177	-169.4	179.7	179.1	159.6	7.4	112.8	N49 Y51 E56 E57	N49-R53 WeakPolarHBondContact O-CB 3.37Å; N49-R53 PolarHBondContact O-N 2.98Å; Y51-R53 VanDerWaalsContact C-N 3.31Å; Y51-R53 PolarHBondContact O-N 3.41Å; R53-E56 PolarHBondContact O-N 3.17Å; R53-E57 IonicContact NE-OE1 3.34Å; R53-E57 PolarHBondContact NE-OE1 2.72Å; R53-E57 WeakPolarHBondContact O-CB 3.47Å; R53-E57 VanDerWaalsContact O-CG 3.22Å; R53-E57 WeakPolarHBondContact O-CG 3.22Å; R53-E57 PolarHBondContact O-N 2.9Å
54	R	61.3	Low	63.5	Low	178 Å²	178	103.7 Å²	103.7	67%	0.672	48%	0.479	S	S	*	.	H	α-helix	trans	-66.6	-40.5	175	-84.2	-176.8	-179.7	173.8	0.9	112.7	Q50 Y51 M52 E57 K58	Q50-R54 WeakPolarHBondContact O-CB 3.42Å; Q50-R54 WeakPolarHBondContact O-CG 3.46Å; Q50-R54 PolarHBondContact O-N 2.96Å; Y51-R54 PolarHBondContact O-N 3.34Å; Y51-R54 VanDerWaalsContact O-N 3.15Å; M52-R54 PolarHBondContact O-N 3.16Å; R54-E57 PolarHBondContact O-N 3.33Å; R54-K58 VanDerWaalsContact O-CB 3.23Å; R54-K58 WeakPolarHBondContact O-CB 3.46Å; R54-K58 PolarHBondContact O-N 2.83Å
55	E	64.6	Low	63	Low	71 Å²	71	105.5 Å²	105.5	33%	0.332	48%	0.479	S	S	.	.	H	α-helix	trans	-68.9	-38.7	176.2	-73.5	-60.5	120.1	0	0	111	Y51 M52 K58 E59	Y51-E55 HydrophobicContact CD1-CG 4.31Å; Y51-E55 HydrophobicContact CE1-CG 3.73Å; Y51-E55 HydrophobicContact CE2-CG 4.28Å; Y51-E55 PolarHBondContact O-N 3.15Å; M52-E55 PolarHBondContact O-N 3.37Å; E55-K58 PolarHBondContact O-N 3.38Å; E55-K58 IonicContact OE1-NZ 2.73Å; E55-K58 IonicContact OE2-NZ 3.39Å; E55-K58 PolarHBondContact OE2-NZ 2.88Å; E55-E59 WeakPolarHBondContact O-CB 3.22Å; E55-E59 PolarHBondContact O-N 3.4Å
56	E	68.3	Low	62.6	Low	117 Å²	117	105 Å²	105	55%	0.547	48%	0.481	S	S	.	.	H	α-helix	trans	-61.8	-43.6	170.7	-73.8	171.3	-175.2	0	0	112.1	M52 R53 E59 A60	M52-E56 WeakPolarHBondContact O-CB 3.44Å; M52-E56 WeakPolarHBondContact O-CG 3.39Å; M52-E56 PolarHBondContact O-N 3.36Å; R53-E56 PolarHBondContact O-N 3.17Å; E56-E59 PolarHBondContact O-N 2.97Å; E56-A60 VanDerWaalsContact O-CB 3.25Å; E56-A60 WeakPolarHBondContact O-CB 3.44Å; E56-A60 PolarHBondContact O-N 3.2Å
57	E	64.5	Low	61.7	Low	97 Å²	97	105.9 Å²	105.9	45%	0.453	49%	0.489	S	S	.	.	H	α-helix	trans	-64.8	-40	176	-78.3	170.3	-172	0	0	111.7	R53 R54 A60 L61	R53-E57 IonicContact NE-OE1 3.34Å; R53-E57 PolarHBondContact NE-OE1 2.72Å; R53-E57 WeakPolarHBondContact O-CB 3.47Å; R53-E57 VanDerWaalsContact O-CG 3.22Å; R53-E57 WeakPolarHBondContact O-CG 3.22Å; R53-E57 PolarHBondContact O-N 2.9Å; R54-E57 PolarHBondContact O-N 3.33Å; E57-A60 PolarHBondContact O-N 2.92Å; E57-L61 WeakPolarHBondContact O-CB 3.33Å; E57-L61 VanDerWaalsContact O-CG 3.32Å; E57-L61 WeakPolarHBondContact O-CG 3.48Å; E57-L61 PolarHBondContact O-N 3.4Å
58	K	59.8	Low	61.1	Low	105 Å²	105	106.8 Å²	106.8	46%	0.457	50%	0.495	S	S	.	.	H	α-helix	trans	-66.2	-43.4	175.1	179.6	-176.5	166.1	-159.3	0	111.3	R54 E55 L61 I62	R54-K58 VanDerWaalsContact O-CB 3.23Å; R54-K58 WeakPolarHBondContact O-CB 3.46Å; R54-K58 PolarHBondContact O-N 2.83Å; E55-K58 PolarHBondContact O-N 3.38Å; E55-K58 IonicContact OE1-NZ 2.73Å; E55-K58 IonicContact OE2-NZ 3.39Å; E55-K58 PolarHBondContact OE2-NZ 2.88Å; K58-L61 PolarHBondContact O-N 3.13Å; K58-I62 HydrophobicContact CG-CD1 4Å; K58-I62 WeakPolarHBondContact O-CB 3.35Å; K58-I62 WeakPolarHBondContact O-CG1 3.48Å; K58-I62 PolarHBondContact O-N 2.89Å
59	E	63.1	Low	60.2	Low	120 Å²	120	108.5 Å²	108.5	56%	0.561	50%	0.503	S	S	*	.	H	α-helix	trans	-65	-40.9	175	-170.3	173.7	-177.4	0	0	111.2	E55 E56 L61 I62 N63	E55-E59 WeakPolarHBondContact O-CB 3.22Å; E55-E59 PolarHBondContact O-N 3.4Å; E56-E59 PolarHBondContact O-N 2.97Å; E59-L61 PolarHBondContact O-N 2.84Å; E59-I62 PolarHBondContact O-N 3.43Å; E59-N63 VanDerWaalsContact O-CB 3.31Å; E59-N63 WeakPolarHBondContact O-CB 3.27Å; E59-N63 VanDerWaalsContact O-CG 3.25Å; E59-N63 PolarHBondContact O-N 2.87Å; E59-N63 PolarHBondContact O-ND2 2.92Å
60	A	66.3	Low	59.1	Low	59 Å²	59	112.3 Å²	112.3	49%	0.488	51%	0.514	S	S	.	.	H	α-helix	trans	-62.1	-41.6	173.2	0	0	0	0	0	112.1	E56 E57 N63 Y64	E56-A60 VanDerWaalsContact O-CB 3.25Å; E56-A60 WeakPolarHBondContact O-CB 3.44Å; E56-A60 PolarHBondContact O-N 3.2Å; E57-A60 PolarHBondContact O-N 2.92Å; A60-N63 PolarHBondContact O-N 3.47Å; A60-Y64 VanDerWaalsContact O-CB 3.27Å; A60-Y64 WeakPolarHBondContact O-CB 3.21Å; A60-Y64 PolarHBondContact O-N 2.92Å
61	L	57.8	Low	57.6	Low	93 Å²	93	116.6 Å²	116.6	49%	0.487	53%	0.534	S	S	.	.	H	α-helix	trans	-62.7	-47.7	173.4	-80.7	166.3	0	0	0	111.1	E57 K58 E59 N63 Y64 Y65	E57-L61 WeakPolarHBondContact O-CB 3.33Å; E57-L61 VanDerWaalsContact O-CG 3.32Å; E57-L61 WeakPolarHBondContact O-CG 3.48Å; E57-L61 PolarHBondContact O-N 3.4Å; K58-L61 PolarHBondContact O-N 3.13Å; E59-L61 PolarHBondContact O-N 2.84Å; L61-N63 VanDerWaalsContact C-N 3.34Å; L61-N63 PolarHBondContact O-N 3.43Å; L61-Y64 WeakPolarHBondContact O-CB 3.37Å; L61-Y64 PolarHBondContact O-N 3.04Å; L61-Y65 HydrophobicContact CB-CD2 4.49Å; L61-Y65 HydrophobicContact CB-CE2 4.18Å; L61-Y65 HydrophobicContact CD2-CE2 4.32Å; L61-Y65 WeakPolarHBondContact O-CD2 3.43Å; L61-Y65 PolarHBondContact O-N 3.12Å
62	I	61.5	Low	56.4	Low	74 Å²	74	117.8 Å²	117.8	38%	0.379	55%	0.545	S	S	.	.	H	α-helix	trans	-58.8	-46.6	176.9	-71.5	166.3	0	0	0	110.5	K58 E59 Y64 Y65 F66	K58-I62 HydrophobicContact CG-CD1 4Å; K58-I62 WeakPolarHBondContact O-CB 3.35Å; K58-I62 WeakPolarHBondContact O-CG1 3.48Å; K58-I62 PolarHBondContact O-N 2.89Å; E59-I62 PolarHBondContact O-N 3.43Å; I62-Y64 PolarHBondContact O-N 2.81Å; I62-Y65 PolarHBondContact O-N 3.15Å; I62-F66 HydrophobicContact CG2-CD2 3.55Å; I62-F66 HydrophobicContact CG2-CE2 3.35Å; I62-F66 WeakPolarHBondContact O-CD2 3.31Å; I62-F66 PolarHBondContact O-N 3.39Å
63	N	60.3	Low	54.8	Low	78 Å²	78	119.8 Å²	119.8	42%	0.417	56%	0.558	S	S	.	*	H	α-helix	trans	-63.5	-39.8	176.8	-74.4	-27.5	0	0	0	112.1	E59 A60 L61 F66 L67	E59-N63 VanDerWaalsContact O-CB 3.31Å; E59-N63 WeakPolarHBondContact O-CB 3.27Å; E59-N63 VanDerWaalsContact O-CG 3.25Å; E59-N63 PolarHBondContact O-N 2.87Å; E59-N63 PolarHBondContact O-ND2 2.92Å; A60-N63 PolarHBondContact O-N 3.47Å; L61-N63 VanDerWaalsContact C-N 3.34Å; L61-N63 PolarHBondContact O-N 3.43Å; N63-F66 PolarHBondContact O-N 2.89Å; N63-L67 WeakPolarHBondContact O-CB 3.29Å; N63-L67 WeakPolarHBondContact O-CD1 3.5Å; N63-L67 WeakPolarHBondContact O-CG 3.49Å; N63-L67 PolarHBondContact O-N 3.42Å
64	Y	61.8	Low	53.1	Low	134 Å²	134	119.6 Å²	119.6	53%	0.525	57%	0.568	S	S	.	*	H	α-helix	trans	-61.5	-42.2	173.2	174.9	-97.3	0	0	0	111.8	A60 L61 I62 L67 N68	A60-Y64 VanDerWaalsContact O-CB 3.27Å; A60-Y64 WeakPolarHBondContact O-CB 3.21Å; A60-Y64 PolarHBondContact O-N 2.92Å; L61-Y64 WeakPolarHBondContact O-CB 3.37Å; L61-Y64 PolarHBondContact O-N 3.04Å; I62-Y64 PolarHBondContact O-N 2.81Å; Y64-L67 PolarHBondContact O-N 2.85Å; Y64-N68 WeakPolarHBondContact CE1-ND2 3.43Å; Y64-N68 WeakPolarHBondContact CE2-ND2 3.3Å; Y64-N68 WeakPolarHBondContact O-CB 3.38Å; Y64-N68 PolarHBondContact O-N 3.05Å; Y64-N68 PolarHBondContact O-ND2 2.99Å; Y64-N68 PolarHBondContact OH-ND2 2.69Å
65	Y	51.4	Low	51.6	Low	111 Å²	111	119.8 Å²	119.8	44%	0.435	58%	0.576	S	S	.	*	H	α-helix	trans	-64.2	-44	174.9	-70.8	-60.8	0	0	0	111.8	L61 I62 N68 E69	L61-Y65 HydrophobicContact CB-CD2 4.49Å; L61-Y65 HydrophobicContact CB-CE2 4.18Å; L61-Y65 HydrophobicContact CD2-CE2 4.32Å; L61-Y65 WeakPolarHBondContact O-CD2 3.43Å; L61-Y65 PolarHBondContact O-N 3.12Å; I62-Y65 PolarHBondContact O-N 3.15Å; Y65-N68 PolarHBondContact O-N 3.35Å; Y65-E69 PolarHBondContact O-N 2.69Å
66	F	55.8	Low	49.9	Very low	124 Å²	124	124.1 Å²	124.1	54%	0.544	60%	0.601	S	S	.	*	H	α-helix	trans	-67.3	-35.6	177.1	-79.8	-58.8	0	0	0	113.9	I62 N63	I62-F66 HydrophobicContact CG2-CD2 3.55Å; I62-F66 HydrophobicContact CG2-CE2 3.35Å; I62-F66 WeakPolarHBondContact O-CD2 3.31Å; I62-F66 PolarHBondContact O-N 3.39Å; N63-F66 PolarHBondContact O-N 2.89Å
67	L	49.1	Very low	48.3	Very low	120 Å²	120	123.6 Å²	123.6	63%	0.628	61%	0.61	S	S	*	*	H	α-helix	trans	-68.6	-39.4	176	-81.9	159.4	0	0	0	111.4	N63 Y64 K70 Q71	N63-L67 WeakPolarHBondContact O-CB 3.29Å; N63-L67 WeakPolarHBondContact O-CD1 3.5Å; N63-L67 WeakPolarHBondContact O-CG 3.49Å; N63-L67 PolarHBondContact O-N 3.42Å; Y64-L67 PolarHBondContact O-N 2.85Å; L67-K70 PolarHBondContact O-N 2.84Å; L67-Q71 PolarHBondContact O-N 3.39Å
68	N	48.9	Very low	46.4	Very low	71 Å²	71	126 Å²	126	38%	0.38	63%	0.627	S	S	.	*	H	α-helix	trans	-77.5	-27.4	179.7	-75.1	-23.4	0	0	0	113.9	Y64 Y65 K70 Q71	Y64-N68 WeakPolarHBondContact CE1-ND2 3.43Å; Y64-N68 WeakPolarHBondContact CE2-ND2 3.3Å; Y64-N68 WeakPolarHBondContact O-CB 3.38Å; Y64-N68 PolarHBondContact O-N 3.05Å; Y64-N68 PolarHBondContact O-ND2 2.99Å; Y64-N68 PolarHBondContact OH-ND2 2.69Å; Y65-N68 PolarHBondContact O-N 3.35Å; N68-K70 PolarHBondContact O-N 2.85Å; N68-Q71 PolarHBondContact O-N 3.37Å
69	E	48.2	Very low	44.8	Very low	150 Å²	150	126.7 Å²	126.7	70%	0.701	64%	0.643	S	S	*	*	H	α-helix	trans	-62.8	-29.4	168.7	-87.8	-168.9	153.7	0	0	112.1	Y65	Y65-E69 PolarHBondContact O-N 2.69Å
70	K	43.4	Very low	42.8	Very low	186 Å²	186	129.7 Å²	129.7	81%	0.809	66%	0.657	S	S	*	*	H	α-helix	trans	-85.4	-14.2	179.9	-73.3	-172.9	178.8	179.5	0	114.7	L67 N68 Q72	L67-K70 PolarHBondContact O-N 2.84Å; N68-K70 PolarHBondContact O-N 2.85Å; K70-Q72 PolarHBondContact O-N 3.37Å
71	Q	33.5	Very low	40.8	Very low	163 Å²	163	132 Å²	132	76%	0.762	67%	0.665	S	S	*	*			trans	-101.6	65.9	175.6	-74.1	-172.9	-12.9	0	0	111.1	L67 N68	L67-Q71 PolarHBondContact O-N 3.39Å; N68-Q71 PolarHBondContact O-N 3.37Å
72	Q	36.6	Very low	39	Very low	172 Å²	172	132.9 Å²	132.9	80%	0.804	68%	0.679	S	S	*	*			trans	-82.3	100.9	154.5	-84.8	-175.2	-22	0	0	109	K70	K70-Q72 PolarHBondContact O-N 3.37Å
73	N	29.9	Very low	37.2	Very low	147 Å²	147	138 Å²	138	79%	0.786	70%	0.699	S	S	*	*			trans	162.8	140.4	132.8	-82.8	-19.1	0	0	0	110.9
74	D	29	Very low	35.3	Very low	141 Å²	141	144.2 Å²	144.2	75%	0.754	72%	0.722	S	S	*	*			trans	72.9	93	170.2	-59.2	-23.3	0	0	0	118
75	H	29.8	Very low	33.7	Very low	182 Å²	182	142.5 Å²	142.5	84%	0.843	73%	0.726	S	S	*	*				177	122.3	106.8	-89.9	-59.8	0	0	0	112.2	S77	H75-S77 PolarHBondContact O-N 3.31Å
76	N	29.1	Very low	32.4	Very low	162 Å²	162	148.7 Å²	148.7	87%	0.866	75%	0.748	S	S	*	*			trans	-56	116	157.4	-92.2	-17.5	0	0	0	109.6
77	S	33.4	Very low	31.2	Very low	106 Å²	106	148.1 Å²	148.1	74%	0.741	76%	0.755	S	S	*	*			trans	-133.6	104.1	151.6	55.2	0	0	0	0	108.8	H75 C79	H75-S77 PolarHBondContact O-N 3.31Å; S77-C79 PolarHBondContact O-N 2.73Å; S77-C79 VanDerWaalsContact O-N 3.14Å
78	N	25.8	Very low	30.6	Very low	148 Å²	148	153 Å²	153	79%	0.791	77%	0.771	S	S	*	*			trans	-58.2	110.2	164	-77.1	-15.9	0	0	0	108.3
79	C	25.2	Very low	30	Very low	120 Å²	120	153.2 Å²	153.2	81%	0.811	78%	0.775	S	S	*	*			trans	-117.1	79	153.9	-106.1	0	0	0	0	106.7	S77 V81	S77-C79 PolarHBondContact O-N 2.73Å; S77-C79 VanDerWaalsContact O-N 3.14Å; C79-V81 PolarHBondContact O-N 3.39Å
80	E	21.8	Very low	29.9	Very low	182 Å²	182	150.6 Å²	150.6	85%	0.85	77%	0.77	S	S	*	*			trans	-66.8	115.9	158	-83.9	-176.5	147.6	0	0	107.8
81	V	23.6	Very low	30.6	Very low	108 Å²	108	146.1 Å²	146.1	66%	0.655	76%	0.755	S	S	*	*			trans	-108.6	97.7	163.5	-177.9	0	0	0	0	106.7	C79 F83	C79-V81 PolarHBondContact O-N 3.39Å; V81-F83 HydrophobicContact CG1-CD2 3.76Å; V81-F83 HydrophobicContact CG1-CE2 3.46Å; V81-F83 VanDerWaalsContact CG1-CE2 3.46Å; V81-F83 HydrophobicContact CG1-CZ 4.44Å
82	S	20.5	Very low	31.8	Very low	112 Å²	112	139.9 Å²	139.9	78%	0.783	73%	0.726	S	S	*	*			trans	-79.9	120	171.3	61.4	0	0	0	0	110
83	F	24.2	Very low	33.3	Very low	182 Å²	182	134.9 Å²	134.9	80%	0.798	71%	0.71	S	S	*	*			trans	-100	119.3	168.1	-89	-88	0	0	0	110.4	V81	V81-F83 HydrophobicContact CG1-CD2 3.76Å; V81-F83 HydrophobicContact CG1-CE2 3.46Å; V81-F83 VanDerWaalsContact CG1-CE2 3.46Å; V81-F83 HydrophobicContact CG1-CZ 4.44Å
84	K	20.6	Very low	35.2	Very low	207 Å²	207	131.5 Å²	131.5	90%	0.9	70%	0.695	S	S	*	*			trans	-82.9	111.9	167.2	-85.4	177.9	175	170.9	0	108.9
85	V	28.3	Very low	37.1	Very low	99 Å²	99	128.2 Å²	128.2	60%	0.6	67%	0.673	S	S	*	*			trans	-127.9	114.6	159.5	-179.6	0	0	0	0	109.1	T89	V85-T89 PolarHBondContact O-OG1 3.41Å; V85-T89 VanDerWaalsContact O-OG1 3.06Å
86	R	24.5	Very low	39.1	Very low	241 Å²	241	120.2 Å²	120.2	91%	0.909	64%	0.636	S	S	*	*			trans	-78.1	108.4	172.2	-80.7	175.5	169	176.6	-3.8	108.9
87	T	29.7	Very low	41.3	Very low	111 Å²	111	114.9 Å²	114.9	68%	0.681	62%	0.615	S	S	*	*	S	Bend	trans	-173	64.4	149.4	26.4	0	0	0	0	109.8	T89	T87-T89 PolarHBondContact O-N 3.39Å
88	K	35.9	Very low	43.4	Very low	223 Å²	223	115.5 Å²	115.5	97%	0.97	60%	0.604	S	S	*	*	S	Bend	trans	39	32	-178.4	-80	-170.6	176.4	-177.9	0	114	T90	K88-T90 PolarHBondContact O-N 2.7Å; K88-T90 VanDerWaalsContact O-N 3.1Å
89	T	37.9	Very low	45.9	Very low	76 Å²	76	108.5 Å²	108.5	47%	0.466	57%	0.567	S	S	.	*			trans	-69.9	105.1	174	31.4	0	0	0	0	103.6	V85 T87 D91	V85-T89 PolarHBondContact O-OG1 3.41Å; V85-T89 VanDerWaalsContact O-OG1 3.06Å; T87-T89 PolarHBondContact O-N 3.39Å; T89-D91 PolarHBondContact O-N 3.31Å
90	T	45.3	Very low	48.5	Very low	95 Å²	95	103.5 Å²	103.5	58%	0.583	53%	0.533	S	S	*	.			trans	-47.6	109.3	143.6	20.8	0	0	0	0	103.8	K88 L92	K88-T90 PolarHBondContact O-N 2.7Å; K88-T90 VanDerWaalsContact O-N 3.1Å; T90-L92 PolarHBondContact O-N 2.89Å; T90-L92 VanDerWaalsContact O-N 3.16Å
91	D	57.4	Low	51.3	Low	92 Å²	92	98.2 Å²	98.2	49%	0.492	52%	0.516	S	S	.	.			trans	-43.7	130.5	178.1	179.8	-3.4	0	0	0	106.2	T89 S93 T94 Y95	T89-D91 PolarHBondContact O-N 3.31Å; D91-S93 CarbonylContact O-C 3.46Å; D91-S93 PolarHBondContact O-N 2.9Å; D91-S93 PolarHBondContact OD1-N 3.47Å; D91-S93 PolarHBondContact OD1-OG 2.8Å; D91-S93 PolarHBondContact OD2-OG 2.86Å; D91-T94 CarbonylContact O-C 3.58Å; D91-T94 VanDerWaalsContact O-CA 3.28Å; D91-T94 WeakPolarHBondContact O-CA 3.1Å; D91-T94 VanDerWaalsContact O-CB 3.29Å; D91-T94 WeakPolarHBondContact O-CB 3.35Å; D91-T94 PolarHBondContact O-N 3.12Å; D91-Y95 PolarHBondContact O-N 2.76Å
92	L	60.2	Low	54	Low	31 Å²	31	95.3 Å²	95.3	16%	0.162	50%	0.496	C	S	.	.	H	α-helix	trans	-52.7	-30	-177.6	-178.5	58.7	0	0	0	110.4	T90 Y95 T96 A143 E146 N147	T90-L92 PolarHBondContact O-N 2.89Å; T90-L92 VanDerWaalsContact O-N 3.16Å; L92-Y95 HydrophobicContact CD1-CD1 4.32Å; L92-Y95 PolarHBondContact O-N 3.29Å; L92-T96 VanDerWaalsContact O-CB 3.25Å; L92-T96 WeakPolarHBondContact O-CB 3.42Å; L92-T96 PolarHBondContact O-N 3.42Å; L92-T96 PolarHBondContact O-OG1 2.89Å; L92-A143 HydrophobicContact CD1-CB 3.76Å; L92-A143 HydrophobicContact CG-CB 4.32Å; L92-E146 VanDerWaalsContact CD1-OE2 3.28Å; L92-E146 WeakPolarHBondContact CD1-OE2 3.43Å; L92-E146 HydrophobicContact CD2-CB 3.62Å; L92-E146 WeakPolarHBondContact CD2-OE2 3.3Å; L92-N147 WeakPolarHBondContact CD2-ND2 3.5Å
93	S	66.2	Low	56.9	Low	68 Å²	68	90.2 Å²	90.2	48%	0.476	46%	0.46	S	S	.	.	H	α-helix	trans	-57.3	-47.3	169.1	80.9	0	0	0	0	112.7	D91 A97	D91-S93 CarbonylContact O-C 3.46Å; D91-S93 PolarHBondContact O-N 2.9Å; D91-S93 PolarHBondContact OD1-N 3.47Å; D91-S93 PolarHBondContact OD1-OG 2.8Å; D91-S93 PolarHBondContact OD2-OG 2.86Å; S93-A97 WeakPolarHBondContact O-CB 3.1Å; S93-A97 PolarHBondContact O-N 3.22Å
94	T	70.2	Confident	59.8	Low	76 Å²	76	87.3 Å²	87.3	47%	0.466	45%	0.447	S	S	.	.	H	α-helix	trans	-68.7	-41.4	177.5	-56.1	0	0	0	0	111.4	D91 A97 F98	D91-T94 CarbonylContact O-C 3.58Å; D91-T94 VanDerWaalsContact O-CA 3.28Å; D91-T94 WeakPolarHBondContact O-CA 3.1Å; D91-T94 VanDerWaalsContact O-CB 3.29Å; D91-T94 WeakPolarHBondContact O-CB 3.35Å; D91-T94 PolarHBondContact O-N 3.12Å; T94-A97 PolarHBondContact O-N 3.45Å; T94-F98 VanDerWaalsContact O-CB 3.27Å; T94-F98 WeakPolarHBondContact O-CB 3.24Å; T94-F98 PolarHBondContact O-N 2.94Å
95	Y	68.9	Low	62.6	Low	72 Å²	72	82.4 Å²	82.4	28%	0.282	43%	0.428	S	S	.	.	H	α-helix	trans	-65.1	-45.3	176.7	-177.4	-104	0	0	0	111.9	D91 L92 F98 N99 N138	D91-Y95 PolarHBondContact O-N 2.76Å; L92-Y95 HydrophobicContact CD1-CD1 4.32Å; L92-Y95 PolarHBondContact O-N 3.29Å; Y95-F98 PolarHBondContact O-N 3.44Å; Y95-N99 WeakPolarHBondContact CE1-ND2 3.31Å; Y95-N99 PolarHBondContact O-N 3.05Å; Y95-N99 PolarHBondContact O-ND2 3.08Å; Y95-N138 HydrophobicContact CE1-CB 3.95Å; Y95-N138 PolarHBondContact OH-ND2 3.28Å; Y95-N138 PolarHBondContact OH-OD1 2.95Å; Y95-N138 VanDerWaalsContact OH-OD1 3.07Å
96	T	72	Confident	65.3	Low	13 Å²	13	78 Å²	78	8%	0.08	40%	0.402	C	S	.	.	H	α-helix	trans	-65.8	-42	176	-51.5	0	0	0	0	110.7	L92 F98 N99 S100 I139 A143 M164	L92-T96 VanDerWaalsContact O-CB 3.25Å; L92-T96 WeakPolarHBondContact O-CB 3.42Å; L92-T96 PolarHBondContact O-N 3.42Å; L92-T96 PolarHBondContact O-OG1 2.89Å; T96-F98 VanDerWaalsContact C-N 3.34Å; T96-F98 PolarHBondContact O-N 2.95Å; T96-N99 PolarHBondContact O-N 2.9Å; T96-S100 WeakPolarHBondContact O-CB 3.29Å; T96-S100 PolarHBondContact O-N 2.8Å; T96-I139 HydrophobicContact CG2-CG1 4.47Å; T96-I139 HydrophobicContact CG2-CG2 4.26Å; T96-A143 HydrophobicContact CG2-CB 4.3Å; T96-A143 WeakPolarHBondContact OG1-CB 3.35Å; T96-M164 HydrophobicContact CG2-CE 3.64Å; T96-M164 HydrophobicContact CG2-SD 3.77Å
97	A	75.1	Confident	68.2	Low	50 Å²	50	68.9 Å²	68.9	41%	0.413	37%	0.368	S	S	.	.	H	α-helix	trans	-63.5	-39	176.1	0	0	0	0	0	111.9	S93 T94 S100 S101	S93-A97 WeakPolarHBondContact O-CB 3.1Å; S93-A97 PolarHBondContact O-N 3.22Å; T94-A97 PolarHBondContact O-N 3.45Å; A97-S100 PolarHBondContact O-N 3.14Å; A97-S101 VanDerWaalsContact O-CB 3.29Å; A97-S101 WeakPolarHBondContact O-CB 3.33Å; A97-S101 PolarHBondContact O-N 2.96Å; A97-S101 PolarHBondContact O-OG 3.17Å
98	F	78.3	Confident	70.8	Confident	119 Å²	119	68.8 Å²	68.8	52%	0.522	36%	0.359	S	S	.	.	H	α-helix	trans	-61.8	-54.8	175.2	175.7	-100.1	0	0	0	111.5	T94 Y95 T96 S100 S101 Q102	T94-F98 VanDerWaalsContact O-CB 3.27Å; T94-F98 WeakPolarHBondContact O-CB 3.24Å; T94-F98 PolarHBondContact O-N 2.94Å; Y95-F98 PolarHBondContact O-N 3.44Å; T96-F98 VanDerWaalsContact C-N 3.34Å; T96-F98 PolarHBondContact O-N 2.95Å; F98-S100 VanDerWaalsContact C-N 3.29Å; F98-S100 PolarHBondContact O-N 2.94Å; F98-S101 CarbonylContact O-C 3.56Å; F98-S101 WeakPolarHBondContact O-CA 3.31Å; F98-S101 WeakPolarHBondContact O-CB 3.47Å; F98-S101 PolarHBondContact O-N 3.37Å; F98-Q102 HydrophobicContact CD1-CG 4.44Å; F98-Q102 HydrophobicContact CE1-CG 4.02Å; F98-Q102 HydrophobicContact CE2-CG 4.36Å; F98-Q102 VanDerWaalsContact CZ-CD 3.47Å; F98-Q102 HydrophobicContact CZ-CG 3.97Å; F98-Q102 PolarHBondContact O-N 2.92Å
99	N	78.3	Confident	73.1	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.011	33%	0.325	C	S	.	.	H	α-helix	trans	-62.5	-36.6	178.2	-72.9	-86.2	0	0	0	111.6	Y95 T96 S101 Q102 L103 N138 I139	Y95-N99 WeakPolarHBondContact CE1-ND2 3.31Å; Y95-N99 PolarHBondContact O-N 3.05Å; Y95-N99 PolarHBondContact O-ND2 3.08Å; T96-N99 PolarHBondContact O-N 2.9Å; N99-S101 VanDerWaalsContact C-N 3.32Å; N99-S101 PolarHBondContact O-N 2.85Å; N99-Q102 PolarHBondContact O-N 3.42Å; N99-L103 WeakPolarHBondContact O-CB 3.26Å; N99-L103 PolarHBondContact O-N 2.87Å; N99-N138 HydrophobicContact CB-CB 4.45Å; N99-N138 VanDerWaalsContact OD1-CB 3.25Å; N99-N138 WeakPolarHBondContact OD1-CB 3.31Å; N99-N138 PolarHBondContact OD1-ND2 3.35Å; N99-I139 HydrophobicContact CB-CD1 3.8Å; N99-I139 HydrophobicContact CB-CG1 3.57Å
100	S	80.4	Confident	75.4	Confident	14 Å²	14	56.8 Å²	56.8	10%	0.098	30%	0.303	C	S	.	.	H	α-helix	trans	-64.7	-37.9	174.3	-178.1	0	0	0	0	111.6	T96 A97 F98 L103 K104	T96-S100 WeakPolarHBondContact O-CB 3.29Å; T96-S100 PolarHBondContact O-N 2.8Å; A97-S100 PolarHBondContact O-N 3.14Å; F98-S100 VanDerWaalsContact C-N 3.29Å; F98-S100 PolarHBondContact O-N 2.94Å; S100-L103 PolarHBondContact O-N 3.19Å; S100-K104 WeakPolarHBondContact O-CB 3.38Å; S100-K104 VanDerWaalsContact O-CG 3.3Å; S100-K104 WeakPolarHBondContact O-CG 3.46Å; S100-K104 PolarHBondContact O-N 3.47Å
101	S	79.5	Confident	77.4	Confident	71 Å²	71	56.9 Å²	56.9	50%	0.497	30%	0.296	S	S	.	.	H	α-helix	trans	-70.3	-39.3	176.7	-58	0	0	0	0	111.5	A97 F98 N99 K104 M105	A97-S101 VanDerWaalsContact O-CB 3.29Å; A97-S101 WeakPolarHBondContact O-CB 3.33Å; A97-S101 PolarHBondContact O-N 2.96Å; A97-S101 PolarHBondContact O-OG 3.17Å; F98-S101 CarbonylContact O-C 3.56Å; F98-S101 WeakPolarHBondContact O-CA 3.31Å; F98-S101 WeakPolarHBondContact O-CB 3.47Å; F98-S101 PolarHBondContact O-N 3.37Å; N99-S101 VanDerWaalsContact C-N 3.32Å; N99-S101 PolarHBondContact O-N 2.85Å; S101-K104 PolarHBondContact O-N 2.92Å; S101-M105 WeakPolarHBondContact O-CB 3.04Å; S101-M105 PolarHBondContact O-N 2.96Å
102	Q	80.3	Confident	78.6	Confident	47 Å²	47	56.9 Å²	56.9	22%	0.22	30%	0.296	C	S	.	.	H	α-helix	trans	-60.1	-47.8	171.4	-74.4	-175.6	-62.6	0	0	111.3	F98 N99 K104 M105 T106 E131	F98-Q102 HydrophobicContact CD1-CG 4.44Å; F98-Q102 HydrophobicContact CE1-CG 4.02Å; F98-Q102 HydrophobicContact CE2-CG 4.36Å; F98-Q102 VanDerWaalsContact CZ-CD 3.47Å; F98-Q102 HydrophobicContact CZ-CG 3.97Å; F98-Q102 PolarHBondContact O-N 2.92Å; N99-Q102 PolarHBondContact O-N 3.42Å; Q102-K104 VanDerWaalsContact C-N 3.32Å; Q102-K104 PolarHBondContact O-N 3.4Å; Q102-M105 PolarHBondContact O-N 3.01Å; Q102-M105 VanDerWaalsContact O-N 3.15Å; Q102-T106 WeakPolarHBondContact O-CB 3.19Å; Q102-T106 PolarHBondContact O-N 2.62Å; Q102-T106 PolarHBondContact O-OG1 3.34Å; Q102-T106 VanDerWaalsContact O-OG1 3.12Å; Q102-E131 PolarHBondContact NE2-OE2 3.29Å
103	L	81.4	Confident	79.4	Confident	5 Å²	5	56.5 Å²	56.5	3%	0.026	30%	0.295	C	S	.	.	H	α-helix	trans	-60.2	-42.5	177.7	-173.1	66.6	0	0	0	111.8	N99 S100 T106 K107 I132 D167 A168 T171	N99-L103 WeakPolarHBondContact O-CB 3.26Å; N99-L103 PolarHBondContact O-N 2.87Å; S100-L103 PolarHBondContact O-N 3.19Å; L103-T106 PolarHBondContact O-N 2.76Å; L103-K107 WeakPolarHBondContact O-CB 3.25Å; L103-K107 PolarHBondContact O-N 3.36Å; L103-I132 HydrophobicContact CD1-CB 4.5Å; L103-I132 HydrophobicContact CD1-CG1 4.23Å; L103-I132 HydrophobicContact CD1-CG2 4.38Å; L103-D167 HydrophobicContact CD2-CB 4.25Å; L103-A168 HydrophobicContact CD2-CB 4.1Å; L103-T171 HydrophobicContact CD1-CG2 3.95Å
104	K	84.5	Confident	79.7	Confident	121 Å²	121	58.3 Å²	58.3	53%	0.526	30%	0.303	S	S	.	.	H	α-helix	trans	-63.9	-40.9	174.7	-74.5	174	-176.8	177.8	0	112.4	S100 S101 Q102 K107 F108	S100-K104 WeakPolarHBondContact O-CB 3.38Å; S100-K104 VanDerWaalsContact O-CG 3.3Å; S100-K104 WeakPolarHBondContact O-CG 3.46Å; S100-K104 PolarHBondContact O-N 3.47Å; S101-K104 PolarHBondContact O-N 2.92Å; Q102-K104 VanDerWaalsContact C-N 3.32Å; Q102-K104 PolarHBondContact O-N 3.4Å; K104-K107 WeakPolarHBondContact O-CB 3.38Å; K104-K107 PolarHBondContact O-N 2.92Å; K104-F108 WeakPolarHBondContact O-CB 3.3Å; K104-F108 PolarHBondContact O-N 3.48Å
105	M	81.5	Confident	79.6	Confident	105 Å²	105	60 Å²	60	52%	0.517	31%	0.313	S	S	.	.	H	α-helix	trans	-66.8	-42.8	177.2	-169.1	64.4	-176.4	0	0	111.1	S101 Q102 F108 N109	S101-M105 WeakPolarHBondContact O-CB 3.04Å; S101-M105 PolarHBondContact O-N 2.96Å; Q102-M105 PolarHBondContact O-N 3.01Å; Q102-M105 VanDerWaalsContact O-N 3.15Å; M105-F108 PolarHBondContact O-N 2.92Å; M105-N109 WeakPolarHBondContact O-CB 3.49Å; M105-N109 PolarHBondContact O-N 3.28Å; M105-N109 PolarHBondContact O-ND2 2.96Å
106	T	84.7	Confident	79.6	Confident	6 Å²	6	59.7 Å²	59.7	4%	0.037	32%	0.316	C	S	.	.	H	α-helix	trans	-62.6	-42.4	174.7	-61.9	0	0	0	0	111.4	Q102 L103 N109 L110 Y128 I132	Q102-T106 WeakPolarHBondContact O-CB 3.19Å; Q102-T106 PolarHBondContact O-N 2.62Å; Q102-T106 PolarHBondContact O-OG1 3.34Å; Q102-T106 VanDerWaalsContact O-OG1 3.12Å; L103-T106 PolarHBondContact O-N 2.76Å; T106-N109 PolarHBondContact O-N 2.9Å; T106-L110 HydrophobicContact CG2-CD1 4.05Å; T106-L110 HydrophobicContact CG2-CG 4.49Å; T106-L110 WeakPolarHBondContact O-CB 3.11Å; T106-L110 WeakPolarHBondContact O-CG 3.46Å; T106-L110 PolarHBondContact O-N 2.95Å; T106-Y128 HydrophobicContact CG2-CD1 3.98Å; T106-Y128 HydrophobicContact CG2-CG 4.17Å; T106-I132 HydrophobicContact CG2-CD1 4.15Å; T106-I132 HydrophobicContact CG2-CG1 3.81Å
107	K	85.5	Confident	79.6	Confident	49 Å²	49	62.2 Å²	62.2	21%	0.213	33%	0.334	C	S	.	.	H	α-helix	trans	-57.3	-50	171.5	177.7	179	174.1	170.4	0	111.6	L103 K104 N109 L110 Q111 D167 F170 T171 L174	L103-K107 WeakPolarHBondContact O-CB 3.25Å; L103-K107 PolarHBondContact O-N 3.36Å; K104-K107 WeakPolarHBondContact O-CB 3.38Å; K104-K107 PolarHBondContact O-N 2.92Å; K107-N109 PolarHBondContact O-N 2.92Å; K107-L110 PolarHBondContact O-N 3.36Å; K107-Q111 VanDerWaalsContact O-CG 3.31Å; K107-Q111 WeakPolarHBondContact O-CG 3.26Å; K107-Q111 PolarHBondContact O-N 2.85Å; K107-D167 IonicContact NZ-OD1 3.46Å; K107-F170 HydrophobicContact CD-CD1 4.12Å; K107-F170 HydrophobicContact CD-CE1 4.27Å; K107-F170 VanDerWaalsContact CE-CE1 3.42Å; K107-T171 HydrophobicContact CB-CG2 3.87Å; K107-L174 HydrophobicContact CG-CD2 4.33Å
108	F	83.5	Confident	79.6	Confident	110 Å²	110	63.4 Å²	63.4	48%	0.482	34%	0.337	S	S	.	.	H	α-helix	trans	-60.4	-44.6	177.6	177.9	-94.2	0	0	0	111.8	K104 M105 L110 Q111 N112	K104-F108 WeakPolarHBondContact O-CB 3.3Å; K104-F108 PolarHBondContact O-N 3.48Å; M105-F108 PolarHBondContact O-N 2.92Å; F108-L110 PolarHBondContact O-N 2.67Å; F108-Q111 PolarHBondContact O-N 3.43Å; F108-N112 VanDerWaalsContact CD2-ND2 3.33Å; F108-N112 WeakPolarHBondContact CD2-ND2 3.46Å; F108-N112 WeakPolarHBondContact CE2-ND2 3.32Å; F108-N112 WeakPolarHBondContact CZ-ND2 3.27Å; F108-N112 PolarHBondContact O-N 2.84Å; F108-N112 PolarHBondContact O-ND2 3.38Å
109	N	83.3	Confident	79.5	Confident	47 Å²	47	63.6 Å²	63.6	25%	0.251	34%	0.343	S	S	.	.	H	α-helix	trans	-63.6	-41.5	178.1	-71.4	-19	0	0	0	111.5	M105 T106 K107 N112 T113 Y128	M105-N109 WeakPolarHBondContact O-CB 3.49Å; M105-N109 PolarHBondContact O-N 3.28Å; M105-N109 PolarHBondContact O-ND2 2.96Å; T106-N109 PolarHBondContact O-N 2.9Å; K107-N109 PolarHBondContact O-N 2.92Å; N109-N112 CarbonylContact O-C 3.36Å; N109-N112 PolarHBondContact O-N 3.07Å; N109-T113 WeakPolarHBondContact O-CA 3.16Å; N109-T113 PolarHBondContact O-N 3.29Å; N109-T113 PolarHBondContact O-OG1 3.36Å; N109-Y128 HydrophobicContact CB-CE1 3.91Å
110	L	87.2	Confident	79.7	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-63.5	-41	175.2	-79.1	168.7	0	0	0	112.5	T106 K107 F108 N112 T113 L125 Y128 I132 T171 L174 W175 K178	T106-L110 HydrophobicContact CG2-CD1 4.05Å; T106-L110 HydrophobicContact CG2-CG 4.49Å; T106-L110 WeakPolarHBondContact O-CB 3.11Å; T106-L110 WeakPolarHBondContact O-CG 3.46Å; T106-L110 PolarHBondContact O-N 2.95Å; K107-L110 PolarHBondContact O-N 3.36Å; F108-L110 PolarHBondContact O-N 2.67Å; L110-N112 VanDerWaalsContact C-N 3.28Å; L110-N112 PolarHBondContact O-N 2.84Å; L110-T113 WeakPolarHBondContact CA-OG1 3.09Å; L110-L125 HydrophobicContact CD2-CD2 4.32Å; L110-Y128 HydrophobicContact CD2-CD2 3.47Å; L110-Y128 VanDerWaalsContact CD2-CD2 3.47Å; L110-Y128 HydrophobicContact CD2-CE2 4.11Å; L110-Y128 HydrophobicContact CD2-CG 4.11Å; L110-Y128 HydrophobicContact CG-CD2 3.97Å; L110-Y128 HydrophobicContact CG-CG 4.25Å; L110-I132 HydrophobicContact CD1-CD1 3.91Å; L110-T171 HydrophobicContact CD1-CG2 4.22Å; L110-L174 HydrophobicContact CB-CD2 3.69Å; L110-L174 HydrophobicContact CB-CG 4.11Å; L110-W175 HydrophobicContact CD1-CB 3.85Å; L110-K178 HydrophobicContact CD2-CB 4.45Å
111	Q	86.8	Confident	79.9	Confident	97 Å²	97	68.2 Å²	68.2	45%	0.453	36%	0.363	S	S	.	.	H	α-helix	trans	-63.9	-36.5	176.1	-72	177.1	-38.9	0	0	111.9	K107 F108 L174	K107-Q111 VanDerWaalsContact O-CG 3.31Å; K107-Q111 WeakPolarHBondContact O-CG 3.26Å; K107-Q111 PolarHBondContact O-N 2.85Å; F108-Q111 PolarHBondContact O-N 3.43Å; Q111-L174 HydrophobicContact CG-CD2 3.57Å
112	N	82.6	Confident	80.3	Confident	91 Å²	91	65 Å²	65	49%	0.487	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	16.1	-177	-60.5	-66.2	0	0	0	113.4	F108 N109 L110 V114	F108-N112 VanDerWaalsContact CD2-ND2 3.33Å; F108-N112 WeakPolarHBondContact CD2-ND2 3.46Å; F108-N112 WeakPolarHBondContact CE2-ND2 3.32Å; F108-N112 WeakPolarHBondContact CZ-ND2 3.27Å; F108-N112 PolarHBondContact O-N 2.84Å; F108-N112 PolarHBondContact O-ND2 3.38Å; N109-N112 CarbonylContact O-C 3.36Å; N109-N112 PolarHBondContact O-N 3.07Å; L110-N112 VanDerWaalsContact C-N 3.28Å; L110-N112 PolarHBondContact O-N 2.84Å; N112-V114 PolarHBondContact O-N 3.06Å
113	T	77.6	Confident	80.7	Confident	23 Å²	23	67.6 Å²	67.6	14%	0.141	36%	0.356	C	S	.	.			trans	-65.6	124.1	-178.1	-67.2	0	0	0	0	109.4	N109 L110 L182	N109-T113 WeakPolarHBondContact O-CA 3.16Å; N109-T113 PolarHBondContact O-N 3.29Å; N109-T113 PolarHBondContact O-OG1 3.36Å; L110-T113 WeakPolarHBondContact CA-OG1 3.09Å; T113-L182 HydrophobicContact CG2-CD1 3.75Å
114	V	72.1	Confident	81	Confident	106 Å²	106	70.5 Å²	70.5	64%	0.642	37%	0.369	S	S	*	.			trans	-92	142.7	173.3	-175.9	0	0	0	0	108.7	N112 L116	N112-V114 PolarHBondContact O-N 3.06Å; V114-L116 PolarHBondContact O-N 3.48Å; V114-L116 VanDerWaalsContact O-N 3.12Å
115	V	68.1	Low	81.2	Confident	112 Å²	112	64.8 Å²	64.8	68%	0.679	35%	0.345	S	S	*	.			trans	-60.3	114.6	175	-176.8	0	0	0	0	109.3	L182	V115-L182 HydrophobicContact CG2-CD2 3.81Å
116	L	68.7	Low	81.7	Confident	66 Å²	66	61.8 Å²	61.8	35%	0.346	33%	0.329	S	S	.	.			trans	-99.2	-177	172.3	-60.9	-178.5	0	0	0	110.6	V114 Q120 T121 Q124	V114-L116 PolarHBondContact O-N 3.48Å; V114-L116 VanDerWaalsContact O-N 3.12Å; L116-Q120 HydrophobicContact CB-CB 3.96Å; L116-Q120 HydrophobicContact CD1-CB 4.03Å; L116-T121 PolarHBondContact N-OG1 2.86Å; L116-T121 PolarHBondContact O-OG1 2.86Å; L116-Q124 VanDerWaalsContact CD1-CD 3.48Å; L116-Q124 VanDerWaalsContact CD1-NE2 3.33Å; L116-Q124 VanDerWaalsContact CD1-OE1 3.27Å
117	S	73.4	Confident	81.9	Confident	66 Å²	66	67.4 Å²	67.4	46%	0.462	35%	0.35	S	S	.	.			trans	-55.6	144.4	165.7	67.3	0	0	0	0	110.7	N119 Q120 T121	S117-N119 VanDerWaalsContact C-N 3.3Å; S117-N119 PolarHBondContact O-N 3.1Å; S117-N119 VanDerWaalsContact O-N 3.14Å; S117-Q120 WeakPolarHBondContact O-CB 3.35Å; S117-Q120 PolarHBondContact O-N 2.88Å; S117-Q120 VanDerWaalsContact OG-CG 3.28Å; S117-Q120 WeakPolarHBondContact OG-CG 3.48Å; S117-Q120 PolarHBondContact OG-OE1 3.49Å; S117-T121 PolarHBondContact O-N 3.48Å; S117-T121 PolarHBondContact O-OG1 3.49Å
118	T	73.2	Confident	82.1	Confident	75 Å²	75	66 Å²	66	46%	0.46	34%	0.344	S	S	.	.	H	α-helix	trans	-50.9	-46	-170.7	-44.1	0	0	0	0	113	Q120 T121 V122 N186	T118-Q120 PolarHBondContact O-N 3.16Å; T118-T121 PolarHBondContact O-N 2.7Å; T118-V122 VanDerWaalsContact O-CG2 3.32Å; T118-V122 WeakPolarHBondContact O-CG2 3.41Å; T118-V122 PolarHBondContact O-N 3.46Å; T118-N186 HydrophobicContact CG2-CB 4.37Å
119	N	77.7	Confident	82.4	Confident	122 Å²	122	60.8 Å²	60.8	65%	0.652	32%	0.321	S	S	*	.	H	α-helix	trans	-64.4	-37.5	179.2	-72.3	-14.3	0	0	0	113.1	S117 N123	S117-N119 VanDerWaalsContact C-N 3.3Å; S117-N119 PolarHBondContact O-N 3.1Å; S117-N119 VanDerWaalsContact O-N 3.14Å; N119-N123 WeakPolarHBondContact O-CB 3.3Å; N119-N123 VanDerWaalsContact O-CG 3.32Å; N119-N123 PolarHBondContact O-N 2.97Å; N119-N123 VanDerWaalsContact O-N 3.13Å; N119-N123 PolarHBondContact O-ND2 3.36Å
120	Q	82.5	Confident	82.7	Confident	108 Å²	108	63.4 Å²	63.4	51%	0.505	33%	0.331	S	S	.	.	H	α-helix	trans	-69.4	-41.7	176.5	-71.4	172.1	-27.8	0	0	111	L116 S117 T118 N123 Q124	L116-Q120 HydrophobicContact CB-CB 3.96Å; L116-Q120 HydrophobicContact CD1-CB 4.03Å; S117-Q120 WeakPolarHBondContact O-CB 3.35Å; S117-Q120 PolarHBondContact O-N 2.88Å; S117-Q120 VanDerWaalsContact OG-CG 3.28Å; S117-Q120 WeakPolarHBondContact OG-CG 3.48Å; S117-Q120 PolarHBondContact OG-OE1 3.49Å; T118-Q120 PolarHBondContact O-N 3.16Å; Q120-N123 PolarHBondContact O-N 2.84Å; Q120-Q124 WeakPolarHBondContact O-CB 3.21Å; Q120-Q124 WeakPolarHBondContact O-CG 3.46Å; Q120-Q124 PolarHBondContact O-N 2.98Å
121	T	84.7	Confident	82.6	Confident	5 Å²	5	65 Å²	65	3%	0.031	34%	0.339	C	S	.	.	H	α-helix	trans	-59.7	-46.5	176.2	-57.5	0	0	0	0	111.3	L116 S117 T118 N123 Q124 L125 L182 L183	L116-T121 PolarHBondContact N-OG1 2.86Å; L116-T121 PolarHBondContact O-OG1 2.86Å; S117-T121 PolarHBondContact O-N 3.48Å; S117-T121 PolarHBondContact O-OG1 3.49Å; T118-T121 PolarHBondContact O-N 2.7Å; T121-N123 PolarHBondContact O-N 3.05Å; T121-Q124 PolarHBondContact O-N 3.41Å; T121-L125 HydrophobicContact CG2-CD1 4.02Å; T121-L125 HydrophobicContact CG2-CG 4.5Å; T121-L125 WeakPolarHBondContact O-CB 3.45Å; T121-L125 VanDerWaalsContact O-CG 3.31Å; T121-L125 WeakPolarHBondContact O-CG 3.25Å; T121-L125 PolarHBondContact O-N 2.88Å; T121-L182 HydrophobicContact CG2-CB 3.91Å; T121-L182 HydrophobicContact CG2-CD1 4.13Å; T121-L183 HydrophobicContact CG2-CD2 4.25Å
122	V	86.5	Confident	82.6	Confident	4 Å²	4	60.4 Å²	60.4	2%	0.024	32%	0.317	C	S	.	.	H	α-helix	trans	-60.8	-47.9	176.9	173.6	0	0	0	0	111.5	T118 Q124 L125 K126 L183 S189	T118-V122 VanDerWaalsContact O-CG2 3.32Å; T118-V122 WeakPolarHBondContact O-CG2 3.41Å; T118-V122 PolarHBondContact O-N 3.46Å; V122-Q124 VanDerWaalsContact C-N 3.32Å; V122-Q124 PolarHBondContact O-N 2.82Å; V122-L125 PolarHBondContact O-N 3.44Å; V122-K126 HydrophobicContact CG1-CD 4.13Å; V122-K126 HydrophobicContact CG1-CG 4.46Å; V122-K126 WeakPolarHBondContact O-CB 3.2Å; V122-K126 VanDerWaalsContact O-CG 3.32Å; V122-K126 WeakPolarHBondContact O-CG 3.3Å; V122-K126 PolarHBondContact O-N 2.68Å; V122-L183 HydrophobicContact CG2-CD2 3.69Å; V122-S189 VanDerWaalsContact CG2-CB 3.4Å; V122-S189 WeakPolarHBondContact CG2-OG 3.42Å
123	N	88.5	Confident	82.8	Confident	102 Å²	102	56.5 Å²	56.5	55%	0.545	30%	0.297	S	S	.	.	H	α-helix	trans	-64	-37.6	179.6	-72.4	-23.9	0	0	0	112.2	N119 Q120 T121 Y127	N119-N123 WeakPolarHBondContact O-CB 3.3Å; N119-N123 VanDerWaalsContact O-CG 3.32Å; N119-N123 PolarHBondContact O-N 2.97Å; N119-N123 VanDerWaalsContact O-N 3.13Å; N119-N123 PolarHBondContact O-ND2 3.36Å; Q120-N123 PolarHBondContact O-N 2.84Å; T121-N123 PolarHBondContact O-N 3.05Å; N123-Y127 WeakPolarHBondContact O-CB 3.29Å; N123-Y127 PolarHBondContact O-N 3.21Å
124	Q	87.7	Confident	83.1	Confident	65 Å²	65	57.5 Å²	57.5	30%	0.304	30%	0.304	S	S	.	.	H	α-helix	trans	-65.1	-45.3	173.5	-81.6	-174.6	-17.5	0	0	112.4	L116 Q120 T121 V122 K126 Y127 Y128	L116-Q124 VanDerWaalsContact CD1-CD 3.48Å; L116-Q124 VanDerWaalsContact CD1-NE2 3.33Å; L116-Q124 VanDerWaalsContact CD1-OE1 3.27Å; Q120-Q124 WeakPolarHBondContact O-CB 3.21Å; Q120-Q124 WeakPolarHBondContact O-CG 3.46Å; Q120-Q124 PolarHBondContact O-N 2.98Å; T121-Q124 PolarHBondContact O-N 3.41Å; V122-Q124 VanDerWaalsContact C-N 3.32Å; V122-Q124 PolarHBondContact O-N 2.82Å; Q124-K126 VanDerWaalsContact C-N 3.33Å; Q124-K126 PolarHBondContact O-N 2.78Å; Q124-Y127 WeakPolarHBondContact O-CB 3.28Å; Q124-Y127 PolarHBondContact O-N 2.86Å; Q124-Y128 HydrophobicContact CB-CE2 4.14Å; Q124-Y128 VanDerWaalsContact O-CD2 3.27Å; Q124-Y128 WeakPolarHBondContact O-CD2 3.47Å; Q124-Y128 VanDerWaalsContact O-CG 3.24Å; Q124-Y128 PolarHBondContact O-N 3.19Å
125	L	90.1	Very high	83.5	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-63.3	-40.8	178	-71	171.2	0	0	0	111.4	L110 T121 V122 Y128 L129 W175 T179 L182 L183	L110-L125 HydrophobicContact CD2-CD2 4.32Å; T121-L125 HydrophobicContact CG2-CD1 4.02Å; T121-L125 HydrophobicContact CG2-CG 4.5Å; T121-L125 WeakPolarHBondContact O-CB 3.45Å; T121-L125 VanDerWaalsContact O-CG 3.31Å; T121-L125 WeakPolarHBondContact O-CG 3.25Å; T121-L125 PolarHBondContact O-N 2.88Å; V122-L125 PolarHBondContact O-N 3.44Å; L125-Y128 PolarHBondContact O-N 3.41Å; L125-L129 WeakPolarHBondContact O-CB 3.46Å; L125-L129 PolarHBondContact O-N 3.35Å; L125-W175 PolarHBondContact O-NE1 3.14Å; L125-T179 HydrophobicContact CD1-CG2 4.25Å; L125-L182 HydrophobicContact CD1-CB 4.4Å; L125-L182 HydrophobicContact CD2-CD1 4.37Å; L125-L183 HydrophobicContact CD1-CD1 3.86Å; L125-L183 HydrophobicContact CD1-CD2 3.99Å; L125-L183 HydrophobicContact CD1-CG 3.78Å
126	K	90.8	Very high	84.1	Confident	42 Å²	42	47.2 Å²	47.2	18%	0.183	24%	0.242	C	C	.	.	H	α-helix	trans	-59.6	-45.8	172.3	-73.5	178.5	-178.3	171.1	0	111.9	V122 Q124 L129 Q130 Q192 L196	V122-K126 HydrophobicContact CG1-CD 4.13Å; V122-K126 HydrophobicContact CG1-CG 4.46Å; V122-K126 WeakPolarHBondContact O-CB 3.2Å; V122-K126 VanDerWaalsContact O-CG 3.32Å; V122-K126 WeakPolarHBondContact O-CG 3.3Å; V122-K126 PolarHBondContact O-N 2.68Å; Q124-K126 VanDerWaalsContact C-N 3.33Å; Q124-K126 PolarHBondContact O-N 2.78Å; K126-L129 PolarHBondContact O-N 2.91Å; K126-Q130 WeakPolarHBondContact O-CG 3.24Å; K126-Q130 PolarHBondContact O-N 2.92Å; K126-Q192 WeakPolarHBondContact CE-O 3.38Å; K126-L196 HydrophobicContact CB-CD1 3.65Å; K126-L196 HydrophobicContact CD-CD1 4.3Å; K126-L196 HydrophobicContact CG-CD1 3.65Å
127	Y	89	Confident	84.7	Confident	123 Å²	123	46.2 Å²	46.2	48%	0.482	23%	0.234	S	C	.	.	H	α-helix	trans	-61.4	-48.5	176.8	175.8	-96	0	0	0	111.7	N123 Q124 L129 Q130 E131	N123-Y127 WeakPolarHBondContact O-CB 3.29Å; N123-Y127 PolarHBondContact O-N 3.21Å; Q124-Y127 WeakPolarHBondContact O-CB 3.28Å; Q124-Y127 PolarHBondContact O-N 2.86Å; Y127-L129 VanDerWaalsContact C-N 3.3Å; Y127-L129 PolarHBondContact O-N 3.16Å; Y127-Q130 PolarHBondContact O-N 3.25Å; Y127-Q130 VanDerWaalsContact O-N 3.17Å; Y127-E131 HydrophobicContact CD1-CG 4.2Å; Y127-E131 HydrophobicContact CE1-CG 3.69Å; Y127-E131 HydrophobicContact CE2-CG 4.11Å; Y127-E131 WeakPolarHBondContact O-CG 3.47Å; Y127-E131 PolarHBondContact O-N 3.26Å
128	Y	89.9	Confident	84.8	Confident	20 Å²	20	44.6 Å²	44.6	8%	0.078	22%	0.221	C	C	.	.	H	α-helix	trans	-60.2	-40.2	177.3	-63.9	-32.4	0	0	0	112.2	T106 N109 L110 Q124 L125 E131 I132	T106-Y128 HydrophobicContact CG2-CD1 3.98Å; T106-Y128 HydrophobicContact CG2-CG 4.17Å; N109-Y128 HydrophobicContact CB-CE1 3.91Å; L110-Y128 HydrophobicContact CD2-CD2 3.47Å; L110-Y128 VanDerWaalsContact CD2-CD2 3.47Å; L110-Y128 HydrophobicContact CD2-CE2 4.11Å; L110-Y128 HydrophobicContact CD2-CG 4.11Å; L110-Y128 HydrophobicContact CG-CD2 3.97Å; L110-Y128 HydrophobicContact CG-CG 4.25Å; Q124-Y128 HydrophobicContact CB-CE2 4.14Å; Q124-Y128 VanDerWaalsContact O-CD2 3.27Å; Q124-Y128 WeakPolarHBondContact O-CD2 3.47Å; Q124-Y128 VanDerWaalsContact O-CG 3.24Å; Q124-Y128 PolarHBondContact O-N 3.19Å; L125-Y128 PolarHBondContact O-N 3.41Å; Y128-E131 PolarHBondContact O-N 2.88Å; Y128-I132 WeakPolarHBondContact O-CD1 3.44Å; Y128-I132 WeakPolarHBondContact O-CG1 3.09Å; Y128-I132 PolarHBondContact O-N 3.47Å
129	L	91	Very high	84.8	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.5	-50.8	174.5	-179.4	60.1	0	0	0	110.8	L125 K126 Y127 E131 I132 L133 F172 W175 L196 L197	L125-L129 WeakPolarHBondContact O-CB 3.46Å; L125-L129 PolarHBondContact O-N 3.35Å; K126-L129 PolarHBondContact O-N 2.91Å; Y127-L129 VanDerWaalsContact C-N 3.3Å; Y127-L129 PolarHBondContact O-N 3.16Å; L129-E131 VanDerWaalsContact C-N 3.28Å; L129-E131 PolarHBondContact O-N 3.46Å; L129-I132 PolarHBondContact O-N 2.71Å; L129-I132 VanDerWaalsContact O-N 3.16Å; L129-L133 HydrophobicContact CD1-CD1 3.83Å; L129-L133 HydrophobicContact CD1-CD2 4.19Å; L129-L133 HydrophobicContact CD1-CG 3.83Å; L129-L133 HydrophobicContact CD2-CD1 4.38Å; L129-L133 HydrophobicContact CG-CD1 3.79Å; L129-L133 HydrophobicContact CG-CG 4.16Å; L129-L133 WeakPolarHBondContact O-CB 3.4Å; L129-L133 WeakPolarHBondContact O-CG 3.4Å; L129-L133 PolarHBondContact O-N 3.38Å; L129-F172 HydrophobicContact CD1-CD2 4.28Å; L129-F172 HydrophobicContact CD1-CE2 3.84Å; L129-W175 HydrophobicContact CB-CD2 4.32Å; L129-W175 HydrophobicContact CB-CH2 4.46Å; L129-W175 HydrophobicContact CB-CZ2 3.69Å; L129-W175 HydrophobicContact CD1-CD2 4.01Å; L129-W175 HydrophobicContact CD1-CE3 3.97Å; L129-W175 HydrophobicContact CD1-CH2 4.12Å; L129-W175 HydrophobicContact CD1-CZ2 4.11Å; L129-W175 HydrophobicContact CD1-CZ3 4.05Å; L129-W175 HydrophobicContact CD2-CH2 3.7Å; L129-W175 HydrophobicContact CD2-CZ2 3.66Å; L129-W175 HydrophobicContact CD2-CZ3 4.38Å; L129-W175 HydrophobicContact CG-CH2 4.3Å; L129-W175 HydrophobicContact CG-CZ2 4.01Å; L129-L196 HydrophobicContact CD2-CB 3.62Å; L129-L196 HydrophobicContact CD2-CD1 4.24Å; L129-L197 HydrophobicContact CD1-CD2 3.8Å; L129-L197 HydrophobicContact CD1-CG 4.17Å; L129-L197 HydrophobicContact CD2-CD2 4.24Å; L129-L197 HydrophobicContact CD2-CG 3.84Å
130	Q	88.5	Confident	84.6	Confident	102 Å²	102	36 Å²	36	48%	0.477	17%	0.171	S	C	.	.	H	α-helix	trans	-56.4	-43.5	178.7	-74.4	175.9	-22.5	0	0	111.7	K126 Y127 L133 S134 L196	K126-Q130 WeakPolarHBondContact O-CG 3.24Å; K126-Q130 PolarHBondContact O-N 2.92Å; Y127-Q130 PolarHBondContact O-N 3.25Å; Y127-Q130 VanDerWaalsContact O-N 3.17Å; Q130-L133 PolarHBondContact O-N 3.44Å; Q130-S134 WeakPolarHBondContact O-CB 3.49Å; Q130-S134 PolarHBondContact O-N 2.61Å; Q130-S134 PolarHBondContact O-OG 2.96Å; Q130-L196 HydrophobicContact CG-CD1 4.29Å
131	E	85.9	Confident	84	Confident	33 Å²	33	31.4 Å²	31.4	15%	0.154	15%	0.15	C	C	.	.	H	α-helix	trans	-64.9	-41.3	176.6	-72.2	-63.9	116.6	0	0	112.8	Q102 Y127 Y128 L129 S134 S135	Q102-E131 PolarHBondContact NE2-OE2 3.29Å; Y127-E131 HydrophobicContact CD1-CG 4.2Å; Y127-E131 HydrophobicContact CE1-CG 3.69Å; Y127-E131 HydrophobicContact CE2-CG 4.11Å; Y127-E131 WeakPolarHBondContact O-CG 3.47Å; Y127-E131 PolarHBondContact O-N 3.26Å; Y128-E131 PolarHBondContact O-N 2.88Å; L129-E131 VanDerWaalsContact C-N 3.28Å; L129-E131 PolarHBondContact O-N 3.46Å; E131-S134 WeakPolarHBondContact CA-OG 3.46Å; E131-S134 PolarHBondContact O-OG 2.82Å; E131-S135 WeakPolarHBondContact O-CB 3.21Å; E131-S135 PolarHBondContact O-N 2.96Å; E131-S135 PolarHBondContact O-OG 2.94Å
132	I	86.9	Confident	83.2	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-61.5	-50.4	175.6	-70	161.8	0	0	0	109.7	L103 T106 L110 Y128 L129 S136 T171 F172 W175	L103-I132 HydrophobicContact CD1-CB 4.5Å; L103-I132 HydrophobicContact CD1-CG1 4.23Å; L103-I132 HydrophobicContact CD1-CG2 4.38Å; T106-I132 HydrophobicContact CG2-CD1 4.15Å; T106-I132 HydrophobicContact CG2-CG1 3.81Å; L110-I132 HydrophobicContact CD1-CD1 3.91Å; Y128-I132 WeakPolarHBondContact O-CD1 3.44Å; Y128-I132 WeakPolarHBondContact O-CG1 3.09Å; Y128-I132 PolarHBondContact O-N 3.47Å; L129-I132 PolarHBondContact O-N 2.71Å; L129-I132 VanDerWaalsContact O-N 3.16Å; I132-S136 WeakPolarHBondContact O-CB 3.26Å; I132-S136 PolarHBondContact O-N 2.93Å; I132-S136 PolarHBondContact O-OG 3.48Å; I132-T171 HydrophobicContact CD1-CG2 3.83Å; I132-T171 HydrophobicContact CG1-CG2 3.79Å; I132-F172 HydrophobicContact CG2-CB 4.27Å; I132-F172 HydrophobicContact CG2-CD2 4.42Å; I132-W175 HydrophobicContact CD1-CB 3.6Å; I132-W175 HydrophobicContact CD1-CG 3.98Å
133	L	86.2	Confident	82.2	Confident	9 Å²	9	34.2 Å²	34.2	5%	0.047	16%	0.162	C	C	.	.	H	α-helix	trans	-65.5	-45.6	-176.2	-66.2	-177.4	0	0	0	111.5	L129 Q130 Y137 L197 F200 L222	L129-L133 HydrophobicContact CD1-CD1 3.83Å; L129-L133 HydrophobicContact CD1-CD2 4.19Å; L129-L133 HydrophobicContact CD1-CG 3.83Å; L129-L133 HydrophobicContact CD2-CD1 4.38Å; L129-L133 HydrophobicContact CG-CD1 3.79Å; L129-L133 HydrophobicContact CG-CG 4.16Å; L129-L133 WeakPolarHBondContact O-CB 3.4Å; L129-L133 WeakPolarHBondContact O-CG 3.4Å; L129-L133 PolarHBondContact O-N 3.38Å; Q130-L133 PolarHBondContact O-N 3.44Å; L133-Y137 VanDerWaalsContact O-CB 3.27Å; L133-Y137 WeakPolarHBondContact O-CB 3.3Å; L133-Y137 PolarHBondContact O-N 2.97Å; L133-L197 HydrophobicContact CD1-CD2 4.18Å; L133-L197 HydrophobicContact CD2-CD2 4.28Å; L133-F200 HydrophobicContact CB-CD2 4.32Å; L133-F200 HydrophobicContact CB-CE1 4.15Å; L133-F200 HydrophobicContact CB-CE2 3.75Å; L133-F200 HydrophobicContact CB-CZ 3.57Å; L133-F200 HydrophobicContact CD1-CB 4.03Å; L133-F200 HydrophobicContact CD1-CD1 3.89Å; L133-F200 HydrophobicContact CD1-CD2 3.9Å; L133-F200 HydrophobicContact CD1-CE1 4.14Å; L133-F200 HydrophobicContact CD1-CE2 4.16Å; L133-F200 HydrophobicContact CD1-CG 3.7Å; L133-F200 HydrophobicContact CD1-CZ 4.19Å; L133-F200 HydrophobicContact CD2-CD1 3.9Å; L133-F200 HydrophobicContact CD2-CE1 3.52Å; L133-F200 HydrophobicContact CD2-CZ 3.87Å; L133-F200 HydrophobicContact CG-CD1 4.34Å; L133-F200 HydrophobicContact CG-CE1 4.11Å; L133-F200 HydrophobicContact CG-CE2 4.37Å; L133-F200 HydrophobicContact CG-CZ 4.04Å; L133-L222 HydrophobicContact CD2-CD1 3.99Å
134	S	83.5	Confident	81.2	Confident	44 Å²	44	30.9 Å²	30.9	31%	0.308	14%	0.143	S	C	.	.	H	α-helix	trans	-66.1	-47.2	178.7	68.3	0	0	0	0	111.7	Q130 E131 S136 Y137 N138	Q130-S134 WeakPolarHBondContact O-CB 3.49Å; Q130-S134 PolarHBondContact O-N 2.61Å; Q130-S134 PolarHBondContact O-OG 2.96Å; E131-S134 WeakPolarHBondContact CA-OG 3.46Å; E131-S134 PolarHBondContact O-OG 2.82Å; S134-S136 PolarHBondContact O-N 3.44Å; S134-Y137 PolarHBondContact O-N 3.38Å; S134-N138 WeakPolarHBondContact O-CB 3.4Å; S134-N138 PolarHBondContact O-N 3.33Å; S134-N138 PolarHBondContact O-ND2 3.3Å
135	S	80.3	Confident	80.2	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-63.8	-42.9	179.2	-60.5	0	0	0	0	111.2	E131 N138 I139	E131-S135 WeakPolarHBondContact O-CB 3.21Å; E131-S135 PolarHBondContact O-N 2.96Å; E131-S135 PolarHBondContact O-OG 2.94Å; S135-N138 PolarHBondContact O-N 3.38Å; S135-I139 WeakPolarHBondContact O-CB 3.07Å; S135-I139 WeakPolarHBondContact O-CD1 3.31Å; S135-I139 WeakPolarHBondContact O-CG1 3.2Å; S135-I139 PolarHBondContact O-N 3.42Å
136	S	82.1	Confident	78.9	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.014	17%	0.171	C	C	.	.	H	α-helix	trans	-64.9	-43.9	178.5	-56.8	0	0	0	0	111.3	I132 S134 I139 L140 A168	I132-S136 WeakPolarHBondContact O-CB 3.26Å; I132-S136 PolarHBondContact O-N 2.93Å; I132-S136 PolarHBondContact O-OG 3.48Å; S134-S136 PolarHBondContact O-N 3.44Å; S136-I139 PolarHBondContact O-N 3Å; S136-L140 WeakPolarHBondContact O-CB 3.39Å; S136-L140 VanDerWaalsContact O-CG 3.3Å; S136-L140 WeakPolarHBondContact O-CG 3.37Å; S136-L140 PolarHBondContact O-N 3.42Å; S136-A168 VanDerWaalsContact OG-CB 3.28Å; S136-A168 WeakPolarHBondContact OG-CB 3.42Å
137	Y	79.4	Confident	77.7	Confident	46 Å²	46	36.8 Å²	36.8	18%	0.18	17%	0.171	C	C	.	.	H	α-helix	trans	-59.4	-49.5	173.7	179.4	-104	0	0	0	111.3	L133 S134 I139 F141 H142 V206 W215	L133-Y137 VanDerWaalsContact O-CB 3.27Å; L133-Y137 WeakPolarHBondContact O-CB 3.3Å; L133-Y137 PolarHBondContact O-N 2.97Å; S134-Y137 PolarHBondContact O-N 3.38Å; Y137-I139 VanDerWaalsContact C-N 3.33Å; Y137-I139 PolarHBondContact O-N 3.24Å; Y137-F141 HydrophobicContact CD2-CB 3.94Å; Y137-F141 HydrophobicContact CD2-CG 4.35Å; Y137-F141 HydrophobicContact CE1-CD1 4.27Å; Y137-F141 HydrophobicContact CE2-CB 3.84Å; Y137-F141 AromaticContact CE2-CD1 3.8Å; Y137-F141 HydrophobicContact CE2-CD1 3.8Å; Y137-F141 HydrophobicContact CE2-CD2 4.31Å; Y137-F141 HydrophobicContact CE2-CE1 4.41Å; Y137-F141 AromaticContact CE2-CG 3.74Å; Y137-F141 HydrophobicContact CE2-CG 3.74Å; Y137-F141 HydrophobicContact CG-CB 4.48Å; Y137-F141 AromaticContact CZ-CD1 3.57Å; Y137-F141 WeakPolarHBondContact O-CA 3.42Å; Y137-F141 WeakPolarHBondContact O-CB 3.32Å; Y137-F141 PolarHBondContact O-N 3.4Å; Y137-F141 WeakPolarHBondContact OH-CD1 3.33Å; Y137-F141 WeakPolarHBondContact OH-CE1 3.43Å; Y137-H142 AromaticContact CD1-CD2 3.93Å; Y137-H142 AromaticContact CD1-NE2 3.99Å; Y137-H142 AromaticContact CE1-CD2 3.57Å; Y137-H142 AromaticContact CE1-NE2 3.19Å; Y137-H142 WeakPolarHBondContact CE1-NE2 3.19Å; Y137-H142 AromaticContact CZ-NE2 3.84Å; Y137-H142 PolarHBondContact O-N 2.82Å; Y137-V206 HydrophobicContact CE2-CG1 4.39Å; Y137-W215 AromaticContact CD2-CD2 3.58Å; Y137-W215 HydrophobicContact CD2-CD2 3.58Å; Y137-W215 AromaticContact CD2-CE2 3.64Å; Y137-W215 AromaticContact CD2-CE3 3.71Å; Y137-W215 HydrophobicContact CD2-CE3 3.71Å; Y137-W215 HydrophobicContact CD2-CG 4.21Å; Y137-W215 HydrophobicContact CD2-CH2 4.12Å; Y137-W215 AromaticContact CD2-CZ2 3.94Å; Y137-W215 HydrophobicContact CD2-CZ2 3.94Å; Y137-W215 AromaticContact CD2-CZ3 3.98Å; Y137-W215 HydrophobicContact CD2-CZ3 3.98Å; Y137-W215 HydrophobicContact CE2-CD2 4.09Å; Y137-W215 HydrophobicContact CE2-CG 4.25Å; Y137-W215 HydrophobicContact CG-CZ3 4.45Å
138	N	75.9	Confident	76.4	Confident	32 Å²	32	32.7 Å²	32.7	17%	0.171	16%	0.16	C	C	.	.	I	π-helix	trans	-60.4	-39.1	-179.6	-72.6	-25.3	0	0	0	113.3	Y95 N99 S134 S135 H142 A143	Y95-N138 HydrophobicContact CE1-CB 3.95Å; Y95-N138 PolarHBondContact OH-ND2 3.28Å; Y95-N138 PolarHBondContact OH-OD1 2.95Å; Y95-N138 VanDerWaalsContact OH-OD1 3.07Å; N99-N138 HydrophobicContact CB-CB 4.45Å; N99-N138 VanDerWaalsContact OD1-CB 3.25Å; N99-N138 WeakPolarHBondContact OD1-CB 3.31Å; N99-N138 PolarHBondContact OD1-ND2 3.35Å; S134-N138 WeakPolarHBondContact O-CB 3.4Å; S134-N138 PolarHBondContact O-N 3.33Å; S134-N138 PolarHBondContact O-ND2 3.3Å; S135-N138 PolarHBondContact O-N 3.38Å; N138-H142 WeakPolarHBondContact O-CB 3.28Å; N138-H142 PolarHBondContact O-N 3.11Å; N138-A143 PolarHBondContact O-N 3.12Å
139	I	73.9	Confident	74.9	Confident	3 Å²	3	36 Å²	36	2%	0.015	19%	0.192	C	C	.	.	I	π-helix	trans	-76.5	-53.9	178.7	-64.6	163.3	0	0	0	111	T96 N99 S135 S136 Y137 A143 F144 F161 M164	T96-I139 HydrophobicContact CG2-CG1 4.47Å; T96-I139 HydrophobicContact CG2-CG2 4.26Å; N99-I139 HydrophobicContact CB-CD1 3.8Å; N99-I139 HydrophobicContact CB-CG1 3.57Å; S135-I139 WeakPolarHBondContact O-CB 3.07Å; S135-I139 WeakPolarHBondContact O-CD1 3.31Å; S135-I139 WeakPolarHBondContact O-CG1 3.2Å; S135-I139 PolarHBondContact O-N 3.42Å; S136-I139 PolarHBondContact O-N 3Å; Y137-I139 VanDerWaalsContact C-N 3.33Å; Y137-I139 PolarHBondContact O-N 3.24Å; I139-A143 WeakPolarHBondContact O-CB 3.34Å; I139-A143 PolarHBondContact O-N 3.17Å; I139-F144 PolarHBondContact O-N 3.46Å; I139-F161 HydrophobicContact CG2-CD1 4.49Å; I139-M164 HydrophobicContact CG2-CB 3.88Å; I139-M164 HydrophobicContact CG2-CG 4.17Å; I139-M164 HydrophobicContact CG2-SD 3.42Å; I139-M164 WeakPolarHBondContact CG2-SD 3.19Å
140	L	73.4	Confident	73.2	Confident	12 Å²	12	44.5 Å²	44.5	6%	0.063	23%	0.231	C	C	.	.	I	π-helix	trans	-79.2	-30.4	-168.7	-61.4	175.3	0	0	0	112.8	S136 F144 K165 T218	S136-L140 WeakPolarHBondContact O-CB 3.39Å; S136-L140 VanDerWaalsContact O-CG 3.3Å; S136-L140 WeakPolarHBondContact O-CG 3.37Å; S136-L140 PolarHBondContact O-N 3.42Å; L140-F144 VanDerWaalsContact O-CB 3.24Å; L140-F144 WeakPolarHBondContact O-CB 3.4Å; L140-K165 HydrophobicContact CD1-CB 4.41Å; L140-K165 HydrophobicContact CD1-CG 4.3Å; L140-K165 HydrophobicContact CD2-CB 3.76Å; L140-K165 HydrophobicContact CD2-CG 4.41Å; L140-T218 HydrophobicContact CD1-CG2 3.68Å; L140-T218 WeakPolarHBondContact CD1-OG1 3.07Å
141	F	69.1	Low	71.6	Confident	12 Å²	12	42.8 Å²	42.8	5%	0.053	24%	0.241	C	C	.	.	I	π-helix	trans	-94.5	-65.3	177.4	-174.8	-98.2	0	0	0	110.9	Y137 K145 D211 W215	Y137-F141 HydrophobicContact CD2-CB 3.94Å; Y137-F141 HydrophobicContact CD2-CG 4.35Å; Y137-F141 HydrophobicContact CE1-CD1 4.27Å; Y137-F141 HydrophobicContact CE2-CB 3.84Å; Y137-F141 AromaticContact CE2-CD1 3.8Å; Y137-F141 HydrophobicContact CE2-CD1 3.8Å; Y137-F141 HydrophobicContact CE2-CD2 4.31Å; Y137-F141 HydrophobicContact CE2-CE1 4.41Å; Y137-F141 AromaticContact CE2-CG 3.74Å; Y137-F141 HydrophobicContact CE2-CG 3.74Å; Y137-F141 HydrophobicContact CG-CB 4.48Å; Y137-F141 AromaticContact CZ-CD1 3.57Å; Y137-F141 WeakPolarHBondContact O-CA 3.42Å; Y137-F141 WeakPolarHBondContact O-CB 3.32Å; Y137-F141 PolarHBondContact O-N 3.4Å; Y137-F141 WeakPolarHBondContact OH-CD1 3.33Å; Y137-F141 WeakPolarHBondContact OH-CE1 3.43Å; F141-K145 WeakPolarHBondContact O-CB 3.41Å; F141-K145 PolarHBondContact O-N 3.42Å; F141-K145 VanDerWaalsContact O-N 3.09Å; F141-D211 HydrophobicContact CE2-CB 4.28Å; F141-D211 WeakPolarHBondContact CE2-O 3.22Å; F141-D211 HydrophobicContact CZ-CB 4.33Å; F141-W215 HydrophobicContact CD2-CB 3.97Å
142	H	67.7	Low	70.3	Confident	68 Å²	68	47.9 Å²	47.9	32%	0.315	27%	0.269	S	S	.	.	I	π-helix	trans	-67.5	-51.8	-172.3	-72.1	-68.4	0	0	0	112.4	Y137 N138 E146	Y137-H142 AromaticContact CD1-CD2 3.93Å; Y137-H142 AromaticContact CD1-NE2 3.99Å; Y137-H142 AromaticContact CE1-CD2 3.57Å; Y137-H142 AromaticContact CE1-NE2 3.19Å; Y137-H142 WeakPolarHBondContact CE1-NE2 3.19Å; Y137-H142 AromaticContact CZ-NE2 3.84Å; Y137-H142 PolarHBondContact O-N 2.82Å; N138-H142 WeakPolarHBondContact O-CB 3.28Å; N138-H142 PolarHBondContact O-N 3.11Å; H142-E146 WeakPolarHBondContact O-CG 3.29Å; H142-E146 PolarHBondContact O-N 2.86Å; H142-E146 VanDerWaalsContact O-N 3.09Å
143	A	65.9	Low	69.1	Low	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.28	C	S	.	.	I	π-helix	trans	-73.6	-37.5	-174.8	0	0	0	0	0	114.3	L92 T96 N138 I139 N147 F161	L92-A143 HydrophobicContact CD1-CB 3.76Å; L92-A143 HydrophobicContact CG-CB 4.32Å; T96-A143 HydrophobicContact CG2-CB 4.3Å; T96-A143 WeakPolarHBondContact OG1-CB 3.35Å; N138-A143 PolarHBondContact O-N 3.12Å; I139-A143 WeakPolarHBondContact O-CB 3.34Å; I139-A143 PolarHBondContact O-N 3.17Å; A143-N147 PolarHBondContact O-N 3.4Å; A143-N147 PolarHBondContact O-ND2 2.91Å; A143-F161 HydrophobicContact CB-CE1 4.21Å
144	F	68.7	Low	68.2	Low	33 Å²	33	52.7 Å²	52.7	15%	0.145	30%	0.3	C	S	.	.	H	α-helix	trans	-63.3	-48.3	173.1	-173.4	-90.9	0	0	0	111.3	I139 L140 E146 N147 C148 V153 L158 F161 L214	I139-F144 PolarHBondContact O-N 3.46Å; L140-F144 VanDerWaalsContact O-CB 3.24Å; L140-F144 WeakPolarHBondContact O-CB 3.4Å; F144-E146 PolarHBondContact O-N 2.96Å; F144-N147 CarbonylContact O-C 3.53Å; F144-N147 WeakPolarHBondContact O-CA 3.22Å; F144-N147 WeakPolarHBondContact O-CB 3.43Å; F144-N147 PolarHBondContact O-N 3.39Å; F144-C148 WeakPolarHBondContact CD1-SG 3.28Å; F144-C148 HydrophobicContact CE1-CB 4.41Å; F144-C148 WeakPolarHBondContact CE1-SG 3.42Å; F144-C148 WeakPolarHBondContact CZ-SG 3.36Å; F144-C148 PolarHBondContact O-N 2.79Å; F144-C148 PolarHBondContact O-SG 3.46Å; F144-C148 VanDerWaalsContact O-SG 3.36Å; F144-V153 HydrophobicContact CE2-CG2 4.5Å; F144-V153 HydrophobicContact CZ-CG2 4.33Å; F144-L158 HydrophobicContact CE2-CD1 4.12Å; F144-F161 HydrophobicContact CB-CD1 4.19Å; F144-F161 HydrophobicContact CB-CE1 4.03Å; F144-F161 HydrophobicContact CB-CZ 4.23Å; F144-F161 HydrophobicContact CD2-CB 3.93Å; F144-F161 HydrophobicContact CD2-CD1 4.03Å; F144-F161 AromaticContact CD2-CD2 3.39Å; F144-F161 HydrophobicContact CD2-CD2 3.39Å; F144-F161 HydrophobicContact CD2-CE1 4.39Å; F144-F161 AromaticContact CD2-CE2 3.81Å; F144-F161 HydrophobicContact CD2-CE2 3.81Å; F144-F161 AromaticContact CD2-CG 3.54Å; F144-F161 HydrophobicContact CD2-CG 3.54Å; F144-F161 HydrophobicContact CD2-CZ 4.29Å; F144-F161 HydrophobicContact CE2-CB 4.35Å; F144-F161 AromaticContact CE2-CD2 3.92Å; F144-F161 HydrophobicContact CE2-CD2 3.92Å; F144-F161 HydrophobicContact CE2-CG 4.26Å; F144-F161 HydrophobicContact CG-CD2 4.45Å; F144-L214 HydrophobicContact CD1-CD1 3.04Å; F144-L214 HydrophobicContact CD1-CG 4.36Å; F144-L214 HydrophobicContact CE1-CD1 3.25Å; F144-L214 HydrophobicContact CE1-CD2 4.21Å; F144-L214 HydrophobicContact CE1-CG 4.3Å; F144-L214 HydrophobicContact CG-CD1 3.93Å; F144-L214 HydrophobicContact CZ-CD1 4.31Å
145	K	64.9	Low	67.5	Low	75 Å²	75	53.7 Å²	53.7	33%	0.326	31%	0.307	S	S	.	.	H	α-helix	trans	-60.2	-45.4	-177.6	-177.4	-174.9	179.1	-178.2	0	112.6	F141 N147 C148 A149 D211	F141-K145 WeakPolarHBondContact O-CB 3.41Å; F141-K145 PolarHBondContact O-N 3.42Å; F141-K145 VanDerWaalsContact O-N 3.09Å; K145-N147 PolarHBondContact O-N 3.49Å; K145-C148 PolarHBondContact O-N 3.34Å; K145-A149 PolarHBondContact O-N 2.88Å; K145-D211 HydrophobicContact CD-CB 4.19Å; K145-D211 WeakPolarHBondContact CE-OD2 3.34Å; K145-D211 IonicContact NZ-OD2 2.59Å; K145-D211 PolarHBondContact NZ-OD2 3.5Å
146	E	64.6	Low	67.2	Low	124 Å²	124	63.7 Å²	63.7	58%	0.579	34%	0.344	S	S	*	.	H	α-helix	trans	-58.9	-32.2	176.3	-77.5	-173.8	-175.2	0	0	112.1	L92 H142 F144	L92-E146 VanDerWaalsContact CD1-OE2 3.28Å; L92-E146 WeakPolarHBondContact CD1-OE2 3.43Å; L92-E146 HydrophobicContact CD2-CB 3.62Å; L92-E146 WeakPolarHBondContact CD2-OE2 3.3Å; H142-E146 WeakPolarHBondContact O-CG 3.29Å; H142-E146 PolarHBondContact O-N 2.86Å; H142-E146 VanDerWaalsContact O-N 3.09Å; F144-E146 PolarHBondContact O-N 2.96Å
147	N	64.1	Low	66.6	Low	33 Å²	33	67.9 Å²	67.9	18%	0.176	36%	0.363	C	S	.	.	H	α-helix	trans	-81.6	-14.7	174.6	-75	-71	0	0	0	114.3	L92 A143 F144 K145 K157 F161	L92-N147 WeakPolarHBondContact CD2-ND2 3.5Å; A143-N147 PolarHBondContact O-N 3.4Å; A143-N147 PolarHBondContact O-ND2 2.91Å; F144-N147 CarbonylContact O-C 3.53Å; F144-N147 WeakPolarHBondContact O-CA 3.22Å; F144-N147 WeakPolarHBondContact O-CB 3.43Å; F144-N147 PolarHBondContact O-N 3.39Å; K145-N147 PolarHBondContact O-N 3.49Å; N147-K157 HydrophobicContact CB-CD 4.49Å; N147-K157 PolarHBondContact OD1-NZ 2.93Å; N147-F161 HydrophobicContact CB-CE2 4.35Å; N147-F161 HydrophobicContact CB-CZ 4.45Å
148	C	62.2	Low	66.3	Low	37 Å²	37	69.1 Å²	69.1	25%	0.25	37%	0.372	C	S	.	.	H	α-helix	trans	-95.2	-10.6	179.4	-73.8	0	0	0	0	114.5	F144 K145 E150 G151 V153	F144-C148 WeakPolarHBondContact CD1-SG 3.28Å; F144-C148 HydrophobicContact CE1-CB 4.41Å; F144-C148 WeakPolarHBondContact CE1-SG 3.42Å; F144-C148 WeakPolarHBondContact CZ-SG 3.36Å; F144-C148 PolarHBondContact O-N 2.79Å; F144-C148 PolarHBondContact O-SG 3.46Å; F144-C148 VanDerWaalsContact O-SG 3.36Å; K145-C148 PolarHBondContact O-N 3.34Å; C148-E150 PolarHBondContact O-N 3.45Å; C148-G151 PolarHBondContact O-N 2.94Å; C148-V153 HydrophobicContact CB-CG2 4.45Å; C148-V153 WeakPolarHBondContact SG-CG2 3.3Å
149	A	58.1	Low	66	Low	91 Å²	91	71.5 Å²	71.5	75%	0.752	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-23.7	-179.8	0	0	0	0	0	112.9	K145 G151	K145-A149 PolarHBondContact O-N 2.88Å; A149-G151 VanDerWaalsContact C-N 3.34Å
150	E	55.7	Low	66.1	Low	177 Å²	177	74.7 Å²	74.7	83%	0.827	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	6.3	176	-61.7	-176.8	173.7	0	0	114	C148 L152	C148-E150 PolarHBondContact O-N 3.45Å; E150-L152 PolarHBondContact O-N 3.06Å
151	G	54.7	Low	66.1	Low	66 Å²	66	74.9 Å²	74.9	68%	0.68	41%	0.405	S	S	*	.	S	Bend	trans	71.3	-4.6	175.3	0	0	0	0	0	115.6	C148 A149	C148-G151 PolarHBondContact O-N 2.94Å; A149-G151 VanDerWaalsContact C-N 3.34Å
152	L	59.5	Low	66.4	Low	141 Å²	141	78 Å²	78	74%	0.738	42%	0.421	S	S	*	.			trans	-136	117.9	-179.2	-66.8	171.4	0	0	0	109.9	E150	E150-L152 PolarHBondContact O-N 3.06Å
153	V	61.4	Low	67	Low	39 Å²	39	77.5 Å²	77.5	24%	0.236	43%	0.425	C	S	.	.			trans	-99.2	119.9	171	-175.1	0	0	0	0	108.2	F144 C148 S155 K157 L158	F144-V153 HydrophobicContact CE2-CG2 4.5Å; F144-V153 HydrophobicContact CZ-CG2 4.33Å; C148-V153 HydrophobicContact CB-CG2 4.45Å; C148-V153 WeakPolarHBondContact SG-CG2 3.3Å; V153-S155 PolarHBondContact O-N 3.46Å; V153-K157 HydrophobicContact CG1-CB 3.67Å; V153-L158 HydrophobicContact CG1-CB 4.12Å
154	P	66.8	Low	67.6	Low	72 Å²	72	78.6 Å²	78.6	47%	0.468	43%	0.431	S	S	.	.			trans	-53.8	140	171.1	-25.3	33.1	0	0	0	111.3	R156 K157 L158	P154-R156 PolarHBondContact O-N 3.44Å; P154-R156 VanDerWaalsContact O-N 3.09Å; P154-K157 HydrophobicContact CG-CD 4.45Å; P154-K157 PolarHBondContact O-N 2.85Å; P154-L158 PolarHBondContact O-N 3.46Å
155	S	70.3	Confident	68.1	Low	65 Å²	65	79.5 Å²	79.5	46%	0.455	44%	0.435	S	S	.	.	H	α-helix	trans	-51.1	-39.1	-178.2	57.6	0	0	0	0	113.3	V153 K157 L158 N159	V153-S155 PolarHBondContact O-N 3.46Å; S155-K157 PolarHBondContact O-N 3.32Å; S155-L158 PolarHBondContact O-N 3.2Å; S155-N159 WeakPolarHBondContact O-CB 3.19Å; S155-N159 VanDerWaalsContact O-CG 3.28Å; S155-N159 PolarHBondContact O-N 3.46Å
156	R	72.2	Confident	69.1	Low	209 Å²	209	81.4 Å²	81.4	79%	0.789	45%	0.445	S	S	*	.	H	α-helix	trans	-58.1	-47	174.7	-68.9	-175.2	-179.5	179.4	0	112.6	P154 N159 T160	P154-R156 PolarHBondContact O-N 3.44Å; P154-R156 VanDerWaalsContact O-N 3.09Å; R156-N159 PolarHBondContact O-N 3.34Å; R156-T160 PolarHBondContact O-N 2.94Å; R156-T160 PolarHBondContact O-OG1 3.06Å
157	K	70.7	Confident	70	Confident	91 Å²	91	77.7 Å²	77.7	40%	0.396	43%	0.429	S	S	.	.	H	α-helix	trans	-65	-43.9	178	-71.2	-168.2	-176.8	178.5	0	110.5	N147 V153 P154 S155 N159 T160 F161	N147-K157 HydrophobicContact CB-CD 4.49Å; N147-K157 PolarHBondContact OD1-NZ 2.93Å; V153-K157 HydrophobicContact CG1-CB 3.67Å; P154-K157 HydrophobicContact CG-CD 4.45Å; P154-K157 PolarHBondContact O-N 2.85Å; S155-K157 PolarHBondContact O-N 3.32Å; K157-N159 VanDerWaalsContact C-N 3.33Å; K157-N159 PolarHBondContact O-N 2.86Å; K157-T160 WeakPolarHBondContact O-CB 3.42Å; K157-T160 PolarHBondContact O-N 2.68Å; K157-T160 VanDerWaalsContact O-N 3.16Å; K157-F161 HydrophobicContact CB-CD2 4.43Å; K157-F161 HydrophobicContact CB-CE2 4.19Å; K157-F161 WeakPolarHBondContact O-CD2 3.25Å; K157-F161 PolarHBondContact O-N 3.22Å
158	L	71.9	Confident	71	Confident	71 Å²	71	76.3 Å²	76.3	37%	0.372	42%	0.422	S	S	.	.	H	α-helix	trans	-58.1	-45.3	176.2	-178.3	62.4	0	0	0	111.6	F144 V153 P154 S155 T160 F161 I162	F144-L158 HydrophobicContact CE2-CD1 4.12Å; V153-L158 HydrophobicContact CG1-CB 4.12Å; P154-L158 PolarHBondContact O-N 3.46Å; S155-L158 PolarHBondContact O-N 3.2Å; L158-T160 VanDerWaalsContact C-N 3.34Å; L158-T160 PolarHBondContact O-N 2.94Å; L158-F161 PolarHBondContact O-N 3.27Å; L158-F161 VanDerWaalsContact O-N 3.17Å; L158-I162 HydrophobicContact CD1-CD1 4.27Å; L158-I162 HydrophobicContact CD1-CG1 4.42Å; L158-I162 HydrophobicContact CG-CD1 3.95Å; L158-I162 WeakPolarHBondContact O-CG1 3.27Å; L158-I162 PolarHBondContact O-N 3.12Å
159	N	71.1	Confident	72.1	Confident	82 Å²	82	76.7 Å²	76.7	44%	0.439	42%	0.42	S	S	.	.	H	α-helix	trans	-61.7	-40.7	176	-72.2	-11.3	0	0	0	112	S155 R156 K157 F161 I162 S163	S155-N159 WeakPolarHBondContact O-CB 3.19Å; S155-N159 VanDerWaalsContact O-CG 3.28Å; S155-N159 PolarHBondContact O-N 3.46Å; R156-N159 PolarHBondContact O-N 3.34Å; K157-N159 VanDerWaalsContact C-N 3.33Å; K157-N159 PolarHBondContact O-N 2.86Å; N159-F161 VanDerWaalsContact C-N 3.35Å; N159-F161 PolarHBondContact O-N 2.64Å; N159-I162 PolarHBondContact O-N 3.21Å; N159-S163 WeakPolarHBondContact O-CB 3.28Å; N159-S163 PolarHBondContact O-N 3.43Å
160	T	74.2	Confident	73.6	Confident	71 Å²	71	77.1 Å²	77.1	44%	0.436	41%	0.405	S	S	.	.	H	α-helix	trans	-59.5	-45.2	173.1	-57.6	0	0	0	0	111.5	R156 K157 L158 S163 M164	R156-T160 PolarHBondContact O-N 2.94Å; R156-T160 PolarHBondContact O-OG1 3.06Å; K157-T160 WeakPolarHBondContact O-CB 3.42Å; K157-T160 PolarHBondContact O-N 2.68Å; K157-T160 VanDerWaalsContact O-N 3.16Å; L158-T160 VanDerWaalsContact C-N 3.34Å; L158-T160 PolarHBondContact O-N 2.94Å; T160-S163 PolarHBondContact O-N 2.92Å; T160-M164 HydrophobicContact CG2-CE 3.48Å; T160-M164 VanDerWaalsContact CG2-CE 3.48Å; T160-M164 HydrophobicContact CG2-SD 4.05Å; T160-M164 VanDerWaalsContact O-CG 3.27Å; T160-M164 WeakPolarHBondContact O-CG 3.41Å; T160-M164 PolarHBondContact O-N 3.28Å
161	F	74.2	Confident	75.3	Confident	15 Å²	15	68.8 Å²	68.8	7%	0.066	37%	0.366	C	S	.	.	H	α-helix	trans	-67.8	-39.4	178.5	-71.3	-64.3	0	0	0	113.3	I139 A143 F144 N147 K157 L158 N159 S163 M164 K165	I139-F161 HydrophobicContact CG2-CD1 4.49Å; A143-F161 HydrophobicContact CB-CE1 4.21Å; F144-F161 HydrophobicContact CB-CD1 4.19Å; F144-F161 HydrophobicContact CB-CE1 4.03Å; F144-F161 HydrophobicContact CB-CZ 4.23Å; F144-F161 HydrophobicContact CD2-CB 3.93Å; F144-F161 HydrophobicContact CD2-CD1 4.03Å; F144-F161 AromaticContact CD2-CD2 3.39Å; F144-F161 HydrophobicContact CD2-CD2 3.39Å; F144-F161 HydrophobicContact CD2-CE1 4.39Å; F144-F161 AromaticContact CD2-CE2 3.81Å; F144-F161 HydrophobicContact CD2-CE2 3.81Å; F144-F161 AromaticContact CD2-CG 3.54Å; F144-F161 HydrophobicContact CD2-CG 3.54Å; F144-F161 HydrophobicContact CD2-CZ 4.29Å; F144-F161 HydrophobicContact CE2-CB 4.35Å; F144-F161 AromaticContact CE2-CD2 3.92Å; F144-F161 HydrophobicContact CE2-CD2 3.92Å; F144-F161 HydrophobicContact CE2-CG 4.26Å; F144-F161 HydrophobicContact CG-CD2 4.45Å; N147-F161 HydrophobicContact CB-CE2 4.35Å; N147-F161 HydrophobicContact CB-CZ 4.45Å; K157-F161 HydrophobicContact CB-CD2 4.43Å; K157-F161 HydrophobicContact CB-CE2 4.19Å; K157-F161 WeakPolarHBondContact O-CD2 3.25Å; K157-F161 PolarHBondContact O-N 3.22Å; L158-F161 PolarHBondContact O-N 3.27Å; L158-F161 VanDerWaalsContact O-N 3.17Å; N159-F161 VanDerWaalsContact C-N 3.35Å; N159-F161 PolarHBondContact O-N 2.64Å; F161-S163 VanDerWaalsContact C-N 3.35Å; F161-M164 HydrophobicContact CD1-SD 4.41Å; F161-M164 PolarHBondContact O-N 3.03Å; F161-K165 WeakPolarHBondContact O-CB 3.27Å; F161-K165 PolarHBondContact O-N 3.34Å
162	I	76.3	Confident	77.1	Confident	77 Å²	77	65.6 Å²	65.6	40%	0.395	33%	0.334	S	S	.	.	H	α-helix	trans	-61.2	-46	173.8	-69.7	168.2	0	0	0	110.1	L158 N159 M164 K165 Q166	L158-I162 HydrophobicContact CD1-CD1 4.27Å; L158-I162 HydrophobicContact CD1-CG1 4.42Å; L158-I162 HydrophobicContact CG-CD1 3.95Å; L158-I162 WeakPolarHBondContact O-CG1 3.27Å; L158-I162 PolarHBondContact O-N 3.12Å; N159-I162 PolarHBondContact O-N 3.21Å; I162-M164 VanDerWaalsContact C-N 3.31Å; I162-M164 PolarHBondContact O-N 2.96Å; I162-K165 WeakPolarHBondContact O-CB 3.3Å; I162-K165 PolarHBondContact O-N 3.4Å; I162-Q166 WeakPolarHBondContact O-CG 3.48Å; I162-Q166 PolarHBondContact O-N 2.93Å
163	S	80	Confident	78.7	Confident	58 Å²	58	65.6 Å²	65.6	41%	0.406	32%	0.324	S	S	.	.	H	α-helix	trans	-60.2	-40.9	175.7	177.1	0	0	0	0	111.8	N159 T160 F161 Q166 D167	N159-S163 WeakPolarHBondContact O-CB 3.28Å; N159-S163 PolarHBondContact O-N 3.43Å; T160-S163 PolarHBondContact O-N 2.92Å; F161-S163 VanDerWaalsContact C-N 3.35Å; S163-Q166 PolarHBondContact O-N 3.39Å; S163-D167 PolarHBondContact O-N 3.33Å
164	M	77.8	Confident	80.1	Confident	24 Å²	24	65.1 Å²	65.1	12%	0.118	32%	0.319	C	S	.	.	H	α-helix	trans	-67.2	-38.5	176	-71.9	170.5	177.7	0	0	112.6	T96 I139 T160 F161 I162 D167 A168	T96-M164 HydrophobicContact CG2-CE 3.64Å; T96-M164 HydrophobicContact CG2-SD 3.77Å; I139-M164 HydrophobicContact CG2-CB 3.88Å; I139-M164 HydrophobicContact CG2-CG 4.17Å; I139-M164 HydrophobicContact CG2-SD 3.42Å; I139-M164 WeakPolarHBondContact CG2-SD 3.19Å; T160-M164 HydrophobicContact CG2-CE 3.48Å; T160-M164 VanDerWaalsContact CG2-CE 3.48Å; T160-M164 HydrophobicContact CG2-SD 4.05Å; T160-M164 VanDerWaalsContact O-CG 3.27Å; T160-M164 WeakPolarHBondContact O-CG 3.41Å; T160-M164 PolarHBondContact O-N 3.28Å; F161-M164 HydrophobicContact CD1-SD 4.41Å; F161-M164 PolarHBondContact O-N 3.03Å; I162-M164 VanDerWaalsContact C-N 3.31Å; I162-M164 PolarHBondContact O-N 2.96Å; M164-D167 PolarHBondContact O-N 3.01Å; M164-A168 WeakPolarHBondContact O-CB 3.49Å; M164-A168 PolarHBondContact O-N 3.33Å
165	K	80.3	Confident	81.5	Confident	52 Å²	52	61.7 Å²	61.7	23%	0.226	30%	0.297	C	S	.	.	H	α-helix	trans	-60.6	-46.8	173.5	-178.1	178.3	166.5	176.6	0	110.7	L140 F161 I162 D167 A168 E169 S217	L140-K165 HydrophobicContact CD1-CB 4.41Å; L140-K165 HydrophobicContact CD1-CG 4.3Å; L140-K165 HydrophobicContact CD2-CB 3.76Å; L140-K165 HydrophobicContact CD2-CG 4.41Å; F161-K165 WeakPolarHBondContact O-CB 3.27Å; F161-K165 PolarHBondContact O-N 3.34Å; I162-K165 WeakPolarHBondContact O-CB 3.3Å; I162-K165 PolarHBondContact O-N 3.4Å; K165-D167 VanDerWaalsContact C-N 3.34Å; K165-D167 PolarHBondContact O-N 3.12Å; K165-A168 WeakPolarHBondContact O-CB 3.5Å; K165-A168 PolarHBondContact O-N 3.13Å; K165-E169 WeakPolarHBondContact CE-OE1 3.45Å; K165-E169 IonicContact NZ-OE1 3.04Å; K165-E169 WeakPolarHBondContact O-CG 3.41Å; K165-E169 PolarHBondContact O-N 2.93Å; K165-S217 PolarHBondContact NZ-OG 3.14Å
166	Q	84.1	Confident	82.5	Confident	115 Å²	115	58.7 Å²	58.7	54%	0.537	28%	0.276	S	S	.	.	H	α-helix	trans	-62.4	-39.8	176.4	-71.5	174	-16.1	0	0	112.3	I162 S163 A168 E169 F170	I162-Q166 WeakPolarHBondContact O-CG 3.48Å; I162-Q166 PolarHBondContact O-N 2.93Å; S163-Q166 PolarHBondContact O-N 3.39Å; Q166-A168 VanDerWaalsContact C-N 3.35Å; Q166-E169 PolarHBondContact O-N 3.46Å; Q166-F170 VanDerWaalsContact O-CB 3.3Å; Q166-F170 WeakPolarHBondContact O-CB 3.15Å; Q166-F170 PolarHBondContact O-N 3.47Å
167	D	83.5	Confident	83.4	Confident	46 Å²	46	52.4 Å²	52.4	25%	0.246	26%	0.258	C	S	.	.	H	α-helix	trans	-63.4	-40	174.3	-86.8	-26.1	0	0	0	112	L103 K107 S163 M164 K165 T171	L103-D167 HydrophobicContact CD2-CB 4.25Å; K107-D167 IonicContact NZ-OD1 3.46Å; S163-D167 PolarHBondContact O-N 3.33Å; M164-D167 PolarHBondContact O-N 3.01Å; K165-D167 VanDerWaalsContact C-N 3.34Å; K165-D167 PolarHBondContact O-N 3.12Å; D167-T171 VanDerWaalsContact O-CB 3.3Å; D167-T171 WeakPolarHBondContact O-CB 3.49Å; D167-T171 PolarHBondContact O-N 3.19Å; D167-T171 PolarHBondContact O-OG1 3.36Å
168	A	85.5	Confident	84.3	Confident	3 Å²	3	49.8 Å²	49.8	3%	0.025	25%	0.247	C	C	.	.	H	α-helix	trans	-63.7	-48.3	175.4	0	0	0	0	0	111.6	L103 S136 M164 K165 Q166 F170 T171 F172	L103-A168 HydrophobicContact CD2-CB 4.1Å; S136-A168 VanDerWaalsContact OG-CB 3.28Å; S136-A168 WeakPolarHBondContact OG-CB 3.42Å; M164-A168 WeakPolarHBondContact O-CB 3.49Å; M164-A168 PolarHBondContact O-N 3.33Å; K165-A168 WeakPolarHBondContact O-CB 3.5Å; K165-A168 PolarHBondContact O-N 3.13Å; Q166-A168 VanDerWaalsContact C-N 3.35Å; A168-F170 PolarHBondContact O-N 3.31Å; A168-T171 PolarHBondContact O-N 3.41Å; A168-F172 WeakPolarHBondContact O-CB 3.24Å; A168-F172 PolarHBondContact O-N 3.41Å
169	E	86.4	Confident	85.2	Confident	46 Å²	46	46.5 Å²	46.5	22%	0.215	23%	0.23	C	C	.	.	H	α-helix	trans	-59.4	-44.9	175.9	-73.1	170.4	-171.3	0	0	112	K165 Q166 F172 R173 E221 I225	K165-E169 WeakPolarHBondContact CE-OE1 3.45Å; K165-E169 IonicContact NZ-OE1 3.04Å; K165-E169 WeakPolarHBondContact O-CG 3.41Å; K165-E169 PolarHBondContact O-N 2.93Å; Q166-E169 PolarHBondContact O-N 3.46Å; E169-F172 PolarHBondContact O-N 2.86Å; E169-R173 WeakPolarHBondContact O-CB 3.4Å; E169-R173 PolarHBondContact O-N 2.83Å; E169-E221 HydrophobicContact CG-CB 4.49Å; E169-I225 HydrophobicContact CB-CD1 3.96Å; E169-I225 HydrophobicContact CG-CD1 4.19Å
170	F	89.3	Confident	86	Confident	100 Å²	100	43 Å²	43	44%	0.439	21%	0.211	S	C	.	.	H	α-helix	trans	-61.8	-46.4	176.7	-179.4	-86.1	0	0	0	111.4	K107 Q166 A168 F172 R173 L174	K107-F170 HydrophobicContact CD-CD1 4.12Å; K107-F170 HydrophobicContact CD-CE1 4.27Å; K107-F170 VanDerWaalsContact CE-CE1 3.42Å; Q166-F170 VanDerWaalsContact O-CB 3.3Å; Q166-F170 WeakPolarHBondContact O-CB 3.15Å; Q166-F170 PolarHBondContact O-N 3.47Å; A168-F170 PolarHBondContact O-N 3.31Å; F170-F172 VanDerWaalsContact C-N 3.32Å; F170-F172 PolarHBondContact O-N 3.41Å; F170-R173 PolarHBondContact O-N 3.41Å; F170-L174 WeakPolarHBondContact O-CB 3.44Å; F170-L174 PolarHBondContact O-N 2.97Å
171	T	90.3	Very high	86.5	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-67	-37.4	-178.5	-53.2	0	0	0	0	111	L103 K107 L110 I132 D167 A168 L174 W175	L103-T171 HydrophobicContact CD1-CG2 3.95Å; K107-T171 HydrophobicContact CB-CG2 3.87Å; L110-T171 HydrophobicContact CD1-CG2 4.22Å; I132-T171 HydrophobicContact CD1-CG2 3.83Å; I132-T171 HydrophobicContact CG1-CG2 3.79Å; D167-T171 VanDerWaalsContact O-CB 3.3Å; D167-T171 WeakPolarHBondContact O-CB 3.49Å; D167-T171 PolarHBondContact O-N 3.19Å; D167-T171 PolarHBondContact O-OG1 3.36Å; A168-T171 PolarHBondContact O-N 3.41Å; T171-L174 WeakPolarHBondContact O-CB 3.23Å; T171-L174 PolarHBondContact O-N 3.04Å; T171-W175 PolarHBondContact O-N 2.94Å
172	F	92.9	Very high	87.1	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-65.6	-44.6	174	-176.4	-112.8	0	0	0	112.5	L129 I132 A168 E169 F170 L174 W175 I176 L197 L222 I225	L129-F172 HydrophobicContact CD1-CD2 4.28Å; L129-F172 HydrophobicContact CD1-CE2 3.84Å; I132-F172 HydrophobicContact CG2-CB 4.27Å; I132-F172 HydrophobicContact CG2-CD2 4.42Å; A168-F172 WeakPolarHBondContact O-CB 3.24Å; A168-F172 PolarHBondContact O-N 3.41Å; E169-F172 PolarHBondContact O-N 2.86Å; F170-F172 VanDerWaalsContact C-N 3.32Å; F170-F172 PolarHBondContact O-N 3.41Å; F172-L174 VanDerWaalsContact C-N 3.28Å; F172-L174 PolarHBondContact O-N 3.1Å; F172-W175 HydrophobicContact CD2-CE3 4.35Å; F172-W175 AromaticContact CE2-CE3 3.91Å; F172-W175 HydrophobicContact CE2-CE3 3.91Å; F172-W175 HydrophobicContact CE2-CZ3 4.24Å; F172-W175 WeakPolarHBondContact O-CB 3.21Å; F172-W175 PolarHBondContact O-N 3.15Å; F172-W175 VanDerWaalsContact O-N 3.13Å; F172-I176 HydrophobicContact CD1-CD1 3.72Å; F172-I176 HydrophobicContact CD1-CG1 4.39Å; F172-I176 HydrophobicContact CE1-CD1 3.16Å; F172-I176 HydrophobicContact CE1-CG1 3.96Å; F172-I176 HydrophobicContact CE2-CD1 4.26Å; F172-I176 HydrophobicContact CE2-CG1 4.18Å; F172-I176 HydrophobicContact CG-CD1 4.5Å; F172-I176 HydrophobicContact CZ-CD1 3.48Å; F172-I176 VanDerWaalsContact CZ-CD1 3.48Å; F172-I176 HydrophobicContact CZ-CG1 3.84Å; F172-I176 PolarHBondContact O-N 3.13Å; F172-L197 HydrophobicContact CE2-CD1 4.08Å; F172-L197 HydrophobicContact CE2-CD2 3.69Å; F172-L197 HydrophobicContact CE2-CG 4.45Å; F172-L197 HydrophobicContact CZ-CD1 3.8Å; F172-L197 HydrophobicContact CZ-CD2 3.8Å; F172-L197 HydrophobicContact CZ-CG 4.45Å; F172-L222 HydrophobicContact CB-CD2 3.62Å; F172-L222 HydrophobicContact CD1-CB 4.11Å; F172-L222 HydrophobicContact CD1-CD2 3.33Å; F172-L222 HydrophobicContact CD1-CG 4.29Å; F172-L222 HydrophobicContact CD2-CD2 4.08Å; F172-L222 HydrophobicContact CE1-CB 3.86Å; F172-L222 HydrophobicContact CE1-CD2 3.96Å; F172-L222 HydrophobicContact CE1-CG 4.48Å; F172-L222 VanDerWaalsContact CE1-O 3.31Å; F172-L222 WeakPolarHBondContact CE1-O 3.19Å; F172-L222 HydrophobicContact CG-CD2 3.39Å; F172-L222 HydrophobicContact CZ-CB 4.38Å; F172-I225 HydrophobicContact CD1-CB 4.15Å; F172-I225 HydrophobicContact CD1-CD1 4.23Å; F172-I225 HydrophobicContact CD1-CG2 4Å; F172-I225 HydrophobicContact CE1-CB 4.31Å; F172-I225 HydrophobicContact CE1-CG2 4.32Å
173	R	92.6	Very high	87.5	Confident	141 Å²	141	42.5 Å²	42.5	53%	0.532	20%	0.203	S	C	.	.	H	α-helix	trans	-59.1	-42.6	174.3	-173	179	-64.3	-168.9	0.9	111.5	E169 F170 W175 I176 N177 I225	E169-R173 WeakPolarHBondContact O-CB 3.4Å; E169-R173 PolarHBondContact O-N 2.83Å; F170-R173 PolarHBondContact O-N 3.41Å; R173-W175 VanDerWaalsContact C-N 3.34Å; R173-I176 PolarHBondContact O-N 3.37Å; R173-N177 WeakPolarHBondContact O-CB 3.42Å; R173-N177 VanDerWaalsContact O-CG 3.22Å; R173-N177 PolarHBondContact O-N 3.23Å; R173-I225 HydrophobicContact CB-CG2 3.85Å; R173-I225 HydrophobicContact CG-CG2 4.06Å
174	L	92.4	Very high	87.3	Confident	28 Å²	28	43 Å²	43	15%	0.147	20%	0.201	C	C	.	.	H	α-helix	trans	-61	-44.3	174.6	178.5	67.3	0	0	0	111.4	K107 L110 Q111 F170 T171 F172 N177 K178	K107-L174 HydrophobicContact CG-CD2 4.33Å; L110-L174 HydrophobicContact CB-CD2 3.69Å; L110-L174 HydrophobicContact CB-CG 4.11Å; Q111-L174 HydrophobicContact CG-CD2 3.57Å; F170-L174 WeakPolarHBondContact O-CB 3.44Å; F170-L174 PolarHBondContact O-N 2.97Å; T171-L174 WeakPolarHBondContact O-CB 3.23Å; T171-L174 PolarHBondContact O-N 3.04Å; F172-L174 VanDerWaalsContact C-N 3.28Å; F172-L174 PolarHBondContact O-N 3.1Å; L174-N177 PolarHBondContact O-N 3.39Å; L174-K178 HydrophobicContact CD1-CG 4.24Å; L174-K178 WeakPolarHBondContact O-CB 3.48Å; L174-K178 PolarHBondContact O-N 3.29Å
175	W	94.5	Very high	87	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-60.4	-46.3	177.1	176.6	89.3	0	0	0	112	L110 L125 L129 I132 T171 F172 R173 K178 T179 C193 L197	L110-W175 HydrophobicContact CD1-CB 3.85Å; L125-W175 PolarHBondContact O-NE1 3.14Å; L129-W175 HydrophobicContact CB-CD2 4.32Å; L129-W175 HydrophobicContact CB-CH2 4.46Å; L129-W175 HydrophobicContact CB-CZ2 3.69Å; L129-W175 HydrophobicContact CD1-CD2 4.01Å; L129-W175 HydrophobicContact CD1-CE3 3.97Å; L129-W175 HydrophobicContact CD1-CH2 4.12Å; L129-W175 HydrophobicContact CD1-CZ2 4.11Å; L129-W175 HydrophobicContact CD1-CZ3 4.05Å; L129-W175 HydrophobicContact CD2-CH2 3.7Å; L129-W175 HydrophobicContact CD2-CZ2 3.66Å; L129-W175 HydrophobicContact CD2-CZ3 4.38Å; L129-W175 HydrophobicContact CG-CH2 4.3Å; L129-W175 HydrophobicContact CG-CZ2 4.01Å; I132-W175 HydrophobicContact CD1-CB 3.6Å; I132-W175 HydrophobicContact CD1-CG 3.98Å; T171-W175 PolarHBondContact O-N 2.94Å; F172-W175 HydrophobicContact CD2-CE3 4.35Å; F172-W175 AromaticContact CE2-CE3 3.91Å; F172-W175 HydrophobicContact CE2-CE3 3.91Å; F172-W175 HydrophobicContact CE2-CZ3 4.24Å; F172-W175 WeakPolarHBondContact O-CB 3.21Å; F172-W175 PolarHBondContact O-N 3.15Å; F172-W175 VanDerWaalsContact O-N 3.13Å; R173-W175 VanDerWaalsContact C-N 3.34Å; W175-K178 PolarHBondContact O-N 3.18Å; W175-T179 VanDerWaalsContact CE2-OG1 3.24Å; W175-T179 HydrophobicContact CH2-CG2 4.29Å; W175-T179 HydrophobicContact CZ2-CG2 4.25Å; W175-T179 WeakPolarHBondContact CZ2-OG1 3.43Å; W175-T179 VanDerWaalsContact O-CB 3.28Å; W175-T179 WeakPolarHBondContact O-CB 3.34Å; W175-T179 PolarHBondContact O-N 3.18Å; W175-T179 PolarHBondContact O-OG1 2.7Å; W175-C193 HydrophobicContact CH2-CB 4.2Å; W175-C193 HydrophobicContact CZ2-CB 4.05Å; W175-L197 HydrophobicContact CH2-CD1 4.2Å; W175-L197 HydrophobicContact CZ3-CD1 3.77Å
176	I	92.2	Very high	87	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-60.8	-50.4	177.9	-64	168.2	0	0	0	109.6	F172 R173 K178 T179 M180 I225 L226 S229	F172-I176 HydrophobicContact CD1-CD1 3.72Å; F172-I176 HydrophobicContact CD1-CG1 4.39Å; F172-I176 HydrophobicContact CE1-CD1 3.16Å; F172-I176 HydrophobicContact CE1-CG1 3.96Å; F172-I176 HydrophobicContact CE2-CD1 4.26Å; F172-I176 HydrophobicContact CE2-CG1 4.18Å; F172-I176 HydrophobicContact CG-CD1 4.5Å; F172-I176 HydrophobicContact CZ-CD1 3.48Å; F172-I176 VanDerWaalsContact CZ-CD1 3.48Å; F172-I176 HydrophobicContact CZ-CG1 3.84Å; F172-I176 PolarHBondContact O-N 3.13Å; R173-I176 PolarHBondContact O-N 3.37Å; I176-K178 VanDerWaalsContact C-N 3.31Å; I176-K178 PolarHBondContact O-N 3.45Å; I176-T179 WeakPolarHBondContact O-CB 3.37Å; I176-T179 PolarHBondContact O-N 3.4Å; I176-T179 VanDerWaalsContact O-N 3.15Å; I176-M180 HydrophobicContact CG2-CG 4.08Å; I176-M180 WeakPolarHBondContact O-CB 3.49Å; I176-M180 VanDerWaalsContact O-CG 3.28Å; I176-M180 WeakPolarHBondContact O-CG 3.3Å; I176-M180 PolarHBondContact O-N 3.26Å; I176-I225 HydrophobicContact CD1-CG2 3.79Å; I176-L226 HydrophobicContact CD1-CB 4.2Å; I176-L226 HydrophobicContact CD1-CD1 3.99Å; I176-L226 HydrophobicContact CG1-CD1 4.42Å; I176-S229 WeakPolarHBondContact CG2-OG 3.41Å
177	N	90.4	Very high	86.8	Confident	77 Å²	77	48.2 Å²	48.2	41%	0.412	23%	0.233	S	C	.	.	H	α-helix	trans	-59	-43.1	-179	-69.9	-8.3	0	0	0	111.8	R173 L174 M180 E181	R173-N177 WeakPolarHBondContact O-CB 3.42Å; R173-N177 VanDerWaalsContact O-CG 3.22Å; R173-N177 PolarHBondContact O-N 3.23Å; L174-N177 PolarHBondContact O-N 3.39Å; N177-M180 CarbonylContact O-C 3.52Å; N177-M180 PolarHBondContact O-N 3.41Å; N177-E181 WeakPolarHBondContact O-CB 3.43Å; N177-E181 PolarHBondContact O-N 3.28Å
178	K	89.8	Confident	87	Confident	37 Å²	37	52.7 Å²	52.7	16%	0.161	25%	0.253	C	S	.	.	H	α-helix	trans	-68.6	-36.6	176.9	-80.4	-70.6	174.1	-158.5	0	112.8	L110 L174 W175 I176 E181 L182	L110-K178 HydrophobicContact CD2-CB 4.45Å; L174-K178 HydrophobicContact CD1-CG 4.24Å; L174-K178 WeakPolarHBondContact O-CB 3.48Å; L174-K178 PolarHBondContact O-N 3.29Å; W175-K178 PolarHBondContact O-N 3.18Å; I176-K178 VanDerWaalsContact C-N 3.31Å; I176-K178 PolarHBondContact O-N 3.45Å; K178-E181 WeakPolarHBondContact CD-OE2 3.15Å; K178-E181 WeakPolarHBondContact CE-OE2 3.24Å; K178-E181 VanDerWaalsContact NZ-CD 3.26Å; K178-E181 IonicContact NZ-OE1 3.95Å; K178-E181 PolarHBondContact NZ-OE1 3.43Å; K178-E181 IonicContact NZ-OE2 3.45Å; K178-E181 PolarHBondContact NZ-OE2 3.13Å; K178-E181 PolarHBondContact O-N 3.13Å; K178-E181 VanDerWaalsContact O-N 3.11Å; K178-L182 WeakPolarHBondContact O-CB 3.36Å; K178-L182 VanDerWaalsContact O-CG 3.29Å; K178-L182 WeakPolarHBondContact O-CG 3.42Å; K178-L182 PolarHBondContact O-N 3.14Å
179	T	90.8	Very high	87	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.012	25%	0.253	C	S	.	.	H	α-helix	trans	-63.6	-45	174.4	-58.6	0	0	0	0	110.5	L125 W175 I176 E181 L183 L190 C193	L125-T179 HydrophobicContact CD1-CG2 4.25Å; W175-T179 VanDerWaalsContact CE2-OG1 3.24Å; W175-T179 HydrophobicContact CH2-CG2 4.29Å; W175-T179 HydrophobicContact CZ2-CG2 4.25Å; W175-T179 WeakPolarHBondContact CZ2-OG1 3.43Å; W175-T179 VanDerWaalsContact O-CB 3.28Å; W175-T179 WeakPolarHBondContact O-CB 3.34Å; W175-T179 PolarHBondContact O-N 3.18Å; W175-T179 PolarHBondContact O-OG1 2.7Å; I176-T179 WeakPolarHBondContact O-CB 3.37Å; I176-T179 PolarHBondContact O-N 3.4Å; I176-T179 VanDerWaalsContact O-N 3.15Å; T179-E181 PolarHBondContact O-N 3.37Å; T179-L183 HydrophobicContact CG2-CD1 3.68Å; T179-L183 HydrophobicContact CG2-CG 4.37Å; T179-L183 WeakPolarHBondContact O-CB 3.35Å; T179-L183 WeakPolarHBondContact O-CG 3.48Å; T179-L183 PolarHBondContact O-N 3.28Å; T179-L183 VanDerWaalsContact O-N 3.07Å; T179-L190 HydrophobicContact CG2-CD1 3.65Å; T179-C193 HydrophobicContact CG2-CB 4.17Å
180	M	87.7	Confident	87.1	Confident	9 Å²	9	50.6 Å²	50.6	4%	0.044	24%	0.243	C	C	.	.	H	α-helix	trans	-71.5	-5.3	172.7	-62.3	-65	-152.5	0	0	113.7	I176 N177 L190 F230 H233 Y238 I242	I176-M180 HydrophobicContact CG2-CG 4.08Å; I176-M180 WeakPolarHBondContact O-CB 3.49Å; I176-M180 VanDerWaalsContact O-CG 3.28Å; I176-M180 WeakPolarHBondContact O-CG 3.3Å; I176-M180 PolarHBondContact O-N 3.26Å; N177-M180 CarbonylContact O-C 3.52Å; N177-M180 PolarHBondContact O-N 3.41Å; M180-L190 HydrophobicContact SD-CD1 3.96Å; M180-L190 HydrophobicContact SD-CD2 3.81Å; M180-F230 HydrophobicContact CE-CD1 3.67Å; M180-F230 HydrophobicContact CE-CE1 3.73Å; M180-H233 HydrophobicContact CE-CB 4.47Å; M180-Y238 WeakPolarHBondContact CA-OH 3.37Å; M180-Y238 HydrophobicContact CB-CE2 4.06Å; M180-Y238 WeakPolarHBondContact O-CE2 3.43Å; M180-Y238 PolarHBondContact O-OH 2.87Å; M180-Y238 HydrophobicContact SD-CD1 4.39Å; M180-Y238 HydrophobicContact SD-CD2 4Å; M180-Y238 HydrophobicContact SD-CE2 4.16Å; M180-Y238 HydrophobicContact SD-CG 4.09Å; M180-I242 HydrophobicContact CE-CD1 4.1Å; M180-I242 HydrophobicContact CE-CG1 4.21Å
181	E	86	Confident	87.1	Confident	114 Å²	114	46.5 Å²	46.5	53%	0.533	23%	0.225	S	C	.	.	H	α-helix	trans	-97.8	-47.8	172.9	-176	-171.2	143.3	0	0	109.8	N177 K178 T179	N177-E181 WeakPolarHBondContact O-CB 3.43Å; N177-E181 PolarHBondContact O-N 3.28Å; K178-E181 WeakPolarHBondContact CD-OE2 3.15Å; K178-E181 WeakPolarHBondContact CE-OE2 3.24Å; K178-E181 VanDerWaalsContact NZ-CD 3.26Å; K178-E181 IonicContact NZ-OE1 3.95Å; K178-E181 PolarHBondContact NZ-OE1 3.43Å; K178-E181 IonicContact NZ-OE2 3.45Å; K178-E181 PolarHBondContact NZ-OE2 3.13Å; K178-E181 PolarHBondContact O-N 3.13Å; K178-E181 VanDerWaalsContact O-N 3.11Å; T179-E181 PolarHBondContact O-N 3.37Å
182	L	86.1	Confident	87	Confident	35 Å²	35	50.3 Å²	50.3	18%	0.183	24%	0.243	C	C	.	.	H	α-helix	trans	-82.1	-22.9	-170.9	-64.5	174.5	0	0	0	113.9	T113 V115 T121 L125 K178	T113-L182 HydrophobicContact CG2-CD1 3.75Å; V115-L182 HydrophobicContact CG2-CD2 3.81Å; T121-L182 HydrophobicContact CG2-CB 3.91Å; T121-L182 HydrophobicContact CG2-CD1 4.13Å; L125-L182 HydrophobicContact CD1-CB 4.4Å; L125-L182 HydrophobicContact CD2-CD1 4.37Å; K178-L182 WeakPolarHBondContact O-CB 3.36Å; K178-L182 VanDerWaalsContact O-CG 3.29Å; K178-L182 WeakPolarHBondContact O-CG 3.42Å; K178-L182 PolarHBondContact O-N 3.14Å
183	L	85.2	Confident	86.8	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.01	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103	18.1	-178.2	-55.8	-176.1	0	0	0	113.6	T121 V122 L125 T179 E185 N186 L190	T121-L183 HydrophobicContact CG2-CD2 4.25Å; V122-L183 HydrophobicContact CG2-CD2 3.69Å; L125-L183 HydrophobicContact CD1-CD1 3.86Å; L125-L183 HydrophobicContact CD1-CD2 3.99Å; L125-L183 HydrophobicContact CD1-CG 3.78Å; T179-L183 HydrophobicContact CG2-CD1 3.68Å; T179-L183 HydrophobicContact CG2-CG 4.37Å; T179-L183 WeakPolarHBondContact O-CB 3.35Å; T179-L183 WeakPolarHBondContact O-CG 3.48Å; T179-L183 PolarHBondContact O-N 3.28Å; T179-L183 VanDerWaalsContact O-N 3.07Å; L183-E185 PolarHBondContact O-N 2.94Å; L183-N186 PolarHBondContact O-N 3.15Å; L183-L190 HydrophobicContact CB-CB 4.4Å; L183-L190 HydrophobicContact CD1-CB 4.37Å
184	N	74.4	Confident	86.8	Confident	70 Å²	70	43.7 Å²	43.7	37%	0.374	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-26	-173.1	-165.5	29.3	0	0	0	115	L237 Y238	N184-L237 WeakPolarHBondContact OD1-CD1 3.13Å; N184-Y238 VanDerWaalsContact CA-CZ 3.44Å; N184-Y238 WeakPolarHBondContact CA-OH 3.16Å; N184-Y238 VanDerWaalsContact CB-OH 3.23Å; N184-Y238 WeakPolarHBondContact CB-OH 3.37Å; N184-Y238 PolarHBondContact N-OH 3.47Å
185	E	72.4	Confident	86.6	Confident	187 Å²	187	43.8 Å²	43.8	87%	0.874	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.3	-1	-177.3	-60.3	-179.3	173.3	0	0	113.1	L183	L183-E185 PolarHBondContact O-N 2.94Å
186	N	80.6	Confident	86.2	Confident	48 Å²	48	45.5 Å²	45.5	26%	0.257	23%	0.228	S	C	.	.			trans	-136.2	87.9	-176.1	-165	-36.4	0	0	0	112.7	T118 L183 E188 S189 L190	T118-N186 HydrophobicContact CG2-CB 4.37Å; L183-N186 PolarHBondContact O-N 3.15Å; N186-E188 VanDerWaalsContact C-N 3.3Å; N186-E188 PolarHBondContact O-N 2.84Å; N186-E188 PolarHBondContact OD1-N 3.39Å; N186-S189 VanDerWaalsContact CG-CB 3.49Å; N186-S189 PolarHBondContact ND2-OG 3Å; N186-S189 WeakPolarHBondContact O-CB 3.29Å; N186-S189 PolarHBondContact O-N 2.81Å; N186-S189 WeakPolarHBondContact OD1-CB 3.38Å; N186-S189 PolarHBondContact OD1-N 3.47Å; N186-S189 PolarHBondContact OD1-OG 3.47Å; N186-S189 VanDerWaalsContact OD1-OG 3.1Å; N186-L190 PolarHBondContact O-N 2.94Å; N186-L190 VanDerWaalsContact O-N 3.16Å
187	P	80.7	Confident	86	Confident	64 Å²	64	45.4 Å²	45.4	42%	0.416	23%	0.228	S	C	.	.	H	α-helix	trans	-50	-44	174.4	-33.7	39.7	0	0	0	114.6	S189 L190 I191 S241	P187-S189 VanDerWaalsContact C-N 3.35Å; P187-S189 PolarHBondContact O-N 3.41Å; P187-L190 PolarHBondContact O-N 2.7Å; P187-I191 WeakPolarHBondContact O-CD1 3.26Å; P187-I191 WeakPolarHBondContact O-CG1 3.49Å; P187-I191 PolarHBondContact O-N 3.24Å; P187-S241 WeakPolarHBondContact CA-OG 3.36Å; P187-S241 VanDerWaalsContact CB-OG 3.24Å; P187-S241 WeakPolarHBondContact CB-OG 3.35Å
188	E	86	Confident	85.9	Confident	140 Å²	140	43.2 Å²	43.2	65%	0.654	21%	0.214	S	C	*	.	H	α-helix	trans	-65.7	-39.9	-178.6	-63.6	179.7	176.5	0	0	111.4	N186 L190 I191 Q192	N186-E188 VanDerWaalsContact C-N 3.3Å; N186-E188 PolarHBondContact O-N 2.84Å; N186-E188 PolarHBondContact OD1-N 3.39Å; E188-L190 VanDerWaalsContact C-N 3.34Å; E188-L190 PolarHBondContact O-N 3.18Å; E188-I191 PolarHBondContact O-N 2.86Å; E188-Q192 WeakPolarHBondContact O-CG 3.18Å; E188-Q192 PolarHBondContact O-N 2.83Å
189	S	86.9	Confident	85.7	Confident	5 Å²	5	49.8 Å²	49.8	4%	0.035	24%	0.237	C	C	.	.	H	α-helix	trans	-63.4	-40.1	176.3	-72.3	0	0	0	0	112.2	V122 N186 P187 Q192 C193	V122-S189 VanDerWaalsContact CG2-CB 3.4Å; V122-S189 WeakPolarHBondContact CG2-OG 3.42Å; N186-S189 VanDerWaalsContact CG-CB 3.49Å; N186-S189 PolarHBondContact ND2-OG 3Å; N186-S189 WeakPolarHBondContact O-CB 3.29Å; N186-S189 PolarHBondContact O-N 2.81Å; N186-S189 WeakPolarHBondContact OD1-CB 3.38Å; N186-S189 PolarHBondContact OD1-N 3.47Å; N186-S189 PolarHBondContact OD1-OG 3.47Å; N186-S189 VanDerWaalsContact OD1-OG 3.1Å; P187-S189 VanDerWaalsContact C-N 3.35Å; P187-S189 PolarHBondContact O-N 3.41Å; S189-Q192 PolarHBondContact O-N 3.37Å; S189-C193 PolarHBondContact O-N 3.47Å
190	L	88.7	Confident	85.3	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62.9	-47	174.4	176.2	62.6	0	0	0	110.9	T179 M180 L183 N186 P187 E188 Q192 C193 L194 Y238	T179-L190 HydrophobicContact CG2-CD1 3.65Å; M180-L190 HydrophobicContact SD-CD1 3.96Å; M180-L190 HydrophobicContact SD-CD2 3.81Å; L183-L190 HydrophobicContact CB-CB 4.4Å; L183-L190 HydrophobicContact CD1-CB 4.37Å; N186-L190 PolarHBondContact O-N 2.94Å; N186-L190 VanDerWaalsContact O-N 3.16Å; P187-L190 PolarHBondContact O-N 2.7Å; E188-L190 VanDerWaalsContact C-N 3.34Å; E188-L190 PolarHBondContact O-N 3.18Å; L190-Q192 VanDerWaalsContact C-N 3.3Å; L190-Q192 PolarHBondContact O-N 3.36Å; L190-C193 WeakPolarHBondContact O-CB 3.47Å; L190-C193 PolarHBondContact O-N 2.93Å; L190-C193 VanDerWaalsContact O-N 3.07Å; L190-L194 HydrophobicContact CD1-CD1 4.11Å; L190-L194 HydrophobicContact CD1-CG 4.08Å; L190-L194 HydrophobicContact CD2-CD1 4.45Å; L190-L194 HydrophobicContact CG-CD1 3.9Å; L190-L194 HydrophobicContact CG-CG 4.28Å; L190-L194 WeakPolarHBondContact O-CG 2.9Å; L190-L194 PolarHBondContact O-N 3.17Å; L190-Y238 HydrophobicContact CD2-CD1 3.39Å; L190-Y238 HydrophobicContact CD2-CE1 3.83Å; L190-Y238 HydrophobicContact CD2-CG 4.09Å
191	I	87.9	Confident	85.1	Confident	14 Å²	14	51.7 Å²	51.7	7%	0.072	25%	0.245	C	C	.	.	H	α-helix	trans	-56.9	-45.5	177.9	-68.8	158.2	0	0	0	110.5	P187 E188 C193 L194 D195 Q244	P187-I191 WeakPolarHBondContact O-CD1 3.26Å; P187-I191 WeakPolarHBondContact O-CG1 3.49Å; P187-I191 PolarHBondContact O-N 3.24Å; E188-I191 PolarHBondContact O-N 2.86Å; I191-C193 VanDerWaalsContact C-N 3.25Å; I191-C193 PolarHBondContact O-N 3.49Å; I191-L194 CarbonylContact O-C 3.41Å; I191-L194 PolarHBondContact O-N 3.02Å; I191-L194 VanDerWaalsContact O-N 3.1Å; I191-D195 WeakPolarHBondContact O-CB 3.39Å; I191-D195 VanDerWaalsContact O-CG 3.23Å; I191-D195 PolarHBondContact O-N 2.91Å; I191-Q244 VanDerWaalsContact CD1-CD 3.45Å; I191-Q244 HydrophobicContact CD1-CG 4.3Å
192	Q	88.6	Confident	84.7	Confident	81 Å²	81	47.1 Å²	47.1	38%	0.379	22%	0.224	S	C	.	.	H	α-helix	trans	-61	-31.2	178.2	-69.1	176.6	36.7	0	0	114	K126 E188 S189 L190	K126-Q192 WeakPolarHBondContact CE-O 3.38Å; E188-Q192 WeakPolarHBondContact O-CG 3.18Å; E188-Q192 PolarHBondContact O-N 2.83Å; S189-Q192 PolarHBondContact O-N 3.37Å; L190-Q192 VanDerWaalsContact C-N 3.3Å; L190-Q192 PolarHBondContact O-N 3.36Å
193	C	89.4	Confident	84	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-74.5	-43.8	173.7	-74.2	0	0	0	0	111.2	W175 T179 S189 L190 I191 D195 L196	W175-C193 HydrophobicContact CH2-CB 4.2Å; W175-C193 HydrophobicContact CZ2-CB 4.05Å; T179-C193 HydrophobicContact CG2-CB 4.17Å; S189-C193 PolarHBondContact O-N 3.47Å; L190-C193 WeakPolarHBondContact O-CB 3.47Å; L190-C193 PolarHBondContact O-N 2.93Å; L190-C193 VanDerWaalsContact O-N 3.07Å; I191-C193 VanDerWaalsContact C-N 3.25Å; I191-C193 PolarHBondContact O-N 3.49Å; C193-D195 VanDerWaalsContact C-N 3.28Å; C193-D195 PolarHBondContact O-N 2.9Å; C193-L196 WeakPolarHBondContact O-CB 3.24Å; C193-L196 PolarHBondContact O-N 2.84Å
194	L	91	Very high	82.4	Confident	2 Å²	2	54 Å²	54	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-66.7	-30.3	177.9	-64	176.9	0	0	0	112	L190 I191 L196 L197 R198 L226 F230 F245	L190-L194 HydrophobicContact CD1-CD1 4.11Å; L190-L194 HydrophobicContact CD1-CG 4.08Å; L190-L194 HydrophobicContact CD2-CD1 4.45Å; L190-L194 HydrophobicContact CG-CD1 3.9Å; L190-L194 HydrophobicContact CG-CG 4.28Å; L190-L194 WeakPolarHBondContact O-CG 2.9Å; L190-L194 PolarHBondContact O-N 3.17Å; I191-L194 CarbonylContact O-C 3.41Å; I191-L194 PolarHBondContact O-N 3.02Å; I191-L194 VanDerWaalsContact O-N 3.1Å; L194-L196 PolarHBondContact O-N 3.36Å; L194-L197 HydrophobicContact CD2-CD1 4.14Å; L194-L197 WeakPolarHBondContact O-CA 3.14Å; L194-L197 VanDerWaalsContact O-CB 3.25Å; L194-L197 WeakPolarHBondContact O-CB 3.49Å; L194-L197 PolarHBondContact O-N 3.36Å; L194-R198 PolarHBondContact O-N 3.48Å; L194-L226 HydrophobicContact CD2-CD1 4.1Å; L194-F230 HydrophobicContact CD1-CE1 4.18Å; L194-F230 HydrophobicContact CD1-CZ 4Å; L194-F230 HydrophobicContact CD2-CE1 4.23Å; L194-F230 HydrophobicContact CD2-CZ 4.19Å; L194-F245 HydrophobicContact CB-CD2 3.37Å; L194-F245 HydrophobicContact CB-CE2 3.59Å; L194-F245 HydrophobicContact CB-CG 4.01Å; L194-F245 HydrophobicContact CB-CZ 4.41Å; L194-F245 HydrophobicContact CD1-CB 3.98Å; L194-F245 HydrophobicContact CD1-CD1 4.44Å; L194-F245 HydrophobicContact CD1-CD2 4.16Å; L194-F245 HydrophobicContact CD1-CG 3.91Å; L194-F245 HydrophobicContact CG-CD2 4.35Å; L194-F245 VanDerWaalsContact O-CE2 3.26Å; L194-F245 WeakPolarHBondContact O-CE2 3.44Å
195	D	88.8	Confident	81	Confident	31 Å²	31	56.7 Å²	56.7	17%	0.166	27%	0.273	C	S	.	.	H	α-helix	trans	-58.2	-33.2	175.5	-79.3	-21	0	0	0	113.3	I191 C193 L197 R198 R199	I191-D195 WeakPolarHBondContact O-CB 3.39Å; I191-D195 VanDerWaalsContact O-CG 3.23Å; I191-D195 PolarHBondContact O-N 2.91Å; C193-D195 VanDerWaalsContact C-N 3.28Å; C193-D195 PolarHBondContact O-N 2.9Å; D195-L197 VanDerWaalsContact C-N 3.32Å; D195-R198 PolarHBondContact O-N 3.09Å; D195-R198 IonicContact OD1-CZ 2.76Å; D195-R198 IonicContact OD1-NE 2.73Å; D195-R198 PolarHBondContact OD1-NE 2.93Å; D195-R198 IonicContact OD1-NH2 3.33Å; D195-R198 PolarHBondContact OD1-NH2 3.41Å; D195-R198 IonicContact OD2-NH2 2.99Å; D195-R199 WeakPolarHBondContact O-CB 3Å; D195-R199 WeakPolarHBondContact O-CG 3.37Å; D195-R199 PolarHBondContact O-N 3.41Å
196	L	87.4	Confident	79.7	Confident	36 Å²	36	49.3 Å²	49.3	19%	0.188	24%	0.24	C	C	.	.	H	α-helix	trans	-64.4	-38.8	172.6	-68	178	0	0	0	111.3	K126 L129 Q130 C193 L194 F200	K126-L196 HydrophobicContact CB-CD1 3.65Å; K126-L196 HydrophobicContact CD-CD1 4.3Å; K126-L196 HydrophobicContact CG-CD1 3.65Å; L129-L196 HydrophobicContact CD2-CB 3.62Å; L129-L196 HydrophobicContact CD2-CD1 4.24Å; Q130-L196 HydrophobicContact CG-CD1 4.29Å; C193-L196 WeakPolarHBondContact O-CB 3.24Å; C193-L196 PolarHBondContact O-N 2.84Å; L194-L196 PolarHBondContact O-N 3.36Å; L196-F200 VanDerWaalsContact O-CB 3.26Å; L196-F200 WeakPolarHBondContact O-CB 3.41Å; L196-F200 PolarHBondContact O-N 3.4Å
197	L	88	Confident	77.9	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-66.3	-44.3	174.4	-76.1	175	0	0	0	112.3	L129 L133 F172 W175 L194 D195 F200 F201 L226	L129-L197 HydrophobicContact CD1-CD2 3.8Å; L129-L197 HydrophobicContact CD1-CG 4.17Å; L129-L197 HydrophobicContact CD2-CD2 4.24Å; L129-L197 HydrophobicContact CD2-CG 3.84Å; L133-L197 HydrophobicContact CD1-CD2 4.18Å; L133-L197 HydrophobicContact CD2-CD2 4.28Å; F172-L197 HydrophobicContact CE2-CD1 4.08Å; F172-L197 HydrophobicContact CE2-CD2 3.69Å; F172-L197 HydrophobicContact CE2-CG 4.45Å; F172-L197 HydrophobicContact CZ-CD1 3.8Å; F172-L197 HydrophobicContact CZ-CD2 3.8Å; F172-L197 HydrophobicContact CZ-CG 4.45Å; W175-L197 HydrophobicContact CH2-CD1 4.2Å; W175-L197 HydrophobicContact CZ3-CD1 3.77Å; L194-L197 HydrophobicContact CD2-CD1 4.14Å; L194-L197 WeakPolarHBondContact O-CA 3.14Å; L194-L197 VanDerWaalsContact O-CB 3.25Å; L194-L197 WeakPolarHBondContact O-CB 3.49Å; L194-L197 PolarHBondContact O-N 3.36Å; D195-L197 VanDerWaalsContact C-N 3.32Å; L197-F200 WeakPolarHBondContact O-CB 2.96Å; L197-F200 PolarHBondContact O-N 2.78Å; L197-F200 VanDerWaalsContact O-N 3.14Å; L197-F201 HydrophobicContact CB-CE2 4.37Å; L197-F201 HydrophobicContact CD2-CE1 4.31Å; L197-F201 HydrophobicContact CD2-CZ 4.03Å; L197-F201 WeakPolarHBondContact O-CB 3.49Å; L197-F201 VanDerWaalsContact O-CG 3.3Å; L197-F201 WeakPolarHBondContact O-CG 3.41Å; L197-F201 PolarHBondContact O-N 3.09Å; L197-L226 HydrophobicContact CD1-CD1 4.13Å; L197-L226 HydrophobicContact CD1-CD2 4.29Å
198	R	88.1	Confident	76.1	Confident	31 Å²	31	53.4 Å²	53.4	12%	0.117	26%	0.263	C	S	.	.	H	α-helix	trans	-57.9	-50.8	176.2	175.9	172.5	65.2	147.3	-25.8	111.1	L194 D195 F200 F201 I202 F245 E248 F249 D252	L194-R198 PolarHBondContact O-N 3.48Å; D195-R198 PolarHBondContact O-N 3.09Å; D195-R198 IonicContact OD1-CZ 2.76Å; D195-R198 IonicContact OD1-NE 2.73Å; D195-R198 PolarHBondContact OD1-NE 2.93Å; D195-R198 IonicContact OD1-NH2 3.33Å; D195-R198 PolarHBondContact OD1-NH2 3.41Å; D195-R198 IonicContact OD2-NH2 2.99Å; R198-F200 PolarHBondContact O-N 3.19Å; R198-F201 PolarHBondContact O-N 2.83Å; R198-I202 HydrophobicContact CG-CD1 3.78Å; R198-I202 WeakPolarHBondContact O-CB 3.4Å; R198-I202 WeakPolarHBondContact O-CG1 3.25Å; R198-I202 PolarHBondContact O-N 3.22Å; R198-F245 HydrophobicContact CB-CE2 3.77Å; R198-F245 HydrophobicContact CB-CZ 4.33Å; R198-E248 IonicContact CZ-OE2 2.7Å; R198-E248 IonicContact NH1-OE2 3.91Å; R198-E248 PolarHBondContact NH1-OE2 3.21Å; R198-E248 IonicContact NH2-OE2 3.39Å; R198-E248 PolarHBondContact NH2-OE2 2.96Å; R198-F249 HydrophobicContact CB-CD2 4.28Å; R198-F249 HydrophobicContact CG-CD2 4.02Å; R198-D252 WeakPolarHBondContact CD-OD2 3.37Å; R198-D252 IonicContact CZ-OD2 3.26Å; R198-D252 IonicContact NE-OD2 3.93Å; R198-D252 PolarHBondContact NE-OD2 3.49Å; R198-D252 VanDerWaalsContact NH1-CG 3.31Å; R198-D252 IonicContact NH1-OD1 2.61Å; R198-D252 PolarHBondContact NH1-OD1 2.88Å; R198-D252 IonicContact NH1-OD2 2.7Å; R198-D252 PolarHBondContact NH1-OD2 3.1Å
199	R	84.4	Confident	74.2	Confident	175 Å²	175	50.3 Å²	50.3	66%	0.66	25%	0.251	S	S	*	.	H	α-helix	trans	-57.2	-40.9	175.1	-73	178.2	-171.6	-173.3	3.9	111.3	D195 S203	D195-R199 WeakPolarHBondContact O-CB 3Å; D195-R199 WeakPolarHBondContact O-CG 3.37Å; D195-R199 PolarHBondContact O-N 3.41Å; R199-S203 WeakPolarHBondContact O-CA 3.46Å; R199-S203 WeakPolarHBondContact O-CB 3.49Å; R199-S203 PolarHBondContact O-N 3.43Å
200	F	82.6	Confident	72.2	Confident	42 Å²	42	53.1 Å²	53.1	18%	0.184	27%	0.271	C	S	.	.	H	α-helix	trans	-65.5	-49.3	179.5	-170.9	-110.5	0	0	0	113.2	L133 L196 L197 R198 I202 S203 W215 L222	L133-F200 HydrophobicContact CB-CD2 4.32Å; L133-F200 HydrophobicContact CB-CE1 4.15Å; L133-F200 HydrophobicContact CB-CE2 3.75Å; L133-F200 HydrophobicContact CB-CZ 3.57Å; L133-F200 HydrophobicContact CD1-CB 4.03Å; L133-F200 HydrophobicContact CD1-CD1 3.89Å; L133-F200 HydrophobicContact CD1-CD2 3.9Å; L133-F200 HydrophobicContact CD1-CE1 4.14Å; L133-F200 HydrophobicContact CD1-CE2 4.16Å; L133-F200 HydrophobicContact CD1-CG 3.7Å; L133-F200 HydrophobicContact CD1-CZ 4.19Å; L133-F200 HydrophobicContact CD2-CD1 3.9Å; L133-F200 HydrophobicContact CD2-CE1 3.52Å; L133-F200 HydrophobicContact CD2-CZ 3.87Å; L133-F200 HydrophobicContact CG-CD1 4.34Å; L133-F200 HydrophobicContact CG-CE1 4.11Å; L133-F200 HydrophobicContact CG-CE2 4.37Å; L133-F200 HydrophobicContact CG-CZ 4.04Å; L196-F200 VanDerWaalsContact O-CB 3.26Å; L196-F200 WeakPolarHBondContact O-CB 3.41Å; L196-F200 PolarHBondContact O-N 3.4Å; L197-F200 WeakPolarHBondContact O-CB 2.96Å; L197-F200 PolarHBondContact O-N 2.78Å; L197-F200 VanDerWaalsContact O-N 3.14Å; R198-F200 PolarHBondContact O-N 3.19Å; F200-I202 VanDerWaalsContact C-N 3.34Å; F200-I202 PolarHBondContact O-N 3.26Å; F200-S203 PolarHBondContact O-OG 3.38Å; F200-W215 HydrophobicContact CD1-CZ2 4.33Å; F200-W215 AromaticContact CE1-CH2 3.49Å; F200-W215 HydrophobicContact CE1-CH2 3.49Å; F200-W215 VanDerWaalsContact CE1-CH2 3.49Å; F200-W215 AromaticContact CE1-CZ2 3.22Å; F200-W215 HydrophobicContact CE1-CZ2 3.22Å; F200-W215 HydrophobicContact CE2-CH2 4.38Å; F200-W215 AromaticContact CE2-CZ2 3.95Å; F200-W215 HydrophobicContact CE2-CZ2 3.95Å; F200-W215 AromaticContact CZ-CH2 3.23Å; F200-W215 HydrophobicContact CZ-CH2 3.23Å; F200-W215 AromaticContact CZ-CZ2 3.03Å; F200-W215 HydrophobicContact CZ-CZ2 3.03Å; F200-L222 HydrophobicContact CE1-CD1 4.47Å
201	F	84	Confident	70.5	Confident	8 Å²	8	56.1 Å²	56.1	4%	0.035	29%	0.287	C	S	.	.	H	α-helix	trans	-66.8	-33.1	-179.8	-65.7	-18.3	0	0	0	113.2	L197 R198 I219 L222 N223 L226 F249 L285	L197-F201 HydrophobicContact CB-CE2 4.37Å; L197-F201 HydrophobicContact CD2-CE1 4.31Å; L197-F201 HydrophobicContact CD2-CZ 4.03Å; L197-F201 WeakPolarHBondContact O-CB 3.49Å; L197-F201 VanDerWaalsContact O-CG 3.3Å; L197-F201 WeakPolarHBondContact O-CG 3.41Å; L197-F201 PolarHBondContact O-N 3.09Å; R198-F201 PolarHBondContact O-N 2.83Å; F201-I219 HydrophobicContact CD1-CG1 4.47Å; F201-I219 HydrophobicContact CD1-CG2 3.69Å; F201-I219 HydrophobicContact CE1-CG2 4.16Å; F201-I219 HydrophobicContact CG-CG2 4.26Å; F201-L222 HydrophobicContact CE1-CB 4.06Å; F201-L222 HydrophobicContact CE1-CD1 4.48Å; F201-L222 HydrophobicContact CZ-CB 4.04Å; F201-N223 HydrophobicContact CE2-CB 4.3Å; F201-N223 HydrophobicContact CZ-CB 4.4Å; F201-L226 HydrophobicContact CE2-CD2 4.03Å; F201-F249 HydrophobicContact CB-CE2 3.96Å; F201-F249 HydrophobicContact CB-CZ 4.46Å; F201-F249 AromaticContact CD2-CE2 3.92Å; F201-F249 HydrophobicContact CD2-CE2 3.92Å; F201-F249 HydrophobicContact CG-CE2 4.47Å; F201-L285 HydrophobicContact CB-CD1 4.39Å
202	I	78.3	Confident	69	Low	19 Å²	19	56 Å²	56	10%	0.097	29%	0.287	C	S	.	.	H	α-helix	trans	-97.9	-15.1	-176.1	-56.1	177.1	0	0	0	112.1	R198 F200 K204 F249 D252 V253 M256	R198-I202 HydrophobicContact CG-CD1 3.78Å; R198-I202 WeakPolarHBondContact O-CB 3.4Å; R198-I202 WeakPolarHBondContact O-CG1 3.25Å; R198-I202 PolarHBondContact O-N 3.22Å; F200-I202 VanDerWaalsContact C-N 3.34Å; F200-I202 PolarHBondContact O-N 3.26Å; I202-K204 PolarHBondContact O-N 2.93Å; I202-F249 HydrophobicContact CD1-CD2 3.9Å; I202-F249 HydrophobicContact CD1-CE2 3.88Å; I202-F249 HydrophobicContact CD1-CG 4.44Å; I202-F249 HydrophobicContact CD1-CZ 4.42Å; I202-F249 HydrophobicContact CG1-CD2 4.42Å; I202-F249 HydrophobicContact CG1-CE2 3.9Å; I202-F249 HydrophobicContact CG1-CZ 4.33Å; I202-D252 HydrophobicContact CD1-CB 3.51Å; I202-V253 HydrophobicContact CD1-CG2 3.77Å; I202-V253 HydrophobicContact CG1-CG2 4.11Å; I202-M256 HydrophobicContact CG2-CB 4.19Å; I202-M256 HydrophobicContact CG2-CG 4.22Å
203	S	70.4	Confident	67.7	Low	46 Å²	46	58.3 Å²	58.3	32%	0.322	30%	0.302	S	S	.	.			trans	-45	133.3	-170.6	56	0	0	0	0	113.4	R199 F200 D205	R199-S203 WeakPolarHBondContact O-CA 3.46Å; R199-S203 WeakPolarHBondContact O-CB 3.49Å; R199-S203 PolarHBondContact O-N 3.43Å; F200-S203 PolarHBondContact O-OG 3.38Å; S203-D205 PolarHBondContact O-N 2.94Å
204	K	52.4	Low	66.4	Low	135 Å²	135	62.1 Å²	62.1	59%	0.587	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-19.1	175.9	-62.7	-176.5	-175	-176.7	0	112	I202 E259	I202-K204 PolarHBondContact O-N 2.93Å; K204-E259 VanDerWaalsContact CE-OE2 3.24Å; K204-E259 WeakPolarHBondContact CE-OE2 3.42Å; K204-E259 IonicContact NZ-OE1 2.55Å; K204-E259 PolarHBondContact NZ-OE1 3.39Å; K204-E259 IonicContact NZ-OE2 2.68Å; K204-E259 PolarHBondContact NZ-OE2 3.23Å
205	D	44.5	Very low	65.3	Low	126 Å²	126	62.1 Å²	62.1	67%	0.674	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	12.3	-163.6	-65.4	-30.5	0	0	0	115.6	S203 L207	S203-D205 PolarHBondContact O-N 2.94Å; D205-L207 WeakPolarHBondContact O-CD1 3.36Å; D205-L207 VanDerWaalsContact O-CG 3.22Å; D205-L207 WeakPolarHBondContact O-CG 3.38Å; D205-L207 PolarHBondContact O-N 3.43Å
206	V	44.4	Very low	64.7	Low	32 Å²	32	61.8 Å²	61.8	19%	0.194	32%	0.321	C	S	.	.	S	Bend	trans	-75.7	84.3	164.4	-171.4	0	0	0	0	108.5	Y137	Y137-V206 HydrophobicContact CE2-CG1 4.39Å
207	L	42.8	Very low	64	Low	132 Å²	132	62.1 Å²	62.1	69%	0.691	33%	0.326	S	S	*	.			trans	-55.5	147.2	-172.9	-71.5	138	0	0	0	113.7	D205	D205-L207 WeakPolarHBondContact O-CD1 3.36Å; D205-L207 VanDerWaalsContact O-CG 3.22Å; D205-L207 WeakPolarHBondContact O-CG 3.38Å; D205-L207 PolarHBondContact O-N 3.43Å
208	S	43.2	Very low	63.3	Low	66 Å²	66	62.5 Å²	62.5	46%	0.462	33%	0.328	S	S	.	.			trans	76	128.2	171.8	76.5	0	0	0	0	117.3	S210 R278	S208-S210 PolarHBondContact O-N 2.87Å; S208-S210 VanDerWaalsContact O-N 3.11Å; S208-R278 PolarHBondContact O-NH2 3.38Å; S208-R278 VanDerWaalsContact O-NH2 3.1Å
209	D	47.3	Very low	63	Low	75 Å²	75	61.4 Å²	61.4	40%	0.401	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-9.3	-178.2	-79.8	-27.3	0	0	0	114.6	L274	D209-L274 HydrophobicContact CB-CD1 3.57Å; D209-L274 WeakPolarHBondContact O-CD1 3.49Å; D209-L274 WeakPolarHBondContact O-CD2 3.33Å
210	S	45.1	Very low	63	Low	64 Å²	64	54.8 Å²	54.8	45%	0.448	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-20.5	-165.1	45.6	0	0	0	0	117.6	S208	S208-S210 PolarHBondContact O-N 2.87Å; S208-S210 VanDerWaalsContact O-N 3.11Å
211	D	51.3	Low	63.1	Low	63 Å²	63	55.9 Å²	55.9	34%	0.337	31%	0.308	S	S	.	.			trans	-141.7	28.4	-154.1	-59.5	-65.6	0	0	0	117.8	F141 K145	F141-D211 HydrophobicContact CE2-CB 4.28Å; F141-D211 WeakPolarHBondContact CE2-O 3.22Å; F141-D211 HydrophobicContact CZ-CB 4.33Å; K145-D211 HydrophobicContact CD-CB 4.19Å; K145-D211 WeakPolarHBondContact CE-OD2 3.34Å; K145-D211 IonicContact NZ-OD2 2.59Å; K145-D211 PolarHBondContact NZ-OD2 3.5Å
212	S	57.6	Low	63.2	Low	12 Å²	12	55.6 Å²	55.6	8%	0.084	31%	0.307	C	S	.	.			trans	-79.1	-16.5	-168.3	69.6	0	0	0	0	117.8	L214 W215 D216	S212-L214 PolarHBondContact O-N 3.17Å; S212-W215 WeakPolarHBondContact O-CB 3.43Å; S212-W215 PolarHBondContact O-N 2.93Å; S212-D216 WeakPolarHBondContact CB-OD2 3.45Å; S212-D216 PolarHBondContact O-N 3.03Å; S212-D216 PolarHBondContact OG-OD2 3.01Å
213	N	61.8	Low	63.8	Low	129 Å²	129	54.7 Å²	54.7	69%	0.69	30%	0.302	S	S	*	.	H	α-helix	trans	-58.6	-42.9	-161.5	-67.5	-9.8	0	0	0	116.5	W215 S217	N213-W215 VanDerWaalsContact C-N 3.3Å; N213-S217 PolarHBondContact O-N 3.16Å
214	L	61.2	Low	64.7	Low	80 Å²	80	55.7 Å²	55.7	42%	0.419	30%	0.303	S	S	.	.	H	α-helix	trans	-69.7	-34.6	179.3	-71.9	158.4	0	0	0	111.9	F144 S212 S217 T218	F144-L214 HydrophobicContact CD1-CD1 3.04Å; F144-L214 HydrophobicContact CD1-CG 4.36Å; F144-L214 HydrophobicContact CE1-CD1 3.25Å; F144-L214 HydrophobicContact CE1-CD2 4.21Å; F144-L214 HydrophobicContact CE1-CG 4.3Å; F144-L214 HydrophobicContact CG-CD1 3.93Å; F144-L214 HydrophobicContact CZ-CD1 4.31Å; S212-L214 PolarHBondContact O-N 3.17Å; L214-S217 PolarHBondContact O-N 3.4Å; L214-T218 PolarHBondContact O-N 3.24Å; L214-T218 PolarHBondContact O-OG1 3.43Å
215	W	68.7	Low	66.5	Low	2 Å²	2	50 Å²	50	1%	0.008	28%	0.279	C	S	.	.	H	α-helix	trans	-72.8	-43.5	178.8	-175.4	-114.5	0	0	0	111	Y137 F141 F200 S212 N213 S217 T218 I219	Y137-W215 AromaticContact CD2-CD2 3.58Å; Y137-W215 HydrophobicContact CD2-CD2 3.58Å; Y137-W215 AromaticContact CD2-CE2 3.64Å; Y137-W215 AromaticContact CD2-CE3 3.71Å; Y137-W215 HydrophobicContact CD2-CE3 3.71Å; Y137-W215 HydrophobicContact CD2-CG 4.21Å; Y137-W215 HydrophobicContact CD2-CH2 4.12Å; Y137-W215 AromaticContact CD2-CZ2 3.94Å; Y137-W215 HydrophobicContact CD2-CZ2 3.94Å; Y137-W215 AromaticContact CD2-CZ3 3.98Å; Y137-W215 HydrophobicContact CD2-CZ3 3.98Å; Y137-W215 HydrophobicContact CE2-CD2 4.09Å; Y137-W215 HydrophobicContact CE2-CG 4.25Å; Y137-W215 HydrophobicContact CG-CZ3 4.45Å; F141-W215 HydrophobicContact CD2-CB 3.97Å; F200-W215 HydrophobicContact CD1-CZ2 4.33Å; F200-W215 AromaticContact CE1-CH2 3.49Å; F200-W215 HydrophobicContact CE1-CH2 3.49Å; F200-W215 VanDerWaalsContact CE1-CH2 3.49Å; F200-W215 AromaticContact CE1-CZ2 3.22Å; F200-W215 HydrophobicContact CE1-CZ2 3.22Å; F200-W215 HydrophobicContact CE2-CH2 4.38Å; F200-W215 AromaticContact CE2-CZ2 3.95Å; F200-W215 HydrophobicContact CE2-CZ2 3.95Å; F200-W215 AromaticContact CZ-CH2 3.23Å; F200-W215 HydrophobicContact CZ-CH2 3.23Å; F200-W215 AromaticContact CZ-CZ2 3.03Å; F200-W215 HydrophobicContact CZ-CZ2 3.03Å; S212-W215 WeakPolarHBondContact O-CB 3.43Å; S212-W215 PolarHBondContact O-N 2.93Å; N213-W215 VanDerWaalsContact C-N 3.3Å; W215-S217 VanDerWaalsContact C-N 3.27Å; W215-S217 PolarHBondContact O-N 2.77Å; W215-T218 HydrophobicContact CE3-CG2 4.25Å; W215-T218 HydrophobicContact CH2-CG2 4.42Å; W215-T218 HydrophobicContact CZ3-CG2 3.78Å; W215-T218 CarbonylContact O-C 3.59Å; W215-T218 WeakPolarHBondContact O-CA 3.32Å; W215-T218 WeakPolarHBondContact O-CB 3.4Å; W215-T218 PolarHBondContact O-N 3.26Å; W215-I219 HydrophobicContact CD2-CD1 4.5Å; W215-I219 HydrophobicContact CD2-CG1 4.47Å; W215-I219 HydrophobicContact CG-CD1 4.41Å; W215-I219 HydrophobicContact CZ2-CD1 4.16Å; W215-I219 HydrophobicContact CZ2-CG1 3.91Å; W215-I219 PolarHBondContact O-N 3.49Å
216	D	75	Confident	68.7	Low	25 Å²	25	44 Å²	44	13%	0.134	25%	0.247	C	C	.	.	H	α-helix	trans	-57.2	-42	170.7	-63.6	-22.5	0	0	0	110.4	S212 T218 I219 L220 H281	S212-D216 WeakPolarHBondContact CB-OD2 3.45Å; S212-D216 PolarHBondContact O-N 3.03Å; S212-D216 PolarHBondContact OG-OD2 3.01Å; D216-T218 VanDerWaalsContact C-N 3.35Å; D216-T218 PolarHBondContact O-N 3.47Å; D216-I219 PolarHBondContact O-N 2.88Å; D216-L220 WeakPolarHBondContact O-CB 3.34Å; D216-L220 PolarHBondContact O-N 3.23Å; D216-H281 PolarHBondContact O-CE1 3.35Å; D216-H281 PolarHBondContact O-NE2 3.35Å
217	S	73.2	Confident	71	Confident	42 Å²	42	42.9 Å²	42.9	29%	0.294	24%	0.24	S	C	.	.	H	α-helix	trans	-61.9	-41.9	172.7	174.3	0	0	0	0	112.1	K165 N213 L214 W215 L220 E221	K165-S217 PolarHBondContact NZ-OG 3.14Å; N213-S217 PolarHBondContact O-N 3.16Å; L214-S217 PolarHBondContact O-N 3.4Å; W215-S217 VanDerWaalsContact C-N 3.27Å; W215-S217 PolarHBondContact O-N 2.77Å; S217-L220 PolarHBondContact O-N 2.99Å; S217-E221 WeakPolarHBondContact O-CG 3.42Å; S217-E221 PolarHBondContact O-N 3.22Å
218	T	73.2	Confident	73.3	Confident	8 Å²	8	40.5 Å²	40.5	5%	0.049	24%	0.235	C	C	.	.	H	α-helix	trans	-65.5	-47.2	178.7	-56	0	0	0	0	110.8	L140 L214 W215 D216 L220 E221 L222	L140-T218 HydrophobicContact CD1-CG2 3.68Å; L140-T218 WeakPolarHBondContact CD1-OG1 3.07Å; L214-T218 PolarHBondContact O-N 3.24Å; L214-T218 PolarHBondContact O-OG1 3.43Å; W215-T218 HydrophobicContact CE3-CG2 4.25Å; W215-T218 HydrophobicContact CH2-CG2 4.42Å; W215-T218 HydrophobicContact CZ3-CG2 3.78Å; W215-T218 CarbonylContact O-C 3.59Å; W215-T218 WeakPolarHBondContact O-CA 3.32Å; W215-T218 WeakPolarHBondContact O-CB 3.4Å; W215-T218 PolarHBondContact O-N 3.26Å; D216-T218 VanDerWaalsContact C-N 3.35Å; D216-T218 PolarHBondContact O-N 3.47Å; T218-L220 VanDerWaalsContact C-N 3.27Å; T218-L220 PolarHBondContact O-N 3.4Å; T218-E221 PolarHBondContact O-N 3.13Å; T218-L222 HydrophobicContact CG2-CD1 4.25Å; T218-L222 HydrophobicContact CG2-CG 4.41Å; T218-L222 VanDerWaalsContact O-CG 3.28Å; T218-L222 WeakPolarHBondContact O-CG 3.42Å; T218-L222 PolarHBondContact O-N 3.21Å
219	I	82.2	Confident	75.5	Confident	8 Å²	8	37.8 Å²	37.8	4%	0.041	22%	0.216	C	C	.	.	H	α-helix	trans	-56.4	-44.2	174.7	-72.1	170.6	0	0	0	110.5	F201 W215 D216 E221 L222 N223 L285	F201-I219 HydrophobicContact CD1-CG1 4.47Å; F201-I219 HydrophobicContact CD1-CG2 3.69Å; F201-I219 HydrophobicContact CE1-CG2 4.16Å; F201-I219 HydrophobicContact CG-CG2 4.26Å; W215-I219 HydrophobicContact CD2-CD1 4.5Å; W215-I219 HydrophobicContact CD2-CG1 4.47Å; W215-I219 HydrophobicContact CG-CD1 4.41Å; W215-I219 HydrophobicContact CZ2-CD1 4.16Å; W215-I219 HydrophobicContact CZ2-CG1 3.91Å; W215-I219 PolarHBondContact O-N 3.49Å; D216-I219 PolarHBondContact O-N 2.88Å; I219-E221 PolarHBondContact O-N 3.45Å; I219-L222 PolarHBondContact O-N 2.8Å; I219-N223 VanDerWaalsContact O-CB 3.26Å; I219-N223 WeakPolarHBondContact O-CB 3.45Å; I219-N223 PolarHBondContact O-N 3.4Å; I219-L285 HydrophobicContact CG2-CD1 3.52Å; I219-L285 HydrophobicContact CG2-CD2 3.97Å; I219-L285 HydrophobicContact CG2-CG 4.4Å
220	L	84.6	Confident	77.5	Confident	37 Å²	37	34.2 Å²	34.2	19%	0.194	20%	0.197	C	C	.	.	H	α-helix	trans	-59.2	-47.5	177	-179.9	59.5	0	0	0	111.8	D216 S217 T218 N223 L224 L285 N288	D216-L220 WeakPolarHBondContact O-CB 3.34Å; D216-L220 PolarHBondContact O-N 3.23Å; S217-L220 PolarHBondContact O-N 2.99Å; T218-L220 VanDerWaalsContact C-N 3.27Å; T218-L220 PolarHBondContact O-N 3.4Å; L220-N223 WeakPolarHBondContact O-CB 3.39Å; L220-N223 PolarHBondContact O-N 3.07Å; L220-L224 HydrophobicContact CD1-CD1 4.41Å; L220-L224 HydrophobicContact CD1-CG 4.32Å; L220-L224 HydrophobicContact CG-CD1 4.19Å; L220-L224 VanDerWaalsContact O-CG 3.29Å; L220-L224 WeakPolarHBondContact O-CG 3.37Å; L220-L224 PolarHBondContact O-N 3.5Å; L220-L285 HydrophobicContact CB-CD2 4.39Å; L220-L285 HydrophobicContact CD1-CD2 3.96Å; L220-N288 WeakPolarHBondContact CD1-ND2 3.32Å
221	E	83.7	Confident	79.7	Confident	64 Å²	64	35.8 Å²	35.8	30%	0.299	20%	0.196	S	C	.	.	H	α-helix	trans	-62.6	-44.2	178.1	-65.9	-58.5	160.6	0	0	111.8	E169 S217 T218 I219 N223 L224 I225	E169-E221 HydrophobicContact CG-CB 4.49Å; S217-E221 WeakPolarHBondContact O-CG 3.42Å; S217-E221 PolarHBondContact O-N 3.22Å; T218-E221 PolarHBondContact O-N 3.13Å; I219-E221 PolarHBondContact O-N 3.45Å; E221-N223 VanDerWaalsContact C-N 3.3Å; E221-N223 PolarHBondContact O-N 3.45Å; E221-L224 PolarHBondContact O-N 3.46Å; E221-I225 VanDerWaalsContact O-CG1 3.29Å; E221-I225 WeakPolarHBondContact O-CG1 3.47Å; E221-I225 PolarHBondContact O-N 3.18Å
222	L	86.8	Confident	81.4	Confident	3 Å²	3	36.3 Å²	36.3	2%	0.016	21%	0.209	C	C	.	.	H	α-helix	trans	-60	-42.3	175.1	-62	176.4	0	0	0	111	L133 F172 F200 F201 T218 I219 L224 I225 L226	L133-L222 HydrophobicContact CD2-CD1 3.99Å; F172-L222 HydrophobicContact CB-CD2 3.62Å; F172-L222 HydrophobicContact CD1-CB 4.11Å; F172-L222 HydrophobicContact CD1-CD2 3.33Å; F172-L222 HydrophobicContact CD1-CG 4.29Å; F172-L222 HydrophobicContact CD2-CD2 4.08Å; F172-L222 HydrophobicContact CE1-CB 3.86Å; F172-L222 HydrophobicContact CE1-CD2 3.96Å; F172-L222 HydrophobicContact CE1-CG 4.48Å; F172-L222 VanDerWaalsContact CE1-O 3.31Å; F172-L222 WeakPolarHBondContact CE1-O 3.19Å; F172-L222 HydrophobicContact CG-CD2 3.39Å; F172-L222 HydrophobicContact CZ-CB 4.38Å; F200-L222 HydrophobicContact CE1-CD1 4.47Å; F201-L222 HydrophobicContact CE1-CB 4.06Å; F201-L222 HydrophobicContact CE1-CD1 4.48Å; F201-L222 HydrophobicContact CZ-CB 4.04Å; T218-L222 HydrophobicContact CG2-CD1 4.25Å; T218-L222 HydrophobicContact CG2-CG 4.41Å; T218-L222 VanDerWaalsContact O-CG 3.28Å; T218-L222 WeakPolarHBondContact O-CG 3.42Å; T218-L222 PolarHBondContact O-N 3.21Å; I219-L222 PolarHBondContact O-N 2.8Å; L222-L224 PolarHBondContact O-N 3.46Å; L222-I225 PolarHBondContact O-N 2.89Å; L222-L226 WeakPolarHBondContact O-CB 3.43Å; L222-L226 PolarHBondContact O-N 3.34Å
223	N	89.7	Confident	82.9	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-65	-37.3	176.5	-177.3	-101.3	0	0	0	112.5	F201 I219 L220 E221 L226 S227 L285 L289	F201-N223 HydrophobicContact CE2-CB 4.3Å; F201-N223 HydrophobicContact CZ-CB 4.4Å; I219-N223 VanDerWaalsContact O-CB 3.26Å; I219-N223 WeakPolarHBondContact O-CB 3.45Å; I219-N223 PolarHBondContact O-N 3.4Å; L220-N223 WeakPolarHBondContact O-CB 3.39Å; L220-N223 PolarHBondContact O-N 3.07Å; E221-N223 VanDerWaalsContact C-N 3.3Å; E221-N223 PolarHBondContact O-N 3.45Å; N223-L226 PolarHBondContact O-N 3.39Å; N223-S227 WeakPolarHBondContact O-CB 3.27Å; N223-S227 PolarHBondContact O-N 2.94Å; N223-S227 PolarHBondContact O-OG 3.41Å; N223-L285 HydrophobicContact CB-CD2 3.73Å; N223-L285 PolarHBondContact OD1-O 3.5Å; N223-L285 VanDerWaalsContact OD1-O 3.14Å; N223-L289 WeakPolarHBondContact ND2-CD1 3.33Å
224	L	90.4	Very high	84	Confident	67 Å²	67	31.7 Å²	31.7	35%	0.351	18%	0.182	S	C	.	.	H	α-helix	trans	-67.6	-40.6	174.4	-70.8	172.3	0	0	0	112	L220 E221 L222 L226 S227 S228 N288	L220-L224 HydrophobicContact CD1-CD1 4.41Å; L220-L224 HydrophobicContact CD1-CG 4.32Å; L220-L224 HydrophobicContact CG-CD1 4.19Å; L220-L224 VanDerWaalsContact O-CG 3.29Å; L220-L224 WeakPolarHBondContact O-CG 3.37Å; L220-L224 PolarHBondContact O-N 3.5Å; E221-L224 PolarHBondContact O-N 3.46Å; L222-L224 PolarHBondContact O-N 3.46Å; L224-L226 VanDerWaalsContact C-N 3.35Å; L224-S227 PolarHBondContact O-N 3.14Å; L224-S228 WeakPolarHBondContact O-CB 3.42Å; L224-S228 PolarHBondContact O-N 3Å; L224-N288 HydrophobicContact CD2-CB 4.01Å
225	I	89.6	Confident	85.1	Confident	14 Å²	14	34.7 Å²	34.7	7%	0.072	20%	0.198	C	C	.	.	H	α-helix	trans	-61.9	-45.8	173.7	-64.9	166	0	0	0	110	E169 F172 R173 I176 E221 L222 S228 S229	E169-I225 HydrophobicContact CB-CD1 3.96Å; E169-I225 HydrophobicContact CG-CD1 4.19Å; F172-I225 HydrophobicContact CD1-CB 4.15Å; F172-I225 HydrophobicContact CD1-CD1 4.23Å; F172-I225 HydrophobicContact CD1-CG2 4Å; F172-I225 HydrophobicContact CE1-CB 4.31Å; F172-I225 HydrophobicContact CE1-CG2 4.32Å; R173-I225 HydrophobicContact CB-CG2 3.85Å; R173-I225 HydrophobicContact CG-CG2 4.06Å; I176-I225 HydrophobicContact CD1-CG2 3.79Å; E221-I225 VanDerWaalsContact O-CG1 3.29Å; E221-I225 WeakPolarHBondContact O-CG1 3.47Å; E221-I225 PolarHBondContact O-N 3.18Å; L222-I225 PolarHBondContact O-N 2.89Å; I225-S228 PolarHBondContact O-N 3.36Å; I225-S229 PolarHBondContact O-N 2.92Å
226	L	91.9	Very high	85.9	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59.6	-49	176.7	-176.1	67.6	0	0	0	111.3	I176 L194 L197 F201 L222 N223 L224 S228 S229 F230 F245 L289	I176-L226 HydrophobicContact CD1-CB 4.2Å; I176-L226 HydrophobicContact CD1-CD1 3.99Å; I176-L226 HydrophobicContact CG1-CD1 4.42Å; L194-L226 HydrophobicContact CD2-CD1 4.1Å; L197-L226 HydrophobicContact CD1-CD1 4.13Å; L197-L226 HydrophobicContact CD1-CD2 4.29Å; F201-L226 HydrophobicContact CE2-CD2 4.03Å; L222-L226 WeakPolarHBondContact O-CB 3.43Å; L222-L226 PolarHBondContact O-N 3.34Å; N223-L226 PolarHBondContact O-N 3.39Å; L224-L226 VanDerWaalsContact C-N 3.35Å; L226-S228 VanDerWaalsContact C-N 3.32Å; L226-S228 PolarHBondContact O-N 2.84Å; L226-S229 PolarHBondContact O-N 3.44Å; L226-F230 HydrophobicContact CD1-CD1 4.08Å; L226-F230 HydrophobicContact CD1-CE1 3.43Å; L226-F230 VanDerWaalsContact CD1-CE1 3.43Å; L226-F230 HydrophobicContact CD1-CE2 4.28Å; L226-F230 HydrophobicContact CD1-CZ 3.55Å; L226-F230 HydrophobicContact CD2-CE2 4.09Å; L226-F230 HydrophobicContact CD2-CZ 3.96Å; L226-F230 HydrophobicContact CG-CD1 4.37Å; L226-F230 HydrophobicContact CG-CD2 4.36Å; L226-F230 HydrophobicContact CG-CE1 3.94Å; L226-F230 HydrophobicContact CG-CE2 3.9Å; L226-F230 HydrophobicContact CG-CZ 3.69Å; L226-F230 WeakPolarHBondContact O-CG 3.5Å; L226-F230 PolarHBondContact O-N 3.23Å; L226-F245 HydrophobicContact CD2-CE1 3.94Å; L226-F245 HydrophobicContact CD2-CZ 4.13Å; L226-L289 HydrophobicContact CD2-CD2 4.37Å
227	S	91.5	Very high	86.3	Confident	9 Å²	9	42.2 Å²	42.2	6%	0.063	24%	0.24	C	C	.	.	H	α-helix	trans	-60.8	-41.5	179.9	-55.5	0	0	0	0	111.7	N223 L224 F230 K231 N288 L289 S292	N223-S227 WeakPolarHBondContact O-CB 3.27Å; N223-S227 PolarHBondContact O-N 2.94Å; N223-S227 PolarHBondContact O-OG 3.41Å; L224-S227 PolarHBondContact O-N 3.14Å; S227-F230 PolarHBondContact O-N 2.88Å; S227-K231 PolarHBondContact O-N 3.3Å; S227-N288 PolarHBondContact OG-O 3.46Å; S227-L289 WeakPolarHBondContact OG-CA 3.23Å; S227-L289 PolarHBondContact OG-N 2.89Å; S227-S292 WeakPolarHBondContact O-CB 3.31Å
228	S	90.7	Very high	86.9	Confident	83 Å²	83	40.4 Å²	40.4	58%	0.58	23%	0.227	S	C	*	.	H	α-helix	trans	-63.7	-43.4	175.5	-176.3	0	0	0	0	112	L224 I225 L226 K231 A232	L224-S228 WeakPolarHBondContact O-CB 3.42Å; L224-S228 PolarHBondContact O-N 3Å; I225-S228 PolarHBondContact O-N 3.36Å; L226-S228 VanDerWaalsContact C-N 3.32Å; L226-S228 PolarHBondContact O-N 2.84Å; S228-K231 PolarHBondContact O-N 3.06Å; S228-A232 PolarHBondContact O-N 2.68Å; S228-A232 VanDerWaalsContact O-N 3.11Å
229	S	89.3	Confident	87.5	Confident	9 Å²	9	45.1 Å²	45.1	6%	0.063	24%	0.244	C	C	.	.	H	α-helix	trans	-63.8	-43.8	175.2	-179	0	0	0	0	111.7	I176 I225 L226 K231 A232 H233	I176-S229 WeakPolarHBondContact CG2-OG 3.41Å; I225-S229 PolarHBondContact O-N 2.92Å; L226-S229 PolarHBondContact O-N 3.44Å; S229-K231 VanDerWaalsContact C-N 3.35Å; S229-K231 PolarHBondContact O-N 2.78Å; S229-A232 WeakPolarHBondContact O-CB 3.32Å; S229-A232 PolarHBondContact O-N 2.55Å; S229-A232 VanDerWaalsContact O-N 3.12Å; S229-H233 PolarHBondContact O-CD2 3.14Å; S229-H233 PolarHBondContact O-N 2.7Å; S229-H233 VanDerWaalsContact O-N 3.08Å
230	F	90.9	Very high	87.8	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-56.7	-49.6	175	-75.4	-1	0	0	0	111.2	M180 L194 L226 S227 A232 H233 L234 I242 F245 L289	M180-F230 HydrophobicContact CE-CD1 3.67Å; M180-F230 HydrophobicContact CE-CE1 3.73Å; L194-F230 HydrophobicContact CD1-CE1 4.18Å; L194-F230 HydrophobicContact CD1-CZ 4Å; L194-F230 HydrophobicContact CD2-CE1 4.23Å; L194-F230 HydrophobicContact CD2-CZ 4.19Å; L226-F230 HydrophobicContact CD1-CD1 4.08Å; L226-F230 HydrophobicContact CD1-CE1 3.43Å; L226-F230 VanDerWaalsContact CD1-CE1 3.43Å; L226-F230 HydrophobicContact CD1-CE2 4.28Å; L226-F230 HydrophobicContact CD1-CZ 3.55Å; L226-F230 HydrophobicContact CD2-CE2 4.09Å; L226-F230 HydrophobicContact CD2-CZ 3.96Å; L226-F230 HydrophobicContact CG-CD1 4.37Å; L226-F230 HydrophobicContact CG-CD2 4.36Å; L226-F230 HydrophobicContact CG-CE1 3.94Å; L226-F230 HydrophobicContact CG-CE2 3.9Å; L226-F230 HydrophobicContact CG-CZ 3.69Å; L226-F230 WeakPolarHBondContact O-CG 3.5Å; L226-F230 PolarHBondContact O-N 3.23Å; S227-F230 PolarHBondContact O-N 2.88Å; F230-A232 PolarHBondContact O-N 2.74Å; F230-H233 CarbonylContact O-C 3.51Å; F230-H233 WeakPolarHBondContact O-CA 3.48Å; F230-H233 PolarHBondContact O-N 3.19Å; F230-L234 VanDerWaalsContact O-CG 3.31Å; F230-L234 WeakPolarHBondContact O-CG 3.24Å; F230-L234 PolarHBondContact O-N 2.9Å; F230-I242 HydrophobicContact CB-CD1 4.48Å; F230-I242 HydrophobicContact CB-CG2 3.85Å; F230-I242 HydrophobicContact CD1-CD1 4.17Å; F230-I242 HydrophobicContact CD1-CG1 3.89Å; F230-I242 HydrophobicContact CD1-CG2 4.15Å; F230-I242 HydrophobicContact CD2-CG2 3.67Å; F230-I242 HydrophobicContact CE1-CG1 4.12Å; F230-I242 HydrophobicContact CE2-CG2 4.19Å; F230-I242 HydrophobicContact CG-CD1 4.47Å; F230-I242 HydrophobicContact CG-CG1 4.25Å; F230-I242 HydrophobicContact CG-CG2 3.64Å; F230-F245 AromaticContact CE2-CD1 3.42Å; F230-F245 HydrophobicContact CE2-CD1 3.42Å; F230-F245 VanDerWaalsContact CE2-CD1 3.42Å; F230-F245 AromaticContact CE2-CE1 3.6Å; F230-F245 HydrophobicContact CE2-CE1 3.6Å; F230-F245 AromaticContact CZ-CD1 3.49Å; F230-F245 HydrophobicContact CZ-CD1 3.49Å; F230-F245 VanDerWaalsContact CZ-CD1 3.49Å; F230-F245 AromaticContact CZ-CE1 3.71Å; F230-F245 HydrophobicContact CZ-CE1 3.71Å; F230-F245 HydrophobicContact CZ-CG 4.32Å; F230-L289 HydrophobicContact CD2-CD2 3.65Å; F230-L289 HydrophobicContact CE2-CD2 3.6Å
231	K	90.1	Very high	88	Confident	97 Å²	97	48 Å²	48	42%	0.422	26%	0.264	S	S	.	.	H	α-helix	trans	-52.7	-43.4	175.9	-172.5	167.8	-177	161.2	0	112.2	S227 S228 S229 H233 D295	S227-K231 PolarHBondContact O-N 3.3Å; S228-K231 PolarHBondContact O-N 3.06Å; S229-K231 VanDerWaalsContact C-N 3.35Å; S229-K231 PolarHBondContact O-N 2.78Å; K231-H233 VanDerWaalsContact C-N 3.26Å; K231-H233 PolarHBondContact O-N 3.34Å; K231-D295 VanDerWaalsContact CE-OD2 3.24Å; K231-D295 WeakPolarHBondContact CE-OD2 3.48Å; K231-D295 IonicContact NZ-OD2 2.63Å; K231-D295 PolarHBondContact NZ-OD2 2.93Å
232	A	88.1	Confident	88.3	Confident	74 Å²	74	45 Å²	45	61%	0.612	25%	0.249	S	C	*	.	H	α-helix	trans	-66.7	-26.1	177.9	0	0	0	0	0	113.5	S228 S229 F230	S228-A232 PolarHBondContact O-N 2.68Å; S228-A232 VanDerWaalsContact O-N 3.11Å; S229-A232 WeakPolarHBondContact O-CB 3.32Å; S229-A232 PolarHBondContact O-N 2.55Å; S229-A232 VanDerWaalsContact O-N 3.12Å; F230-A232 PolarHBondContact O-N 2.74Å
233	H	87.7	Confident	88.5	Confident	42 Å²	42	45.9 Å²	45.9	19%	0.194	26%	0.255	C	S	.	.	H	α-helix	trans	-104.6	2.4	-177	-70.6	-69.9	0	0	0	114.5	M180 S229 F230 K231 N235 T236 Y238 I242	M180-H233 HydrophobicContact CE-CB 4.47Å; S229-H233 PolarHBondContact O-CD2 3.14Å; S229-H233 PolarHBondContact O-N 2.7Å; S229-H233 VanDerWaalsContact O-N 3.08Å; F230-H233 CarbonylContact O-C 3.51Å; F230-H233 WeakPolarHBondContact O-CA 3.48Å; F230-H233 PolarHBondContact O-N 3.19Å; K231-H233 VanDerWaalsContact C-N 3.26Å; K231-H233 PolarHBondContact O-N 3.34Å; H233-N235 VanDerWaalsContact C-N 3.26Å; H233-N235 PolarHBondContact O-N 2.9Å; H233-T236 WeakPolarHBondContact O-CB 3.48Å; H233-T236 PolarHBondContact O-N 3.26Å; H233-T236 PolarHBondContact O-OG1 3.48Å; H233-Y238 HydrophobicContact CB-CD2 4.27Å; H233-Y238 AromaticContact ND1-CD2 3.98Å; H233-I242 HydrophobicContact CB-CD1 3.76Å
234	L	85.6	Confident	88.5	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.005	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-30.4	179.3	-72.2	-176.6	0	0	0	113.9	F230 T236 R239 I242 S292 F293 D296 I299	F230-L234 VanDerWaalsContact O-CG 3.31Å; F230-L234 WeakPolarHBondContact O-CG 3.24Å; F230-L234 PolarHBondContact O-N 2.9Å; L234-T236 VanDerWaalsContact C-N 3.27Å; L234-T236 PolarHBondContact O-N 3.3Å; L234-R239 VanDerWaalsContact O-CB 3.29Å; L234-R239 WeakPolarHBondContact O-CB 3.47Å; L234-R239 WeakPolarHBondContact O-CD 3.21Å; L234-R239 WeakPolarHBondContact O-CG 3.01Å; L234-I242 HydrophobicContact CD2-CB 4.45Å; L234-I242 HydrophobicContact CD2-CD1 4.47Å; L234-I242 HydrophobicContact CD2-CG2 3.73Å; L234-S292 WeakPolarHBondContact CD1-O 3.4Å; L234-F293 HydrophobicContact CD1-CD1 3.69Å; L234-F293 HydrophobicContact CD1-CE1 4.1Å; L234-F293 HydrophobicContact CD1-CG 4.28Å; L234-F293 HydrophobicContact CD2-CD1 3.78Å; L234-F293 HydrophobicContact CD2-CE1 3.34Å; L234-F293 HydrophobicContact CD2-CZ 4.13Å; L234-F293 HydrophobicContact CG-CD1 4.43Å; L234-F293 HydrophobicContact CG-CE1 4.38Å; L234-D296 WeakPolarHBondContact CD1-OD2 3.43Å; L234-I299 HydrophobicContact CD1-CD1 4.31Å
235	N	84.7	Confident	88.6	Confident	143 Å²	143	46.6 Å²	46.6	77%	0.765	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	10.2	176.6	-71.6	-43.2	0	0	0	113.8	H233	H233-N235 VanDerWaalsContact C-N 3.26Å; H233-N235 PolarHBondContact O-N 2.9Å
236	T	85.5	Confident	88.8	Confident	56 Å²	56	45.9 Å²	45.9	34%	0.344	25%	0.253	S	S	.	.	S	Bend	trans	-108.6	179.3	-178.1	73.5	0	0	0	0	111.6	H233 L234 Y238 R239	H233-T236 WeakPolarHBondContact O-CB 3.48Å; H233-T236 PolarHBondContact O-N 3.26Å; H233-T236 PolarHBondContact O-OG1 3.48Å; L234-T236 VanDerWaalsContact C-N 3.27Å; L234-T236 PolarHBondContact O-N 3.3Å; T236-Y238 PolarHBondContact O-N 3.03Å; T236-Y238 VanDerWaalsContact OG1-CD2 3.3Å; T236-Y238 WeakPolarHBondContact OG1-CD2 3.2Å; T236-Y238 PolarHBondContact OG1-N 3.34Å; T236-R239 PolarHBondContact O-N 3.46Å; T236-R239 VanDerWaalsContact O-N 3.11Å
237	L	83.3	Confident	88.8	Confident	129 Å²	129	47.3 Å²	47.3	68%	0.675	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-21.6	175.7	-61	145.4	0	0	0	112.6	N184 R239	N184-L237 WeakPolarHBondContact OD1-CD1 3.13Å; L237-R239 VanDerWaalsContact C-N 3.27Å; L237-R239 PolarHBondContact O-N 2.97Å
238	Y	84.6	Confident	88.9	Confident	5 Å²	5	49.1 Å²	49.1	2%	0.02	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-8.6	179	-61.3	-56.9	0	0	0	115.3	M180 N184 L190 H233 T236 T240 S241 I242	M180-Y238 WeakPolarHBondContact CA-OH 3.37Å; M180-Y238 HydrophobicContact CB-CE2 4.06Å; M180-Y238 WeakPolarHBondContact O-CE2 3.43Å; M180-Y238 PolarHBondContact O-OH 2.87Å; M180-Y238 HydrophobicContact SD-CD1 4.39Å; M180-Y238 HydrophobicContact SD-CD2 4Å; M180-Y238 HydrophobicContact SD-CE2 4.16Å; M180-Y238 HydrophobicContact SD-CG 4.09Å; N184-Y238 VanDerWaalsContact CA-CZ 3.44Å; N184-Y238 WeakPolarHBondContact CA-OH 3.16Å; N184-Y238 VanDerWaalsContact CB-OH 3.23Å; N184-Y238 WeakPolarHBondContact CB-OH 3.37Å; N184-Y238 PolarHBondContact N-OH 3.47Å; L190-Y238 HydrophobicContact CD2-CD1 3.39Å; L190-Y238 HydrophobicContact CD2-CE1 3.83Å; L190-Y238 HydrophobicContact CD2-CG 4.09Å; H233-Y238 HydrophobicContact CB-CD2 4.27Å; H233-Y238 AromaticContact ND1-CD2 3.98Å; T236-Y238 PolarHBondContact O-N 3.03Å; T236-Y238 VanDerWaalsContact OG1-CD2 3.3Å; T236-Y238 WeakPolarHBondContact OG1-CD2 3.2Å; T236-Y238 PolarHBondContact OG1-N 3.34Å; Y238-T240 VanDerWaalsContact C-N 3.28Å; Y238-T240 PolarHBondContact O-N 3.31Å; Y238-S241 PolarHBondContact O-N 2.82Å; Y238-I242 WeakPolarHBondContact O-CG1 2.85Å; Y238-I242 PolarHBondContact O-N 3.04Å
239	R	86.5	Confident	89	Confident	107 Å²	107	45.2 Å²	45.2	40%	0.404	24%	0.241	S	C	.	.	H	α-helix	trans	-47.1	-52.8	-176.9	-172.3	178.4	174.2	-174.7	-0.2	111.4	L234 T236 L237 S241 I242 V243	L234-R239 VanDerWaalsContact O-CB 3.29Å; L234-R239 WeakPolarHBondContact O-CB 3.47Å; L234-R239 WeakPolarHBondContact O-CD 3.21Å; L234-R239 WeakPolarHBondContact O-CG 3.01Å; T236-R239 PolarHBondContact O-N 3.46Å; T236-R239 VanDerWaalsContact O-N 3.11Å; L237-R239 VanDerWaalsContact C-N 3.27Å; L237-R239 PolarHBondContact O-N 2.97Å; R239-S241 PolarHBondContact O-N 3.27Å; R239-I242 PolarHBondContact O-N 2.92Å; R239-V243 HydrophobicContact CG-CG2 4.39Å; R239-V243 WeakPolarHBondContact O-CB 3.47Å; R239-V243 WeakPolarHBondContact O-CG2 3.35Å; R239-V243 PolarHBondContact O-N 3Å
240	T	87.9	Confident	89.2	Confident	105 Å²	105	44.8 Å²	44.8	64%	0.644	24%	0.238	S	C	*	.	H	α-helix	trans	-60	-45.3	-178.8	-51.7	0	0	0	0	112.3	Y238 V243 Q244	Y238-T240 VanDerWaalsContact C-N 3.28Å; Y238-T240 PolarHBondContact O-N 3.31Å; T240-V243 PolarHBondContact O-N 2.96Å; T240-Q244 WeakPolarHBondContact O-CB 3.47Å; T240-Q244 PolarHBondContact O-N 3.41Å
241	S	89.1	Confident	89.4	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.007	25%	0.251	C	S	.	.	H	α-helix	trans	-65.1	-40.9	178.6	-53	0	0	0	0	112.6	P187 Y238 R239 V243 Q244 F245	P187-S241 WeakPolarHBondContact CA-OG 3.36Å; P187-S241 VanDerWaalsContact CB-OG 3.24Å; P187-S241 WeakPolarHBondContact CB-OG 3.35Å; Y238-S241 PolarHBondContact O-N 2.82Å; R239-S241 PolarHBondContact O-N 3.27Å; S241-V243 VanDerWaalsContact C-N 3.34Å; S241-Q244 PolarHBondContact O-N 3.43Å; S241-F245 VanDerWaalsContact O-CB 3.31Å; S241-F245 WeakPolarHBondContact O-CB 3.2Å; S241-F245 PolarHBondContact O-N 3.11Å
242	I	90.4	Very high	89.4	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.5	-42.5	178.4	-70.3	166.7	0	0	0	110.2	M180 F230 H233 L234 Y238 R239 T246 F293	M180-I242 HydrophobicContact CE-CD1 4.1Å; M180-I242 HydrophobicContact CE-CG1 4.21Å; F230-I242 HydrophobicContact CB-CD1 4.48Å; F230-I242 HydrophobicContact CB-CG2 3.85Å; F230-I242 HydrophobicContact CD1-CD1 4.17Å; F230-I242 HydrophobicContact CD1-CG1 3.89Å; F230-I242 HydrophobicContact CD1-CG2 4.15Å; F230-I242 HydrophobicContact CD2-CG2 3.67Å; F230-I242 HydrophobicContact CE1-CG1 4.12Å; F230-I242 HydrophobicContact CE2-CG2 4.19Å; F230-I242 HydrophobicContact CG-CD1 4.47Å; F230-I242 HydrophobicContact CG-CG1 4.25Å; F230-I242 HydrophobicContact CG-CG2 3.64Å; H233-I242 HydrophobicContact CB-CD1 3.76Å; L234-I242 HydrophobicContact CD2-CB 4.45Å; L234-I242 HydrophobicContact CD2-CD1 4.47Å; L234-I242 HydrophobicContact CD2-CG2 3.73Å; Y238-I242 WeakPolarHBondContact O-CG1 2.85Å; Y238-I242 PolarHBondContact O-N 3.04Å; R239-I242 PolarHBondContact O-N 2.92Å; I242-T246 VanDerWaalsContact O-CB 3.31Å; I242-T246 WeakPolarHBondContact O-CB 3.48Å; I242-T246 PolarHBondContact O-N 3.23Å; I242-T246 PolarHBondContact O-OG1 3.49Å; I242-F293 HydrophobicContact CG2-CE1 4.09Å; I242-F293 HydrophobicContact CG2-CZ 3.79Å
243	V	90.1	Very high	89.5	Confident	22 Å²	22	41.3 Å²	41.3	13%	0.133	21%	0.214	C	C	.	.	H	α-helix	trans	-66.9	-45	178	174.4	0	0	0	0	110.7	R239 T240 S241 T246 T247 F293 I299 F300	R239-V243 HydrophobicContact CG-CG2 4.39Å; R239-V243 WeakPolarHBondContact O-CB 3.47Å; R239-V243 WeakPolarHBondContact O-CG2 3.35Å; R239-V243 PolarHBondContact O-N 3Å; T240-V243 PolarHBondContact O-N 2.96Å; S241-V243 VanDerWaalsContact C-N 3.34Å; V243-T246 PolarHBondContact O-N 3Å; V243-T247 VanDerWaalsContact O-CB 3.3Å; V243-T247 WeakPolarHBondContact O-CB 3.36Å; V243-T247 PolarHBondContact O-N 2.82Å; V243-T247 PolarHBondContact O-OG1 2.9Å; V243-F293 HydrophobicContact CG2-CE1 4.2Å; V243-I299 HydrophobicContact CB-CG2 4.26Å; V243-I299 HydrophobicContact CG1-CG2 4.06Å; V243-I299 HydrophobicContact CG2-CG2 3.17Å; V243-F300 HydrophobicContact CG1-CD1 3.97Å; V243-F300 HydrophobicContact CG1-CE1 4.05Å
244	Q	91.3	Very high	89.7	Confident	81 Å²	81	39.5 Å²	39.5	38%	0.379	21%	0.206	S	C	.	.	H	α-helix	trans	-59.3	-54	175.8	179.3	176.5	-10.5	0	0	110.6	I191 T240 S241 T246 T247 E248	I191-Q244 VanDerWaalsContact CD1-CD 3.45Å; I191-Q244 HydrophobicContact CD1-CG 4.3Å; T240-Q244 WeakPolarHBondContact O-CB 3.47Å; T240-Q244 PolarHBondContact O-N 3.41Å; S241-Q244 PolarHBondContact O-N 3.43Å; Q244-T246 VanDerWaalsContact C-N 3.31Å; Q244-T246 PolarHBondContact O-N 3.04Å; Q244-T247 WeakPolarHBondContact O-CB 3.44Å; Q244-T247 PolarHBondContact O-N 3.06Å; Q244-T247 VanDerWaalsContact O-N 3.12Å; Q244-E248 HydrophobicContact CG-CG 4.39Å; Q244-E248 VanDerWaalsContact CG-OE1 3.26Å; Q244-E248 WeakPolarHBondContact CG-OE1 3.4Å; Q244-E248 PolarHBondContact NE2-OE1 3.11Å; Q244-E248 WeakPolarHBondContact O-CG 3.49Å; Q244-E248 PolarHBondContact O-N 2.63Å
245	F	92.4	Very high	89.9	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-54.8	-46.3	177	169	-94.4	0	0	0	112.2	L194 R198 L226 F230 S241 T247 E248 F249 L289	L194-F245 HydrophobicContact CB-CD2 3.37Å; L194-F245 HydrophobicContact CB-CE2 3.59Å; L194-F245 HydrophobicContact CB-CG 4.01Å; L194-F245 HydrophobicContact CB-CZ 4.41Å; L194-F245 HydrophobicContact CD1-CB 3.98Å; L194-F245 HydrophobicContact CD1-CD1 4.44Å; L194-F245 HydrophobicContact CD1-CD2 4.16Å; L194-F245 HydrophobicContact CD1-CG 3.91Å; L194-F245 HydrophobicContact CG-CD2 4.35Å; L194-F245 VanDerWaalsContact O-CE2 3.26Å; L194-F245 WeakPolarHBondContact O-CE2 3.44Å; R198-F245 HydrophobicContact CB-CE2 3.77Å; R198-F245 HydrophobicContact CB-CZ 4.33Å; L226-F245 HydrophobicContact CD2-CE1 3.94Å; L226-F245 HydrophobicContact CD2-CZ 4.13Å; F230-F245 AromaticContact CE2-CD1 3.42Å; F230-F245 HydrophobicContact CE2-CD1 3.42Å; F230-F245 VanDerWaalsContact CE2-CD1 3.42Å; F230-F245 AromaticContact CE2-CE1 3.6Å; F230-F245 HydrophobicContact CE2-CE1 3.6Å; F230-F245 AromaticContact CZ-CD1 3.49Å; F230-F245 HydrophobicContact CZ-CD1 3.49Å; F230-F245 VanDerWaalsContact CZ-CD1 3.49Å; F230-F245 AromaticContact CZ-CE1 3.71Å; F230-F245 HydrophobicContact CZ-CE1 3.71Å; F230-F245 HydrophobicContact CZ-CG 4.32Å; S241-F245 VanDerWaalsContact O-CB 3.31Å; S241-F245 WeakPolarHBondContact O-CB 3.2Å; S241-F245 PolarHBondContact O-N 3.11Å; F245-T247 VanDerWaalsContact C-N 3.32Å; F245-T247 PolarHBondContact O-N 3.1Å; F245-E248 PolarHBondContact O-N 3.34Å; F245-F249 HydrophobicContact CE1-CB 4.49Å; F245-F249 HydrophobicContact CZ-CD2 4.24Å; F245-F249 VanDerWaalsContact O-CB 3.24Å; F245-F249 WeakPolarHBondContact O-CB 3.46Å; F245-F249 PolarHBondContact O-N 2.64Å; F245-L289 HydrophobicContact CE1-CD2 4.44Å
246	T	92.8	Very high	89.9	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-65.7	-38.3	-179.7	-57	0	0	0	0	111.4	I242 V243 Q244 F249 I250 L290 F293 F300	I242-T246 VanDerWaalsContact O-CB 3.31Å; I242-T246 WeakPolarHBondContact O-CB 3.48Å; I242-T246 PolarHBondContact O-N 3.23Å; I242-T246 PolarHBondContact O-OG1 3.49Å; V243-T246 PolarHBondContact O-N 3Å; Q244-T246 VanDerWaalsContact C-N 3.31Å; Q244-T246 PolarHBondContact O-N 3.04Å; T246-F249 PolarHBondContact O-N 3.25Å; T246-I250 HydrophobicContact CG2-CD1 4Å; T246-I250 VanDerWaalsContact O-CG1 3.3Å; T246-I250 WeakPolarHBondContact O-CG1 3.34Å; T246-I250 PolarHBondContact O-N 3.36Å; T246-L290 HydrophobicContact CG2-CD2 4.11Å; T246-F293 HydrophobicContact CG2-CE2 3.83Å; T246-F293 HydrophobicContact CG2-CZ 4.15Å; T246-F300 HydrophobicContact CG2-CE1 4.03Å; T246-F300 HydrophobicContact CG2-CZ 3.86Å
247	T	92.8	Very high	89.8	Confident	29 Å²	29	36 Å²	36	18%	0.178	18%	0.181	C	C	.	.	H	α-helix	trans	-62.1	-51.1	175.9	-58.2	0	0	0	0	110.3	V243 Q244 F245 F249 I250 D251 Q304 W308	V243-T247 VanDerWaalsContact O-CB 3.3Å; V243-T247 WeakPolarHBondContact O-CB 3.36Å; V243-T247 PolarHBondContact O-N 2.82Å; V243-T247 PolarHBondContact O-OG1 2.9Å; Q244-T247 WeakPolarHBondContact O-CB 3.44Å; Q244-T247 PolarHBondContact O-N 3.06Å; Q244-T247 VanDerWaalsContact O-N 3.12Å; F245-T247 VanDerWaalsContact C-N 3.32Å; F245-T247 PolarHBondContact O-N 3.1Å; T247-F249 VanDerWaalsContact C-N 3.33Å; T247-F249 PolarHBondContact O-N 2.97Å; T247-I250 PolarHBondContact O-N 3.45Å; T247-D251 PolarHBondContact O-N 3.01Å; T247-Q304 HydrophobicContact CG2-CG 3.93Å; T247-W308 HydrophobicContact CG2-CH2 4.12Å; T247-W308 HydrophobicContact CG2-CZ2 3.67Å
248	E	93.1	Very high	89.8	Confident	48 Å²	48	32.1 Å²	32.1	22%	0.224	16%	0.164	C	C	.	.	H	α-helix	trans	-65.6	-35.8	178.7	-62.5	-179.5	-162.1	0	0	112.2	R198 Q244 F245 D251 D252	R198-E248 IonicContact CZ-OE2 2.7Å; R198-E248 IonicContact NH1-OE2 3.91Å; R198-E248 PolarHBondContact NH1-OE2 3.21Å; R198-E248 IonicContact NH2-OE2 3.39Å; R198-E248 PolarHBondContact NH2-OE2 2.96Å; Q244-E248 HydrophobicContact CG-CG 4.39Å; Q244-E248 VanDerWaalsContact CG-OE1 3.26Å; Q244-E248 WeakPolarHBondContact CG-OE1 3.4Å; Q244-E248 PolarHBondContact NE2-OE1 3.11Å; Q244-E248 WeakPolarHBondContact O-CG 3.49Å; Q244-E248 PolarHBondContact O-N 2.63Å; F245-E248 PolarHBondContact O-N 3.34Å; E248-D251 PolarHBondContact O-N 3.04Å; E248-D252 WeakPolarHBondContact O-CB 3.35Å; E248-D252 VanDerWaalsContact O-CG 3.3Å; E248-D252 PolarHBondContact O-N 2.9Å
249	F	93.6	Very high	89.6	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60.9	-46.7	173.6	-177.7	-86.6	0	0	0	111.3	R198 F201 I202 F245 T246 T247 D252 V253 L285 L289	R198-F249 HydrophobicContact CB-CD2 4.28Å; R198-F249 HydrophobicContact CG-CD2 4.02Å; F201-F249 HydrophobicContact CB-CE2 3.96Å; F201-F249 HydrophobicContact CB-CZ 4.46Å; F201-F249 AromaticContact CD2-CE2 3.92Å; F201-F249 HydrophobicContact CD2-CE2 3.92Å; F201-F249 HydrophobicContact CG-CE2 4.47Å; I202-F249 HydrophobicContact CD1-CD2 3.9Å; I202-F249 HydrophobicContact CD1-CE2 3.88Å; I202-F249 HydrophobicContact CD1-CG 4.44Å; I202-F249 HydrophobicContact CD1-CZ 4.42Å; I202-F249 HydrophobicContact CG1-CD2 4.42Å; I202-F249 HydrophobicContact CG1-CE2 3.9Å; I202-F249 HydrophobicContact CG1-CZ 4.33Å; F245-F249 HydrophobicContact CE1-CB 4.49Å; F245-F249 HydrophobicContact CZ-CD2 4.24Å; F245-F249 VanDerWaalsContact O-CB 3.24Å; F245-F249 WeakPolarHBondContact O-CB 3.46Å; F245-F249 PolarHBondContact O-N 2.64Å; T246-F249 PolarHBondContact O-N 3.25Å; T247-F249 VanDerWaalsContact C-N 3.33Å; T247-F249 PolarHBondContact O-N 2.97Å; F249-D252 PolarHBondContact O-N 3.48Å; F249-V253 HydrophobicContact CD1-CG2 4Å; F249-V253 HydrophobicContact CE1-CG2 3.62Å; F249-V253 HydrophobicContact CZ-CG2 3.98Å; F249-V253 WeakPolarHBondContact O-CB 3.46Å; F249-V253 VanDerWaalsContact O-CG2 3.26Å; F249-V253 WeakPolarHBondContact O-CG2 3.48Å; F249-V253 PolarHBondContact O-N 3.03Å; F249-L285 HydrophobicContact CZ-CB 4.25Å; F249-L289 HydrophobicContact CD1-CD1 3.54Å; F249-L289 HydrophobicContact CD2-CD1 4.22Å; F249-L289 HydrophobicContact CE1-CD1 3.58Å; F249-L289 HydrophobicContact CE2-CD1 4.26Å; F249-L289 HydrophobicContact CG-CD1 3.89Å; F249-L289 HydrophobicContact CZ-CD1 3.96Å
250	I	93.7	Very high	89.2	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65.7	-42.2	178	-67.9	166.7	0	0	0	110.1	T246 T247 D252 V253 L254 L290 W308	T246-I250 HydrophobicContact CG2-CD1 4Å; T246-I250 VanDerWaalsContact O-CG1 3.3Å; T246-I250 WeakPolarHBondContact O-CG1 3.34Å; T246-I250 PolarHBondContact O-N 3.36Å; T247-I250 PolarHBondContact O-N 3.45Å; I250-D252 PolarHBondContact O-N 3.09Å; I250-V253 PolarHBondContact O-N 2.96Å; I250-L254 HydrophobicContact CG2-CD1 3.86Å; I250-L254 HydrophobicContact CG2-CG 4.11Å; I250-L254 WeakPolarHBondContact O-CB 3.35Å; I250-L254 WeakPolarHBondContact O-CG 3.27Å; I250-L254 PolarHBondContact O-N 3.33Å; I250-L290 HydrophobicContact CD1-CD1 3.97Å; I250-L290 HydrophobicContact CD1-CD2 3.51Å; I250-L290 HydrophobicContact CD1-CG 3.86Å; I250-W308 HydrophobicContact CB-CH2 4.23Å; I250-W308 HydrophobicContact CB-CZ2 3.85Å; I250-W308 HydrophobicContact CD1-CE3 4.37Å; I250-W308 HydrophobicContact CD1-CH2 3.75Å; I250-W308 HydrophobicContact CD1-CZ2 4.27Å; I250-W308 HydrophobicContact CD1-CZ3 3.8Å; I250-W308 HydrophobicContact CG2-CD2 3.68Å; I250-W308 HydrophobicContact CG2-CE3 4.11Å; I250-W308 HydrophobicContact CG2-CG 4.05Å; I250-W308 HydrophobicContact CG2-CH2 4.32Å; I250-W308 HydrophobicContact CG2-CZ2 3.86Å; I250-W308 HydrophobicContact CG2-CZ3 4.43Å
251	D	93.6	Very high	88.6	Confident	49 Å²	49	28.3 Å²	28.3	26%	0.262	14%	0.143	S	C	.	.	H	α-helix	trans	-57.2	-49.4	176.1	-76.3	-22.7	0	0	0	112	T247 E248 V253 L254 E255 Q304 W308	T247-D251 PolarHBondContact O-N 3.01Å; E248-D251 PolarHBondContact O-N 3.04Å; D251-V253 PolarHBondContact O-N 3.45Å; D251-L254 PolarHBondContact O-N 3.06Å; D251-L254 VanDerWaalsContact O-N 3.16Å; D251-E255 WeakPolarHBondContact O-CB 2.89Å; D251-E255 PolarHBondContact O-N 3.32Å; D251-Q304 PolarHBondContact OD1-NE2 3Å; D251-Q304 PolarHBondContact OD2-NE2 3.33Å; D251-Q304 VanDerWaalsContact OD2-NE2 3.14Å; D251-W308 PolarHBondContact OD1-NE1 3.42Å
252	D	91.1	Very high	87.7	Confident	48 Å²	48	35.8 Å²	35.8	26%	0.257	18%	0.178	S	C	.	.	H	α-helix	trans	-64.1	-39.9	178.3	-72.8	1.2	0	0	0	112	R198 I202 E248 F249 I250 L254 E255 M256	R198-D252 WeakPolarHBondContact CD-OD2 3.37Å; R198-D252 IonicContact CZ-OD2 3.26Å; R198-D252 IonicContact NE-OD2 3.93Å; R198-D252 PolarHBondContact NE-OD2 3.49Å; R198-D252 VanDerWaalsContact NH1-CG 3.31Å; R198-D252 IonicContact NH1-OD1 2.61Å; R198-D252 PolarHBondContact NH1-OD1 2.88Å; R198-D252 IonicContact NH1-OD2 2.7Å; R198-D252 PolarHBondContact NH1-OD2 3.1Å; I202-D252 HydrophobicContact CD1-CB 3.51Å; E248-D252 WeakPolarHBondContact O-CB 3.35Å; E248-D252 VanDerWaalsContact O-CG 3.3Å; E248-D252 PolarHBondContact O-N 2.9Å; F249-D252 PolarHBondContact O-N 3.48Å; I250-D252 PolarHBondContact O-N 3.09Å; D252-L254 VanDerWaalsContact C-N 3.31Å; D252-E255 PolarHBondContact O-N 2.96Å; D252-M256 WeakPolarHBondContact O-CB 3.35Å; D252-M256 PolarHBondContact O-N 3.38Å
253	V	90.8	Very high	86.9	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.006	20%	0.197	C	C	.	.	H	α-helix	trans	-60.8	-46.1	174.2	165.2	0	0	0	0	109.5	I202 F249 I250 D251 M256 L257 I282	I202-V253 HydrophobicContact CD1-CG2 3.77Å; I202-V253 HydrophobicContact CG1-CG2 4.11Å; F249-V253 HydrophobicContact CD1-CG2 4Å; F249-V253 HydrophobicContact CE1-CG2 3.62Å; F249-V253 HydrophobicContact CZ-CG2 3.98Å; F249-V253 WeakPolarHBondContact O-CB 3.46Å; F249-V253 VanDerWaalsContact O-CG2 3.26Å; F249-V253 WeakPolarHBondContact O-CG2 3.48Å; F249-V253 PolarHBondContact O-N 3.03Å; I250-V253 PolarHBondContact O-N 2.96Å; D251-V253 PolarHBondContact O-N 3.45Å; V253-M256 PolarHBondContact O-N 3.28Å; V253-L257 HydrophobicContact CG1-CD1 3.69Å; V253-L257 HydrophobicContact CG1-CG 4.17Å; V253-L257 WeakPolarHBondContact O-CB 3.26Å; V253-L257 WeakPolarHBondContact O-CG 3.47Å; V253-L257 PolarHBondContact O-N 3.04Å; V253-I282 HydrophobicContact CB-CG2 4.18Å; V253-I282 HydrophobicContact CG1-CG2 3.75Å; V253-I282 HydrophobicContact CG2-CG2 3.46Å; V253-I282 VanDerWaalsContact CG2-CG2 3.46Å
254	L	91.5	Very high	86	Confident	4 Å²	4	38 Å²	38	2%	0.021	19%	0.191	C	C	.	.	H	α-helix	trans	-67	-39.4	-178	-67.5	176.1	0	0	0	111.8	I250 D251 D252 L257 C258 W308 I311 L312 W315	I250-L254 HydrophobicContact CG2-CD1 3.86Å; I250-L254 HydrophobicContact CG2-CG 4.11Å; I250-L254 WeakPolarHBondContact O-CB 3.35Å; I250-L254 WeakPolarHBondContact O-CG 3.27Å; I250-L254 PolarHBondContact O-N 3.33Å; D251-L254 PolarHBondContact O-N 3.06Å; D251-L254 VanDerWaalsContact O-N 3.16Å; D252-L254 VanDerWaalsContact C-N 3.31Å; L254-L257 PolarHBondContact O-N 3.13Å; L254-C258 WeakPolarHBondContact O-CB 3.29Å; L254-C258 PolarHBondContact O-N 2.59Å; L254-W308 HydrophobicContact CD1-CB 3.91Å; L254-W308 HydrophobicContact CD1-CG 3.74Å; L254-I311 HydrophobicContact CB-CG2 4.4Å; L254-I311 HydrophobicContact CD1-CD1 4.28Å; L254-I311 HydrophobicContact CD1-CG2 4.46Å; L254-I311 HydrophobicContact CD2-CG2 4.42Å; L254-L312 HydrophobicContact CD2-CD2 3.78Å; L254-L312 HydrophobicContact CD2-CG 4.17Å; L254-W315 HydrophobicContact CB-CH2 3.74Å; L254-W315 HydrophobicContact CB-CZ2 4.44Å; L254-W315 HydrophobicContact CD2-CH2 3.34Å; L254-W315 HydrophobicContact CD2-CZ3 3.39Å; L254-W315 HydrophobicContact CG-CH2 4.1Å; L254-W315 VanDerWaalsContact O-CH2 3.24Å; L254-W315 WeakPolarHBondContact O-CH2 3.46Å; L254-W315 VanDerWaalsContact O-CZ2 3.23Å; L254-W315 WeakPolarHBondContact O-CZ2 3.24Å
255	E	89.1	Confident	84.8	Confident	121 Å²	121	38.6 Å²	38.6	57%	0.565	20%	0.201	S	C	*	.	H	α-helix	trans	-62.6	-48.3	174.1	-176.2	173.3	-164.4	0	0	111.7	D251 D252 L257 C258 E259	D251-E255 WeakPolarHBondContact O-CB 2.89Å; D251-E255 PolarHBondContact O-N 3.32Å; D252-E255 PolarHBondContact O-N 2.96Å; E255-L257 VanDerWaalsContact C-N 3.33Å; E255-L257 PolarHBondContact O-N 3.16Å; E255-C258 WeakPolarHBondContact O-CA 3.39Å; E255-C258 WeakPolarHBondContact O-CB 3.4Å; E255-C258 PolarHBondContact O-N 2.73Å; E255-C258 VanDerWaalsContact O-N 3.13Å; E255-E259 PolarHBondContact O-N 3.23Å
256	M	84.8	Confident	83.7	Confident	7 Å²	7	42.5 Å²	42.5	3%	0.034	23%	0.228	C	C	.	.	H	α-helix	trans	-62.6	-39.7	177.9	176.9	-79	-51.6	0	0	112	I202 D252 V253 E259 K260 I282	I202-M256 HydrophobicContact CG2-CB 4.19Å; I202-M256 HydrophobicContact CG2-CG 4.22Å; D252-M256 WeakPolarHBondContact O-CB 3.35Å; D252-M256 PolarHBondContact O-N 3.38Å; V253-M256 PolarHBondContact O-N 3.28Å; M256-E259 PolarHBondContact O-N 3.5Å; M256-K260 WeakPolarHBondContact O-CG 3.21Å; M256-K260 PolarHBondContact O-N 3.22Å; M256-K260 HydrophobicContact SD-CD 3.42Å; M256-K260 WeakPolarHBondContact SD-CD 3.06Å; M256-K260 WeakPolarHBondContact SD-CE 2.99Å; M256-K260 HydrophobicContact SD-CG 3.98Å; M256-K260 PolarHBondContact SD-NZ 2.77Å; M256-I282 HydrophobicContact CE-CB 4Å; M256-I282 HydrophobicContact CE-CD1 3.37Å; M256-I282 HydrophobicContact CE-CG1 4.25Å; M256-I282 HydrophobicContact CE-CG2 3.59Å; M256-I282 HydrophobicContact SD-CD1 3.99Å
257	L	83.7	Confident	82.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-62.6	-45.5	173.4	-72.6	172.5	0	0	0	110.5	V253 L254 E255 E259 K260 F261 C279 I283 W315	V253-L257 HydrophobicContact CG1-CD1 3.69Å; V253-L257 HydrophobicContact CG1-CG 4.17Å; V253-L257 WeakPolarHBondContact O-CB 3.26Å; V253-L257 WeakPolarHBondContact O-CG 3.47Å; V253-L257 PolarHBondContact O-N 3.04Å; L254-L257 PolarHBondContact O-N 3.13Å; E255-L257 VanDerWaalsContact C-N 3.33Å; E255-L257 PolarHBondContact O-N 3.16Å; L257-E259 VanDerWaalsContact C-N 3.32Å; L257-E259 PolarHBondContact O-N 2.95Å; L257-K260 PolarHBondContact O-N 3.43Å; L257-F261 HydrophobicContact CB-CD2 3.95Å; L257-F261 HydrophobicContact CB-CE2 3.96Å; L257-F261 HydrophobicContact CD2-CE2 3.95Å; L257-F261 HydrophobicContact CG-CE2 4.4Å; L257-F261 VanDerWaalsContact O-CB 3.32Å; L257-F261 WeakPolarHBondContact O-CB 3.41Å; L257-F261 WeakPolarHBondContact O-CD2 3.14Å; L257-F261 PolarHBondContact O-N 3.08Å; L257-C279 HydrophobicContact CD2-CB 3.58Å; L257-I283 HydrophobicContact CD1-CD1 3.9Å; L257-I283 HydrophobicContact CD1-CG1 3.49Å; L257-I283 VanDerWaalsContact CD1-CG1 3.49Å; L257-I283 HydrophobicContact CD2-CD1 4.15Å; L257-I283 HydrophobicContact CD2-CG1 4.15Å; L257-I283 HydrophobicContact CG-CG1 4.45Å; L257-W315 HydrophobicContact CB-CH2 3.85Å; L257-W315 HydrophobicContact CB-CZ2 4.4Å; L257-W315 HydrophobicContact CB-CZ3 4.13Å; L257-W315 HydrophobicContact CD1-CH2 4.28Å; L257-W315 HydrophobicContact CD1-CZ3 3.98Å
258	C	82.3	Confident	81.7	Confident	47 Å²	47	49.3 Å²	49.3	32%	0.318	26%	0.258	S	S	.	.	H	α-helix	trans	-50.4	-50.9	174.3	-107.7	0	0	0	0	111.9	L254 E255 Q262 W315	L254-C258 WeakPolarHBondContact O-CB 3.29Å; L254-C258 PolarHBondContact O-N 2.59Å; E255-C258 WeakPolarHBondContact O-CA 3.39Å; E255-C258 WeakPolarHBondContact O-CB 3.4Å; E255-C258 PolarHBondContact O-N 2.73Å; E255-C258 VanDerWaalsContact O-N 3.13Å; C258-Q262 WeakPolarHBondContact O-CG 3.37Å; C258-Q262 PolarHBondContact O-N 2.92Å; C258-W315 HydrophobicContact CB-CZ2 4.14Å; C258-W315 WeakPolarHBondContact SG-CZ2 3.34Å; C258-W315 PolarHBondContact SG-NE1 2.88Å
259	E	81	Confident	80.6	Confident	84 Å²	84	49.7 Å²	49.7	39%	0.393	28%	0.275	S	S	.	.	H	α-helix	trans	-62.5	-47.3	177.7	-66.2	-179.5	163.9	0	0	112	K204 E255 M256 L257 Q262	K204-E259 VanDerWaalsContact CE-OE2 3.24Å; K204-E259 WeakPolarHBondContact CE-OE2 3.42Å; K204-E259 IonicContact NZ-OE1 2.55Å; K204-E259 PolarHBondContact NZ-OE1 3.39Å; K204-E259 IonicContact NZ-OE2 2.68Å; K204-E259 PolarHBondContact NZ-OE2 3.23Å; E255-E259 PolarHBondContact O-N 3.23Å; M256-E259 PolarHBondContact O-N 3.5Å; L257-E259 VanDerWaalsContact C-N 3.32Å; L257-E259 PolarHBondContact O-N 2.95Å; E259-Q262 PolarHBondContact O-N 3.3Å
260	K	78.7	Confident	79.5	Confident	42 Å²	42	56 Å²	56	18%	0.183	30%	0.302	C	S	.	.	H	α-helix	trans	-67.9	-37.9	-178.3	-73.3	-169.5	-174.7	162.4	0	112.4	M256 L257 Q262 T263 L264	M256-K260 WeakPolarHBondContact O-CG 3.21Å; M256-K260 PolarHBondContact O-N 3.22Å; M256-K260 HydrophobicContact SD-CD 3.42Å; M256-K260 WeakPolarHBondContact SD-CD 3.06Å; M256-K260 WeakPolarHBondContact SD-CE 2.99Å; M256-K260 HydrophobicContact SD-CG 3.98Å; M256-K260 PolarHBondContact SD-NZ 2.77Å; L257-K260 PolarHBondContact O-N 3.43Å; K260-Q262 VanDerWaalsContact C-N 3.35Å; K260-Q262 PolarHBondContact O-N 3.3Å; K260-T263 CarbonylContact O-C 3.55Å; K260-T263 PolarHBondContact O-N 3.38Å; K260-T263 PolarHBondContact O-OG1 3.42Å; K260-L264 WeakPolarHBondContact O-CG 3.22Å; K260-L264 PolarHBondContact O-N 3.48Å
261	F	74.2	Confident	78.6	Confident	11 Å²	11	58.3 Å²	58.3	5%	0.048	32%	0.317	C	S	.	.	H	α-helix	trans	-64.3	-36.8	179.1	-85.8	-66.1	0	0	0	113.3	L257 T263 L264 Q319 L337 I341	L257-F261 HydrophobicContact CB-CD2 3.95Å; L257-F261 HydrophobicContact CB-CE2 3.96Å; L257-F261 HydrophobicContact CD2-CE2 3.95Å; L257-F261 HydrophobicContact CG-CE2 4.4Å; L257-F261 VanDerWaalsContact O-CB 3.32Å; L257-F261 WeakPolarHBondContact O-CB 3.41Å; L257-F261 WeakPolarHBondContact O-CD2 3.14Å; L257-F261 PolarHBondContact O-N 3.08Å; F261-T263 PolarHBondContact O-N 3Å; F261-L264 HydrophobicContact CD1-CD1 3.4Å; F261-L264 HydrophobicContact CE1-CD1 3.63Å; F261-L264 HydrophobicContact CG-CD1 4.02Å; F261-L264 HydrophobicContact CZ-CD1 4.38Å; F261-L264 PolarHBondContact O-N 3.1Å; F261-Q319 HydrophobicContact CE1-CG 4.38Å; F261-L337 HydrophobicContact CE1-CD2 3.36Å; F261-L337 HydrophobicContact CE1-CG 4.05Å; F261-L337 HydrophobicContact CZ-CD1 4.1Å; F261-L337 HydrophobicContact CZ-CD2 3.41Å; F261-L337 VanDerWaalsContact CZ-CD2 3.41Å; F261-L337 HydrophobicContact CZ-CG 3.73Å; F261-I341 HydrophobicContact CE2-CD1 4.18Å; F261-I341 HydrophobicContact CZ-CD1 3.74Å
262	Q	71.5	Confident	77.7	Confident	158 Å²	158	56.3 Å²	56.3	74%	0.738	31%	0.306	S	S	*	.	H	α-helix	trans	-59.5	-34.3	172.9	-70.9	176	1.1	0	0	111.6	C258 E259 K260	C258-Q262 WeakPolarHBondContact O-CG 3.37Å; C258-Q262 PolarHBondContact O-N 2.92Å; E259-Q262 PolarHBondContact O-N 3.3Å; K260-Q262 VanDerWaalsContact C-N 3.35Å; K260-Q262 PolarHBondContact O-N 3.3Å
263	T	73.8	Confident	76.9	Confident	64 Å²	64	59.1 Å²	59.1	39%	0.393	32%	0.316	S	S	.	.	H	α-helix	trans	-86.2	-22.9	177.5	68.9	0	0	0	0	114.2	K260 F261 V265 S266 N267	K260-T263 CarbonylContact O-C 3.55Å; K260-T263 PolarHBondContact O-N 3.38Å; K260-T263 PolarHBondContact O-OG1 3.42Å; F261-T263 PolarHBondContact O-N 3Å; T263-V265 VanDerWaalsContact C-N 3.33Å; T263-V265 PolarHBondContact O-N 3.08Å; T263-S266 PolarHBondContact O-N 3.34Å; T263-S266 PolarHBondContact O-OG 3.3Å; T263-N267 PolarHBondContact O-ND2 2.93Å
264	L	71.6	Confident	76.1	Confident	3 Å²	3	60.1 Å²	60.1	2%	0.016	32%	0.321	C	S	.	.	H	α-helix	trans	-62.6	-37.3	-177.6	-89.1	164	0	0	0	112.3	K260 F261 S266 N267 L272 Q275 A276 L337	K260-L264 WeakPolarHBondContact O-CG 3.22Å; K260-L264 PolarHBondContact O-N 3.48Å; F261-L264 HydrophobicContact CD1-CD1 3.4Å; F261-L264 HydrophobicContact CE1-CD1 3.63Å; F261-L264 HydrophobicContact CG-CD1 4.02Å; F261-L264 HydrophobicContact CZ-CD1 4.38Å; F261-L264 PolarHBondContact O-N 3.1Å; L264-S266 PolarHBondContact O-N 2.99Å; L264-N267 PolarHBondContact O-N 2.94Å; L264-N267 VanDerWaalsContact O-N 3.08Å; L264-L272 HydrophobicContact CD2-CD1 3.65Å; L264-Q275 HydrophobicContact CD2-CB 3.58Å; L264-Q275 HydrophobicContact CG-CB 4.37Å; L264-A276 HydrophobicContact CD2-CB 4.45Å; L264-L337 HydrophobicContact CD1-CD2 4.28Å
265	V	65.4	Low	75.4	Confident	95 Å²	95	61.8 Å²	61.8	58%	0.576	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-30.8	-178.4	-178.5	0	0	0	0	112.1	T263	T263-V265 VanDerWaalsContact C-N 3.33Å; T263-V265 PolarHBondContact O-N 3.08Å
266	S	69.9	Low	74.9	Confident	82 Å²	82	56.2 Å²	56.2	57%	0.573	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-7.6	177.2	49.8	0	0	0	0	114.4	T263 L264	T263-S266 PolarHBondContact O-N 3.34Å; T263-S266 PolarHBondContact O-OG 3.3Å; L264-S266 PolarHBondContact O-N 2.99Å
267	N	72.5	Confident	74.6	Confident	35 Å²	35	58.3 Å²	58.3	19%	0.187	32%	0.319	C	S	.	.			trans	-97	146.6	-174.6	-70.2	-33.4	0	0	0	111.9	T263 L264 T271 L272 Q275	T263-N267 PolarHBondContact O-ND2 2.93Å; L264-N267 PolarHBondContact O-N 2.94Å; L264-N267 VanDerWaalsContact O-N 3.08Å; N267-T271 HydrophobicContact CB-CG2 4.26Å; N267-L272 HydrophobicContact CB-CB 4.37Å; N267-Q275 VanDerWaalsContact ND2-CD 3.26Å; N267-Q275 PolarHBondContact ND2-NE2 3.03Å; N267-Q275 VanDerWaalsContact ND2-NE2 3.19Å; N267-Q275 PolarHBondContact ND2-OE1 3.04Å
268	H	70.3	Confident	74.4	Confident	137 Å²	137	60.7 Å²	60.7	63%	0.634	33%	0.328	S	S	*	.			trans	-134.6	163.3	-179.9	-60.1	-50.8	0	0	0	111.6	K270	H268-K270 PolarHBondContact O-N 2.88Å
269	G	69.6	Low	74.5	Confident	55 Å²	55	58.5 Å²	58.5	57%	0.567	31%	0.313	S	S	*	.	H	α-helix	trans	59.7	-132.7	174.1	0	0	0	0	0	113.9	T271 L272 F273	G269-T271 VanDerWaalsContact C-N 3.34Å; G269-T271 PolarHBondContact O-N 3.41Å; G269-L272 PolarHBondContact O-N 3.46Å; G269-F273 PolarHBondContact O-N 3.04Å
270	K	69.9	Low	74.6	Confident	132 Å²	132	55.6 Å²	55.6	57%	0.574	30%	0.304	S	S	*	.	H	α-helix	trans	-62.1	-39.5	-175.6	-169.7	-175.9	177.8	-177.2	0	112.2	H268 F273 L274	H268-K270 PolarHBondContact O-N 2.88Å; K270-F273 WeakPolarHBondContact O-CB 3.47Å; K270-F273 PolarHBondContact O-N 3.45Å; K270-L274 HydrophobicContact CD-CD1 4.36Å; K270-L274 HydrophobicContact CG-CD1 3.8Å; K270-L274 HydrophobicContact CG-CG 4.34Å; K270-L274 WeakPolarHBondContact O-CD1 3.25Å; K270-L274 VanDerWaalsContact O-CG 3.24Å; K270-L274 WeakPolarHBondContact O-CG 3.36Å; K270-L274 PolarHBondContact O-N 3.4Å
271	T	75	Confident	74.9	Confident	50 Å²	50	55.1 Å²	55.1	31%	0.307	30%	0.302	S	S	.	.	H	α-helix	trans	-63.7	-43.4	-179.1	-53.6	0	0	0	0	111.5	N267 G269 F273 L274 Q275	N267-T271 HydrophobicContact CB-CG2 4.26Å; G269-T271 VanDerWaalsContact C-N 3.34Å; G269-T271 PolarHBondContact O-N 3.41Å; T271-F273 PolarHBondContact O-N 3.05Å; T271-L274 PolarHBondContact O-N 3.41Å; T271-Q275 WeakPolarHBondContact O-CB 3.43Å; T271-Q275 WeakPolarHBondContact O-CG 3.41Å; T271-Q275 PolarHBondContact O-N 3.06Å
272	L	76.2	Confident	75.5	Confident	6 Å²	6	55.1 Å²	55.1	3%	0.031	30%	0.302	C	S	.	.	H	α-helix	trans	-58.9	-48.7	174.3	178.6	66.4	0	0	0	111.2	L264 N267 G269 L274 Q275 A276 P330 L334	L264-L272 HydrophobicContact CD2-CD1 3.65Å; N267-L272 HydrophobicContact CB-CB 4.37Å; G269-L272 PolarHBondContact O-N 3.46Å; L272-L274 PolarHBondContact O-N 3.5Å; L272-Q275 PolarHBondContact O-N 3.43Å; L272-A276 VanDerWaalsContact O-CB 3.26Å; L272-A276 WeakPolarHBondContact O-CB 3.21Å; L272-A276 PolarHBondContact O-N 3.48Å; L272-P330 HydrophobicContact CD2-CB 3.56Å; L272-P330 HydrophobicContact CD2-CG 3.83Å; L272-L334 HydrophobicContact CD1-CD2 4.5Å
273	F	72.7	Confident	76.4	Confident	107 Å²	107	47.6 Å²	47.6	47%	0.469	27%	0.267	S	S	.	.	H	α-helix	trans	-56.1	-49.7	-179.9	174.9	-109.4	0	0	0	112.3	G269 K270 T271 A276 S277 Q333	G269-F273 PolarHBondContact O-N 3.04Å; K270-F273 WeakPolarHBondContact O-CB 3.47Å; K270-F273 PolarHBondContact O-N 3.45Å; T271-F273 PolarHBondContact O-N 3.05Å; F273-A276 PolarHBondContact O-N 3.3Å; F273-S277 VanDerWaalsContact O-CB 3.27Å; F273-S277 WeakPolarHBondContact O-CB 3.39Å; F273-S277 PolarHBondContact O-N 3.28Å; F273-Q333 VanDerWaalsContact CA-OE1 3.29Å; F273-Q333 HydrophobicContact CD2-CG 4.06Å
274	L	73.7	Confident	77.2	Confident	22 Å²	22	49.5 Å²	49.5	12%	0.115	27%	0.267	C	S	.	.	H	α-helix	trans	-66.1	-43.7	-176.7	-67.8	160.8	0	0	0	111.8	D209 K270 T271 L272 S277 R278	D209-L274 HydrophobicContact CB-CD1 3.57Å; D209-L274 WeakPolarHBondContact O-CD1 3.49Å; D209-L274 WeakPolarHBondContact O-CD2 3.33Å; K270-L274 HydrophobicContact CD-CD1 4.36Å; K270-L274 HydrophobicContact CG-CD1 3.8Å; K270-L274 HydrophobicContact CG-CG 4.34Å; K270-L274 WeakPolarHBondContact O-CD1 3.25Å; K270-L274 VanDerWaalsContact O-CG 3.24Å; K270-L274 WeakPolarHBondContact O-CG 3.36Å; K270-L274 PolarHBondContact O-N 3.4Å; T271-L274 PolarHBondContact O-N 3.41Å; L272-L274 PolarHBondContact O-N 3.5Å; L274-S277 PolarHBondContact O-N 3.45Å; L274-R278 WeakPolarHBondContact O-CB 3.32Å; L274-R278 VanDerWaalsContact O-CG 3.24Å; L274-R278 WeakPolarHBondContact O-CG 3.43Å; L274-R278 PolarHBondContact O-N 3.35Å
275	Q	78.2	Confident	78.1	Confident	39 Å²	39	49.3 Å²	49.3	18%	0.182	27%	0.266	C	S	.	.	H	α-helix	trans	-66.5	-42.5	177.8	-71.9	-174.6	-5.1	0	0	111.9	L264 N267 T271 L272 R278 C279	L264-Q275 HydrophobicContact CD2-CB 3.58Å; L264-Q275 HydrophobicContact CG-CB 4.37Å; N267-Q275 VanDerWaalsContact ND2-CD 3.26Å; N267-Q275 PolarHBondContact ND2-NE2 3.03Å; N267-Q275 VanDerWaalsContact ND2-NE2 3.19Å; N267-Q275 PolarHBondContact ND2-OE1 3.04Å; T271-Q275 WeakPolarHBondContact O-CB 3.43Å; T271-Q275 WeakPolarHBondContact O-CG 3.41Å; T271-Q275 PolarHBondContact O-N 3.06Å; L272-Q275 PolarHBondContact O-N 3.43Å; Q275-R278 PolarHBondContact O-N 2.88Å; Q275-C279 PolarHBondContact O-N 3.24Å; Q275-C279 PolarHBondContact O-SG 2.84Å
276	A	78.6	Confident	79.4	Confident	5 Å²	5	44.8 Å²	44.8	4%	0.041	24%	0.239	C	C	.	.	H	α-helix	trans	-62.9	-43.4	176.4	0	0	0	0	0	111.3	L264 L272 F273 C279 A280 Q333 L337	L264-A276 HydrophobicContact CD2-CB 4.45Å; L272-A276 VanDerWaalsContact O-CB 3.26Å; L272-A276 WeakPolarHBondContact O-CB 3.21Å; L272-A276 PolarHBondContact O-N 3.48Å; F273-A276 PolarHBondContact O-N 3.3Å; A276-C279 PolarHBondContact O-N 3.4Å; A276-A280 WeakPolarHBondContact O-CB 3.43Å; A276-A280 PolarHBondContact O-N 3.31Å; A276-Q333 HydrophobicContact CB-CB 4.45Å; A276-L337 HydrophobicContact CB-CD2 4.15Å
277	S	78.9	Confident	80.4	Confident	50 Å²	50	41.1 Å²	41.1	35%	0.35	21%	0.213	S	C	.	.	H	α-helix	trans	-61	-44.7	175.2	-172	0	0	0	0	111.8	F273 L274 C279 A280 H281	F273-S277 VanDerWaalsContact O-CB 3.27Å; F273-S277 WeakPolarHBondContact O-CB 3.39Å; F273-S277 PolarHBondContact O-N 3.28Å; L274-S277 PolarHBondContact O-N 3.45Å; S277-C279 PolarHBondContact O-N 3.04Å; S277-A280 PolarHBondContact O-N 3.43Å; S277-H281 WeakPolarHBondContact O-CB 3.22Å; S277-H281 PolarHBondContact O-N 3.49Å
278	R	78.2	Confident	81.3	Confident	51 Å²	51	39.7 Å²	39.7	19%	0.192	21%	0.205	C	C	.	.	H	α-helix	trans	-61.4	-43.3	175.2	-75.6	173.2	178.6	-163.7	-2.8	112	S208 L274 Q275 H281 I282	S208-R278 PolarHBondContact O-NH2 3.38Å; S208-R278 VanDerWaalsContact O-NH2 3.1Å; L274-R278 WeakPolarHBondContact O-CB 3.32Å; L274-R278 VanDerWaalsContact O-CG 3.24Å; L274-R278 WeakPolarHBondContact O-CG 3.43Å; L274-R278 PolarHBondContact O-N 3.35Å; Q275-R278 PolarHBondContact O-N 2.88Å; R278-H281 PolarHBondContact O-N 3Å; R278-I282 WeakPolarHBondContact O-CG1 3.41Å; R278-I282 PolarHBondContact O-N 3.41Å
279	C	83.9	Confident	82.3	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61	-47	175.4	-66.2	0	0	0	0	110.6	L257 Q275 A276 S277 H281 I282 I283 L337	L257-C279 HydrophobicContact CD2-CB 3.58Å; Q275-C279 PolarHBondContact O-N 3.24Å; Q275-C279 PolarHBondContact O-SG 2.84Å; A276-C279 PolarHBondContact O-N 3.4Å; S277-C279 PolarHBondContact O-N 3.04Å; C279-H281 VanDerWaalsContact C-N 3.32Å; C279-H281 PolarHBondContact O-N 3.36Å; C279-I282 PolarHBondContact O-N 3.32Å; C279-I283 WeakPolarHBondContact O-CD1 3.15Å; C279-I283 WeakPolarHBondContact O-CG1 3.49Å; C279-I283 PolarHBondContact O-N 2.9Å; C279-L337 HydrophobicContact CB-CD1 3.7Å; C279-L337 HydrophobicContact CB-CD2 4.05Å
280	A	84.7	Confident	83.3	Confident	24 Å²	24	30.6 Å²	30.6	20%	0.198	15%	0.148	C	C	.	.	H	α-helix	trans	-60.8	-41.4	177.3	0	0	0	0	0	112	A276 S277 I283 W284 L337	A276-A280 WeakPolarHBondContact O-CB 3.43Å; A276-A280 PolarHBondContact O-N 3.31Å; S277-A280 PolarHBondContact O-N 3.43Å; A280-I283 PolarHBondContact O-N 3.27Å; A280-W284 WeakPolarHBondContact O-CB 3.39Å; A280-W284 PolarHBondContact O-N 2.92Å; A280-L337 HydrophobicContact CB-CD1 4.08Å
281	H	84.8	Confident	84.1	Confident	31 Å²	31	28.4 Å²	28.4	14%	0.144	14%	0.139	C	C	.	.	H	α-helix	trans	-59.9	-49.5	176.4	-177	70.5	0	0	0	111.7	D216 S277 R278 C279 I283 W284 L285	D216-H281 PolarHBondContact O-CE1 3.35Å; D216-H281 PolarHBondContact O-NE2 3.35Å; S277-H281 WeakPolarHBondContact O-CB 3.22Å; S277-H281 PolarHBondContact O-N 3.49Å; R278-H281 PolarHBondContact O-N 3Å; C279-H281 VanDerWaalsContact C-N 3.32Å; C279-H281 PolarHBondContact O-N 3.36Å; H281-I283 PolarHBondContact O-N 2.78Å; H281-W284 WeakPolarHBondContact O-CA 3.46Å; H281-W284 VanDerWaalsContact O-CB 3.27Å; H281-W284 WeakPolarHBondContact O-CB 3.37Å; H281-W284 PolarHBondContact O-N 2.81Å; H281-L285 WeakPolarHBondContact O-CG 3.32Å; H281-L285 PolarHBondContact O-N 3.4Å
282	I	87.3	Confident	84.4	Confident	12 Å²	12	26.2 Å²	26.2	6%	0.062	13%	0.125	C	C	.	.	H	α-helix	trans	-67.6	-38	-178.5	-63.1	167.9	0	0	0	111.6	V253 M256 R278 C279 W284 L285 S286	V253-I282 HydrophobicContact CB-CG2 4.18Å; V253-I282 HydrophobicContact CG1-CG2 3.75Å; V253-I282 HydrophobicContact CG2-CG2 3.46Å; V253-I282 VanDerWaalsContact CG2-CG2 3.46Å; M256-I282 HydrophobicContact CE-CB 4Å; M256-I282 HydrophobicContact CE-CD1 3.37Å; M256-I282 HydrophobicContact CE-CG1 4.25Å; M256-I282 HydrophobicContact CE-CG2 3.59Å; M256-I282 HydrophobicContact SD-CD1 3.99Å; R278-I282 WeakPolarHBondContact O-CG1 3.41Å; R278-I282 PolarHBondContact O-N 3.41Å; C279-I282 PolarHBondContact O-N 3.32Å; I282-W284 VanDerWaalsContact C-N 3.25Å; I282-W284 PolarHBondContact O-N 3.04Å; I282-L285 WeakPolarHBondContact O-CB 3.36Å; I282-L285 PolarHBondContact O-N 3.44Å; I282-S286 PolarHBondContact O-N 2.98Å; I282-S286 VanDerWaalsContact O-N 3.13Å; I282-S286 PolarHBondContact O-OG 3.05Å; I282-S286 VanDerWaalsContact O-OG 3.1Å
283	I	89	Confident	84.8	Confident	0 Å²	0	26 Å²	26	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-60.3	-40.6	170.9	-65.7	164.1	0	0	0	110	L257 C279 A280 H281 L285 S286 I287 L337 T340 I341 L344	L257-I283 HydrophobicContact CD1-CD1 3.9Å; L257-I283 HydrophobicContact CD1-CG1 3.49Å; L257-I283 VanDerWaalsContact CD1-CG1 3.49Å; L257-I283 HydrophobicContact CD2-CD1 4.15Å; L257-I283 HydrophobicContact CD2-CG1 4.15Å; L257-I283 HydrophobicContact CG-CG1 4.45Å; C279-I283 WeakPolarHBondContact O-CD1 3.15Å; C279-I283 WeakPolarHBondContact O-CG1 3.49Å; C279-I283 PolarHBondContact O-N 2.9Å; A280-I283 PolarHBondContact O-N 3.27Å; H281-I283 PolarHBondContact O-N 2.78Å; I283-L285 PolarHBondContact O-N 3.29Å; I283-S286 VanDerWaalsContact O-CB 3.3Å; I283-S286 WeakPolarHBondContact O-CB 3.31Å; I283-S286 PolarHBondContact O-N 3.32Å; I283-S286 VanDerWaalsContact O-N 3.13Å; I283-I287 HydrophobicContact CG2-CD1 4.02Å; I283-I287 WeakPolarHBondContact O-CG1 3.3Å; I283-I287 PolarHBondContact O-N 3.37Å; I283-L337 HydrophobicContact CD1-CD1 3.64Å; I283-T340 HydrophobicContact CB-CG2 3.93Å; I283-T340 HydrophobicContact CG2-CG2 3.52Å; I283-I341 HydrophobicContact CD1-CG1 3.65Å; I283-L344 HydrophobicContact CG2-CB 3.78Å; I283-L344 HydrophobicContact CG2-CD2 3.88Å; I283-L344 HydrophobicContact CG2-CG 4.41Å
284	W	90.5	Very high	85.1	Confident	103 Å²	103	24.7 Å²	24.7	39%	0.39	12%	0.122	S	C	.	.	H	α-helix	trans	-64.4	-38.3	177.7	-169.8	-112	0	0	0	113	A280 H281 I282 S286 I287 N288	A280-W284 WeakPolarHBondContact O-CB 3.39Å; A280-W284 PolarHBondContact O-N 2.92Å; H281-W284 WeakPolarHBondContact O-CA 3.46Å; H281-W284 VanDerWaalsContact O-CB 3.27Å; H281-W284 WeakPolarHBondContact O-CB 3.37Å; H281-W284 PolarHBondContact O-N 2.81Å; I282-W284 VanDerWaalsContact C-N 3.25Å; I282-W284 PolarHBondContact O-N 3.04Å; W284-S286 VanDerWaalsContact C-N 3.27Å; W284-S286 PolarHBondContact O-N 3.47Å; W284-I287 HydrophobicContact CE3-CB 4.4Å; W284-I287 HydrophobicContact CE3-CD1 3.79Å; W284-I287 HydrophobicContact CE3-CG2 4.4Å; W284-I287 HydrophobicContact CZ3-CD1 4.21Å; W284-I287 HydrophobicContact CZ3-CG2 4.29Å; W284-I287 PolarHBondContact O-N 2.92Å; W284-N288 PolarHBondContact NE1-ND2 3.23Å; W284-N288 VanDerWaalsContact NE1-ND2 3.11Å; W284-N288 PolarHBondContact O-N 3.34Å; W284-N288 PolarHBondContact O-ND2 2.87Å
285	L	91.1	Very high	85.1	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-58.9	-42.1	171	-57.9	178.2	0	0	0	111.1	F201 I219 L220 N223 F249 H281 I282 I283 N288 L289	F201-L285 HydrophobicContact CB-CD1 4.39Å; I219-L285 HydrophobicContact CG2-CD1 3.52Å; I219-L285 HydrophobicContact CG2-CD2 3.97Å; I219-L285 HydrophobicContact CG2-CG 4.4Å; L220-L285 HydrophobicContact CB-CD2 4.39Å; L220-L285 HydrophobicContact CD1-CD2 3.96Å; N223-L285 HydrophobicContact CB-CD2 3.73Å; N223-L285 PolarHBondContact OD1-O 3.5Å; N223-L285 VanDerWaalsContact OD1-O 3.14Å; F249-L285 HydrophobicContact CZ-CB 4.25Å; H281-L285 WeakPolarHBondContact O-CG 3.32Å; H281-L285 PolarHBondContact O-N 3.4Å; I282-L285 WeakPolarHBondContact O-CB 3.36Å; I282-L285 PolarHBondContact O-N 3.44Å; I283-L285 PolarHBondContact O-N 3.29Å; L285-N288 PolarHBondContact O-N 3.33Å; L285-L289 PolarHBondContact O-N 2.91Å
286	S	93.4	Very high	84.7	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.3	-43.6	176.9	-51.3	0	0	0	0	111.8	I282 I283 W284 N288 L289 L290	I282-S286 PolarHBondContact O-N 2.98Å; I282-S286 VanDerWaalsContact O-N 3.13Å; I282-S286 PolarHBondContact O-OG 3.05Å; I282-S286 VanDerWaalsContact O-OG 3.1Å; I283-S286 VanDerWaalsContact O-CB 3.3Å; I283-S286 WeakPolarHBondContact O-CB 3.31Å; I283-S286 PolarHBondContact O-N 3.32Å; I283-S286 VanDerWaalsContact O-N 3.13Å; W284-S286 VanDerWaalsContact C-N 3.27Å; W284-S286 PolarHBondContact O-N 3.47Å; S286-N288 VanDerWaalsContact C-N 3.31Å; S286-N288 PolarHBondContact O-N 3.33Å; S286-L289 PolarHBondContact O-N 3.29Å; S286-L290 WeakPolarHBondContact O-CB 3.28Å; S286-L290 WeakPolarHBondContact O-CG 3.28Å; S286-L290 PolarHBondContact O-N 2.95Å
287	I	91	Very high	83.9	Confident	5 Å²	5	34.9 Å²	34.9	3%	0.026	18%	0.177	C	C	.	.	H	α-helix	trans	-59.8	-42.5	176.1	-69.3	162.7	0	0	0	110.9	I283 W284 L290 K291 T340 V343 L344	I283-I287 HydrophobicContact CG2-CD1 4.02Å; I283-I287 WeakPolarHBondContact O-CG1 3.3Å; I283-I287 PolarHBondContact O-N 3.37Å; W284-I287 HydrophobicContact CE3-CB 4.4Å; W284-I287 HydrophobicContact CE3-CD1 3.79Å; W284-I287 HydrophobicContact CE3-CG2 4.4Å; W284-I287 HydrophobicContact CZ3-CD1 4.21Å; W284-I287 HydrophobicContact CZ3-CG2 4.29Å; W284-I287 PolarHBondContact O-N 2.92Å; I287-L290 PolarHBondContact O-N 2.92Å; I287-K291 WeakPolarHBondContact O-CG 3.28Å; I287-K291 PolarHBondContact O-N 2.8Å; I287-K291 VanDerWaalsContact O-N 3.15Å; I287-T340 HydrophobicContact CD1-CG2 3.95Å; I287-V343 HydrophobicContact CD1-CB 4.06Å; I287-V343 HydrophobicContact CD1-CG1 3.73Å; I287-V343 HydrophobicContact CG1-CG1 4.38Å; I287-V343 HydrophobicContact CG2-CG1 4.38Å; I287-L344 HydrophobicContact CD1-CB 4.15Å; I287-L344 HydrophobicContact CG1-CB 3.88Å; I287-L344 HydrophobicContact CG1-CD1 3.99Å
288	N	89.7	Confident	83.6	Confident	5 Å²	5	37.6 Å²	37.6	3%	0.027	18%	0.184	C	C	.	.	H	α-helix	trans	-71	-39.5	-179.6	-71.1	-47.9	0	0	0	112.7	L220 L224 S227 W284 L285 S286 L290 K291	L220-N288 WeakPolarHBondContact CD1-ND2 3.32Å; L224-N288 HydrophobicContact CD2-CB 4.01Å; S227-N288 PolarHBondContact OG-O 3.46Å; W284-N288 PolarHBondContact NE1-ND2 3.23Å; W284-N288 VanDerWaalsContact NE1-ND2 3.11Å; W284-N288 PolarHBondContact O-N 3.34Å; W284-N288 PolarHBondContact O-ND2 2.87Å; L285-N288 PolarHBondContact O-N 3.33Å; S286-N288 VanDerWaalsContact C-N 3.31Å; S286-N288 PolarHBondContact O-N 3.33Å; N288-L290 VanDerWaalsContact C-N 3.3Å; N288-L290 PolarHBondContact O-N 3.35Å; N288-K291 WeakPolarHBondContact O-CB 3.3Å; N288-K291 PolarHBondContact O-N 3.46Å; N288-K291 VanDerWaalsContact O-N 3.13Å; N288-K291 WeakPolarHBondContact OD1-CE 3.25Å; N288-K291 PolarHBondContact OD1-NZ 3.3Å
289	L	91.1	Very high	83.7	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-56.5	-46.7	169.4	-94.9	162.6	0	0	0	110.9	N223 L226 S227 F230 F245 F249 L285 S286 K291 S292 F293	N223-L289 WeakPolarHBondContact ND2-CD1 3.33Å; L226-L289 HydrophobicContact CD2-CD2 4.37Å; S227-L289 WeakPolarHBondContact OG-CA 3.23Å; S227-L289 PolarHBondContact OG-N 2.89Å; F230-L289 HydrophobicContact CD2-CD2 3.65Å; F230-L289 HydrophobicContact CE2-CD2 3.6Å; F245-L289 HydrophobicContact CE1-CD2 4.44Å; F249-L289 HydrophobicContact CD1-CD1 3.54Å; F249-L289 HydrophobicContact CD2-CD1 4.22Å; F249-L289 HydrophobicContact CE1-CD1 3.58Å; F249-L289 HydrophobicContact CE2-CD1 4.26Å; F249-L289 HydrophobicContact CG-CD1 3.89Å; F249-L289 HydrophobicContact CZ-CD1 3.96Å; L285-L289 PolarHBondContact O-N 2.91Å; S286-L289 PolarHBondContact O-N 3.29Å; L289-K291 PolarHBondContact O-N 3.48Å; L289-S292 PolarHBondContact O-N 3.46Å; L289-S292 VanDerWaalsContact O-N 3.15Å; L289-S292 PolarHBondContact O-OG 3.5Å; L289-F293 WeakPolarHBondContact O-CD2 3.47Å; L289-F293 WeakPolarHBondContact O-CE2 3.11Å
290	L	91.1	Very high	83.7	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-66.3	-18.5	179.3	-72	-178.9	0	0	0	114.1	T246 I250 S286 I287 N288 S292 F293 F300 L344 K347 I348 L351	T246-L290 HydrophobicContact CG2-CD2 4.11Å; I250-L290 HydrophobicContact CD1-CD1 3.97Å; I250-L290 HydrophobicContact CD1-CD2 3.51Å; I250-L290 HydrophobicContact CD1-CG 3.86Å; S286-L290 WeakPolarHBondContact O-CB 3.28Å; S286-L290 WeakPolarHBondContact O-CG 3.28Å; S286-L290 PolarHBondContact O-N 2.95Å; I287-L290 PolarHBondContact O-N 2.92Å; N288-L290 VanDerWaalsContact C-N 3.3Å; N288-L290 PolarHBondContact O-N 3.35Å; L290-S292 PolarHBondContact O-N 3.21Å; L290-F293 HydrophobicContact CD2-CD2 4.43Å; L290-F293 PolarHBondContact O-N 2.86Å; L290-F300 HydrophobicContact CD2-CE2 4.05Å; L290-F300 HydrophobicContact CD2-CZ 3.98Å; L290-L344 HydrophobicContact CD1-CD1 3.74Å; L290-K347 HydrophobicContact CB-CD 4.49Å; L290-K347 HydrophobicContact CB-CG 3.68Å; L290-K347 HydrophobicContact CD1-CG 3.99Å; L290-K347 WeakPolarHBondContact O-CE 3.27Å; L290-I348 HydrophobicContact CD1-CD1 4.49Å; L290-I348 HydrophobicContact CD1-CG1 3.66Å; L290-L351 HydrophobicContact CB-CD1 4.25Å; L290-L351 HydrophobicContact CD1-CD1 4.22Å; L290-L351 HydrophobicContact CD2-CD1 3.62Å; L290-L351 HydrophobicContact CG-CD1 4.24Å
291	K	86.3	Confident	83.8	Confident	87 Å²	87	39.9 Å²	39.9	38%	0.378	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-66.4	-22.9	174	-72.8	173.5	-177.7	166.4	0	113.1	I287 N288 L289 F293 D294	I287-K291 WeakPolarHBondContact O-CG 3.28Å; I287-K291 PolarHBondContact O-N 2.8Å; I287-K291 VanDerWaalsContact O-N 3.15Å; N288-K291 WeakPolarHBondContact O-CB 3.3Å; N288-K291 PolarHBondContact O-N 3.46Å; N288-K291 VanDerWaalsContact O-N 3.13Å; N288-K291 WeakPolarHBondContact OD1-CE 3.25Å; N288-K291 PolarHBondContact OD1-NZ 3.3Å; L289-K291 PolarHBondContact O-N 3.48Å; K291-F293 PolarHBondContact O-N 3.15Å; K291-D294 PolarHBondContact O-N 3.06Å
292	S	82.5	Confident	83.9	Confident	4 Å²	4	44.9 Å²	44.9	3%	0.028	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-64.3	-20.7	177.2	57.7	0	0	0	0	112.5	S227 L234 L289 L290	S227-S292 WeakPolarHBondContact O-CB 3.31Å; L234-S292 WeakPolarHBondContact CD1-O 3.4Å; L289-S292 PolarHBondContact O-N 3.46Å; L289-S292 VanDerWaalsContact O-N 3.15Å; L289-S292 PolarHBondContact O-OG 3.5Å; L290-S292 PolarHBondContact O-N 3.21Å
293	F	84.4	Confident	84	Confident	1 Å²	1	50.7 Å²	50.7	0%	0.004	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-104.1	12.4	-174	-50.2	-90.1	0	0	0	113.5	L234 I242 V243 T246 L289 L290 K291 D295 D296 I299 F300 L351	L234-F293 HydrophobicContact CD1-CD1 3.69Å; L234-F293 HydrophobicContact CD1-CE1 4.1Å; L234-F293 HydrophobicContact CD1-CG 4.28Å; L234-F293 HydrophobicContact CD2-CD1 3.78Å; L234-F293 HydrophobicContact CD2-CE1 3.34Å; L234-F293 HydrophobicContact CD2-CZ 4.13Å; L234-F293 HydrophobicContact CG-CD1 4.43Å; L234-F293 HydrophobicContact CG-CE1 4.38Å; I242-F293 HydrophobicContact CG2-CE1 4.09Å; I242-F293 HydrophobicContact CG2-CZ 3.79Å; V243-F293 HydrophobicContact CG2-CE1 4.2Å; T246-F293 HydrophobicContact CG2-CE2 3.83Å; T246-F293 HydrophobicContact CG2-CZ 4.15Å; L289-F293 WeakPolarHBondContact O-CD2 3.47Å; L289-F293 WeakPolarHBondContact O-CE2 3.11Å; L290-F293 HydrophobicContact CD2-CD2 4.43Å; L290-F293 PolarHBondContact O-N 2.86Å; K291-F293 PolarHBondContact O-N 3.15Å; F293-D295 PolarHBondContact O-N 3.4Å; F293-D296 PolarHBondContact O-N 3.41Å; F293-I299 HydrophobicContact CD1-CB 4.43Å; F293-I299 HydrophobicContact CD1-CD1 3.65Å; F293-I299 HydrophobicContact CD1-CG2 3.82Å; F293-I299 HydrophobicContact CE1-CD1 4.38Å; F293-I299 HydrophobicContact CE1-CG2 4.02Å; F293-F300 HydrophobicContact CB-CE2 4.06Å; F293-F300 AromaticContact CD1-CE2 3.87Å; F293-F300 HydrophobicContact CD1-CE2 3.87Å; F293-F300 AromaticContact CD1-CZ 3.96Å; F293-F300 HydrophobicContact CD1-CZ 3.96Å; F293-F300 AromaticContact CD2-CE2 3.91Å; F293-F300 HydrophobicContact CD2-CE2 3.91Å; F293-F300 AromaticContact CD2-CZ 3.85Å; F293-F300 HydrophobicContact CD2-CZ 3.85Å; F293-F300 HydrophobicContact CE1-CE2 4.23Å; F293-F300 AromaticContact CE1-CZ 3.84Å; F293-F300 HydrophobicContact CE1-CZ 3.84Å; F293-F300 HydrophobicContact CE2-CE2 4.31Å; F293-F300 AromaticContact CE2-CZ 3.77Å; F293-F300 HydrophobicContact CE2-CZ 3.77Å; F293-F300 AromaticContact CG-CE2 3.67Å; F293-F300 HydrophobicContact CG-CE2 3.67Å; F293-F300 AromaticContact CG-CZ 3.95Å; F293-F300 HydrophobicContact CG-CZ 3.95Å; F293-F300 HydrophobicContact CZ-CE2 4.45Å; F293-F300 AromaticContact CZ-CZ 3.76Å; F293-F300 HydrophobicContact CZ-CZ 3.76Å; F293-L351 HydrophobicContact CB-CD2 3.86Å; F293-L351 WeakPolarHBondContact O-CD2 3.35Å
294	D	79.1	Confident	84.1	Confident	80 Å²	80	52.3 Å²	52.3	43%	0.428	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-27.8	-177.9	-88.2	-38.4	0	0	0	114.1	K291 K347	K291-D294 PolarHBondContact O-N 3.06Å; D294-K347 WeakPolarHBondContact OD1-CE 3.16Å; D294-K347 IonicContact OD1-NZ 3.37Å; D294-K347 PolarHBondContact OD1-NZ 3.5Å; D294-K347 IonicContact OD2-NZ 3.31Å; D294-K347 PolarHBondContact OD2-NZ 3.42Å
295	D	72.7	Confident	84	Confident	116 Å²	116	47.5 Å²	47.5	62%	0.62	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-7.6	-174.7	-57.1	-44.9	0	0	0	112.8	K231 F293	K231-D295 VanDerWaalsContact CE-OD2 3.24Å; K231-D295 WeakPolarHBondContact CE-OD2 3.48Å; K231-D295 IonicContact NZ-OD2 2.63Å; K231-D295 PolarHBondContact NZ-OD2 2.93Å; F293-D295 PolarHBondContact O-N 3.4Å
296	D	70	Confident	83.9	Confident	43 Å²	43	53.3 Å²	53.3	23%	0.23	26%	0.259	C	S	.	.			trans	-118.4	107.3	-167.8	-73.9	-44.3	0	0	0	112.5	L234 F293 I299	L234-D296 WeakPolarHBondContact CD1-OD2 3.43Å; F293-D296 PolarHBondContact O-N 3.41Å; D296-I299 HydrophobicContact CB-CD1 3.15Å; D296-I299 HydrophobicContact CB-CG1 3.77Å
297	D	63.2	Low	83.9	Confident	121 Å²	121	59.9 Å²	59.9	65%	0.647	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	140.7	179	-73	-22.4	0	0	0	112.5	I299	D297-I299 VanDerWaalsContact C-N 3.26Å; D297-I299 PolarHBondContact O-N 3.34Å
298	Q	71.1	Confident	84	Confident	107 Å²	107	59.7 Å²	59.7	50%	0.5	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	31.9	166.4	-56.2	177.7	13.5	0	0	114.8	R302	Q298-R302 VanDerWaalsContact NE2-NH2 3.17Å
299	I	80.4	Confident	84	Confident	18 Å²	18	60 Å²	60	9%	0.092	29%	0.285	C	S	.	.			trans	-67.5	-40.9	173.6	-80.4	-171	0	0	0	112.1	L234 V243 F293 D296 D297	L234-I299 HydrophobicContact CD1-CD1 4.31Å; V243-I299 HydrophobicContact CB-CG2 4.26Å; V243-I299 HydrophobicContact CG1-CG2 4.06Å; V243-I299 HydrophobicContact CG2-CG2 3.17Å; F293-I299 HydrophobicContact CD1-CB 4.43Å; F293-I299 HydrophobicContact CD1-CD1 3.65Å; F293-I299 HydrophobicContact CD1-CG2 3.82Å; F293-I299 HydrophobicContact CE1-CD1 4.38Å; F293-I299 HydrophobicContact CE1-CG2 4.02Å; D296-I299 HydrophobicContact CB-CD1 3.15Å; D296-I299 HydrophobicContact CB-CG1 3.77Å; D297-I299 VanDerWaalsContact C-N 3.26Å; D297-I299 PolarHBondContact O-N 3.34Å
300	F	84.9	Confident	84.1	Confident	14 Å²	14	64 Å²	64	6%	0.061	30%	0.304	C	S	.	.	S	Bend	trans	-94.3	147.5	-176.4	-62.9	-79.6	0	0	0	111	V243 T246 L290 F293 R302 W308 L351	V243-F300 HydrophobicContact CG1-CD1 3.97Å; V243-F300 HydrophobicContact CG1-CE1 4.05Å; T246-F300 HydrophobicContact CG2-CE1 4.03Å; T246-F300 HydrophobicContact CG2-CZ 3.86Å; L290-F300 HydrophobicContact CD2-CE2 4.05Å; L290-F300 HydrophobicContact CD2-CZ 3.98Å; F293-F300 HydrophobicContact CB-CE2 4.06Å; F293-F300 AromaticContact CD1-CE2 3.87Å; F293-F300 HydrophobicContact CD1-CE2 3.87Å; F293-F300 AromaticContact CD1-CZ 3.96Å; F293-F300 HydrophobicContact CD1-CZ 3.96Å; F293-F300 AromaticContact CD2-CE2 3.91Å; F293-F300 HydrophobicContact CD2-CE2 3.91Å; F293-F300 AromaticContact CD2-CZ 3.85Å; F293-F300 HydrophobicContact CD2-CZ 3.85Å; F293-F300 HydrophobicContact CE1-CE2 4.23Å; F293-F300 AromaticContact CE1-CZ 3.84Å; F293-F300 HydrophobicContact CE1-CZ 3.84Å; F293-F300 HydrophobicContact CE2-CE2 4.31Å; F293-F300 AromaticContact CE2-CZ 3.77Å; F293-F300 HydrophobicContact CE2-CZ 3.77Å; F293-F300 AromaticContact CG-CE2 3.67Å; F293-F300 HydrophobicContact CG-CE2 3.67Å; F293-F300 AromaticContact CG-CZ 3.95Å; F293-F300 HydrophobicContact CG-CZ 3.95Å; F293-F300 HydrophobicContact CZ-CE2 4.45Å; F293-F300 AromaticContact CZ-CZ 3.76Å; F293-F300 HydrophobicContact CZ-CZ 3.76Å; F300-R302 PolarHBondContact O-N 3.29Å; F300-W308 HydrophobicContact CD1-CH2 4.07Å; F300-W308 HydrophobicContact CD1-CZ3 4.34Å; F300-W308 HydrophobicContact CE1-CH2 4.45Å; F300-L351 HydrophobicContact CD2-CB 4.49Å; F300-L351 HydrophobicContact CD2-CD1 4.1Å; F300-L351 HydrophobicContact CE2-CD1 3.99Å
301	D	86	Confident	84.1	Confident	91 Å²	91	65.9 Å²	65.9	49%	0.487	31%	0.313	S	S	.	.			trans	-60.5	129.6	170.7	171.6	36.1	0	0	0	110.3	I303 Q304 A305	D301-I303 VanDerWaalsContact C-N 3.29Å; D301-I303 PolarHBondContact O-N 3.31Å; D301-I303 PolarHBondContact OD1-N 3.38Å; D301-I303 WeakPolarHBondContact OD2-CB 3.2Å; D301-Q304 HydrophobicContact CB-CB 4.07Å; D301-Q304 PolarHBondContact O-N 2.81Å; D301-Q304 PolarHBondContact OD2-N 3.33Å; D301-A305 WeakPolarHBondContact O-CB 3.29Å; D301-A305 PolarHBondContact O-N 3.38Å
302	R	86.6	Confident	84.2	Confident	135 Å²	135	61.7 Å²	61.7	51%	0.509	30%	0.295	S	S	.	.	H	α-helix	trans	-65.3	-34.8	-179.1	-65.4	-172.4	-179.3	176.6	1.8	111.9	Q298 F300 F306 I352	Q298-R302 VanDerWaalsContact NE2-NH2 3.17Å; F300-R302 PolarHBondContact O-N 3.29Å; R302-F306 WeakPolarHBondContact O-CB 3.34Å; R302-F306 PolarHBondContact O-N 3.08Å; R302-I352 HydrophobicContact CG-CG2 4.25Å
303	I	89.5	Confident	84.5	Confident	135 Å²	135	63.8 Å²	63.8	69%	0.692	31%	0.306	S	S	*	.	H	α-helix	trans	-66.3	-47.4	179.5	-59.4	172.1	0	0	0	108.9	D301 F306 R307	D301-I303 VanDerWaalsContact C-N 3.29Å; D301-I303 PolarHBondContact O-N 3.31Å; D301-I303 PolarHBondContact OD1-N 3.38Å; D301-I303 WeakPolarHBondContact OD2-CB 3.2Å; I303-F306 PolarHBondContact O-N 3.36Å; I303-R307 PolarHBondContact O-N 2.89Å
304	Q	90.6	Very high	84.5	Confident	34 Å²	34	72 Å²	72	16%	0.159	34%	0.337	C	S	.	.	H	α-helix	trans	-61.9	-47.2	176.3	-172.7	61.3	19.3	0	0	112.8	T247 D251 D301 F306 R307 W308	T247-Q304 HydrophobicContact CG2-CG 3.93Å; D251-Q304 PolarHBondContact OD1-NE2 3Å; D251-Q304 PolarHBondContact OD2-NE2 3.33Å; D251-Q304 VanDerWaalsContact OD2-NE2 3.14Å; D301-Q304 HydrophobicContact CB-CB 4.07Å; D301-Q304 PolarHBondContact O-N 2.81Å; D301-Q304 PolarHBondContact OD2-N 3.33Å; Q304-F306 VanDerWaalsContact C-N 3.32Å; Q304-F306 PolarHBondContact O-N 3.1Å; Q304-R307 VanDerWaalsContact O-CB 3.3Å; Q304-R307 WeakPolarHBondContact O-CB 3.31Å; Q304-R307 PolarHBondContact O-N 3.24Å; Q304-R307 VanDerWaalsContact O-N 3.12Å; Q304-W308 HydrophobicContact CG-CH2 4.48Å; Q304-W308 HydrophobicContact CG-CZ2 3.85Å; Q304-W308 VanDerWaalsContact NE2-NE1 3.13Å; Q304-W308 PolarHBondContact O-N 2.87Å
305	A	89.1	Confident	84.6	Confident	2 Å²	2	69.2 Å²	69.2	2%	0.017	32%	0.32	C	S	.	.	H	α-helix	trans	-66	-35.1	179.8	0	0	0	0	0	112.2	D301 W308 V309 I348 I352	D301-A305 WeakPolarHBondContact O-CB 3.29Å; D301-A305 PolarHBondContact O-N 3.38Å; A305-W308 HydrophobicContact CB-CE3 4.09Å; A305-W308 HydrophobicContact CB-CZ3 4.37Å; A305-W308 WeakPolarHBondContact O-CB 3.19Å; A305-W308 PolarHBondContact O-N 3.43Å; A305-V309 WeakPolarHBondContact O-CG2 3.43Å; A305-V309 PolarHBondContact O-N 2.81Å; A305-V309 VanDerWaalsContact O-N 3.12Å; A305-I348 HydrophobicContact CB-CG2 4.07Å; A305-I352 HydrophobicContact CB-CD1 3.29Å; A305-I352 HydrophobicContact CB-CG1 3.43Å; A305-I352 VanDerWaalsContact CB-CG1 3.43Å
306	F	89.5	Confident	85	Confident	121 Å²	121	64.7 Å²	64.7	53%	0.531	30%	0.296	S	S	.	.	H	α-helix	trans	-64.8	-39.3	172	-176.8	-108.9	0	0	0	111.9	R302 I303 Q304 W308 V309 Q310	R302-F306 WeakPolarHBondContact O-CB 3.34Å; R302-F306 PolarHBondContact O-N 3.08Å; I303-F306 PolarHBondContact O-N 3.36Å; Q304-F306 VanDerWaalsContact C-N 3.32Å; Q304-F306 PolarHBondContact O-N 3.1Å; F306-W308 VanDerWaalsContact C-N 3.31Å; F306-W308 PolarHBondContact O-N 3.31Å; F306-V309 PolarHBondContact O-N 3.06Å; F306-Q310 HydrophobicContact CD1-CG 4.26Å; F306-Q310 HydrophobicContact CE1-CG 4.01Å; F306-Q310 HydrophobicContact CZ-CG 4.21Å; F306-Q310 WeakPolarHBondContact O-CG 3.17Å; F306-Q310 PolarHBondContact O-N 3.24Å
307	R	92.4	Very high	85.4	Confident	138 Å²	138	68.6 Å²	68.6	52%	0.521	31%	0.313	S	S	.	.	H	α-helix	trans	-58.8	-42.3	172.9	-178.7	-175.5	176.9	-171.7	-2.6	111.4	I303 Q304 Q310 I311	I303-R307 PolarHBondContact O-N 2.89Å; Q304-R307 VanDerWaalsContact O-CB 3.3Å; Q304-R307 WeakPolarHBondContact O-CB 3.31Å; Q304-R307 PolarHBondContact O-N 3.24Å; Q304-R307 VanDerWaalsContact O-N 3.12Å; R307-Q310 PolarHBondContact O-N 2.63Å; R307-I311 HydrophobicContact CG-CD1 4.07Å; R307-I311 VanDerWaalsContact O-CG1 3.27Å; R307-I311 WeakPolarHBondContact O-CG1 3.33Å; R307-I311 PolarHBondContact O-N 2.77Å
308	W	93.7	Very high	86	Confident	1 Å²	1	65.3 Å²	65.3	0%	0.004	30%	0.3	C	S	.	.	H	α-helix	trans	-60.2	-45.3	174.6	-62.3	-26.1	0	0	0	112.5	T247 I250 D251 L254 F300 Q304 A305 F306 Q310 I311 L312 I348	T247-W308 HydrophobicContact CG2-CH2 4.12Å; T247-W308 HydrophobicContact CG2-CZ2 3.67Å; I250-W308 HydrophobicContact CB-CH2 4.23Å; I250-W308 HydrophobicContact CB-CZ2 3.85Å; I250-W308 HydrophobicContact CD1-CE3 4.37Å; I250-W308 HydrophobicContact CD1-CH2 3.75Å; I250-W308 HydrophobicContact CD1-CZ2 4.27Å; I250-W308 HydrophobicContact CD1-CZ3 3.8Å; I250-W308 HydrophobicContact CG2-CD2 3.68Å; I250-W308 HydrophobicContact CG2-CE3 4.11Å; I250-W308 HydrophobicContact CG2-CG 4.05Å; I250-W308 HydrophobicContact CG2-CH2 4.32Å; I250-W308 HydrophobicContact CG2-CZ2 3.86Å; I250-W308 HydrophobicContact CG2-CZ3 4.43Å; D251-W308 PolarHBondContact OD1-NE1 3.42Å; L254-W308 HydrophobicContact CD1-CB 3.91Å; L254-W308 HydrophobicContact CD1-CG 3.74Å; F300-W308 HydrophobicContact CD1-CH2 4.07Å; F300-W308 HydrophobicContact CD1-CZ3 4.34Å; F300-W308 HydrophobicContact CE1-CH2 4.45Å; Q304-W308 HydrophobicContact CG-CH2 4.48Å; Q304-W308 HydrophobicContact CG-CZ2 3.85Å; Q304-W308 VanDerWaalsContact NE2-NE1 3.13Å; Q304-W308 PolarHBondContact O-N 2.87Å; A305-W308 HydrophobicContact CB-CE3 4.09Å; A305-W308 HydrophobicContact CB-CZ3 4.37Å; A305-W308 WeakPolarHBondContact O-CB 3.19Å; A305-W308 PolarHBondContact O-N 3.43Å; F306-W308 VanDerWaalsContact C-N 3.31Å; F306-W308 PolarHBondContact O-N 3.31Å; W308-Q310 VanDerWaalsContact C-N 3.34Å; W308-Q310 PolarHBondContact O-N 2.88Å; W308-I311 PolarHBondContact O-N 3.41Å; W308-L312 WeakPolarHBondContact O-CG 3.28Å; W308-L312 PolarHBondContact O-N 3.4Å; W308-I348 HydrophobicContact CB-CD1 3.92Å; W308-I348 HydrophobicContact CB-CG2 4.39Å; W308-I348 HydrophobicContact CE3-CD1 4.12Å; W308-I348 HydrophobicContact CE3-CG1 4.27Å; W308-I348 HydrophobicContact CE3-CG2 3.98Å
309	V	90.6	Very high	85.9	Confident	13 Å²	13	60.5 Å²	60.5	8%	0.079	28%	0.277	C	S	.	.	H	α-helix	trans	-60.1	-45	177.2	174	0	0	0	0	111.1	A305 F306 I311 L312 D313 K345 I348 I349	A305-V309 WeakPolarHBondContact O-CG2 3.43Å; A305-V309 PolarHBondContact O-N 2.81Å; A305-V309 VanDerWaalsContact O-N 3.12Å; F306-V309 PolarHBondContact O-N 3.06Å; V309-I311 VanDerWaalsContact C-N 3.31Å; V309-I311 PolarHBondContact O-N 3.29Å; V309-L312 PolarHBondContact O-N 3.33Å; V309-D313 WeakPolarHBondContact O-CB 3.19Å; V309-D313 PolarHBondContact O-N 2.86Å; V309-K345 HydrophobicContact CG1-CD 4.39Å; V309-K345 HydrophobicContact CG1-CG 4.23Å; V309-I348 HydrophobicContact CG2-CB 4.36Å; V309-I348 HydrophobicContact CG2-CG2 3.76Å; V309-I349 HydrophobicContact CG1-CD1 4.36Å; V309-I349 HydrophobicContact CG1-CG1 4.42Å; V309-I349 HydrophobicContact CG2-CG1 3.79Å
310	Q	91.6	Very high	85.2	Confident	83 Å²	83	64.7 Å²	64.7	39%	0.388	30%	0.296	S	S	.	.	H	α-helix	trans	-61	-39.1	176.8	-71.7	-175.2	-25.5	0	0	113	F306 R307 W308 D313 R314	F306-Q310 HydrophobicContact CD1-CG 4.26Å; F306-Q310 HydrophobicContact CE1-CG 4.01Å; F306-Q310 HydrophobicContact CZ-CG 4.21Å; F306-Q310 WeakPolarHBondContact O-CG 3.17Å; F306-Q310 PolarHBondContact O-N 3.24Å; R307-Q310 PolarHBondContact O-N 2.63Å; W308-Q310 VanDerWaalsContact C-N 3.34Å; W308-Q310 PolarHBondContact O-N 2.88Å; Q310-D313 PolarHBondContact O-N 2.87Å; Q310-R314 WeakPolarHBondContact O-CG 3.29Å; Q310-R314 PolarHBondContact O-N 3.48Å; Q310-R314 VanDerWaalsContact O-N 3.13Å
311	I	91	Very high	84.3	Confident	39 Å²	39	69.7 Å²	69.7	20%	0.2	32%	0.323	C	S	.	.	H	α-helix	trans	-62.8	-48.4	176	-70.9	166.6	0	0	0	109.9	L254 R307 W308 V309 D313 R314 W315	L254-I311 HydrophobicContact CB-CG2 4.4Å; L254-I311 HydrophobicContact CD1-CD1 4.28Å; L254-I311 HydrophobicContact CD1-CG2 4.46Å; L254-I311 HydrophobicContact CD2-CG2 4.42Å; R307-I311 HydrophobicContact CG-CD1 4.07Å; R307-I311 VanDerWaalsContact O-CG1 3.27Å; R307-I311 WeakPolarHBondContact O-CG1 3.33Å; R307-I311 PolarHBondContact O-N 2.77Å; W308-I311 PolarHBondContact O-N 3.41Å; V309-I311 VanDerWaalsContact C-N 3.31Å; V309-I311 PolarHBondContact O-N 3.29Å; I311-D313 VanDerWaalsContact C-N 3.33Å; I311-D313 PolarHBondContact O-N 2.88Å; I311-R314 PolarHBondContact O-N 3.46Å; I311-W315 HydrophobicContact CG2-CD2 4.06Å; I311-W315 VanDerWaalsContact CG2-CE2 3.43Å; I311-W315 HydrophobicContact CG2-CE3 4.31Å; I311-W315 HydrophobicContact CG2-CH2 3.37Å; I311-W315 HydrophobicContact CG2-CZ2 3.06Å; I311-W315 HydrophobicContact CG2-CZ3 4.01Å; I311-W315 VanDerWaalsContact O-CG 3.28Å; I311-W315 PolarHBondContact O-N 2.82Å
312	L	90.1	Very high	83.1	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-63.2	-37.7	178.9	-66.1	165.1	0	0	0	112.2	L254 W308 V309 W315 L316 I341 L344 K345 I348	L254-L312 HydrophobicContact CD2-CD2 3.78Å; L254-L312 HydrophobicContact CD2-CG 4.17Å; W308-L312 WeakPolarHBondContact O-CG 3.28Å; W308-L312 PolarHBondContact O-N 3.4Å; V309-L312 PolarHBondContact O-N 3.33Å; L312-W315 HydrophobicContact CD2-CE3 3.72Å; L312-W315 HydrophobicContact CD2-CZ3 3.52Å; L312-W315 HydrophobicContact CG-CE3 4.48Å; L312-W315 HydrophobicContact CG-CZ3 4.37Å; L312-W315 WeakPolarHBondContact O-CB 3.21Å; L312-W315 PolarHBondContact O-N 2.86Å; L312-L316 WeakPolarHBondContact O-CG 3.26Å; L312-L316 PolarHBondContact O-N 3.45Å; L312-I341 HydrophobicContact CB-CG2 4.22Å; L312-I341 HydrophobicContact CD2-CG2 3.79Å; L312-L344 HydrophobicContact CD1-CD2 4.32Å; L312-L344 HydrophobicContact CD1-CG 4.18Å; L312-L344 HydrophobicContact CD2-CD2 4.09Å; L312-K345 HydrophobicContact CB-CB 4.43Å; L312-K345 HydrophobicContact CD1-CB 3.96Å; L312-I348 HydrophobicContact CD1-CD1 3.79Å
313	D	87.2	Confident	81.8	Confident	47 Å²	47	60.6 Å²	60.6	25%	0.251	29%	0.287	S	S	.	.	H	α-helix	trans	-65.8	-47.5	178.4	-83.4	-25.2	0	0	0	112.9	V309 Q310 I311 W315 L316 E317 K345	V309-D313 WeakPolarHBondContact O-CB 3.19Å; V309-D313 PolarHBondContact O-N 2.86Å; Q310-D313 PolarHBondContact O-N 2.87Å; I311-D313 VanDerWaalsContact C-N 3.33Å; I311-D313 PolarHBondContact O-N 2.88Å; D313-W315 PolarHBondContact O-N 3.49Å; D313-W315 VanDerWaalsContact O-N 3.16Å; D313-L316 PolarHBondContact O-N 2.8Å; D313-L316 VanDerWaalsContact O-N 3.13Å; D313-E317 WeakPolarHBondContact O-CG 3.41Å; D313-E317 PolarHBondContact O-N 2.98Å; D313-K345 WeakPolarHBondContact OD1-CD 3.19Å; D313-K345 WeakPolarHBondContact OD1-CE 3.48Å; D313-K345 IonicContact OD1-NZ 3.46Å; D313-K345 PolarHBondContact OD1-NZ 3.35Å; D313-K345 IonicContact OD2-NZ 3.56Å; D313-K345 PolarHBondContact OD2-NZ 3.45Å
314	R	86.2	Confident	80.3	Confident	175 Å²	175	60.7 Å²	60.7	66%	0.66	29%	0.288	S	S	*	.	H	α-helix	trans	-55.6	-35	174.1	-72.8	176.5	-179	-177.1	2.4	111.7	Q310 I311 S318	Q310-R314 WeakPolarHBondContact O-CG 3.29Å; Q310-R314 PolarHBondContact O-N 3.48Å; Q310-R314 VanDerWaalsContact O-N 3.13Å; I311-R314 PolarHBondContact O-N 3.46Å; R314-S318 WeakPolarHBondContact O-CB 3.3Å; R314-S318 PolarHBondContact O-N 2.78Å
315	W	80.4	Confident	78.7	Confident	21 Å²	21	67.4 Å²	67.4	8%	0.08	32%	0.32	C	S	.	.	H	α-helix	trans	-73.1	-45.8	176.9	-60.7	-23.2	0	0	0	113	L254 L257 C258 I311 L312 D313 E317 S318 Q319	L254-W315 HydrophobicContact CB-CH2 3.74Å; L254-W315 HydrophobicContact CB-CZ2 4.44Å; L254-W315 HydrophobicContact CD2-CH2 3.34Å; L254-W315 HydrophobicContact CD2-CZ3 3.39Å; L254-W315 HydrophobicContact CG-CH2 4.1Å; L254-W315 VanDerWaalsContact O-CH2 3.24Å; L254-W315 WeakPolarHBondContact O-CH2 3.46Å; L254-W315 VanDerWaalsContact O-CZ2 3.23Å; L254-W315 WeakPolarHBondContact O-CZ2 3.24Å; L257-W315 HydrophobicContact CB-CH2 3.85Å; L257-W315 HydrophobicContact CB-CZ2 4.4Å; L257-W315 HydrophobicContact CB-CZ3 4.13Å; L257-W315 HydrophobicContact CD1-CH2 4.28Å; L257-W315 HydrophobicContact CD1-CZ3 3.98Å; C258-W315 HydrophobicContact CB-CZ2 4.14Å; C258-W315 WeakPolarHBondContact SG-CZ2 3.34Å; C258-W315 PolarHBondContact SG-NE1 2.88Å; I311-W315 HydrophobicContact CG2-CD2 4.06Å; I311-W315 VanDerWaalsContact CG2-CE2 3.43Å; I311-W315 HydrophobicContact CG2-CE3 4.31Å; I311-W315 HydrophobicContact CG2-CH2 3.37Å; I311-W315 HydrophobicContact CG2-CZ2 3.06Å; I311-W315 HydrophobicContact CG2-CZ3 4.01Å; I311-W315 VanDerWaalsContact O-CG 3.28Å; I311-W315 PolarHBondContact O-N 2.82Å; L312-W315 HydrophobicContact CD2-CE3 3.72Å; L312-W315 HydrophobicContact CD2-CZ3 3.52Å; L312-W315 HydrophobicContact CG-CE3 4.48Å; L312-W315 HydrophobicContact CG-CZ3 4.37Å; L312-W315 WeakPolarHBondContact O-CB 3.21Å; L312-W315 PolarHBondContact O-N 2.86Å; D313-W315 PolarHBondContact O-N 3.49Å; D313-W315 VanDerWaalsContact O-N 3.16Å; W315-E317 PolarHBondContact O-N 3.39Å; W315-S318 WeakPolarHBondContact CA-OG 3.25Å; W315-S318 PolarHBondContact O-N 2.83Å; W315-S318 VanDerWaalsContact O-N 3.1Å; W315-S318 PolarHBondContact O-OG 3.43Å; W315-Q319 WeakPolarHBondContact O-CG 3.42Å; W315-Q319 PolarHBondContact O-N 2.84Å
316	L	80.3	Confident	77.1	Confident	21 Å²	21	69.1 Å²	69.1	11%	0.11	33%	0.334	C	S	.	.	H	α-helix	trans	-55.5	-42.5	175.6	-73	172.4	0	0	0	110.8	L312 D313 Q319 Q320 M338 I341 K345	L312-L316 WeakPolarHBondContact O-CG 3.26Å; L312-L316 PolarHBondContact O-N 3.45Å; D313-L316 PolarHBondContact O-N 2.8Å; D313-L316 VanDerWaalsContact O-N 3.13Å; L316-Q319 PolarHBondContact O-N 3.27Å; L316-Q320 VanDerWaalsContact O-CG 3.29Å; L316-Q320 WeakPolarHBondContact O-CG 3.41Å; L316-Q320 PolarHBondContact O-N 2.82Å; L316-M338 HydrophobicContact CD2-CB 4.12Å; L316-M338 HydrophobicContact CD2-CE 4.38Å; L316-M338 HydrophobicContact CD2-CG 4.3Å; L316-I341 HydrophobicContact CD1-CG2 4.18Å; L316-I341 HydrophobicContact CD2-CB 4.13Å; L316-I341 HydrophobicContact CD2-CG2 3.72Å; L316-I341 HydrophobicContact CG-CG2 3.75Å; L316-K345 HydrophobicContact CD1-CD 4.36Å
317	E	79.7	Confident	75.6	Confident	124 Å²	124	70.9 Å²	70.9	58%	0.579	34%	0.344	S	S	*	.	H	α-helix	trans	-62	-47	174	-69.7	173.6	-179	0	0	112.1	D313 W315 Q319 Q320 L321	D313-E317 WeakPolarHBondContact O-CG 3.41Å; D313-E317 PolarHBondContact O-N 2.98Å; W315-E317 PolarHBondContact O-N 3.39Å; E317-Q319 VanDerWaalsContact C-N 3.31Å; E317-Q319 PolarHBondContact O-N 3.21Å; E317-Q320 PolarHBondContact O-N 3.36Å; E317-L321 PolarHBondContact O-N 3.27Å
318	S	75.8	Confident	73.9	Confident	53 Å²	53	73.3 Å²	73.3	37%	0.371	35%	0.353	S	S	.	.	H	α-helix	trans	-62.1	-35.6	178.8	74.8	0	0	0	0	113.3	R314 W315 L321 S322	R314-S318 WeakPolarHBondContact O-CB 3.3Å; R314-S318 PolarHBondContact O-N 2.78Å; W315-S318 WeakPolarHBondContact CA-OG 3.25Å; W315-S318 PolarHBondContact O-N 2.83Å; W315-S318 VanDerWaalsContact O-N 3.1Å; W315-S318 PolarHBondContact O-OG 3.43Å; S318-L321 PolarHBondContact O-N 2.84Å; S318-S322 PolarHBondContact O-N 2.81Å
319	Q	67.8	Low	71.9	Confident	6 Å²	6	80.3 Å²	80.3	3%	0.028	38%	0.384	C	S	.	.	H	α-helix	trans	-80.1	-28.3	-179.9	-67.6	-58	-38.6	0	0	112.6	F261 W315 L316 E317 L321 S322 T323 M338	F261-Q319 HydrophobicContact CE1-CG 4.38Å; W315-Q319 WeakPolarHBondContact O-CG 3.42Å; W315-Q319 PolarHBondContact O-N 2.84Å; L316-Q319 PolarHBondContact O-N 3.27Å; E317-Q319 VanDerWaalsContact C-N 3.31Å; E317-Q319 PolarHBondContact O-N 3.21Å; Q319-L321 PolarHBondContact O-N 3.48Å; Q319-S322 WeakPolarHBondContact CA-OG 3.22Å; Q319-S322 PolarHBondContact O-N 3.47Å; Q319-S322 PolarHBondContact O-OG 3.32Å; Q319-S322 PolarHBondContact OE1-OG 2.84Å; Q319-T323 WeakPolarHBondContact O-CB 3.46Å; Q319-T323 WeakPolarHBondContact O-CG2 3.31Å; Q319-T323 PolarHBondContact O-N 3.18Å; Q319-T323 PolarHBondContact O-OG1 3.34Å; Q319-M338 HydrophobicContact CB-CG 4.01Å; Q319-M338 HydrophobicContact CB-SD 3.97Å
320	Q	67	Low	70.4	Confident	105 Å²	105	80.7 Å²	80.7	49%	0.491	39%	0.386	S	S	.	.	H	α-helix	trans	-61.2	-37.1	170.3	-76.2	174	2.9	0	0	111.3	L316 E317 T323 N324 M338	L316-Q320 VanDerWaalsContact O-CG 3.29Å; L316-Q320 WeakPolarHBondContact O-CG 3.41Å; L316-Q320 PolarHBondContact O-N 2.82Å; E317-Q320 PolarHBondContact O-N 3.36Å; Q320-T323 WeakPolarHBondContact CA-OG1 3.43Å; Q320-T323 PolarHBondContact O-OG1 2.8Å; Q320-T323 VanDerWaalsContact O-OG1 3.06Å; Q320-N324 VanDerWaalsContact O-CG 3.29Å; Q320-N324 PolarHBondContact O-N 2.72Å; Q320-N324 PolarHBondContact O-ND2 2.83Å; Q320-N324 VanDerWaalsContact O-ND2 3.15Å; Q320-M338 HydrophobicContact CG-CE 3.63Å
321	L	64.7	Low	69	Low	120 Å²	120	81 Å²	81	63%	0.628	39%	0.389	S	S	*	.	H	α-helix	trans	-67.4	-40.8	174.8	-64.6	172.5	0	0	0	112.5	E317 S318 Q319	E317-L321 PolarHBondContact O-N 3.27Å; S318-L321 PolarHBondContact O-N 2.84Å; Q319-L321 PolarHBondContact O-N 3.48Å
322	S	62	Low	67.7	Low	19 Å²	19	83.5 Å²	83.5	13%	0.133	41%	0.406	C	S	.	.	H	α-helix	trans	-71	-40.6	180	68.2	0	0	0	0	112.7	S318 Q319 N324 Q325 A326	S318-S322 PolarHBondContact O-N 2.81Å; Q319-S322 WeakPolarHBondContact CA-OG 3.22Å; Q319-S322 PolarHBondContact O-N 3.47Å; Q319-S322 PolarHBondContact O-OG 3.32Å; Q319-S322 PolarHBondContact OE1-OG 2.84Å; S322-N324 VanDerWaalsContact C-N 3.3Å; S322-N324 PolarHBondContact O-N 2.77Å; S322-Q325 PolarHBondContact O-N 3.24Å; S322-Q325 VanDerWaalsContact O-N 3.08Å; S322-A326 PolarHBondContact O-N 3.46Å
323	T	59	Low	66.6	Low	16 Å²	16	85.9 Å²	85.9	10%	0.098	42%	0.417	C	S	.	.	H	α-helix	trans	-65.1	-30.5	179.6	47.1	0	0	0	0	113.3	Q319 Q320 Q325 L334 M338	Q319-T323 WeakPolarHBondContact O-CB 3.46Å; Q319-T323 WeakPolarHBondContact O-CG2 3.31Å; Q319-T323 PolarHBondContact O-N 3.18Å; Q319-T323 PolarHBondContact O-OG1 3.34Å; Q320-T323 WeakPolarHBondContact CA-OG1 3.43Å; Q320-T323 PolarHBondContact O-OG1 2.8Å; Q320-T323 VanDerWaalsContact O-OG1 3.06Å; T323-Q325 PolarHBondContact O-N 2.97Å; T323-L334 HydrophobicContact CG2-CB 3.79Å; T323-L334 HydrophobicContact CG2-CD1 4.05Å; T323-M338 HydrophobicContact CG2-SD 4.19Å
324	N	58.6	Low	65.9	Low	136 Å²	136	84.2 Å²	84.2	73%	0.727	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-18.3	173.8	-73.6	-24.3	0	0	0	113.6	Q320 S322	Q320-N324 VanDerWaalsContact O-CG 3.29Å; Q320-N324 PolarHBondContact O-N 2.72Å; Q320-N324 PolarHBondContact O-ND2 2.83Å; Q320-N324 VanDerWaalsContact O-ND2 3.15Å; S322-N324 VanDerWaalsContact C-N 3.3Å; S322-N324 PolarHBondContact O-N 2.77Å
325	Q	55.5	Low	65.2	Low	175 Å²	175	79.2 Å²	79.2	82%	0.818	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	-9.6	-177.1	-63.7	-178.2	-3.7	0	0	113.5	S322 T323	S322-Q325 PolarHBondContact O-N 3.24Å; S322-Q325 VanDerWaalsContact O-N 3.08Å; T323-Q325 PolarHBondContact O-N 2.97Å
326	A	56.6	Low	64.9	Low	38 Å²	38	79.9 Å²	79.9	31%	0.314	41%	0.41	S	S	.	.	S	Bend	trans	-94.6	154.5	-167.9	0	0	0	0	0	114	S322 P330	S322-A326 PolarHBondContact O-N 3.46Å; A326-P330 HydrophobicContact CB-CB 3.97Å
327	E	57.6	Low	64.9	Low	158 Å²	158	79.1 Å²	79.1	74%	0.738	41%	0.406	S	S	*	.			trans	-63.1	161.6	169.2	-64.2	-175.7	171.2	0	0	112.3	F329 P330 M331	E327-F329 VanDerWaalsContact C-N 3.25Å; E327-F329 PolarHBondContact O-N 2.82Å; E327-P330 VanDerWaalsContact O-CD 3.28Å; E327-P330 WeakPolarHBondContact O-CD 3.21Å; E327-M331 PolarHBondContact O-N 2.87Å
328	R	56.2	Low	64.9	Low	190 Å²	190	74.6 Å²	74.6	72%	0.717	39%	0.386	S	S	*	.	H	α-helix	trans	-54.3	-31	-173.4	-71.5	-179.4	177	179.3	0.3	115.3
329	F	51.4	Low	65	Low	148 Å²	148	77.1 Å²	77.1	65%	0.649	39%	0.394	S	S	*	.	H	α-helix	trans	-78.3	-53.3	-177	-81.2	-79.1	0	0	0	113	E327 M331 V332	E327-F329 VanDerWaalsContact C-N 3.25Å; E327-F329 PolarHBondContact O-N 2.82Å; F329-M331 PolarHBondContact O-N 3.4Å; F329-V332 PolarHBondContact O-N 3.15Å
330	P	59.5	Low	65.7	Low	20 Å²	20	78 Å²	78	13%	0.13	40%	0.4	C	S	.	.	H	α-helix	trans	-48.8	-41.1	168	-31.4	34.5	0	0	0	113.3	L272 A326 E327 V332 Q333 L334	L272-P330 HydrophobicContact CD2-CB 3.56Å; L272-P330 HydrophobicContact CD2-CG 3.83Å; A326-P330 HydrophobicContact CB-CB 3.97Å; E327-P330 VanDerWaalsContact O-CD 3.28Å; E327-P330 WeakPolarHBondContact O-CD 3.21Å; P330-V332 PolarHBondContact O-N 3.11Å; P330-Q333 PolarHBondContact O-N 2.96Å; P330-L334 WeakPolarHBondContact O-CB 3.32Å; P330-L334 VanDerWaalsContact O-CG 3.25Å; P330-L334 WeakPolarHBondContact O-CG 3.45Å; P330-L334 PolarHBondContact O-N 2.9Å
331	M	62.7	Low	66.6	Low	90 Å²	90	73 Å²	73	44%	0.443	38%	0.377	S	S	.	.	H	α-helix	trans	-56.4	-45.6	-178.1	-167.7	-171.7	-174.3	0	0	112.9	E327 F329 T335	E327-M331 PolarHBondContact O-N 2.87Å; F329-M331 PolarHBondContact O-N 3.4Å; M331-T335 VanDerWaalsContact O-CB 3.28Å; M331-T335 WeakPolarHBondContact O-CB 3.18Å; M331-T335 PolarHBondContact O-N 2.84Å; M331-T335 PolarHBondContact O-OG1 3.34Å
332	V	63.3	Low	67.5	Low	91 Å²	91	72.1 Å²	72.1	55%	0.552	37%	0.368	S	S	*	.	H	α-helix	trans	-66.2	-43.9	-178.8	175.8	0	0	0	0	111.7	F329 P330 T335 G336	F329-V332 PolarHBondContact O-N 3.15Å; P330-V332 PolarHBondContact O-N 3.11Å; V332-T335 PolarHBondContact O-N 3.49Å; V332-G336 PolarHBondContact O-N 2.77Å
333	Q	66.4	Low	68.7	Low	50 Å²	50	73.9 Å²	73.9	23%	0.234	38%	0.378	C	S	.	.	H	α-helix	trans	-65.4	-44.4	-179.4	-66	170.8	-0.9	0	0	111	F273 A276 P330 T335 G336 L337	F273-Q333 VanDerWaalsContact CA-OE1 3.29Å; F273-Q333 HydrophobicContact CD2-CG 4.06Å; A276-Q333 HydrophobicContact CB-CB 4.45Å; P330-Q333 PolarHBondContact O-N 2.96Å; Q333-T335 VanDerWaalsContact C-N 3.33Å; Q333-T335 PolarHBondContact O-N 2.86Å; Q333-G336 PolarHBondContact O-N 3.3Å; Q333-L337 PolarHBondContact O-N 3.47Å
334	L	73	Confident	70.2	Confident	12 Å²	12	73.1 Å²	73.1	6%	0.063	37%	0.373	C	S	.	.	H	α-helix	trans	-64.7	-37.7	175.1	-66.5	176.5	0	0	0	111.5	L272 T323 P330 L337 M338	L272-L334 HydrophobicContact CD1-CD2 4.5Å; T323-L334 HydrophobicContact CG2-CB 3.79Å; T323-L334 HydrophobicContact CG2-CD1 4.05Å; P330-L334 WeakPolarHBondContact O-CB 3.32Å; P330-L334 VanDerWaalsContact O-CG 3.25Å; P330-L334 WeakPolarHBondContact O-CG 3.45Å; P330-L334 PolarHBondContact O-N 2.9Å; L334-L337 PolarHBondContact O-N 3.43Å; L334-M338 WeakPolarHBondContact O-CB 3.28Å; L334-M338 VanDerWaalsContact O-CG 3.22Å; L334-M338 WeakPolarHBondContact O-CG 3.35Å; L334-M338 PolarHBondContact O-N 3.05Å
335	T	71.8	Confident	71.6	Confident	70 Å²	70	68.5 Å²	68.5	43%	0.429	35%	0.347	S	S	.	.	H	α-helix	trans	-65.3	-42.8	176.2	-57.2	0	0	0	0	111.6	M331 V332 Q333 L337 M338 L339	M331-T335 VanDerWaalsContact O-CB 3.28Å; M331-T335 WeakPolarHBondContact O-CB 3.18Å; M331-T335 PolarHBondContact O-N 2.84Å; M331-T335 PolarHBondContact O-OG1 3.34Å; V332-T335 PolarHBondContact O-N 3.49Å; Q333-T335 VanDerWaalsContact C-N 3.33Å; Q333-T335 PolarHBondContact O-N 2.86Å; T335-L337 VanDerWaalsContact C-N 3.32Å; T335-L337 PolarHBondContact O-N 3.26Å; T335-M338 PolarHBondContact O-N 3.27Å; T335-L339 PolarHBondContact O-N 3.34Å
336	G	73.3	Confident	73	Confident	35 Å²	35	62.8 Å²	62.8	36%	0.361	32%	0.322	S	S	.	.	H	α-helix	trans	-60.9	-41.8	174.9	0	0	0	0	0	112.2	V332 Q333 L339 T340	V332-G336 PolarHBondContact O-N 2.77Å; Q333-G336 PolarHBondContact O-N 3.3Å; G336-L339 WeakPolarHBondContact O-CB 3.38Å; G336-L339 PolarHBondContact O-N 2.84Å; G336-T340 PolarHBondContact O-N 3.35Å; G336-T340 VanDerWaalsContact O-N 3.08Å; G336-T340 PolarHBondContact O-OG1 3.45Å; G336-T340 VanDerWaalsContact O-OG1 3.05Å
337	L	80.5	Confident	74.5	Confident	5 Å²	5	62.1 Å²	62.1	3%	0.026	31%	0.312	C	S	.	.	H	α-helix	trans	-65.9	-44.5	175.1	-178.3	54.1	0	0	0	112.2	F261 L264 A276 C279 A280 I283 Q333 L334 T335 L339 T340 I341	F261-L337 HydrophobicContact CE1-CD2 3.36Å; F261-L337 HydrophobicContact CE1-CG 4.05Å; F261-L337 HydrophobicContact CZ-CD1 4.1Å; F261-L337 HydrophobicContact CZ-CD2 3.41Å; F261-L337 VanDerWaalsContact CZ-CD2 3.41Å; F261-L337 HydrophobicContact CZ-CG 3.73Å; L264-L337 HydrophobicContact CD1-CD2 4.28Å; A276-L337 HydrophobicContact CB-CD2 4.15Å; C279-L337 HydrophobicContact CB-CD1 3.7Å; C279-L337 HydrophobicContact CB-CD2 4.05Å; A280-L337 HydrophobicContact CB-CD1 4.08Å; I283-L337 HydrophobicContact CD1-CD1 3.64Å; Q333-L337 PolarHBondContact O-N 3.47Å; L334-L337 PolarHBondContact O-N 3.43Å; T335-L337 VanDerWaalsContact C-N 3.32Å; T335-L337 PolarHBondContact O-N 3.26Å; L337-L339 PolarHBondContact O-N 3.45Å; L337-T340 PolarHBondContact O-N 2.79Å; L337-T340 VanDerWaalsContact O-N 3.1Å; L337-I341 HydrophobicContact CG-CD1 4.39Å; L337-I341 WeakPolarHBondContact O-CG1 3.25Å; L337-I341 PolarHBondContact O-N 2.99Å
338	M	80	Confident	75.9	Confident	30 Å²	30	54.6 Å²	54.6	15%	0.148	28%	0.277	C	S	.	.	H	α-helix	trans	-57.5	-38.7	173.3	-74.1	174.6	71.2	0	0	111.7	L316 Q319 Q320 T323 L334 T335 I341 F342	L316-M338 HydrophobicContact CD2-CB 4.12Å; L316-M338 HydrophobicContact CD2-CE 4.38Å; L316-M338 HydrophobicContact CD2-CG 4.3Å; Q319-M338 HydrophobicContact CB-CG 4.01Å; Q319-M338 HydrophobicContact CB-SD 3.97Å; Q320-M338 HydrophobicContact CG-CE 3.63Å; T323-M338 HydrophobicContact CG2-SD 4.19Å; L334-M338 WeakPolarHBondContact O-CB 3.28Å; L334-M338 VanDerWaalsContact O-CG 3.22Å; L334-M338 WeakPolarHBondContact O-CG 3.35Å; L334-M338 PolarHBondContact O-N 3.05Å; T335-M338 PolarHBondContact O-N 3.27Å; M338-I341 PolarHBondContact O-N 3.03Å; M338-F342 WeakPolarHBondContact O-CB 3.4Å; M338-F342 PolarHBondContact O-N 3.25Å
339	L	79	Confident	77.2	Confident	105 Å²	105	47.1 Å²	47.1	55%	0.55	25%	0.251	S	S	.	.	H	α-helix	trans	-63.8	-44.7	174.8	179.7	66.1	0	0	0	111.3	T335 G336 L337 I341 F342 V343	T335-L339 PolarHBondContact O-N 3.34Å; G336-L339 WeakPolarHBondContact O-CB 3.38Å; G336-L339 PolarHBondContact O-N 2.84Å; L337-L339 PolarHBondContact O-N 3.45Å; L339-I341 VanDerWaalsContact C-N 3.34Å; L339-I341 PolarHBondContact O-N 3.48Å; L339-F342 WeakPolarHBondContact O-CB 3.12Å; L339-F342 PolarHBondContact O-N 3.49Å; L339-V343 WeakPolarHBondContact O-CG2 3.42Å; L339-V343 PolarHBondContact O-N 3.5Å
340	T	82.2	Confident	78.7	Confident	25 Å²	25	48.8 Å²	48.8	15%	0.153	25%	0.253	C	S	.	.	H	α-helix	trans	-63.8	-40.3	177.4	-39.8	0	0	0	0	111.5	I283 I287 G336 L337 F342 V343 L344	I283-T340 HydrophobicContact CB-CG2 3.93Å; I283-T340 HydrophobicContact CG2-CG2 3.52Å; I287-T340 HydrophobicContact CD1-CG2 3.95Å; G336-T340 PolarHBondContact O-N 3.35Å; G336-T340 VanDerWaalsContact O-N 3.08Å; G336-T340 PolarHBondContact O-OG1 3.45Å; G336-T340 VanDerWaalsContact O-OG1 3.05Å; L337-T340 PolarHBondContact O-N 2.79Å; L337-T340 VanDerWaalsContact O-N 3.1Å; T340-F342 VanDerWaalsContact C-N 3.35Å; T340-F342 PolarHBondContact O-N 3.33Å; T340-V343 PolarHBondContact O-N 3.26Å; T340-L344 PolarHBondContact O-N 3.49Å
341	I	85.8	Confident	79.7	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-58.7	-46.9	172.7	-68.5	171.3	0	0	0	110.6	F261 I283 L312 L316 L337 M338 L339 V343 L344 K345	F261-I341 HydrophobicContact CE2-CD1 4.18Å; F261-I341 HydrophobicContact CZ-CD1 3.74Å; I283-I341 HydrophobicContact CD1-CG1 3.65Å; L312-I341 HydrophobicContact CB-CG2 4.22Å; L312-I341 HydrophobicContact CD2-CG2 3.79Å; L316-I341 HydrophobicContact CD1-CG2 4.18Å; L316-I341 HydrophobicContact CD2-CB 4.13Å; L316-I341 HydrophobicContact CD2-CG2 3.72Å; L316-I341 HydrophobicContact CG-CG2 3.75Å; L337-I341 HydrophobicContact CG-CD1 4.39Å; L337-I341 WeakPolarHBondContact O-CG1 3.25Å; L337-I341 PolarHBondContact O-N 2.99Å; M338-I341 PolarHBondContact O-N 3.03Å; L339-I341 VanDerWaalsContact C-N 3.34Å; L339-I341 PolarHBondContact O-N 3.48Å; I341-V343 VanDerWaalsContact C-N 3.33Å; I341-V343 PolarHBondContact O-N 3.05Å; I341-L344 PolarHBondContact O-N 2.88Å; I341-K345 WeakPolarHBondContact O-CB 3.43Å; I341-K345 PolarHBondContact O-N 2.93Å
342	F	83.6	Confident	80.3	Confident	101 Å²	101	46.6 Å²	46.6	44%	0.443	24%	0.241	S	C	.	.	H	α-helix	trans	-61.2	-40.5	178.5	176.4	-104.2	0	0	0	112.2	M338 L339 T340 K345 N346	M338-F342 WeakPolarHBondContact O-CB 3.4Å; M338-F342 PolarHBondContact O-N 3.25Å; L339-F342 WeakPolarHBondContact O-CB 3.12Å; L339-F342 PolarHBondContact O-N 3.49Å; T340-F342 VanDerWaalsContact C-N 3.35Å; T340-F342 PolarHBondContact O-N 3.33Å; F342-K345 PolarHBondContact O-N 3.39Å; F342-N346 WeakPolarHBondContact CD1-ND2 3.5Å; F342-N346 WeakPolarHBondContact CE1-ND2 3.26Å; F342-N346 WeakPolarHBondContact CZ-ND2 3.18Å; F342-N346 PolarHBondContact O-N 2.93Å; F342-N346 PolarHBondContact O-ND2 2.84Å
343	V	87.5	Confident	80.5	Confident	57 Å²	57	47.1 Å²	47.1	35%	0.345	24%	0.237	S	C	.	.	H	α-helix	trans	-63.5	-44.9	174.7	174.6	0	0	0	0	111.1	I287 L339 T340 I341 N346 K347	I287-V343 HydrophobicContact CD1-CB 4.06Å; I287-V343 HydrophobicContact CD1-CG1 3.73Å; I287-V343 HydrophobicContact CG1-CG1 4.38Å; I287-V343 HydrophobicContact CG2-CG1 4.38Å; L339-V343 WeakPolarHBondContact O-CG2 3.42Å; L339-V343 PolarHBondContact O-N 3.5Å; T340-V343 PolarHBondContact O-N 3.26Å; I341-V343 VanDerWaalsContact C-N 3.33Å; I341-V343 PolarHBondContact O-N 3.05Å; V343-N346 PolarHBondContact O-N 3.31Å; V343-K347 WeakPolarHBondContact O-CB 3.01Å; V343-K347 PolarHBondContact O-N 3.23Å
344	L	89.3	Confident	79.9	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60.7	-45.9	175.2	176.8	61.9	0	0	0	111.4	I283 I287 L290 L312 T340 I341 N346 K347 I348	I283-L344 HydrophobicContact CG2-CB 3.78Å; I283-L344 HydrophobicContact CG2-CD2 3.88Å; I283-L344 HydrophobicContact CG2-CG 4.41Å; I287-L344 HydrophobicContact CD1-CB 4.15Å; I287-L344 HydrophobicContact CG1-CB 3.88Å; I287-L344 HydrophobicContact CG1-CD1 3.99Å; L290-L344 HydrophobicContact CD1-CD1 3.74Å; L312-L344 HydrophobicContact CD1-CD2 4.32Å; L312-L344 HydrophobicContact CD1-CG 4.18Å; L312-L344 HydrophobicContact CD2-CD2 4.09Å; T340-L344 PolarHBondContact O-N 3.49Å; I341-L344 PolarHBondContact O-N 2.88Å; L344-N346 PolarHBondContact O-N 2.93Å; L344-K347 WeakPolarHBondContact O-CB 3.33Å; L344-K347 PolarHBondContact O-N 2.87Å; L344-K347 VanDerWaalsContact O-N 3.14Å; L344-I348 HydrophobicContact CD1-CD1 3.99Å; L344-I348 HydrophobicContact CD1-CG1 4.24Å; L344-I348 HydrophobicContact CG-CD1 3.95Å; L344-I348 WeakPolarHBondContact O-CG1 3.43Å; L344-I348 PolarHBondContact O-N 3.43Å
345	K	87.6	Confident	78.2	Confident	39 Å²	39	63.9 Å²	63.9	17%	0.17	31%	0.31	C	S	.	.	H	α-helix	trans	-54.9	-52.4	176.1	177	-177.5	164.6	175	0	110.9	V309 L312 D313 L316 I341 F342 K347 I348 I349	V309-K345 HydrophobicContact CG1-CD 4.39Å; V309-K345 HydrophobicContact CG1-CG 4.23Å; L312-K345 HydrophobicContact CB-CB 4.43Å; L312-K345 HydrophobicContact CD1-CB 3.96Å; D313-K345 WeakPolarHBondContact OD1-CD 3.19Å; D313-K345 WeakPolarHBondContact OD1-CE 3.48Å; D313-K345 IonicContact OD1-NZ 3.46Å; D313-K345 PolarHBondContact OD1-NZ 3.35Å; D313-K345 IonicContact OD2-NZ 3.56Å; D313-K345 PolarHBondContact OD2-NZ 3.45Å; L316-K345 HydrophobicContact CD1-CD 4.36Å; I341-K345 WeakPolarHBondContact O-CB 3.43Å; I341-K345 PolarHBondContact O-N 2.93Å; F342-K345 PolarHBondContact O-N 3.39Å; K345-K347 VanDerWaalsContact C-N 3.25Å; K345-K347 PolarHBondContact O-N 3.04Å; K345-I348 PolarHBondContact O-N 2.95Å; K345-I349 HydrophobicContact CD-CD1 4.34Å; K345-I349 HydrophobicContact CG-CD1 3.83Å; K345-I349 HydrophobicContact CG-CG1 4.44Å; K345-I349 WeakPolarHBondContact O-CG1 3.42Å; K345-I349 PolarHBondContact O-N 3.39Å
346	N	86.7	Confident	78.5	Confident	55 Å²	55	63.6 Å²	63.6	29%	0.294	30%	0.304	S	S	.	.	H	α-helix	trans	-63	-34.6	179.5	-71.6	-30.7	0	0	0	112.4	F342 V343 L344 I349 R350	F342-N346 WeakPolarHBondContact CD1-ND2 3.5Å; F342-N346 WeakPolarHBondContact CE1-ND2 3.26Å; F342-N346 WeakPolarHBondContact CZ-ND2 3.18Å; F342-N346 PolarHBondContact O-N 2.93Å; F342-N346 PolarHBondContact O-ND2 2.84Å; V343-N346 PolarHBondContact O-N 3.31Å; L344-N346 PolarHBondContact O-N 2.93Å; N346-I349 PolarHBondContact O-N 3Å; N346-R350 WeakPolarHBondContact O-CG 3.27Å; N346-R350 PolarHBondContact O-N 3.28Å
347	K	86.5	Confident	78.8	Confident	23 Å²	23	65.1 Å²	65.1	10%	0.1	30%	0.301	C	S	.	.	H	α-helix	trans	-62.1	-46.5	174.8	-171.7	63.3	166.7	-169.3	0	111	L290 D294 V343 L344 K345 R350 L351	L290-K347 HydrophobicContact CB-CD 4.49Å; L290-K347 HydrophobicContact CB-CG 3.68Å; L290-K347 HydrophobicContact CD1-CG 3.99Å; L290-K347 WeakPolarHBondContact O-CE 3.27Å; D294-K347 WeakPolarHBondContact OD1-CE 3.16Å; D294-K347 IonicContact OD1-NZ 3.37Å; D294-K347 PolarHBondContact OD1-NZ 3.5Å; D294-K347 IonicContact OD2-NZ 3.31Å; D294-K347 PolarHBondContact OD2-NZ 3.42Å; V343-K347 WeakPolarHBondContact O-CB 3.01Å; V343-K347 PolarHBondContact O-N 3.23Å; L344-K347 WeakPolarHBondContact O-CB 3.33Å; L344-K347 PolarHBondContact O-N 2.87Å; L344-K347 VanDerWaalsContact O-N 3.14Å; K345-K347 VanDerWaalsContact C-N 3.25Å; K345-K347 PolarHBondContact O-N 3.04Å; K347-R350 PolarHBondContact O-N 3.17Å; K347-L351 WeakPolarHBondContact O-CG 3.49Å; K347-L351 PolarHBondContact O-N 2.91Å
348	I	87.6	Confident	78.7	Confident	1 Å²	1	68.4 Å²	68.4	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-64.7	-43.6	177.3	-66.7	167.6	0	0	0	111.1	L290 A305 W308 V309 L312 L344 K345 R350 L351 I352	L290-I348 HydrophobicContact CD1-CD1 4.49Å; L290-I348 HydrophobicContact CD1-CG1 3.66Å; A305-I348 HydrophobicContact CB-CG2 4.07Å; W308-I348 HydrophobicContact CB-CD1 3.92Å; W308-I348 HydrophobicContact CB-CG2 4.39Å; W308-I348 HydrophobicContact CE3-CD1 4.12Å; W308-I348 HydrophobicContact CE3-CG1 4.27Å; W308-I348 HydrophobicContact CE3-CG2 3.98Å; V309-I348 HydrophobicContact CG2-CB 4.36Å; V309-I348 HydrophobicContact CG2-CG2 3.76Å; L312-I348 HydrophobicContact CD1-CD1 3.79Å; L344-I348 HydrophobicContact CD1-CD1 3.99Å; L344-I348 HydrophobicContact CD1-CG1 4.24Å; L344-I348 HydrophobicContact CG-CD1 3.95Å; L344-I348 WeakPolarHBondContact O-CG1 3.43Å; L344-I348 PolarHBondContact O-N 3.43Å; K345-I348 PolarHBondContact O-N 2.95Å; I348-R350 VanDerWaalsContact C-N 3.32Å; I348-R350 PolarHBondContact O-N 2.95Å; I348-L351 WeakPolarHBondContact O-CB 3.3Å; I348-L351 PolarHBondContact O-N 2.85Å; I348-I352 HydrophobicContact CG2-CD1 4.13Å; I348-I352 WeakPolarHBondContact O-CG1 3.43Å; I348-I352 PolarHBondContact O-N 2.63Å
349	I	84.2	Confident	78.6	Confident	33 Å²	33	70.7 Å²	70.7	17%	0.169	33%	0.326	C	S	.	.	H	α-helix	trans	-58.5	-44.9	177.4	-70.8	172.2	0	0	0	110.9	V309 K345 N346 L351 I352 E353	V309-I349 HydrophobicContact CG1-CD1 4.36Å; V309-I349 HydrophobicContact CG1-CG1 4.42Å; V309-I349 HydrophobicContact CG2-CG1 3.79Å; K345-I349 HydrophobicContact CD-CD1 4.34Å; K345-I349 HydrophobicContact CG-CD1 3.83Å; K345-I349 HydrophobicContact CG-CG1 4.44Å; K345-I349 WeakPolarHBondContact O-CG1 3.42Å; K345-I349 PolarHBondContact O-N 3.39Å; N346-I349 PolarHBondContact O-N 3Å; I349-L351 PolarHBondContact O-N 2.9Å; I349-I352 WeakPolarHBondContact O-CA 3.48Å; I349-I352 PolarHBondContact O-N 3.09Å; I349-E353 HydrophobicContact CG2-CB 4.27Å; I349-E353 HydrophobicContact CG2-CG 3.84Å; I349-E353 WeakPolarHBondContact CG2-OE2 3.48Å; I349-E353 PolarHBondContact O-N 3.45Å
350	R	83	Confident	78.5	Confident	183 Å²	183	68.6 Å²	68.6	69%	0.691	31%	0.312	S	S	*	.	H	α-helix	trans	-59.9	-28.5	176.8	-76.1	179.4	-179.8	-164.8	-0.5	113.7	N346 K347 I348 I352	N346-R350 WeakPolarHBondContact O-CG 3.27Å; N346-R350 PolarHBondContact O-N 3.28Å; K347-R350 PolarHBondContact O-N 3.17Å; I348-R350 VanDerWaalsContact C-N 3.32Å; I348-R350 PolarHBondContact O-N 2.95Å; R350-I352 VanDerWaalsContact C-N 3.26Å
351	L	79.4	Confident	78.3	Confident	21 Å²	21	71.5 Å²	71.5	11%	0.11	32%	0.322	C	S	.	.	H	α-helix	trans	-76.4	-15.5	176	-63.8	168	0	0	0	112.6	L290 F293 F300 K347 I348 I349	L290-L351 HydrophobicContact CB-CD1 4.25Å; L290-L351 HydrophobicContact CD1-CD1 4.22Å; L290-L351 HydrophobicContact CD2-CD1 3.62Å; L290-L351 HydrophobicContact CG-CD1 4.24Å; F293-L351 HydrophobicContact CB-CD2 3.86Å; F293-L351 WeakPolarHBondContact O-CD2 3.35Å; F300-L351 HydrophobicContact CD2-CB 4.49Å; F300-L351 HydrophobicContact CD2-CD1 4.1Å; F300-L351 HydrophobicContact CE2-CD1 3.99Å; K347-L351 WeakPolarHBondContact O-CG 3.49Å; K347-L351 PolarHBondContact O-N 2.91Å; I348-L351 WeakPolarHBondContact O-CB 3.3Å; I348-L351 PolarHBondContact O-N 2.85Å; I349-L351 PolarHBondContact O-N 2.9Å
352	I	75	Confident	77.8	Confident	42 Å²	42	76.6 Å²	76.6	22%	0.215	35%	0.345	C	S	.	.	H	α-helix	trans	-103.3	-44.4	179.7	-57.8	162.8	0	0	0	111.9	R302 A305 I348 I349 R350	R302-I352 HydrophobicContact CG-CG2 4.25Å; A305-I352 HydrophobicContact CB-CD1 3.29Å; A305-I352 HydrophobicContact CB-CG1 3.43Å; A305-I352 VanDerWaalsContact CB-CG1 3.43Å; I348-I352 HydrophobicContact CG2-CD1 4.13Å; I348-I352 WeakPolarHBondContact O-CG1 3.43Å; I348-I352 PolarHBondContact O-N 2.63Å; I349-I352 WeakPolarHBondContact O-CA 3.48Å; I349-I352 PolarHBondContact O-N 3.09Å; R350-I352 VanDerWaalsContact C-N 3.26Å
353	E	68.6	Low	77.3	Confident	102 Å²	102	74.7 Å²	74.7	48%	0.477	34%	0.338	S	S	.	.			trans	-90.9	121.9	-171.2	-69	-174	172.3	0	0	111.3	I349 F355	I349-E353 HydrophobicContact CG2-CB 4.27Å; I349-E353 HydrophobicContact CG2-CG 3.84Å; I349-E353 WeakPolarHBondContact CG2-OE2 3.48Å; I349-E353 PolarHBondContact O-N 3.45Å; E353-F355 HydrophobicContact CB-CE2 4.37Å; E353-F355 PolarHBondContact O-N 3.1Å
354	K	52.5	Low	76.5	Confident	160 Å²	160	76.2 Å²	76.2	70%	0.696	34%	0.337	S	S	*	.			trans	-66.4	125.4	161.1	-78.9	-172.4	171.5	-171	0	109.2
355	F	37.4	Very low	75.3	Confident	255 Å²	255	83.1 Å²	83.1	100%	1.118	37%	0.368	S	S	*	.			trans	-116.7	0	147.1	-76.1	-74.2	0	0	0	109.4	E353	E353-F355 HydrophobicContact CB-CE2 4.37Å; E353-F355 PolarHBondContact O-N 3.1Å

Retrieved 355 of 355 residues in 400.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).