A0A077ZEC3_TRITR Loading...

BK channel interacting protein 2

AlphaFold DB , UniProt , Accession A0A077ZEC3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 768 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	25.4	Very low	32.1	Very low	246 Å²	246	126.7 Å²	126.7	100%	1.212	73%	0.73	S	S	*	*				0	138.6	0	-71.5	-168.1	-148.6	0	0	108.8
2	A	24.8	Very low	33.4	Very low	96 Å²	96	133.8 Å²	133.8	79%	0.793	74%	0.736	S	S	*	*			trans	61.3	62.7	175.7	0	0	0	0	0	118.2	V4	A2-V4 VanDerWaalsContact C-N 3.3Å; A2-V4 PolarHBondContact O-N 2.78Å; A2-V4 VanDerWaalsContact O-N 3.1Å
3	A	27.1	Very low	35.4	Very low	106 Å²	106	126.7 Å²	126.7	88%	0.876	70%	0.696	S	S	*	*			trans	-72.7	92.8	150.3	0	0	0	0	0	107.6	G5	A3-G5 PolarHBondContact O-N 2.66Å; A3-G5 VanDerWaalsContact O-N 3.15Å
4	V	28.9	Very low	37.7	Very low	131 Å²	131	127.5 Å²	127.5	79%	0.794	69%	0.693	S	S	*	*			trans	-55.7	117.7	167.3	174	0	0	0	0	107	A2 S6	A2-V4 VanDerWaalsContact C-N 3.3Å; A2-V4 PolarHBondContact O-N 2.78Å; A2-V4 VanDerWaalsContact O-N 3.1Å; V4-S6 PolarHBondContact O-N 3.14Å
5	G	27.6	Very low	40.7	Very low	67 Å²	67	121.4 Å²	121.4	69%	0.691	66%	0.659	S	S	*	*			trans	-58	99.9	179.5	0	0	0	0	0	110.7	A3 K7	A3-G5 PolarHBondContact O-N 2.66Å; A3-G5 VanDerWaalsContact O-N 3.15Å; G5-K7 PolarHBondContact O-N 3.41Å
6	S	31.1	Very low	43.4	Very low	105 Å²	105	117.8 Å²	117.8	73%	0.734	64%	0.635	S	S	*	*			trans	-67.1	103	164.6	55.6	0	0	0	0	107.2	V4 L8	V4-S6 PolarHBondContact O-N 3.14Å; S6-L8 PolarHBondContact O-N 2.79Å
7	K	37.1	Very low	46.1	Very low	199 Å²	199	111 Å²	111	87%	0.865	60%	0.598	S	S	*	*			trans	-48.2	123.2	166.7	-76.4	-178.2	175	-178.1	0	108.2	G5 D9	G5-K7 PolarHBondContact O-N 3.41Å; K7-D9 PolarHBondContact O-N 2.78Å; K7-D9 VanDerWaalsContact O-N 3.11Å
8	L	44	Very low	48.6	Very low	71 Å²	71	107.7 Å²	107.7	37%	0.372	58%	0.578	S	S	.	*			trans	-54.4	114.9	176.7	-142.7	92.2	0	0	0	108.6	S6 P10 L13 L138	S6-L8 PolarHBondContact O-N 2.79Å; L8-P10 WeakPolarHBondContact O-CD 3.39Å; L8-L13 HydrophobicContact CD2-CD2 3.68Å; L8-L138 HydrophobicContact CD2-CD1 4.13Å
9	D	35.6	Very low	50.9	Low	81 Å²	81	106.3 Å²	106.3	43%	0.433	57%	0.573	S	S	.	*			trans	-74.3	112.5	174.8	-176.7	-3.7	0	0	0	109	K7 R11 R12	K7-D9 PolarHBondContact O-N 2.78Å; K7-D9 VanDerWaalsContact O-N 3.11Å; D9-R11 PolarHBondContact O-N 2.97Å; D9-R11 WeakPolarHBondContact OD1-CB 3.48Å; D9-R11 PolarHBondContact OD1-N 3.2Å; D9-R12 PolarHBondContact O-N 3.31Å; D9-R12 VanDerWaalsContact O-N 3.09Å
10	P	36.3	Very low	52.9	Low	60 Å²	60	101.3 Å²	101.3	39%	0.39	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-63.3	-13	-178.7	-18	32.2	0	0	0	113.5	L8 L13 T131	L8-P10 WeakPolarHBondContact O-CD 3.39Å; P10-L13 HydrophobicContact CB-CD1 4.33Å; P10-L13 WeakPolarHBondContact O-CD1 3.29Å; P10-L13 VanDerWaalsContact O-CG 3.27Å; P10-L13 WeakPolarHBondContact O-CG 3.46Å; P10-T131 HydrophobicContact CB-CG2 4.1Å
11	R	34.9	Very low	54.6	Low	232 Å²	232	99.9 Å²	99.9	88%	0.875	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-86.3	-6.5	178.3	-62.8	-177.2	178.9	-176.7	0.7	113.7	D9	D9-R11 PolarHBondContact O-N 2.97Å; D9-R11 WeakPolarHBondContact OD1-CB 3.48Å; D9-R11 PolarHBondContact OD1-N 3.2Å
12	R	48.1	Very low	57.6	Low	211 Å²	211	96.6 Å²	96.6	80%	0.796	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-118.9	28.3	179.7	-72.8	-173.8	168.8	-155.5	-1.5	113.1	D9 E14	D9-R12 PolarHBondContact O-N 3.31Å; D9-R12 VanDerWaalsContact O-N 3.09Å; R12-E14 PolarHBondContact O-N 3.03Å
13	L	59.9	Low	60.6	Low	42 Å²	42	95.1 Å²	95.1	22%	0.22	49%	0.492	C	S	.	.			trans	-73.5	72.6	-179	-56.7	167.7	0	0	0	111	L8 P10 I15 T134 L138	L8-L13 HydrophobicContact CD2-CD2 3.68Å; P10-L13 HydrophobicContact CB-CD1 4.33Å; P10-L13 WeakPolarHBondContact O-CD1 3.29Å; P10-L13 VanDerWaalsContact O-CG 3.27Å; P10-L13 WeakPolarHBondContact O-CG 3.46Å; L13-I15 PolarHBondContact O-N 3.45Å; L13-T134 HydrophobicContact CB-CG2 4.27Å; L13-T134 HydrophobicContact CD1-CG2 3.88Å; L13-T134 HydrophobicContact CG-CG2 4.5Å; L13-L138 HydrophobicContact CB-CD1 4.17Å; L13-L138 HydrophobicContact CD2-CD1 3.26Å; L13-L138 HydrophobicContact CG-CD1 4.2Å
14	E	67.8	Low	63.4	Low	138 Å²	138	90.7 Å²	90.7	65%	0.645	45%	0.453	S	S	*	.			trans	-73.3	114.3	172.6	-169.6	-176.7	-174.3	0	0	109.4	R12 K16	R12-E14 PolarHBondContact O-N 3.03Å; E14-K16 HydrophobicContact CG-CG 4.13Å; E14-K16 PolarHBondContact O-N 2.58Å; E14-K16 WeakPolarHBondContact OE2-CE 3.44Å; E14-K16 IonicContact OE2-NZ 3.92Å
15	I	81.9	Confident	65.8	Low	36 Å²	36	88.7 Å²	88.7	19%	0.185	44%	0.441	C	S	.	.			trans	-80	109.1	179.2	-53.4	-55.1	0	0	0	109.8	L13 V20 E21 L24 T134 L138 K197	L13-I15 PolarHBondContact O-N 3.45Å; I15-V20 HydrophobicContact CD1-CG1 3.85Å; I15-V20 HydrophobicContact CG2-CB 3.93Å; I15-V20 HydrophobicContact CG2-CG1 3.78Å; I15-E21 HydrophobicContact CG2-CB 3.91Å; I15-L24 HydrophobicContact CD1-CD1 3.69Å; I15-L24 HydrophobicContact CG1-CD1 3.99Å; I15-T134 HydrophobicContact CD1-CG2 3.82Å; I15-L138 HydrophobicContact CD1-CD2 4.26Å; I15-K197 WeakPolarHBondContact O-CD 3.47Å; I15-K197 PolarHBondContact O-NZ 3.27Å; I15-K197 VanDerWaalsContact O-NZ 3.13Å
16	K	83.8	Confident	68.3	Low	63 Å²	63	88.4 Å²	88.4	27%	0.274	43%	0.427	S	S	.	.			trans	-105.3	-9.1	-171.7	-69.3	169.5	-178.9	-177.3	0	114.8	E14 K197 E259	E14-K16 HydrophobicContact CG-CG 4.13Å; E14-K16 PolarHBondContact O-N 2.58Å; E14-K16 WeakPolarHBondContact OE2-CE 3.44Å; E14-K16 IonicContact OE2-NZ 3.92Å; K16-K197 WeakPolarHBondContact O-CB 3.31Å; K16-K197 WeakPolarHBondContact O-CG 3.28Å; K16-K197 PolarHBondContact O-N 3.28Å; K16-E259 WeakPolarHBondContact CB-OE1 3.48Å; K16-E259 HydrophobicContact CD-CG 4.19Å; K16-E259 WeakPolarHBondContact CD-OE1 3.45Å; K16-E259 WeakPolarHBondContact CD-OE2 3.28Å; K16-E259 WeakPolarHBondContact CE-OE2 3.47Å; K16-E259 IonicContact NZ-OE2 2.63Å; K16-E259 PolarHBondContact NZ-OE2 2.82Å
17	T	90.1	Very high	70.6	Confident	3 Å²	3	85.3 Å²	85.3	2%	0.018	40%	0.402	C	S	.	.	B	Isolated β-bridge	trans	-114.2	144.8	177.3	55	0	0	0	0	112.6	T19 V20 E21 D141 R192 D195	T17-T19 VanDerWaalsContact C-N 3.31Å; T17-V20 WeakPolarHBondContact OG1-CB 3.36Å; T17-V20 WeakPolarHBondContact OG1-CG2 3.36Å; T17-E21 WeakPolarHBondContact O-CB 3.43Å; T17-E21 PolarHBondContact O-N 2.84Å; T17-E21 VanDerWaalsContact O-N 3.13Å; T17-D141 WeakPolarHBondContact CG2-OD1 3.49Å; T17-R192 VanDerWaalsContact CG2-NH1 3.31Å; T17-D195 CarbonylContact C-O 3.3Å; T17-D195 WeakPolarHBondContact CA-O 3.49Å; T17-D195 VanDerWaalsContact CB-OD2 3.25Å; T17-D195 WeakPolarHBondContact CB-OD2 3.32Å; T17-D195 WeakPolarHBondContact CG2-OD2 3.06Å
18	K	91.2	Very high	72.5	Confident	52 Å²	52	78.7 Å²	78.7	23%	0.226	38%	0.378	C	S	.	.	H	α-helix	trans	-67.4	-34.5	179	-68	171.2	-170.4	163.1	0	110.8	E21 R22 Q194 D195 L196 K197	K18-E21 PolarHBondContact O-N 3.15Å; K18-R22 WeakPolarHBondContact O-CB 3.1Å; K18-R22 WeakPolarHBondContact O-CD 3.03Å; K18-R22 WeakPolarHBondContact O-CG 3.26Å; K18-R22 PolarHBondContact O-N 2.94Å; K18-Q194 WeakPolarHBondContact CD-O 3.29Å; K18-Q194 PolarHBondContact NZ-O 3.07Å; K18-D195 WeakPolarHBondContact CB-O 3.46Å; K18-D195 WeakPolarHBondContact CG-O 3.39Å; K18-D195 PolarHBondContact N-O 3.41Å; K18-D195 PolarHBondContact N-OD1 2.87Å; K18-L196 WeakPolarHBondContact CE-O 3.32Å; K18-K197 HydrophobicContact CG-CG 3.86Å
19	T	91.6	Very high	73.9	Confident	80 Å²	80	78.7 Å²	78.7	49%	0.491	38%	0.384	S	S	.	.	H	α-helix	trans	-64.6	-46.3	179.8	-61.7	0	0	0	0	111.6	T17 T23 D195	T17-T19 VanDerWaalsContact C-N 3.31Å; T19-T23 WeakPolarHBondContact O-CB 3.49Å; T19-T23 PolarHBondContact O-N 3.37Å; T19-T23 VanDerWaalsContact O-N 3.1Å; T19-T23 PolarHBondContact O-OG1 3.13Å; T19-D195 VanDerWaalsContact CB-OD1 3.28Å; T19-D195 WeakPolarHBondContact CB-OD1 3.32Å; T19-D195 PolarHBondContact N-OD1 3.18Å; T19-D195 PolarHBondContact OG1-OD1 3.01Å
20	V	90.4	Very high	75.7	Confident	7 Å²	7	81 Å²	81	4%	0.042	39%	0.392	C	S	.	.	H	α-helix	trans	-65.2	-44.5	176.1	178.1	0	0	0	0	110.4	I15 T17 T23 L24 L137	I15-V20 HydrophobicContact CD1-CG1 3.85Å; I15-V20 HydrophobicContact CG2-CB 3.93Å; I15-V20 HydrophobicContact CG2-CG1 3.78Å; T17-V20 WeakPolarHBondContact OG1-CB 3.36Å; T17-V20 WeakPolarHBondContact OG1-CG2 3.36Å; V20-T23 PolarHBondContact O-N 3.23Å; V20-L24 HydrophobicContact CG1-CD1 3.74Å; V20-L24 HydrophobicContact CG1-CG 4.3Å; V20-L24 WeakPolarHBondContact O-CB 3.44Å; V20-L24 WeakPolarHBondContact O-CG 3.34Å; V20-L24 PolarHBondContact O-N 2.96Å; V20-L137 HydrophobicContact CG1-CB 4.03Å; V20-L137 HydrophobicContact CG1-CD1 4.21Å; V20-L137 HydrophobicContact CG2-CB 4.28Å
21	E	88.5	Confident	77.3	Confident	71 Å²	71	79.3 Å²	79.3	33%	0.332	38%	0.38	S	S	.	.	H	α-helix	trans	-59.6	-50	176.5	178.4	172.5	-114.5	0	0	112.7	I15 T17 K18 T23 L24 V25 K197	I15-E21 HydrophobicContact CG2-CB 3.91Å; T17-E21 WeakPolarHBondContact O-CB 3.43Å; T17-E21 PolarHBondContact O-N 2.84Å; T17-E21 VanDerWaalsContact O-N 3.13Å; K18-E21 PolarHBondContact O-N 3.15Å; E21-T23 PolarHBondContact O-N 3.4Å; E21-L24 PolarHBondContact O-N 3.05Å; E21-L24 VanDerWaalsContact O-N 3.13Å; E21-V25 HydrophobicContact CG-CG2 3.97Å; E21-V25 WeakPolarHBondContact O-CB 3.34Å; E21-V25 VanDerWaalsContact O-CG2 3.27Å; E21-V25 WeakPolarHBondContact O-CG2 3.48Å; E21-V25 PolarHBondContact O-N 3.14Å; E21-K197 HydrophobicContact CB-CD 4.35Å; E21-K197 VanDerWaalsContact OE1-CE 3.23Å; E21-K197 WeakPolarHBondContact OE1-CE 3.28Å; E21-K197 IonicContact OE1-NZ 2.77Å; E21-K197 PolarHBondContact OE1-NZ 2.71Å; E21-K197 WeakPolarHBondContact OE2-CD 3.44Å; E21-K197 VanDerWaalsContact OE2-CE 3.32Å; E21-K197 WeakPolarHBondContact OE2-CE 3.47Å; E21-K197 IonicContact OE2-NZ 2.71Å
22	R	89.4	Confident	79.1	Confident	178 Å²	178	71.5 Å²	71.5	67%	0.672	36%	0.358	S	S	*	.	H	α-helix	trans	-61.2	-27.1	178.6	-75	170.2	179.4	174.5	-1.5	112.8	K18 P26	K18-R22 WeakPolarHBondContact O-CB 3.1Å; K18-R22 WeakPolarHBondContact O-CD 3.03Å; K18-R22 WeakPolarHBondContact O-CG 3.26Å; K18-R22 PolarHBondContact O-N 2.94Å; R22-P26 WeakPolarHBondContact O-CD 3.49Å; R22-P26 WeakPolarHBondContact O-CG 3.28Å
23	T	87	Confident	80.2	Confident	64 Å²	64	64.2 Å²	64.2	39%	0.393	34%	0.337	S	S	.	.	H	α-helix	trans	-79.8	-39.9	175.6	-54.4	0	0	0	0	111.5	T19 V20 E21 L137	T19-T23 WeakPolarHBondContact O-CB 3.49Å; T19-T23 PolarHBondContact O-N 3.37Å; T19-T23 VanDerWaalsContact O-N 3.1Å; T19-T23 PolarHBondContact O-OG1 3.13Å; V20-T23 PolarHBondContact O-N 3.23Å; E21-T23 PolarHBondContact O-N 3.4Å; T23-L137 HydrophobicContact CG2-CD1 3.8Å; T23-L137 HydrophobicContact CG2-CD2 4.19Å
24	L	86.2	Confident	80.6	Confident	14 Å²	14	63.9 Å²	63.9	7%	0.073	34%	0.335	C	S	.	.	H	α-helix	trans	-77.7	-36.9	-177.9	-70.8	175.8	0	0	0	113.4	I15 V20 E21 L27 V28 L130 V133 T134 L137	I15-L24 HydrophobicContact CD1-CD1 3.69Å; I15-L24 HydrophobicContact CG1-CD1 3.99Å; V20-L24 HydrophobicContact CG1-CD1 3.74Å; V20-L24 HydrophobicContact CG1-CG 4.3Å; V20-L24 WeakPolarHBondContact O-CB 3.44Å; V20-L24 WeakPolarHBondContact O-CG 3.34Å; V20-L24 PolarHBondContact O-N 2.96Å; E21-L24 PolarHBondContact O-N 3.05Å; E21-L24 VanDerWaalsContact O-N 3.13Å; L24-L27 HydrophobicContact CD2-CD2 4.49Å; L24-L27 WeakPolarHBondContact O-CB 3.24Å; L24-L27 PolarHBondContact O-N 3.46Å; L24-L27 VanDerWaalsContact O-N 3.07Å; L24-V28 WeakPolarHBondContact O-CG2 3.44Å; L24-V28 PolarHBondContact O-N 3.12Å; L24-L130 HydrophobicContact CD2-CD1 4.14Å; L24-V133 HydrophobicContact CD2-CG1 4.18Å; L24-T134 HydrophobicContact CD1-CG2 3.98Å; L24-T134 WeakPolarHBondContact CD2-OG1 3.36Å; L24-L137 HydrophobicContact CD2-CD1 3.76Å; L24-L137 HydrophobicContact CG-CD1 3.87Å
25	V	79.1	Confident	80.6	Confident	89 Å²	89	58.5 Å²	58.5	54%	0.539	31%	0.312	S	S	.	.	H	α-helix	trans	-56.4	-49.1	-176.2	165.2	0	0	0	0	112.7	E21 L27 V28 S29	E21-V25 HydrophobicContact CG-CG2 3.97Å; E21-V25 WeakPolarHBondContact O-CB 3.34Å; E21-V25 VanDerWaalsContact O-CG2 3.27Å; E21-V25 WeakPolarHBondContact O-CG2 3.48Å; E21-V25 PolarHBondContact O-N 3.14Å; V25-L27 VanDerWaalsContact C-N 3.3Å; V25-L27 PolarHBondContact O-N 3.21Å; V25-V28 PolarHBondContact O-N 2.96Å; V25-S29 PolarHBondContact O-N 3.45Å
26	P	80.8	Confident	79.9	Confident	61 Å²	61	58.7 Å²	58.7	40%	0.396	31%	0.313	S	S	.	.	H	α-helix	trans	-62.4	-37.7	175.5	-22.1	33.4	0	0	0	112.6	R22 S29 Q30	R22-P26 WeakPolarHBondContact O-CD 3.49Å; R22-P26 WeakPolarHBondContact O-CG 3.28Å; P26-S29 PolarHBondContact O-N 3.44Å; P26-Q30 WeakPolarHBondContact O-CB 3.31Å; P26-Q30 VanDerWaalsContact O-CG 3.26Å; P26-Q30 WeakPolarHBondContact O-CG 3.45Å; P26-Q30 PolarHBondContact O-N 3.11Å
27	L	78.9	Confident	78.9	Confident	39 Å²	39	60.4 Å²	60.4	20%	0.204	32%	0.322	C	S	.	.	H	α-helix	trans	-64.6	-45.6	178.9	-177.7	64.3	0	0	0	111	L24 V25 S29 Q30 I31 L130 V133	L24-L27 HydrophobicContact CD2-CD2 4.49Å; L24-L27 WeakPolarHBondContact O-CB 3.24Å; L24-L27 PolarHBondContact O-N 3.46Å; L24-L27 VanDerWaalsContact O-N 3.07Å; V25-L27 VanDerWaalsContact C-N 3.3Å; V25-L27 PolarHBondContact O-N 3.21Å; L27-S29 VanDerWaalsContact C-N 3.33Å; L27-S29 PolarHBondContact O-N 3.43Å; L27-Q30 PolarHBondContact O-N 3.11Å; L27-I31 HydrophobicContact CD1-CD1 4.03Å; L27-I31 HydrophobicContact CD1-CG1 4.31Å; L27-I31 HydrophobicContact CD2-CD1 4.48Å; L27-I31 HydrophobicContact CG-CD1 3.8Å; L27-I31 HydrophobicContact CG-CG1 4.43Å; L27-I31 VanDerWaalsContact O-CB 3.26Å; L27-I31 WeakPolarHBondContact O-CB 2.81Å; L27-I31 WeakPolarHBondContact O-CG1 3.42Å; L27-I31 PolarHBondContact O-N 2.94Å; L27-L130 HydrophobicContact CD2-CD1 4.11Å; L27-L130 HydrophobicContact CG-CD1 4.45Å; L27-V133 HydrophobicContact CD2-CB 4.03Å; L27-V133 HydrophobicContact CD2-CG1 3.72Å; L27-V133 HydrophobicContact CD2-CG2 4.22Å
28	V	77.8	Confident	77.4	Confident	60 Å²	60	62 Å²	62	36%	0.364	33%	0.328	S	S	.	.	H	α-helix	trans	-60.4	-43.3	175.8	174	0	0	0	0	110.9	L24 V25 I31 T32 L130	L24-V28 WeakPolarHBondContact O-CG2 3.44Å; L24-V28 PolarHBondContact O-N 3.12Å; V25-V28 PolarHBondContact O-N 2.96Å; V28-I31 PolarHBondContact O-N 3.04Å; V28-T32 WeakPolarHBondContact O-CB 3.35Å; V28-T32 PolarHBondContact O-N 3.29Å; V28-T32 PolarHBondContact O-OG1 3.48Å; V28-L130 HydrophobicContact CG2-CD1 3.64Å; V28-L130 HydrophobicContact CG2-CD2 3.94Å; V28-L130 HydrophobicContact CG2-CG 4.47Å
29	S	72.8	Confident	75.6	Confident	72 Å²	72	61.7 Å²	61.7	50%	0.503	33%	0.327	S	S	.	.	H	α-helix	trans	-62.4	-46.2	176.9	178.2	0	0	0	0	112.2	V25 P26 L27 T32 T33	V25-S29 PolarHBondContact O-N 3.45Å; P26-S29 PolarHBondContact O-N 3.44Å; L27-S29 VanDerWaalsContact C-N 3.33Å; L27-S29 PolarHBondContact O-N 3.43Å; S29-T32 PolarHBondContact O-N 2.97Å; S29-T33 WeakPolarHBondContact O-CB 3.4Å; S29-T33 PolarHBondContact O-N 3.12Å; S29-T33 PolarHBondContact O-OG1 3.17Å
30	Q	72.9	Confident	73.6	Confident	129 Å²	129	62 Å²	62	60%	0.603	32%	0.322	S	S	*	.	H	α-helix	trans	-65.5	-40.8	178.2	-71.6	173.1	20	0	0	112.3	P26 L27 T33 L34	P26-Q30 WeakPolarHBondContact O-CB 3.31Å; P26-Q30 VanDerWaalsContact O-CG 3.26Å; P26-Q30 WeakPolarHBondContact O-CG 3.45Å; P26-Q30 PolarHBondContact O-N 3.11Å; L27-Q30 PolarHBondContact O-N 3.11Å; Q30-T33 PolarHBondContact O-N 3.29Å; Q30-L34 WeakPolarHBondContact O-CB 3.42Å; Q30-L34 PolarHBondContact O-N 3.15Å
31	I	70.5	Confident	71.7	Confident	25 Å²	25	67.3 Å²	67.3	13%	0.128	34%	0.342	C	S	.	.	H	α-helix	trans	-60.4	-48.6	174.9	-77.8	176.2	0	0	0	110.9	L27 V28 T33 L34 V35 T126 L130	L27-I31 HydrophobicContact CD1-CD1 4.03Å; L27-I31 HydrophobicContact CD1-CG1 4.31Å; L27-I31 HydrophobicContact CD2-CD1 4.48Å; L27-I31 HydrophobicContact CG-CD1 3.8Å; L27-I31 HydrophobicContact CG-CG1 4.43Å; L27-I31 VanDerWaalsContact O-CB 3.26Å; L27-I31 WeakPolarHBondContact O-CB 2.81Å; L27-I31 WeakPolarHBondContact O-CG1 3.42Å; L27-I31 PolarHBondContact O-N 2.94Å; V28-I31 PolarHBondContact O-N 3.04Å; I31-T33 VanDerWaalsContact C-N 3.3Å; I31-T33 PolarHBondContact O-N 3.22Å; I31-L34 PolarHBondContact O-N 3.34Å; I31-V35 WeakPolarHBondContact O-CG2 3.41Å; I31-V35 PolarHBondContact O-N 2.78Å; I31-T126 HydrophobicContact CB-CG2 3.69Å; I31-T126 HydrophobicContact CD1-CG2 3.73Å; I31-T126 HydrophobicContact CG1-CG2 3.35Å; I31-T126 HydrophobicContact CG2-CG2 3.25Å; I31-L130 HydrophobicContact CD1-CB 4.03Å; I31-L130 HydrophobicContact CD1-CD1 4.45Å
32	T	72	Confident	69.9	Low	67 Å²	67	67.6 Å²	67.6	41%	0.411	35%	0.351	S	S	.	.	H	α-helix	trans	-60.3	-45	179	-55.8	0	0	0	0	110.1	V28 S29 L34 V35 N36	V28-T32 WeakPolarHBondContact O-CB 3.35Å; V28-T32 PolarHBondContact O-N 3.29Å; V28-T32 PolarHBondContact O-OG1 3.48Å; S29-T32 PolarHBondContact O-N 2.97Å; T32-L34 PolarHBondContact O-N 3.48Å; T32-V35 PolarHBondContact O-N 3.09Å; T32-N36 WeakPolarHBondContact O-CB 3.4Å; T32-N36 VanDerWaalsContact O-CG 3.23Å; T32-N36 PolarHBondContact O-N 2.93Å; T32-N36 PolarHBondContact O-OD1 3.35Å
33	T	71.2	Confident	67.9	Low	58 Å²	58	61.8 Å²	61.8	36%	0.356	35%	0.347	S	S	.	.	H	α-helix	trans	-60.3	-44.5	175.7	-55.8	0	0	0	0	112.1	S29 Q30 I31 N36 Q37	S29-T33 WeakPolarHBondContact O-CB 3.4Å; S29-T33 PolarHBondContact O-N 3.12Å; S29-T33 PolarHBondContact O-OG1 3.17Å; Q30-T33 PolarHBondContact O-N 3.29Å; I31-T33 VanDerWaalsContact C-N 3.3Å; I31-T33 PolarHBondContact O-N 3.22Å; T33-N36 PolarHBondContact O-N 3.35Å; T33-Q37 HydrophobicContact CG2-CG 4.09Å; T33-Q37 VanDerWaalsContact O-CB 3.25Å; T33-Q37 WeakPolarHBondContact O-CB 3.41Å; T33-Q37 WeakPolarHBondContact O-CG 3.33Å; T33-Q37 PolarHBondContact O-N 3.04Å
34	L	68.1	Low	66.1	Low	35 Å²	35	67.3 Å²	67.3	18%	0.183	37%	0.365	C	S	.	.	H	α-helix	trans	-66.6	-38.2	-179.2	-175.5	141.8	0	0	0	112.4	Q30 I31 T32 R38 V57 L122	Q30-L34 WeakPolarHBondContact O-CB 3.42Å; Q30-L34 PolarHBondContact O-N 3.15Å; I31-L34 PolarHBondContact O-N 3.34Å; T32-L34 PolarHBondContact O-N 3.48Å; L34-R38 PolarHBondContact O-N 2.91Å; L34-V57 HydrophobicContact CD1-CG1 3.5Å; L34-L122 HydrophobicContact CD2-CD1 4.17Å; L34-L122 HydrophobicContact CD2-CD2 3.99Å; L34-L122 HydrophobicContact CD2-CG 4.31Å
35	V	68.9	Low	64.2	Low	26 Å²	26	73.2 Å²	73.2	16%	0.158	40%	0.395	C	S	.	.	H	α-helix	trans	-67.1	-45.3	176.1	172.2	0	0	0	0	110.7	I31 T32 R38 V123	I31-V35 WeakPolarHBondContact O-CG2 3.41Å; I31-V35 PolarHBondContact O-N 2.78Å; T32-V35 PolarHBondContact O-N 3.09Å; V35-R38 PolarHBondContact O-N 3Å; V35-V123 HydrophobicContact CG1-CG2 3.83Å; V35-V123 HydrophobicContact CG2-CG2 4.39Å
36	N	67.2	Low	63.2	Low	40 Å²	40	77.7 Å²	77.7	21%	0.214	40%	0.403	C	S	.	.	H	α-helix	trans	-73.8	-33	-179.6	-65.2	1.3	0	0	0	112.9	T32 T33 R38 E39 D585	T32-N36 WeakPolarHBondContact O-CB 3.4Å; T32-N36 VanDerWaalsContact O-CG 3.23Å; T32-N36 PolarHBondContact O-N 2.93Å; T32-N36 PolarHBondContact O-OD1 3.35Å; T33-N36 PolarHBondContact O-N 3.35Å; N36-R38 VanDerWaalsContact C-N 3.26Å; N36-R38 PolarHBondContact O-N 3.2Å; N36-E39 WeakPolarHBondContact O-CB 3.43Å; N36-E39 PolarHBondContact O-N 3.04Å; N36-D585 VanDerWaalsContact CB-OD2 3.32Å; N36-D585 WeakPolarHBondContact CB-OD2 3.11Å; N36-D585 PolarHBondContact ND2-OD2 3.39Å
37	Q	62.9	Low	62.4	Low	99 Å²	99	77.5 Å²	77.5	46%	0.463	40%	0.402	S	S	.	.	H	α-helix	trans	-66	-30.2	176.8	-80	179.9	-4	0	0	112	T33 E39 K40 Y41	T33-Q37 HydrophobicContact CG2-CG 4.09Å; T33-Q37 VanDerWaalsContact O-CB 3.25Å; T33-Q37 WeakPolarHBondContact O-CB 3.41Å; T33-Q37 WeakPolarHBondContact O-CG 3.33Å; T33-Q37 PolarHBondContact O-N 3.04Å; Q37-E39 VanDerWaalsContact C-N 3.3Å; Q37-E39 PolarHBondContact O-N 3.21Å; Q37-K40 PolarHBondContact O-N 3.49Å; Q37-Y41 WeakPolarHBondContact O-CD2 3.29Å; Q37-Y41 PolarHBondContact O-N 3.45Å
38	R	57.5	Low	61.9	Low	37 Å²	37	81.9 Å²	81.9	14%	0.14	42%	0.422	C	S	.	.	H	α-helix	trans	-68	-29.5	177.3	-165.1	178.1	-178	-165.3	3.2	112.8	L34 V35 N36 Y41 C42 D118 L122	L34-R38 PolarHBondContact O-N 2.91Å; V35-R38 PolarHBondContact O-N 3Å; N36-R38 VanDerWaalsContact C-N 3.26Å; N36-R38 PolarHBondContact O-N 3.2Å; R38-Y41 PolarHBondContact O-N 2.92Å; R38-C42 WeakPolarHBondContact O-CB 3.28Å; R38-C42 PolarHBondContact O-N 3.39Å; R38-C42 VanDerWaalsContact O-N 3.11Å; R38-D118 PolarHBondContact NH1-O 2.98Å; R38-D118 IonicContact NH2-OD2 2.75Å; R38-L122 VanDerWaalsContact CD-CD2 3.42Å
39	E	53.2	Low	61.7	Low	44 Å²	44	87.2 Å²	87.2	21%	0.206	44%	0.44	C	S	.	.	H	α-helix	trans	-58.3	-50.2	170.3	-92.8	176.9	157	0	0	111.1	N36 Q37 Y41 C42 R119 E586	N36-E39 WeakPolarHBondContact O-CB 3.43Å; N36-E39 PolarHBondContact O-N 3.04Å; Q37-E39 VanDerWaalsContact C-N 3.3Å; Q37-E39 PolarHBondContact O-N 3.21Å; E39-Y41 VanDerWaalsContact C-N 3.27Å; E39-Y41 PolarHBondContact O-N 3.38Å; E39-C42 PolarHBondContact O-N 2.93Å; E39-R119 VanDerWaalsContact CG-NH1 3.35Å; E39-R119 IonicContact OE1-CZ 3.5Å; E39-R119 IonicContact OE1-NH1 3.13Å; E39-R119 PolarHBondContact OE1-NH1 3.26Å; E39-R119 IonicContact OE1-NH2 3.48Å; E39-R119 PolarHBondContact OE1-NH2 2.96Å; E39-R119 IonicContact OE2-NH2 2.69Å; E39-E586 HydrophobicContact CB-CG 3.93Å; E39-E586 VanDerWaalsContact CB-OE1 3.22Å; E39-E586 WeakPolarHBondContact CB-OE1 3.46Å; E39-E586 HydrophobicContact CG-CG 4.2Å; E39-E586 WeakPolarHBondContact CG-OE1 3.47Å
40	K	50.3	Low	61.4	Low	88 Å²	88	84.6 Å²	84.6	38%	0.383	42%	0.423	S	S	.	.	H	α-helix	trans	-60.7	-32.7	-177.9	-73.8	175.8	176.4	161	0	113.7	Q37 D585	Q37-K40 PolarHBondContact O-N 3.49Å; K40-D585 WeakPolarHBondContact CE-O 3.01Å; K40-D585 PolarHBondContact NZ-O 2.82Å; K40-D585 IonicContact NZ-OD1 2.67Å; K40-D585 PolarHBondContact NZ-OD1 3.39Å
41	Y	50.6	Low	61.2	Low	118 Å²	118	80.2 Å²	80.2	46%	0.463	40%	0.404	S	S	.	.	H	α-helix	trans	-98.8	-14.3	-174.9	-65.9	-67.1	0	0	0	115.2	Q37 R38 E39 A50	Q37-Y41 WeakPolarHBondContact O-CD2 3.29Å; Q37-Y41 PolarHBondContact O-N 3.45Å; R38-Y41 PolarHBondContact O-N 2.92Å; E39-Y41 VanDerWaalsContact C-N 3.27Å; E39-Y41 PolarHBondContact O-N 3.38Å; Y41-A50 HydrophobicContact CD1-CB 3.88Å; Y41-A50 HydrophobicContact CE1-CB 4.05Å; Y41-A50 HydrophobicContact CG-CB 4.45Å
42	C	50.9	Low	61.5	Low	76 Å²	76	84.6 Å²	84.6	51%	0.514	42%	0.422	S	S	.	.	H	α-helix	trans	-82.1	-15	174.4	-84.4	0	0	0	0	113.7	R38 E39	R38-C42 WeakPolarHBondContact O-CB 3.28Å; R38-C42 PolarHBondContact O-N 3.39Å; R38-C42 VanDerWaalsContact O-N 3.11Å; E39-C42 PolarHBondContact O-N 2.93Å
43	G	47	Very low	61.8	Low	57 Å²	57	83.8 Å²	83.8	59%	0.588	42%	0.422	S	S	*	.	S	Bend	trans	-71.3	-65.2	-171.9	0	0	0	0	0	116
44	K	49.6	Very low	62	Low	179 Å²	179	83.7 Å²	83.7	78%	0.778	42%	0.419	S	S	*	.	S	Bend	trans	-146.4	-6.1	-163.6	-73.4	177.6	179.2	163.1	0	117.5	E719	K44-E719 IonicContact NZ-OE1 3.52Å; K44-E719 PolarHBondContact NZ-OE1 3.41Å
45	I	46.7	Very low	62.6	Low	139 Å²	139	83.5 Å²	83.5	71%	0.713	42%	0.419	S	S	*	.			trans	-144.7	98.9	178.4	-52.9	177.4	0	0	0	111.8	S47	I45-S47 VanDerWaalsContact C-N 3.33Å; I45-S47 PolarHBondContact O-N 3.09Å
46	R	57.2	Low	63.3	Low	183 Å²	183	89.8 Å²	89.8	69%	0.691	44%	0.444	S	S	*	.			trans	-77	79.5	170.1	-73.5	-177	-176.5	174.3	-0	110.3	E48 L51	R46-E48 PolarHBondContact O-N 3.35Å; R46-L51 HydrophobicContact CB-CD1 4.17Å; R46-L51 HydrophobicContact CG-CD1 4.41Å
47	S	63.7	Low	64.1	Low	56 Å²	56	91 Å²	91	39%	0.392	45%	0.453	S	S	.	.			trans	-67.4	125.5	163.1	174.6	0	0	0	0	108.7	I45 K49 A50 L51	I45-S47 VanDerWaalsContact C-N 3.33Å; I45-S47 PolarHBondContact O-N 3.09Å; S47-K49 PolarHBondContact O-N 2.92Å; S47-K49 VanDerWaalsContact O-N 3.08Å; S47-K49 WeakPolarHBondContact OG-CB 3.43Å; S47-K49 PolarHBondContact OG-N 3.47Å; S47-A50 WeakPolarHBondContact O-CB 3.1Å; S47-A50 PolarHBondContact O-N 3.4Å; S47-L51 PolarHBondContact O-N 3.08Å
48	E	68	Low	65.2	Low	131 Å²	131	86.3 Å²	86.3	61%	0.612	43%	0.431	S	S	*	.	H	α-helix	trans	-51.9	-31.8	172.8	-166.5	-168.3	151.5	0	0	111.8	R46 K52	R46-E48 PolarHBondContact O-N 3.35Å; E48-K52 HydrophobicContact CG-CD 4.41Å; E48-K52 WeakPolarHBondContact O-CB 3.35Å; E48-K52 WeakPolarHBondContact O-CG 3.41Å; E48-K52 PolarHBondContact O-N 3.34Å; E48-K52 VanDerWaalsContact OE1-CE 3.25Å; E48-K52 WeakPolarHBondContact OE1-CE 3.03Å; E48-K52 IonicContact OE1-NZ 2.71Å; E48-K52 PolarHBondContact OE1-NZ 3.45Å
49	K	74	Confident	66.6	Low	173 Å²	173	89.6 Å²	89.6	75%	0.752	45%	0.446	S	S	*	.	H	α-helix	trans	-64.9	-39.1	175.4	-167.9	178.9	179.4	-179.5	0	112.5	S47 A53	S47-K49 PolarHBondContact O-N 2.92Å; S47-K49 VanDerWaalsContact O-N 3.08Å; S47-K49 WeakPolarHBondContact OG-CB 3.43Å; S47-K49 PolarHBondContact OG-N 3.47Å; K49-A53 WeakPolarHBondContact O-CB 3.12Å; K49-A53 PolarHBondContact O-N 2.94Å
50	A	67.9	Low	68.3	Low	17 Å²	17	90.2 Å²	90.2	14%	0.14	46%	0.459	C	S	.	.	H	α-helix	trans	-71.1	-41.8	178.6	0	0	0	0	0	111.7	Y41 S47 A53 I54	Y41-A50 HydrophobicContact CD1-CB 3.88Å; Y41-A50 HydrophobicContact CE1-CB 4.05Å; Y41-A50 HydrophobicContact CG-CB 4.45Å; S47-A50 WeakPolarHBondContact O-CB 3.1Å; S47-A50 PolarHBondContact O-N 3.4Å; A50-A53 WeakPolarHBondContact O-CB 3.3Å; A50-A53 PolarHBondContact O-N 3.13Å; A50-A53 VanDerWaalsContact O-N 3.16Å; A50-I54 WeakPolarHBondContact O-CG1 3.38Å; A50-I54 PolarHBondContact O-N 3.49Å
51	L	67.6	Low	70.2	Confident	37 Å²	37	87.8 Å²	87.8	19%	0.194	45%	0.452	C	S	.	.	H	α-helix	trans	-60.3	-47	173.2	-82	151.1	0	0	0	111.5	R46 S47 A53 I54 V55	R46-L51 HydrophobicContact CB-CD1 4.17Å; R46-L51 HydrophobicContact CG-CD1 4.41Å; S47-L51 PolarHBondContact O-N 3.08Å; L51-A53 VanDerWaalsContact C-N 3.25Å; L51-A53 PolarHBondContact O-N 3.01Å; L51-I54 PolarHBondContact O-N 3.25Å; L51-V55 WeakPolarHBondContact O-CG2 3.5Å; L51-V55 PolarHBondContact O-N 3.29Å
52	K	77.5	Confident	72.1	Confident	117 Å²	117	84.6 Å²	84.6	51%	0.509	44%	0.441	S	S	.	.	H	α-helix	trans	-58.8	-36.2	174.1	-77.5	172.8	170.4	169.2	0	112.3	E48 K56	E48-K52 HydrophobicContact CG-CD 4.41Å; E48-K52 WeakPolarHBondContact O-CB 3.35Å; E48-K52 WeakPolarHBondContact O-CG 3.41Å; E48-K52 PolarHBondContact O-N 3.34Å; E48-K52 VanDerWaalsContact OE1-CE 3.25Å; E48-K52 WeakPolarHBondContact OE1-CE 3.03Å; E48-K52 IonicContact OE1-NZ 2.71Å; E48-K52 PolarHBondContact OE1-NZ 3.45Å; K52-K56 VanDerWaalsContact O-CG 3.29Å; K52-K56 WeakPolarHBondContact O-CG 3.44Å; K52-K56 PolarHBondContact O-N 3.26Å; K52-K56 VanDerWaalsContact O-N 3.1Å
53	A	78.1	Confident	74.1	Confident	50 Å²	50	83 Å²	83	41%	0.413	43%	0.433	S	S	.	.	H	α-helix	trans	-67.5	-46.2	176.7	0	0	0	0	0	112.1	K49 A50 L51 V55 K56 V57	K49-A53 WeakPolarHBondContact O-CB 3.12Å; K49-A53 PolarHBondContact O-N 2.94Å; A50-A53 WeakPolarHBondContact O-CB 3.3Å; A50-A53 PolarHBondContact O-N 3.13Å; A50-A53 VanDerWaalsContact O-N 3.16Å; L51-A53 VanDerWaalsContact C-N 3.25Å; L51-A53 PolarHBondContact O-N 3.01Å; A53-V55 VanDerWaalsContact C-N 3.34Å; A53-V55 PolarHBondContact O-N 3.28Å; A53-K56 WeakPolarHBondContact O-CB 3.45Å; A53-K56 PolarHBondContact O-N 3.34Å; A53-V57 WeakPolarHBondContact O-CG2 3.3Å; A53-V57 PolarHBondContact O-N 2.92Å
54	I	74.6	Confident	76.2	Confident	56 Å²	56	82.4 Å²	82.4	29%	0.287	42%	0.422	S	S	.	.	H	α-helix	trans	-59.7	-45.2	177.6	-67.8	167	0	0	0	111	A50 L51 K56 V57 G58	A50-I54 WeakPolarHBondContact O-CG1 3.38Å; A50-I54 PolarHBondContact O-N 3.49Å; L51-I54 PolarHBondContact O-N 3.25Å; I54-K56 PolarHBondContact O-N 2.92Å; I54-V57 PolarHBondContact O-N 2.89Å; I54-G58 PolarHBondContact O-N 3.03Å
55	V	80.9	Confident	78.4	Confident	30 Å²	30	74.4 Å²	74.4	18%	0.182	39%	0.389	C	S	.	.	H	α-helix	trans	-58.3	-48.2	176.1	174.6	0	0	0	0	110.8	L51 A53 V57 G58 F59 S104 V108	L51-V55 WeakPolarHBondContact O-CG2 3.5Å; L51-V55 PolarHBondContact O-N 3.29Å; A53-V55 VanDerWaalsContact C-N 3.34Å; A53-V55 PolarHBondContact O-N 3.28Å; V55-V57 VanDerWaalsContact C-N 3.3Å; V55-V57 PolarHBondContact O-N 3.4Å; V55-G58 PolarHBondContact O-N 3.48Å; V55-F59 HydrophobicContact CG1-CD2 3.74Å; V55-F59 HydrophobicContact CG1-CE2 3.65Å; V55-F59 VanDerWaalsContact O-CD2 3.28Å; V55-F59 WeakPolarHBondContact O-CD2 3.13Å; V55-F59 PolarHBondContact O-N 3.44Å; V55-F59 VanDerWaalsContact O-N 3.1Å; V55-S104 VanDerWaalsContact CG2-O 3.3Å; V55-S104 WeakPolarHBondContact CG2-O 3.47Å; V55-V108 HydrophobicContact CG2-CG2 4.48Å
56	K	85.2	Confident	80.7	Confident	158 Å²	158	70.9 Å²	70.9	69%	0.687	37%	0.369	S	S	*	.	H	α-helix	trans	-59	-40.9	177	-76.9	178.7	178.6	-170.8	0	112.3	K52 A53 I54 A60	K52-K56 VanDerWaalsContact O-CG 3.29Å; K52-K56 WeakPolarHBondContact O-CG 3.44Å; K52-K56 PolarHBondContact O-N 3.26Å; K52-K56 VanDerWaalsContact O-N 3.1Å; A53-K56 WeakPolarHBondContact O-CB 3.45Å; A53-K56 PolarHBondContact O-N 3.34Å; I54-K56 PolarHBondContact O-N 2.92Å; K56-A60 VanDerWaalsContact O-CB 3.31Å; K56-A60 WeakPolarHBondContact O-CB 3.49Å; K56-A60 PolarHBondContact O-N 3Å
57	V	83.3	Confident	82.5	Confident	66 Å²	66	70 Å²	70	40%	0.4	37%	0.366	S	S	.	.	H	α-helix	trans	-64.3	-46	177.1	172.8	0	0	0	0	110.8	L34 A53 I54 V55 F59 A60 V61	L34-V57 HydrophobicContact CD1-CG1 3.5Å; A53-V57 WeakPolarHBondContact O-CG2 3.3Å; A53-V57 PolarHBondContact O-N 2.92Å; I54-V57 PolarHBondContact O-N 2.89Å; V55-V57 VanDerWaalsContact C-N 3.3Å; V55-V57 PolarHBondContact O-N 3.4Å; V57-F59 PolarHBondContact O-N 3.44Å; V57-A60 WeakPolarHBondContact O-CB 3.49Å; V57-A60 PolarHBondContact O-N 2.81Å; V57-A60 VanDerWaalsContact O-N 3.14Å; V57-V61 HydrophobicContact CG1-CG2 4.38Å; V57-V61 WeakPolarHBondContact O-CG2 3.28Å; V57-V61 PolarHBondContact O-N 3.28Å
58	G	84.9	Confident	83.9	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-57.5	-45.6	177.5	0	0	0	0	0	113.1	I54 V55 V61 Q62	I54-G58 PolarHBondContact O-N 3.03Å; V55-G58 PolarHBondContact O-N 3.48Å; G58-V61 PolarHBondContact O-N 3.06Å; G58-Q62 PolarHBondContact O-N 3.17Å
59	F	88.5	Confident	85.3	Confident	106 Å²	106	63.7 Å²	63.7	47%	0.465	33%	0.329	S	S	.	.	H	α-helix	trans	-67.9	-35	175	-78.7	-69.8	0	0	0	113.1	V55 V57 Q62 A63	V55-F59 HydrophobicContact CG1-CD2 3.74Å; V55-F59 HydrophobicContact CG1-CE2 3.65Å; V55-F59 VanDerWaalsContact O-CD2 3.28Å; V55-F59 WeakPolarHBondContact O-CD2 3.13Å; V55-F59 PolarHBondContact O-N 3.44Å; V55-F59 VanDerWaalsContact O-N 3.1Å; V57-F59 PolarHBondContact O-N 3.44Å; F59-Q62 PolarHBondContact O-N 3.42Å; F59-A63 WeakPolarHBondContact O-CB 3.41Å; F59-A63 PolarHBondContact O-N 2.77Å
60	A	89.1	Confident	86.4	Confident	58 Å²	58	58 Å²	58	48%	0.479	32%	0.315	S	S	.	.	H	α-helix	trans	-65.5	-40.3	174.8	0	0	0	0	0	111.9	K56 V57 A63 A64	K56-A60 VanDerWaalsContact O-CB 3.31Å; K56-A60 WeakPolarHBondContact O-CB 3.49Å; K56-A60 PolarHBondContact O-N 3Å; V57-A60 WeakPolarHBondContact O-CB 3.49Å; V57-A60 PolarHBondContact O-N 2.81Å; V57-A60 VanDerWaalsContact O-N 3.14Å; A60-A63 PolarHBondContact O-N 3.35Å; A60-A64 WeakPolarHBondContact O-CB 3.39Å; A60-A64 PolarHBondContact O-N 3.46Å
61	V	88.7	Confident	87.7	Confident	37 Å²	37	61.5 Å²	61.5	22%	0.224	33%	0.334	C	S	.	.	H	α-helix	trans	-61.3	-49.8	173.5	171.7	0	0	0	0	110.1	V57 G58 A63 A64 V65 I100 L129	V57-V61 HydrophobicContact CG1-CG2 4.38Å; V57-V61 WeakPolarHBondContact O-CG2 3.28Å; V57-V61 PolarHBondContact O-N 3.28Å; G58-V61 PolarHBondContact O-N 3.06Å; V61-A63 PolarHBondContact O-N 3.01Å; V61-A64 PolarHBondContact O-N 3.09Å; V61-A64 VanDerWaalsContact O-N 3.16Å; V61-V65 HydrophobicContact CG1-CG2 4.4Å; V61-V65 WeakPolarHBondContact O-CG2 3.18Å; V61-V65 PolarHBondContact O-N 2.83Å; V61-I100 HydrophobicContact CB-CG2 4.49Å; V61-I100 HydrophobicContact CG1-CD1 4.16Å; V61-I100 HydrophobicContact CG1-CG2 4.3Å; V61-L129 HydrophobicContact CG1-CD2 3.98Å
62	Q	91.5	Very high	89.1	Confident	50 Å²	50	59.8 Å²	59.8	23%	0.234	33%	0.326	C	S	.	.	H	α-helix	trans	-56.1	-48.6	176.8	-175.8	-171.7	5.1	0	0	111.8	G58 F59 A64 V65 E66 N98 A101	G58-Q62 PolarHBondContact O-N 3.17Å; F59-Q62 PolarHBondContact O-N 3.42Å; Q62-A64 VanDerWaalsContact C-N 3.29Å; Q62-A64 PolarHBondContact O-N 3.41Å; Q62-V65 PolarHBondContact O-N 3Å; Q62-E66 PolarHBondContact O-N 2.83Å; Q62-N98 PolarHBondContact NE2-OD1 3.43Å; Q62-A101 HydrophobicContact CB-CB 4.02Å; Q62-A101 HydrophobicContact CG-CB 4.45Å
63	A	92.6	Very high	90	Very high	44 Å²	44	56.3 Å²	56.3	36%	0.364	31%	0.311	S	S	.	.	H	α-helix	trans	-63.1	-34.2	178.9	0	0	0	0	0	113	F59 A60 V61 R67	F59-A63 WeakPolarHBondContact O-CB 3.41Å; F59-A63 PolarHBondContact O-N 2.77Å; A60-A63 PolarHBondContact O-N 3.35Å; V61-A63 PolarHBondContact O-N 3.01Å; A63-R67 PolarHBondContact O-N 3.35Å; A63-R67 PolarHBondContact O-NH1 3.02Å; A63-R67 VanDerWaalsContact O-NH1 3.15Å
64	A	91.9	Very high	90.9	Very high	43 Å²	43	57 Å²	57	36%	0.355	31%	0.313	S	S	.	.	H	α-helix	trans	-69.3	-40.7	174.5	0	0	0	0	0	112	A60 V61 Q62 R67 F68	A60-A64 WeakPolarHBondContact O-CB 3.39Å; A60-A64 PolarHBondContact O-N 3.46Å; V61-A64 PolarHBondContact O-N 3.09Å; V61-A64 VanDerWaalsContact O-N 3.16Å; Q62-A64 VanDerWaalsContact C-N 3.29Å; Q62-A64 PolarHBondContact O-N 3.41Å; A64-R67 PolarHBondContact O-N 3.46Å; A64-F68 PolarHBondContact O-N 3.11Å
65	V	93.9	Very high	91.8	Very high	11 Å²	11	56.4 Å²	56.4	7%	0.067	31%	0.31	C	S	.	.	H	α-helix	trans	-63.3	-42.2	175.8	172.7	0	0	0	0	111.2	V61 Q62 R67 F68 V69 A93 L129	V61-V65 HydrophobicContact CG1-CG2 4.4Å; V61-V65 WeakPolarHBondContact O-CG2 3.18Å; V61-V65 PolarHBondContact O-N 2.83Å; Q62-V65 PolarHBondContact O-N 3Å; V65-R67 VanDerWaalsContact C-N 3.33Å; V65-R67 PolarHBondContact O-N 3.44Å; V65-F68 WeakPolarHBondContact O-CB 3.5Å; V65-F68 PolarHBondContact O-N 3.01Å; V65-F68 VanDerWaalsContact O-N 3.17Å; V65-V69 HydrophobicContact CG1-CG2 4.07Å; V65-V69 WeakPolarHBondContact O-CB 3.36Å; V65-V69 VanDerWaalsContact O-CG2 3.31Å; V65-V69 WeakPolarHBondContact O-CG2 3.39Å; V65-V69 PolarHBondContact O-N 3.32Å; V65-A93 HydrophobicContact CG1-CB 4.23Å; V65-A93 WeakPolarHBondContact CG1-O 3.21Å; V65-L129 HydrophobicContact CG1-CD1 4.36Å; V65-L129 HydrophobicContact CG2-CD1 3.59Å; V65-L129 HydrophobicContact CG2-CD2 4.11Å; V65-L129 HydrophobicContact CG2-CG 4.49Å
66	E	95.6	Very high	92.4	Very high	66 Å²	66	55 Å²	55	31%	0.308	30%	0.301	S	S	.	.	H	α-helix	trans	-61.5	-40.6	176.8	-69.3	-58	156.4	0	0	112.3	Q62 V69 A70 R94	Q62-E66 PolarHBondContact O-N 2.83Å; E66-V69 PolarHBondContact O-N 2.94Å; E66-A70 WeakPolarHBondContact O-CB 3.49Å; E66-A70 PolarHBondContact O-N 2.91Å; E66-R94 WeakPolarHBondContact OE1-CG 3.28Å; E66-R94 IonicContact OE1-NE 3.1Å; E66-R94 IonicContact OE2-NE 3.71Å; E66-R94 PolarHBondContact OE2-NE 3.13Å
67	R	94.9	Very high	92.9	Very high	164 Å²	164	51.9 Å²	51.9	62%	0.619	29%	0.292	S	S	*	.	H	α-helix	trans	-64.3	-40.6	174.3	-70.3	-170.2	-61.1	-83.9	2.3	112.2	A63 A64 V65 V71	A63-R67 PolarHBondContact O-N 3.35Å; A63-R67 PolarHBondContact O-NH1 3.02Å; A63-R67 VanDerWaalsContact O-NH1 3.15Å; A64-R67 PolarHBondContact O-N 3.46Å; V65-R67 VanDerWaalsContact C-N 3.33Å; V65-R67 PolarHBondContact O-N 3.44Å; R67-V71 PolarHBondContact O-N 2.75Å
68	F	94.5	Very high	93.4	Very high	54 Å²	54	55.3 Å²	55.3	24%	0.237	30%	0.303	C	S	.	.	H	α-helix	trans	-64.7	-45.3	177.4	175.3	-97.9	0	0	0	111.7	A64 V65 V71 G72 V133 V136 L137	A64-F68 PolarHBondContact O-N 3.11Å; V65-F68 WeakPolarHBondContact O-CB 3.5Å; V65-F68 PolarHBondContact O-N 3.01Å; V65-F68 VanDerWaalsContact O-N 3.17Å; F68-V71 PolarHBondContact O-N 2.89Å; F68-G72 PolarHBondContact O-N 3.29Å; F68-G72 VanDerWaalsContact O-N 3.07Å; F68-V133 HydrophobicContact CD1-CG2 4.33Å; F68-V133 HydrophobicContact CE1-CB 4.28Å; F68-V133 HydrophobicContact CE1-CG1 4.15Å; F68-V133 HydrophobicContact CE1-CG2 3.99Å; F68-V133 HydrophobicContact CE2-CG1 4.28Å; F68-V133 HydrophobicContact CZ-CB 4.37Å; F68-V133 HydrophobicContact CZ-CG1 3.79Å; F68-V133 HydrophobicContact CZ-CG2 4.47Å; F68-V136 HydrophobicContact CE1-CB 3.6Å; F68-V136 HydrophobicContact CE1-CG1 3.49Å; F68-V136 VanDerWaalsContact CE1-CG1 3.49Å; F68-V136 HydrophobicContact CE1-CG2 3.92Å; F68-V136 HydrophobicContact CE2-CG1 4.34Å; F68-V136 HydrophobicContact CZ-CB 3.64Å; F68-V136 HydrophobicContact CZ-CG1 3.38Å; F68-V136 HydrophobicContact CZ-CG2 4.46Å; F68-L137 HydrophobicContact CE2-CD2 3.98Å; F68-L137 HydrophobicContact CE2-CG 4.36Å; F68-L137 HydrophobicContact CZ-CD2 4.24Å; F68-L137 HydrophobicContact CZ-CG 4.19Å
69	V	96.3	Very high	93.7	Very high	0 Å²	0	57 Å²	57	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-65.2	-40.9	178.9	168.3	0	0	0	0	111.5	V65 E66 V71 G72 E73 C90 A93	V65-V69 HydrophobicContact CG1-CG2 4.07Å; V65-V69 WeakPolarHBondContact O-CB 3.36Å; V65-V69 VanDerWaalsContact O-CG2 3.31Å; V65-V69 WeakPolarHBondContact O-CG2 3.39Å; V65-V69 PolarHBondContact O-N 3.32Å; E66-V69 PolarHBondContact O-N 2.94Å; V69-V71 PolarHBondContact O-N 3.26Å; V69-G72 CarbonylContact O-C 3.57Å; V69-G72 WeakPolarHBondContact O-CA 3.47Å; V69-G72 PolarHBondContact O-N 3.4Å; V69-E73 HydrophobicContact CG1-CG 4.02Å; V69-E73 WeakPolarHBondContact CG1-OE1 3.39Å; V69-E73 WeakPolarHBondContact O-CG 3.48Å; V69-E73 PolarHBondContact O-N 3.26Å; V69-C90 HydrophobicContact CG1-CB 3.67Å; V69-C90 HydrophobicContact CG2-CB 4.34Å; V69-C90 WeakPolarHBondContact CG2-O 3.29Å; V69-A93 HydrophobicContact CG2-CB 4Å
70	A	96.8	Very high	93.9	Very high	55 Å²	55	57 Å²	57	46%	0.455	32%	0.32	S	S	.	.	H	α-helix	trans	-57.1	-37.8	176.3	0	0	0	0	0	112.4	E66 C74	E66-A70 WeakPolarHBondContact O-CB 3.49Å; E66-A70 PolarHBondContact O-N 2.91Å; A70-C74 WeakPolarHBondContact O-CB 3.4Å; A70-C74 PolarHBondContact O-N 3.35Å; A70-C74 VanDerWaalsContact O-N 3.09Å
71	V	96	Very high	93.8	Very high	89 Å²	89	59.2 Å²	59.2	54%	0.539	32%	0.32	S	S	.	.	H	α-helix	trans	-68.9	-43.9	173.4	177.7	0	0	0	0	111	R67 F68 V69 C74 I75	R67-V71 PolarHBondContact O-N 2.75Å; F68-V71 PolarHBondContact O-N 2.89Å; V69-V71 PolarHBondContact O-N 3.26Å; V71-C74 WeakPolarHBondContact O-CB 3.41Å; V71-C74 PolarHBondContact O-N 2.92Å; V71-I75 HydrophobicContact CG1-CD1 4.04Å; V71-I75 WeakPolarHBondContact O-CG1 3.27Å; V71-I75 PolarHBondContact O-N 3.27Å
72	G	95.7	Very high	93.9	Very high	2 Å²	2	57.4 Å²	57.4	2%	0.021	31%	0.309	C	S	.	.	H	α-helix	trans	-60.4	-44	177	0	0	0	0	0	113.2	F68 V69 I75 G76 M86	F68-G72 PolarHBondContact O-N 3.29Å; F68-G72 VanDerWaalsContact O-N 3.07Å; V69-G72 CarbonylContact O-C 3.57Å; V69-G72 WeakPolarHBondContact O-CA 3.47Å; V69-G72 PolarHBondContact O-N 3.4Å; G72-I75 PolarHBondContact O-N 3.4Å; G72-G76 PolarHBondContact O-N 3.41Å; G72-M86 WeakPolarHBondContact O-CG 3Å
73	E	96.7	Very high	94.1	Very high	44 Å²	44	57.9 Å²	57.9	21%	0.206	31%	0.312	C	S	.	.	H	α-helix	trans	-64.3	-42.4	176.1	-71.3	172.7	166	0	0	111.3	V69 I75 G76 D77 Y87 C90 R94	V69-E73 HydrophobicContact CG1-CG 4.02Å; V69-E73 WeakPolarHBondContact CG1-OE1 3.39Å; V69-E73 WeakPolarHBondContact O-CG 3.48Å; V69-E73 PolarHBondContact O-N 3.26Å; E73-I75 VanDerWaalsContact C-N 3.35Å; E73-I75 PolarHBondContact O-N 3.04Å; E73-G76 CarbonylContact O-C 3.44Å; E73-G76 WeakPolarHBondContact O-CA 3.16Å; E73-G76 PolarHBondContact O-N 3.45Å; E73-D77 PolarHBondContact O-N 3.34Å; E73-Y87 HydrophobicContact CG-CE1 4.47Å; E73-C90 HydrophobicContact CG-CB 4.13Å; E73-R94 VanDerWaalsContact CD-NH2 3.32Å; E73-R94 IonicContact OE1-CZ 2.69Å; E73-R94 IonicContact OE1-NH1 2.7Å; E73-R94 PolarHBondContact OE1-NH1 3Å; E73-R94 IonicContact OE1-NH2 3.12Å; E73-R94 PolarHBondContact OE1-NH2 2.86Å; E73-R94 IonicContact OE2-NH2 2.96Å; E73-R94 PolarHBondContact OE2-NH2 3.04Å
74	C	96.6	Very high	94.2	Very high	65 Å²	65	59.5 Å²	59.5	44%	0.439	32%	0.318	S	S	.	.	H	α-helix	trans	-57.8	-44	173.2	-170.5	0	0	0	0	112.4	A70 V71 G76 D77 E78	A70-C74 WeakPolarHBondContact O-CB 3.4Å; A70-C74 PolarHBondContact O-N 3.35Å; A70-C74 VanDerWaalsContact O-N 3.09Å; V71-C74 WeakPolarHBondContact O-CB 3.41Å; V71-C74 PolarHBondContact O-N 2.92Å; C74-G76 VanDerWaalsContact C-N 3.31Å; C74-G76 PolarHBondContact O-N 3.25Å; C74-D77 PolarHBondContact O-N 3.4Å; C74-E78 PolarHBondContact O-N 3.28Å
75	I	94.3	Very high	94.3	Very high	43 Å²	43	60.1 Å²	60.1	22%	0.221	31%	0.314	C	S	.	.	H	α-helix	trans	-64.1	-39	174.7	-66.7	167	0	0	0	110.6	V71 G72 E73 E78 H79 I82 M86 A140 V143	V71-I75 HydrophobicContact CG1-CD1 4.04Å; V71-I75 WeakPolarHBondContact O-CG1 3.27Å; V71-I75 PolarHBondContact O-N 3.27Å; G72-I75 PolarHBondContact O-N 3.4Å; E73-I75 VanDerWaalsContact C-N 3.35Å; E73-I75 PolarHBondContact O-N 3.04Å; I75-E78 PolarHBondContact O-N 3.24Å; I75-H79 PolarHBondContact O-CD2 2.89Å; I75-H79 VanDerWaalsContact O-CD2 3.29Å; I75-H79 PolarHBondContact O-N 3.35Å; I75-I82 HydrophobicContact CG2-CD1 4.32Å; I75-M86 HydrophobicContact CB-CE 4.47Å; I75-M86 HydrophobicContact CG2-CE 4.07Å; I75-A140 HydrophobicContact CD1-CB 4.34Å; I75-V143 HydrophobicContact CG2-CG2 4.06Å
76	G	94.3	Very high	94.4	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-60.8	-42.4	175.1	0	0	0	0	0	112.6	G72 E73 C74 E78 H79 Q83	G72-G76 PolarHBondContact O-N 3.41Å; E73-G76 CarbonylContact O-C 3.44Å; E73-G76 WeakPolarHBondContact O-CA 3.16Å; E73-G76 PolarHBondContact O-N 3.45Å; C74-G76 VanDerWaalsContact C-N 3.31Å; C74-G76 PolarHBondContact O-N 3.25Å; G76-E78 VanDerWaalsContact C-N 3.33Å; G76-E78 PolarHBondContact O-N 3.12Å; G76-H79 CarbonylContact O-C 3.59Å; G76-H79 VanDerWaalsContact O-C 3.3Å; G76-H79 PolarHBondContact O-N 3.22Å; G76-H79 VanDerWaalsContact O-N 3.15Å; G76-Q83 WeakPolarHBondContact O-CB 3.32Å; G76-Q83 WeakPolarHBondContact O-CG 3.38Å
77	D	95.3	Very high	94.5	Very high	93 Å²	93	60.3 Å²	60.3	50%	0.497	31%	0.311	S	S	.	.	H	α-helix	trans	-64.7	-35.5	178.3	-76.5	-27.4	0	0	0	113.1	E73 C74 H79 Q83 Y87	E73-D77 PolarHBondContact O-N 3.34Å; C74-D77 PolarHBondContact O-N 3.4Å; D77-H79 VanDerWaalsContact C-N 3.28Å; D77-H79 PolarHBondContact O-N 3.4Å; D77-Q83 PolarHBondContact OD1-NE2 3.39Å; D77-Q83 VanDerWaalsContact OD1-NE2 3.13Å; D77-Y87 PolarHBondContact OD1-OH 3.07Å; D77-Y87 PolarHBondContact OD2-OH 3.32Å
78	E	94	Very high	94.6	Very high	137 Å²	137	57.2 Å²	57.2	64%	0.64	31%	0.307	S	S	*	.	H	α-helix	trans	-74	-18.9	175.4	-68.1	178.5	-177.9	0	0	112.9	C74 I75 G76	C74-E78 PolarHBondContact O-N 3.28Å; I75-E78 PolarHBondContact O-N 3.24Å; G76-E78 VanDerWaalsContact C-N 3.33Å; G76-E78 PolarHBondContact O-N 3.12Å
79	H	91.7	Very high	94.6	Very high	35 Å²	35	54.6 Å²	54.6	16%	0.162	30%	0.295	C	S	.	.			trans	-134.1	78.7	-171.6	-62.7	-63.9	0	0	0	113.1	I75 G76 D77 E81 I82 Q83 V143	I75-H79 PolarHBondContact O-CD2 2.89Å; I75-H79 VanDerWaalsContact O-CD2 3.29Å; I75-H79 PolarHBondContact O-N 3.35Å; G76-H79 CarbonylContact O-C 3.59Å; G76-H79 VanDerWaalsContact O-C 3.3Å; G76-H79 PolarHBondContact O-N 3.22Å; G76-H79 VanDerWaalsContact O-N 3.15Å; D77-H79 VanDerWaalsContact C-N 3.28Å; D77-H79 PolarHBondContact O-N 3.4Å; H79-E81 HydrophobicContact CB-CG 4.42Å; H79-E81 PolarHBondContact O-N 3.47Å; H79-I82 HydrophobicContact CB-CD1 4.22Å; H79-I82 HydrophobicContact CB-CG1 3.68Å; H79-I82 VanDerWaalsContact O-CG1 3.28Å; H79-I82 WeakPolarHBondContact O-CG1 3.25Å; H79-I82 PolarHBondContact O-N 2.85Å; H79-Q83 PolarHBondContact O-N 3.33Å; H79-Q83 VanDerWaalsContact O-N 3.1Å; H79-V143 HydrophobicContact CB-CG2 4.35Å; H79-V143 VanDerWaalsContact CD2-CG1 3.41Å; H79-V143 WeakPolarHBondContact CD2-CG1 3.32Å; H79-V143 WeakPolarHBondContact NE2-CG1 3.42Å
80	V	91	Very high	94.7	Very high	107 Å²	107	54.6 Å²	54.6	65%	0.648	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.4	-38.9	-175.6	-178.4	0	0	0	0	113.9	I82 Q83	V80-I82 VanDerWaalsContact C-N 3.34Å; V80-I82 PolarHBondContact O-N 3.05Å; V80-Q83 WeakPolarHBondContact O-CB 3.49Å; V80-Q83 PolarHBondContact O-N 2.85Å
81	E	88.1	Confident	94.7	Very high	104 Å²	104	56.5 Å²	56.5	49%	0.486	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-29.3	176.7	56.5	-129.9	-110.3	0	0	117.3	H79 K146	H79-E81 HydrophobicContact CB-CG 4.42Å; H79-E81 PolarHBondContact O-N 3.47Å; E81-K146 VanDerWaalsContact CD-NZ 3.32Å; E81-K146 VanDerWaalsContact OE1-CD 3.24Å; E81-K146 WeakPolarHBondContact OE1-CD 3.12Å; E81-K146 IonicContact OE1-NZ 2.69Å; E81-K146 PolarHBondContact OE1-NZ 3.3Å
82	I	91.2	Very high	94.7	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-9.6	178	60.3	146.5	0	0	0	111.6	I75 H79 V80 P84 E85 M86 V143	I75-I82 HydrophobicContact CG2-CD1 4.32Å; H79-I82 HydrophobicContact CB-CD1 4.22Å; H79-I82 HydrophobicContact CB-CG1 3.68Å; H79-I82 VanDerWaalsContact O-CG1 3.28Å; H79-I82 WeakPolarHBondContact O-CG1 3.25Å; H79-I82 PolarHBondContact O-N 2.85Å; V80-I82 VanDerWaalsContact C-N 3.34Å; V80-I82 PolarHBondContact O-N 3.05Å; I82-P84 VanDerWaalsContact C-CD 3.45Å; I82-P84 VanDerWaalsContact C-N 3.34Å; I82-E85 PolarHBondContact O-N 2.81Å; I82-E85 VanDerWaalsContact O-N 3.1Å; I82-M86 HydrophobicContact CD1-CB 4.49Å; I82-M86 HydrophobicContact CD1-CE 3.91Å; I82-M86 WeakPolarHBondContact O-CB 3.47Å; I82-M86 PolarHBondContact O-N 2.91Å; I82-V143 HydrophobicContact CD1-CG2 3.26Å; I82-V143 HydrophobicContact CG1-CG2 4.07Å
83	Q	94.3	Very high	94.7	Very high	60 Å²	60	54.9 Å²	54.9	28%	0.28	28%	0.281	S	S	.	.	H	α-helix	trans	-47.5	-48.8	-176.1	-169.5	-170.6	49.6	0	0	112.3	G76 D77 H79 V80 E85 M86 Y87	G76-Q83 WeakPolarHBondContact O-CB 3.32Å; G76-Q83 WeakPolarHBondContact O-CG 3.38Å; D77-Q83 PolarHBondContact OD1-NE2 3.39Å; D77-Q83 VanDerWaalsContact OD1-NE2 3.13Å; H79-Q83 PolarHBondContact O-N 3.33Å; H79-Q83 VanDerWaalsContact O-N 3.1Å; V80-Q83 WeakPolarHBondContact O-CB 3.49Å; V80-Q83 PolarHBondContact O-N 2.85Å; Q83-E85 PolarHBondContact O-N 3.34Å; Q83-M86 PolarHBondContact O-N 3.49Å; Q83-Y87 HydrophobicContact CG-CD2 3.63Å; Q83-Y87 HydrophobicContact CG-CE2 3.48Å; Q83-Y87 VanDerWaalsContact CG-CE2 3.48Å; Q83-Y87 WeakPolarHBondContact O-CB 3.35Å; Q83-Y87 WeakPolarHBondContact O-CD2 3.48Å; Q83-Y87 PolarHBondContact O-N 3.27Å
84	P	95.2	Very high	94.7	Very high	78 Å²	78	55 Å²	55	51%	0.506	28%	0.279	S	S	.	.	H	α-helix	trans	-61.2	-46.6	-179.2	-21.5	34.2	0	0	0	112.8	I82 M86 Y87 D88	I82-P84 VanDerWaalsContact C-CD 3.45Å; I82-P84 VanDerWaalsContact C-N 3.34Å; P84-M86 VanDerWaalsContact C-N 3.32Å; P84-M86 PolarHBondContact O-N 3.47Å; P84-Y87 PolarHBondContact O-N 2.78Å; P84-D88 VanDerWaalsContact O-CG 3.3Å; P84-D88 PolarHBondContact O-N 2.95Å
85	E	94.4	Very high	94.7	Very high	56 Å²	56	55.1 Å²	55.1	26%	0.262	28%	0.28	S	S	.	.	H	α-helix	trans	-66.3	-35.9	179.8	-61	-177.5	-123.7	0	0	111.8	I82 Q83 A89 L139 R142	I82-E85 PolarHBondContact O-N 2.81Å; I82-E85 VanDerWaalsContact O-N 3.1Å; Q83-E85 PolarHBondContact O-N 3.34Å; E85-A89 WeakPolarHBondContact O-CB 3.47Å; E85-A89 PolarHBondContact O-N 2.78Å; E85-L139 HydrophobicContact CB-CD1 3.95Å; E85-L139 HydrophobicContact CB-CD2 3.84Å; E85-L139 WeakPolarHBondContact O-CD1 3.49Å; E85-R142 IonicContact OE1-NH1 3.69Å; E85-R142 PolarHBondContact OE1-NH1 2.86Å; E85-R142 IonicContact OE2-NH1 3.71Å
86	M	95.9	Very high	94.7	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-68.1	-47.1	178.7	-176.4	60.4	84.3	0	0	111.2	G72 I75 I82 Q83 P84 D88 A89 C90 V136 L139 A140	G72-M86 WeakPolarHBondContact O-CG 3Å; I75-M86 HydrophobicContact CB-CE 4.47Å; I75-M86 HydrophobicContact CG2-CE 4.07Å; I82-M86 HydrophobicContact CD1-CB 4.49Å; I82-M86 HydrophobicContact CD1-CE 3.91Å; I82-M86 WeakPolarHBondContact O-CB 3.47Å; I82-M86 PolarHBondContact O-N 2.91Å; Q83-M86 PolarHBondContact O-N 3.49Å; P84-M86 VanDerWaalsContact C-N 3.32Å; P84-M86 PolarHBondContact O-N 3.47Å; M86-D88 VanDerWaalsContact C-N 3.34Å; M86-D88 PolarHBondContact O-N 2.89Å; M86-A89 PolarHBondContact O-N 3.15Å; M86-C90 VanDerWaalsContact O-CB 3.24Å; M86-C90 WeakPolarHBondContact O-CB 3.36Å; M86-C90 PolarHBondContact O-N 3.19Å; M86-C90 PolarHBondContact O-SG 3.29Å; M86-C90 VanDerWaalsContact O-SG 3.4Å; M86-V136 HydrophobicContact SD-CB 4.36Å; M86-V136 HydrophobicContact SD-CG1 3.85Å; M86-V136 HydrophobicContact SD-CG2 4.32Å; M86-L139 HydrophobicContact CB-CD1 4.41Å; M86-L139 HydrophobicContact CE-CB 3.63Å; M86-L139 HydrophobicContact SD-CB 4.32Å; M86-L139 HydrophobicContact SD-CD1 4.42Å; M86-A140 HydrophobicContact CE-CB 4.49Å
87	Y	96.8	Very high	94.7	Very high	81 Å²	81	53.2 Å²	53.2	32%	0.318	27%	0.271	S	S	.	.	H	α-helix	trans	-61.8	-42.3	176.8	-87.6	-111.5	0	0	0	111.6	E73 D77 Q83 P84 C90 Q91	E73-Y87 HydrophobicContact CG-CE1 4.47Å; D77-Y87 PolarHBondContact OD1-OH 3.07Å; D77-Y87 PolarHBondContact OD2-OH 3.32Å; Q83-Y87 HydrophobicContact CG-CD2 3.63Å; Q83-Y87 HydrophobicContact CG-CE2 3.48Å; Q83-Y87 VanDerWaalsContact CG-CE2 3.48Å; Q83-Y87 WeakPolarHBondContact O-CB 3.35Å; Q83-Y87 WeakPolarHBondContact O-CD2 3.48Å; Q83-Y87 PolarHBondContact O-N 3.27Å; P84-Y87 PolarHBondContact O-N 2.78Å; Y87-C90 PolarHBondContact O-N 2.69Å; Y87-Q91 VanDerWaalsContact O-CB 3.27Å; Y87-Q91 WeakPolarHBondContact O-CB 3.36Å; Y87-Q91 PolarHBondContact O-N 3.13Å
88	D	96.6	Very high	94.6	Very high	98 Å²	98	51.8 Å²	51.8	52%	0.524	26%	0.263	S	S	.	.	H	α-helix	trans	-59.6	-47.8	175.1	-75.2	-14.5	0	0	0	111.6	P84 M86 Q91 E92	P84-D88 VanDerWaalsContact O-CG 3.3Å; P84-D88 PolarHBondContact O-N 2.95Å; M86-D88 VanDerWaalsContact C-N 3.34Å; M86-D88 PolarHBondContact O-N 2.89Å; D88-Q91 PolarHBondContact O-N 3.28Å; D88-E92 WeakPolarHBondContact O-CG 3.35Å; D88-E92 PolarHBondContact O-N 2.87Å
89	A	95.7	Very high	94.6	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-66	-40.4	179.4	0	0	0	0	0	112.5	E85 M86 E92 A93 R135 V136 L139	E85-A89 WeakPolarHBondContact O-CB 3.47Å; E85-A89 PolarHBondContact O-N 2.78Å; M86-A89 PolarHBondContact O-N 3.15Å; A89-E92 PolarHBondContact O-N 3.28Å; A89-A93 PolarHBondContact O-N 3.2Å; A89-R135 HydrophobicContact CB-CB 3.91Å; A89-V136 HydrophobicContact CB-CG2 3.67Å; A89-L139 HydrophobicContact CB-CD1 4.06Å
90	C	97.5	Very high	94.4	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.5	-44.7	173.9	-84.1	0	0	0	0	111.9	V69 E73 M86 Y87 E92 A93 R94	V69-C90 HydrophobicContact CG1-CB 3.67Å; V69-C90 HydrophobicContact CG2-CB 4.34Å; V69-C90 WeakPolarHBondContact CG2-O 3.29Å; E73-C90 HydrophobicContact CG-CB 4.13Å; M86-C90 VanDerWaalsContact O-CB 3.24Å; M86-C90 WeakPolarHBondContact O-CB 3.36Å; M86-C90 PolarHBondContact O-N 3.19Å; M86-C90 PolarHBondContact O-SG 3.29Å; M86-C90 VanDerWaalsContact O-SG 3.4Å; Y87-C90 PolarHBondContact O-N 2.69Å; C90-E92 PolarHBondContact O-N 2.92Å; C90-A93 PolarHBondContact O-N 3.5Å; C90-R94 WeakPolarHBondContact O-CB 3.48Å; C90-R94 PolarHBondContact O-N 3.48Å
91	Q	97.4	Very high	94.3	Very high	94 Å²	94	40.6 Å²	40.6	44%	0.439	21%	0.211	S	C	.	.	H	α-helix	trans	-66.1	-38.5	178.5	-176.4	60.3	7.2	0	0	111.9	Y87 D88 R94 C95	Y87-Q91 VanDerWaalsContact O-CB 3.27Å; Y87-Q91 WeakPolarHBondContact O-CB 3.36Å; Y87-Q91 PolarHBondContact O-N 3.13Å; D88-Q91 PolarHBondContact O-N 3.28Å; Q91-R94 PolarHBondContact O-N 2.75Å; Q91-C95 WeakPolarHBondContact O-CB 2.98Å; Q91-C95 PolarHBondContact O-N 3.36Å; Q91-C95 PolarHBondContact O-SG 2.9Å
92	E	96.2	Very high	94.4	Very high	58 Å²	58	37.8 Å²	37.8	27%	0.271	20%	0.203	S	C	.	.	H	α-helix	trans	-63.4	-41.6	172.5	-74.6	177.5	-161.1	0	0	112.3	D88 A89 C90 C95 A96 Q128 R135	D88-E92 WeakPolarHBondContact O-CG 3.35Å; D88-E92 PolarHBondContact O-N 2.87Å; A89-E92 PolarHBondContact O-N 3.28Å; C90-E92 PolarHBondContact O-N 2.92Å; E92-C95 PolarHBondContact O-N 3.25Å; E92-A96 WeakPolarHBondContact O-CB 3.38Å; E92-A96 PolarHBondContact O-N 3.31Å; E92-Q128 PolarHBondContact OE2-NE2 3.28Å; E92-R135 IonicContact OE1-CZ 3.9Å; E92-R135 IonicContact OE1-NH1 2.81Å; E92-R135 PolarHBondContact OE1-NH1 3.27Å; E92-R135 IonicContact OE1-NH2 2.73Å; E92-R135 IonicContact OE2-CZ 3.92Å; E92-R135 IonicContact OE2-NH1 3.79Å; E92-R135 PolarHBondContact OE2-NH1 3.19Å
93	A	95.9	Very high	94.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.5	-46.6	176.6	0	0	0	0	0	111.2	V65 V69 A89 C90 C95 A96 G97 L129 S132	V65-A93 HydrophobicContact CG1-CB 4.23Å; V65-A93 WeakPolarHBondContact CG1-O 3.21Å; V69-A93 HydrophobicContact CG2-CB 4Å; A89-A93 PolarHBondContact O-N 3.2Å; C90-A93 PolarHBondContact O-N 3.5Å; A93-C95 PolarHBondContact O-N 3.15Å; A93-A96 PolarHBondContact O-N 3.33Å; A93-G97 PolarHBondContact O-N 3.14Å; A93-L129 HydrophobicContact CB-CD1 4.44Å; A93-S132 WeakPolarHBondContact CA-OG 3.27Å; A93-S132 WeakPolarHBondContact CB-OG 3.36Å; A93-S132 PolarHBondContact N-OG 3.1Å
94	R	97.2	Very high	93.4	Very high	46 Å²	46	36.5 Å²	36.5	17%	0.174	20%	0.198	C	C	.	.	H	α-helix	trans	-56.5	-49.4	174.2	-178.2	177.9	-64.4	121.5	-8.8	111.8	E66 E73 C90 Q91 A96 G97 N98	E66-R94 WeakPolarHBondContact OE1-CG 3.28Å; E66-R94 IonicContact OE1-NE 3.1Å; E66-R94 IonicContact OE2-NE 3.71Å; E66-R94 PolarHBondContact OE2-NE 3.13Å; E73-R94 VanDerWaalsContact CD-NH2 3.32Å; E73-R94 IonicContact OE1-CZ 2.69Å; E73-R94 IonicContact OE1-NH1 2.7Å; E73-R94 PolarHBondContact OE1-NH1 3Å; E73-R94 IonicContact OE1-NH2 3.12Å; E73-R94 PolarHBondContact OE1-NH2 2.86Å; E73-R94 IonicContact OE2-NH2 2.96Å; E73-R94 PolarHBondContact OE2-NH2 3.04Å; C90-R94 WeakPolarHBondContact O-CB 3.48Å; C90-R94 PolarHBondContact O-N 3.48Å; Q91-R94 PolarHBondContact O-N 2.75Å; R94-A96 VanDerWaalsContact C-N 3.3Å; R94-A96 PolarHBondContact O-N 2.92Å; R94-G97 PolarHBondContact O-N 3.41Å; R94-N98 WeakPolarHBondContact O-CB 3.22Å; R94-N98 VanDerWaalsContact O-CG 3.26Å; R94-N98 PolarHBondContact O-N 3.09Å; R94-N98 PolarHBondContact O-ND2 3.12Å
95	C	96.4	Very high	92.5	Very high	68 Å²	68	35 Å²	35	46%	0.459	19%	0.19	S	C	.	.	H	α-helix	trans	-57.4	-43.4	176.4	-69.9	0	0	0	0	112	Q91 E92 A93 A99	Q91-C95 WeakPolarHBondContact O-CB 2.98Å; Q91-C95 PolarHBondContact O-N 3.36Å; Q91-C95 PolarHBondContact O-SG 2.9Å; E92-C95 PolarHBondContact O-N 3.25Å; A93-C95 PolarHBondContact O-N 3.15Å; C95-A99 WeakPolarHBondContact O-CB 3.45Å; C95-A99 PolarHBondContact O-N 2.96Å
96	A	94.1	Very high	91.2	Very high	3 Å²	3	38.6 Å²	38.6	3%	0.025	20%	0.204	C	C	.	.	H	α-helix	trans	-67.3	-43.1	178.8	0	0	0	0	0	112.5	E92 A93 R94 A99 I100 Q128 L129	E92-A96 WeakPolarHBondContact O-CB 3.38Å; E92-A96 PolarHBondContact O-N 3.31Å; A93-A96 PolarHBondContact O-N 3.33Å; R94-A96 VanDerWaalsContact C-N 3.3Å; R94-A96 PolarHBondContact O-N 2.92Å; A96-A99 PolarHBondContact O-N 3.18Å; A96-I100 WeakPolarHBondContact O-CG1 3.38Å; A96-I100 PolarHBondContact O-N 3.48Å; A96-Q128 HydrophobicContact CB-CB 4.15Å; A96-Q128 HydrophobicContact CB-CG 4.04Å; A96-L129 HydrophobicContact CB-CB 3.78Å; A96-L129 HydrophobicContact CB-CD1 4.25Å
97	G	93.3	Very high	89.2	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.2	-44.5	174.4	0	0	0	0	0	112.5	A93 R94 A99 I100 A101	A93-G97 PolarHBondContact O-N 3.14Å; R94-G97 PolarHBondContact O-N 3.41Å; G97-A99 PolarHBondContact O-N 3.37Å; G97-I100 PolarHBondContact O-N 2.67Å; G97-A101 PolarHBondContact O-N 3.37Å
98	N	94.4	Very high	87	Confident	62 Å²	62	42 Å²	42	33%	0.332	24%	0.236	S	C	.	.	H	α-helix	trans	-63.3	-40.4	175.3	-71.5	-22.8	0	0	0	112.2	Q62 R94 A101 S102	Q62-N98 PolarHBondContact NE2-OD1 3.43Å; R94-N98 WeakPolarHBondContact O-CB 3.22Å; R94-N98 VanDerWaalsContact O-CG 3.26Å; R94-N98 PolarHBondContact O-N 3.09Å; R94-N98 PolarHBondContact O-ND2 3.12Å; N98-A101 PolarHBondContact O-N 3.11Å; N98-S102 WeakPolarHBondContact O-CB 3.37Å; N98-S102 PolarHBondContact O-N 2.87Å
99	A	92.7	Very high	84.6	Confident	37 Å²	37	40.2 Å²	40.2	31%	0.306	24%	0.24	S	C	.	.	H	α-helix	trans	-62.7	-42.2	175.9	0	0	0	0	0	111.7	C95 A96 G97 S102 L103 A125	C95-A99 WeakPolarHBondContact O-CB 3.45Å; C95-A99 PolarHBondContact O-N 2.96Å; A96-A99 PolarHBondContact O-N 3.18Å; G97-A99 PolarHBondContact O-N 3.37Å; A99-S102 PolarHBondContact O-N 2.95Å; A99-L103 WeakPolarHBondContact O-CB 3.24Å; A99-L103 WeakPolarHBondContact O-CD1 3.42Å; A99-L103 WeakPolarHBondContact O-CG 3.31Å; A99-L103 PolarHBondContact O-N 3.33Å; A99-A125 HydrophobicContact CB-CB 3.91Å
100	I	89.1	Confident	82.2	Confident	4 Å²	4	47.8 Å²	47.8	2%	0.021	28%	0.28	C	S	.	.	H	α-helix	trans	-62.8	-45.3	176.5	-67.1	164.8	0	0	0	110.9	V61 A96 G97 L103 S104 L122 A125 L129	V61-I100 HydrophobicContact CB-CG2 4.49Å; V61-I100 HydrophobicContact CG1-CD1 4.16Å; V61-I100 HydrophobicContact CG1-CG2 4.3Å; A96-I100 WeakPolarHBondContact O-CG1 3.38Å; A96-I100 PolarHBondContact O-N 3.48Å; G97-I100 PolarHBondContact O-N 2.67Å; I100-L103 PolarHBondContact O-N 2.73Å; I100-S104 WeakPolarHBondContact O-CB 3.34Å; I100-S104 PolarHBondContact O-N 3.22Å; I100-S104 PolarHBondContact O-OG 2.98Å; I100-L122 HydrophobicContact CG1-CD1 4.32Å; I100-L122 HydrophobicContact CG2-CD1 4.3Å; I100-A125 HydrophobicContact CG1-CB 3.88Å; I100-L129 HydrophobicContact CD1-CB 4.26Å; I100-L129 HydrophobicContact CD1-CD2 3.71Å
101	A	88.8	Confident	79.5	Confident	4 Å²	4	52.5 Å²	52.5	3%	0.033	31%	0.314	C	S	.	.	H	α-helix	trans	-62.8	-43.1	176.6	0	0	0	0	0	112.4	Q62 G97 N98 S104 S105	Q62-A101 HydrophobicContact CB-CB 4.02Å; Q62-A101 HydrophobicContact CG-CB 4.45Å; G97-A101 PolarHBondContact O-N 3.37Å; N98-A101 PolarHBondContact O-N 3.11Å; A101-S104 PolarHBondContact O-N 3.45Å; A101-S105 PolarHBondContact O-N 3.27Å; A101-S105 PolarHBondContact O-OG 2.75Å
102	S	89.2	Confident	76.8	Confident	44 Å²	44	52.9 Å²	52.9	31%	0.308	33%	0.326	S	S	.	.	H	α-helix	trans	-64	-44	177.4	-173.6	0	0	0	0	112.6	N98 A99 S104 S105 K106	N98-S102 WeakPolarHBondContact O-CB 3.37Å; N98-S102 PolarHBondContact O-N 2.87Å; A99-S102 PolarHBondContact O-N 2.95Å; S102-S104 VanDerWaalsContact C-N 3.25Å; S102-S104 PolarHBondContact O-N 3.11Å; S102-S105 PolarHBondContact O-N 3.12Å; S102-S105 PolarHBondContact O-OG 3.4Å; S102-S105 VanDerWaalsContact O-OG 3.06Å; S102-K106 WeakPolarHBondContact O-CB 3.47Å; S102-K106 VanDerWaalsContact O-CG 3.29Å; S102-K106 WeakPolarHBondContact O-CG 3.5Å; S102-K106 PolarHBondContact O-N 2.71Å; S102-K106 VanDerWaalsContact OG-CE 3.31Å; S102-K106 WeakPolarHBondContact OG-CE 3.36Å
103	L	84.4	Confident	74.4	Confident	23 Å²	23	58.2 Å²	58.2	12%	0.12	36%	0.357	C	S	.	.	H	α-helix	trans	-67.6	-29.2	177	-69.7	167.1	0	0	0	111.9	A99 I100 L122 A125	A99-L103 WeakPolarHBondContact O-CB 3.24Å; A99-L103 WeakPolarHBondContact O-CD1 3.42Å; A99-L103 WeakPolarHBondContact O-CG 3.31Å; A99-L103 PolarHBondContact O-N 3.33Å; I100-L103 PolarHBondContact O-N 2.73Å; L103-L122 HydrophobicContact CD1-CB 4.3Å; L103-L122 HydrophobicContact CD1-CD1 4.48Å; L103-A125 HydrophobicContact CD1-CB 4.24Å
104	S	79.7	Confident	72.1	Confident	10 Å²	10	60 Å²	60	7%	0.07	38%	0.375	C	S	.	.	H	α-helix	trans	-73.1	-32.3	175.5	-57.6	0	0	0	0	112.4	V55 I100 A101 S102	V55-S104 VanDerWaalsContact CG2-O 3.3Å; V55-S104 WeakPolarHBondContact CG2-O 3.47Å; I100-S104 WeakPolarHBondContact O-CB 3.34Å; I100-S104 PolarHBondContact O-N 3.22Å; I100-S104 PolarHBondContact O-OG 2.98Å; A101-S104 PolarHBondContact O-N 3.45Å; S102-S104 VanDerWaalsContact C-N 3.25Å; S102-S104 PolarHBondContact O-N 3.11Å
105	S	76	Confident	69.9	Low	46 Å²	46	62.3 Å²	62.3	32%	0.322	40%	0.399	S	S	.	.	H	α-helix	trans	-87.4	-30.3	-178.7	63.6	0	0	0	0	114.6	A101 S102 S107 V108	A101-S105 PolarHBondContact O-N 3.27Å; A101-S105 PolarHBondContact O-OG 2.75Å; S102-S105 PolarHBondContact O-N 3.12Å; S102-S105 PolarHBondContact O-OG 3.4Å; S102-S105 VanDerWaalsContact O-OG 3.06Å; S105-S107 PolarHBondContact O-N 3.03Å; S105-S107 VanDerWaalsContact O-N 3.13Å; S105-V108 PolarHBondContact O-N 3.41Å
106	K	67	Low	67.8	Low	132 Å²	132	65.6 Å²	65.6	57%	0.574	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-63.7	-16.3	-179.8	-78.4	173.5	177.9	175.6	0	114.7	S102 V108 G109	S102-K106 WeakPolarHBondContact O-CB 3.47Å; S102-K106 VanDerWaalsContact O-CG 3.29Å; S102-K106 WeakPolarHBondContact O-CG 3.5Å; S102-K106 PolarHBondContact O-N 2.71Å; S102-K106 VanDerWaalsContact OG-CE 3.31Å; S102-K106 WeakPolarHBondContact OG-CE 3.36Å; K106-V108 PolarHBondContact O-N 2.9Å; K106-V108 VanDerWaalsContact O-N 3.13Å; K106-G109 PolarHBondContact O-N 3.13Å
107	S	55.4	Low	65.8	Low	46 Å²	46	69.1 Å²	69.1	32%	0.322	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-71.5	-3.6	-179.7	-161.2	0	0	0	0	114.8	S105	S105-S107 PolarHBondContact O-N 3.03Å; S105-S107 VanDerWaalsContact O-N 3.13Å
108	V	50.1	Low	64.7	Low	108 Å²	108	71.3 Å²	71.3	66%	0.655	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-97.2	-15.4	-178.5	-175	0	0	0	0	112.7	V55 S105 K106	V55-V108 HydrophobicContact CG2-CG2 4.48Å; S105-V108 PolarHBondContact O-N 3.41Å; K106-V108 PolarHBondContact O-N 2.9Å; K106-V108 VanDerWaalsContact O-N 3.13Å
109	G	46.6	Very low	63.5	Low	59 Å²	59	73.5 Å²	73.5	61%	0.608	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	-39.4	-163.2	0	0	0	0	0	118.2	K106	K106-G109 PolarHBondContact O-N 3.13Å
110	D	45.4	Very low	62.8	Low	159 Å²	159	76.8 Å²	76.8	85%	0.85	46%	0.459	S	S	*	.			trans	-125.7	97.8	-166.2	-80.4	-37.6	0	0	0	113	S112	D110-S112 PolarHBondContact O-N 3.36Å
111	S	40.5	Very low	62.6	Low	100 Å²	100	82.7 Å²	82.7	70%	0.699	48%	0.482	S	S	*	.			trans	-89.3	83	172.3	-66	0	0	0	0	110.4
112	S	41.4	Very low	62.3	Low	101 Å²	101	83 Å²	83	71%	0.706	48%	0.483	S	S	*	.	S	Bend	trans	-175.4	121.3	146.5	42.5	0	0	0	0	110.3	D110	D110-S112 PolarHBondContact O-N 3.36Å
113	N	45.3	Very low	62	Low	171 Å²	171	82.6 Å²	82.6	91%	0.914	48%	0.478	S	S	*	.	S	Bend	trans	83.3	7.3	169.3	-57.6	-14.4	0	0	0	121.7
114	G	46.3	Very low	62.1	Low	37 Å²	37	90.3 Å²	90.3	38%	0.381	51%	0.506	S	S	.	.			trans	-94.2	-6.3	-168.3	0	0	0	0	0	121.2	I116 V117	G114-I116 PolarHBondContact O-N 2.78Å; G114-V117 PolarHBondContact O-N 2.86Å
115	S	52.4	Low	62.6	Low	95 Å²	95	90.3 Å²	90.3	66%	0.664	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-39.5	-159.7	-175.6	0	0	0	0	116.9
116	I	51	Low	63.1	Low	136 Å²	136	88.3 Å²	88.3	70%	0.697	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-30.8	-174	-65	170.2	0	0	0	112.1	G114	G114-I116 PolarHBondContact O-N 2.78Å
117	V	53.6	Low	64.1	Low	77 Å²	77	90.5 Å²	90.5	47%	0.467	50%	0.497	S	S	.	.	H	α-helix	trans	-76.5	-36.9	-168.9	173.5	0	0	0	0	111	G114 R119 Y121	G114-V117 PolarHBondContact O-N 2.86Å; V117-R119 PolarHBondContact O-N 3.13Å; V117-Y121 HydrophobicContact CG1-CD2 3.7Å; V117-Y121 HydrophobicContact CG1-CE2 3.22Å; V117-Y121 WeakPolarHBondContact O-CD2 3.44Å; V117-Y121 PolarHBondContact O-N 3.46Å
118	D	68.7	Low	65.8	Low	46 Å²	46	92 Å²	92	25%	0.246	50%	0.498	C	S	.	.	H	α-helix	trans	-71.5	-26.7	-177.2	-67.5	-29.4	0	0	0	114.2	R38 L122	R38-D118 PolarHBondContact NH1-O 2.98Å; R38-D118 IonicContact NH2-OD2 2.75Å; D118-L122 PolarHBondContact O-N 3Å
119	R	69.4	Low	67.8	Low	109 Å²	109	87 Å²	87	41%	0.411	47%	0.468	S	S	.	.	H	α-helix	trans	-66.2	-49.6	178	179.2	-177.6	174.7	157.5	4	110.7	E39 V117 Y121 L122 V123	E39-R119 VanDerWaalsContact CG-NH1 3.35Å; E39-R119 IonicContact OE1-CZ 3.5Å; E39-R119 IonicContact OE1-NH1 3.13Å; E39-R119 PolarHBondContact OE1-NH1 3.26Å; E39-R119 IonicContact OE1-NH2 3.48Å; E39-R119 PolarHBondContact OE1-NH2 2.96Å; E39-R119 IonicContact OE2-NH2 2.69Å; V117-R119 PolarHBondContact O-N 3.13Å; R119-Y121 VanDerWaalsContact C-N 3.26Å; R119-Y121 PolarHBondContact O-N 3.41Å; R119-L122 PolarHBondContact O-N 3.3Å; R119-L122 VanDerWaalsContact O-N 3.13Å; R119-V123 HydrophobicContact CG-CG2 4.37Å; R119-V123 WeakPolarHBondContact O-CG2 3.46Å; R119-V123 PolarHBondContact O-N 2.94Å
120	N	78.8	Confident	69.9	Low	106 Å²	106	86.4 Å²	86.4	57%	0.567	45%	0.451	S	S	*	.	H	α-helix	trans	-60.5	-39	179.9	-71.3	-24.5	0	0	0	111.3	R124	N120-R124 VanDerWaalsContact O-CB 3.24Å; N120-R124 WeakPolarHBondContact O-CB 3.42Å; N120-R124 PolarHBondContact O-N 3.26Å
121	Y	84.4	Confident	72	Confident	128 Å²	128	81 Å²	81	50%	0.502	42%	0.424	S	S	.	.	H	α-helix	trans	-66.4	-40.9	174.4	-72.9	-58.9	0	0	0	113.1	V117 R119 R124 A125	V117-Y121 HydrophobicContact CG1-CD2 3.7Å; V117-Y121 HydrophobicContact CG1-CE2 3.22Å; V117-Y121 WeakPolarHBondContact O-CD2 3.44Å; V117-Y121 PolarHBondContact O-N 3.46Å; R119-Y121 VanDerWaalsContact C-N 3.26Å; R119-Y121 PolarHBondContact O-N 3.41Å; Y121-R124 PolarHBondContact O-N 3.21Å; Y121-A125 WeakPolarHBondContact O-CB 3.46Å; Y121-A125 PolarHBondContact O-N 3.46Å
122	L	82.8	Confident	74.5	Confident	10 Å²	10	76.2 Å²	76.2	5%	0.052	39%	0.39	C	S	.	.	H	α-helix	trans	-64.9	-50.1	176.7	-178.8	64.8	0	0	0	111.1	L34 R38 I100 L103 D118 R119 R124 A125 T126	L34-L122 HydrophobicContact CD2-CD1 4.17Å; L34-L122 HydrophobicContact CD2-CD2 3.99Å; L34-L122 HydrophobicContact CD2-CG 4.31Å; R38-L122 VanDerWaalsContact CD-CD2 3.42Å; I100-L122 HydrophobicContact CG1-CD1 4.32Å; I100-L122 HydrophobicContact CG2-CD1 4.3Å; L103-L122 HydrophobicContact CD1-CB 4.3Å; L103-L122 HydrophobicContact CD1-CD1 4.48Å; D118-L122 PolarHBondContact O-N 3Å; R119-L122 PolarHBondContact O-N 3.3Å; R119-L122 VanDerWaalsContact O-N 3.13Å; L122-R124 PolarHBondContact O-N 3.21Å; L122-A125 PolarHBondContact O-N 3.36Å; L122-A125 VanDerWaalsContact O-N 3.09Å; L122-T126 WeakPolarHBondContact O-CB 3.45Å; L122-T126 PolarHBondContact O-N 3.08Å; L122-T126 PolarHBondContact O-OG1 3.11Å
123	V	82	Confident	76.9	Confident	35 Å²	35	72 Å²	72	21%	0.212	36%	0.36	C	S	.	.	H	α-helix	trans	-56	-42.6	177.1	172.8	0	0	0	0	110.7	V35 R119 T126 R127	V35-V123 HydrophobicContact CG1-CG2 3.83Å; V35-V123 HydrophobicContact CG2-CG2 4.39Å; R119-V123 HydrophobicContact CG-CG2 4.37Å; R119-V123 WeakPolarHBondContact O-CG2 3.46Å; R119-V123 PolarHBondContact O-N 2.94Å; V123-T126 PolarHBondContact O-N 3.26Å; V123-R127 HydrophobicContact CG1-CG 4.45Å; V123-R127 WeakPolarHBondContact O-CB 3.24Å; V123-R127 VanDerWaalsContact O-CG 3.29Å; V123-R127 WeakPolarHBondContact O-CG 3.38Å; V123-R127 PolarHBondContact O-N 3.29Å
124	R	87.8	Confident	79.1	Confident	186 Å²	186	64.4 Å²	64.4	70%	0.702	32%	0.32	S	S	*	.	H	α-helix	trans	-63.5	-46.4	175.8	-176.8	176.4	175.7	167.3	-1.1	112.1	N120 Y121 L122 T126 R127 Q128	N120-R124 VanDerWaalsContact O-CB 3.24Å; N120-R124 WeakPolarHBondContact O-CB 3.42Å; N120-R124 PolarHBondContact O-N 3.26Å; Y121-R124 PolarHBondContact O-N 3.21Å; L122-R124 PolarHBondContact O-N 3.21Å; R124-T126 VanDerWaalsContact C-N 3.33Å; R124-T126 PolarHBondContact O-N 3.41Å; R124-R127 PolarHBondContact O-N 3.43Å; R124-Q128 WeakPolarHBondContact O-CB 3.16Å; R124-Q128 PolarHBondContact O-N 3.49Å
125	A	89.4	Confident	81.4	Confident	9 Å²	9	64.9 Å²	64.9	7%	0.074	31%	0.31	C	S	.	.	H	α-helix	trans	-62.4	-41.2	178.3	0	0	0	0	0	111.6	A99 I100 L103 Y121 L122 Q128 L129	A99-A125 HydrophobicContact CB-CB 3.91Å; I100-A125 HydrophobicContact CG1-CB 3.88Å; L103-A125 HydrophobicContact CD1-CB 4.24Å; Y121-A125 WeakPolarHBondContact O-CB 3.46Å; Y121-A125 PolarHBondContact O-N 3.46Å; L122-A125 PolarHBondContact O-N 3.36Å; L122-A125 VanDerWaalsContact O-N 3.09Å; A125-Q128 PolarHBondContact O-N 3.35Å; A125-L129 PolarHBondContact O-N 3.29Å
126	T	88	Confident	83.3	Confident	4 Å²	4	60.5 Å²	60.5	3%	0.025	28%	0.28	C	S	.	.	H	α-helix	trans	-71.2	-39.5	179.3	-47.4	0	0	0	0	112.6	I31 L122 V123 R124 Q128 L129 L130	I31-T126 HydrophobicContact CB-CG2 3.69Å; I31-T126 HydrophobicContact CD1-CG2 3.73Å; I31-T126 HydrophobicContact CG1-CG2 3.35Å; I31-T126 HydrophobicContact CG2-CG2 3.25Å; L122-T126 WeakPolarHBondContact O-CB 3.45Å; L122-T126 PolarHBondContact O-N 3.08Å; L122-T126 PolarHBondContact O-OG1 3.11Å; V123-T126 PolarHBondContact O-N 3.26Å; R124-T126 VanDerWaalsContact C-N 3.33Å; R124-T126 PolarHBondContact O-N 3.41Å; T126-Q128 VanDerWaalsContact C-N 3.34Å; T126-L129 WeakPolarHBondContact O-CB 3.42Å; T126-L129 PolarHBondContact O-N 3.08Å; T126-L130 PolarHBondContact O-N 3.49Å
127	R	87.1	Confident	85.3	Confident	179 Å²	179	55.2 Å²	55.2	68%	0.675	25%	0.253	S	S	*	.	H	α-helix	trans	-63.9	-39.7	171.2	-75.6	177.2	179.5	-101.1	1.1	112.1	V123 R124 L129 L130 T131	V123-R127 HydrophobicContact CG1-CG 4.45Å; V123-R127 WeakPolarHBondContact O-CB 3.24Å; V123-R127 VanDerWaalsContact O-CG 3.29Å; V123-R127 WeakPolarHBondContact O-CG 3.38Å; V123-R127 PolarHBondContact O-N 3.29Å; R124-R127 PolarHBondContact O-N 3.43Å; R127-L129 VanDerWaalsContact C-N 3.33Å; R127-L130 PolarHBondContact O-N 2.97Å; R127-T131 PolarHBondContact O-N 2.93Å; R127-T131 PolarHBondContact O-OG1 3.17Å
128	Q	91.1	Very high	87.1	Confident	76 Å²	76	53.2 Å²	53.2	36%	0.355	24%	0.239	S	C	.	.	H	α-helix	trans	-61.2	-45	174.3	-174.6	63.7	26.7	0	0	110.4	E92 A96 R124 A125 T126 L130 T131 S132	E92-Q128 PolarHBondContact OE2-NE2 3.28Å; A96-Q128 HydrophobicContact CB-CB 4.15Å; A96-Q128 HydrophobicContact CB-CG 4.04Å; R124-Q128 WeakPolarHBondContact O-CB 3.16Å; R124-Q128 PolarHBondContact O-N 3.49Å; A125-Q128 PolarHBondContact O-N 3.35Å; T126-Q128 VanDerWaalsContact C-N 3.34Å; Q128-L130 PolarHBondContact O-N 3.49Å; Q128-T131 PolarHBondContact O-N 2.9Å; Q128-S132 PolarHBondContact O-N 3.5Å; Q128-S132 PolarHBondContact O-OG 2.71Å
129	L	92.2	Very high	88.3	Confident	5 Å²	5	51.2 Å²	51.2	3%	0.026	23%	0.228	C	C	.	.	H	α-helix	trans	-58.7	-45.6	177.4	-179.1	61.9	0	0	0	111.9	V61 V65 A93 A96 I100 A125 T126 R127 T131 S132 V133	V61-L129 HydrophobicContact CG1-CD2 3.98Å; V65-L129 HydrophobicContact CG1-CD1 4.36Å; V65-L129 HydrophobicContact CG2-CD1 3.59Å; V65-L129 HydrophobicContact CG2-CD2 4.11Å; V65-L129 HydrophobicContact CG2-CG 4.49Å; A93-L129 HydrophobicContact CB-CD1 4.44Å; A96-L129 HydrophobicContact CB-CB 3.78Å; A96-L129 HydrophobicContact CB-CD1 4.25Å; I100-L129 HydrophobicContact CD1-CB 4.26Å; I100-L129 HydrophobicContact CD1-CD2 3.71Å; A125-L129 PolarHBondContact O-N 3.29Å; T126-L129 WeakPolarHBondContact O-CB 3.42Å; T126-L129 PolarHBondContact O-N 3.08Å; R127-L129 VanDerWaalsContact C-N 3.33Å; L129-T131 VanDerWaalsContact C-N 3.31Å; L129-T131 PolarHBondContact O-N 3Å; L129-S132 WeakPolarHBondContact CA-OG 3.27Å; L129-S132 PolarHBondContact O-N 3.39Å; L129-S132 PolarHBondContact O-OG 3.22Å; L129-V133 HydrophobicContact CD1-CG2 3.86Å; L129-V133 HydrophobicContact CG-CG2 4.27Å; L129-V133 WeakPolarHBondContact O-CB 3.19Å; L129-V133 VanDerWaalsContact O-CG2 3.23Å; L129-V133 WeakPolarHBondContact O-CG2 3.45Å; L129-V133 PolarHBondContact O-N 3Å
130	L	89.7	Confident	89.4	Confident	45 Å²	45	47.2 Å²	47.2	24%	0.236	22%	0.219	C	C	.	.	H	α-helix	trans	-60.8	-43.1	177.1	-178.3	63.4	0	0	0	111.5	L24 L27 V28 I31 T126 R127 Q128 T134	L24-L130 HydrophobicContact CD2-CD1 4.14Å; L27-L130 HydrophobicContact CD2-CD1 4.11Å; L27-L130 HydrophobicContact CG-CD1 4.45Å; V28-L130 HydrophobicContact CG2-CD1 3.64Å; V28-L130 HydrophobicContact CG2-CD2 3.94Å; V28-L130 HydrophobicContact CG2-CG 4.47Å; I31-L130 HydrophobicContact CD1-CB 4.03Å; I31-L130 HydrophobicContact CD1-CD1 4.45Å; T126-L130 PolarHBondContact O-N 3.49Å; R127-L130 PolarHBondContact O-N 2.97Å; Q128-L130 PolarHBondContact O-N 3.49Å; L130-T134 VanDerWaalsContact O-CB 3.3Å; L130-T134 WeakPolarHBondContact O-CB 3.47Å; L130-T134 PolarHBondContact O-N 3.38Å; L130-T134 PolarHBondContact O-OG1 2.83Å
131	T	90.2	Very high	90	Very high	46 Å²	46	43.1 Å²	43.1	28%	0.282	20%	0.197	S	C	.	.	H	α-helix	trans	-64.2	-47.7	179.5	-53.7	0	0	0	0	111.1	P10 R127 Q128 L129 T134 R135	P10-T131 HydrophobicContact CB-CG2 4.1Å; R127-T131 PolarHBondContact O-N 2.93Å; R127-T131 PolarHBondContact O-OG1 3.17Å; Q128-T131 PolarHBondContact O-N 2.9Å; L129-T131 VanDerWaalsContact C-N 3.31Å; L129-T131 PolarHBondContact O-N 3Å; T131-T134 PolarHBondContact O-N 3.24Å; T131-R135 WeakPolarHBondContact O-CG 3.31Å; T131-R135 PolarHBondContact O-N 3.06Å
132	S	92.6	Very high	90.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-68.3	-40.9	-179.8	56.6	0	0	0	0	112.5	A93 Q128 L129 T134 R135 V136	A93-S132 WeakPolarHBondContact CA-OG 3.27Å; A93-S132 WeakPolarHBondContact CB-OG 3.36Å; A93-S132 PolarHBondContact N-OG 3.1Å; Q128-S132 PolarHBondContact O-N 3.5Å; Q128-S132 PolarHBondContact O-OG 2.71Å; L129-S132 WeakPolarHBondContact CA-OG 3.27Å; L129-S132 PolarHBondContact O-N 3.39Å; L129-S132 PolarHBondContact O-OG 3.22Å; S132-T134 VanDerWaalsContact C-N 3.34Å; S132-T134 PolarHBondContact O-N 3.4Å; S132-R135 WeakPolarHBondContact O-CB 3.42Å; S132-R135 PolarHBondContact O-N 3.36Å; S132-V136 WeakPolarHBondContact O-CG2 3.46Å; S132-V136 PolarHBondContact O-N 3.11Å
133	V	93	Very high	90.7	Very high	12 Å²	12	41.4 Å²	41.4	7%	0.073	19%	0.189	C	C	.	.	H	α-helix	trans	-62.6	-43.6	174.6	169	0	0	0	0	110.6	L24 L27 F68 L129 R135 V136 L137	L24-V133 HydrophobicContact CD2-CG1 4.18Å; L27-V133 HydrophobicContact CD2-CB 4.03Å; L27-V133 HydrophobicContact CD2-CG1 3.72Å; L27-V133 HydrophobicContact CD2-CG2 4.22Å; F68-V133 HydrophobicContact CD1-CG2 4.33Å; F68-V133 HydrophobicContact CE1-CB 4.28Å; F68-V133 HydrophobicContact CE1-CG1 4.15Å; F68-V133 HydrophobicContact CE1-CG2 3.99Å; F68-V133 HydrophobicContact CE2-CG1 4.28Å; F68-V133 HydrophobicContact CZ-CB 4.37Å; F68-V133 HydrophobicContact CZ-CG1 3.79Å; F68-V133 HydrophobicContact CZ-CG2 4.47Å; L129-V133 HydrophobicContact CD1-CG2 3.86Å; L129-V133 HydrophobicContact CG-CG2 4.27Å; L129-V133 WeakPolarHBondContact O-CB 3.19Å; L129-V133 VanDerWaalsContact O-CG2 3.23Å; L129-V133 WeakPolarHBondContact O-CG2 3.45Å; L129-V133 PolarHBondContact O-N 3Å; V133-R135 VanDerWaalsContact C-N 3.31Å; V133-R135 PolarHBondContact O-N 3.47Å; V133-V136 PolarHBondContact O-N 3.37Å; V133-L137 HydrophobicContact CG1-CD1 4.1Å; V133-L137 HydrophobicContact CG1-CG 4.44Å; V133-L137 WeakPolarHBondContact O-CG 3.47Å; V133-L137 PolarHBondContact O-N 3.18Å
134	T	91.4	Very high	91.2	Very high	11 Å²	11	43.8 Å²	43.8	7%	0.067	20%	0.201	C	C	.	.	H	α-helix	trans	-59.3	-43.6	175.1	-56.7	0	0	0	0	111.1	L13 I15 L24 L130 T131 S132 L137 L138	L13-T134 HydrophobicContact CB-CG2 4.27Å; L13-T134 HydrophobicContact CD1-CG2 3.88Å; L13-T134 HydrophobicContact CG-CG2 4.5Å; I15-T134 HydrophobicContact CD1-CG2 3.82Å; L24-T134 HydrophobicContact CD1-CG2 3.98Å; L24-T134 WeakPolarHBondContact CD2-OG1 3.36Å; L130-T134 VanDerWaalsContact O-CB 3.3Å; L130-T134 WeakPolarHBondContact O-CB 3.47Å; L130-T134 PolarHBondContact O-N 3.38Å; L130-T134 PolarHBondContact O-OG1 2.83Å; T131-T134 PolarHBondContact O-N 3.24Å; S132-T134 VanDerWaalsContact C-N 3.34Å; S132-T134 PolarHBondContact O-N 3.4Å; T134-L137 PolarHBondContact O-N 3.28Å; T134-L138 HydrophobicContact CG2-CD1 3.99Å; T134-L138 HydrophobicContact CG2-CG 4.35Å; T134-L138 VanDerWaalsContact O-CG 3.31Å; T134-L138 WeakPolarHBondContact O-CG 3.44Å; T134-L138 PolarHBondContact O-N 3Å
135	R	93.1	Very high	91.4	Very high	47 Å²	47	36 Å²	36	18%	0.177	17%	0.174	C	C	.	.	H	α-helix	trans	-59.9	-46.3	176.1	-74.9	174.8	63	-175.1	-1.3	112.5	A89 E92 T131 S132 V133 L137 L138 L139	A89-R135 HydrophobicContact CB-CB 3.91Å; E92-R135 IonicContact OE1-CZ 3.9Å; E92-R135 IonicContact OE1-NH1 2.81Å; E92-R135 PolarHBondContact OE1-NH1 3.27Å; E92-R135 IonicContact OE1-NH2 2.73Å; E92-R135 IonicContact OE2-CZ 3.92Å; E92-R135 IonicContact OE2-NH1 3.79Å; E92-R135 PolarHBondContact OE2-NH1 3.19Å; T131-R135 WeakPolarHBondContact O-CG 3.31Å; T131-R135 PolarHBondContact O-N 3.06Å; S132-R135 WeakPolarHBondContact O-CB 3.42Å; S132-R135 PolarHBondContact O-N 3.36Å; V133-R135 VanDerWaalsContact C-N 3.31Å; V133-R135 PolarHBondContact O-N 3.47Å; R135-L137 VanDerWaalsContact C-N 3.34Å; R135-L137 PolarHBondContact O-N 2.94Å; R135-L138 PolarHBondContact O-N 3.28Å; R135-L139 VanDerWaalsContact O-CG 3.31Å; R135-L139 WeakPolarHBondContact O-CG 3.37Å; R135-L139 PolarHBondContact O-N 2.92Å
136	V	93.9	Very high	91.5	Very high	4 Å²	4	38.9 Å²	38.9	2%	0.024	18%	0.184	C	C	.	.	H	α-helix	trans	-59.2	-45.6	176.6	171.1	0	0	0	0	110.9	F68 M86 A89 S132 V133 L138 L139 A140	F68-V136 HydrophobicContact CE1-CB 3.6Å; F68-V136 HydrophobicContact CE1-CG1 3.49Å; F68-V136 VanDerWaalsContact CE1-CG1 3.49Å; F68-V136 HydrophobicContact CE1-CG2 3.92Å; F68-V136 HydrophobicContact CE2-CG1 4.34Å; F68-V136 HydrophobicContact CZ-CB 3.64Å; F68-V136 HydrophobicContact CZ-CG1 3.38Å; F68-V136 HydrophobicContact CZ-CG2 4.46Å; M86-V136 HydrophobicContact SD-CB 4.36Å; M86-V136 HydrophobicContact SD-CG1 3.85Å; M86-V136 HydrophobicContact SD-CG2 4.32Å; A89-V136 HydrophobicContact CB-CG2 3.67Å; S132-V136 WeakPolarHBondContact O-CG2 3.46Å; S132-V136 PolarHBondContact O-N 3.11Å; V133-V136 PolarHBondContact O-N 3.37Å; V136-L138 PolarHBondContact O-N 2.87Å; V136-L139 PolarHBondContact O-N 3.42Å; V136-A140 PolarHBondContact O-N 2.9Å
137	L	93.1	Very high	91.8	Very high	25 Å²	25	42.4 Å²	42.4	13%	0.131	20%	0.201	C	C	.	.	H	α-helix	trans	-63.6	-39.6	179	-68.9	175.4	0	0	0	112.8	V20 T23 L24 F68 V133 T134 R135 A140 D141	V20-L137 HydrophobicContact CG1-CB 4.03Å; V20-L137 HydrophobicContact CG1-CD1 4.21Å; V20-L137 HydrophobicContact CG2-CB 4.28Å; T23-L137 HydrophobicContact CG2-CD1 3.8Å; T23-L137 HydrophobicContact CG2-CD2 4.19Å; L24-L137 HydrophobicContact CD2-CD1 3.76Å; L24-L137 HydrophobicContact CG-CD1 3.87Å; F68-L137 HydrophobicContact CE2-CD2 3.98Å; F68-L137 HydrophobicContact CE2-CG 4.36Å; F68-L137 HydrophobicContact CZ-CD2 4.24Å; F68-L137 HydrophobicContact CZ-CG 4.19Å; V133-L137 HydrophobicContact CG1-CD1 4.1Å; V133-L137 HydrophobicContact CG1-CG 4.44Å; V133-L137 WeakPolarHBondContact O-CG 3.47Å; V133-L137 PolarHBondContact O-N 3.18Å; T134-L137 PolarHBondContact O-N 3.28Å; R135-L137 VanDerWaalsContact C-N 3.34Å; R135-L137 PolarHBondContact O-N 2.94Å; L137-A140 PolarHBondContact O-N 3.37Å; L137-D141 PolarHBondContact O-N 3.28Å
138	L	91.3	Very high	92.2	Very high	35 Å²	35	34.2 Å²	34.2	18%	0.183	17%	0.17	C	C	.	.	H	α-helix	trans	-70.8	-34.2	176.8	-68.1	173.5	0	0	0	112.6	L8 L13 I15 T134 R135 V136 D141 R142	L8-L138 HydrophobicContact CD2-CD1 4.13Å; L13-L138 HydrophobicContact CB-CD1 4.17Å; L13-L138 HydrophobicContact CD2-CD1 3.26Å; L13-L138 HydrophobicContact CG-CD1 4.2Å; I15-L138 HydrophobicContact CD1-CD2 4.26Å; T134-L138 HydrophobicContact CG2-CD1 3.99Å; T134-L138 HydrophobicContact CG2-CG 4.35Å; T134-L138 VanDerWaalsContact O-CG 3.31Å; T134-L138 WeakPolarHBondContact O-CG 3.44Å; T134-L138 PolarHBondContact O-N 3Å; R135-L138 PolarHBondContact O-N 3.28Å; V136-L138 PolarHBondContact O-N 2.87Å; L138-D141 PolarHBondContact O-N 2.82Å; L138-R142 PolarHBondContact O-N 2.81Å
139	L	92.4	Very high	92.2	Very high	4 Å²	4	31.7 Å²	31.7	2%	0.021	16%	0.159	C	C	.	.	H	α-helix	trans	-67.2	-40.2	173	-71.7	168.7	0	0	0	111.3	E85 M86 A89 R135 V136 R142 V143	E85-L139 HydrophobicContact CB-CD1 3.95Å; E85-L139 HydrophobicContact CB-CD2 3.84Å; E85-L139 WeakPolarHBondContact O-CD1 3.49Å; M86-L139 HydrophobicContact CB-CD1 4.41Å; M86-L139 HydrophobicContact CE-CB 3.63Å; M86-L139 HydrophobicContact SD-CB 4.32Å; M86-L139 HydrophobicContact SD-CD1 4.42Å; A89-L139 HydrophobicContact CB-CD1 4.06Å; R135-L139 VanDerWaalsContact O-CG 3.31Å; R135-L139 WeakPolarHBondContact O-CG 3.37Å; R135-L139 PolarHBondContact O-N 2.92Å; V136-L139 PolarHBondContact O-N 3.42Å; L139-R142 WeakPolarHBondContact O-CB 3.17Å; L139-R142 PolarHBondContact O-N 3.31Å; L139-V143 PolarHBondContact O-N 2.91Å
140	A	92.7	Very high	92.3	Very high	25 Å²	25	34.4 Å²	34.4	21%	0.207	18%	0.178	C	C	.	.	H	α-helix	trans	-62.9	-40.8	171.9	0	0	0	0	0	111.8	I75 M86 V136 L137 R142 V143 L144	I75-A140 HydrophobicContact CD1-CB 4.34Å; M86-A140 HydrophobicContact CE-CB 4.49Å; V136-A140 PolarHBondContact O-N 2.9Å; L137-A140 PolarHBondContact O-N 3.37Å; A140-R142 VanDerWaalsContact C-N 3.31Å; A140-R142 PolarHBondContact O-N 2.83Å; A140-V143 WeakPolarHBondContact O-CB 3.47Å; A140-V143 PolarHBondContact O-N 3.38Å; A140-V143 VanDerWaalsContact O-N 3.14Å; A140-L144 PolarHBondContact O-N 3.05Å
141	D	92.2	Very high	92.6	Very high	19 Å²	19	32.4 Å²	32.4	10%	0.102	17%	0.168	C	C	.	.	H	α-helix	trans	-61	-39.7	174	-167.5	80.2	0	0	0	112.2	T17 L137 L138 V143 L144 V145 R192	T17-D141 WeakPolarHBondContact CG2-OD1 3.49Å; L137-D141 PolarHBondContact O-N 3.28Å; L138-D141 PolarHBondContact O-N 2.82Å; D141-V143 PolarHBondContact O-N 2.89Å; D141-L144 WeakPolarHBondContact O-CB 2.69Å; D141-L144 PolarHBondContact O-N 3.22Å; D141-V145 PolarHBondContact O-N 3.44Å; D141-R192 VanDerWaalsContact CG-NH1 3.35Å; D141-R192 IonicContact OD1-CZ 2.94Å; D141-R192 IonicContact OD1-NH1 3.05Å; D141-R192 PolarHBondContact OD1-NH1 3.36Å; D141-R192 IonicContact OD1-NH2 3.78Å; D141-R192 IonicContact OD2-CZ 3.24Å; D141-R192 IonicContact OD2-NH1 2.83Å; D141-R192 PolarHBondContact OD2-NH1 3.09Å; D141-R192 IonicContact OD2-NH2 2.73Å; D141-R192 PolarHBondContact OD2-NH2 3.07Å
142	R	90.5	Very high	92.8	Very high	93 Å²	93	30.2 Å²	30.2	35%	0.351	15%	0.154	S	C	.	.	H	α-helix	trans	-60.5	-32.2	175.4	-172.7	178.5	179.2	-167.3	-3.8	112.5	E85 L138 L139 A140 K146	E85-R142 IonicContact OE1-NH1 3.69Å; E85-R142 PolarHBondContact OE1-NH1 2.86Å; E85-R142 IonicContact OE2-NH1 3.71Å; L138-R142 PolarHBondContact O-N 2.81Å; L139-R142 WeakPolarHBondContact O-CB 3.17Å; L139-R142 PolarHBondContact O-N 3.31Å; A140-R142 VanDerWaalsContact C-N 3.31Å; A140-R142 PolarHBondContact O-N 2.83Å; R142-K146 WeakPolarHBondContact O-CG 3.48Å; R142-K146 PolarHBondContact O-N 3.5Å
143	V	91.9	Very high	92.9	Very high	9 Å²	9	33.5 Å²	33.5	6%	0.055	17%	0.172	C	C	.	.	H	α-helix	trans	-64.1	-48.4	172	174.8	0	0	0	0	110.6	I75 H79 I82 L139 A140 D141 V145 K146 Q147	I75-V143 HydrophobicContact CG2-CG2 4.06Å; H79-V143 HydrophobicContact CB-CG2 4.35Å; H79-V143 VanDerWaalsContact CD2-CG1 3.41Å; H79-V143 WeakPolarHBondContact CD2-CG1 3.32Å; H79-V143 WeakPolarHBondContact NE2-CG1 3.42Å; I82-V143 HydrophobicContact CD1-CG2 3.26Å; I82-V143 HydrophobicContact CG1-CG2 4.07Å; L139-V143 PolarHBondContact O-N 2.91Å; A140-V143 WeakPolarHBondContact O-CB 3.47Å; A140-V143 PolarHBondContact O-N 3.38Å; A140-V143 VanDerWaalsContact O-N 3.14Å; D141-V143 PolarHBondContact O-N 2.89Å; V143-V145 VanDerWaalsContact C-N 3.3Å; V143-V145 PolarHBondContact O-N 2.8Å; V143-K146 WeakPolarHBondContact O-CB 3.39Å; V143-K146 PolarHBondContact O-N 3.36Å; V143-K146 VanDerWaalsContact O-N 3.09Å; V143-Q147 HydrophobicContact CG1-CG 4.4Å; V143-Q147 WeakPolarHBondContact O-CG 3.45Å; V143-Q147 PolarHBondContact O-N 3.37Å
144	L	92.4	Very high	93	Very high	85 Å²	85	37.9 Å²	37.9	45%	0.445	19%	0.19	S	C	.	.	H	α-helix	trans	-59.5	-42.6	178.6	-62.9	176.3	0	0	0	111.4	A140 D141 K146 Q147 I148	A140-L144 PolarHBondContact O-N 3.05Å; D141-L144 WeakPolarHBondContact O-CB 2.69Å; D141-L144 PolarHBondContact O-N 3.22Å; L144-K146 PolarHBondContact O-N 2.89Å; L144-Q147 PolarHBondContact O-N 3.26Å; L144-I148 WeakPolarHBondContact O-CG1 3.33Å; L144-I148 PolarHBondContact O-N 3.05Å
145	V	92.2	Very high	93.2	Very high	23 Å²	23	37.3 Å²	37.3	14%	0.139	19%	0.187	C	C	.	.	H	α-helix	trans	-54.5	-50.4	172.4	161.5	0	0	0	0	111.1	D141 V143 Q147 I148 I149 V257	D141-V145 PolarHBondContact O-N 3.44Å; V143-V145 VanDerWaalsContact C-N 3.3Å; V143-V145 PolarHBondContact O-N 2.8Å; V145-Q147 VanDerWaalsContact C-N 3.34Å; V145-Q147 PolarHBondContact O-N 3.38Å; V145-I148 PolarHBondContact O-N 2.82Å; V145-I149 WeakPolarHBondContact O-CG1 3.45Å; V145-I149 PolarHBondContact O-N 2.86Å; V145-V257 HydrophobicContact CB-CG1 3.86Å; V145-V257 HydrophobicContact CG1-CG1 3.66Å; V145-V257 HydrophobicContact CG2-CG1 3.76Å
146	K	90.9	Very high	93.3	Very high	69 Å²	69	35.7 Å²	35.7	30%	0.3	18%	0.183	S	C	.	.	H	α-helix	trans	-63.1	-38	179.1	-77.5	-178.7	161.2	-164.3	0	113.3	E81 R142 V143 L144 I148 I149 C150	E81-K146 VanDerWaalsContact CD-NZ 3.32Å; E81-K146 VanDerWaalsContact OE1-CD 3.24Å; E81-K146 WeakPolarHBondContact OE1-CD 3.12Å; E81-K146 IonicContact OE1-NZ 2.69Å; E81-K146 PolarHBondContact OE1-NZ 3.3Å; R142-K146 WeakPolarHBondContact O-CG 3.48Å; R142-K146 PolarHBondContact O-N 3.5Å; V143-K146 WeakPolarHBondContact O-CB 3.39Å; V143-K146 PolarHBondContact O-N 3.36Å; V143-K146 VanDerWaalsContact O-N 3.09Å; L144-K146 PolarHBondContact O-N 2.89Å; K146-I148 VanDerWaalsContact C-N 3.3Å; K146-I148 PolarHBondContact O-N 3.42Å; K146-I149 PolarHBondContact O-N 3.16Å; K146-C150 VanDerWaalsContact O-CB 3.3Å; K146-C150 WeakPolarHBondContact O-CB 3.44Å; K146-C150 PolarHBondContact O-N 2.84Å
147	Q	93.9	Very high	93.3	Very high	79 Å²	79	41.4 Å²	41.4	37%	0.369	21%	0.208	S	C	.	.	H	α-helix	trans	-63	-38.7	176	-70.3	179	2	0	0	111.6	V143 L144 V145 A151 K188	V143-Q147 HydrophobicContact CG1-CG 4.4Å; V143-Q147 WeakPolarHBondContact O-CG 3.45Å; V143-Q147 PolarHBondContact O-N 3.37Å; L144-Q147 PolarHBondContact O-N 3.26Å; V145-Q147 VanDerWaalsContact C-N 3.34Å; V145-Q147 PolarHBondContact O-N 3.38Å; Q147-A151 PolarHBondContact O-N 2.87Å; Q147-A151 VanDerWaalsContact O-N 3.08Å; Q147-K188 HydrophobicContact CB-CD 4.48Å
148	I	94.9	Very high	93.4	Very high	7 Å²	7	40.2 Å²	40.2	4%	0.036	20%	0.202	C	C	.	.	H	α-helix	trans	-66.7	-46.6	174.9	-61.7	158.4	0	0	0	110.8	L144 V145 K146 C150 A151 E152 L185 K188 T189 R192 I253 V257	L144-I148 WeakPolarHBondContact O-CG1 3.33Å; L144-I148 PolarHBondContact O-N 3.05Å; V145-I148 PolarHBondContact O-N 2.82Å; K146-I148 VanDerWaalsContact C-N 3.3Å; K146-I148 PolarHBondContact O-N 3.42Å; I148-C150 VanDerWaalsContact C-N 3.32Å; I148-C150 PolarHBondContact O-N 2.98Å; I148-A151 PolarHBondContact O-N 2.92Å; I148-E152 PolarHBondContact O-N 3.46Å; I148-L185 HydrophobicContact CG2-CD1 4.29Å; I148-K188 HydrophobicContact CG1-CB 3.77Å; I148-T189 HydrophobicContact CG2-CG2 3.99Å; I148-R192 HydrophobicContact CD1-CB 3.73Å; I148-R192 HydrophobicContact CD1-CG 3.8Å; I148-I253 HydrophobicContact CG2-CG2 4.5Å; I148-V257 HydrophobicContact CB-CG1 4.22Å; I148-V257 HydrophobicContact CB-CG2 4.34Å; I148-V257 HydrophobicContact CD1-CG1 4.05Å; I148-V257 HydrophobicContact CD1-CG2 4.22Å; I148-V257 HydrophobicContact CG2-CG1 4.4Å; I148-V257 HydrophobicContact CG2-CG2 3.68Å
149	I	92.8	Very high	93.5	Very high	22 Å²	22	38.6 Å²	38.6	11%	0.113	19%	0.193	C	C	.	.	H	α-helix	trans	-61.7	-40.8	177.9	-63.3	-61.2	0	0	0	111.1	V145 K146 A151 E152 D153 A254 V257	V145-I149 WeakPolarHBondContact O-CG1 3.45Å; V145-I149 PolarHBondContact O-N 2.86Å; K146-I149 PolarHBondContact O-N 3.16Å; I149-A151 VanDerWaalsContact C-N 3.34Å; I149-A151 PolarHBondContact O-N 3.45Å; I149-E152 WeakPolarHBondContact O-CB 3.27Å; I149-E152 PolarHBondContact O-N 3.33Å; I149-D153 WeakPolarHBondContact O-CB 3.44Å; I149-D153 PolarHBondContact O-N 3.29Å; I149-A254 HydrophobicContact CD1-CB 3.88Å; I149-V257 HydrophobicContact CD1-CB 4.49Å
150	C	93.1	Very high	93.6	Very high	62 Å²	62	41.5 Å²	41.5	42%	0.419	21%	0.214	S	C	.	.	H	α-helix	trans	-63.6	-37.8	175.7	-178.7	0	0	0	0	112.5	K146 I148 K154	K146-C150 VanDerWaalsContact O-CB 3.3Å; K146-C150 WeakPolarHBondContact O-CB 3.44Å; K146-C150 PolarHBondContact O-N 2.84Å; I148-C150 VanDerWaalsContact C-N 3.32Å; I148-C150 PolarHBondContact O-N 2.98Å; C150-K154 WeakPolarHBondContact O-CG 3.18Å; C150-K154 PolarHBondContact O-N 2.78Å; C150-K154 VanDerWaalsContact O-N 3.15Å
151	A	96.4	Very high	93.6	Very high	3 Å²	3	45 Å²	45	3%	0.025	22%	0.224	C	C	.	.	H	α-helix	trans	-66.4	-40	173.4	0	0	0	0	0	111.6	Q147 I148 I149 K154 V155 L185 K188	Q147-A151 PolarHBondContact O-N 2.87Å; Q147-A151 VanDerWaalsContact O-N 3.08Å; I148-A151 PolarHBondContact O-N 2.92Å; I149-A151 VanDerWaalsContact C-N 3.34Å; I149-A151 PolarHBondContact O-N 3.45Å; A151-K154 PolarHBondContact O-N 3.04Å; A151-V155 WeakPolarHBondContact O-CG2 3.37Å; A151-V155 PolarHBondContact O-N 3.44Å; A151-L185 HydrophobicContact CB-CB 4.42Å; A151-L185 HydrophobicContact CB-CD1 4.11Å; A151-K188 HydrophobicContact CB-CD 4.25Å
152	E	95.3	Very high	93.6	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.7	-47.2	174.7	-174.8	-85	126.3	0	0	111.7	I148 I149 K154 V155 A156 L185 L250 F269	I148-E152 PolarHBondContact O-N 3.46Å; I149-E152 WeakPolarHBondContact O-CB 3.27Å; I149-E152 PolarHBondContact O-N 3.33Å; E152-K154 VanDerWaalsContact C-N 3.3Å; E152-K154 PolarHBondContact O-N 3.49Å; E152-V155 WeakPolarHBondContact O-CB 3.29Å; E152-V155 PolarHBondContact O-N 2.86Å; E152-V155 VanDerWaalsContact O-N 3.11Å; E152-A156 PolarHBondContact O-N 3.48Å; E152-L185 HydrophobicContact CB-CD1 4.07Å; E152-L250 HydrophobicContact CG-CB 3.98Å; E152-L250 HydrophobicContact CG-CD2 3.99Å; E152-L250 HydrophobicContact CG-CG 4.48Å; E152-L250 WeakPolarHBondContact OE1-CB 3.06Å; E152-F269 WeakPolarHBondContact OE1-CE1 3.44Å; E152-F269 VanDerWaalsContact OE1-CZ 3.32Å; E152-F269 WeakPolarHBondContact OE1-CZ 3.49Å
153	D	93.1	Very high	93.6	Very high	70 Å²	70	41.9 Å²	41.9	37%	0.374	21%	0.213	S	C	.	.	H	α-helix	trans	-58.1	-40.2	177	-75.8	-33.9	0	0	0	111.8	I149 A156 F157	I149-D153 WeakPolarHBondContact O-CB 3.44Å; I149-D153 PolarHBondContact O-N 3.29Å; D153-A156 PolarHBondContact O-N 2.89Å; D153-F157 VanDerWaalsContact O-CB 3.26Å; D153-F157 WeakPolarHBondContact O-CB 3.48Å; D153-F157 PolarHBondContact O-N 3.17Å
154	K	95.8	Very high	93.4	Very high	103 Å²	103	46.3 Å²	46.3	45%	0.448	24%	0.243	S	C	.	.	H	α-helix	trans	-61.3	-48.6	175	-73.5	173.1	-174.7	177.3	0	111.3	C150 A151 E152 A156 F157 T158 E181	C150-K154 WeakPolarHBondContact O-CG 3.18Å; C150-K154 PolarHBondContact O-N 2.78Å; C150-K154 VanDerWaalsContact O-N 3.15Å; A151-K154 PolarHBondContact O-N 3.04Å; E152-K154 VanDerWaalsContact C-N 3.3Å; E152-K154 PolarHBondContact O-N 3.49Å; K154-A156 PolarHBondContact O-N 2.74Å; K154-F157 PolarHBondContact O-N 2.87Å; K154-T158 PolarHBondContact O-N 3.42Å; K154-T158 PolarHBondContact O-OG1 3.21Å; K154-E181 HydrophobicContact CB-CG 4.36Å
155	V	96.4	Very high	93.2	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-58.9	-48	176.5	169.6	0	0	0	0	110.8	A151 E152 F157 T158 L159 F178 E181 M182 L185 L250	A151-V155 WeakPolarHBondContact O-CG2 3.37Å; A151-V155 PolarHBondContact O-N 3.44Å; E152-V155 WeakPolarHBondContact O-CB 3.29Å; E152-V155 PolarHBondContact O-N 2.86Å; E152-V155 VanDerWaalsContact O-N 3.11Å; V155-F157 VanDerWaalsContact C-N 3.32Å; V155-F157 PolarHBondContact O-N 3.25Å; V155-T158 PolarHBondContact O-N 2.96Å; V155-L159 VanDerWaalsContact O-CB 3.22Å; V155-L159 WeakPolarHBondContact O-CB 3.2Å; V155-L159 PolarHBondContact O-N 3.06Å; V155-F178 HydrophobicContact CG1-CD2 4.26Å; V155-F178 HydrophobicContact CG1-CE2 3.58Å; V155-F178 HydrophobicContact CG1-CZ 4.24Å; V155-E181 HydrophobicContact CG2-CB 3.77Å; V155-M182 HydrophobicContact CB-CE 4.35Å; V155-M182 HydrophobicContact CG1-CE 3.31Å; V155-M182 HydrophobicContact CG2-CE 4.06Å; V155-L185 HydrophobicContact CB-CD2 4.4Å; V155-L185 HydrophobicContact CG2-CB 4.23Å; V155-L185 HydrophobicContact CG2-CD2 4.01Å; V155-L250 HydrophobicContact CB-CD2 4.38Å; V155-L250 HydrophobicContact CG1-CD1 3.95Å; V155-L250 HydrophobicContact CG1-CD2 3.79Å
156	A	93.5	Very high	92.7	Very high	13 Å²	13	47.9 Å²	47.9	11%	0.107	26%	0.257	C	S	.	.	H	α-helix	trans	-61.8	-39.7	179.5	0	0	0	0	0	112.3	E152 D153 K154 S160 L250 F269	E152-A156 PolarHBondContact O-N 3.48Å; D153-A156 PolarHBondContact O-N 2.89Å; K154-A156 PolarHBondContact O-N 2.74Å; A156-S160 PolarHBondContact O-N 3.36Å; A156-S160 PolarHBondContact O-OG 3.49Å; A156-L250 HydrophobicContact CB-CD1 4.06Å; A156-F269 HydrophobicContact CB-CE1 4.18Å
157	F	94.3	Very high	92.6	Very high	123 Å²	123	47 Å²	47	54%	0.539	26%	0.259	S	S	.	.	H	α-helix	trans	-64.1	-48.9	176.5	177.9	-105.3	0	0	0	112	D153 K154 V155 S160 K161	D153-F157 VanDerWaalsContact O-CB 3.26Å; D153-F157 WeakPolarHBondContact O-CB 3.48Å; D153-F157 PolarHBondContact O-N 3.17Å; K154-F157 PolarHBondContact O-N 2.87Å; V155-F157 VanDerWaalsContact C-N 3.32Å; V155-F157 PolarHBondContact O-N 3.25Å; F157-S160 WeakPolarHBondContact O-CB 3.45Å; F157-S160 PolarHBondContact O-N 3.49Å; F157-K161 HydrophobicContact CE1-CD 4.36Å; F157-K161 PolarHBondContact O-N 3.37Å
158	T	94.6	Very high	92.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-68.2	-36.4	178.3	-56.4	0	0	0	0	111.7	K154 V155 S160 K161 L162 Q177 F178 E181	K154-T158 PolarHBondContact O-N 3.42Å; K154-T158 PolarHBondContact O-OG1 3.21Å; V155-T158 PolarHBondContact O-N 2.96Å; T158-S160 VanDerWaalsContact C-N 3.27Å; T158-S160 PolarHBondContact O-N 3.03Å; T158-K161 WeakPolarHBondContact O-CB 3.19Å; T158-K161 PolarHBondContact O-N 2.97Å; T158-K161 VanDerWaalsContact O-N 3.11Å; T158-L162 PolarHBondContact O-N 3.46Å; T158-Q177 HydrophobicContact CG2-CB 4.34Å; T158-Q177 HydrophobicContact CG2-CG 4.19Å; T158-Q177 PolarHBondContact OG1-NE2 2.98Å; T158-F178 HydrophobicContact CG2-CB 3.81Å; T158-E181 WeakPolarHBondContact CB-OE2 3.35Å; T158-E181 PolarHBondContact OG1-OE1 3.27Å; T158-E181 PolarHBondContact OG1-OE2 3.43Å
159	L	94.8	Very high	92.1	Very high	1 Å²	1	51 Å²	51	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-57.5	-40.7	172.5	-174.5	68	0	0	0	111.5	V155 K161 L162 E163 F178 L219 F243 I246 R247 L250	V155-L159 VanDerWaalsContact O-CB 3.22Å; V155-L159 WeakPolarHBondContact O-CB 3.2Å; V155-L159 PolarHBondContact O-N 3.06Å; L159-K161 VanDerWaalsContact C-N 3.29Å; L159-K161 PolarHBondContact O-N 3.27Å; L159-L162 WeakPolarHBondContact O-CB 3.35Å; L159-L162 PolarHBondContact O-N 3.37Å; L159-L162 VanDerWaalsContact O-N 3.13Å; L159-E163 PolarHBondContact O-N 2.81Å; L159-F178 HydrophobicContact CB-CD2 4.36Å; L159-F178 HydrophobicContact CB-CE2 3.98Å; L159-F178 HydrophobicContact CD1-CE2 3.89Å; L159-F178 HydrophobicContact CD1-CZ 4.23Å; L159-F178 HydrophobicContact CG-CE2 4.47Å; L159-L219 HydrophobicContact CD1-CD2 4.41Å; L159-F243 HydrophobicContact CD1-CD1 3.63Å; L159-F243 HydrophobicContact CD1-CE1 3.68Å; L159-F243 HydrophobicContact CD1-CG 4.48Å; L159-F243 HydrophobicContact CG-CD1 3.89Å; L159-F243 HydrophobicContact CG-CE1 4.16Å; L159-F243 WeakPolarHBondContact O-CE1 3.41Å; L159-I246 HydrophobicContact CD1-CD1 4.11Å; L159-I246 HydrophobicContact CD1-CG2 4.13Å; L159-I246 HydrophobicContact CD2-CB 4.03Å; L159-I246 HydrophobicContact CD2-CG2 3.53Å; L159-I246 HydrophobicContact CG-CG2 4.47Å; L159-R247 HydrophobicContact CD2-CG 3.73Å; L159-L250 HydrophobicContact CD2-CD1 4.37Å
160	S	93.2	Very high	92.2	Very high	66 Å²	66	53.3 Å²	53.3	46%	0.462	30%	0.295	S	S	.	.	H	α-helix	trans	-63.8	-34.8	177.6	-59	0	0	0	0	112.4	A156 F157 T158	A156-S160 PolarHBondContact O-N 3.36Å; A156-S160 PolarHBondContact O-OG 3.49Å; F157-S160 WeakPolarHBondContact O-CB 3.45Å; F157-S160 PolarHBondContact O-N 3.49Å; T158-S160 VanDerWaalsContact C-N 3.27Å; T158-S160 PolarHBondContact O-N 3.03Å
161	K	92.6	Very high	92.2	Very high	97 Å²	97	50.3 Å²	50.3	42%	0.422	28%	0.275	S	S	.	.	H	α-helix	trans	-70.3	-35.1	173	-63	-178.3	178.4	179.5	0	112.5	F157 T158 L159 E163 L174	F157-K161 HydrophobicContact CE1-CD 4.36Å; F157-K161 PolarHBondContact O-N 3.37Å; T158-K161 WeakPolarHBondContact O-CB 3.19Å; T158-K161 PolarHBondContact O-N 2.97Å; T158-K161 VanDerWaalsContact O-N 3.11Å; L159-K161 VanDerWaalsContact C-N 3.29Å; L159-K161 PolarHBondContact O-N 3.27Å; K161-E163 PolarHBondContact O-N 3.21Å; K161-L174 HydrophobicContact CB-CD1 4.05Å; K161-L174 HydrophobicContact CB-CD2 3.96Å; K161-L174 HydrophobicContact CD-CD2 4.08Å
162	L	93.3	Very high	92	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-66.5	-16.7	179.6	-85.8	171	0	0	0	114.3	T158 L159 P165 F171 L174 F175 F178 L219 F243	T158-L162 PolarHBondContact O-N 3.46Å; L159-L162 WeakPolarHBondContact O-CB 3.35Å; L159-L162 PolarHBondContact O-N 3.37Å; L159-L162 VanDerWaalsContact O-N 3.13Å; L162-P165 VanDerWaalsContact O-CD 3.29Å; L162-P165 WeakPolarHBondContact O-CD 3.29Å; L162-F171 HydrophobicContact CD2-CD2 3.72Å; L162-F171 HydrophobicContact CD2-CE2 3.73Å; L162-L174 HydrophobicContact CD2-CB 3.49Å; L162-L174 VanDerWaalsContact CD2-CB 3.49Å; L162-L174 HydrophobicContact CG-CB 3.89Å; L162-F175 HydrophobicContact CD2-CB 4.12Å; L162-F178 HydrophobicContact CD1-CB 3.51Å; L162-F178 HydrophobicContact CD1-CD1 4.19Å; L162-F178 HydrophobicContact CD1-CD2 3.88Å; L162-F178 HydrophobicContact CD1-CG 3.59Å; L162-L219 HydrophobicContact CD1-CD2 4.16Å; L162-F243 HydrophobicContact CB-CE1 3.91Å; L162-F243 HydrophobicContact CB-CZ 3.97Å; L162-F243 WeakPolarHBondContact O-CZ 3.27Å
163	E	90.7	Very high	92	Very high	47 Å²	47	60.4 Å²	60.4	22%	0.22	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-31.5	-175.7	-166.1	161.6	-147.1	0	0	112.7	L159 K161 P165 K239 F243 R247	L159-E163 PolarHBondContact O-N 2.81Å; K161-E163 PolarHBondContact O-N 3.21Å; E163-P165 VanDerWaalsContact C-CD 3.48Å; E163-K239 PolarHBondContact O-NZ 3.03Å; E163-F243 VanDerWaalsContact CA-CE1 3.49Å; E163-F243 HydrophobicContact CB-CD1 4.01Å; E163-F243 HydrophobicContact CB-CE1 3.69Å; E163-F243 HydrophobicContact CB-CZ 4.21Å; E163-F243 HydrophobicContact CG-CD1 4.17Å; E163-F243 HydrophobicContact CG-CE1 4.24Å; E163-R247 IonicContact OE1-CZ 3.83Å; E163-R247 IonicContact OE1-NH1 2.8Å; E163-R247 PolarHBondContact OE1-NH1 3Å; E163-R247 IonicContact OE1-NH2 3.83Å; E163-R247 IonicContact OE2-CZ 3.78Å; E163-R247 IonicContact OE2-NH1 3.5Å; E163-R247 PolarHBondContact OE2-NH1 2.95Å; E163-R247 IonicContact OE2-NH2 2.86Å; E163-R247 PolarHBondContact OE2-NH2 3.38Å
164	C	88.1	Confident	92.1	Very high	102 Å²	102	58 Å²	58	69%	0.689	31%	0.311	S	S	*	.	S	Bend	trans	-131.2	55.9	-175.3	-61.6	0	0	0	0	113.4
165	P	86.3	Confident	92.1	Very high	16 Å²	16	55.4 Å²	55.4	10%	0.104	30%	0.3	C	S	.	.			trans	-67.1	139.6	175.6	31.6	-37.3	0	0	0	110.2	L162 E163 S167 F171 L227	L162-P165 VanDerWaalsContact O-CD 3.29Å; L162-P165 WeakPolarHBondContact O-CD 3.29Å; E163-P165 VanDerWaalsContact C-CD 3.48Å; P165-S167 VanDerWaalsContact C-N 3.33Å; P165-F171 HydrophobicContact CB-CB 3.87Å; P165-F171 HydrophobicContact CG-CB 3.99Å; P165-F171 HydrophobicContact CG-CD2 3.99Å; P165-F171 HydrophobicContact CG-CG 4.44Å; P165-L227 HydrophobicContact CG-CD1 4.27Å; P165-L227 HydrophobicContact CG-CD2 4.39Å
166	T	83.3	Confident	92	Very high	126 Å²	126	60.1 Å²	60.1	77%	0.773	33%	0.329	S	S	*	.	S	Bend	trans	-79	-18.3	177.9	66.9	0	0	0	0	112.9	E170	T166-E170 WeakPolarHBondContact CA-OE2 3.38Å; T166-E170 VanDerWaalsContact CB-OE2 3.3Å; T166-E170 WeakPolarHBondContact CB-OE2 3.25Å; T166-E170 PolarHBondContact N-OE2 2.84Å; T166-E170 PolarHBondContact OG1-OE2 3.39Å
167	S	87.4	Confident	92.1	Very high	49 Å²	49	63.6 Å²	63.6	34%	0.343	34%	0.342	S	S	.	.	S	Bend	trans	-153.2	161.4	177.6	68.9	0	0	0	0	111.8	P165 S169 E170 F171	P165-S167 VanDerWaalsContact C-N 3.33Å; S167-S169 VanDerWaalsContact C-N 3.26Å; S167-S169 PolarHBondContact O-N 2.9Å; S167-E170 PolarHBondContact O-N 3.08Å; S167-E170 WeakPolarHBondContact OG-CB 3.3Å; S167-E170 PolarHBondContact OG-N 3Å; S167-E170 VanDerWaalsContact OG-N 3.13Å; S167-F171 PolarHBondContact O-N 3.4Å
168	F	88.4	Confident	92.3	Very high	97 Å²	97	57.7 Å²	57.7	43%	0.425	32%	0.317	S	S	.	.	H	α-helix	trans	-63.6	-32.5	174.1	-171.9	-107.8	0	0	0	112.6	F171 V172 K224 L227	F168-F171 HydrophobicContact CD2-CD1 4.34Å; F168-F171 HydrophobicContact CE2-CD1 4.15Å; F168-F171 WeakPolarHBondContact O-CB 3.48Å; F168-F171 PolarHBondContact O-N 2.9Å; F168-V172 HydrophobicContact CD1-CG2 4.14Å; F168-V172 HydrophobicContact CE1-CG2 3.74Å; F168-V172 HydrophobicContact CE2-CG2 4.44Å; F168-V172 HydrophobicContact CZ-CG2 3.9Å; F168-V172 WeakPolarHBondContact O-CG2 3.37Å; F168-V172 PolarHBondContact O-N 2.92Å; F168-K224 HydrophobicContact CE2-CB 4.16Å; F168-K224 HydrophobicContact CE2-CG 3.99Å; F168-L227 HydrophobicContact CB-CD1 4.49Å; F168-L227 HydrophobicContact CD2-CD1 4.07Å
169	S	91.5	Very high	92.3	Very high	74 Å²	74	59 Å²	59	52%	0.517	33%	0.33	S	S	.	.	H	α-helix	trans	-64.3	-42.5	175.3	-177.7	0	0	0	0	111.7	S167 V172 K173	S167-S169 VanDerWaalsContact C-N 3.26Å; S167-S169 PolarHBondContact O-N 2.9Å; S169-V172 PolarHBondContact O-N 2.89Å; S169-K173 WeakPolarHBondContact O-CG 3.4Å; S169-K173 PolarHBondContact O-N 3.09Å
170	E	93.2	Very high	92.4	Very high	70 Å²	70	61.2 Å²	61.2	33%	0.327	35%	0.353	S	S	.	.	H	α-helix	trans	-63.8	-44.6	173	-176.4	-179.5	-163.2	0	0	111.5	T166 S167 V172 K173 L174	T166-E170 WeakPolarHBondContact CA-OE2 3.38Å; T166-E170 VanDerWaalsContact CB-OE2 3.3Å; T166-E170 WeakPolarHBondContact CB-OE2 3.25Å; T166-E170 PolarHBondContact N-OE2 2.84Å; T166-E170 PolarHBondContact OG1-OE2 3.39Å; S167-E170 PolarHBondContact O-N 3.08Å; S167-E170 WeakPolarHBondContact OG-CB 3.3Å; S167-E170 PolarHBondContact OG-N 3Å; S167-E170 VanDerWaalsContact OG-N 3.13Å; E170-V172 VanDerWaalsContact C-N 3.34Å; E170-V172 PolarHBondContact O-N 3.48Å; E170-K173 PolarHBondContact O-N 3.03Å; E170-L174 HydrophobicContact CG-CD1 3.97Å; E170-L174 HydrophobicContact CG-CG 4.43Å; E170-L174 PolarHBondContact O-N 2.84Å
171	F	93.3	Very high	92.6	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-55.1	-48.1	176.2	175.7	-93.6	0	0	0	111.7	L162 P165 S167 F168 K173 L174 F175 L220 S223 L227	L162-F171 HydrophobicContact CD2-CD2 3.72Å; L162-F171 HydrophobicContact CD2-CE2 3.73Å; P165-F171 HydrophobicContact CB-CB 3.87Å; P165-F171 HydrophobicContact CG-CB 3.99Å; P165-F171 HydrophobicContact CG-CD2 3.99Å; P165-F171 HydrophobicContact CG-CG 4.44Å; S167-F171 PolarHBondContact O-N 3.4Å; F168-F171 HydrophobicContact CD2-CD1 4.34Å; F168-F171 HydrophobicContact CE2-CD1 4.15Å; F168-F171 WeakPolarHBondContact O-CB 3.48Å; F168-F171 PolarHBondContact O-N 2.9Å; F171-K173 VanDerWaalsContact C-N 3.33Å; F171-K173 PolarHBondContact O-N 3.03Å; F171-L174 PolarHBondContact O-N 3.39Å; F171-F175 HydrophobicContact CD1-CB 4.5Å; F171-F175 HydrophobicContact CE1-CB 4.12Å; F171-F175 HydrophobicContact CE1-CD2 4.27Å; F171-F175 HydrophobicContact CE1-CG 4.22Å; F171-F175 HydrophobicContact CZ-CB 4.28Å; F171-F175 AromaticContact CZ-CD2 3.86Å; F171-F175 HydrophobicContact CZ-CD2 3.86Å; F171-F175 HydrophobicContact CZ-CG 4.25Å; F171-F175 WeakPolarHBondContact O-CB 3.5Å; F171-F175 PolarHBondContact O-N 3.45Å; F171-L220 HydrophobicContact CE1-CD1 3.67Å; F171-L220 HydrophobicContact CZ-CD1 4.44Å; F171-S223 WeakPolarHBondContact CE2-OG 3.39Å; F171-S223 VanDerWaalsContact CZ-CB 3.48Å; F171-L227 HydrophobicContact CB-CD1 4.27Å; F171-L227 HydrophobicContact CG-CD1 4.49Å
172	V	93.2	Very high	92.8	Very high	64 Å²	64	56.1 Å²	56.1	39%	0.388	32%	0.324	S	S	.	.	H	α-helix	trans	-61.5	-39.8	179.9	170.9	0	0	0	0	111.8	F168 S169 E170 F175 T176	F168-V172 HydrophobicContact CD1-CG2 4.14Å; F168-V172 HydrophobicContact CE1-CG2 3.74Å; F168-V172 HydrophobicContact CE2-CG2 4.44Å; F168-V172 HydrophobicContact CZ-CG2 3.9Å; F168-V172 WeakPolarHBondContact O-CG2 3.37Å; F168-V172 PolarHBondContact O-N 2.92Å; S169-V172 PolarHBondContact O-N 2.89Å; E170-V172 VanDerWaalsContact C-N 3.34Å; E170-V172 PolarHBondContact O-N 3.48Å; V172-F175 PolarHBondContact O-N 3.3Å; V172-T176 WeakPolarHBondContact O-CB 3.33Å; V172-T176 PolarHBondContact O-N 3.41Å; V172-T176 PolarHBondContact O-OG1 2.97Å
173	K	94.3	Very high	93	Very high	151 Å²	151	60 Å²	60	66%	0.657	35%	0.348	S	S	*	.	H	α-helix	trans	-62.9	-50.1	176.1	-70.7	177.1	-177.4	-178.3	0	111.4	S169 E170 F171 F175 T176 Q177	S169-K173 WeakPolarHBondContact O-CG 3.4Å; S169-K173 PolarHBondContact O-N 3.09Å; E170-K173 PolarHBondContact O-N 3.03Å; F171-K173 VanDerWaalsContact C-N 3.33Å; F171-K173 PolarHBondContact O-N 3.03Å; K173-F175 VanDerWaalsContact C-N 3.33Å; K173-F175 PolarHBondContact O-N 2.91Å; K173-T176 PolarHBondContact O-N 3.27Å; K173-Q177 PolarHBondContact O-N 3.48Å; K173-Q177 VanDerWaalsContact O-N 3.15Å
174	L	95.6	Very high	93.3	Very high	20 Å²	20	60.6 Å²	60.6	11%	0.105	35%	0.352	C	S	.	.	H	α-helix	trans	-64.1	-38.2	178.4	-70.1	171.4	0	0	0	112	K161 L162 E170 F171 T176 Q177 F178	K161-L174 HydrophobicContact CB-CD1 4.05Å; K161-L174 HydrophobicContact CB-CD2 3.96Å; K161-L174 HydrophobicContact CD-CD2 4.08Å; L162-L174 HydrophobicContact CD2-CB 3.49Å; L162-L174 VanDerWaalsContact CD2-CB 3.49Å; L162-L174 HydrophobicContact CG-CB 3.89Å; E170-L174 HydrophobicContact CG-CD1 3.97Å; E170-L174 HydrophobicContact CG-CG 4.43Å; E170-L174 PolarHBondContact O-N 2.84Å; F171-L174 PolarHBondContact O-N 3.39Å; L174-T176 VanDerWaalsContact C-N 3.34Å; L174-Q177 PolarHBondContact O-N 3.09Å; L174-F178 WeakPolarHBondContact O-CB 3.28Å; L174-F178 PolarHBondContact O-N 3.47Å
175	F	95.2	Very high	93.8	Very high	48 Å²	48	55.8 Å²	55.8	21%	0.211	32%	0.319	C	S	.	.	H	α-helix	trans	-68.5	-36.1	-179.9	-174	-96.9	0	0	0	111.2	L162 F171 V172 K173 F178 G179 L219 L220	L162-F175 HydrophobicContact CD2-CB 4.12Å; F171-F175 HydrophobicContact CD1-CB 4.5Å; F171-F175 HydrophobicContact CE1-CB 4.12Å; F171-F175 HydrophobicContact CE1-CD2 4.27Å; F171-F175 HydrophobicContact CE1-CG 4.22Å; F171-F175 HydrophobicContact CZ-CB 4.28Å; F171-F175 AromaticContact CZ-CD2 3.86Å; F171-F175 HydrophobicContact CZ-CD2 3.86Å; F171-F175 HydrophobicContact CZ-CG 4.25Å; F171-F175 WeakPolarHBondContact O-CB 3.5Å; F171-F175 PolarHBondContact O-N 3.45Å; V172-F175 PolarHBondContact O-N 3.3Å; K173-F175 VanDerWaalsContact C-N 3.33Å; K173-F175 PolarHBondContact O-N 2.91Å; F175-F178 PolarHBondContact O-N 3.38Å; F175-G179 PolarHBondContact O-N 2.9Å; F175-L219 HydrophobicContact CD2-CD2 4.06Å; F175-L219 HydrophobicContact CD2-CG 4.38Å; F175-L219 HydrophobicContact CE2-CB 4.07Å; F175-L219 HydrophobicContact CE2-CD2 3.88Å; F175-L219 HydrophobicContact CE2-CG 4.09Å; F175-L220 HydrophobicContact CE2-CB 4.34Å; F175-L220 HydrophobicContact CZ-CB 4.07Å
176	T	95.5	Very high	94.3	Very high	99 Å²	99	56.9 Å²	56.9	61%	0.607	33%	0.33	S	S	*	.	H	α-helix	trans	-63.7	-44.6	172.9	-55.8	0	0	0	0	111.2	V172 K173 L174 G179 G180	V172-T176 WeakPolarHBondContact O-CB 3.33Å; V172-T176 PolarHBondContact O-N 3.41Å; V172-T176 PolarHBondContact O-OG1 2.97Å; K173-T176 PolarHBondContact O-N 3.27Å; L174-T176 VanDerWaalsContact C-N 3.34Å; T176-G179 PolarHBondContact O-N 3.04Å; T176-G180 PolarHBondContact O-N 3.13Å
177	Q	96.2	Very high	95	Very high	85 Å²	85	56.6 Å²	56.6	40%	0.397	32%	0.32	S	S	.	.	H	α-helix	trans	-61.5	-50.2	175.4	-179.6	-175.7	-13.9	0	0	111.3	T158 K173 L174 G179 G180 E181	T158-Q177 HydrophobicContact CG2-CB 4.34Å; T158-Q177 HydrophobicContact CG2-CG 4.19Å; T158-Q177 PolarHBondContact OG1-NE2 2.98Å; K173-Q177 PolarHBondContact O-N 3.48Å; K173-Q177 VanDerWaalsContact O-N 3.15Å; L174-Q177 PolarHBondContact O-N 3.09Å; Q177-G179 VanDerWaalsContact C-N 3.27Å; Q177-G179 PolarHBondContact O-N 3.29Å; Q177-G180 PolarHBondContact O-N 3.43Å; Q177-G180 VanDerWaalsContact O-N 3.11Å; Q177-E181 WeakPolarHBondContact CG-OE1 3.42Å; Q177-E181 PolarHBondContact NE2-OE1 3.3Å; Q177-E181 PolarHBondContact O-N 3.06Å; Q177-E181 VanDerWaalsContact O-N 3.1Å
178	F	96.6	Very high	95.4	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-55.7	-42.2	177.6	175.2	-94.9	0	0	0	111.9	V155 T158 L159 L162 L174 F175 G180 E181 M182 T216 L219 I246	V155-F178 HydrophobicContact CG1-CD2 4.26Å; V155-F178 HydrophobicContact CG1-CE2 3.58Å; V155-F178 HydrophobicContact CG1-CZ 4.24Å; T158-F178 HydrophobicContact CG2-CB 3.81Å; L159-F178 HydrophobicContact CB-CD2 4.36Å; L159-F178 HydrophobicContact CB-CE2 3.98Å; L159-F178 HydrophobicContact CD1-CE2 3.89Å; L159-F178 HydrophobicContact CD1-CZ 4.23Å; L159-F178 HydrophobicContact CG-CE2 4.47Å; L162-F178 HydrophobicContact CD1-CB 3.51Å; L162-F178 HydrophobicContact CD1-CD1 4.19Å; L162-F178 HydrophobicContact CD1-CD2 3.88Å; L162-F178 HydrophobicContact CD1-CG 3.59Å; L174-F178 WeakPolarHBondContact O-CB 3.28Å; L174-F178 PolarHBondContact O-N 3.47Å; F175-F178 PolarHBondContact O-N 3.38Å; F178-G180 PolarHBondContact O-N 3.06Å; F178-E181 PolarHBondContact O-N 2.94Å; F178-M182 HydrophobicContact CE1-CE 4.3Å; F178-M182 HydrophobicContact CE2-CE 4.2Å; F178-M182 HydrophobicContact CZ-CE 3.73Å; F178-M182 VanDerWaalsContact O-CB 3.31Å; F178-M182 WeakPolarHBondContact O-CB 3.41Å; F178-M182 PolarHBondContact O-N 3.39Å; F178-T216 HydrophobicContact CE1-CG2 3.98Å; F178-L219 HydrophobicContact CD1-CD2 4.27Å; F178-L219 HydrophobicContact CE1-CD2 3.95Å; F178-L219 HydrophobicContact CZ-CD2 4.34Å; F178-I246 HydrophobicContact CZ-CG2 4.37Å
179	G	95.8	Very high	95.9	Very high	28 Å²	28	52.6 Å²	52.6	29%	0.289	30%	0.296	S	S	.	.	H	α-helix	trans	-60.1	-42.7	176.6	0	0	0	0	0	113	F175 T176 Q177 M182 V183	F175-G179 PolarHBondContact O-N 2.9Å; T176-G179 PolarHBondContact O-N 3.04Å; Q177-G179 VanDerWaalsContact C-N 3.27Å; Q177-G179 PolarHBondContact O-N 3.29Å; G179-M182 PolarHBondContact O-N 3.28Å; G179-V183 WeakPolarHBondContact O-CG2 3.48Å; G179-V183 PolarHBondContact O-N 3.49Å; G179-V183 VanDerWaalsContact O-N 3.07Å
180	G	96.5	Very high	96.1	Very high	47 Å²	47	49.3 Å²	49.3	49%	0.485	27%	0.274	S	S	.	.	H	α-helix	trans	-63.8	-43.5	175.9	0	0	0	0	0	113	T176 Q177 F178 V183 D184	T176-G180 PolarHBondContact O-N 3.13Å; Q177-G180 PolarHBondContact O-N 3.43Å; Q177-G180 VanDerWaalsContact O-N 3.11Å; F178-G180 PolarHBondContact O-N 3.06Å; G180-V183 PolarHBondContact O-N 2.97Å; G180-D184 PolarHBondContact O-N 3.31Å
181	E	97.6	Very high	96.3	Very high	34 Å²	34	51.2 Å²	51.2	16%	0.159	29%	0.286	C	S	.	.	H	α-helix	trans	-66.3	-37.2	176.7	-67.3	167.4	177.1	0	0	111.8	K154 V155 T158 Q177 F178 D184 L185	K154-E181 HydrophobicContact CB-CG 4.36Å; V155-E181 HydrophobicContact CG2-CB 3.77Å; T158-E181 WeakPolarHBondContact CB-OE2 3.35Å; T158-E181 PolarHBondContact OG1-OE1 3.27Å; T158-E181 PolarHBondContact OG1-OE2 3.43Å; Q177-E181 WeakPolarHBondContact CG-OE1 3.42Å; Q177-E181 PolarHBondContact NE2-OE1 3.3Å; Q177-E181 PolarHBondContact O-N 3.06Å; Q177-E181 VanDerWaalsContact O-N 3.1Å; F178-E181 PolarHBondContact O-N 2.94Å; E181-D184 PolarHBondContact O-N 3.48Å; E181-L185 PolarHBondContact O-N 2.81Å
182	M	96.9	Very high	96.4	Very high	21 Å²	21	51.6 Å²	51.6	10%	0.103	29%	0.288	C	S	.	.	H	α-helix	trans	-65	-38.7	176	-173.5	51.2	58.7	0	0	112.2	V155 F178 G179 L185 A186 L212	V155-M182 HydrophobicContact CB-CE 4.35Å; V155-M182 HydrophobicContact CG1-CE 3.31Å; V155-M182 HydrophobicContact CG2-CE 4.06Å; F178-M182 HydrophobicContact CE1-CE 4.3Å; F178-M182 HydrophobicContact CE2-CE 4.2Å; F178-M182 HydrophobicContact CZ-CE 3.73Å; F178-M182 VanDerWaalsContact O-CB 3.31Å; F178-M182 WeakPolarHBondContact O-CB 3.41Å; F178-M182 PolarHBondContact O-N 3.39Å; G179-M182 PolarHBondContact O-N 3.28Å; M182-L185 HydrophobicContact CE-CD2 4.39Å; M182-L185 PolarHBondContact O-N 2.75Å; M182-L185 HydrophobicContact SD-CD2 4.28Å; M182-A186 VanDerWaalsContact O-CB 3.24Å; M182-A186 WeakPolarHBondContact O-CB 3.41Å; M182-A186 PolarHBondContact O-N 3.19Å; M182-L212 HydrophobicContact CE-CD1 4.19Å; M182-L212 HydrophobicContact CE-CD2 4.12Å; M182-L212 HydrophobicContact SD-CB 4.25Å; M182-L212 HydrophobicContact SD-CD1 3.83Å; M182-L212 HydrophobicContact SD-CG 4.48Å
183	V	97.1	Very high	96.5	Very high	83 Å²	83	49.6 Å²	49.6	50%	0.503	27%	0.274	S	S	.	.	H	α-helix	trans	-64	-43.2	174.9	171.8	0	0	0	0	110.9	G179 G180 A186 H187	G179-V183 WeakPolarHBondContact O-CG2 3.48Å; G179-V183 PolarHBondContact O-N 3.49Å; G179-V183 VanDerWaalsContact O-N 3.07Å; G180-V183 PolarHBondContact O-N 2.97Å; V183-A186 PolarHBondContact O-N 3.37Å; V183-H187 VanDerWaalsContact CG1-CE1 3.47Å; V183-H187 WeakPolarHBondContact CG1-CE1 3.43Å; V183-H187 PolarHBondContact O-N 3.45Å; V183-H187 VanDerWaalsContact O-N 3.17Å; V183-H187 PolarHBondContact O-ND1 2.89Å
184	D	97.4	Very high	96.5	Very high	58 Å²	58	49 Å²	49	31%	0.31	27%	0.273	S	S	.	.	H	α-helix	trans	-60.6	-47.6	175.1	-175.6	46.2	0	0	0	111.1	G180 E181 A186 H187 K188	G180-D184 PolarHBondContact O-N 3.31Å; E181-D184 PolarHBondContact O-N 3.48Å; D184-A186 VanDerWaalsContact C-N 3.33Å; D184-A186 PolarHBondContact O-N 2.91Å; D184-H187 PolarHBondContact O-N 2.96Å; D184-K188 WeakPolarHBondContact O-CG 3.5Å; D184-K188 PolarHBondContact O-N 3.26Å; D184-K188 WeakPolarHBondContact OD1-CE 3.48Å; D184-K188 IonicContact OD1-NZ 3.26Å; D184-K188 PolarHBondContact OD1-NZ 3.02Å; D184-K188 WeakPolarHBondContact OD2-CE 3.39Å; D184-K188 IonicContact OD2-NZ 2.99Å
185	L	97.7	Very high	96.4	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-59.7	-41.7	175.8	-177.8	63.3	0	0	0	112.1	I148 A151 E152 V155 E181 M182 H187 K188 T189 L212 L250	I148-L185 HydrophobicContact CG2-CD1 4.29Å; A151-L185 HydrophobicContact CB-CB 4.42Å; A151-L185 HydrophobicContact CB-CD1 4.11Å; E152-L185 HydrophobicContact CB-CD1 4.07Å; V155-L185 HydrophobicContact CB-CD2 4.4Å; V155-L185 HydrophobicContact CG2-CB 4.23Å; V155-L185 HydrophobicContact CG2-CD2 4.01Å; E181-L185 PolarHBondContact O-N 2.81Å; M182-L185 HydrophobicContact CE-CD2 4.39Å; M182-L185 PolarHBondContact O-N 2.75Å; M182-L185 HydrophobicContact SD-CD2 4.28Å; L185-H187 VanDerWaalsContact C-N 3.34Å; L185-H187 PolarHBondContact O-N 3.39Å; L185-K188 PolarHBondContact O-N 2.84Å; L185-T189 HydrophobicContact CD1-CG2 3.68Å; L185-T189 HydrophobicContact CG-CG2 4.06Å; L185-T189 WeakPolarHBondContact O-CB 3.38Å; L185-T189 VanDerWaalsContact O-CG2 3.25Å; L185-T189 WeakPolarHBondContact O-CG2 3.26Å; L185-T189 PolarHBondContact O-N 3.44Å; L185-T189 PolarHBondContact O-OG1 3.35Å; L185-L212 HydrophobicContact CD2-CD1 4Å; L185-L250 HydrophobicContact CD2-CD2 3.62Å
186	A	97.2	Very high	96.3	Very high	39 Å²	39	47.1 Å²	47.1	32%	0.322	27%	0.266	S	S	.	.	H	α-helix	trans	-63.4	-36.3	-178.7	0	0	0	0	0	113.1	M182 V183 D184 T189 G190 R209	M182-A186 VanDerWaalsContact O-CB 3.24Å; M182-A186 WeakPolarHBondContact O-CB 3.41Å; M182-A186 PolarHBondContact O-N 3.19Å; V183-A186 PolarHBondContact O-N 3.37Å; D184-A186 VanDerWaalsContact C-N 3.33Å; D184-A186 PolarHBondContact O-N 2.91Å; A186-T189 PolarHBondContact O-OG1 3.4Å; A186-G190 PolarHBondContact O-N 2.95Å; A186-G190 VanDerWaalsContact O-N 3.08Å; A186-R209 PolarHBondContact O-NH2 3Å
187	H	97.6	Very high	96	Very high	121 Å²	121	45.9 Å²	45.9	56%	0.56	25%	0.252	S	S	*	.	H	α-helix	trans	-67.5	-54.2	174.2	-72.8	96.9	0	0	0	110.9	V183 D184 L185 T189 G190 D191	V183-H187 VanDerWaalsContact CG1-CE1 3.47Å; V183-H187 WeakPolarHBondContact CG1-CE1 3.43Å; V183-H187 PolarHBondContact O-N 3.45Å; V183-H187 VanDerWaalsContact O-N 3.17Å; V183-H187 PolarHBondContact O-ND1 2.89Å; D184-H187 PolarHBondContact O-N 2.96Å; L185-H187 VanDerWaalsContact C-N 3.34Å; L185-H187 PolarHBondContact O-N 3.39Å; H187-T189 VanDerWaalsContact C-N 3.35Å; H187-T189 PolarHBondContact O-N 3.34Å; H187-G190 PolarHBondContact O-N 3.19Å; H187-G190 VanDerWaalsContact O-N 3.08Å; H187-D191 PolarHBondContact O-N 2.98Å
188	K	97.4	Very high	95.6	Very high	59 Å²	59	44.4 Å²	44.4	26%	0.257	25%	0.251	S	S	.	.	H	α-helix	trans	-63	-41	-176.4	-55.4	-170.7	-159.6	-44	0	112.5	Q147 I148 A151 D184 L185 G190 R192	Q147-K188 HydrophobicContact CB-CD 4.48Å; I148-K188 HydrophobicContact CG1-CB 3.77Å; A151-K188 HydrophobicContact CB-CD 4.25Å; D184-K188 WeakPolarHBondContact O-CG 3.5Å; D184-K188 PolarHBondContact O-N 3.26Å; D184-K188 WeakPolarHBondContact OD1-CE 3.48Å; D184-K188 IonicContact OD1-NZ 3.26Å; D184-K188 PolarHBondContact OD1-NZ 3.02Å; D184-K188 WeakPolarHBondContact OD2-CE 3.39Å; D184-K188 IonicContact OD2-NZ 2.99Å; L185-K188 PolarHBondContact O-N 2.84Å; K188-G190 VanDerWaalsContact C-N 3.33Å; K188-R192 WeakPolarHBondContact O-CB 3.41Å; K188-R192 PolarHBondContact O-N 2.97Å
189	T	97.2	Very high	95.3	Very high	2 Å²	2	49 Å²	49	1%	0.012	27%	0.272	C	S	.	.	H	α-helix	trans	-68.7	-32.6	175.9	55.7	0	0	0	0	112.3	I148 L185 A186 H187 Q193 M205 R209 I253	I148-T189 HydrophobicContact CG2-CG2 3.99Å; L185-T189 HydrophobicContact CD1-CG2 3.68Å; L185-T189 HydrophobicContact CG-CG2 4.06Å; L185-T189 WeakPolarHBondContact O-CB 3.38Å; L185-T189 VanDerWaalsContact O-CG2 3.25Å; L185-T189 WeakPolarHBondContact O-CG2 3.26Å; L185-T189 PolarHBondContact O-N 3.44Å; L185-T189 PolarHBondContact O-OG1 3.35Å; A186-T189 PolarHBondContact O-OG1 3.4Å; H187-T189 VanDerWaalsContact C-N 3.35Å; H187-T189 PolarHBondContact O-N 3.34Å; T189-Q193 VanDerWaalsContact O-CB 3.26Å; T189-Q193 WeakPolarHBondContact O-CB 3.37Å; T189-Q193 PolarHBondContact O-N 2.88Å; T189-M205 HydrophobicContact CG2-SD 4.14Å; T189-R209 PolarHBondContact OG1-NE 3.5Å; T189-I253 HydrophobicContact CG2-CD1 4.4Å; T189-I253 HydrophobicContact CG2-CG2 3.58Å
190	G	97.3	Very high	95	Very high	5 Å²	5	49.5 Å²	49.5	5%	0.052	27%	0.267	C	S	.	.	H	α-helix	trans	-65.7	-46.3	174.4	0	0	0	0	0	113	A186 H187 K188 Q193 Q194	A186-G190 PolarHBondContact O-N 2.95Å; A186-G190 VanDerWaalsContact O-N 3.08Å; H187-G190 PolarHBondContact O-N 3.19Å; H187-G190 VanDerWaalsContact O-N 3.08Å; K188-G190 VanDerWaalsContact C-N 3.33Å; G190-Q193 WeakPolarHBondContact O-CB 3.42Å; G190-Q193 PolarHBondContact O-N 2.96Å; G190-Q194 WeakPolarHBondContact O-CG 3.46Å; G190-Q194 PolarHBondContact O-N 3.47Å
191	D	96.3	Very high	94.7	Very high	110 Å²	110	49.3 Å²	49.3	59%	0.588	25%	0.252	S	S	*	.	H	α-helix	trans	-63.2	-46.7	175.7	-67	-20.7	0	0	0	110.5	H187 Q193 Q194 D195	H187-D191 PolarHBondContact O-N 2.98Å; D191-Q193 VanDerWaalsContact C-N 3.34Å; D191-Q193 PolarHBondContact O-N 2.88Å; D191-Q194 PolarHBondContact O-N 3.33Å; D191-D195 WeakPolarHBondContact O-CB 3.24Å; D191-D195 PolarHBondContact O-N 2.78Å; D191-D195 VanDerWaalsContact O-N 3.09Å
192	R	95.4	Very high	94.5	Very high	8 Å²	8	51.3 Å²	51.3	3%	0.03	26%	0.257	C	S	.	.	H	α-helix	trans	-58.6	-44.3	175.9	-171.6	58.5	163.6	-172.8	-2.6	111.8	T17 D141 I148 K188 Q194 D195 L196 M205	T17-R192 VanDerWaalsContact CG2-NH1 3.31Å; D141-R192 VanDerWaalsContact CG-NH1 3.35Å; D141-R192 IonicContact OD1-CZ 2.94Å; D141-R192 IonicContact OD1-NH1 3.05Å; D141-R192 PolarHBondContact OD1-NH1 3.36Å; D141-R192 IonicContact OD1-NH2 3.78Å; D141-R192 IonicContact OD2-CZ 3.24Å; D141-R192 IonicContact OD2-NH1 2.83Å; D141-R192 PolarHBondContact OD2-NH1 3.09Å; D141-R192 IonicContact OD2-NH2 2.73Å; D141-R192 PolarHBondContact OD2-NH2 3.07Å; I148-R192 HydrophobicContact CD1-CB 3.73Å; I148-R192 HydrophobicContact CD1-CG 3.8Å; K188-R192 WeakPolarHBondContact O-CB 3.41Å; K188-R192 PolarHBondContact O-N 2.97Å; R192-Q194 VanDerWaalsContact C-N 3.3Å; R192-Q194 PolarHBondContact O-N 3.15Å; R192-D195 PolarHBondContact O-N 2.99Å; R192-D195 VanDerWaalsContact O-N 3.14Å; R192-L196 HydrophobicContact CG-CG 4.43Å; R192-L196 VanDerWaalsContact O-CG 3.31Å; R192-L196 WeakPolarHBondContact O-CG 3.4Å; R192-L196 PolarHBondContact O-N 3.1Å; R192-M205 HydrophobicContact CG-CE 4.36Å
193	Q	95.4	Very high	94.4	Very high	22 Å²	22	50.5 Å²	50.5	10%	0.103	25%	0.254	C	S	.	.	H	α-helix	trans	-55.9	-44.4	178.1	-175.5	-176	-5.7	0	0	112.1	T189 G190 D191 D195 R202 M205 Q206	T189-Q193 VanDerWaalsContact O-CB 3.26Å; T189-Q193 WeakPolarHBondContact O-CB 3.37Å; T189-Q193 PolarHBondContact O-N 2.88Å; G190-Q193 WeakPolarHBondContact O-CB 3.42Å; G190-Q193 PolarHBondContact O-N 2.96Å; D191-Q193 VanDerWaalsContact C-N 3.34Å; D191-Q193 PolarHBondContact O-N 2.88Å; Q193-D195 VanDerWaalsContact C-N 3.3Å; Q193-R202 HydrophobicContact CG-CG 3.76Å; Q193-R202 WeakPolarHBondContact O-CD 3.3Å; Q193-R202 WeakPolarHBondContact O-CG 3.38Å; Q193-M205 HydrophobicContact CB-CB 4.3Å; Q193-M205 HydrophobicContact CB-CG 3.61Å; Q193-M205 HydrophobicContact CG-CB 4.16Å; Q193-M205 HydrophobicContact CG-CG 3.95Å; Q193-Q206 VanDerWaalsContact NE2-CB 3.26Å
194	Q	94.2	Very high	94.2	Very high	138 Å²	138	46.6 Å²	46.6	65%	0.645	23%	0.231	S	C	*	.	H	α-helix	trans	-69.9	-31.7	-179.5	-66.6	-179.6	31.7	0	0	112.1	K18 G190 D191 R192	K18-Q194 WeakPolarHBondContact CD-O 3.29Å; K18-Q194 PolarHBondContact NZ-O 3.07Å; G190-Q194 WeakPolarHBondContact O-CG 3.46Å; G190-Q194 PolarHBondContact O-N 3.47Å; D191-Q194 PolarHBondContact O-N 3.33Å; R192-Q194 VanDerWaalsContact C-N 3.3Å; R192-Q194 PolarHBondContact O-N 3.15Å
195	D	94.3	Very high	94.1	Very high	23 Å²	23	43.9 Å²	43.9	12%	0.123	22%	0.216	C	C	.	.	H	α-helix	trans	-80.3	-26.7	-178.1	-167.8	39.7	0	0	0	113.8	T17 K18 T19 D191 R192 Q193 K197	T17-D195 CarbonylContact C-O 3.3Å; T17-D195 WeakPolarHBondContact CA-O 3.49Å; T17-D195 VanDerWaalsContact CB-OD2 3.25Å; T17-D195 WeakPolarHBondContact CB-OD2 3.32Å; T17-D195 WeakPolarHBondContact CG2-OD2 3.06Å; K18-D195 WeakPolarHBondContact CB-O 3.46Å; K18-D195 WeakPolarHBondContact CG-O 3.39Å; K18-D195 PolarHBondContact N-O 3.41Å; K18-D195 PolarHBondContact N-OD1 2.87Å; T19-D195 VanDerWaalsContact CB-OD1 3.28Å; T19-D195 WeakPolarHBondContact CB-OD1 3.32Å; T19-D195 PolarHBondContact N-OD1 3.18Å; T19-D195 PolarHBondContact OG1-OD1 3.01Å; D191-D195 WeakPolarHBondContact O-CB 3.24Å; D191-D195 PolarHBondContact O-N 2.78Å; D191-D195 VanDerWaalsContact O-N 3.09Å; R192-D195 PolarHBondContact O-N 2.99Å; R192-D195 VanDerWaalsContact O-N 3.14Å; Q193-D195 VanDerWaalsContact C-N 3.3Å; D195-K197 PolarHBondContact O-N 3.34Å
196	L	91.8	Very high	94	Very high	7 Å²	7	47.8 Å²	47.8	4%	0.037	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-59.7	133.2	176.9	-73	168.5	0	0	0	112.4	K18 R192 R201 M205	K18-L196 WeakPolarHBondContact CE-O 3.32Å; R192-L196 HydrophobicContact CG-CG 4.43Å; R192-L196 VanDerWaalsContact O-CG 3.31Å; R192-L196 WeakPolarHBondContact O-CG 3.4Å; R192-L196 PolarHBondContact O-N 3.1Å; L196-R201 HydrophobicContact CD1-CB 4.18Å; L196-M205 HydrophobicContact CD1-CB 4.46Å
197	K	90	Very high	93.9	Very high	73 Å²	73	46.1 Å²	46.1	32%	0.317	22%	0.22	S	C	.	.			trans	-77.8	-47.6	176.1	-72.7	178.1	59.7	-175.5	0	112.7	I15 K16 K18 E21 D195 E199	I15-K197 WeakPolarHBondContact O-CD 3.47Å; I15-K197 PolarHBondContact O-NZ 3.27Å; I15-K197 VanDerWaalsContact O-NZ 3.13Å; K16-K197 WeakPolarHBondContact O-CB 3.31Å; K16-K197 WeakPolarHBondContact O-CG 3.28Å; K16-K197 PolarHBondContact O-N 3.28Å; K18-K197 HydrophobicContact CG-CG 3.86Å; E21-K197 HydrophobicContact CB-CD 4.35Å; E21-K197 VanDerWaalsContact OE1-CE 3.23Å; E21-K197 WeakPolarHBondContact OE1-CE 3.28Å; E21-K197 IonicContact OE1-NZ 2.77Å; E21-K197 PolarHBondContact OE1-NZ 2.71Å; E21-K197 WeakPolarHBondContact OE2-CD 3.44Å; E21-K197 VanDerWaalsContact OE2-CE 3.32Å; E21-K197 WeakPolarHBondContact OE2-CE 3.47Å; E21-K197 IonicContact OE2-NZ 2.71Å; D195-K197 PolarHBondContact O-N 3.34Å; K197-E199 PolarHBondContact O-N 2.84Å
198	S	88.2	Confident	93.7	Very high	53 Å²	53	40.3 Å²	40.3	37%	0.371	19%	0.193	S	C	.	.			trans	-60.7	122.7	-179.3	168.7	0	0	0	0	110.6	R201 R202	S198-R201 PolarHBondContact O-N 2.96Å; S198-R201 PolarHBondContact OG-N 3.27Å; S198-R202 WeakPolarHBondContact O-CB 3.47Å; S198-R202 PolarHBondContact O-N 3.27Å
199	E	89.4	Confident	93.7	Very high	96 Å²	96	41.2 Å²	41.2	45%	0.449	20%	0.195	S	C	.	.	H	α-helix	trans	-63.5	-43.7	175.9	-178.6	166.4	-156	0	0	111.4	K197 R201 R202 A203 D457	K197-E199 PolarHBondContact O-N 2.84Å; E199-R201 PolarHBondContact O-N 2.77Å; E199-R202 PolarHBondContact O-N 3.35Å; E199-A203 WeakPolarHBondContact O-CB 3.42Å; E199-A203 PolarHBondContact O-N 3.01Å; E199-D457 HydrophobicContact CB-CB 4.47Å; E199-D457 HydrophobicContact CG-CB 4.5Å
200	K	89.7	Confident	93.6	Very high	39 Å²	39	42.8 Å²	42.8	17%	0.17	21%	0.206	C	C	.	.	H	α-helix	trans	-51.4	-54.6	171.9	175.1	170.8	164.8	170.6	0	112.1	R202 A203 Q204 D281 G283 D457 V461	K200-R202 VanDerWaalsContact C-N 3.33Å; K200-R202 PolarHBondContact O-N 3.14Å; K200-A203 PolarHBondContact O-N 3.47Å; K200-Q204 VanDerWaalsContact O-CG 3.3Å; K200-Q204 WeakPolarHBondContact O-CG 3.26Å; K200-Q204 PolarHBondContact O-N 3.41Å; K200-D281 IonicContact NZ-OD1 3.95Å; K200-G283 PolarHBondContact NZ-O 2.98Å; K200-D457 HydrophobicContact CB-CB 3.96Å; K200-V461 HydrophobicContact CG-CG2 4.11Å
201	R	90.4	Very high	93.5	Very high	44 Å²	44	43.1 Å²	43.1	17%	0.166	21%	0.207	C	C	.	.	H	α-helix	trans	-65	-36.5	-179.5	-68.7	-68.6	-176	-147.7	4.6	112.4	L196 S198 E199 Q204 M205 E259 D281	L196-R201 HydrophobicContact CD1-CB 4.18Å; S198-R201 PolarHBondContact O-N 2.96Å; S198-R201 PolarHBondContact OG-N 3.27Å; E199-R201 PolarHBondContact O-N 2.77Å; R201-Q204 PolarHBondContact O-N 3.23Å; R201-M205 WeakPolarHBondContact O-CB 3.48Å; R201-M205 PolarHBondContact O-N 3.32Å; R201-E259 PolarHBondContact NH2-O 2.77Å; R201-D281 IonicContact CZ-OD2 2.71Å; R201-D281 IonicContact NH1-OD2 2.7Å; R201-D281 PolarHBondContact NH1-OD2 3.12Å; R201-D281 IonicContact NH2-OD2 2.98Å
202	R	93.8	Very high	93.4	Very high	75 Å²	75	38.2 Å²	38.2	28%	0.283	18%	0.18	S	C	.	.	H	α-helix	trans	-63.8	-41.4	174.9	-176.7	170.9	66.2	-126.5	1.2	112	Q193 S198 E199 K200 Q206	Q193-R202 HydrophobicContact CG-CG 3.76Å; Q193-R202 WeakPolarHBondContact O-CD 3.3Å; Q193-R202 WeakPolarHBondContact O-CG 3.38Å; S198-R202 WeakPolarHBondContact O-CB 3.47Å; S198-R202 PolarHBondContact O-N 3.27Å; E199-R202 PolarHBondContact O-N 3.35Å; K200-R202 VanDerWaalsContact C-N 3.33Å; K200-R202 PolarHBondContact O-N 3.14Å; R202-Q206 PolarHBondContact O-N 2.87Å
203	A	94.2	Very high	93.4	Very high	5 Å²	5	44.2 Å²	44.2	4%	0.041	21%	0.209	C	C	.	.	H	α-helix	trans	-67	-41	175.3	0	0	0	0	0	111.6	E199 K200 Q206 V207 V461	E199-A203 WeakPolarHBondContact O-CB 3.42Å; E199-A203 PolarHBondContact O-N 3.01Å; K200-A203 PolarHBondContact O-N 3.47Å; A203-Q206 VanDerWaalsContact O-CB 3.25Å; A203-Q206 WeakPolarHBondContact O-CB 3.45Å; A203-Q206 PolarHBondContact O-N 3.33Å; A203-Q206 VanDerWaalsContact O-N 3.17Å; A203-V207 WeakPolarHBondContact O-CG2 3.36Å; A203-V207 PolarHBondContact O-N 3.24Å; A203-V461 HydrophobicContact CB-CB 3.89Å; A203-V461 HydrophobicContact CB-CG1 3.82Å; A203-V461 HydrophobicContact CB-CG2 4.45Å
204	Q	93.6	Very high	93.3	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-65.4	-41.5	177.1	-71	175.4	-27.6	0	0	112.6	K200 R201 Q206 V207 G208 L252 C256 D281 V461	K200-Q204 VanDerWaalsContact O-CG 3.3Å; K200-Q204 WeakPolarHBondContact O-CG 3.26Å; K200-Q204 PolarHBondContact O-N 3.41Å; R201-Q204 PolarHBondContact O-N 3.23Å; Q204-Q206 VanDerWaalsContact C-N 3.28Å; Q204-Q206 PolarHBondContact O-N 2.87Å; Q204-V207 WeakPolarHBondContact O-CB 3.48Å; Q204-V207 PolarHBondContact O-N 2.97Å; Q204-G208 PolarHBondContact O-N 3.44Å; Q204-L252 HydrophobicContact CB-CD1 4.35Å; Q204-C256 WeakPolarHBondContact CB-SG 3.25Å; Q204-D281 PolarHBondContact NE2-OD1 3.44Å; Q204-V461 HydrophobicContact CB-CG1 4.39Å; Q204-V461 HydrophobicContact CG-CB 4.47Å; Q204-V461 HydrophobicContact CG-CG1 3.64Å; Q204-V461 HydrophobicContact CG-CG2 3.92Å
205	M	94.9	Very high	93.3	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-60	-41.6	172.2	-178.8	61.4	76.7	0	0	110.9	T189 R192 Q193 L196 R201 V207 G208 R209 I253 C256 V257	T189-M205 HydrophobicContact CG2-SD 4.14Å; R192-M205 HydrophobicContact CG-CE 4.36Å; Q193-M205 HydrophobicContact CB-CB 4.3Å; Q193-M205 HydrophobicContact CB-CG 3.61Å; Q193-M205 HydrophobicContact CG-CB 4.16Å; Q193-M205 HydrophobicContact CG-CG 3.95Å; L196-M205 HydrophobicContact CD1-CB 4.46Å; R201-M205 WeakPolarHBondContact O-CB 3.48Å; R201-M205 PolarHBondContact O-N 3.32Å; M205-V207 VanDerWaalsContact C-N 3.33Å; M205-V207 PolarHBondContact O-N 3.35Å; M205-G208 PolarHBondContact O-N 3.22Å; M205-R209 WeakPolarHBondContact O-CB 3.13Å; M205-R209 VanDerWaalsContact O-CG 3.23Å; M205-R209 WeakPolarHBondContact O-CG 3.43Å; M205-R209 PolarHBondContact O-N 3.42Å; M205-R209 HydrophobicContact SD-CG 4.4Å; M205-I253 HydrophobicContact CE-CG2 4.33Å; M205-I253 HydrophobicContact SD-CB 4.48Å; M205-I253 HydrophobicContact SD-CG1 4.01Å; M205-I253 HydrophobicContact SD-CG2 4.2Å; M205-C256 HydrophobicContact CB-CB 4.44Å; M205-C256 HydrophobicContact CE-CB 3.72Å; M205-V257 HydrophobicContact CE-CG2 3.65Å
206	Q	95.5	Very high	93.3	Very high	83 Å²	83	38.2 Å²	38.2	39%	0.388	18%	0.18	S	C	.	.	H	α-helix	trans	-59.6	-44.3	174.3	-164.5	173.6	-15.5	0	0	112.1	Q193 R202 A203 Q204 R209 S210	Q193-Q206 VanDerWaalsContact NE2-CB 3.26Å; R202-Q206 PolarHBondContact O-N 2.87Å; A203-Q206 VanDerWaalsContact O-CB 3.25Å; A203-Q206 WeakPolarHBondContact O-CB 3.45Å; A203-Q206 PolarHBondContact O-N 3.33Å; A203-Q206 VanDerWaalsContact O-N 3.17Å; Q204-Q206 VanDerWaalsContact C-N 3.28Å; Q204-Q206 PolarHBondContact O-N 2.87Å; Q206-R209 PolarHBondContact O-N 3.48Å; Q206-S210 WeakPolarHBondContact O-CB 3.48Å; Q206-S210 PolarHBondContact O-N 2.88Å
207	V	94.7	Very high	93.2	Very high	4 Å²	4	42.8 Å²	42.8	2%	0.024	20%	0.203	C	C	.	.	H	α-helix	trans	-60.3	-51.4	177.4	165.1	0	0	0	0	110.7	A203 Q204 M205 R209 S210 I211 L252 I282 V461 H465	A203-V207 WeakPolarHBondContact O-CG2 3.36Å; A203-V207 PolarHBondContact O-N 3.24Å; Q204-V207 WeakPolarHBondContact O-CB 3.48Å; Q204-V207 PolarHBondContact O-N 2.97Å; M205-V207 VanDerWaalsContact C-N 3.33Å; M205-V207 PolarHBondContact O-N 3.35Å; V207-R209 VanDerWaalsContact C-N 3.3Å; V207-R209 PolarHBondContact O-N 3.47Å; V207-S210 PolarHBondContact O-N 3.47Å; V207-S210 VanDerWaalsContact O-N 3.12Å; V207-I211 HydrophobicContact CG1-CD1 3.79Å; V207-I211 HydrophobicContact CG1-CG1 4.42Å; V207-I211 WeakPolarHBondContact O-CG1 3.2Å; V207-I211 PolarHBondContact O-N 3Å; V207-L252 HydrophobicContact CB-CD2 4.23Å; V207-L252 HydrophobicContact CG1-CD2 3.75Å; V207-I282 HydrophobicContact CG1-CD1 4.29Å; V207-V461 HydrophobicContact CG2-CG1 3.93Å; V207-H465 HydrophobicContact CB-CB 4.32Å; V207-H465 HydrophobicContact CG1-CB 3.79Å; V207-H465 WeakPolarHBondContact CG1-ND1 3.34Å; V207-H465 HydrophobicContact CG2-CB 3.54Å
208	G	94.7	Very high	93.5	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-55.9	-45.4	177.3	0	0	0	0	0	112.2	Q204 M205 S210 I211 L212	Q204-G208 PolarHBondContact O-N 3.44Å; M205-G208 PolarHBondContact O-N 3.22Å; G208-S210 PolarHBondContact O-N 3.16Å; G208-I211 PolarHBondContact O-N 3.2Å; G208-L212 WeakPolarHBondContact O-CG 3.32Å; G208-L212 PolarHBondContact O-N 3.37Å; G208-L212 VanDerWaalsContact O-N 3.09Å
209	R	96.7	Very high	93.8	Very high	78 Å²	78	36.8 Å²	36.8	29%	0.294	17%	0.17	S	C	.	.	H	α-helix	trans	-62.3	-43	176	-67.2	174.6	81.9	-139.8	-3.7	112.4	A186 T189 M205 Q206 V207 L212 E213	A186-R209 PolarHBondContact O-NH2 3Å; T189-R209 PolarHBondContact OG1-NE 3.5Å; M205-R209 WeakPolarHBondContact O-CB 3.13Å; M205-R209 VanDerWaalsContact O-CG 3.23Å; M205-R209 WeakPolarHBondContact O-CG 3.43Å; M205-R209 PolarHBondContact O-N 3.42Å; M205-R209 HydrophobicContact SD-CG 4.4Å; Q206-R209 PolarHBondContact O-N 3.48Å; V207-R209 VanDerWaalsContact C-N 3.3Å; V207-R209 PolarHBondContact O-N 3.47Å; R209-L212 PolarHBondContact O-N 3.48Å; R209-E213 PolarHBondContact O-N 3Å
210	S	94.7	Very high	94	Very high	34 Å²	34	35.4 Å²	35.4	24%	0.238	17%	0.165	C	C	.	.	H	α-helix	trans	-64.8	-39.6	178.3	-176.6	0	0	0	0	112.6	Q206 V207 G208 E213 R214	Q206-S210 WeakPolarHBondContact O-CB 3.48Å; Q206-S210 PolarHBondContact O-N 2.88Å; V207-S210 PolarHBondContact O-N 3.47Å; V207-S210 VanDerWaalsContact O-N 3.12Å; G208-S210 PolarHBondContact O-N 3.16Å; S210-E213 PolarHBondContact O-N 3.4Å; S210-R214 WeakPolarHBondContact O-CB 3.17Å; S210-R214 PolarHBondContact O-N 2.88Å; S210-R214 PolarHBondContact OG-NH2 2.99Å
211	I	94.9	Very high	94.3	Very high	13 Å²	13	34.7 Å²	34.7	7%	0.067	16%	0.164	C	C	.	.	H	α-helix	trans	-63.8	-44.7	175.8	-62.7	165.1	0	0	0	110.2	V207 G208 R214 H215 Q245 A249 H465	V207-I211 HydrophobicContact CG1-CD1 3.79Å; V207-I211 HydrophobicContact CG1-CG1 4.42Å; V207-I211 WeakPolarHBondContact O-CG1 3.2Å; V207-I211 PolarHBondContact O-N 3Å; G208-I211 PolarHBondContact O-N 3.2Å; I211-R214 PolarHBondContact O-N 3.46Å; I211-H215 WeakPolarHBondContact CG2-ND1 3.37Å; I211-H215 WeakPolarHBondContact O-CB 3.36Å; I211-H215 PolarHBondContact O-N 2.94Å; I211-H215 PolarHBondContact O-ND1 3.21Å; I211-Q245 HydrophobicContact CG2-CB 4.37Å; I211-Q245 WeakPolarHBondContact CG2-O 3.33Å; I211-A249 HydrophobicContact CB-CB 3.71Å; I211-A249 HydrophobicContact CG2-CB 3.63Å; I211-H465 WeakPolarHBondContact CG1-CE1 3.47Å
212	L	95.7	Very high	94.5	Very high	6 Å²	6	32.6 Å²	32.6	3%	0.031	16%	0.156	C	C	.	.	H	α-helix	trans	-59.8	-48.7	176.9	-73.8	-177.6	0	0	0	111.9	M182 L185 G208 R209 R214 T216 I246 A249 L250 I253	M182-L212 HydrophobicContact CE-CD1 4.19Å; M182-L212 HydrophobicContact CE-CD2 4.12Å; M182-L212 HydrophobicContact SD-CB 4.25Å; M182-L212 HydrophobicContact SD-CD1 3.83Å; M182-L212 HydrophobicContact SD-CG 4.48Å; L185-L212 HydrophobicContact CD2-CD1 4Å; G208-L212 WeakPolarHBondContact O-CG 3.32Å; G208-L212 PolarHBondContact O-N 3.37Å; G208-L212 VanDerWaalsContact O-N 3.09Å; R209-L212 PolarHBondContact O-N 3.48Å; L212-R214 PolarHBondContact O-N 2.91Å; L212-T216 WeakPolarHBondContact O-CB 3.25Å; L212-T216 PolarHBondContact O-N 3.1Å; L212-T216 PolarHBondContact O-OG1 2.87Å; L212-I246 HydrophobicContact CD2-CB 4.5Å; L212-I246 HydrophobicContact CD2-CG2 3.73Å; L212-A249 HydrophobicContact CD2-CB 3.7Å; L212-A249 HydrophobicContact CG-CB 3.75Å; L212-L250 HydrophobicContact CD1-CD2 4Å; L212-L250 HydrophobicContact CD2-CD2 3.87Å; L212-L250 HydrophobicContact CD2-CG 4.09Å; L212-I253 HydrophobicContact CD1-CD1 3.3Å; L212-I253 HydrophobicContact CG-CD1 4.18Å
213	E	93.7	Very high	94.6	Very high	135 Å²	135	29.1 Å²	29.1	63%	0.631	14%	0.144	S	C	*	.	H	α-helix	trans	-57.5	-51.3	178.7	-176.6	175.8	-169.4	0	0	111.1	R209 S210 M217	R209-E213 PolarHBondContact O-N 3Å; S210-E213 PolarHBondContact O-N 3.4Å; E213-M217 WeakPolarHBondContact O-CG 3.43Å; E213-M217 PolarHBondContact O-N 3.49Å
214	R	93.8	Very high	94.5	Very high	28 Å²	28	31.8 Å²	31.8	11%	0.106	15%	0.154	C	C	.	.	H	α-helix	trans	-60.4	-52	-179.3	-171.1	179.3	-60.7	99.7	10.2	112.6	S210 I211 L212 M217 L218 T503	S210-R214 WeakPolarHBondContact O-CB 3.17Å; S210-R214 PolarHBondContact O-N 2.88Å; S210-R214 PolarHBondContact OG-NH2 2.99Å; I211-R214 PolarHBondContact O-N 3.46Å; L212-R214 PolarHBondContact O-N 2.91Å; R214-M217 PolarHBondContact O-N 3.17Å; R214-L218 PolarHBondContact O-N 3.37Å; R214-T503 HydrophobicContact CG-CG2 3.54Å
215	H	95.4	Very high	94.6	Very high	4 Å²	4	31.8 Å²	31.8	2%	0.019	15%	0.154	C	C	.	.	H	α-helix	trans	-78.8	-22.7	-173	-67.7	85.8	0	0	0	113.1	I211 M217 L218 L219 V242 Q245 I246	I211-H215 WeakPolarHBondContact CG2-ND1 3.37Å; I211-H215 WeakPolarHBondContact O-CB 3.36Å; I211-H215 PolarHBondContact O-N 2.94Å; I211-H215 PolarHBondContact O-ND1 3.21Å; H215-M217 VanDerWaalsContact C-N 3.31Å; H215-L218 PolarHBondContact O-N 3.45Å; H215-L219 PolarHBondContact O-N 2.95Å; H215-V242 HydrophobicContact CB-CG1 4.24Å; H215-V242 WeakPolarHBondContact O-CG1 3.26Å; H215-Q245 HydrophobicContact CB-CB 4.47Å; H215-Q245 WeakPolarHBondContact CD2-CB 3.14Å; H215-Q245 WeakPolarHBondContact NE2-CB 3.28Å; H215-Q245 WeakPolarHBondContact NE2-CG 3.38Å; H215-I246 HydrophobicContact CB-CD1 4.22Å; H215-I246 HydrophobicContact CB-CG1 3.6Å
216	T	93.7	Very high	94.6	Very high	24 Å²	24	32.2 Å²	32.2	15%	0.147	16%	0.158	C	C	.	.	H	α-helix	trans	-63.8	-38.6	169.9	-62.7	0	0	0	0	111.2	F178 L212 L218 L219	F178-T216 HydrophobicContact CE1-CG2 3.98Å; L212-T216 WeakPolarHBondContact O-CB 3.25Å; L212-T216 PolarHBondContact O-N 3.1Å; L212-T216 PolarHBondContact O-OG1 2.87Å; T216-L218 VanDerWaalsContact C-N 3.32Å; T216-L218 PolarHBondContact O-N 2.79Å; T216-L219 WeakPolarHBondContact O-CB 3.43Å; T216-L219 PolarHBondContact O-N 3.45Å
217	M	90.3	Very high	94.5	Very high	103 Å²	103	31.3 Å²	31.3	51%	0.507	16%	0.156	S	C	.	.	H	α-helix	trans	-64	-36.9	174.5	-65.7	-173.5	-70.5	0	0	112.3	E213 R214 H215 L219	E213-M217 WeakPolarHBondContact O-CG 3.43Å; E213-M217 PolarHBondContact O-N 3.49Å; R214-M217 PolarHBondContact O-N 3.17Å; H215-M217 VanDerWaalsContact C-N 3.31Å; M217-L219 VanDerWaalsContact C-N 3.35Å
218	L	95.9	Very high	94.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-76.3	-20.1	178.6	-62.8	178.3	0	0	0	113.8	R214 H215 T216 L220 T221 S222 V242 L473 V499 F500 T503	R214-L218 PolarHBondContact O-N 3.37Å; H215-L218 PolarHBondContact O-N 3.45Å; T216-L218 VanDerWaalsContact C-N 3.32Å; T216-L218 PolarHBondContact O-N 2.79Å; L218-L220 VanDerWaalsContact C-N 3.34Å; L218-L220 PolarHBondContact O-N 2.91Å; L218-T221 PolarHBondContact O-N 3.25Å; L218-T221 PolarHBondContact O-OG1 2.98Å; L218-S222 VanDerWaalsContact O-CB 3.29Å; L218-S222 WeakPolarHBondContact O-CB 3.46Å; L218-S222 PolarHBondContact O-N 2.72Å; L218-S222 PolarHBondContact O-OG 2.92Å; L218-V242 HydrophobicContact CB-CG1 4.21Å; L218-V242 HydrophobicContact CB-CG2 4.05Å; L218-V242 HydrophobicContact CD1-CG2 4.49Å; L218-L473 HydrophobicContact CD1-CD1 4.41Å; L218-V499 HydrophobicContact CD2-CG1 3.79Å; L218-F500 HydrophobicContact CB-CZ 4.26Å; L218-F500 HydrophobicContact CD1-CD1 4.27Å; L218-F500 HydrophobicContact CD1-CE1 3.63Å; L218-F500 HydrophobicContact CD1-CZ 4.12Å; L218-F500 HydrophobicContact CD2-CD1 4.07Å; L218-F500 HydrophobicContact CD2-CD2 4.49Å; L218-F500 HydrophobicContact CD2-CE1 3.88Å; L218-F500 HydrophobicContact CD2-CE2 4.29Å; L218-F500 HydrophobicContact CD2-CG 4.36Å; L218-F500 HydrophobicContact CD2-CZ 3.98Å; L218-F500 HydrophobicContact CG-CE1 4.24Å; L218-F500 HydrophobicContact CG-CZ 4.36Å; L218-T503 HydrophobicContact CD1-CG2 4.22Å; L218-T503 HydrophobicContact CD2-CG2 4.35Å; L218-T503 WeakPolarHBondContact CD2-OG1 3.28Å; L218-T503 HydrophobicContact CG-CG2 4.5Å
219	L	94.7	Very high	94.4	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-63.3	-39.7	-173.2	-173.5	63.5	0	0	0	112.2	L159 L162 F175 F178 H215 T216 M217 S222 S223 V242 F243 I246	L159-L219 HydrophobicContact CD1-CD2 4.41Å; L162-L219 HydrophobicContact CD1-CD2 4.16Å; F175-L219 HydrophobicContact CD2-CD2 4.06Å; F175-L219 HydrophobicContact CD2-CG 4.38Å; F175-L219 HydrophobicContact CE2-CB 4.07Å; F175-L219 HydrophobicContact CE2-CD2 3.88Å; F175-L219 HydrophobicContact CE2-CG 4.09Å; F178-L219 HydrophobicContact CD1-CD2 4.27Å; F178-L219 HydrophobicContact CE1-CD2 3.95Å; F178-L219 HydrophobicContact CZ-CD2 4.34Å; H215-L219 PolarHBondContact O-N 2.95Å; T216-L219 WeakPolarHBondContact O-CB 3.43Å; T216-L219 PolarHBondContact O-N 3.45Å; M217-L219 VanDerWaalsContact C-N 3.35Å; L219-S222 PolarHBondContact O-OG 3.45Å; L219-S223 WeakPolarHBondContact O-CB 3.48Å; L219-S223 PolarHBondContact O-N 3.37Å; L219-S223 VanDerWaalsContact O-N 3.09Å; L219-S223 PolarHBondContact O-OG 3.44Å; L219-V242 HydrophobicContact CB-CG1 4.31Å; L219-V242 HydrophobicContact CD1-CG1 4.09Å; L219-F243 HydrophobicContact CD1-CD2 3.72Å; L219-F243 HydrophobicContact CD1-CE1 4.28Å; L219-F243 HydrophobicContact CD1-CE2 3.25Å; L219-F243 HydrophobicContact CD1-CG 4.46Å; L219-F243 HydrophobicContact CD1-CZ 3.56Å; L219-I246 HydrophobicContact CD1-CD1 4.2Å; L219-I246 HydrophobicContact CD2-CD1 4.14Å
220	L	93.6	Very high	94.2	Very high	68 Å²	68	40 Å²	40	36%	0.356	20%	0.199	S	C	.	.	H	α-helix	trans	-65.9	-52	179.3	174.7	60.6	0	0	0	111.6	F171 F175 L218 K224	F171-L220 HydrophobicContact CE1-CD1 3.67Å; F171-L220 HydrophobicContact CZ-CD1 4.44Å; F175-L220 HydrophobicContact CE2-CB 4.34Å; F175-L220 HydrophobicContact CZ-CB 4.07Å; L218-L220 VanDerWaalsContact C-N 3.34Å; L218-L220 PolarHBondContact O-N 2.91Å; L220-K224 WeakPolarHBondContact O-CB 3.3Å; L220-K224 PolarHBondContact O-N 2.82Å
221	T	94.4	Very high	94.3	Very high	23 Å²	23	45.8 Å²	45.8	14%	0.141	23%	0.227	C	C	.	.	H	α-helix	trans	-68.2	-43.6	-175.6	50.3	0	0	0	0	111.7	L218 T225 N496 V499	L218-T221 PolarHBondContact O-N 3.25Å; L218-T221 PolarHBondContact O-OG1 2.98Å; T221-T225 WeakPolarHBondContact O-CB 3.33Å; T221-T225 PolarHBondContact O-N 2.88Å; T221-T225 PolarHBondContact O-OG1 3.16Å; T221-N496 VanDerWaalsContact C-OD1 3.23Å; T221-N496 WeakPolarHBondContact CB-OD1 3.37Å; T221-N496 PolarHBondContact O-OD1 3.45Å; T221-N496 PolarHBondContact OG1-OD1 3.49Å; T221-V499 HydrophobicContact CG2-CB 4.27Å; T221-V499 HydrophobicContact CG2-CG1 4.25Å; T221-V499 HydrophobicContact CG2-CG2 4.03Å
222	S	95.7	Very high	94.3	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.007	23%	0.226	C	C	.	.	H	α-helix	trans	-62.8	-45.8	176.9	58.5	0	0	0	0	112.3	L218 L219 T225 A226 N496	L218-S222 VanDerWaalsContact O-CB 3.29Å; L218-S222 WeakPolarHBondContact O-CB 3.46Å; L218-S222 PolarHBondContact O-N 2.72Å; L218-S222 PolarHBondContact O-OG 2.92Å; L219-S222 PolarHBondContact O-OG 3.45Å; S222-T225 PolarHBondContact O-N 3.39Å; S222-A226 WeakPolarHBondContact O-CB 3.34Å; S222-A226 PolarHBondContact O-N 2.94Å; S222-N496 PolarHBondContact N-OD1 2.99Å
223	S	94.9	Very high	94.4	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.014	25%	0.25	C	C	.	.	H	α-helix	trans	-68.6	-41.7	179.2	-57.5	0	0	0	0	112.4	F171 L219 T225 A226 L227	F171-S223 WeakPolarHBondContact CE2-OG 3.39Å; F171-S223 VanDerWaalsContact CZ-CB 3.48Å; L219-S223 WeakPolarHBondContact O-CB 3.48Å; L219-S223 PolarHBondContact O-N 3.37Å; L219-S223 VanDerWaalsContact O-N 3.09Å; L219-S223 PolarHBondContact O-OG 3.44Å; S223-T225 VanDerWaalsContact C-N 3.29Å; S223-T225 PolarHBondContact O-N 3.22Å; S223-A226 PolarHBondContact O-N 3.03Å; S223-L227 WeakPolarHBondContact O-CB 3.42Å; S223-L227 WeakPolarHBondContact O-CG 3.25Å; S223-L227 PolarHBondContact O-N 3.31Å
224	K	93.4	Very high	94.6	Very high	60 Å²	60	44.8 Å²	44.8	26%	0.261	22%	0.224	S	C	.	.	H	α-helix	trans	-59.8	-40.7	174.1	-175.7	-172.1	178.8	-166.3	0	111.3	F168 L220 R228 I492 E495	F168-K224 HydrophobicContact CE2-CB 4.16Å; F168-K224 HydrophobicContact CE2-CG 3.99Å; L220-K224 WeakPolarHBondContact O-CB 3.3Å; L220-K224 PolarHBondContact O-N 2.82Å; K224-R228 WeakPolarHBondContact O-CB 3.49Å; K224-R228 PolarHBondContact O-N 3.32Å; K224-I492 HydrophobicContact CD-CG2 4.17Å; K224-I492 HydrophobicContact CG-CD1 4.34Å; K224-I492 HydrophobicContact CG-CG2 3.98Å; K224-E495 IonicContact NZ-OE2 3.01Å; K224-E495 PolarHBondContact NZ-OE2 3.17Å
225	T	95.1	Very high	94.7	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.006	22%	0.219	C	C	.	.	H	α-helix	trans	-67.7	-46.4	178.2	-55.7	0	0	0	0	111.5	T221 S222 S223 L227 R228 H229 A235 T483 N496	T221-T225 WeakPolarHBondContact O-CB 3.33Å; T221-T225 PolarHBondContact O-N 2.88Å; T221-T225 PolarHBondContact O-OG1 3.16Å; S222-T225 PolarHBondContact O-N 3.39Å; S223-T225 VanDerWaalsContact C-N 3.29Å; S223-T225 PolarHBondContact O-N 3.22Å; T225-L227 VanDerWaalsContact C-N 3.34Å; T225-L227 PolarHBondContact O-N 2.88Å; T225-R228 PolarHBondContact O-N 3Å; T225-H229 PolarHBondContact O-N 3.44Å; T225-A235 HydrophobicContact CG2-CB 4.04Å; T225-T483 HydrophobicContact CG2-CG2 3.77Å; T225-N496 WeakPolarHBondContact OG1-CB 3.46Å
226	A	94.6	Very high	94.7	Very high	10 Å²	10	49.3 Å²	49.3	8%	0.083	24%	0.241	C	C	.	.	H	α-helix	trans	-64.2	-35.2	177.3	0	0	0	0	0	113.1	S222 S223 H229 P230 K239	S222-A226 WeakPolarHBondContact O-CB 3.34Å; S222-A226 PolarHBondContact O-N 2.94Å; S223-A226 PolarHBondContact O-N 3.03Å; A226-H229 CarbonylContact O-C 3Å; A226-P230 WeakPolarHBondContact O-CA 3.36Å; A226-K239 HydrophobicContact CB-CB 4.29Å; A226-K239 HydrophobicContact CB-CD 4.08Å
227	L	93	Very high	94.8	Very high	64 Å²	64	52.2 Å²	52.2	34%	0.335	25%	0.253	S	S	.	.	H	α-helix	trans	-70.7	-32	173.8	-76.7	170.9	0	0	0	112.7	P165 F168 F171 S223 T225	P165-L227 HydrophobicContact CG-CD1 4.27Å; P165-L227 HydrophobicContact CG-CD2 4.39Å; F168-L227 HydrophobicContact CB-CD1 4.49Å; F168-L227 HydrophobicContact CD2-CD1 4.07Å; F171-L227 HydrophobicContact CB-CD1 4.27Å; F171-L227 HydrophobicContact CG-CD1 4.49Å; S223-L227 WeakPolarHBondContact O-CB 3.42Å; S223-L227 WeakPolarHBondContact O-CG 3.25Å; S223-L227 PolarHBondContact O-N 3.31Å; T225-L227 VanDerWaalsContact C-N 3.34Å; T225-L227 PolarHBondContact O-N 2.88Å
228	R	94.1	Very high	95.1	Very high	163 Å²	163	47.4 Å²	47.4	62%	0.615	23%	0.229	S	C	*	.	H	α-helix	trans	-75	-38	178	-178.9	59.8	176.5	165.5	1.2	112.1	K224 T225 P230 I492	K224-R228 WeakPolarHBondContact O-CB 3.49Å; K224-R228 PolarHBondContact O-N 3.32Å; T225-R228 PolarHBondContact O-N 3Å; R228-P230 VanDerWaalsContact C-CD 3.5Å; R228-P230 WeakPolarHBondContact O-CD 3.43Å; R228-I492 HydrophobicContact CB-CD1 4.09Å; R228-I492 HydrophobicContact CG-CD1 3.92Å
229	H	94.9	Very high	95.1	Very high	27 Å²	27	49.3 Å²	49.3	13%	0.125	24%	0.238	C	C	.	.			trans	-125.4	70	-175.1	-54.8	-60.1	0	0	0	110.2	T225 A226 D231 C232 H487 S490	T225-H229 PolarHBondContact O-N 3.44Å; A226-H229 CarbonylContact O-C 3Å; H229-D231 PolarHBondContact O-N 3.18Å; H229-C232 HydrophobicContact CB-CB 3.82Å; H229-C232 WeakPolarHBondContact O-CB 3.43Å; H229-C232 PolarHBondContact O-N 2.95Å; H229-H487 AromaticContact CD2-CD2 3.73Å; H229-H487 AromaticContact CE1-CD2 3.95Å; H229-H487 AromaticContact CE1-CG 3.69Å; H229-H487 AromaticContact CG-CD2 3.71Å; H229-H487 AromaticContact CG-NE2 3.88Å; H229-H487 AromaticContact ND1-CD2 3.9Å; H229-H487 AromaticContact ND1-CG 3.96Å; H229-H487 AromaticContact NE2-CD2 3.87Å; H229-H487 AromaticContact NE2-CG 3.86Å; H229-S490 WeakPolarHBondContact NE2-CB 3.41Å; H229-S490 PolarHBondContact NE2-OG 3.42Å
230	P	92.5	Very high	95.1	Very high	74 Å²	74	52 Å²	52	48%	0.481	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-29.5	-173.1	24.5	-34.6	0	0	0	113.5	A226 R228 C232	A226-P230 WeakPolarHBondContact O-CA 3.36Å; R228-P230 VanDerWaalsContact C-CD 3.5Å; R228-P230 WeakPolarHBondContact O-CD 3.43Å; P230-C232 VanDerWaalsContact C-N 3.32Å
231	D	95	Very high	95.2	Very high	155 Å²	155	50.7 Å²	50.7	83%	0.829	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-9.6	179.9	-55.3	-42.8	0	0	0	113	H229 E233	H229-D231 PolarHBondContact O-N 3.18Å; D231-E233 PolarHBondContact O-N 2.68Å
232	C	96.3	Very high	95.3	Very high	7 Å²	7	49.6 Å²	49.6	5%	0.047	24%	0.24	C	C	.	.			trans	-78.1	106.1	179.2	-175.2	0	0	0	0	110.5	H229 P230 A234 A235 R236	H229-C232 HydrophobicContact CB-CB 3.82Å; H229-C232 WeakPolarHBondContact O-CB 3.43Å; H229-C232 PolarHBondContact O-N 2.95Å; P230-C232 VanDerWaalsContact C-N 3.32Å; C232-A234 VanDerWaalsContact C-N 3.31Å; C232-A234 PolarHBondContact O-N 2.69Å; C232-A235 HydrophobicContact CB-CB 3.92Å; C232-A235 PolarHBondContact O-N 3.2Å; C232-R236 PolarHBondContact O-N 3.43Å; C232-R236 VanDerWaalsContact O-N 3.16Å
233	E	97	Very high	95.2	Very high	115 Å²	115	49.5 Å²	49.5	54%	0.537	24%	0.239	S	C	.	.	H	α-helix	trans	-58.7	-42.5	178.7	-169.2	-176.6	166.5	0	0	112.2	D231 A235 R236 Q237	D231-E233 PolarHBondContact O-N 2.68Å; E233-A235 VanDerWaalsContact C-N 3.34Å; E233-A235 PolarHBondContact O-N 3.46Å; E233-R236 PolarHBondContact O-N 3.04Å; E233-R236 VanDerWaalsContact O-N 3.15Å; E233-Q237 HydrophobicContact CG-CG 4.33Å; E233-Q237 WeakPolarHBondContact O-CG 3.16Å; E233-Q237 PolarHBondContact O-N 3.3Å; E233-Q237 PolarHBondContact OE1-NE2 3.32Å
234	A	97.4	Very high	95.1	Very high	11 Å²	11	54.4 Å²	54.4	9%	0.091	26%	0.257	C	S	.	.	H	α-helix	trans	-58.8	-44.3	178.3	0	0	0	0	0	111.9	C232 R236 Q237 I238 L479 T483	C232-A234 VanDerWaalsContact C-N 3.31Å; C232-A234 PolarHBondContact O-N 2.69Å; A234-R236 VanDerWaalsContact C-N 3.35Å; A234-R236 PolarHBondContact O-N 2.93Å; A234-Q237 PolarHBondContact O-N 3.24Å; A234-I238 VanDerWaalsContact O-CG1 3.27Å; A234-I238 WeakPolarHBondContact O-CG1 3.23Å; A234-I238 PolarHBondContact O-N 3Å; A234-L479 HydrophobicContact CB-CB 4.43Å; A234-L479 HydrophobicContact CB-CD2 3.93Å; A234-T483 WeakPolarHBondContact CB-OG1 3.4Å
235	A	96.8	Very high	95.1	Very high	1 Å²	1	53 Å²	53	1%	0.008	25%	0.252	C	S	.	.	H	α-helix	trans	-62.5	-39.9	176.5	0	0	0	0	0	112.4	T225 C232 E233 K239 T483	T225-A235 HydrophobicContact CG2-CB 4.04Å; C232-A235 HydrophobicContact CB-CB 3.92Å; C232-A235 PolarHBondContact O-N 3.2Å; E233-A235 VanDerWaalsContact C-N 3.34Å; E233-A235 PolarHBondContact O-N 3.46Å; A235-K239 PolarHBondContact O-N 2.96Å; A235-K239 VanDerWaalsContact O-N 3.13Å; A235-T483 HydrophobicContact CB-CG2 4.15Å
236	R	95.3	Very high	95.1	Very high	126 Å²	126	53 Å²	53	48%	0.475	25%	0.252	S	S	.	.	H	α-helix	trans	-65.3	-44.9	175.3	-69.1	-170.4	-65.9	121.6	0.6	111.7	C232 E233 A234 I238 K239 T240	C232-R236 PolarHBondContact O-N 3.43Å; C232-R236 VanDerWaalsContact O-N 3.16Å; E233-R236 PolarHBondContact O-N 3.04Å; E233-R236 VanDerWaalsContact O-N 3.15Å; A234-R236 VanDerWaalsContact C-N 3.35Å; A234-R236 PolarHBondContact O-N 2.93Å; R236-I238 PolarHBondContact O-N 2.63Å; R236-K239 PolarHBondContact O-N 2.98Å; R236-T240 PolarHBondContact O-N 3.45Å; R236-T240 PolarHBondContact O-OG1 2.88Å
237	Q	96.4	Very high	95	Very high	86 Å²	86	53.4 Å²	53.4	40%	0.402	25%	0.251	S	S	.	.	H	α-helix	trans	-60.8	-43.8	177.7	-71.3	-177	21.4	0	0	111.8	E233 A234 K239 T240 Q241 L479	E233-Q237 HydrophobicContact CG-CG 4.33Å; E233-Q237 WeakPolarHBondContact O-CG 3.16Å; E233-Q237 PolarHBondContact O-N 3.3Å; E233-Q237 PolarHBondContact OE1-NE2 3.32Å; A234-Q237 PolarHBondContact O-N 3.24Å; Q237-K239 PolarHBondContact O-N 3.05Å; Q237-T240 PolarHBondContact O-N 3.43Å; Q237-Q241 PolarHBondContact O-N 3.26Å; Q237-L479 HydrophobicContact CB-CD1 3.93Å
238	I	97	Very high	94.8	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-57	-52	175.2	-66.7	165.4	0	0	0	110.2	A234 R236 T240 Q241 V242 L476 L479 A480 F500	A234-I238 VanDerWaalsContact O-CG1 3.27Å; A234-I238 WeakPolarHBondContact O-CG1 3.23Å; A234-I238 PolarHBondContact O-N 3Å; R236-I238 PolarHBondContact O-N 2.63Å; I238-T240 PolarHBondContact O-N 3.11Å; I238-Q241 PolarHBondContact O-N 3.17Å; I238-V242 HydrophobicContact CG2-CG2 4.42Å; I238-V242 WeakPolarHBondContact O-CG2 3.28Å; I238-V242 PolarHBondContact O-N 3.01Å; I238-L476 HydrophobicContact CB-CD2 4.4Å; I238-L476 HydrophobicContact CG1-CD2 4.29Å; I238-L476 HydrophobicContact CG2-CD2 4.41Å; I238-L479 HydrophobicContact CD1-CB 3.8Å; I238-L479 HydrophobicContact CG1-CB 3.58Å; I238-L479 HydrophobicContact CG1-CD1 4.19Å; I238-A480 HydrophobicContact CD1-CB 4.11Å; I238-F500 HydrophobicContact CG2-CE1 4.25Å; I238-F500 HydrophobicContact CG2-CE2 3.61Å; I238-F500 HydrophobicContact CG2-CZ 3.31Å
239	K	95.3	Very high	94.8	Very high	40 Å²	40	44.5 Å²	44.5	17%	0.174	22%	0.219	C	C	.	.	H	α-helix	trans	-54.9	-54.6	178.3	-170.4	-171.4	72.5	168	0	110.2	E163 A226 A235 R236 Q237 Q241 V242 F243	E163-K239 PolarHBondContact O-NZ 3.03Å; A226-K239 HydrophobicContact CB-CB 4.29Å; A226-K239 HydrophobicContact CB-CD 4.08Å; A235-K239 PolarHBondContact O-N 2.96Å; A235-K239 VanDerWaalsContact O-N 3.13Å; R236-K239 PolarHBondContact O-N 2.98Å; Q237-K239 PolarHBondContact O-N 3.05Å; K239-Q241 VanDerWaalsContact C-N 3.29Å; K239-Q241 PolarHBondContact O-N 2.89Å; K239-V242 PolarHBondContact O-N 3.06Å; K239-V242 VanDerWaalsContact O-N 3.13Å; K239-F243 HydrophobicContact CD-CE2 4.13Å; K239-F243 HydrophobicContact CG-CD2 3.91Å; K239-F243 HydrophobicContact CG-CE2 3.62Å; K239-F243 VanDerWaalsContact O-CD2 3.24Å; K239-F243 WeakPolarHBondContact O-CD2 3.42Å; K239-F243 PolarHBondContact O-N 3.39Å; K239-F243 VanDerWaalsContact O-N 3.08Å
240	T	94.6	Very high	94.7	Very high	57 Å²	57	43.2 Å²	43.2	35%	0.35	21%	0.213	S	C	.	.	H	α-helix	trans	-56.3	-41.3	-178.8	-63.7	0	0	0	0	112.8	R236 Q237 I238 F243 R244	R236-T240 PolarHBondContact O-N 3.45Å; R236-T240 PolarHBondContact O-OG1 2.88Å; Q237-T240 PolarHBondContact O-N 3.43Å; I238-T240 PolarHBondContact O-N 3.11Å; T240-F243 PolarHBondContact O-N 3.44Å; T240-R244 WeakPolarHBondContact O-CB 3.32Å; T240-R244 PolarHBondContact O-N 3.31Å
241	Q	95.1	Very high	94.5	Very high	40 Å²	40	40.8 Å²	40.8	19%	0.187	20%	0.195	C	C	.	.	H	α-helix	trans	-68.8	-40.3	178.4	-175.8	64.8	5.4	0	0	112.2	Q237 I238 K239 F243 R244 Q245 L476	Q237-Q241 PolarHBondContact O-N 3.26Å; I238-Q241 PolarHBondContact O-N 3.17Å; K239-Q241 VanDerWaalsContact C-N 3.29Å; K239-Q241 PolarHBondContact O-N 2.89Å; Q241-F243 VanDerWaalsContact C-N 3.31Å; Q241-F243 PolarHBondContact O-N 3.31Å; Q241-R244 WeakPolarHBondContact O-CB 3.34Å; Q241-R244 PolarHBondContact O-N 2.87Å; Q241-R244 VanDerWaalsContact O-N 3.17Å; Q241-Q245 HydrophobicContact CG-CG 4.45Å; Q241-Q245 VanDerWaalsContact O-CG 3.31Å; Q241-Q245 WeakPolarHBondContact O-CG 3.43Å; Q241-Q245 PolarHBondContact O-N 3.28Å; Q241-L476 HydrophobicContact CB-CD1 4.47Å; Q241-L476 HydrophobicContact CB-CD2 3.67Å; Q241-L476 HydrophobicContact CG-CD1 3.95Å; Q241-L476 HydrophobicContact CG-CD2 3.75Å; Q241-L476 HydrophobicContact CG-CG 4.19Å
242	V	96.1	Very high	94.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-58.4	-44.7	175.2	172.2	0	0	0	0	110.6	H215 L218 L219 I238 K239 Q245 I246 F500	H215-V242 HydrophobicContact CB-CG1 4.24Å; H215-V242 WeakPolarHBondContact O-CG1 3.26Å; L218-V242 HydrophobicContact CB-CG1 4.21Å; L218-V242 HydrophobicContact CB-CG2 4.05Å; L218-V242 HydrophobicContact CD1-CG2 4.49Å; L219-V242 HydrophobicContact CB-CG1 4.31Å; L219-V242 HydrophobicContact CD1-CG1 4.09Å; I238-V242 HydrophobicContact CG2-CG2 4.42Å; I238-V242 WeakPolarHBondContact O-CG2 3.28Å; I238-V242 PolarHBondContact O-N 3.01Å; K239-V242 PolarHBondContact O-N 3.06Å; K239-V242 VanDerWaalsContact O-N 3.13Å; V242-Q245 PolarHBondContact O-N 3.32Å; V242-I246 HydrophobicContact CG1-CD1 4.25Å; V242-I246 WeakPolarHBondContact O-CG1 3.34Å; V242-I246 PolarHBondContact O-N 2.7Å; V242-I246 VanDerWaalsContact O-N 3.14Å; V242-F500 HydrophobicContact CG2-CZ 4.22Å
243	F	94.5	Very high	94	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.9	-42	175.3	-83	-104.5	0	0	0	112.5	L159 L162 E163 L219 K239 T240 Q241 Q245 I246 R247	L159-F243 HydrophobicContact CD1-CD1 3.63Å; L159-F243 HydrophobicContact CD1-CE1 3.68Å; L159-F243 HydrophobicContact CD1-CG 4.48Å; L159-F243 HydrophobicContact CG-CD1 3.89Å; L159-F243 HydrophobicContact CG-CE1 4.16Å; L159-F243 WeakPolarHBondContact O-CE1 3.41Å; L162-F243 HydrophobicContact CB-CE1 3.91Å; L162-F243 HydrophobicContact CB-CZ 3.97Å; L162-F243 WeakPolarHBondContact O-CZ 3.27Å; E163-F243 VanDerWaalsContact CA-CE1 3.49Å; E163-F243 HydrophobicContact CB-CD1 4.01Å; E163-F243 HydrophobicContact CB-CE1 3.69Å; E163-F243 HydrophobicContact CB-CZ 4.21Å; E163-F243 HydrophobicContact CG-CD1 4.17Å; E163-F243 HydrophobicContact CG-CE1 4.24Å; L219-F243 HydrophobicContact CD1-CD2 3.72Å; L219-F243 HydrophobicContact CD1-CE1 4.28Å; L219-F243 HydrophobicContact CD1-CE2 3.25Å; L219-F243 HydrophobicContact CD1-CG 4.46Å; L219-F243 HydrophobicContact CD1-CZ 3.56Å; K239-F243 HydrophobicContact CD-CE2 4.13Å; K239-F243 HydrophobicContact CG-CD2 3.91Å; K239-F243 HydrophobicContact CG-CE2 3.62Å; K239-F243 VanDerWaalsContact O-CD2 3.24Å; K239-F243 WeakPolarHBondContact O-CD2 3.42Å; K239-F243 PolarHBondContact O-N 3.39Å; K239-F243 VanDerWaalsContact O-N 3.08Å; T240-F243 PolarHBondContact O-N 3.44Å; Q241-F243 VanDerWaalsContact C-N 3.31Å; Q241-F243 PolarHBondContact O-N 3.31Å; F243-Q245 VanDerWaalsContact C-N 3.33Å; F243-Q245 PolarHBondContact O-N 3.1Å; F243-I246 PolarHBondContact O-N 2.69Å; F243-R247 WeakPolarHBondContact O-CG 3.41Å; F243-R247 PolarHBondContact O-N 3.36Å
244	R	92.7	Very high	93.6	Very high	104 Å²	104	28 Å²	28	39%	0.392	13%	0.131	S	C	.	.	H	α-helix	trans	-59.5	-43.2	176.6	-175.8	-177.4	-71.3	117.2	-2.8	111.7	T240 Q241 R247 S248	T240-R244 WeakPolarHBondContact O-CB 3.32Å; T240-R244 PolarHBondContact O-N 3.31Å; Q241-R244 WeakPolarHBondContact O-CB 3.34Å; Q241-R244 PolarHBondContact O-N 2.87Å; Q241-R244 VanDerWaalsContact O-N 3.17Å; R244-R247 PolarHBondContact O-N 3.5Å; R244-S248 PolarHBondContact O-N 3.49Å
245	Q	93.7	Very high	93	Very high	32 Å²	32	28.6 Å²	28.6	15%	0.15	13%	0.132	C	C	.	.	H	α-helix	trans	-64.7	-42.2	178.7	-69.5	-65.7	-33.8	0	0	112.2	I211 H215 Q241 V242 F243 R247 S248 A249	I211-Q245 HydrophobicContact CG2-CB 4.37Å; I211-Q245 WeakPolarHBondContact CG2-O 3.33Å; H215-Q245 HydrophobicContact CB-CB 4.47Å; H215-Q245 WeakPolarHBondContact CD2-CB 3.14Å; H215-Q245 WeakPolarHBondContact NE2-CB 3.28Å; H215-Q245 WeakPolarHBondContact NE2-CG 3.38Å; Q241-Q245 HydrophobicContact CG-CG 4.45Å; Q241-Q245 VanDerWaalsContact O-CG 3.31Å; Q241-Q245 WeakPolarHBondContact O-CG 3.43Å; Q241-Q245 PolarHBondContact O-N 3.28Å; V242-Q245 PolarHBondContact O-N 3.32Å; F243-Q245 VanDerWaalsContact C-N 3.33Å; F243-Q245 PolarHBondContact O-N 3.1Å; Q245-R247 PolarHBondContact O-N 2.89Å; Q245-S248 PolarHBondContact O-N 3.06Å; Q245-A249 PolarHBondContact O-N 3.1Å
246	I	94.8	Very high	92.6	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-61.2	-46.3	174.7	-63.5	170.4	0	0	0	110.3	L159 F178 L212 H215 L219 V242 F243 S248 A249 L250	L159-I246 HydrophobicContact CD1-CD1 4.11Å; L159-I246 HydrophobicContact CD1-CG2 4.13Å; L159-I246 HydrophobicContact CD2-CB 4.03Å; L159-I246 HydrophobicContact CD2-CG2 3.53Å; L159-I246 HydrophobicContact CG-CG2 4.47Å; F178-I246 HydrophobicContact CZ-CG2 4.37Å; L212-I246 HydrophobicContact CD2-CB 4.5Å; L212-I246 HydrophobicContact CD2-CG2 3.73Å; H215-I246 HydrophobicContact CB-CD1 4.22Å; H215-I246 HydrophobicContact CB-CG1 3.6Å; L219-I246 HydrophobicContact CD1-CD1 4.2Å; L219-I246 HydrophobicContact CD2-CD1 4.14Å; V242-I246 HydrophobicContact CG1-CD1 4.25Å; V242-I246 WeakPolarHBondContact O-CG1 3.34Å; V242-I246 PolarHBondContact O-N 2.7Å; V242-I246 VanDerWaalsContact O-N 3.14Å; F243-I246 PolarHBondContact O-N 2.69Å; I246-S248 PolarHBondContact O-N 3.43Å; I246-A249 WeakPolarHBondContact O-CB 3.33Å; I246-A249 PolarHBondContact O-N 2.92Å; I246-A249 VanDerWaalsContact O-N 3.16Å; I246-L250 HydrophobicContact CG2-CD1 4.35Å; I246-L250 WeakPolarHBondContact O-CG 3.49Å; I246-L250 PolarHBondContact O-N 3.49Å
247	R	92.7	Very high	92.2	Very high	18 Å²	18	22.6 Å²	22.6	7%	0.068	11%	0.109	C	C	.	.	H	α-helix	trans	-60.4	-44.7	178	-71.5	176.2	176.6	125	-0.9	112.4	L159 E163 F243 R244 Q245 A249 L250 Q251 F269	L159-R247 HydrophobicContact CD2-CG 3.73Å; E163-R247 IonicContact OE1-CZ 3.83Å; E163-R247 IonicContact OE1-NH1 2.8Å; E163-R247 PolarHBondContact OE1-NH1 3Å; E163-R247 IonicContact OE1-NH2 3.83Å; E163-R247 IonicContact OE2-CZ 3.78Å; E163-R247 IonicContact OE2-NH1 3.5Å; E163-R247 PolarHBondContact OE2-NH1 2.95Å; E163-R247 IonicContact OE2-NH2 2.86Å; E163-R247 PolarHBondContact OE2-NH2 3.38Å; F243-R247 WeakPolarHBondContact O-CG 3.41Å; F243-R247 PolarHBondContact O-N 3.36Å; R244-R247 PolarHBondContact O-N 3.5Å; Q245-R247 PolarHBondContact O-N 2.89Å; R247-A249 VanDerWaalsContact C-N 3.26Å; R247-A249 PolarHBondContact O-N 3.37Å; R247-L250 PolarHBondContact O-N 3Å; R247-Q251 WeakPolarHBondContact O-CG 3.33Å; R247-Q251 PolarHBondContact O-N 3.23Å; R247-F269 HydrophobicContact CB-CD1 4.37Å; R247-F269 HydrophobicContact CG-CD1 4.49Å
248	S	89	Confident	91.5	Very high	41 Å²	41	20 Å²	20	29%	0.287	10%	0.1	S	C	.	.	H	α-helix	trans	-60.6	-36.8	176	-178.9	0	0	0	0	112.2	R244 Q245 I246 L252	R244-S248 PolarHBondContact O-N 3.49Å; Q245-S248 PolarHBondContact O-N 3.06Å; I246-S248 PolarHBondContact O-N 3.43Å; S248-L252 PolarHBondContact O-N 3.47Å
249	A	93.1	Very high	90.1	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-68.5	-40.8	177.3	0	0	0	0	0	112.7	I211 L212 Q245 I246 R247 L252 I253	I211-A249 HydrophobicContact CB-CB 3.71Å; I211-A249 HydrophobicContact CG2-CB 3.63Å; L212-A249 HydrophobicContact CD2-CB 3.7Å; L212-A249 HydrophobicContact CG-CB 3.75Å; Q245-A249 PolarHBondContact O-N 3.1Å; I246-A249 WeakPolarHBondContact O-CB 3.33Å; I246-A249 PolarHBondContact O-N 2.92Å; I246-A249 VanDerWaalsContact O-N 3.16Å; R247-A249 VanDerWaalsContact C-N 3.26Å; R247-A249 PolarHBondContact O-N 3.37Å; A249-L252 PolarHBondContact O-N 3.2Å; A249-I253 WeakPolarHBondContact O-CG1 3.48Å; A249-I253 PolarHBondContact O-N 2.95Å
250	L	93.3	Very high	88.3	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62	-44.3	174.8	-64.4	173.1	0	0	0	111.3	E152 V155 A156 L159 L185 L212 I246 R247 L252 I253 A254 F269	E152-L250 HydrophobicContact CG-CB 3.98Å; E152-L250 HydrophobicContact CG-CD2 3.99Å; E152-L250 HydrophobicContact CG-CG 4.48Å; E152-L250 WeakPolarHBondContact OE1-CB 3.06Å; V155-L250 HydrophobicContact CB-CD2 4.38Å; V155-L250 HydrophobicContact CG1-CD1 3.95Å; V155-L250 HydrophobicContact CG1-CD2 3.79Å; A156-L250 HydrophobicContact CB-CD1 4.06Å; L159-L250 HydrophobicContact CD2-CD1 4.37Å; L185-L250 HydrophobicContact CD2-CD2 3.62Å; L212-L250 HydrophobicContact CD1-CD2 4Å; L212-L250 HydrophobicContact CD2-CD2 3.87Å; L212-L250 HydrophobicContact CD2-CG 4.09Å; I246-L250 HydrophobicContact CG2-CD1 4.35Å; I246-L250 WeakPolarHBondContact O-CG 3.49Å; I246-L250 PolarHBondContact O-N 3.49Å; R247-L250 PolarHBondContact O-N 3Å; L250-L252 VanDerWaalsContact C-N 3.29Å; L250-L252 PolarHBondContact O-N 2.8Å; L250-I253 PolarHBondContact O-N 3.1Å; L250-A254 WeakPolarHBondContact O-CB 3.41Å; L250-A254 PolarHBondContact O-N 3.49Å; L250-F269 HydrophobicContact CB-CE1 4.14Å
251	Q	88.1	Confident	86.6	Confident	22 Å²	22	25.8 Å²	25.8	10%	0.103	14%	0.141	C	C	.	.	H	α-helix	trans	-58.6	-40	173.5	-72	171.3	-14.3	0	0	112.1	R247 A254 L255 F269 F280	R247-Q251 WeakPolarHBondContact O-CG 3.33Å; R247-Q251 PolarHBondContact O-N 3.23Å; Q251-A254 PolarHBondContact O-N 3.32Å; Q251-L255 WeakPolarHBondContact O-CB 3.44Å; Q251-L255 PolarHBondContact O-N 2.93Å; Q251-F269 HydrophobicContact CG-CD1 4.14Å; Q251-F269 HydrophobicContact CG-CD2 3.43Å; Q251-F269 VanDerWaalsContact CG-CD2 3.43Å; Q251-F269 HydrophobicContact CG-CE1 4.13Å; Q251-F269 HydrophobicContact CG-CE2 3.41Å; Q251-F269 VanDerWaalsContact CG-CE2 3.41Å; Q251-F269 HydrophobicContact CG-CG 3.8Å; Q251-F269 HydrophobicContact CG-CZ 3.78Å; Q251-F269 VanDerWaalsContact NE2-CG 3.28Å; Q251-F280 HydrophobicContact CB-CE1 4.18Å; Q251-F280 HydrophobicContact CB-CE2 3.84Å; Q251-F280 HydrophobicContact CB-CZ 3.3Å
252	L	88.9	Confident	84.7	Confident	9 Å²	9	25.4 Å²	25.4	5%	0.047	14%	0.138	C	C	.	.	H	α-helix	trans	-69.7	-39.9	-179	178.4	60.8	0	0	0	110.6	Q204 V207 S248 A249 L250 L255 C256 F280	Q204-L252 HydrophobicContact CB-CD1 4.35Å; V207-L252 HydrophobicContact CB-CD2 4.23Å; V207-L252 HydrophobicContact CG1-CD2 3.75Å; S248-L252 PolarHBondContact O-N 3.47Å; A249-L252 PolarHBondContact O-N 3.2Å; L250-L252 VanDerWaalsContact C-N 3.29Å; L250-L252 PolarHBondContact O-N 2.8Å; L252-L255 HydrophobicContact CD1-CD2 4.33Å; L252-L255 WeakPolarHBondContact O-CB 3.27Å; L252-L255 PolarHBondContact O-N 2.92Å; L252-C256 PolarHBondContact O-N 2.94Å; L252-C256 PolarHBondContact O-SG 3.33Å; L252-F280 HydrophobicContact CB-CE1 4.32Å; L252-F280 HydrophobicContact CB-CZ 4.01Å; L252-F280 HydrophobicContact CD1-CE1 4.4Å
253	I	92.1	Very high	82.6	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-60.3	-49.3	172.7	-72.6	165.6	0	0	0	109.8	I148 T189 M205 L212 A249 L250 L255 C256 V257	I148-I253 HydrophobicContact CG2-CG2 4.5Å; T189-I253 HydrophobicContact CG2-CD1 4.4Å; T189-I253 HydrophobicContact CG2-CG2 3.58Å; M205-I253 HydrophobicContact CE-CG2 4.33Å; M205-I253 HydrophobicContact SD-CB 4.48Å; M205-I253 HydrophobicContact SD-CG1 4.01Å; M205-I253 HydrophobicContact SD-CG2 4.2Å; L212-I253 HydrophobicContact CD1-CD1 3.3Å; L212-I253 HydrophobicContact CG-CD1 4.18Å; A249-I253 WeakPolarHBondContact O-CG1 3.48Å; A249-I253 PolarHBondContact O-N 2.95Å; L250-I253 PolarHBondContact O-N 3.1Å; I253-L255 VanDerWaalsContact C-N 3.31Å; I253-L255 PolarHBondContact O-N 3.03Å; I253-C256 WeakPolarHBondContact O-CB 3.46Å; I253-C256 PolarHBondContact O-N 2.68Å; I253-C256 VanDerWaalsContact O-N 3.08Å; I253-V257 HydrophobicContact CG2-CG2 4.3Å; I253-V257 VanDerWaalsContact O-CG2 3.26Å; I253-V257 WeakPolarHBondContact O-CG2 3.25Å; I253-V257 PolarHBondContact O-N 3.15Å
254	A	89	Confident	80.4	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-58.5	-43	178.2	0	0	0	0	0	112	I149 L250 Q251 C256 V257 C258 Y262	I149-A254 HydrophobicContact CD1-CB 3.88Å; L250-A254 WeakPolarHBondContact O-CB 3.41Å; L250-A254 PolarHBondContact O-N 3.49Å; Q251-A254 PolarHBondContact O-N 3.32Å; A254-C256 VanDerWaalsContact C-N 3.35Å; A254-C256 PolarHBondContact O-N 3.36Å; A254-V257 PolarHBondContact O-N 3.43Å; A254-C258 WeakPolarHBondContact O-CB 3.47Å; A254-C258 PolarHBondContact O-N 2.93Å; A254-Y262 HydrophobicContact CB-CD2 3.97Å; A254-Y262 HydrophobicContact CB-CE2 3.61Å
255	L	85	Confident	78.6	Confident	22 Å²	22	33.7 Å²	33.7	12%	0.115	19%	0.187	C	C	.	.	H	α-helix	trans	-58.5	-44.2	173.6	-174	77.9	0	0	0	112.2	Q251 L252 I253 E259 G260 F280 D281	Q251-L255 WeakPolarHBondContact O-CB 3.44Å; Q251-L255 PolarHBondContact O-N 2.93Å; L252-L255 HydrophobicContact CD1-CD2 4.33Å; L252-L255 WeakPolarHBondContact O-CB 3.27Å; L252-L255 PolarHBondContact O-N 2.92Å; I253-L255 VanDerWaalsContact C-N 3.31Å; I253-L255 PolarHBondContact O-N 3.03Å; L255-E259 PolarHBondContact O-N 3.49Å; L255-E259 VanDerWaalsContact O-N 3.1Å; L255-G260 PolarHBondContact O-N 2.89Å; L255-F280 HydrophobicContact CB-CE1 4.29Å; L255-F280 HydrophobicContact CD2-CD1 4.01Å; L255-F280 HydrophobicContact CD2-CE1 4.03Å; L255-D281 HydrophobicContact CD2-CB 4.02Å
256	C	87.6	Confident	76.5	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-66.4	-38.8	180	-68.6	0	0	0	0	112.4	Q204 M205 L252 I253 A254	Q204-C256 WeakPolarHBondContact CB-SG 3.25Å; M205-C256 HydrophobicContact CB-CB 4.44Å; M205-C256 HydrophobicContact CE-CB 3.72Å; L252-C256 PolarHBondContact O-N 2.94Å; L252-C256 PolarHBondContact O-SG 3.33Å; I253-C256 WeakPolarHBondContact O-CB 3.46Å; I253-C256 PolarHBondContact O-N 2.68Å; I253-C256 VanDerWaalsContact O-N 3.08Å; A254-C256 VanDerWaalsContact C-N 3.35Å; A254-C256 PolarHBondContact O-N 3.36Å
257	V	87.1	Confident	74.3	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.006	23%	0.23	C	C	.	.	H	α-helix	trans	-74	-38.9	-179.3	-179.5	0	0	0	0	111.1	V145 I148 I149 M205 I253 A254 E259	V145-V257 HydrophobicContact CB-CG1 3.86Å; V145-V257 HydrophobicContact CG1-CG1 3.66Å; V145-V257 HydrophobicContact CG2-CG1 3.76Å; I148-V257 HydrophobicContact CB-CG1 4.22Å; I148-V257 HydrophobicContact CB-CG2 4.34Å; I148-V257 HydrophobicContact CD1-CG1 4.05Å; I148-V257 HydrophobicContact CD1-CG2 4.22Å; I148-V257 HydrophobicContact CG2-CG1 4.4Å; I148-V257 HydrophobicContact CG2-CG2 3.68Å; I149-V257 HydrophobicContact CD1-CB 4.49Å; M205-V257 HydrophobicContact CE-CG2 3.65Å; I253-V257 HydrophobicContact CG2-CG2 4.3Å; I253-V257 VanDerWaalsContact O-CG2 3.26Å; I253-V257 WeakPolarHBondContact O-CG2 3.25Å; I253-V257 PolarHBondContact O-N 3.15Å; A254-V257 PolarHBondContact O-N 3.43Å; V257-E259 VanDerWaalsContact C-N 3.25Å; V257-E259 PolarHBondContact O-N 3.03Å
258	C	81.3	Confident	72.4	Confident	32 Å²	32	43.9 Å²	43.9	22%	0.216	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	12.1	177.4	-63	0	0	0	0	113.5	A254 G260 V261 Y262	A254-C258 WeakPolarHBondContact O-CB 3.47Å; A254-C258 PolarHBondContact O-N 2.93Å; C258-G260 PolarHBondContact O-N 3.25Å; C258-G260 VanDerWaalsContact O-N 3.13Å; C258-V261 PolarHBondContact O-N 2.93Å; C258-Y262 HydrophobicContact CB-CD2 4.13Å
259	E	68.2	Low	70.6	Confident	64 Å²	64	42.5 Å²	42.5	30%	0.299	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	25.9	171.4	-49.6	-176.7	149.7	0	0	115.1	K16 R201 L255 V257 V261	K16-E259 WeakPolarHBondContact CB-OE1 3.48Å; K16-E259 HydrophobicContact CD-CG 4.19Å; K16-E259 WeakPolarHBondContact CD-OE1 3.45Å; K16-E259 WeakPolarHBondContact CD-OE2 3.28Å; K16-E259 WeakPolarHBondContact CE-OE2 3.47Å; K16-E259 IonicContact NZ-OE2 2.63Å; K16-E259 PolarHBondContact NZ-OE2 2.82Å; R201-E259 PolarHBondContact NH2-O 2.77Å; L255-E259 PolarHBondContact O-N 3.49Å; L255-E259 VanDerWaalsContact O-N 3.1Å; V257-E259 VanDerWaalsContact C-N 3.25Å; V257-E259 PolarHBondContact O-N 3.03Å; E259-V261 VanDerWaalsContact C-N 3.31Å
260	G	58.2	Low	67.9	Low	33 Å²	33	46.3 Å²	46.3	34%	0.34	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	88	-10	-175.9	0	0	0	0	0	114.7	L255 C258 Y262	L255-G260 PolarHBondContact O-N 2.89Å; C258-G260 PolarHBondContact O-N 3.25Å; C258-G260 VanDerWaalsContact O-N 3.13Å; G260-Y262 PolarHBondContact O-N 3.47Å
261	V	58.6	Low	65.5	Low	122 Å²	122	49.2 Å²	49.2	74%	0.739	28%	0.284	S	S	*	.			trans	-92.7	56.5	171.1	-166.3	0	0	0	0	108.5	C258 E259	C258-V261 PolarHBondContact O-N 2.93Å; E259-V261 VanDerWaalsContact C-N 3.31Å
262	Y	55.8	Low	63.1	Low	33 Å²	33	54.7 Å²	54.7	13%	0.129	32%	0.32	C	S	.	.			trans	-95.9	114.3	169.9	-168.3	-99.5	0	0	0	107.4	A254 C258 G260 Y264 R268	A254-Y262 HydrophobicContact CB-CD2 3.97Å; A254-Y262 HydrophobicContact CB-CE2 3.61Å; C258-Y262 HydrophobicContact CB-CD2 4.13Å; G260-Y262 PolarHBondContact O-N 3.47Å; Y262-Y264 VanDerWaalsContact C-N 3.32Å; Y262-Y264 PolarHBondContact O-N 3.47Å; Y262-R268 WeakPolarHBondContact OH-CD 3.46Å; Y262-R268 PolarHBondContact OH-NH1 3.08Å
263	P	50.1	Low	60.8	Low	94 Å²	94	57.2 Å²	57.2	61%	0.61	33%	0.332	S	S	*	.			trans	-62.5	103	169.7	24.1	-28.2	0	0	0	106.7	D265	P263-D265 PolarHBondContact O-N 3.38Å
264	Y	50.1	Low	58.2	Low	122 Å²	122	64.3 Å²	64.3	48%	0.478	36%	0.363	S	S	.	.			trans	-56	107.4	173.9	176.8	-98.7	0	0	0	107.3	Y262 P266 I273	Y262-Y264 VanDerWaalsContact C-N 3.32Å; Y262-Y264 PolarHBondContact O-N 3.47Å; Y264-P266 HydrophobicContact CD1-CB 4.41Å; Y264-P266 HydrophobicContact CD1-CG 4.1Å; Y264-P266 HydrophobicContact CE1-CB 3.58Å; Y264-P266 HydrophobicContact CE1-CG 3.62Å; Y264-P266 WeakPolarHBondContact O-CD 3.34Å; Y264-I273 HydrophobicContact CE2-CD1 4.22Å; Y264-I273 VanDerWaalsContact OH-CD1 3.25Å; Y264-I273 WeakPolarHBondContact OH-CD1 3.47Å
265	D	54	Low	55.6	Low	61 Å²	61	70.6 Å²	70.6	33%	0.326	40%	0.404	S	S	.	.			trans	-108.3	96.8	172.5	-174	-6.1	0	0	0	107.1	P263 S267 R268	P263-D265 PolarHBondContact O-N 3.38Å; D265-S267 PolarHBondContact O-N 3.42Å; D265-S267 VanDerWaalsContact OD1-CB 3.27Å; D265-S267 WeakPolarHBondContact OD1-CB 3.31Å; D265-S267 PolarHBondContact OD1-N 3.47Å; D265-S267 PolarHBondContact OD1-OG 3.34Å; D265-S267 PolarHBondContact OD2-OG 3.16Å; D265-R268 HydrophobicContact CB-CG 3.88Å; D265-R268 WeakPolarHBondContact O-CB 3.39Å; D265-R268 PolarHBondContact O-N 2.83Å
266	P	48.8	Very low	53.7	Low	63 Å²	63	76.7 Å²	76.7	41%	0.409	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-15.6	178.7	17.8	-23	0	0	0	112.2	Y264 F269	Y264-P266 HydrophobicContact CD1-CB 4.41Å; Y264-P266 HydrophobicContact CD1-CG 4.1Å; Y264-P266 HydrophobicContact CE1-CB 3.58Å; Y264-P266 HydrophobicContact CE1-CG 3.62Å; Y264-P266 WeakPolarHBondContact O-CD 3.34Å; P266-F269 CarbonylContact O-C 3.07Å
267	S	49.2	Very low	52.1	Low	94 Å²	94	82.7 Å²	82.7	66%	0.657	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-20.2	175.3	77.3	0	0	0	0	113.9	D265 F269	D265-S267 PolarHBondContact O-N 3.42Å; D265-S267 VanDerWaalsContact OD1-CB 3.27Å; D265-S267 WeakPolarHBondContact OD1-CB 3.31Å; D265-S267 PolarHBondContact OD1-N 3.47Å; D265-S267 PolarHBondContact OD1-OG 3.34Å; D265-S267 PolarHBondContact OD2-OG 3.16Å; S267-F269 VanDerWaalsContact C-N 3.3Å; S267-F269 PolarHBondContact O-N 2.93Å
268	R	53.4	Low	50.7	Low	108 Å²	108	87 Å²	87	41%	0.408	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-30.9	176.5	-74.4	-174.8	-167	-150.7	9.6	112.8	Y262 D265	Y262-R268 WeakPolarHBondContact OH-CD 3.46Å; Y262-R268 PolarHBondContact OH-NH1 3.08Å; D265-R268 HydrophobicContact CB-CG 3.88Å; D265-R268 WeakPolarHBondContact O-CB 3.39Å; D265-R268 PolarHBondContact O-N 2.83Å
269	F	51	Low	49.7	Very low	12 Å²	12	88.1 Å²	88.1	5%	0.053	49%	0.492	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.6	92.6	-179.6	-55.1	-82.1	0	0	0	106.6	E152 A156 R247 L250 Q251 P266 S267 V271	E152-F269 WeakPolarHBondContact OE1-CE1 3.44Å; E152-F269 VanDerWaalsContact OE1-CZ 3.32Å; E152-F269 WeakPolarHBondContact OE1-CZ 3.49Å; A156-F269 HydrophobicContact CB-CE1 4.18Å; R247-F269 HydrophobicContact CB-CD1 4.37Å; R247-F269 HydrophobicContact CG-CD1 4.49Å; L250-F269 HydrophobicContact CB-CE1 4.14Å; Q251-F269 HydrophobicContact CG-CD1 4.14Å; Q251-F269 HydrophobicContact CG-CD2 3.43Å; Q251-F269 VanDerWaalsContact CG-CD2 3.43Å; Q251-F269 HydrophobicContact CG-CE1 4.13Å; Q251-F269 HydrophobicContact CG-CE2 3.41Å; Q251-F269 VanDerWaalsContact CG-CE2 3.41Å; Q251-F269 HydrophobicContact CG-CG 3.8Å; Q251-F269 HydrophobicContact CG-CZ 3.78Å; Q251-F269 VanDerWaalsContact NE2-CG 3.28Å; P266-F269 CarbonylContact O-C 3.07Å; S267-F269 VanDerWaalsContact C-N 3.3Å; S267-F269 PolarHBondContact O-N 2.93Å; F269-V271 VanDerWaalsContact C-N 3.28Å; F269-V271 PolarHBondContact O-N 3.37Å
270	A	36.4	Very low	49.8	Very low	80 Å²	80	88.4 Å²	88.4	66%	0.661	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	87.3	-178.5	0	0	0	0	0	111.8
271	V	43.5	Very low	50.7	Low	60 Å²	60	87.7 Å²	87.7	36%	0.364	48%	0.48	S	S	.	.			trans	-158.8	120.1	152.5	-177.6	0	0	0	0	106.9	F269 I273	F269-V271 VanDerWaalsContact C-N 3.28Å; F269-V271 PolarHBondContact O-N 3.37Å; V271-I273 PolarHBondContact O-N 2.95Å; V271-I273 VanDerWaalsContact O-N 3.08Å
272	T	36.3	Very low	51.8	Low	138 Å²	138	82.2 Å²	82.2	85%	0.847	45%	0.447	S	S	*	.			trans	-61.1	103.8	169.7	-27.5	0	0	0	0	109.1
273	I	41.3	Very low	52.9	Low	62 Å²	62	81.1 Å²	81.1	32%	0.318	45%	0.446	S	S	.	.			trans	-76.4	124.3	173.1	-66.1	173.5	0	0	0	107.6	Y264 V271 E277	Y264-I273 HydrophobicContact CE2-CD1 4.22Å; Y264-I273 VanDerWaalsContact OH-CD1 3.25Å; Y264-I273 WeakPolarHBondContact OH-CD1 3.47Å; V271-I273 PolarHBondContact O-N 2.95Å; V271-I273 VanDerWaalsContact O-N 3.08Å; I273-E277 HydrophobicContact CG2-CB 4.02Å; I273-E277 HydrophobicContact CG2-CG 4.25Å; I273-E277 WeakPolarHBondContact CG2-OE2 3.42Å
274	K	38.4	Very low	54.3	Low	150 Å²	150	82.5 Å²	82.5	65%	0.652	45%	0.448	S	S	*	.			trans	-69.5	147.6	173.6	-72.3	-177.9	178.9	-179.9	0	109.2	D276 E277	K274-D276 PolarHBondContact O-N 3.45Å; K274-E277 PolarHBondContact O-N 2.97Å
275	P	34.2	Very low	56.1	Low	131 Å²	131	78.5 Å²	78.5	85%	0.851	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-8.3	-179.6	23.7	-32.2	0	0	0	115.1
276	D	43.8	Very low	57.8	Low	150 Å²	150	78.3 Å²	78.3	80%	0.802	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	5.1	-179.7	-56.5	-34.6	0	0	0	113.9	K274	K274-D276 PolarHBondContact O-N 3.45Å
277	E	54.6	Low	59.9	Low	126 Å²	126	75.3 Å²	75.3	59%	0.589	41%	0.412	S	S	*	.	S	Bend	trans	-85.2	142.2	-175.4	-72.3	-172.8	-169.3	0	0	113.4	I273 K274	I273-E277 HydrophobicContact CG2-CB 4.02Å; I273-E277 HydrophobicContact CG2-CG 4.25Å; I273-E277 WeakPolarHBondContact CG2-OE2 3.42Å; K274-E277 PolarHBondContact O-N 2.97Å
278	E	58.2	Low	62.2	Low	91 Å²	91	70.9 Å²	70.9	43%	0.425	38%	0.381	S	S	.	.			trans	-41.3	150.5	178.1	-73.3	178.2	-167.7	0	0	113.9	F280 R468 R471	E278-F280 PolarHBondContact O-N 2.95Å; E278-R468 WeakPolarHBondContact OE2-CD 3.4Å; E278-R468 IonicContact OE2-CZ 2.64Å; E278-R468 IonicContact OE2-NE 3.46Å; E278-R468 PolarHBondContact OE2-NE 3.04Å; E278-R468 VanDerWaalsContact OE2-NE 3.1Å; E278-R471 IonicContact OE1-CZ 3.58Å; E278-R471 IonicContact OE1-NE 2.71Å; E278-R471 IonicContact OE1-NH1 3.74Å; E278-R471 PolarHBondContact OE1-NH1 3.43Å; E278-R471 IonicContact OE2-NH1 3.54Å; E278-R471 PolarHBondContact OE2-NH1 3.38Å
279	P	58.8	Low	64.2	Low	57 Å²	57	66.5 Å²	66.5	37%	0.37	37%	0.366	S	S	.	.			trans	-56	116.7	179.8	22.1	-31.7	0	0	0	110.3	D281 Q285 R468	P279-D281 PolarHBondContact O-N 3.37Å; P279-Q285 HydrophobicContact CG-CB 3.93Å; P279-Q285 HydrophobicContact CG-CG 4.15Å; P279-R468 VanDerWaalsContact O-CZ 3.26Å; P279-R468 PolarHBondContact O-NH1 3.4Å; P279-R468 PolarHBondContact O-NH2 2.92Å
280	F	70.7	Confident	66.2	Low	70 Å²	70	68 Å²	68	31%	0.307	38%	0.375	S	S	.	.	S	Bend	trans	-54.7	-41	179.9	-177.6	-96.4	0	0	0	111.6	Q251 L252 L255 E278 I282	Q251-F280 HydrophobicContact CB-CE1 4.18Å; Q251-F280 HydrophobicContact CB-CE2 3.84Å; Q251-F280 HydrophobicContact CB-CZ 3.3Å; L252-F280 HydrophobicContact CB-CE1 4.32Å; L252-F280 HydrophobicContact CB-CZ 4.01Å; L252-F280 HydrophobicContact CD1-CE1 4.4Å; L255-F280 HydrophobicContact CB-CE1 4.29Å; L255-F280 HydrophobicContact CD2-CD1 4.01Å; L255-F280 HydrophobicContact CD2-CE1 4.03Å; E278-F280 PolarHBondContact O-N 2.95Å; F280-I282 PolarHBondContact O-N 3.27Å
281	D	77.2	Confident	69	Low	17 Å²	17	64.3 Å²	64.3	9%	0.091	34%	0.343	C	S	.	.	S	Bend	trans	-83.9	96.8	171	-170.9	-42	0	0	0	109.6	K200 R201 Q204 L255 P279 G283 L284	K200-D281 IonicContact NZ-OD1 3.95Å; R201-D281 IonicContact CZ-OD2 2.71Å; R201-D281 IonicContact NH1-OD2 2.7Å; R201-D281 PolarHBondContact NH1-OD2 3.12Å; R201-D281 IonicContact NH2-OD2 2.98Å; Q204-D281 PolarHBondContact NE2-OD1 3.44Å; L255-D281 HydrophobicContact CD2-CB 4.02Å; P279-D281 PolarHBondContact O-N 3.37Å; D281-G283 PolarHBondContact O-N 2.99Å; D281-G283 PolarHBondContact OD1-N 3.1Å; D281-L284 HydrophobicContact CB-CD1 3.96Å; D281-L284 HydrophobicContact CB-CG 4.11Å; D281-L284 PolarHBondContact O-N 3.47Å
282	I	81.5	Confident	71.5	Confident	7 Å²	7	61.5 Å²	61.5	4%	0.036	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-48.7	-36.4	178.1	-64	163.5	0	0	0	111.7	V207 F280 L284 Q285 H460 H465	V207-I282 HydrophobicContact CG1-CD1 4.29Å; F280-I282 PolarHBondContact O-N 3.27Å; I282-L284 PolarHBondContact O-N 2.79Å; I282-L284 VanDerWaalsContact O-N 3.09Å; I282-Q285 WeakPolarHBondContact O-CB 3.5Å; I282-Q285 PolarHBondContact O-N 3.12Å; I282-H460 PolarHBondContact O-NE2 3.13Å; I282-H465 HydrophobicContact CD1-CB 3.94Å
283	G	78.6	Confident	74.2	Confident	11 Å²	11	56.5 Å²	56.5	11%	0.113	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-76	2.6	-175	0	0	0	0	0	114.1	K200 D281	K200-G283 PolarHBondContact NZ-O 2.98Å; D281-G283 PolarHBondContact O-N 2.99Å; D281-G283 PolarHBondContact OD1-N 3.1Å
284	L	81.2	Confident	76.7	Confident	123 Å²	123	58.3 Å²	58.3	64%	0.644	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-103.2	-2.6	169	-61	178.5	0	0	0	112.2	D281 I282 L286	D281-L284 HydrophobicContact CB-CD1 3.96Å; D281-L284 HydrophobicContact CB-CG 4.11Å; D281-L284 PolarHBondContact O-N 3.47Å; I282-L284 PolarHBondContact O-N 2.79Å; I282-L284 VanDerWaalsContact O-N 3.09Å; L284-L286 PolarHBondContact O-N 3.21Å
285	Q	86.5	Confident	79.4	Confident	37 Å²	37	51.2 Å²	51.2	17%	0.173	28%	0.276	C	S	.	.			trans	-67.5	129.9	-179.9	-172.4	168.1	-21.1	0	0	109.7	P279 I282 H451 H460	P279-Q285 HydrophobicContact CG-CB 3.93Å; P279-Q285 HydrophobicContact CG-CG 4.15Å; I282-Q285 WeakPolarHBondContact O-CB 3.5Å; I282-Q285 PolarHBondContact O-N 3.12Å; Q285-H451 VanDerWaalsContact CD-CE1 3.45Å; Q285-H460 PolarHBondContact O-CE1 3.44Å; Q285-H460 PolarHBondContact O-NE2 2.96Å
286	L	89.5	Confident	82.3	Confident	57 Å²	57	46.2 Å²	46.2	30%	0.298	24%	0.242	S	C	.	.			trans	-69.9	136.9	175.1	-170.1	66.2	0	0	0	109.5	L284 I290 A291 A322 M326	L284-L286 PolarHBondContact O-N 3.21Å; L286-I290 HydrophobicContact CD1-CB 4.33Å; L286-I290 HydrophobicContact CD1-CG2 3.87Å; L286-A291 HydrophobicContact CD1-CB 4.01Å; L286-A291 HydrophobicContact CD2-CB 4.46Å; L286-A291 HydrophobicContact CG-CB 4.27Å; L286-A322 HydrophobicContact CD2-CB 4Å; L286-M326 HydrophobicContact CB-SD 4.41Å; L286-M326 HydrophobicContact CD2-CG 4.16Å; L286-M326 HydrophobicContact CD2-SD 4.37Å; L286-M326 HydrophobicContact CG-CG 4.15Å; L286-M326 HydrophobicContact CG-SD 4.24Å
287	T	94.6	Very high	84.6	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.232	C	C	.	.			trans	-132.2	170.7	176.9	55.2	0	0	0	0	109.8	D289 I290 A291 H451	T287-D289 VanDerWaalsContact C-N 3.33Å; T287-D289 PolarHBondContact O-N 3.34Å; T287-I290 PolarHBondContact O-N 3.41Å; T287-I290 WeakPolarHBondContact OG1-CB 3.41Å; T287-I290 WeakPolarHBondContact OG1-CD1 3.32Å; T287-I290 VanDerWaalsContact OG1-CG1 3.26Å; T287-I290 WeakPolarHBondContact OG1-CG1 3.35Å; T287-I290 PolarHBondContact OG1-N 3.12Å; T287-A291 WeakPolarHBondContact O-CB 3.35Å; T287-A291 PolarHBondContact O-N 3.03Å; T287-H451 WeakPolarHBondContact CG2-O 3.44Å
288	A	96.3	Very high	86.4	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.008	21%	0.212	C	C	.	.	H	α-helix	trans	-64.3	-39.7	179.5	0	0	0	0	0	111.3	T292 M326 F330 L393 H452	A288-T292 WeakPolarHBondContact O-CB 3.47Å; A288-T292 PolarHBondContact O-N 3.45Å; A288-T292 PolarHBondContact O-OG1 3.32Å; A288-M326 HydrophobicContact CB-CB 4.05Å; A288-F330 HydrophobicContact CB-CE2 4.4Å; A288-L393 HydrophobicContact CB-CD1 3.94Å; A288-H452 HydrophobicContact CB-CB 3.9Å; A288-H452 PolarHBondContact N-ND1 2.99Å
289	D	95.6	Very high	88	Confident	16 Å²	16	35.4 Å²	35.4	9%	0.086	19%	0.192	C	C	.	.	H	α-helix	trans	-63.9	-46.7	175.3	-174.6	72.7	0	0	0	112.6	T287 T292 A293 R390 H452 F455	T287-D289 VanDerWaalsContact C-N 3.33Å; T287-D289 PolarHBondContact O-N 3.34Å; D289-T292 WeakPolarHBondContact O-CB 3.42Å; D289-T292 PolarHBondContact O-N 2.98Å; D289-A293 PolarHBondContact O-N 2.71Å; D289-R390 WeakPolarHBondContact OD1-CD 3.41Å; D289-R390 IonicContact OD1-CZ 3.78Å; D289-R390 IonicContact OD1-NE 2.74Å; D289-R390 PolarHBondContact OD1-NE 2.62Å; D289-R390 IonicContact OD1-NH1 2.75Å; D289-R390 IonicContact OD1-NH2 3.62Å; D289-R390 PolarHBondContact OD1-NH2 3.2Å; D289-H452 WeakPolarHBondContact CB-O 3.4Å; D289-H452 PolarHBondContact N-O 3.42Å; D289-F455 HydrophobicContact CB-CB 4.5Å; D289-F455 VanDerWaalsContact CG-CB 3.45Å; D289-F455 VanDerWaalsContact OD2-CA 3.28Å; D289-F455 WeakPolarHBondContact OD2-CA 3.38Å; D289-F455 WeakPolarHBondContact OD2-CB 3.42Å
290	I	93.3	Very high	89.5	Confident	45 Å²	45	35.7 Å²	35.7	23%	0.231	19%	0.188	C	C	.	.	H	α-helix	trans	-65.6	-44	178.4	-66.2	171.8	0	0	0	110.9	L286 T287 T292 A293 Q294 H460	L286-I290 HydrophobicContact CD1-CB 4.33Å; L286-I290 HydrophobicContact CD1-CG2 3.87Å; T287-I290 PolarHBondContact O-N 3.41Å; T287-I290 WeakPolarHBondContact OG1-CB 3.41Å; T287-I290 WeakPolarHBondContact OG1-CD1 3.32Å; T287-I290 VanDerWaalsContact OG1-CG1 3.26Å; T287-I290 WeakPolarHBondContact OG1-CG1 3.35Å; T287-I290 PolarHBondContact OG1-N 3.12Å; I290-T292 VanDerWaalsContact C-N 3.3Å; I290-T292 PolarHBondContact O-N 3.35Å; I290-A293 PolarHBondContact O-N 3.33Å; I290-A293 VanDerWaalsContact O-N 3.17Å; I290-Q294 HydrophobicContact CG2-CG 4.26Å; I290-Q294 WeakPolarHBondContact O-CG 3.38Å; I290-Q294 PolarHBondContact O-N 2.69Å; I290-H460 VanDerWaalsContact CD1-CE1 3.44Å; I290-H460 WeakPolarHBondContact CD1-CE1 3.47Å
291	A	95.2	Very high	90.4	Very high	1 Å²	1	35 Å²	35	1%	0.008	19%	0.186	C	C	.	.	H	α-helix	trans	-60.5	-41.6	175.7	0	0	0	0	0	111.1	L286 T287 A293 Q294 F295 L323 M326	L286-A291 HydrophobicContact CD1-CB 4.01Å; L286-A291 HydrophobicContact CD2-CB 4.46Å; L286-A291 HydrophobicContact CG-CB 4.27Å; T287-A291 WeakPolarHBondContact O-CB 3.35Å; T287-A291 PolarHBondContact O-N 3.03Å; A291-A293 PolarHBondContact O-N 2.96Å; A291-Q294 PolarHBondContact O-N 3.23Å; A291-F295 VanDerWaalsContact O-CB 3.25Å; A291-F295 WeakPolarHBondContact O-CB 3.44Å; A291-F295 PolarHBondContact O-N 3.48Å; A291-L323 HydrophobicContact CB-CB 4.19Å; A291-L323 HydrophobicContact CB-CD1 4.3Å; A291-M326 HydrophobicContact CB-CG 4.3Å
292	T	95.9	Very high	90.8	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.006	18%	0.182	C	C	.	.	H	α-helix	trans	-60.2	-45.8	173.7	-57.3	0	0	0	0	111.1	A288 D289 I290 F295 L296 L323 C386	A288-T292 WeakPolarHBondContact O-CB 3.47Å; A288-T292 PolarHBondContact O-N 3.45Å; A288-T292 PolarHBondContact O-OG1 3.32Å; D289-T292 WeakPolarHBondContact O-CB 3.42Å; D289-T292 PolarHBondContact O-N 2.98Å; I290-T292 VanDerWaalsContact C-N 3.3Å; I290-T292 PolarHBondContact O-N 3.35Å; T292-F295 PolarHBondContact O-N 3.48Å; T292-L296 HydrophobicContact CG2-CD1 4.08Å; T292-L296 HydrophobicContact CG2-CG 4.48Å; T292-L296 VanDerWaalsContact O-CG 3.28Å; T292-L296 WeakPolarHBondContact O-CG 3.45Å; T292-L296 PolarHBondContact O-N 3.43Å; T292-L323 WeakPolarHBondContact OG1-CD1 3.21Å; T292-C386 HydrophobicContact CG2-CB 4.01Å
293	A	93.6	Very high	91.1	Very high	34 Å²	34	37.5 Å²	37.5	28%	0.281	19%	0.194	S	C	.	.	H	α-helix	trans	-63.6	-48.1	179	0	0	0	0	0	112.1	D289 I290 A291 F295 L296 D297	D289-A293 PolarHBondContact O-N 2.71Å; I290-A293 PolarHBondContact O-N 3.33Å; I290-A293 VanDerWaalsContact O-N 3.17Å; A291-A293 PolarHBondContact O-N 2.96Å; A293-F295 VanDerWaalsContact C-N 3.3Å; A293-F295 PolarHBondContact O-N 3.37Å; A293-L296 PolarHBondContact O-N 3.19Å; A293-D297 WeakPolarHBondContact O-CB 3.43Å; A293-D297 PolarHBondContact O-N 2.95Å
294	Q	93	Very high	91.5	Very high	100 Å²	100	43 Å²	43	47%	0.467	22%	0.22	S	C	.	.	H	α-helix	trans	-60.7	-39	177.6	-71.3	178.7	0.3	0	0	112.5	I290 A291 T298	I290-Q294 HydrophobicContact CG2-CG 4.26Å; I290-Q294 WeakPolarHBondContact O-CG 3.38Å; I290-Q294 PolarHBondContact O-N 2.69Å; A291-Q294 PolarHBondContact O-N 3.23Å; Q294-T298 WeakPolarHBondContact O-CB 3.46Å; Q294-T298 PolarHBondContact O-N 2.87Å; Q294-T298 PolarHBondContact O-OG1 3.09Å
295	F	95.1	Very high	91.7	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.5	-48.2	174.6	174.9	-112	0	0	0	111.6	A291 T292 A293 T298 L299 I316 A319 L320 L323 T351 L355 V382 C386	A291-F295 VanDerWaalsContact O-CB 3.25Å; A291-F295 WeakPolarHBondContact O-CB 3.44Å; A291-F295 PolarHBondContact O-N 3.48Å; T292-F295 PolarHBondContact O-N 3.48Å; A293-F295 VanDerWaalsContact C-N 3.3Å; A293-F295 PolarHBondContact O-N 3.37Å; F295-T298 WeakPolarHBondContact O-CB 3.49Å; F295-T298 PolarHBondContact O-N 3.4Å; F295-L299 HydrophobicContact CD1-CD1 4.22Å; F295-L299 HydrophobicContact CE1-CD1 3.67Å; F295-L299 HydrophobicContact CE2-CD1 4.2Å; F295-L299 HydrophobicContact CE2-CG 4.41Å; F295-L299 HydrophobicContact CZ-CD1 3.67Å; F295-L299 HydrophobicContact CZ-CG 4.35Å; F295-L299 WeakPolarHBondContact O-CG 3.3Å; F295-L299 PolarHBondContact O-N 3.21Å; F295-I316 HydrophobicContact CE2-CG2 3.9Å; F295-A319 HydrophobicContact CB-CB 4.11Å; F295-A319 HydrophobicContact CD2-CB 3.98Å; F295-L320 HydrophobicContact CD2-CB 4.2Å; F295-L320 HydrophobicContact CE2-CB 3.81Å; F295-L320 HydrophobicContact CE2-CD1 4.31Å; F295-L320 HydrophobicContact CZ-CB 4.47Å; F295-L320 HydrophobicContact CZ-CD1 4.15Å; F295-L323 HydrophobicContact CD1-CD2 4.39Å; F295-T351 HydrophobicContact CE1-CG2 3.97Å; F295-T351 HydrophobicContact CZ-CG2 3.86Å; F295-L355 HydrophobicContact CE2-CD1 3.71Å; F295-L355 HydrophobicContact CZ-CD1 3.48Å; F295-L355 VanDerWaalsContact CZ-CD1 3.48Å; F295-L355 HydrophobicContact CZ-CG 4.49Å; F295-V382 HydrophobicContact CE1-CG1 3.63Å; F295-V382 HydrophobicContact CZ-CG1 3.96Å; F295-C386 VanDerWaalsContact CE1-SG 3.59Å
296	L	94.9	Very high	91.2	Very high	26 Å²	26	40.9 Å²	40.9	14%	0.136	22%	0.221	C	C	.	.	H	α-helix	trans	-64.5	-39.9	177.7	-68.7	176.9	0	0	0	112.9	T292 A293 T298 L299 E300 C386	T292-L296 HydrophobicContact CG2-CD1 4.08Å; T292-L296 HydrophobicContact CG2-CG 4.48Å; T292-L296 VanDerWaalsContact O-CG 3.28Å; T292-L296 WeakPolarHBondContact O-CG 3.45Å; T292-L296 PolarHBondContact O-N 3.43Å; A293-L296 PolarHBondContact O-N 3.19Å; L296-T298 VanDerWaalsContact C-N 3.29Å; L296-T298 PolarHBondContact O-N 3.34Å; L296-L299 PolarHBondContact O-N 3.41Å; L296-E300 WeakPolarHBondContact O-CB 3.26Å; L296-E300 PolarHBondContact O-N 3.34Å; L296-C386 HydrophobicContact CD1-CB 4.25Å; L296-C386 HydrophobicContact CD2-CB 3.94Å; L296-C386 HydrophobicContact CG-CB 4.34Å
297	D	93.2	Very high	90.5	Very high	113 Å²	113	42.8 Å²	42.8	60%	0.604	23%	0.232	S	C	*	.	H	α-helix	trans	-63.3	-37.6	175.5	-73.6	-14.4	0	0	0	111.5	A293 E300 M301	A293-D297 WeakPolarHBondContact O-CB 3.43Å; A293-D297 PolarHBondContact O-N 2.95Å; D297-E300 PolarHBondContact O-N 2.99Å; D297-M301 WeakPolarHBondContact O-CB 3.41Å; D297-M301 PolarHBondContact O-N 3.22Å
298	T	91.4	Very high	89.6	Confident	27 Å²	27	43.9 Å²	43.9	17%	0.166	24%	0.239	C	C	.	.	H	α-helix	trans	-64.2	-42.8	175	-58	0	0	0	0	111	Q294 F295 L296 M301 V302 R315 I316	Q294-T298 WeakPolarHBondContact O-CB 3.46Å; Q294-T298 PolarHBondContact O-N 2.87Å; Q294-T298 PolarHBondContact O-OG1 3.09Å; F295-T298 WeakPolarHBondContact O-CB 3.49Å; F295-T298 PolarHBondContact O-N 3.4Å; L296-T298 VanDerWaalsContact C-N 3.29Å; L296-T298 PolarHBondContact O-N 3.34Å; T298-M301 HydrophobicContact CG2-CE 4.44Å; T298-M301 PolarHBondContact O-N 2.91Å; T298-V302 VanDerWaalsContact O-CG2 3.25Å; T298-V302 WeakPolarHBondContact O-CG2 3.26Å; T298-V302 PolarHBondContact O-N 3.39Å; T298-V302 VanDerWaalsContact O-N 3.14Å; T298-R315 HydrophobicContact CG2-CB 4.31Å; T298-I316 HydrophobicContact CG2-CG1 3.81Å
299	L	92.3	Very high	88.8	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-67.6	-37.3	175.6	-67.5	179.3	0	0	0	112.6	F295 L296 M301 V302 R303 I316 L355 V379 V382	F295-L299 HydrophobicContact CD1-CD1 4.22Å; F295-L299 HydrophobicContact CE1-CD1 3.67Å; F295-L299 HydrophobicContact CE2-CD1 4.2Å; F295-L299 HydrophobicContact CE2-CG 4.41Å; F295-L299 HydrophobicContact CZ-CD1 3.67Å; F295-L299 HydrophobicContact CZ-CG 4.35Å; F295-L299 WeakPolarHBondContact O-CG 3.3Å; F295-L299 PolarHBondContact O-N 3.21Å; L296-L299 PolarHBondContact O-N 3.41Å; L299-M301 VanDerWaalsContact C-N 3.33Å; L299-V302 WeakPolarHBondContact O-CB 3.38Å; L299-V302 PolarHBondContact O-N 3.09Å; L299-R303 WeakPolarHBondContact O-CB 3.46Å; L299-R303 PolarHBondContact O-N 3.49Å; L299-I316 HydrophobicContact CD2-CD1 4.03Å; L299-I316 HydrophobicContact CD2-CG1 4.13Å; L299-I316 HydrophobicContact CD2-CG2 4.02Å; L299-L355 HydrophobicContact CD2-CD2 3.89Å; L299-V379 HydrophobicContact CB-CG1 4.01Å; L299-V379 HydrophobicContact CB-CG2 4.32Å; L299-V382 HydrophobicContact CD1-CB 4.21Å; L299-V382 HydrophobicContact CD1-CG1 3.48Å; L299-V382 VanDerWaalsContact CD1-CG1 3.48Å
300	E	90.9	Very high	88.1	Confident	62 Å²	62	50.9 Å²	50.9	29%	0.29	28%	0.283	S	S	.	.	H	α-helix	trans	-64.9	-39.2	175.4	-174.4	60.5	-161.8	0	0	111.2	L296 D297 V302 R303 L304	L296-E300 WeakPolarHBondContact O-CB 3.26Å; L296-E300 PolarHBondContact O-N 3.34Å; D297-E300 PolarHBondContact O-N 2.99Å; E300-V302 VanDerWaalsContact C-N 3.31Å; E300-V302 PolarHBondContact O-N 3.2Å; E300-R303 VanDerWaalsContact CD-NE 3.28Å; E300-R303 CarbonylContact O-C 3.59Å; E300-R303 WeakPolarHBondContact O-CB 3.27Å; E300-R303 PolarHBondContact O-N 3.29Å; E300-R303 VanDerWaalsContact O-N 3.15Å; E300-R303 IonicContact OE1-CZ 3.93Å; E300-R303 IonicContact OE1-NE 2.78Å; E300-R303 PolarHBondContact OE1-NE 3Å; E300-R303 VanDerWaalsContact OE1-NE 3.13Å; E300-R303 IonicContact OE1-NH2 3.73Å; E300-R303 PolarHBondContact OE1-NH2 3.47Å; E300-R303 IonicContact OE2-CZ 2.81Å; E300-R303 IonicContact OE2-NE 3.34Å; E300-R303 PolarHBondContact OE2-NE 3.05Å; E300-R303 IonicContact OE2-NH2 3.84Å; E300-R303 PolarHBondContact OE2-NH2 3.4Å; E300-L304 HydrophobicContact CG-CD1 4.34Å; E300-L304 WeakPolarHBondContact O-CG 3.21Å; E300-L304 PolarHBondContact O-N 3.36Å
301	M	88.1	Confident	87.7	Confident	55 Å²	55	50.8 Å²	50.8	27%	0.271	29%	0.292	S	S	.	.	H	α-helix	trans	-62.4	-38.2	172.7	-179.8	-85.9	-55.8	0	0	112	D297 T298 L299 L304 T305 V312	D297-M301 WeakPolarHBondContact O-CB 3.41Å; D297-M301 PolarHBondContact O-N 3.22Å; T298-M301 HydrophobicContact CG2-CE 4.44Å; T298-M301 PolarHBondContact O-N 2.91Å; L299-M301 VanDerWaalsContact C-N 3.33Å; M301-L304 PolarHBondContact O-N 3.29Å; M301-T305 HydrophobicContact CG-CG2 4.48Å; M301-T305 WeakPolarHBondContact O-CB 2.99Å; M301-T305 VanDerWaalsContact O-CG2 3.32Å; M301-T305 WeakPolarHBondContact O-CG2 3.32Å; M301-T305 PolarHBondContact O-N 2.91Å; M301-T305 PolarHBondContact O-OG1 3.33Å; M301-T305 HydrophobicContact SD-CG2 4.26Å; M301-V312 HydrophobicContact CE-CG1 4.15Å
302	V	87	Confident	87.3	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-63.4	-44.3	172	179.7	0	0	0	0	110.8	T298 L299 E300 L304 T305 G306 V308 V312 I316 I375	T298-V302 VanDerWaalsContact O-CG2 3.25Å; T298-V302 WeakPolarHBondContact O-CG2 3.26Å; T298-V302 PolarHBondContact O-N 3.39Å; T298-V302 VanDerWaalsContact O-N 3.14Å; L299-V302 WeakPolarHBondContact O-CB 3.38Å; L299-V302 PolarHBondContact O-N 3.09Å; E300-V302 VanDerWaalsContact C-N 3.31Å; E300-V302 PolarHBondContact O-N 3.2Å; V302-L304 VanDerWaalsContact C-N 3.28Å; V302-L304 PolarHBondContact O-N 3.08Å; V302-T305 PolarHBondContact O-N 3.43Å; V302-G306 WeakPolarHBondContact O-CA 3.36Å; V302-G306 PolarHBondContact O-N 3.37Å; V302-V308 HydrophobicContact CG1-CG2 3.82Å; V302-V312 HydrophobicContact CG2-CG1 3.33Å; V302-I316 HydrophobicContact CG2-CD1 3.82Å; V302-I316 HydrophobicContact CG2-CG1 4.47Å; V302-I375 HydrophobicContact CG1-CG2 4.19Å
303	R	87.2	Confident	86.8	Confident	78 Å²	78	53.1 Å²	53.1	29%	0.294	30%	0.304	S	S	.	.	H	α-helix	trans	-63.4	-29.2	177.3	-163.3	-178.9	82.5	102.7	-1.2	113.3	L299 E300 M372 D376 V379	L299-R303 WeakPolarHBondContact O-CB 3.46Å; L299-R303 PolarHBondContact O-N 3.49Å; E300-R303 VanDerWaalsContact CD-NE 3.28Å; E300-R303 CarbonylContact O-C 3.59Å; E300-R303 WeakPolarHBondContact O-CB 3.27Å; E300-R303 PolarHBondContact O-N 3.29Å; E300-R303 VanDerWaalsContact O-N 3.15Å; E300-R303 IonicContact OE1-CZ 3.93Å; E300-R303 IonicContact OE1-NE 2.78Å; E300-R303 PolarHBondContact OE1-NE 3Å; E300-R303 VanDerWaalsContact OE1-NE 3.13Å; E300-R303 IonicContact OE1-NH2 3.73Å; E300-R303 PolarHBondContact OE1-NH2 3.47Å; E300-R303 IonicContact OE2-CZ 2.81Å; E300-R303 IonicContact OE2-NE 3.34Å; E300-R303 PolarHBondContact OE2-NE 3.05Å; E300-R303 IonicContact OE2-NH2 3.84Å; E300-R303 PolarHBondContact OE2-NH2 3.4Å; R303-M372 WeakPolarHBondContact O-CE 3.47Å; R303-D376 WeakPolarHBondContact CD-OD1 3.43Å; R303-D376 WeakPolarHBondContact CG-OD1 3.42Å; R303-D376 IonicContact CZ-OD1 2.69Å; R303-D376 IonicContact NE-OD1 3.73Å; R303-D376 IonicContact NH1-OD1 3.65Å; R303-D376 PolarHBondContact NH1-OD1 3.03Å; R303-V379 HydrophobicContact CB-CG1 4.29Å; R303-V379 HydrophobicContact CB-CG2 4.44Å; R303-V379 HydrophobicContact CG-CG1 4.47Å
304	L	85.9	Confident	86.5	Confident	126 Å²	126	58.4 Å²	58.4	66%	0.66	32%	0.323	S	S	*	.	H	α-helix	trans	-85.8	-31.3	177.4	-69.3	173	0	0	0	113	E300 M301 V302	E300-L304 HydrophobicContact CG-CD1 4.34Å; E300-L304 WeakPolarHBondContact O-CG 3.21Å; E300-L304 PolarHBondContact O-N 3.36Å; M301-L304 PolarHBondContact O-N 3.29Å; V302-L304 VanDerWaalsContact C-N 3.28Å; V302-L304 PolarHBondContact O-N 3.08Å
305	T	85.3	Confident	86.4	Confident	83 Å²	83	60 Å²	60	51%	0.509	32%	0.324	S	S	.	.	H	α-helix	trans	-95.9	-21.6	-175.4	59.2	0	0	0	0	113.7	M301 V302 N307	M301-T305 HydrophobicContact CG-CG2 4.48Å; M301-T305 WeakPolarHBondContact O-CB 2.99Å; M301-T305 VanDerWaalsContact O-CG2 3.32Å; M301-T305 WeakPolarHBondContact O-CG2 3.32Å; M301-T305 PolarHBondContact O-N 2.91Å; M301-T305 PolarHBondContact O-OG1 3.33Å; M301-T305 HydrophobicContact SD-CG2 4.26Å; V302-T305 PolarHBondContact O-N 3.43Å; T305-N307 PolarHBondContact O-N 2.82Å; T305-N307 VanDerWaalsContact O-N 3.11Å; T305-N307 PolarHBondContact OG1-N 3.41Å
306	G	76.3	Confident	86.1	Confident	32 Å²	32	60 Å²	60	33%	0.33	32%	0.324	S	S	.	.			trans	63.2	6.9	-171.1	0	0	0	0	0	113.9	V302	V302-G306 WeakPolarHBondContact O-CA 3.36Å; V302-G306 PolarHBondContact O-N 3.37Å
307	N	75.3	Confident	85.9	Confident	97 Å²	97	61.6 Å²	61.6	52%	0.519	33%	0.33	S	S	.	.			trans	-99.6	116.4	-173.3	-173.4	5.3	0	0	0	110.7	T305 G309	T305-N307 PolarHBondContact O-N 2.82Å; T305-N307 VanDerWaalsContact O-N 3.11Å; T305-N307 PolarHBondContact OG1-N 3.41Å; N307-G309 PolarHBondContact OD1-N 3.37Å
308	V	76.5	Confident	85.8	Confident	23 Å²	23	58.1 Å²	58.1	14%	0.139	32%	0.321	C	S	.	.			trans	-116.6	41.4	-179.3	-159.4	0	0	0	0	110.7	V302 Q313 L359 L370 I375	V302-V308 HydrophobicContact CG1-CG2 3.82Å; V308-Q313 HydrophobicContact CG1-CG 4.06Å; V308-Q313 PolarHBondContact O-NE2 3.36Å; V308-L359 HydrophobicContact CG1-CD2 3.22Å; V308-L370 HydrophobicContact CB-CD1 4.43Å; V308-L370 HydrophobicContact CG2-CD1 4.16Å; V308-I375 HydrophobicContact CG2-CD1 3.95Å
309	G	78.7	Confident	85.9	Confident	30 Å²	30	57.7 Å²	57.7	31%	0.309	32%	0.32	S	S	.	.			trans	-65.1	162.8	175.6	0	0	0	0	0	113.3	N307 G311 V312 Q313	N307-G309 PolarHBondContact OD1-N 3.37Å; G309-G311 VanDerWaalsContact C-N 3.33Å; G309-G311 PolarHBondContact O-N 2.6Å; G309-G311 VanDerWaalsContact O-N 3.17Å; G309-V312 WeakPolarHBondContact O-CA 2.94Å; G309-V312 WeakPolarHBondContact O-CB 3.02Å; G309-V312 PolarHBondContact O-N 3.01Å; G309-Q313 PolarHBondContact O-N 3.06Å
310	L	82.2	Confident	85.9	Confident	135 Å²	135	57.7 Å²	57.7	71%	0.707	32%	0.32	S	S	*	.	H	α-helix	trans	-48.5	-46.7	-175.1	-68.5	171.8	0	0	0	113.9	V312 Q313 E314	L310-V312 PolarHBondContact O-N 2.69Å; L310-Q313 WeakPolarHBondContact O-CB 3.49Å; L310-Q313 PolarHBondContact O-N 3.38Å; L310-Q313 VanDerWaalsContact O-N 3.09Å; L310-E314 WeakPolarHBondContact O-CG 3.35Å; L310-E314 PolarHBondContact O-N 3.43Å
311	G	84.8	Confident	86.1	Confident	42 Å²	42	58.3 Å²	58.3	43%	0.433	33%	0.326	S	S	.	.	H	α-helix	trans	-69.5	-16.9	178.8	0	0	0	0	0	114.7	G309 R315	G309-G311 VanDerWaalsContact C-N 3.33Å; G309-G311 PolarHBondContact O-N 2.6Å; G309-G311 VanDerWaalsContact O-N 3.17Å; G311-R315 WeakPolarHBondContact O-CG 3.37Å; G311-R315 PolarHBondContact O-NE 3.13Å; G311-R315 VanDerWaalsContact O-NE 3.11Å
312	V	85.3	Confident	86.3	Confident	12 Å²	12	56.8 Å²	56.8	7%	0.073	32%	0.322	C	S	.	.	H	α-helix	trans	-80.7	-42.6	168.6	-176.9	0	0	0	0	109.5	M301 V302 G309 L310 E314 R315 I316	M301-V312 HydrophobicContact CE-CG1 4.15Å; V302-V312 HydrophobicContact CG2-CG1 3.33Å; G309-V312 WeakPolarHBondContact O-CA 2.94Å; G309-V312 WeakPolarHBondContact O-CB 3.02Å; G309-V312 PolarHBondContact O-N 3.01Å; L310-V312 PolarHBondContact O-N 2.69Å; V312-E314 PolarHBondContact O-N 3.38Å; V312-R315 PolarHBondContact O-N 3.4Å; V312-I316 HydrophobicContact CG1-CD1 4.13Å; V312-I316 WeakPolarHBondContact O-CG1 3.4Å; V312-I316 PolarHBondContact O-N 3.45Å
313	Q	85.9	Confident	86.7	Confident	40 Å²	40	56.9 Å²	56.9	19%	0.187	32%	0.322	C	S	.	.	H	α-helix	trans	-58.6	-47.7	176.6	-57.8	-168.7	-23.2	0	0	111.6	V308 G309 L310 R315 I316 F317 L359	V308-Q313 HydrophobicContact CG1-CG 4.06Å; V308-Q313 PolarHBondContact O-NE2 3.36Å; G309-Q313 PolarHBondContact O-N 3.06Å; L310-Q313 WeakPolarHBondContact O-CB 3.49Å; L310-Q313 PolarHBondContact O-N 3.38Å; L310-Q313 VanDerWaalsContact O-N 3.09Å; Q313-R315 VanDerWaalsContact C-N 3.28Å; Q313-R315 PolarHBondContact O-N 2.8Å; Q313-I316 PolarHBondContact O-N 2.63Å; Q313-I316 VanDerWaalsContact O-N 3.15Å; Q313-F317 HydrophobicContact CB-CD2 4.49Å; Q313-F317 HydrophobicContact CB-CE2 4.47Å; Q313-F317 WeakPolarHBondContact O-CD2 3.46Å; Q313-F317 PolarHBondContact O-N 3.45Å; Q313-L359 HydrophobicContact CB-CD1 4.46Å; Q313-L359 HydrophobicContact CG-CD2 4.11Å; Q313-L359 PolarHBondContact NE2-O 3.29Å
314	E	87.9	Confident	87.1	Confident	145 Å²	145	54.1 Å²	54.1	68%	0.678	32%	0.315	S	S	*	.	H	α-helix	trans	-57.8	-39.8	176	-72.6	177.6	167.4	0	0	112.2	L310 V312 G318	L310-E314 WeakPolarHBondContact O-CG 3.35Å; L310-E314 PolarHBondContact O-N 3.43Å; V312-E314 PolarHBondContact O-N 3.38Å; E314-G318 PolarHBondContact O-N 3.07Å
315	R	89.6	Confident	87.5	Confident	132 Å²	132	53.4 Å²	53.4	50%	0.498	31%	0.308	S	S	.	.	H	α-helix	trans	-67.1	-41	176	-76.2	-174.1	-68.6	154.4	-4.2	112.5	T298 G311 V312 Q313 A319	T298-R315 HydrophobicContact CG2-CB 4.31Å; G311-R315 WeakPolarHBondContact O-CG 3.37Å; G311-R315 PolarHBondContact O-NE 3.13Å; G311-R315 VanDerWaalsContact O-NE 3.11Å; V312-R315 PolarHBondContact O-N 3.4Å; Q313-R315 VanDerWaalsContact C-N 3.28Å; Q313-R315 PolarHBondContact O-N 2.8Å; R315-A319 VanDerWaalsContact O-CB 3.31Å; R315-A319 WeakPolarHBondContact O-CB 3.4Å; R315-A319 PolarHBondContact O-N 3.33Å
316	I	90	Very high	88	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-62.3	-48.6	175.7	-66.2	167.2	0	0	0	110.1	F295 T298 L299 V302 V312 Q313 A319 L320 L355 L359	F295-I316 HydrophobicContact CE2-CG2 3.9Å; T298-I316 HydrophobicContact CG2-CG1 3.81Å; L299-I316 HydrophobicContact CD2-CD1 4.03Å; L299-I316 HydrophobicContact CD2-CG1 4.13Å; L299-I316 HydrophobicContact CD2-CG2 4.02Å; V302-I316 HydrophobicContact CG2-CD1 3.82Å; V302-I316 HydrophobicContact CG2-CG1 4.47Å; V312-I316 HydrophobicContact CG1-CD1 4.13Å; V312-I316 WeakPolarHBondContact O-CG1 3.4Å; V312-I316 PolarHBondContact O-N 3.45Å; Q313-I316 PolarHBondContact O-N 2.63Å; Q313-I316 VanDerWaalsContact O-N 3.15Å; I316-A319 PolarHBondContact O-N 3.32Å; I316-L320 WeakPolarHBondContact O-CB 3.33Å; I316-L320 PolarHBondContact O-N 2.92Å; I316-L355 HydrophobicContact CG2-CD1 3.69Å; I316-L355 HydrophobicContact CG2-CD2 4.19Å; I316-L359 HydrophobicContact CD1-CD1 4.43Å; I316-L359 HydrophobicContact CD1-CD2 4.18Å; I316-L359 HydrophobicContact CG2-CD1 4.27Å
317	F	90.2	Very high	88.9	Confident	60 Å²	60	49.8 Å²	49.8	26%	0.263	28%	0.277	S	S	.	.	H	α-helix	trans	-65.8	-40.1	179.2	-75.3	-62.7	0	0	0	112.3	Q313 L320 N321 L359	Q313-F317 HydrophobicContact CB-CD2 4.49Å; Q313-F317 HydrophobicContact CB-CE2 4.47Å; Q313-F317 WeakPolarHBondContact O-CD2 3.46Å; Q313-F317 PolarHBondContact O-N 3.45Å; F317-L320 PolarHBondContact O-N 2.87Å; F317-N321 WeakPolarHBondContact O-CB 3.26Å; F317-N321 PolarHBondContact O-N 2.87Å; F317-N321 PolarHBondContact O-ND2 3.5Å; F317-L359 HydrophobicContact CD2-CD1 4.18Å; F317-L359 HydrophobicContact CE1-CD1 4.33Å; F317-L359 HydrophobicContact CE2-CD1 3.48Å; F317-L359 VanDerWaalsContact CE2-CD1 3.48Å; F317-L359 HydrophobicContact CZ-CB 4.48Å; F317-L359 HydrophobicContact CZ-CD1 3.57Å
318	G	92	Very high	89.9	Confident	40 Å²	40	49.9 Å²	49.9	41%	0.412	27%	0.274	S	S	.	.	H	α-helix	trans	-60.2	-46.1	173.7	0	0	0	0	0	112.3	E314 N321 A322	E314-G318 PolarHBondContact O-N 3.07Å; G318-N321 PolarHBondContact O-N 3.24Å; G318-A322 WeakPolarHBondContact O-CB 3.31Å; G318-A322 PolarHBondContact O-N 3.41Å
319	A	92.1	Very high	90.8	Very high	17 Å²	17	50.9 Å²	50.9	14%	0.14	28%	0.279	C	S	.	.	H	α-helix	trans	-66.2	-38.5	177.1	0	0	0	0	0	112.6	F295 R315 I316 L323	F295-A319 HydrophobicContact CB-CB 4.11Å; F295-A319 HydrophobicContact CD2-CB 3.98Å; R315-A319 VanDerWaalsContact O-CB 3.31Å; R315-A319 WeakPolarHBondContact O-CB 3.4Å; R315-A319 PolarHBondContact O-N 3.33Å; I316-A319 PolarHBondContact O-N 3.32Å; A319-L323 PolarHBondContact O-N 3.41Å
320	L	93.9	Very high	91.8	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-65.5	-43.9	174.4	179.6	62.6	0	0	0	111.9	F295 I316 F317 A322 L323 C324 T351 R352 L355	F295-L320 HydrophobicContact CD2-CB 4.2Å; F295-L320 HydrophobicContact CE2-CB 3.81Å; F295-L320 HydrophobicContact CE2-CD1 4.31Å; F295-L320 HydrophobicContact CZ-CB 4.47Å; F295-L320 HydrophobicContact CZ-CD1 4.15Å; I316-L320 WeakPolarHBondContact O-CB 3.33Å; I316-L320 PolarHBondContact O-N 2.92Å; F317-L320 PolarHBondContact O-N 2.87Å; L320-A322 VanDerWaalsContact C-N 3.34Å; L320-A322 PolarHBondContact O-N 3.14Å; L320-L323 WeakPolarHBondContact O-CB 3.35Å; L320-L323 PolarHBondContact O-N 2.87Å; L320-C324 PolarHBondContact O-N 2.96Å; L320-C324 PolarHBondContact O-SG 2.93Å; L320-C324 VanDerWaalsContact O-SG 3.35Å; L320-T351 HydrophobicContact CD1-CG2 3.84Å; L320-R352 HydrophobicContact CD2-CB 4.34Å; L320-L355 HydrophobicContact CD2-CD1 3.95Å
321	N	93.9	Very high	92.4	Very high	76 Å²	76	43.6 Å²	43.6	41%	0.406	23%	0.234	S	C	.	.	H	α-helix	trans	-62.7	-43.2	178.2	-73.1	-21.2	0	0	0	111	F317 G318 L323 C324 E325	F317-N321 WeakPolarHBondContact O-CB 3.26Å; F317-N321 PolarHBondContact O-N 2.87Å; F317-N321 PolarHBondContact O-ND2 3.5Å; G318-N321 PolarHBondContact O-N 3.24Å; N321-L323 VanDerWaalsContact C-N 3.33Å; N321-L323 PolarHBondContact O-N 3.38Å; N321-C324 WeakPolarHBondContact O-CB 3.31Å; N321-C324 PolarHBondContact O-N 3.31Å; N321-C324 VanDerWaalsContact O-N 3.16Å; N321-E325 WeakPolarHBondContact O-CG 3.33Å; N321-E325 PolarHBondContact O-N 2.96Å
322	A	93.5	Very high	92.9	Very high	23 Å²	23	47.4 Å²	47.4	19%	0.19	25%	0.245	C	C	.	.	H	α-helix	trans	-61.1	-41.1	174.5	0	0	0	0	0	111.9	L286 G318 L320 E325 M326	L286-A322 HydrophobicContact CD2-CB 4Å; G318-A322 WeakPolarHBondContact O-CB 3.31Å; G318-A322 PolarHBondContact O-N 3.41Å; L320-A322 VanDerWaalsContact C-N 3.34Å; L320-A322 PolarHBondContact O-N 3.14Å; A322-E325 PolarHBondContact O-N 3.21Å; A322-M326 VanDerWaalsContact O-CG 3.26Å; A322-M326 WeakPolarHBondContact O-CG 3.5Å; A322-M326 PolarHBondContact O-N 3.32Å
323	L	94.8	Very high	93.3	Very high	1 Å²	1	47 Å²	47	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-60.2	-46.6	172.3	174.5	58.4	0	0	0	111.6	A291 T292 F295 A319 L320 N321 E325 M326 T327 L348 L389	A291-L323 HydrophobicContact CB-CB 4.19Å; A291-L323 HydrophobicContact CB-CD1 4.3Å; T292-L323 WeakPolarHBondContact OG1-CD1 3.21Å; F295-L323 HydrophobicContact CD1-CD2 4.39Å; A319-L323 PolarHBondContact O-N 3.41Å; L320-L323 WeakPolarHBondContact O-CB 3.35Å; L320-L323 PolarHBondContact O-N 2.87Å; N321-L323 VanDerWaalsContact C-N 3.33Å; N321-L323 PolarHBondContact O-N 3.38Å; L323-E325 PolarHBondContact O-N 3.1Å; L323-M326 PolarHBondContact O-N 3.46Å; L323-T327 HydrophobicContact CD1-CG2 4.22Å; L323-T327 WeakPolarHBondContact O-CG2 3.49Å; L323-T327 PolarHBondContact O-N 3.23Å; L323-T327 VanDerWaalsContact O-N 3.08Å; L323-T327 PolarHBondContact O-OG1 3.43Å; L323-L348 HydrophobicContact CG-CD2 4.47Å; L323-L389 HydrophobicContact CD2-CD2 4.27Å
324	C	95	Very high	93.7	Very high	20 Å²	20	49.4 Å²	49.4	14%	0.135	27%	0.269	C	S	.	.	H	α-helix	trans	-58.6	-46.1	176.7	-69.9	0	0	0	0	111.9	L320 N321 M326 T327 Q328	L320-C324 PolarHBondContact O-N 2.96Å; L320-C324 PolarHBondContact O-SG 2.93Å; L320-C324 VanDerWaalsContact O-SG 3.35Å; N321-C324 WeakPolarHBondContact O-CB 3.31Å; N321-C324 PolarHBondContact O-N 3.31Å; N321-C324 VanDerWaalsContact O-N 3.16Å; C324-M326 PolarHBondContact O-N 3.28Å; C324-T327 WeakPolarHBondContact CA-OG1 3.31Å; C324-T327 PolarHBondContact O-N 3Å; C324-T327 PolarHBondContact O-OG1 3.04Å; C324-Q328 PolarHBondContact O-N 2.93Å
325	E	94.8	Very high	94	Very high	111 Å²	111	48.1 Å²	48.1	52%	0.519	26%	0.259	S	S	.	.	H	α-helix	trans	-58.3	-47.2	176.4	-73.3	174.7	-177.2	0	0	111.2	N321 A322 L323 T327 Q328	N321-E325 WeakPolarHBondContact O-CG 3.33Å; N321-E325 PolarHBondContact O-N 2.96Å; A322-E325 PolarHBondContact O-N 3.21Å; L323-E325 PolarHBondContact O-N 3.1Å; E325-T327 PolarHBondContact O-N 3.4Å; E325-Q328 VanDerWaalsContact O-CB 3.3Å; E325-Q328 WeakPolarHBondContact O-CB 3.29Å; E325-Q328 PolarHBondContact O-N 2.95Å
326	M	94.8	Very high	94.1	Very high	37 Å²	37	42.2 Å²	42.2	18%	0.182	24%	0.237	C	C	.	.	H	α-helix	trans	-68	-19.1	179.6	-63.5	-59	91.1	0	0	114	L286 A288 A291 A322 L323 C324 H452	L286-M326 HydrophobicContact CB-SD 4.41Å; L286-M326 HydrophobicContact CD2-CG 4.16Å; L286-M326 HydrophobicContact CD2-SD 4.37Å; L286-M326 HydrophobicContact CG-CG 4.15Å; L286-M326 HydrophobicContact CG-SD 4.24Å; A288-M326 HydrophobicContact CB-CB 4.05Å; A291-M326 HydrophobicContact CB-CG 4.3Å; A322-M326 VanDerWaalsContact O-CG 3.26Å; A322-M326 WeakPolarHBondContact O-CG 3.5Å; A322-M326 PolarHBondContact O-N 3.32Å; L323-M326 PolarHBondContact O-N 3.46Å; C324-M326 PolarHBondContact O-N 3.28Å; M326-H452 PolarHBondContact O-CE1 3.42Å; M326-H452 PolarHBondContact O-ND1 2.98Å
327	T	96.4	Very high	94.3	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.012	26%	0.261	C	S	.	.	H	α-helix	trans	-84.2	-12.6	173.3	54.2	0	0	0	0	113.6	L323 C324 E325 D329 F330 T331 L348 L393	L323-T327 HydrophobicContact CD1-CG2 4.22Å; L323-T327 WeakPolarHBondContact O-CG2 3.49Å; L323-T327 PolarHBondContact O-N 3.23Å; L323-T327 VanDerWaalsContact O-N 3.08Å; L323-T327 PolarHBondContact O-OG1 3.43Å; C324-T327 WeakPolarHBondContact CA-OG1 3.31Å; C324-T327 PolarHBondContact O-N 3Å; C324-T327 PolarHBondContact O-OG1 3.04Å; E325-T327 PolarHBondContact O-N 3.4Å; T327-D329 VanDerWaalsContact C-N 3.27Å; T327-D329 PolarHBondContact O-N 3.45Å; T327-F330 WeakPolarHBondContact O-CB 3.47Å; T327-F330 PolarHBondContact O-N 2.94Å; T327-T331 PolarHBondContact O-N 2.94Å; T327-L348 WeakPolarHBondContact OG1-CD1 3.48Å; T327-L393 HydrophobicContact CG2-CD1 3.84Å; T327-L393 HydrophobicContact CG2-CD2 4.06Å
328	Q	96.4	Very high	94.5	Very high	99 Å²	99	50.9 Å²	50.9	46%	0.463	28%	0.278	S	S	.	.	H	α-helix	trans	-63.1	-33.9	179.8	-72.3	174.5	-22.3	0	0	112.3	C324 E325 F330 T331 D332	C324-Q328 PolarHBondContact O-N 2.93Å; E325-Q328 VanDerWaalsContact O-CB 3.3Å; E325-Q328 WeakPolarHBondContact O-CB 3.29Å; E325-Q328 PolarHBondContact O-N 2.95Å; Q328-F330 PolarHBondContact O-N 3.16Å; Q328-F330 VanDerWaalsContact O-N 3.09Å; Q328-T331 WeakPolarHBondContact CA-OG1 3.33Å; Q328-T331 PolarHBondContact O-N 2.92Å; Q328-T331 VanDerWaalsContact O-N 3.1Å; Q328-T331 PolarHBondContact O-OG1 2.88Å; Q328-D332 VanDerWaalsContact O-CB 3.28Å; Q328-D332 WeakPolarHBondContact O-CB 3.38Å; Q328-D332 PolarHBondContact O-N 3.44Å
329	D	95.7	Very high	94.6	Very high	44 Å²	44	54.1 Å²	54.1	24%	0.235	28%	0.283	C	S	.	.	H	α-helix	trans	-55.7	-29.6	173.9	-77.4	-61.2	0	0	0	112.5	T327 R448 L449 H452	T327-D329 VanDerWaalsContact C-N 3.27Å; T327-D329 PolarHBondContact O-N 3.45Å; D329-R448 VanDerWaalsContact CG-CD 3.41Å; D329-R448 WeakPolarHBondContact OD1-CD 3.46Å; D329-R448 IonicContact OD1-CZ 3.1Å; D329-R448 IonicContact OD1-NE 2.67Å; D329-R448 IonicContact OD1-NH1 2.7Å; D329-R448 PolarHBondContact OD1-NH1 3.4Å; D329-L449 HydrophobicContact CB-CD2 4.03Å; D329-H452 IonicContact OD2-CD2 3.69Å; D329-H452 IonicContact OD2-CE1 3.75Å; D329-H452 IonicContact OD2-NE2 3.69Å; D329-H452 PolarHBondContact OD2-NE2 3.24Å
330	F	97.8	Very high	94.9	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-83.9	-42.6	175.3	-61.8	-100.6	0	0	0	112.1	A288 T327 Q328 T336 I344 L393 V396 L449 H452 I453	A288-F330 HydrophobicContact CB-CE2 4.4Å; T327-F330 WeakPolarHBondContact O-CB 3.47Å; T327-F330 PolarHBondContact O-N 2.94Å; Q328-F330 PolarHBondContact O-N 3.16Å; Q328-F330 VanDerWaalsContact O-N 3.09Å; F330-T336 WeakPolarHBondContact O-CB 3.43Å; F330-T336 PolarHBondContact O-OG1 3.46Å; F330-I344 HydrophobicContact CB-CD1 4.05Å; F330-L393 HydrophobicContact CB-CD2 4.12Å; F330-L393 HydrophobicContact CD1-CB 4.44Å; F330-L393 HydrophobicContact CD1-CD2 3.94Å; F330-L393 HydrophobicContact CD2-CD2 3.74Å; F330-L393 HydrophobicContact CE1-CB 4.05Å; F330-L393 HydrophobicContact CE1-CD2 4.28Å; F330-L393 WeakPolarHBondContact CE1-O 3.02Å; F330-L393 HydrophobicContact CE2-CD2 4.1Å; F330-L393 HydrophobicContact CG-CD2 3.65Å; F330-L393 HydrophobicContact CZ-CB 4.13Å; F330-L393 HydrophobicContact CZ-CD2 4.36Å; F330-V396 HydrophobicContact CD1-CB 4.15Å; F330-V396 HydrophobicContact CD1-CG1 3.96Å; F330-L449 HydrophobicContact CD1-CD1 4.44Å; F330-L449 HydrophobicContact CD1-CD2 3.82Å; F330-L449 HydrophobicContact CD2-CD2 4.01Å; F330-L449 HydrophobicContact CE1-CB 4.12Å; F330-L449 HydrophobicContact CE1-CD2 3.86Å; F330-L449 HydrophobicContact CE1-CG 4.4Å; F330-L449 HydrophobicContact CE2-CD2 4.06Å; F330-L449 HydrophobicContact CG-CD2 3.89Å; F330-L449 HydrophobicContact CZ-CB 4.35Å; F330-L449 HydrophobicContact CZ-CD2 3.98Å; F330-H452 HydrophobicContact CE2-CB 3.45Å; F330-H452 VanDerWaalsContact CE2-CB 3.45Å; F330-H452 AromaticContact CE2-CG 3.83Å; F330-H452 HydrophobicContact CZ-CB 3.53Å; F330-I453 HydrophobicContact CE1-CG2 3.94Å; F330-I453 HydrophobicContact CZ-CG2 3.67Å
331	T	96.7	Very high	95	Very high	12 Å²	12	57.5 Å²	57.5	7%	0.074	29%	0.293	C	S	.	.	H	α-helix	trans	-76	-31.9	-175	58.8	0	0	0	0	112.6	T327 Q328 R341 I344 L345	T327-T331 PolarHBondContact O-N 2.94Å; Q328-T331 WeakPolarHBondContact CA-OG1 3.33Å; Q328-T331 PolarHBondContact O-N 2.92Å; Q328-T331 VanDerWaalsContact O-N 3.1Å; Q328-T331 PolarHBondContact O-OG1 2.88Å; T331-R341 HydrophobicContact CG2-CG 4.28Å; T331-R341 WeakPolarHBondContact O-CD 3.17Å; T331-R341 PolarHBondContact O-NE 3.05Å; T331-I344 HydrophobicContact CG2-CB 4.27Å; T331-I344 HydrophobicContact CG2-CG2 3.75Å; T331-L345 HydrophobicContact CG2-CD2 4.14Å; T331-L345 HydrophobicContact CG2-CG 4.28Å
332	D	94.8	Very high	95.2	Very high	122 Å²	122	58.5 Å²	58.5	65%	0.652	30%	0.295	S	S	*	.	S	Bend	trans	-90.4	-12.6	-175.5	-62.7	-0.5	0	0	0	111.8	Q328 A334	Q328-D332 VanDerWaalsContact O-CB 3.28Å; Q328-D332 WeakPolarHBondContact O-CB 3.38Å; Q328-D332 PolarHBondContact O-N 3.44Å; D332-A334 PolarHBondContact O-N 3.25Å
333	S	94.2	Very high	95.3	Very high	5 Å²	5	59.5 Å²	59.5	4%	0.035	30%	0.296	C	S	.	.			trans	-53.5	127.9	170.3	178.5	0	0	0	0	111.4	Y335 T336 R341 Q400 E445	S333-Y335 PolarHBondContact O-N 3.07Å; S333-Y335 PolarHBondContact OG-N 3.41Å; S333-T336 WeakPolarHBondContact CB-OG1 3.31Å; S333-T336 PolarHBondContact O-N 3.27Å; S333-R341 PolarHBondContact O-NH2 2.73Å; S333-Q400 PolarHBondContact OG-NE2 2.85Å; S333-E445 VanDerWaalsContact CA-OE1 3.26Å; S333-E445 WeakPolarHBondContact CA-OE1 3.4Å; S333-E445 WeakPolarHBondContact CB-OE1 3.33Å; S333-E445 PolarHBondContact OG-OE1 3.45Å
334	A	93.6	Very high	95.5	Very high	90 Å²	90	59.4 Å²	59.4	74%	0.744	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-19.2	173.2	0	0	0	0	0	112.4	D332	D332-A334 PolarHBondContact O-N 3.25Å
335	Y	93.1	Very high	95.6	Very high	117 Å²	117	62.6 Å²	62.6	46%	0.459	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-9.6	-175.4	-55.4	-86.5	0	0	0	112.9	S333 H337 H442	S333-Y335 PolarHBondContact O-N 3.07Å; S333-Y335 PolarHBondContact OG-N 3.41Å; Y335-H337 PolarHBondContact O-N 2.84Å; Y335-H442 AromaticContact CD1-CE1 3.53Å; Y335-H442 AromaticContact CD1-ND1 4Å; Y335-H442 AromaticContact CD2-CE1 3.42Å; Y335-H442 VanDerWaalsContact CD2-CE1 3.42Å; Y335-H442 WeakPolarHBondContact CD2-CE1 3.24Å; Y335-H442 AromaticContact CD2-ND1 3.28Å; Y335-H442 VanDerWaalsContact CD2-ND1 3.28Å; Y335-H442 WeakPolarHBondContact CD2-ND1 3.43Å; Y335-H442 AromaticContact CE1-CE1 3.65Å; Y335-H442 AromaticContact CE1-ND1 3.77Å; Y335-H442 AromaticContact CE1-NE2 3.95Å; Y335-H442 HydrophobicContact CE2-CB 4.31Å; Y335-H442 AromaticContact CE2-CE1 3.58Å; Y335-H442 AromaticContact CE2-CG 3.78Å; Y335-H442 AromaticContact CE2-ND1 3.03Å; Y335-H442 WeakPolarHBondContact CE2-ND1 3.46Å; Y335-H442 AromaticContact CG-CE1 3.4Å; Y335-H442 AromaticContact CG-ND1 3.77Å; Y335-H442 AromaticContact CZ-CE1 3.68Å; Y335-H442 AromaticContact CZ-CG 3.61Å; Y335-H442 AromaticContact CZ-ND1 3.28Å; Y335-H442 VanDerWaalsContact CZ-ND1 3.28Å
336	T	93.1	Very high	95.7	Very high	8 Å²	8	61.4 Å²	61.4	5%	0.049	31%	0.308	C	S	.	.	S	Bend	trans	-77.6	121.4	174.3	-62.8	0	0	0	0	111.4	F330 S333 H340 R341 V396 Q400	F330-T336 WeakPolarHBondContact O-CB 3.43Å; F330-T336 PolarHBondContact O-OG1 3.46Å; S333-T336 WeakPolarHBondContact CB-OG1 3.31Å; S333-T336 PolarHBondContact O-N 3.27Å; T336-H340 HydrophobicContact CG2-CB 4.09Å; T336-R341 HydrophobicContact CG2-CB 4.19Å; T336-R341 VanDerWaalsContact O-CZ 3.28Å; T336-R341 PolarHBondContact O-NH1 3.2Å; T336-R341 PolarHBondContact O-NH2 3.38Å; T336-V396 HydrophobicContact CG2-CG1 3.92Å; T336-Q400 PolarHBondContact OG1-NE2 3.4Å
337	H	93.3	Very high	95.9	Very high	106 Å²	106	61.5 Å²	61.5	49%	0.491	31%	0.307	S	S	.	.			trans	-57.4	145.5	174.6	-67.9	-64.8	0	0	0	112.7	Y335 H339 H340 R341	Y335-H337 PolarHBondContact O-N 2.84Å; H337-H339 VanDerWaalsContact C-N 3.31Å; H337-H339 PolarHBondContact O-N 3.1Å; H337-H340 PolarHBondContact O-N 2.9Å; H337-H340 VanDerWaalsContact O-N 3.14Å; H337-R341 PolarHBondContact O-N 2.91Å; H337-R341 VanDerWaalsContact O-N 3.09Å
338	H	94.1	Very high	95.9	Very high	138 Å²	138	62 Å²	62	64%	0.639	31%	0.31	S	S	*	.	H	α-helix	trans	-55.4	-43.4	-176.1	-172	68.6	0	0	0	113.2	H340 R341 E342	H338-H340 PolarHBondContact O-N 2.96Å; H338-R341 WeakPolarHBondContact O-CB 3.38Å; H338-R341 PolarHBondContact O-N 3.41Å; H338-E342 WeakPolarHBondContact O-CB 3.47Å; H338-E342 PolarHBondContact O-N 3.06Å
339	H	95.6	Very high	95.8	Very high	108 Å²	108	59.7 Å²	59.7	50%	0.5	31%	0.305	S	S	.	.	H	α-helix	trans	-61.4	-41.2	179	-177.9	53.2	0	0	0	113.1	H337 E342 Q343	H337-H339 VanDerWaalsContact C-N 3.31Å; H337-H339 PolarHBondContact O-N 3.1Å; H339-E342 PolarHBondContact O-N 3.33Å; H339-Q343 PolarHBondContact CE1-NE2 3.06Å; H339-Q343 PolarHBondContact NE2-NE2 3.48Å; H339-Q343 WeakPolarHBondContact O-CG 3.23Å; H339-Q343 PolarHBondContact O-N 2.73Å
340	H	96.6	Very high	95.8	Very high	33 Å²	33	62 Å²	62	15%	0.153	31%	0.314	C	S	.	.	H	α-helix	trans	-68.8	-40.3	176.9	-67.3	-47.9	0	0	0	112.1	T336 H337 H338 E342 Q343 I344 L395 V396	T336-H340 HydrophobicContact CG2-CB 4.09Å; H337-H340 PolarHBondContact O-N 2.9Å; H337-H340 VanDerWaalsContact O-N 3.14Å; H338-H340 PolarHBondContact O-N 2.96Å; H340-E342 VanDerWaalsContact C-N 3.35Å; H340-Q343 PolarHBondContact O-N 3.47Å; H340-I344 VanDerWaalsContact O-CG1 3.32Å; H340-I344 WeakPolarHBondContact O-CG1 3.48Å; H340-I344 PolarHBondContact O-N 2.9Å; H340-L395 WeakPolarHBondContact CE1-CD2 3.25Å; H340-V396 HydrophobicContact CB-CG2 3.54Å
341	R	97.2	Very high	95.7	Very high	56 Å²	56	62 Å²	62	21%	0.211	31%	0.314	C	S	.	.	H	α-helix	trans	-58.8	-47	174.3	-177.5	-172.8	-67	89.7	1.2	111.2	T331 S333 T336 H337 H338 I344 L345	T331-R341 HydrophobicContact CG2-CG 4.28Å; T331-R341 WeakPolarHBondContact O-CD 3.17Å; T331-R341 PolarHBondContact O-NE 3.05Å; S333-R341 PolarHBondContact O-NH2 2.73Å; T336-R341 HydrophobicContact CG2-CB 4.19Å; T336-R341 VanDerWaalsContact O-CZ 3.28Å; T336-R341 PolarHBondContact O-NH1 3.2Å; T336-R341 PolarHBondContact O-NH2 3.38Å; H337-R341 PolarHBondContact O-N 2.91Å; H337-R341 VanDerWaalsContact O-N 3.09Å; H338-R341 WeakPolarHBondContact O-CB 3.38Å; H338-R341 PolarHBondContact O-N 3.41Å; R341-I344 PolarHBondContact O-N 3.2Å; R341-L345 HydrophobicContact CG-CD1 4.23Å; R341-L345 VanDerWaalsContact O-CG 3.31Å; R341-L345 WeakPolarHBondContact O-CG 3.47Å; R341-L345 PolarHBondContact O-N 2.75Å; R341-L345 VanDerWaalsContact O-N 3.1Å
342	E	96.9	Very high	95.6	Very high	96 Å²	96	66.8 Å²	66.8	45%	0.449	33%	0.331	S	S	.	.	H	α-helix	trans	-59.5	-48.9	177	-172.9	178.7	-157.5	0	0	111.2	H338 H339 H340 I344 L345 D346	H338-E342 WeakPolarHBondContact O-CB 3.47Å; H338-E342 PolarHBondContact O-N 3.06Å; H339-E342 PolarHBondContact O-N 3.33Å; H340-E342 VanDerWaalsContact C-N 3.35Å; E342-I344 PolarHBondContact O-N 3.28Å; E342-L345 PolarHBondContact O-N 2.69Å; E342-L345 VanDerWaalsContact O-N 3.16Å; E342-D346 WeakPolarHBondContact O-CB 3.09Å; E342-D346 PolarHBondContact O-N 2.96Å
343	Q	97.4	Very high	95.5	Very high	44 Å²	44	65.5 Å²	65.5	21%	0.206	32%	0.324	C	S	.	.	H	α-helix	trans	-58	-42.7	177.3	-75.3	177.5	-15.8	0	0	113.5	H339 H340 D346 F347 Q392	H339-Q343 PolarHBondContact CE1-NE2 3.06Å; H339-Q343 PolarHBondContact NE2-NE2 3.48Å; H339-Q343 WeakPolarHBondContact O-CG 3.23Å; H339-Q343 PolarHBondContact O-N 2.73Å; H340-Q343 PolarHBondContact O-N 3.47Å; Q343-D346 PolarHBondContact O-N 3.41Å; Q343-F347 WeakPolarHBondContact O-CD2 3.41Å; Q343-F347 WeakPolarHBondContact O-CG 3.46Å; Q343-F347 PolarHBondContact O-N 2.92Å; Q343-F347 VanDerWaalsContact O-N 3.08Å; Q343-Q392 VanDerWaalsContact OE1-CD 3.3Å
344	I	97.7	Very high	95.3	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-61.3	-48	176.9	-70.3	163.6	0	0	0	110	F330 T331 H340 R341 E342 D346 F347 L348 L389 Q392 L393 V396	F330-I344 HydrophobicContact CB-CD1 4.05Å; T331-I344 HydrophobicContact CG2-CB 4.27Å; T331-I344 HydrophobicContact CG2-CG2 3.75Å; H340-I344 VanDerWaalsContact O-CG1 3.32Å; H340-I344 WeakPolarHBondContact O-CG1 3.48Å; H340-I344 PolarHBondContact O-N 2.9Å; R341-I344 PolarHBondContact O-N 3.2Å; E342-I344 PolarHBondContact O-N 3.28Å; I344-D346 VanDerWaalsContact C-N 3.33Å; I344-D346 PolarHBondContact O-N 3.41Å; I344-F347 PolarHBondContact O-N 3.47Å; I344-L348 HydrophobicContact CG2-CD1 4.15Å; I344-L348 WeakPolarHBondContact O-CG 3.38Å; I344-L348 PolarHBondContact O-N 3.43Å; I344-L348 VanDerWaalsContact O-N 3.15Å; I344-L389 HydrophobicContact CB-CD1 4.37Å; I344-L389 HydrophobicContact CG1-CD1 4.35Å; I344-L389 HydrophobicContact CG2-CD1 3.94Å; I344-Q392 HydrophobicContact CG1-CB 4.4Å; I344-L393 HydrophobicContact CD1-CD2 3.79Å; I344-L393 HydrophobicContact CG1-CD2 4.07Å; I344-L393 HydrophobicContact CG2-CD2 4.34Å; I344-V396 HydrophobicContact CD1-CG2 4.26Å
345	L	97.3	Very high	95	Very high	86 Å²	86	62.6 Å²	62.6	45%	0.45	30%	0.295	S	S	.	.	H	α-helix	trans	-63.8	-38.7	179.3	-67.3	173.5	0	0	0	112	T331 R341 E342 L348 S349	T331-L345 HydrophobicContact CG2-CD2 4.14Å; T331-L345 HydrophobicContact CG2-CG 4.28Å; R341-L345 HydrophobicContact CG-CD1 4.23Å; R341-L345 VanDerWaalsContact O-CG 3.31Å; R341-L345 WeakPolarHBondContact O-CG 3.47Å; R341-L345 PolarHBondContact O-N 2.75Å; R341-L345 VanDerWaalsContact O-N 3.1Å; E342-L345 PolarHBondContact O-N 2.69Å; E342-L345 VanDerWaalsContact O-N 3.16Å; L345-L348 PolarHBondContact O-N 3.27Å; L345-S349 WeakPolarHBondContact O-CB 3.33Å; L345-S349 PolarHBondContact O-N 3.37Å
346	D	97.7	Very high	94.6	Very high	86 Å²	86	59 Å²	59	46%	0.46	29%	0.287	S	S	.	.	H	α-helix	trans	-60.5	-48.9	176.2	-75.8	-14.9	0	0	0	111.1	E342 Q343 I344 L348 S349 E350	E342-D346 WeakPolarHBondContact O-CB 3.09Å; E342-D346 PolarHBondContact O-N 2.96Å; Q343-D346 PolarHBondContact O-N 3.41Å; I344-D346 VanDerWaalsContact C-N 3.33Å; I344-D346 PolarHBondContact O-N 3.41Å; D346-L348 VanDerWaalsContact C-N 3.33Å; D346-L348 PolarHBondContact O-N 2.9Å; D346-S349 PolarHBondContact O-N 2.93Å; D346-S349 PolarHBondContact O-OG 3.1Å; D346-E350 WeakPolarHBondContact O-CB 3.47Å; D346-E350 PolarHBondContact O-N 3.04Å
347	F	97.6	Very high	94	Very high	39 Å²	39	64.4 Å²	64.4	17%	0.171	32%	0.316	C	S	.	.	H	α-helix	trans	-60.7	-40.1	177.2	-71.5	-49	0	0	0	113.1	Q343 I344 T351 I385 D388 L389 Q392	Q343-F347 WeakPolarHBondContact O-CD2 3.41Å; Q343-F347 WeakPolarHBondContact O-CG 3.46Å; Q343-F347 PolarHBondContact O-N 2.92Å; Q343-F347 VanDerWaalsContact O-N 3.08Å; I344-F347 PolarHBondContact O-N 3.47Å; F347-T351 WeakPolarHBondContact O-CB 3.49Å; F347-T351 PolarHBondContact O-N 3.28Å; F347-T351 PolarHBondContact O-OG1 3.48Å; F347-I385 HydrophobicContact CB-CG2 3.91Å; F347-I385 HydrophobicContact CD1-CG2 3.82Å; F347-I385 HydrophobicContact CG-CG2 4.25Å; F347-I385 WeakPolarHBondContact O-CG2 3.33Å; F347-D388 HydrophobicContact CE1-CB 4.05Å; F347-D388 HydrophobicContact CZ-CB 3.92Å; F347-L389 HydrophobicContact CB-CB 4.1Å; F347-L389 HydrophobicContact CB-CD1 4.26Å; F347-L389 HydrophobicContact CD2-CB 4.26Å; F347-L389 HydrophobicContact CD2-CD1 4.42Å; F347-L389 HydrophobicContact CG-CB 4.34Å; F347-Q392 HydrophobicContact CD2-CG 4.3Å; F347-Q392 HydrophobicContact CE2-CG 3.59Å
348	L	96.4	Very high	93.2	Very high	13 Å²	13	59.8 Å²	59.8	7%	0.068	30%	0.295	C	S	.	.	H	α-helix	trans	-66.6	-41.2	176.6	-66.1	172.5	0	0	0	111.4	L323 T327 I344 L345 D346 T351 R352 L389	L323-L348 HydrophobicContact CG-CD2 4.47Å; T327-L348 WeakPolarHBondContact OG1-CD1 3.48Å; I344-L348 HydrophobicContact CG2-CD1 4.15Å; I344-L348 WeakPolarHBondContact O-CG 3.38Å; I344-L348 PolarHBondContact O-N 3.43Å; I344-L348 VanDerWaalsContact O-N 3.15Å; L345-L348 PolarHBondContact O-N 3.27Å; D346-L348 VanDerWaalsContact C-N 3.33Å; D346-L348 PolarHBondContact O-N 2.9Å; L348-T351 PolarHBondContact O-N 3.02Å; L348-R352 PolarHBondContact O-N 3.3Å; L348-L389 HydrophobicContact CD2-CD2 3.67Å; L348-L389 HydrophobicContact CG-CD2 4.39Å
349	S	95.9	Very high	92.3	Very high	51 Å²	51	53.4 Å²	53.4	36%	0.357	27%	0.266	S	S	.	.	H	α-helix	trans	-66.4	-42.8	177.7	80.6	0	0	0	0	111.9	L345 D346 T351 R352 N353	L345-S349 WeakPolarHBondContact O-CB 3.33Å; L345-S349 PolarHBondContact O-N 3.37Å; D346-S349 PolarHBondContact O-N 2.93Å; D346-S349 PolarHBondContact O-OG 3.1Å; S349-T351 PolarHBondContact O-N 3.29Å; S349-R352 PolarHBondContact O-N 3.06Å; S349-N353 WeakPolarHBondContact O-CB 3.17Å; S349-N353 PolarHBondContact O-N 2.93Å; S349-N353 PolarHBondContact O-ND2 3.4Å
350	E	95.7	Very high	91.1	Very high	92 Å²	92	53.5 Å²	53.5	43%	0.43	27%	0.266	S	S	.	.	H	α-helix	trans	-63.3	-43.2	177	-167.7	-178.2	173.6	0	0	110.7	D346 R352 N353 L354 I385	D346-E350 WeakPolarHBondContact O-CB 3.47Å; D346-E350 PolarHBondContact O-N 3.04Å; E350-R352 PolarHBondContact O-N 3.16Å; E350-N353 PolarHBondContact O-N 3.31Å; E350-L354 HydrophobicContact CG-CD1 4.36Å; E350-L354 WeakPolarHBondContact O-CG 3.49Å; E350-L354 PolarHBondContact O-N 2.88Å; E350-I385 HydrophobicContact CB-CD1 4.29Å; E350-I385 VanDerWaalsContact CD-CD1 3.44Å; E350-I385 HydrophobicContact CG-CD1 3.67Å; E350-I385 WeakPolarHBondContact OE1-CD1 3.23Å
351	T	95.2	Very high	89.3	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.006	27%	0.271	C	S	.	.	H	α-helix	trans	-59.2	-47.8	174.8	-60.3	0	0	0	0	111.5	F295 L320 F347 L348 S349 N353 L354 L355 V382 I385	F295-T351 HydrophobicContact CE1-CG2 3.97Å; F295-T351 HydrophobicContact CZ-CG2 3.86Å; L320-T351 HydrophobicContact CD1-CG2 3.84Å; F347-T351 WeakPolarHBondContact O-CB 3.49Å; F347-T351 PolarHBondContact O-N 3.28Å; F347-T351 PolarHBondContact O-OG1 3.48Å; L348-T351 PolarHBondContact O-N 3.02Å; S349-T351 PolarHBondContact O-N 3.29Å; T351-N353 PolarHBondContact O-N 3.43Å; T351-L354 PolarHBondContact O-N 3.49Å; T351-L355 HydrophobicContact CG2-CD1 4.34Å; T351-L355 WeakPolarHBondContact O-CG 3.32Å; T351-L355 PolarHBondContact O-N 2.91Å; T351-V382 HydrophobicContact CG2-CG1 3.87Å; T351-I385 VanDerWaalsContact OG1-CG2 3.26Å; T351-I385 WeakPolarHBondContact OG1-CG2 3.32Å
352	R	94.3	Very high	87.1	Confident	112 Å²	112	60.2 Å²	60.2	42%	0.423	30%	0.303	S	S	.	.	H	α-helix	trans	-61.3	-45	178.6	-175.2	177.2	-76.8	142.9	-3.4	111.3	L320 L348 S349 E350 L355 S356	L320-R352 HydrophobicContact CD2-CB 4.34Å; L348-R352 PolarHBondContact O-N 3.3Å; S349-R352 PolarHBondContact O-N 3.06Å; E350-R352 PolarHBondContact O-N 3.16Å; R352-L355 PolarHBondContact O-N 3.39Å; R352-S356 PolarHBondContact O-N 2.93Å; R352-S356 PolarHBondContact O-OG 2.95Å
353	N	91.9	Very high	84.9	Confident	95 Å²	95	62.9 Å²	62.9	51%	0.508	32%	0.32	S	S	.	.	H	α-helix	trans	-63.3	-44.4	179.7	-69.2	-24.5	0	0	0	112.2	S349 E350 T351 L355 S356 N357	S349-N353 WeakPolarHBondContact O-CB 3.17Å; S349-N353 PolarHBondContact O-N 2.93Å; S349-N353 PolarHBondContact O-ND2 3.4Å; E350-N353 PolarHBondContact O-N 3.31Å; T351-N353 PolarHBondContact O-N 3.43Å; N353-L355 VanDerWaalsContact C-N 3.34Å; N353-L355 PolarHBondContact O-N 3.16Å; N353-S356 PolarHBondContact O-N 3.41Å; N353-N357 VanDerWaalsContact O-CG 3.24Å; N353-N357 PolarHBondContact O-N 3.41Å; N353-N357 VanDerWaalsContact O-N 3.12Å; N353-N357 PolarHBondContact O-ND2 3.34Å
354	L	90.3	Very high	82.7	Confident	31 Å²	31	63.8 Å²	63.8	16%	0.162	33%	0.334	C	S	.	.	H	α-helix	trans	-63.6	-39	177.1	-72.2	174.9	0	0	0	112.3	E350 T351 L358 R381 V382 I385	E350-L354 HydrophobicContact CG-CD1 4.36Å; E350-L354 WeakPolarHBondContact O-CG 3.49Å; E350-L354 PolarHBondContact O-N 2.88Å; T351-L354 PolarHBondContact O-N 3.49Å; L354-L358 PolarHBondContact O-N 2.92Å; L354-R381 HydrophobicContact CD1-CB 4.1Å; L354-V382 HydrophobicContact CB-CG2 3.9Å; L354-V382 HydrophobicContact CD1-CG2 4.09Å; L354-I385 HydrophobicContact CD1-CD1 3.36Å
355	L	87.9	Confident	80.2	Confident	2 Å²	2	72.5 Å²	72.5	1%	0.01	38%	0.381	C	S	.	.	H	α-helix	trans	-70.7	-41	175.9	-73.8	-179.4	0	0	0	112.9	F295 L299 I316 L320 T351 R352 N353 N357 L358 L359 V382	F295-L355 HydrophobicContact CE2-CD1 3.71Å; F295-L355 HydrophobicContact CZ-CD1 3.48Å; F295-L355 VanDerWaalsContact CZ-CD1 3.48Å; F295-L355 HydrophobicContact CZ-CG 4.49Å; L299-L355 HydrophobicContact CD2-CD2 3.89Å; I316-L355 HydrophobicContact CG2-CD1 3.69Å; I316-L355 HydrophobicContact CG2-CD2 4.19Å; L320-L355 HydrophobicContact CD2-CD1 3.95Å; T351-L355 HydrophobicContact CG2-CD1 4.34Å; T351-L355 WeakPolarHBondContact O-CG 3.32Å; T351-L355 PolarHBondContact O-N 2.91Å; R352-L355 PolarHBondContact O-N 3.39Å; N353-L355 VanDerWaalsContact C-N 3.34Å; N353-L355 PolarHBondContact O-N 3.16Å; L355-N357 VanDerWaalsContact C-N 3.26Å; L355-N357 PolarHBondContact O-N 3.2Å; L355-L358 HydrophobicContact CD2-CD2 4.48Å; L355-L358 WeakPolarHBondContact O-CB 3.49Å; L355-L358 PolarHBondContact O-N 3.45Å; L355-L359 WeakPolarHBondContact O-CB 3.32Å; L355-L359 VanDerWaalsContact O-CG 3.3Å; L355-L359 WeakPolarHBondContact O-CG 3.37Å; L355-L359 PolarHBondContact O-N 3.01Å; L355-V382 HydrophobicContact CD2-CG2 4.39Å; L355-V382 HydrophobicContact CG-CG2 4.47Å
356	S	85.4	Confident	78	Confident	41 Å²	41	71.7 Å²	71.7	29%	0.287	39%	0.394	S	S	.	.	H	α-helix	trans	-57.2	-42.4	174.9	-71.8	0	0	0	0	111.4	R352 N353 L358 L359 Q360	R352-S356 PolarHBondContact O-N 2.93Å; R352-S356 PolarHBondContact O-OG 2.95Å; N353-S356 PolarHBondContact O-N 3.41Å; S356-L358 VanDerWaalsContact C-N 3.29Å; S356-L358 PolarHBondContact O-N 3.05Å; S356-L359 PolarHBondContact O-N 3.28Å; S356-Q360 PolarHBondContact O-N 2.99Å
357	N	79.4	Confident	75.4	Confident	122 Å²	122	71.3 Å²	71.3	65%	0.652	41%	0.41	S	S	*	.	H	α-helix	trans	-64.3	-32	175.6	-67	-21.7	0	0	0	113	N353 L355	N353-N357 VanDerWaalsContact O-CG 3.24Å; N353-N357 PolarHBondContact O-N 3.41Å; N353-N357 VanDerWaalsContact O-N 3.12Å; N353-N357 PolarHBondContact O-ND2 3.34Å; L355-N357 VanDerWaalsContact C-N 3.26Å; L355-N357 PolarHBondContact O-N 3.2Å
358	L	76.3	Confident	73.4	Confident	9 Å²	9	71.5 Å²	71.5	5%	0.047	42%	0.423	C	S	.	.	H	α-helix	trans	-78.5	-40.3	178.5	-173	72.1	0	0	0	112.6	L354 L355 S356 L370 I375 A378	L354-L358 PolarHBondContact O-N 2.92Å; L355-L358 HydrophobicContact CD2-CD2 4.48Å; L355-L358 WeakPolarHBondContact O-CB 3.49Å; L355-L358 PolarHBondContact O-N 3.45Å; S356-L358 VanDerWaalsContact C-N 3.29Å; S356-L358 PolarHBondContact O-N 3.05Å; L358-L370 VanDerWaalsContact O-CD1 3.29Å; L358-L370 WeakPolarHBondContact O-CD1 3.41Å; L358-I375 HydrophobicContact CD1-CB 4.43Å; L358-I375 HydrophobicContact CD1-CG1 4.02Å; L358-A378 HydrophobicContact CD1-CB 3.78Å; L358-A378 HydrophobicContact CD2-CB 4.21Å; L358-A378 HydrophobicContact CG-CB 4.4Å
359	L	75.7	Confident	71.6	Confident	5 Å²	5	76.9 Å²	76.9	3%	0.026	46%	0.459	C	S	.	.	H	α-helix	trans	-92.1	-19.1	-169	-60.4	-176.5	0	0	0	113.5	V308 Q313 I316 F317 L355 S356 P361	V308-L359 HydrophobicContact CG1-CD2 3.22Å; Q313-L359 HydrophobicContact CB-CD1 4.46Å; Q313-L359 HydrophobicContact CG-CD2 4.11Å; Q313-L359 PolarHBondContact NE2-O 3.29Å; I316-L359 HydrophobicContact CD1-CD1 4.43Å; I316-L359 HydrophobicContact CD1-CD2 4.18Å; I316-L359 HydrophobicContact CG2-CD1 4.27Å; F317-L359 HydrophobicContact CD2-CD1 4.18Å; F317-L359 HydrophobicContact CE1-CD1 4.33Å; F317-L359 HydrophobicContact CE2-CD1 3.48Å; F317-L359 VanDerWaalsContact CE2-CD1 3.48Å; F317-L359 HydrophobicContact CZ-CB 4.48Å; F317-L359 HydrophobicContact CZ-CD1 3.57Å; L355-L359 WeakPolarHBondContact O-CB 3.32Å; L355-L359 VanDerWaalsContact O-CG 3.3Å; L355-L359 WeakPolarHBondContact O-CG 3.37Å; L355-L359 PolarHBondContact O-N 3.01Å; S356-L359 PolarHBondContact O-N 3.28Å; L359-P361 WeakPolarHBondContact O-CD 3.49Å
360	Q	70.4	Confident	70.1	Confident	110 Å²	110	77.1 Å²	77.1	51%	0.514	46%	0.456	S	S	.	.			trans	-122.5	66.2	176	-65.7	-177.9	-1.3	0	0	111.5	S356 E362	S356-Q360 PolarHBondContact O-N 2.99Å; Q360-E362 PolarHBondContact O-N 2.99Å; Q360-E362 VanDerWaalsContact O-N 3.13Å
361	P	57.9	Low	69.1	Low	38 Å²	38	79.5 Å²	79.5	25%	0.247	47%	0.465	C	S	.	.	G	3₁₀ helix	trans	-66.7	-11.1	176.6	29.2	-34.8	0	0	0	112.7	L359 L363 A364 L370	L359-P361 WeakPolarHBondContact O-CD 3.49Å; P361-L363 PolarHBondContact O-N 2.6Å; P361-A364 WeakPolarHBondContact O-CA 3.49Å; P361-A364 WeakPolarHBondContact O-CB 3.38Å; P361-A364 PolarHBondContact O-N 3.48Å; P361-L370 HydrophobicContact CB-CD2 4.04Å; P361-L370 HydrophobicContact CG-CD1 4.42Å; P361-L370 HydrophobicContact CG-CD2 4.13Å; P361-L370 HydrophobicContact CG-CG 4.14Å
362	E	51.7	Low	68.3	Low	192 Å²	192	83.9 Å²	83.9	90%	0.897	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-61.8	-14.6	178.8	-64.1	-175.8	171.8	0	0	113.8	Q360	Q360-E362 PolarHBondContact O-N 2.99Å; Q360-E362 VanDerWaalsContact O-N 3.13Å
363	L	51.8	Low	67.7	Low	152 Å²	152	85.5 Å²	85.5	80%	0.796	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-93.7	-12.8	171.4	-68.6	165.8	0	0	0	113.3	P361	P361-L363 PolarHBondContact O-N 2.6Å
364	A	49.6	Very low	67.3	Low	62 Å²	62	85.1 Å²	85.1	51%	0.512	50%	0.496	S	S	.	.	S	Bend	trans	-86	119.5	177.1	0	0	0	0	0	109.4	P361 G366	P361-A364 WeakPolarHBondContact O-CA 3.49Å; P361-A364 WeakPolarHBondContact O-CB 3.38Å; P361-A364 PolarHBondContact O-N 3.48Å; A364-G366 VanDerWaalsContact C-N 3.3Å; A364-G366 PolarHBondContact O-N 2.88Å
365	D	46.1	Very low	67.1	Low	183 Å²	183	83.8 Å²	83.8	98%	0.979	49%	0.489	S	S	*	.	S	Bend	trans	-62.3	86.2	179.8	-158.7	19	0	0	0	110.3
366	G	50.1	Low	67.1	Low	69 Å²	69	86.7 Å²	86.7	71%	0.711	51%	0.505	S	S	*	.	S	Bend	trans	152.2	37.4	-174.5	0	0	0	0	0	115.4	A364 G368	A364-G366 VanDerWaalsContact C-N 3.3Å; A364-G366 PolarHBondContact O-N 2.88Å; G366-G368 PolarHBondContact O-N 3.01Å
367	G	44.2	Very low	67.3	Low	79 Å²	79	88 Å²	88	81%	0.814	51%	0.511	S	S	*	.			trans	-54	60.1	-171.4	0	0	0	0	0	118.2
368	G	55.3	Low	67.8	Low	42 Å²	42	82.9 Å²	82.9	43%	0.433	49%	0.486	S	S	.	.	S	Bend	trans	-88.9	162.5	161.9	0	0	0	0	0	111.4	G366 L370	G366-G368 PolarHBondContact O-N 3.01Å; G368-L370 PolarHBondContact O-N 3.17Å
369	P	59.4	Low	68.5	Low	126 Å²	126	82.6 Å²	82.6	82%	0.818	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-53.5	136.4	170.4	23.3	-32.3	0	0	0	110.1	K371	P369-K371 PolarHBondContact O-N 2.89Å; P369-K371 VanDerWaalsContact O-N 3.14Å
370	L	64.3	Low	69.3	Low	57 Å²	57	85.4 Å²	85.4	30%	0.298	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-48.2	121.2	176.5	-73.1	163.7	0	0	0	109.4	V308 L358 P361 G368 I375	V308-L370 HydrophobicContact CB-CD1 4.43Å; V308-L370 HydrophobicContact CG2-CD1 4.16Å; L358-L370 VanDerWaalsContact O-CD1 3.29Å; L358-L370 WeakPolarHBondContact O-CD1 3.41Å; P361-L370 HydrophobicContact CB-CD2 4.04Å; P361-L370 HydrophobicContact CG-CD1 4.42Å; P361-L370 HydrophobicContact CG-CD2 4.13Å; P361-L370 HydrophobicContact CG-CG 4.14Å; G368-L370 PolarHBondContact O-N 3.17Å; L370-I375 HydrophobicContact CB-CD1 4.15Å; L370-I375 HydrophobicContact CB-CG1 4.28Å
371	K	73.3	Confident	70.5	Confident	141 Å²	141	87.3 Å²	87.3	61%	0.613	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-71.2	142	176.2	-63.3	177.3	-179.4	172.2	0	108.3	P369 E373 D374 I375	P369-K371 PolarHBondContact O-N 2.89Å; P369-K371 VanDerWaalsContact O-N 3.14Å; K371-E373 PolarHBondContact O-N 3.34Å; K371-E373 VanDerWaalsContact O-N 3.15Å; K371-D374 WeakPolarHBondContact CB-OD2 3.26Å; K371-D374 WeakPolarHBondContact O-CB 3.43Å; K371-D374 PolarHBondContact O-N 3.41Å; K371-I375 PolarHBondContact O-N 3.11Å
372	M	79.2	Confident	72.3	Confident	93 Å²	93	85.5 Å²	85.5	46%	0.458	50%	0.496	S	S	.	.	H	α-helix	trans	-55.5	-33.9	177.3	-165.2	66.5	176.5	0	0	112.3	R303 D374 I375 D376	R303-M372 WeakPolarHBondContact O-CE 3.47Å; M372-D374 VanDerWaalsContact C-N 3.35Å; M372-I375 PolarHBondContact O-N 2.8Å; M372-D376 WeakPolarHBondContact O-CB 3.38Å; M372-D376 PolarHBondContact O-N 3.09Å
373	E	82.4	Confident	74.4	Confident	147 Å²	147	77.5 Å²	77.5	69%	0.687	46%	0.461	S	S	*	.	H	α-helix	trans	-64.4	-36.1	176.4	-63.4	178.3	169.8	0	0	112.8	K371 T377	K371-E373 PolarHBondContact O-N 3.34Å; K371-E373 VanDerWaalsContact O-N 3.15Å; E373-T377 WeakPolarHBondContact O-CB 3.28Å; E373-T377 PolarHBondContact O-N 3.46Å; E373-T377 PolarHBondContact O-OG1 3.2Å
374	D	83.8	Confident	76.5	Confident	86 Å²	86	77 Å²	77	46%	0.46	45%	0.452	S	S	.	.	H	α-helix	trans	-70.6	-40.5	177.7	-61.5	-36.5	0	0	0	110.3	K371 M372 T377 A378	K371-D374 WeakPolarHBondContact CB-OD2 3.26Å; K371-D374 WeakPolarHBondContact O-CB 3.43Å; K371-D374 PolarHBondContact O-N 3.41Å; M372-D374 VanDerWaalsContact C-N 3.35Å; D374-T377 PolarHBondContact O-N 3.24Å; D374-A378 VanDerWaalsContact O-CB 3.31Å; D374-A378 WeakPolarHBondContact O-CB 3.45Å; D374-A378 PolarHBondContact O-N 3.43Å
375	I	84.4	Confident	78.8	Confident	3 Å²	3	74.6 Å²	74.6	2%	0.015	43%	0.43	C	S	.	.	H	α-helix	trans	-62.6	-49.6	174.2	-60.9	171.4	0	0	0	110.5	V302 V308 L358 L370 K371 M372 T377 A378 V379	V302-I375 HydrophobicContact CG1-CG2 4.19Å; V308-I375 HydrophobicContact CG2-CD1 3.95Å; L358-I375 HydrophobicContact CD1-CB 4.43Å; L358-I375 HydrophobicContact CD1-CG1 4.02Å; L370-I375 HydrophobicContact CB-CD1 4.15Å; L370-I375 HydrophobicContact CB-CG1 4.28Å; K371-I375 PolarHBondContact O-N 3.11Å; M372-I375 PolarHBondContact O-N 2.8Å; I375-T377 VanDerWaalsContact C-N 3.31Å; I375-T377 PolarHBondContact O-N 3.37Å; I375-A378 PolarHBondContact O-N 2.91Å; I375-V379 HydrophobicContact CG2-CG2 4.1Å; I375-V379 WeakPolarHBondContact O-CB 3.33Å; I375-V379 VanDerWaalsContact O-CG2 3.28Å; I375-V379 WeakPolarHBondContact O-CG2 3.15Å; I375-V379 PolarHBondContact O-N 3.08Å
376	D	88.8	Confident	81.2	Confident	63 Å²	63	65.9 Å²	65.9	34%	0.337	38%	0.384	S	S	.	.	H	α-helix	trans	-61.4	-40.5	-179.3	-168.5	49.2	0	0	0	111.5	R303 M372 S380	R303-D376 WeakPolarHBondContact CD-OD1 3.43Å; R303-D376 WeakPolarHBondContact CG-OD1 3.42Å; R303-D376 IonicContact CZ-OD1 2.69Å; R303-D376 IonicContact NE-OD1 3.73Å; R303-D376 IonicContact NH1-OD1 3.65Å; R303-D376 PolarHBondContact NH1-OD1 3.03Å; M372-D376 WeakPolarHBondContact O-CB 3.38Å; M372-D376 PolarHBondContact O-N 3.09Å; D376-S380 WeakPolarHBondContact O-CB 3.44Å; D376-S380 PolarHBondContact O-N 3.1Å; D376-S380 PolarHBondContact O-OG 3.22Å
377	T	90.3	Very high	83.4	Confident	68 Å²	68	68.4 Å²	68.4	42%	0.417	38%	0.375	S	S	.	.	H	α-helix	trans	-65.4	-46.2	176	-58.4	0	0	0	0	111.8	E373 D374 I375 S380 R381	E373-T377 WeakPolarHBondContact O-CB 3.28Å; E373-T377 PolarHBondContact O-N 3.46Å; E373-T377 PolarHBondContact O-OG1 3.2Å; D374-T377 PolarHBondContact O-N 3.24Å; I375-T377 VanDerWaalsContact C-N 3.31Å; I375-T377 PolarHBondContact O-N 3.37Å; T377-S380 PolarHBondContact O-N 3.36Å; T377-R381 WeakPolarHBondContact O-CG 3.41Å; T377-R381 PolarHBondContact O-N 3Å
378	A	88.6	Confident	85.9	Confident	16 Å²	16	67.1 Å²	67.1	13%	0.132	35%	0.35	C	S	.	.	H	α-helix	trans	-65.5	-47.7	179.7	0	0	0	0	0	111.8	L358 D374 I375 S380 R381 V382	L358-A378 HydrophobicContact CD1-CB 3.78Å; L358-A378 HydrophobicContact CD2-CB 4.21Å; L358-A378 HydrophobicContact CG-CB 4.4Å; D374-A378 VanDerWaalsContact O-CB 3.31Å; D374-A378 WeakPolarHBondContact O-CB 3.45Å; D374-A378 PolarHBondContact O-N 3.43Å; I375-A378 PolarHBondContact O-N 2.91Å; A378-S380 VanDerWaalsContact C-N 3.29Å; A378-S380 PolarHBondContact O-N 3.49Å; A378-R381 PolarHBondContact O-N 3.48Å; A378-V382 WeakPolarHBondContact O-CG2 3.14Å; A378-V382 PolarHBondContact O-N 3.44Å
379	V	91.4	Very high	87.9	Confident	3 Å²	3	65.1 Å²	65.1	2%	0.018	33%	0.329	C	S	.	.	H	α-helix	trans	-60.9	-40.1	177.1	173.1	0	0	0	0	110.7	L299 R303 I375 R381 S383	L299-V379 HydrophobicContact CB-CG1 4.01Å; L299-V379 HydrophobicContact CB-CG2 4.32Å; R303-V379 HydrophobicContact CB-CG1 4.29Å; R303-V379 HydrophobicContact CB-CG2 4.44Å; R303-V379 HydrophobicContact CG-CG1 4.47Å; I375-V379 HydrophobicContact CG2-CG2 4.1Å; I375-V379 WeakPolarHBondContact O-CB 3.33Å; I375-V379 VanDerWaalsContact O-CG2 3.28Å; I375-V379 WeakPolarHBondContact O-CG2 3.15Å; I375-V379 PolarHBondContact O-N 3.08Å; V379-R381 PolarHBondContact O-N 3.38Å; V379-S383 WeakPolarHBondContact O-CB 3.28Å; V379-S383 PolarHBondContact O-N 3.18Å; V379-S383 PolarHBondContact O-OG 3.42Å
380	S	93.3	Very high	89.7	Confident	63 Å²	63	62.3 Å²	62.3	44%	0.441	30%	0.302	S	S	.	.	H	α-helix	trans	-63.3	-40.8	175.8	-67	0	0	0	0	112.8	D376 T377 A378 K384	D376-S380 WeakPolarHBondContact O-CB 3.44Å; D376-S380 PolarHBondContact O-N 3.1Å; D376-S380 PolarHBondContact O-OG 3.22Å; T377-S380 PolarHBondContact O-N 3.36Å; A378-S380 VanDerWaalsContact C-N 3.29Å; A378-S380 PolarHBondContact O-N 3.49Å; S380-K384 PolarHBondContact O-N 3.03Å; S380-K384 VanDerWaalsContact O-N 3.1Å
381	R	95	Very high	91.2	Very high	150 Å²	150	65.7 Å²	65.7	57%	0.566	31%	0.314	S	S	*	.	H	α-helix	trans	-67.6	-49.4	176.6	-72.9	-179.6	-174.1	-171.3	4	112	L354 T377 A378 V379 S383 K384 I385	L354-R381 HydrophobicContact CD1-CB 4.1Å; T377-R381 WeakPolarHBondContact O-CG 3.41Å; T377-R381 PolarHBondContact O-N 3Å; A378-R381 PolarHBondContact O-N 3.48Å; V379-R381 PolarHBondContact O-N 3.38Å; R381-S383 VanDerWaalsContact C-N 3.27Å; R381-S383 PolarHBondContact O-N 3.22Å; R381-K384 WeakPolarHBondContact O-CB 3.44Å; R381-K384 PolarHBondContact O-N 3.08Å; R381-I385 WeakPolarHBondContact O-CG1 3.21Å; R381-I385 PolarHBondContact O-N 2.97Å
382	V	95.6	Very high	92.3	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.006	29%	0.294	C	S	.	.	H	α-helix	trans	-58.8	-42.7	176.1	171.5	0	0	0	0	110.4	F295 L299 T351 L354 L355 A378 K384 I385 C386	F295-V382 HydrophobicContact CE1-CG1 3.63Å; F295-V382 HydrophobicContact CZ-CG1 3.96Å; L299-V382 HydrophobicContact CD1-CB 4.21Å; L299-V382 HydrophobicContact CD1-CG1 3.48Å; L299-V382 VanDerWaalsContact CD1-CG1 3.48Å; T351-V382 HydrophobicContact CG2-CG1 3.87Å; L354-V382 HydrophobicContact CB-CG2 3.9Å; L354-V382 HydrophobicContact CD1-CG2 4.09Å; L355-V382 HydrophobicContact CD2-CG2 4.39Å; L355-V382 HydrophobicContact CG-CG2 4.47Å; A378-V382 WeakPolarHBondContact O-CG2 3.14Å; A378-V382 PolarHBondContact O-N 3.44Å; V382-K384 VanDerWaalsContact C-N 3.26Å; V382-K384 PolarHBondContact O-N 3.49Å; V382-I385 PolarHBondContact O-N 2.99Å; V382-C386 PolarHBondContact O-N 3.09Å; V382-C386 PolarHBondContact O-SG 3.37Å; V382-C386 VanDerWaalsContact O-SG 3.34Å
383	S	95.6	Very high	93.2	Very high	23 Å²	23	56.6 Å²	56.6	16%	0.161	27%	0.273	C	S	.	.	H	α-helix	trans	-59.7	-35.4	175.9	-65.5	0	0	0	0	113.2	V379 R381 K387	V379-S383 WeakPolarHBondContact O-CB 3.28Å; V379-S383 PolarHBondContact O-N 3.18Å; V379-S383 PolarHBondContact O-OG 3.42Å; R381-S383 VanDerWaalsContact C-N 3.27Å; R381-S383 PolarHBondContact O-N 3.22Å; S383-K387 WeakPolarHBondContact O-CD 3.47Å; S383-K387 VanDerWaalsContact O-CG 3.24Å; S383-K387 WeakPolarHBondContact O-CG 3.49Å; S383-K387 PolarHBondContact O-N 3.22Å
384	K	96.6	Very high	93.9	Very high	142 Å²	142	50.7 Å²	50.7	62%	0.617	25%	0.246	S	C	*	.	H	α-helix	trans	-69.4	-48.6	174.6	-174	-175.1	174.1	-169.4	0	110.9	S380 R381 V382 C386 K387 D388	S380-K384 PolarHBondContact O-N 3.03Å; S380-K384 VanDerWaalsContact O-N 3.1Å; R381-K384 WeakPolarHBondContact O-CB 3.44Å; R381-K384 PolarHBondContact O-N 3.08Å; V382-K384 VanDerWaalsContact C-N 3.26Å; V382-K384 PolarHBondContact O-N 3.49Å; K384-C386 VanDerWaalsContact C-N 3.34Å; K384-C386 PolarHBondContact O-N 2.97Å; K384-K387 WeakPolarHBondContact O-CB 3.43Å; K384-K387 PolarHBondContact O-N 3.49Å; K384-K387 VanDerWaalsContact O-N 3.1Å; K384-D388 PolarHBondContact O-N 3.31Å
385	I	97.3	Very high	94.5	Very high	11 Å²	11	50.3 Å²	50.3	6%	0.056	24%	0.243	C	C	.	.	H	α-helix	trans	-58.1	-45.8	178.8	-67.7	159.7	0	0	0	111	F347 E350 T351 L354 R381 V382 K387 D388 L389	F347-I385 HydrophobicContact CB-CG2 3.91Å; F347-I385 HydrophobicContact CD1-CG2 3.82Å; F347-I385 HydrophobicContact CG-CG2 4.25Å; F347-I385 WeakPolarHBondContact O-CG2 3.33Å; E350-I385 HydrophobicContact CB-CD1 4.29Å; E350-I385 VanDerWaalsContact CD-CD1 3.44Å; E350-I385 HydrophobicContact CG-CD1 3.67Å; E350-I385 WeakPolarHBondContact OE1-CD1 3.23Å; T351-I385 VanDerWaalsContact OG1-CG2 3.26Å; T351-I385 WeakPolarHBondContact OG1-CG2 3.32Å; L354-I385 HydrophobicContact CD1-CD1 3.36Å; R381-I385 WeakPolarHBondContact O-CG1 3.21Å; R381-I385 PolarHBondContact O-N 2.97Å; V382-I385 PolarHBondContact O-N 2.99Å; I385-K387 VanDerWaalsContact C-N 3.29Å; I385-K387 PolarHBondContact O-N 2.7Å; I385-D388 PolarHBondContact O-N 2.97Å; I385-D388 VanDerWaalsContact O-N 3.12Å; I385-L389 WeakPolarHBondContact O-CB 3.46Å; I385-L389 PolarHBondContact O-N 2.85Å
386	C	96.8	Very high	95	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-63.2	-33.5	177.4	-68.2	0	0	0	0	113.1	T292 F295 L296 V382 K384 R390	T292-C386 HydrophobicContact CG2-CB 4.01Å; F295-C386 VanDerWaalsContact CE1-SG 3.59Å; L296-C386 HydrophobicContact CD1-CB 4.25Å; L296-C386 HydrophobicContact CD2-CB 3.94Å; L296-C386 HydrophobicContact CG-CB 4.34Å; V382-C386 PolarHBondContact O-N 3.09Å; V382-C386 PolarHBondContact O-SG 3.37Å; V382-C386 VanDerWaalsContact O-SG 3.34Å; K384-C386 VanDerWaalsContact C-N 3.34Å; K384-C386 PolarHBondContact O-N 2.97Å; C386-R390 WeakPolarHBondContact O-CB 3.49Å; C386-R390 PolarHBondContact O-N 3.06Å
387	K	95.3	Very high	95.4	Very high	122 Å²	122	47.3 Å²	47.3	53%	0.53	23%	0.227	S	C	.	.	H	α-helix	trans	-68.3	-37.9	173.5	-74.6	169.6	-175.7	173.5	0	111.7	S383 K384 I385 K391	S383-K387 WeakPolarHBondContact O-CD 3.47Å; S383-K387 VanDerWaalsContact O-CG 3.24Å; S383-K387 WeakPolarHBondContact O-CG 3.49Å; S383-K387 PolarHBondContact O-N 3.22Å; K384-K387 WeakPolarHBondContact O-CB 3.43Å; K384-K387 PolarHBondContact O-N 3.49Å; K384-K387 VanDerWaalsContact O-N 3.1Å; I385-K387 VanDerWaalsContact C-N 3.29Å; I385-K387 PolarHBondContact O-N 2.7Å; K387-K391 WeakPolarHBondContact O-CG 3.38Å; K387-K391 PolarHBondContact O-N 3.28Å
388	D	96.7	Very high	95.7	Very high	52 Å²	52	44.8 Å²	44.8	28%	0.278	21%	0.211	S	C	.	.	H	α-helix	trans	-73.2	-39.5	177.8	-67	-26.1	0	0	0	111.3	F347 K384 I385 R390 K391 Q392	F347-D388 HydrophobicContact CE1-CB 4.05Å; F347-D388 HydrophobicContact CZ-CB 3.92Å; K384-D388 PolarHBondContact O-N 3.31Å; I385-D388 PolarHBondContact O-N 2.97Å; I385-D388 VanDerWaalsContact O-N 3.12Å; D388-R390 PolarHBondContact O-N 3.05Å; D388-K391 WeakPolarHBondContact O-CB 3.16Å; D388-K391 PolarHBondContact O-N 3.34Å; D388-Q392 PolarHBondContact O-N 3.13Å
389	L	97.9	Very high	96	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-55.1	-50	168.6	173.6	62	0	0	0	110.9	L323 I344 F347 L348 I385 K391 Q392 L393	L323-L389 HydrophobicContact CD2-CD2 4.27Å; I344-L389 HydrophobicContact CB-CD1 4.37Å; I344-L389 HydrophobicContact CG1-CD1 4.35Å; I344-L389 HydrophobicContact CG2-CD1 3.94Å; F347-L389 HydrophobicContact CB-CB 4.1Å; F347-L389 HydrophobicContact CB-CD1 4.26Å; F347-L389 HydrophobicContact CD2-CB 4.26Å; F347-L389 HydrophobicContact CD2-CD1 4.42Å; F347-L389 HydrophobicContact CG-CB 4.34Å; L348-L389 HydrophobicContact CD2-CD2 3.67Å; L348-L389 HydrophobicContact CG-CD2 4.39Å; I385-L389 WeakPolarHBondContact O-CB 3.46Å; I385-L389 PolarHBondContact O-N 2.85Å; L389-K391 VanDerWaalsContact C-N 3.27Å; L389-K391 PolarHBondContact O-N 2.85Å; L389-Q392 PolarHBondContact O-N 3.24Å; L389-L393 HydrophobicContact CD1-CD1 4.32Å; L389-L393 HydrophobicContact CD1-CD2 4.34Å; L389-L393 HydrophobicContact CD1-CG 4.15Å; L389-L393 HydrophobicContact CG-CD1 4.2Å; L389-L393 HydrophobicContact CG-CG 4.43Å; L389-L393 WeakPolarHBondContact O-CG 3.47Å; L389-L393 PolarHBondContact O-N 2.8Å
390	R	96.7	Very high	96.2	Very high	66 Å²	66	47 Å²	47	25%	0.249	22%	0.22	C	C	.	.	H	α-helix	trans	-55.3	-42.9	177.8	-175.9	-176.4	-66.9	-178.5	-11.3	112	D289 C386 D388 L393 Q394	D289-R390 WeakPolarHBondContact OD1-CD 3.41Å; D289-R390 IonicContact OD1-CZ 3.78Å; D289-R390 IonicContact OD1-NE 2.74Å; D289-R390 PolarHBondContact OD1-NE 2.62Å; D289-R390 IonicContact OD1-NH1 2.75Å; D289-R390 IonicContact OD1-NH2 3.62Å; D289-R390 PolarHBondContact OD1-NH2 3.2Å; C386-R390 WeakPolarHBondContact O-CB 3.49Å; C386-R390 PolarHBondContact O-N 3.06Å; D388-R390 PolarHBondContact O-N 3.05Å; R390-L393 PolarHBondContact O-N 3.13Å; R390-Q394 VanDerWaalsContact O-CG 3.26Å; R390-Q394 WeakPolarHBondContact O-CG 3.4Å; R390-Q394 PolarHBondContact O-N 2.86Å
391	K	95.9	Very high	96.3	Very high	128 Å²	128	44.1 Å²	44.1	56%	0.557	20%	0.201	S	C	*	.	H	α-helix	trans	-65.1	-38.7	176.4	-72.3	176.1	-179.8	174.8	0	112.5	K387 D388 L389 Q394 L395	K387-K391 WeakPolarHBondContact O-CG 3.38Å; K387-K391 PolarHBondContact O-N 3.28Å; D388-K391 WeakPolarHBondContact O-CB 3.16Å; D388-K391 PolarHBondContact O-N 3.34Å; L389-K391 VanDerWaalsContact C-N 3.27Å; L389-K391 PolarHBondContact O-N 2.85Å; K391-Q394 PolarHBondContact O-N 3.03Å; K391-L395 WeakPolarHBondContact O-CB 3.25Å; K391-L395 PolarHBondContact O-N 2.98Å
392	Q	97.2	Very high	96.2	Very high	39 Å²	39	40.3 Å²	40.3	18%	0.182	19%	0.194	C	C	.	.	H	α-helix	trans	-65.2	-43.3	174.9	-74.3	-52.3	-25.9	0	0	112.2	Q343 I344 F347 D388 L389 Q394 L395 V396	Q343-Q392 VanDerWaalsContact OE1-CD 3.3Å; I344-Q392 HydrophobicContact CG1-CB 4.4Å; F347-Q392 HydrophobicContact CD2-CG 4.3Å; F347-Q392 HydrophobicContact CE2-CG 3.59Å; D388-Q392 PolarHBondContact O-N 3.13Å; L389-Q392 PolarHBondContact O-N 3.24Å; Q392-Q394 VanDerWaalsContact C-N 3.3Å; Q392-Q394 PolarHBondContact O-N 3.1Å; Q392-L395 WeakPolarHBondContact O-CB 3.44Å; Q392-L395 PolarHBondContact O-N 3.13Å; Q392-V396 WeakPolarHBondContact O-CG2 3.37Å; Q392-V396 PolarHBondContact O-N 3.1Å
393	L	97.9	Very high	96.1	Very high	4 Å²	4	43.4 Å²	43.4	2%	0.021	21%	0.211	C	C	.	.	H	α-helix	trans	-60.1	-43	175.7	-61.1	174.5	0	0	0	111	A288 T327 F330 I344 L389 R390 L395 V396 G397 I453	A288-L393 HydrophobicContact CB-CD1 3.94Å; T327-L393 HydrophobicContact CG2-CD1 3.84Å; T327-L393 HydrophobicContact CG2-CD2 4.06Å; F330-L393 HydrophobicContact CB-CD2 4.12Å; F330-L393 HydrophobicContact CD1-CB 4.44Å; F330-L393 HydrophobicContact CD1-CD2 3.94Å; F330-L393 HydrophobicContact CD2-CD2 3.74Å; F330-L393 HydrophobicContact CE1-CB 4.05Å; F330-L393 HydrophobicContact CE1-CD2 4.28Å; F330-L393 WeakPolarHBondContact CE1-O 3.02Å; F330-L393 HydrophobicContact CE2-CD2 4.1Å; F330-L393 HydrophobicContact CG-CD2 3.65Å; F330-L393 HydrophobicContact CZ-CB 4.13Å; F330-L393 HydrophobicContact CZ-CD2 4.36Å; I344-L393 HydrophobicContact CD1-CD2 3.79Å; I344-L393 HydrophobicContact CG1-CD2 4.07Å; I344-L393 HydrophobicContact CG2-CD2 4.34Å; L389-L393 HydrophobicContact CD1-CD1 4.32Å; L389-L393 HydrophobicContact CD1-CD2 4.34Å; L389-L393 HydrophobicContact CD1-CG 4.15Å; L389-L393 HydrophobicContact CG-CD1 4.2Å; L389-L393 HydrophobicContact CG-CG 4.43Å; L389-L393 WeakPolarHBondContact O-CG 3.47Å; L389-L393 PolarHBondContact O-N 2.8Å; R390-L393 PolarHBondContact O-N 3.13Å; L393-L395 PolarHBondContact O-N 3.45Å; L393-V396 PolarHBondContact O-N 2.84Å; L393-G397 PolarHBondContact O-N 2.94Å; L393-I453 HydrophobicContact CB-CG2 4.13Å
394	Q	96.8	Very high	96	Very high	24 Å²	24	42.8 Å²	42.8	11%	0.112	21%	0.205	C	C	.	.	H	α-helix	trans	-58.8	-45.6	174.6	-73.9	168.6	-7.8	0	0	112.1	R390 K391 Q392 L398 I453 C522	R390-Q394 VanDerWaalsContact O-CG 3.26Å; R390-Q394 WeakPolarHBondContact O-CG 3.4Å; R390-Q394 PolarHBondContact O-N 2.86Å; K391-Q394 PolarHBondContact O-N 3.03Å; Q392-Q394 VanDerWaalsContact C-N 3.3Å; Q392-Q394 PolarHBondContact O-N 3.1Å; Q394-L398 VanDerWaalsContact O-CB 3.3Å; Q394-L398 WeakPolarHBondContact O-CB 3.4Å; Q394-L398 VanDerWaalsContact O-CG 3.23Å; Q394-L398 WeakPolarHBondContact O-CG 3.46Å; Q394-L398 PolarHBondContact O-N 3.21Å; Q394-I453 HydrophobicContact CG-CB 3.99Å; Q394-I453 HydrophobicContact CG-CG2 4.33Å; Q394-C522 HydrophobicContact CG-CB 4.42Å
395	L	95.5	Very high	95.8	Very high	78 Å²	78	38.2 Å²	38.2	41%	0.408	19%	0.186	S	C	.	.	H	α-helix	trans	-59.6	-51.8	176.9	-176.9	154.3	0	0	0	110.9	H340 K391 Q392 L393 G397 L398 D399	H340-L395 WeakPolarHBondContact CE1-CD2 3.25Å; K391-L395 WeakPolarHBondContact O-CB 3.25Å; K391-L395 PolarHBondContact O-N 2.98Å; Q392-L395 WeakPolarHBondContact O-CB 3.44Å; Q392-L395 PolarHBondContact O-N 3.13Å; L393-L395 PolarHBondContact O-N 3.45Å; L395-G397 PolarHBondContact O-N 2.95Å; L395-L398 PolarHBondContact O-N 3.24Å; L395-D399 VanDerWaalsContact O-CB 3.24Å; L395-D399 WeakPolarHBondContact O-CB 3.38Å; L395-D399 PolarHBondContact O-N 3.41Å
396	V	96.8	Very high	95.5	Very high	3 Å²	3	45.4 Å²	45.4	2%	0.018	21%	0.212	C	C	.	.	H	α-helix	trans	-61.4	-47.9	-178.6	174.9	0	0	0	0	111.7	F330 T336 H340 I344 Q392 L393 L398 D399 Q400	F330-V396 HydrophobicContact CD1-CB 4.15Å; F330-V396 HydrophobicContact CD1-CG1 3.96Å; T336-V396 HydrophobicContact CG2-CG1 3.92Å; H340-V396 HydrophobicContact CB-CG2 3.54Å; I344-V396 HydrophobicContact CD1-CG2 4.26Å; Q392-V396 WeakPolarHBondContact O-CG2 3.37Å; Q392-V396 PolarHBondContact O-N 3.1Å; L393-V396 PolarHBondContact O-N 2.84Å; V396-L398 VanDerWaalsContact C-N 3.35Å; V396-L398 PolarHBondContact O-N 3.45Å; V396-D399 PolarHBondContact O-N 3.27Å; V396-Q400 WeakPolarHBondContact O-CG 3.36Å; V396-Q400 PolarHBondContact O-N 2.93Å; V396-Q400 VanDerWaalsContact O-N 3.09Å
397	G	96.9	Very high	95.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-64.1	-38.2	-178.9	0	0	0	0	0	113	L393 L395 A401	L393-G397 PolarHBondContact O-N 2.94Å; L395-G397 PolarHBondContact O-N 2.95Å; G397-A401 WeakPolarHBondContact O-CB 3.37Å; G397-A401 PolarHBondContact O-N 2.8Å
398	L	96.2	Very high	94.8	Very high	14 Å²	14	46.9 Å²	46.9	7%	0.073	23%	0.23	C	C	.	.	H	α-helix	trans	-75.9	-35.1	178.2	-70.5	174	0	0	0	113	Q394 L395 V396 A401 T402 L450 I453 V518 D519 C522	Q394-L398 VanDerWaalsContact O-CB 3.3Å; Q394-L398 WeakPolarHBondContact O-CB 3.4Å; Q394-L398 VanDerWaalsContact O-CG 3.23Å; Q394-L398 WeakPolarHBondContact O-CG 3.46Å; Q394-L398 PolarHBondContact O-N 3.21Å; L395-L398 PolarHBondContact O-N 3.24Å; V396-L398 VanDerWaalsContact C-N 3.35Å; V396-L398 PolarHBondContact O-N 3.45Å; L398-A401 PolarHBondContact O-N 3.26Å; L398-T402 WeakPolarHBondContact O-CB 3.27Å; L398-T402 PolarHBondContact O-N 2.92Å; L398-T402 PolarHBondContact O-OG1 3.3Å; L398-L450 HydrophobicContact CD2-CD2 4.12Å; L398-I453 HydrophobicContact CD2-CD1 4.27Å; L398-I453 HydrophobicContact CG-CD1 3.98Å; L398-V518 HydrophobicContact CD2-CG1 4.15Å; L398-D519 HydrophobicContact CD1-CB 4.29Å; L398-D519 HydrophobicContact CD2-CB 3.87Å; L398-C522 HydrophobicContact CD1-CB 4.09Å
399	D	94.6	Very high	94.7	Very high	57 Å²	57	48.8 Å²	48.8	31%	0.305	24%	0.238	S	C	.	.	H	α-helix	trans	-63.2	-49.9	176.2	-167	50.7	0	0	0	110.4	L395 V396 A401 T402 D403	L395-D399 VanDerWaalsContact O-CB 3.24Å; L395-D399 WeakPolarHBondContact O-CB 3.38Å; L395-D399 PolarHBondContact O-N 3.41Å; V396-D399 PolarHBondContact O-N 3.27Å; D399-A401 PolarHBondContact O-N 2.96Å; D399-T402 WeakPolarHBondContact O-CB 3.47Å; D399-T402 PolarHBondContact O-N 3.37Å; D399-T402 VanDerWaalsContact O-N 3.11Å; D399-D403 PolarHBondContact O-N 3.46Å
400	Q	95.1	Very high	94.5	Very high	9 Å²	9	50 Å²	50	4%	0.042	24%	0.244	C	C	.	.	H	α-helix	trans	-59.3	-43.6	175	-70.4	-162.3	24.9	0	0	112.7	S333 T336 V396 T402 D403 M404 V446 L449	S333-Q400 PolarHBondContact OG-NE2 2.85Å; T336-Q400 PolarHBondContact OG1-NE2 3.4Å; V396-Q400 WeakPolarHBondContact O-CG 3.36Å; V396-Q400 PolarHBondContact O-N 2.93Å; V396-Q400 VanDerWaalsContact O-N 3.09Å; Q400-T402 VanDerWaalsContact C-N 3.32Å; Q400-T402 PolarHBondContact O-N 2.94Å; Q400-D403 PolarHBondContact O-N 3.02Å; Q400-M404 WeakPolarHBondContact O-CB 3.28Å; Q400-M404 PolarHBondContact O-N 3.18Å; Q400-V446 HydrophobicContact CB-CG2 4.42Å; Q400-L449 HydrophobicContact CB-CD1 4.49Å; Q400-L449 VanDerWaalsContact CD-CD1 3.47Å; Q400-L449 HydrophobicContact CG-CD1 4.37Å; Q400-L449 VanDerWaalsContact OE1-CD1 3.27Å
401	A	95.4	Very high	94.4	Very high	3 Å²	3	52.9 Å²	52.9	3%	0.025	26%	0.261	C	S	.	.	H	α-helix	trans	-61.5	-42.3	175.9	0	0	0	0	0	111.8	G397 L398 D399 M404 F405 V446 L450 A515	G397-A401 WeakPolarHBondContact O-CB 3.37Å; G397-A401 PolarHBondContact O-N 2.8Å; L398-A401 PolarHBondContact O-N 3.26Å; D399-A401 PolarHBondContact O-N 2.96Å; A401-M404 PolarHBondContact O-N 3.35Å; A401-F405 WeakPolarHBondContact O-CD2 3.43Å; A401-F405 PolarHBondContact O-N 3.43Å; A401-F405 VanDerWaalsContact O-N 3.11Å; A401-V446 HydrophobicContact CB-CG1 3.74Å; A401-L450 HydrophobicContact CB-CD1 4.29Å; A401-L450 HydrophobicContact CB-CD2 4.1Å; A401-L450 HydrophobicContact CB-CG 4.39Å; A401-A515 HydrophobicContact CB-CB 4.38Å
402	T	94.1	Very high	94.4	Very high	70 Å²	70	50.8 Å²	50.8	43%	0.429	26%	0.258	S	S	.	.	H	α-helix	trans	-64.9	-42.8	179.8	-57.7	0	0	0	0	111.5	L398 D399 Q400 R406	L398-T402 WeakPolarHBondContact O-CB 3.27Å; L398-T402 PolarHBondContact O-N 2.92Å; L398-T402 PolarHBondContact O-OG1 3.3Å; D399-T402 WeakPolarHBondContact O-CB 3.47Å; D399-T402 PolarHBondContact O-N 3.37Å; D399-T402 VanDerWaalsContact O-N 3.11Å; Q400-T402 VanDerWaalsContact C-N 3.32Å; Q400-T402 PolarHBondContact O-N 2.94Å; T402-R406 VanDerWaalsContact CG2-NH2 3.29Å; T402-R406 WeakPolarHBondContact O-CB 3.08Å; T402-R406 PolarHBondContact O-N 3.23Å
403	D	92.8	Very high	94.4	Very high	66 Å²	66	49.1 Å²	49.1	35%	0.353	25%	0.251	S	S	.	.	H	α-helix	trans	-66.7	-43.2	178.7	-79.7	-3.6	0	0	0	112	D399 Q400 F405 R406 S407	D399-D403 PolarHBondContact O-N 3.46Å; Q400-D403 PolarHBondContact O-N 3.02Å; D403-F405 PolarHBondContact O-N 2.97Å; D403-R406 PolarHBondContact O-N 3.34Å; D403-R406 IonicContact OD1-CZ 2.7Å; D403-R406 IonicContact OD1-NH1 3.35Å; D403-R406 PolarHBondContact OD1-NH1 3.17Å; D403-R406 IonicContact OD1-NH2 3.96Å; D403-S407 PolarHBondContact O-N 3.34Å
404	M	93.2	Very high	94.4	Very high	10 Å²	10	49 Å²	49	5%	0.049	25%	0.25	C	C	.	.	H	α-helix	trans	-56.4	-51.3	175.8	-173.5	-155	76.1	0	0	111.1	Q400 A401 R406 S407 M443 V446 L511	Q400-M404 WeakPolarHBondContact O-CB 3.28Å; Q400-M404 PolarHBondContact O-N 3.18Å; A401-M404 PolarHBondContact O-N 3.35Å; M404-R406 VanDerWaalsContact C-N 3.29Å; M404-R406 PolarHBondContact O-N 3.15Å; M404-S407 PolarHBondContact O-N 3.21Å; M404-S407 PolarHBondContact O-OG 2.55Å; M404-M443 HydrophobicContact SD-CB 4.24Å; M404-M443 HydrophobicContact SD-CG 3.71Å; M404-V446 HydrophobicContact CB-CG2 4.39Å; M404-V446 HydrophobicContact SD-CB 3.97Å; M404-V446 HydrophobicContact SD-CG1 4Å; M404-V446 HydrophobicContact SD-CG2 3.94Å; M404-L511 HydrophobicContact CE-CD2 4.28Å
405	F	92.3	Very high	94.4	Very high	46 Å²	46	50.5 Å²	50.5	20%	0.202	26%	0.263	C	S	.	.	H	α-helix	trans	-72.1	-17.4	179.9	-70.5	-57.8	0	0	0	114.7	A401 D403 I508 L511 A512 A515	A401-F405 WeakPolarHBondContact O-CD2 3.43Å; A401-F405 PolarHBondContact O-N 3.43Å; A401-F405 VanDerWaalsContact O-N 3.11Å; D403-F405 PolarHBondContact O-N 2.97Å; F405-I508 HydrophobicContact CD1-CG2 4.49Å; F405-I508 HydrophobicContact CE1-CG2 3.85Å; F405-L511 HydrophobicContact CE1-CD2 4.5Å; F405-L511 HydrophobicContact CZ-CB 4.08Å; F405-L511 HydrophobicContact CZ-CD2 3.82Å; F405-L511 HydrophobicContact CZ-CG 3.73Å; F405-A512 HydrophobicContact CD1-CB 3.9Å; F405-A512 HydrophobicContact CD2-CB 4.46Å; F405-A512 HydrophobicContact CE1-CB 3.59Å; F405-A512 HydrophobicContact CE2-CB 4.23Å; F405-A512 HydrophobicContact CG-CB 4.34Å; F405-A512 HydrophobicContact CZ-CB 3.78Å; F405-A512 VanDerWaalsContact CZ-N 3.33Å; F405-A515 HydrophobicContact CD2-CB 4.49Å; F405-A515 HydrophobicContact CE2-CB 3.8Å
406	R	92.4	Very high	94.5	Very high	161 Å²	161	48.6 Å²	48.6	61%	0.608	25%	0.254	S	S	*	.	H	α-helix	trans	-78.6	-23.4	175.9	-167.8	-174.2	-61.8	126.7	1.3	112.2	T402 D403 M404	T402-R406 VanDerWaalsContact CG2-NH2 3.29Å; T402-R406 WeakPolarHBondContact O-CB 3.08Å; T402-R406 PolarHBondContact O-N 3.23Å; D403-R406 PolarHBondContact O-N 3.34Å; D403-R406 IonicContact OD1-CZ 2.7Å; D403-R406 IonicContact OD1-NH1 3.35Å; D403-R406 PolarHBondContact OD1-NH1 3.17Å; D403-R406 IonicContact OD1-NH2 3.96Å; M404-R406 VanDerWaalsContact C-N 3.29Å; M404-R406 PolarHBondContact O-N 3.15Å
407	S	88.2	Confident	94.6	Very high	63 Å²	63	48.4 Å²	48.4	44%	0.441	25%	0.254	S	S	.	.	S	Bend	trans	-74.7	-22.3	-174	71.6	0	0	0	0	114.3	D403 M404 E409	D403-S407 PolarHBondContact O-N 3.34Å; M404-S407 PolarHBondContact O-N 3.21Å; M404-S407 PolarHBondContact O-OG 2.55Å; S407-E409 PolarHBondContact O-N 2.8Å; S407-E409 PolarHBondContact OG-N 2.98Å
408	D	89.2	Confident	94.6	Very high	90 Å²	90	51.4 Å²	51.4	48%	0.481	27%	0.266	S	S	.	.			trans	48.4	23.7	-171.2	-59.6	-36.7	0	0	0	113.7	D410 E411 V412	D408-D410 VanDerWaalsContact C-N 3.31Å; D408-D410 PolarHBondContact O-N 2.75Å; D408-E411 PolarHBondContact O-N 3.32Å; D408-V412 PolarHBondContact O-N 2.92Å
409	E	94	Very high	94.6	Very high	93 Å²	93	53.5 Å²	53.5	44%	0.435	29%	0.286	S	S	.	.	H	α-helix	trans	-64.9	-34.7	-173.8	-179.5	174.8	-157.4	0	0	111.9	S407 V412 I413 H439	S407-E409 PolarHBondContact O-N 2.8Å; S407-E409 PolarHBondContact OG-N 2.98Å; E409-V412 PolarHBondContact O-N 3.01Å; E409-I413 HydrophobicContact CG-CD1 3.77Å; E409-I413 HydrophobicContact CG-CG1 4.33Å; E409-I413 VanDerWaalsContact O-CG1 3.27Å; E409-I413 WeakPolarHBondContact O-CG1 3.41Å; E409-I413 PolarHBondContact O-N 3.07Å; E409-H439 IonicContact OE2-CE1 3.13Å; E409-H439 PolarHBondContact OE2-CE1 3.25Å; E409-H439 IonicContact OE2-CG 3.08Å; E409-H439 IonicContact OE2-ND1 3.79Å; E409-H439 PolarHBondContact OE2-ND1 2.95Å
410	D	93.2	Very high	94.8	Very high	25 Å²	25	51.5 Å²	51.5	13%	0.134	28%	0.276	C	S	.	.	H	α-helix	trans	-64.2	-42.4	178.1	73.2	-66.7	0	0	0	112.1	D408 V412 I413 L414 H439 M443	D408-D410 VanDerWaalsContact C-N 3.31Å; D408-D410 PolarHBondContact O-N 2.75Å; D410-V412 VanDerWaalsContact C-N 3.35Å; D410-V412 PolarHBondContact O-N 3.46Å; D410-I413 PolarHBondContact O-N 2.82Å; D410-L414 WeakPolarHBondContact O-CB 3.41Å; D410-L414 WeakPolarHBondContact O-CD1 3.49Å; D410-L414 WeakPolarHBondContact O-CG 3.46Å; D410-L414 PolarHBondContact O-N 3.29Å; D410-H439 PolarHBondContact N-NE2 3.06Å; D410-M443 HydrophobicContact CB-CE 3.76Å
411	E	94.2	Very high	94.9	Very high	128 Å²	128	51.1 Å²	51.1	60%	0.598	28%	0.275	S	S	*	.	H	α-helix	trans	-63.5	-43.4	177.8	-174.8	176.5	177.9	0	0	110.7	D408 S415	D408-E411 PolarHBondContact O-N 3.32Å; E411-S415 WeakPolarHBondContact O-CB 3.5Å; E411-S415 PolarHBondContact O-N 3.41Å; E411-S415 PolarHBondContact O-OG 3.38Å
412	V	96.2	Very high	95	Very high	83 Å²	83	55.2 Å²	55.2	50%	0.503	30%	0.299	S	S	.	.	H	α-helix	trans	-62.6	-46.7	177.7	175.8	0	0	0	0	111	D408 E409 D410 S415 T416	D408-V412 PolarHBondContact O-N 2.92Å; E409-V412 PolarHBondContact O-N 3.01Å; D410-V412 VanDerWaalsContact C-N 3.35Å; D410-V412 PolarHBondContact O-N 3.46Å; V412-S415 PolarHBondContact O-OG 3.46Å; V412-S415 VanDerWaalsContact O-OG 3.08Å; V412-T416 WeakPolarHBondContact O-CB 3.41Å; V412-T416 PolarHBondContact O-N 3.36Å; V412-T416 VanDerWaalsContact O-N 3.12Å; V412-T416 PolarHBondContact O-OG1 2.97Å
413	I	97.4	Very high	95.1	Very high	5 Å²	5	56 Å²	56	3%	0.026	31%	0.308	C	S	.	.	H	α-helix	trans	-61.5	-51.7	179.2	-70.6	169.5	0	0	0	110.4	E409 D410 T416 I417 R435 F436 H439	E409-I413 HydrophobicContact CG-CD1 3.77Å; E409-I413 HydrophobicContact CG-CG1 4.33Å; E409-I413 VanDerWaalsContact O-CG1 3.27Å; E409-I413 WeakPolarHBondContact O-CG1 3.41Å; E409-I413 PolarHBondContact O-N 3.07Å; D410-I413 PolarHBondContact O-N 2.82Å; I413-T416 PolarHBondContact O-N 3.05Å; I413-I417 HydrophobicContact CG2-CD1 3.84Å; I413-I417 HydrophobicContact CG2-CG1 4.5Å; I413-I417 WeakPolarHBondContact O-CG1 3.39Å; I413-I417 PolarHBondContact O-N 2.82Å; I413-R435 HydrophobicContact CD1-CB 4.41Å; I413-F436 HydrophobicContact CG2-CB 3.69Å; I413-F436 HydrophobicContact CG2-CD2 4.19Å; I413-F436 HydrophobicContact CG2-CG 4.45Å; I413-H439 HydrophobicContact CD1-CB 3.8Å
414	L	97.3	Very high	95.2	Very high	1 Å²	1	55 Å²	55	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-70.8	-38.3	-173.8	-64.2	166.8	0	0	0	112.8	D410 T416 K418 F436 C501 W504 S505	D410-L414 WeakPolarHBondContact O-CB 3.41Å; D410-L414 WeakPolarHBondContact O-CD1 3.49Å; D410-L414 WeakPolarHBondContact O-CG 3.46Å; D410-L414 PolarHBondContact O-N 3.29Å; L414-T416 VanDerWaalsContact C-N 3.29Å; L414-K418 WeakPolarHBondContact O-CB 3.4Å; L414-K418 WeakPolarHBondContact O-CE 3.41Å; L414-K418 VanDerWaalsContact O-CG 3.31Å; L414-K418 WeakPolarHBondContact O-CG 3.34Å; L414-K418 PolarHBondContact O-N 3.1Å; L414-F436 HydrophobicContact CD2-CD2 3.99Å; L414-F436 HydrophobicContact CD2-CE2 3.95Å; L414-C501 HydrophobicContact CD2-CB 4.04Å; L414-W504 HydrophobicContact CD1-CG 4.2Å; L414-S505 WeakPolarHBondContact CD1-OG 3.45Å
415	S	97.1	Very high	95.4	Very high	55 Å²	55	57.7 Å²	57.7	39%	0.385	33%	0.327	S	S	.	.	H	α-helix	trans	-62.9	-39	174.7	60.5	0	0	0	0	111.2	E411 V412 K418 A419	E411-S415 WeakPolarHBondContact O-CB 3.5Å; E411-S415 PolarHBondContact O-N 3.41Å; E411-S415 PolarHBondContact O-OG 3.38Å; V412-S415 PolarHBondContact O-OG 3.46Å; V412-S415 VanDerWaalsContact O-OG 3.08Å; S415-K418 PolarHBondContact O-N 3.13Å; S415-A419 WeakPolarHBondContact O-CB 3.39Å; S415-A419 PolarHBondContact O-N 3.24Å
416	T	97.8	Very high	95.6	Very high	38 Å²	38	57.2 Å²	57.2	23%	0.233	33%	0.328	C	S	.	.	H	α-helix	trans	-70.3	-44.8	177.6	-51.8	0	0	0	0	112.2	V412 I413 L414 K418 A419 C420 F432	V412-T416 WeakPolarHBondContact O-CB 3.41Å; V412-T416 PolarHBondContact O-N 3.36Å; V412-T416 VanDerWaalsContact O-N 3.12Å; V412-T416 PolarHBondContact O-OG1 2.97Å; I413-T416 PolarHBondContact O-N 3.05Å; L414-T416 VanDerWaalsContact C-N 3.29Å; T416-K418 VanDerWaalsContact C-N 3.26Å; T416-K418 PolarHBondContact O-N 3.48Å; T416-A419 PolarHBondContact O-N 2.76Å; T416-A419 VanDerWaalsContact O-N 3.1Å; T416-C420 PolarHBondContact O-N 3.26Å; T416-C420 PolarHBondContact O-SG 3.4Å; T416-F432 HydrophobicContact CG2-CD1 4.05Å; T416-F432 HydrophobicContact CG2-CD2 3.74Å; T416-F432 HydrophobicContact CG2-CE1 3.75Å; T416-F432 HydrophobicContact CG2-CE2 3.43Å; T416-F432 VanDerWaalsContact CG2-CE2 3.43Å; T416-F432 HydrophobicContact CG2-CG 4.04Å; T416-F432 HydrophobicContact CG2-CZ 3.44Å; T416-F432 VanDerWaalsContact CG2-CZ 3.44Å
417	I	98.2	Very high	95.9	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-53.4	-46.9	172.9	-70	170.7	0	0	0	110.5	I413 A421 F432 V433 F436 L497	I413-I417 HydrophobicContact CG2-CD1 3.84Å; I413-I417 HydrophobicContact CG2-CG1 4.5Å; I413-I417 WeakPolarHBondContact O-CG1 3.39Å; I413-I417 PolarHBondContact O-N 2.82Å; I417-A421 VanDerWaalsContact O-CB 3.31Å; I417-A421 WeakPolarHBondContact O-CB 3.2Å; I417-A421 PolarHBondContact O-N 3.27Å; I417-F432 HydrophobicContact CD1-CB 4.21Å; I417-F432 HydrophobicContact CG1-CB 3.49Å; I417-F432 VanDerWaalsContact CG1-CB 3.49Å; I417-V433 HydrophobicContact CD1-CG2 4.24Å; I417-F436 HydrophobicContact CD1-CB 4.2Å; I417-L497 HydrophobicContact CG2-CD1 4.02Å; I417-L497 HydrophobicContact CG2-CD2 3.92Å; I417-L497 HydrophobicContact CG2-CG 4.19Å
418	K	97.4	Very high	96.3	Very high	62 Å²	62	52.8 Å²	52.8	27%	0.27	31%	0.313	S	S	.	.	H	α-helix	trans	-63.8	-41.3	178.7	-73.3	-178	-64.3	-173.6	0	112	L414 S415 T416 V422 Q498 C501	L414-K418 WeakPolarHBondContact O-CB 3.4Å; L414-K418 WeakPolarHBondContact O-CE 3.41Å; L414-K418 VanDerWaalsContact O-CG 3.31Å; L414-K418 WeakPolarHBondContact O-CG 3.34Å; L414-K418 PolarHBondContact O-N 3.1Å; S415-K418 PolarHBondContact O-N 3.13Å; T416-K418 VanDerWaalsContact C-N 3.26Å; T416-K418 PolarHBondContact O-N 3.48Å; K418-V422 VanDerWaalsContact O-CG2 3.3Å; K418-V422 WeakPolarHBondContact O-CG2 3.49Å; K418-V422 PolarHBondContact O-N 2.91Å; K418-Q498 HydrophobicContact CG-CG 4.39Å; K418-C501 HydrophobicContact CD-CB 4.18Å; K418-C501 HydrophobicContact CG-CB 4.22Å
419	A	97.7	Very high	96.7	Very high	59 Å²	59	48.5 Å²	48.5	49%	0.488	29%	0.29	S	S	.	.	H	α-helix	trans	-66	-48.6	178.6	0	0	0	0	0	112.1	S415 T416 A421 V422 S423	S415-A419 WeakPolarHBondContact O-CB 3.39Å; S415-A419 PolarHBondContact O-N 3.24Å; T416-A419 PolarHBondContact O-N 2.76Å; T416-A419 VanDerWaalsContact O-N 3.1Å; A419-A421 VanDerWaalsContact C-N 3.32Å; A419-A421 PolarHBondContact O-N 3.08Å; A419-V422 PolarHBondContact O-N 3.28Å; A419-V422 VanDerWaalsContact O-N 3.16Å; A419-S423 PolarHBondContact O-N 3.47Å; A419-S423 PolarHBondContact O-OG 3.09Å
420	C	97.9	Very high	96.9	Very high	14 Å²	14	49.4 Å²	49.4	10%	0.095	29%	0.294	C	S	.	.	H	α-helix	trans	-56.2	-48	175	-70.6	0	0	0	0	110.5	T416 V422 S423 G424 D425 V429	T416-C420 PolarHBondContact O-N 3.26Å; T416-C420 PolarHBondContact O-SG 3.4Å; C420-V422 VanDerWaalsContact C-N 3.31Å; C420-V422 PolarHBondContact O-N 3.36Å; C420-S423 WeakPolarHBondContact CA-OG 3.4Å; C420-S423 PolarHBondContact O-N 3Å; C420-S423 VanDerWaalsContact O-N 3.11Å; C420-S423 PolarHBondContact O-OG 3.2Å; C420-G424 PolarHBondContact O-N 3.4Å; C420-D425 HydrophobicContact CB-CB 4.17Å; C420-D425 PolarHBondContact O-N 3.37Å; C420-D425 PolarHBondContact SG-OD2 3.44Å; C420-V429 HydrophobicContact CB-CG2 3.62Å
421	A	97.4	Very high	97.1	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.008	31%	0.312	C	S	.	.	H	α-helix	trans	-61.5	-35.1	178.5	0	0	0	0	0	113.7	I417 A419 V429 Y484 R494 L497	I417-A421 VanDerWaalsContact O-CB 3.31Å; I417-A421 WeakPolarHBondContact O-CB 3.2Å; I417-A421 PolarHBondContact O-N 3.27Å; A419-A421 VanDerWaalsContact C-N 3.32Å; A419-A421 PolarHBondContact O-N 3.08Å; A421-V429 HydrophobicContact CB-CG2 3.96Å; A421-Y484 WeakPolarHBondContact CA-OH 3.37Å; A421-Y484 HydrophobicContact CB-CD1 4.46Å; A421-Y484 HydrophobicContact CB-CE1 4.11Å; A421-Y484 HydrophobicContact CB-CE2 4.17Å; A421-Y484 PolarHBondContact O-OH 3.14Å; A421-R494 HydrophobicContact CB-CG 4.34Å; A421-R494 WeakPolarHBondContact O-CD 3.46Å; A421-L497 HydrophobicContact CB-CD2 3.9Å
422	V	96.7	Very high	97.3	Very high	90 Å²	90	48.5 Å²	48.5	55%	0.545	29%	0.289	S	S	.	.	H	α-helix	trans	-70.8	-39.7	175	169.5	0	0	0	0	111.6	K418 A419 C420 G424	K418-V422 VanDerWaalsContact O-CG2 3.3Å; K418-V422 WeakPolarHBondContact O-CG2 3.49Å; K418-V422 PolarHBondContact O-N 2.91Å; A419-V422 PolarHBondContact O-N 3.28Å; A419-V422 VanDerWaalsContact O-N 3.16Å; C420-V422 VanDerWaalsContact C-N 3.31Å; C420-V422 PolarHBondContact O-N 3.36Å; V422-G424 VanDerWaalsContact C-N 3.3Å; V422-G424 PolarHBondContact O-N 3.17Å
423	S	96.1	Very high	97.3	Very high	87 Å²	87	44.8 Å²	44.8	61%	0.608	27%	0.266	S	S	*	.	H	α-helix	trans	-74.9	-16.7	179.6	69.6	0	0	0	0	114.3	A419 C420 D425	A419-S423 PolarHBondContact O-N 3.47Å; A419-S423 PolarHBondContact O-OG 3.09Å; C420-S423 WeakPolarHBondContact CA-OG 3.4Å; C420-S423 PolarHBondContact O-N 3Å; C420-S423 VanDerWaalsContact O-N 3.11Å; C420-S423 PolarHBondContact O-OG 3.2Å; S423-D425 WeakPolarHBondContact OG-CB 3.49Å; S423-D425 PolarHBondContact OG-N 3.43Å
424	G	95.1	Very high	97.3	Very high	44 Å²	44	48.1 Å²	48.1	45%	0.454	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.3	10.5	-174.1	0	0	0	0	0	114	C420 V422 V426 Y484	C420-G424 PolarHBondContact O-N 3.4Å; V422-G424 VanDerWaalsContact C-N 3.3Å; V422-G424 PolarHBondContact O-N 3.17Å; G424-V426 PolarHBondContact O-N 3.43Å; G424-V426 VanDerWaalsContact O-N 3.12Å; G424-Y484 WeakPolarHBondContact CA-OH 3.3Å
425	D	97.3	Very high	97.3	Very high	67 Å²	67	53.7 Å²	53.7	36%	0.358	30%	0.303	S	S	.	.			trans	-77.3	90.2	176.8	176.6	18.5	0	0	0	110.5	C420 S423 G428 V429	C420-D425 HydrophobicContact CB-CB 4.17Å; C420-D425 PolarHBondContact O-N 3.37Å; C420-D425 PolarHBondContact SG-OD2 3.44Å; S423-D425 WeakPolarHBondContact OG-CB 3.49Å; S423-D425 PolarHBondContact OG-N 3.43Å; D425-G428 PolarHBondContact OD1-N 3.36Å; D425-G428 WeakPolarHBondContact OD2-CA 3.3Å; D425-V429 WeakPolarHBondContact O-CG2 3.41Å; D425-V429 PolarHBondContact O-N 3.18Å
426	V	97.5	Very high	97.3	Very high	36 Å²	36	51.1 Å²	51.1	22%	0.218	29%	0.285	C	S	.	.	H	α-helix	trans	-68.6	-40.3	-177.4	-179.1	0	0	0	0	111.7	G424 G428 V429 E430 C485 P488	G424-V426 PolarHBondContact O-N 3.43Å; G424-V426 VanDerWaalsContact O-N 3.12Å; V426-G428 VanDerWaalsContact C-N 3.31Å; V426-G428 PolarHBondContact O-N 3.07Å; V426-V429 PolarHBondContact O-N 3.09Å; V426-E430 PolarHBondContact O-N 2.85Å; V426-C485 HydrophobicContact CG1-CB 3.78Å; V426-P488 HydrophobicContact CG2-CB 3.55Å; V426-P488 HydrophobicContact CG2-CG 4.07Å
427	D	97.6	Very high	97.3	Very high	124 Å²	124	53 Å²	53	66%	0.663	29%	0.287	S	S	*	.	H	α-helix	trans	-63.6	-40.8	179.7	-62	-31.1	0	0	0	110.5	E430 Q431	D427-E430 PolarHBondContact O-N 3.15Å; D427-Q431 WeakPolarHBondContact O-CB 3.46Å; D427-Q431 PolarHBondContact O-N 2.92Å
428	G	97.5	Very high	97.2	Very high	7 Å²	7	58.4 Å²	58.4	7%	0.072	32%	0.317	C	S	.	.	H	α-helix	trans	-62.5	-42	172.9	0	0	0	0	0	113.1	D425 V426 F432	D425-G428 PolarHBondContact OD1-N 3.36Å; D425-G428 WeakPolarHBondContact OD2-CA 3.3Å; V426-G428 VanDerWaalsContact C-N 3.31Å; V426-G428 PolarHBondContact O-N 3.07Å; G428-F432 WeakPolarHBondContact O-CD2 3.43Å; G428-F432 PolarHBondContact O-N 2.93Å; G428-F432 VanDerWaalsContact O-N 3.09Å
429	V	97.8	Very high	97.1	Very high	0 Å²	0	56 Å²	56	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-61.9	-46.6	174.7	174.6	0	0	0	0	111	C420 A421 D425 V426 Q431 F432 V433 Y484 L497	C420-V429 HydrophobicContact CB-CG2 3.62Å; A421-V429 HydrophobicContact CB-CG2 3.96Å; D425-V429 WeakPolarHBondContact O-CG2 3.41Å; D425-V429 PolarHBondContact O-N 3.18Å; V426-V429 PolarHBondContact O-N 3.09Å; V429-Q431 PolarHBondContact O-N 2.71Å; V429-F432 PolarHBondContact O-N 2.68Å; V429-V433 HydrophobicContact CG1-CG2 4.05Å; V429-V433 WeakPolarHBondContact O-CB 3.21Å; V429-V433 WeakPolarHBondContact O-CG2 3.5Å; V429-V433 PolarHBondContact O-N 3.38Å; V429-Y484 HydrophobicContact CB-CD1 4.32Å; V429-Y484 HydrophobicContact CB-CE1 4.39Å; V429-Y484 HydrophobicContact CG1-CD1 4.07Å; V429-Y484 HydrophobicContact CG2-CD1 4.04Å; V429-Y484 HydrophobicContact CG2-CE1 3.79Å; V429-L497 HydrophobicContact CG1-CD2 4.19Å
430	E	97.1	Very high	97.1	Very high	111 Å²	111	53.4 Å²	53.4	52%	0.519	29%	0.285	S	S	.	.	H	α-helix	trans	-61.4	-46	-179.6	-173.5	166	-158.4	0	0	111.7	V426 D427 F432 V433 E434	V426-E430 PolarHBondContact O-N 2.85Å; D427-E430 PolarHBondContact O-N 3.15Å; E430-F432 PolarHBondContact O-N 2.87Å; E430-V433 PolarHBondContact O-N 3.41Å; E430-E434 PolarHBondContact O-N 3.2Å
431	Q	97.7	Very high	96.9	Very high	106 Å²	106	56.9 Å²	56.9	50%	0.495	31%	0.305	S	S	.	.	H	α-helix	trans	-58.8	-47.6	177.6	-177.2	-178.6	43.1	0	0	112.5	D427 V429 E434 R435	D427-Q431 WeakPolarHBondContact O-CB 3.46Å; D427-Q431 PolarHBondContact O-N 2.92Å; V429-Q431 PolarHBondContact O-N 2.71Å; Q431-E434 PolarHBondContact O-N 3.49Å; Q431-R435 PolarHBondContact O-N 3.16Å
432	F	98.1	Very high	96.8	Very high	28 Å²	28	57.9 Å²	57.9	12%	0.123	31%	0.31	C	S	.	.	H	α-helix	trans	-77.6	-23.2	-177.3	-82.3	-93.1	0	0	0	113.1	T416 I417 G428 V429 E430 E434 R435 F436	T416-F432 HydrophobicContact CG2-CD1 4.05Å; T416-F432 HydrophobicContact CG2-CD2 3.74Å; T416-F432 HydrophobicContact CG2-CE1 3.75Å; T416-F432 HydrophobicContact CG2-CE2 3.43Å; T416-F432 VanDerWaalsContact CG2-CE2 3.43Å; T416-F432 HydrophobicContact CG2-CG 4.04Å; T416-F432 HydrophobicContact CG2-CZ 3.44Å; T416-F432 VanDerWaalsContact CG2-CZ 3.44Å; I417-F432 HydrophobicContact CD1-CB 4.21Å; I417-F432 HydrophobicContact CG1-CB 3.49Å; I417-F432 VanDerWaalsContact CG1-CB 3.49Å; G428-F432 WeakPolarHBondContact O-CD2 3.43Å; G428-F432 PolarHBondContact O-N 2.93Å; G428-F432 VanDerWaalsContact O-N 3.09Å; V429-F432 PolarHBondContact O-N 2.68Å; E430-F432 PolarHBondContact O-N 2.87Å; F432-E434 VanDerWaalsContact C-N 3.35Å; F432-R435 PolarHBondContact O-N 3.01Å; F432-F436 VanDerWaalsContact O-CB 3.28Å; F432-F436 WeakPolarHBondContact O-CB 3.31Å; F432-F436 PolarHBondContact O-N 2.94Å
433	V	97.7	Very high	96.7	Very high	5 Å²	5	53.7 Å²	53.7	3%	0.03	28%	0.284	C	S	.	.	H	α-helix	trans	-66.9	-35.9	170	165.1	0	0	0	0	111.6	I417 V429 E430 F436 R437 I478	I417-V433 HydrophobicContact CD1-CG2 4.24Å; V429-V433 HydrophobicContact CG1-CG2 4.05Å; V429-V433 WeakPolarHBondContact O-CB 3.21Å; V429-V433 WeakPolarHBondContact O-CG2 3.5Å; V429-V433 PolarHBondContact O-N 3.38Å; E430-V433 PolarHBondContact O-N 3.41Å; V433-F436 WeakPolarHBondContact O-CB 3.38Å; V433-R437 PolarHBondContact O-N 2.98Å; V433-R437 VanDerWaalsContact O-N 3.1Å; V433-I478 HydrophobicContact CG1-CB 4.25Å; V433-I478 HydrophobicContact CG1-CG1 4.26Å; V433-I478 HydrophobicContact CG1-CG2 3.89Å
434	E	96.7	Very high	96.7	Very high	75 Å²	75	51.3 Å²	51.3	35%	0.35	26%	0.264	S	S	.	.	H	α-helix	trans	-69.6	-42.9	172.6	-66.2	-57.6	133.4	0	0	111.4	E430 Q431 F432 F436 R437 D438	E430-E434 PolarHBondContact O-N 3.2Å; Q431-E434 PolarHBondContact O-N 3.49Å; F432-E434 VanDerWaalsContact C-N 3.35Å; E434-F436 VanDerWaalsContact C-N 3.3Å; E434-F436 PolarHBondContact O-N 3.01Å; E434-R437 VanDerWaalsContact CD-NH2 3.28Å; E434-R437 VanDerWaalsContact O-CB 3.3Å; E434-R437 WeakPolarHBondContact O-CB 3.36Å; E434-R437 PolarHBondContact O-N 3.39Å; E434-R437 IonicContact OE1-CZ 3.84Å; E434-R437 IonicContact OE1-NH1 3.82Å; E434-R437 IonicContact OE1-NH2 2.98Å; E434-R437 PolarHBondContact OE1-NH2 3.39Å; E434-R437 IonicContact OE2-CZ 3.82Å; E434-R437 IonicContact OE2-NE 2.65Å; E434-R437 IonicContact OE2-NH1 3Å; E434-R437 PolarHBondContact OE2-NH1 3.41Å; E434-R437 IonicContact OE2-NH2 3.46Å; E434-R437 PolarHBondContact OE2-NH2 3.35Å; E434-R437 VanDerWaalsContact OE2-NH2 3.13Å; E434-D438 PolarHBondContact O-N 3.11Å
435	R	97.2	Very high	96.7	Very high	118 Å²	118	50.8 Å²	50.8	45%	0.445	25%	0.249	S	C	.	.	H	α-helix	trans	-59.7	-40.8	172.7	-67.3	-172.8	-172.4	173.6	5.3	112.6	I413 Q431 F432 R437 D438 H439	I413-R435 HydrophobicContact CD1-CB 4.41Å; Q431-R435 PolarHBondContact O-N 3.16Å; F432-R435 PolarHBondContact O-N 3.01Å; R435-R437 VanDerWaalsContact C-N 3.26Å; R435-R437 PolarHBondContact O-N 2.91Å; R435-D438 PolarHBondContact O-N 2.8Å; R435-H439 WeakPolarHBondContact O-CB 3.45Å; R435-H439 PolarHBondContact O-N 2.95Å
436	F	98	Very high	96.6	Very high	1 Å²	1	47.6 Å²	47.6	0%	0.004	23%	0.232	C	C	.	.	H	α-helix	trans	-58	-40	174.1	173	-94.3	0	0	0	111.7	I413 L414 I417 F432 V433 E434 H439 A440 A474 V477 I478 W504	I413-F436 HydrophobicContact CG2-CB 3.69Å; I413-F436 HydrophobicContact CG2-CD2 4.19Å; I413-F436 HydrophobicContact CG2-CG 4.45Å; L414-F436 HydrophobicContact CD2-CD2 3.99Å; L414-F436 HydrophobicContact CD2-CE2 3.95Å; I417-F436 HydrophobicContact CD1-CB 4.2Å; F432-F436 VanDerWaalsContact O-CB 3.28Å; F432-F436 WeakPolarHBondContact O-CB 3.31Å; F432-F436 PolarHBondContact O-N 2.94Å; V433-F436 WeakPolarHBondContact O-CB 3.38Å; E434-F436 VanDerWaalsContact C-N 3.3Å; E434-F436 PolarHBondContact O-N 3.01Å; F436-H439 PolarHBondContact O-N 3.37Å; F436-A440 HydrophobicContact CE1-CB 4.18Å; F436-A440 HydrophobicContact CZ-CB 4.24Å; F436-A440 WeakPolarHBondContact O-CB 3.34Å; F436-A440 PolarHBondContact O-N 3.32Å; F436-A474 HydrophobicContact CE1-CB 4.26Å; F436-A474 HydrophobicContact CZ-CB 4.49Å; F436-V477 HydrophobicContact CD1-CB 4.41Å; F436-V477 HydrophobicContact CD1-CG1 4.14Å; F436-V477 HydrophobicContact CE1-CB 3.63Å; F436-V477 HydrophobicContact CE1-CG1 3.75Å; F436-V477 HydrophobicContact CE1-CG2 4.32Å; F436-V477 HydrophobicContact CE2-CG1 4.17Å; F436-V477 HydrophobicContact CZ-CB 3.72Å; F436-V477 HydrophobicContact CZ-CG1 3.76Å; F436-V477 HydrophobicContact CZ-CG2 3.93Å; F436-I478 HydrophobicContact CD1-CD1 4.43Å; F436-I478 HydrophobicContact CD1-CG1 3.85Å; F436-I478 HydrophobicContact CE1-CG1 4.07Å; F436-W504 AromaticContact CE2-CD2 3.63Å; F436-W504 HydrophobicContact CE2-CD2 3.63Å; F436-W504 AromaticContact CE2-CE2 3.41Å; F436-W504 VanDerWaalsContact CE2-CE2 3.41Å; F436-W504 HydrophobicContact CE2-CE3 4.22Å; F436-W504 AromaticContact CE2-CG 3.97Å; F436-W504 HydrophobicContact CE2-CG 3.97Å; F436-W504 HydrophobicContact CE2-CH2 4.31Å; F436-W504 AromaticContact CE2-CZ2 3.75Å; F436-W504 HydrophobicContact CE2-CZ2 3.75Å; F436-W504 AromaticContact CE2-NE1 3.69Å; F436-W504 AromaticContact CZ-CD2 3.57Å; F436-W504 HydrophobicContact CZ-CD2 3.57Å; F436-W504 AromaticContact CZ-CE2 3.66Å; F436-W504 AromaticContact CZ-CE3 3.66Å; F436-W504 HydrophobicContact CZ-CE3 3.66Å; F436-W504 HydrophobicContact CZ-CG 4.22Å; F436-W504 AromaticContact CZ-CH2 3.84Å; F436-W504 HydrophobicContact CZ-CH2 3.84Å; F436-W504 AromaticContact CZ-CZ2 3.75Å; F436-W504 HydrophobicContact CZ-CZ2 3.75Å; F436-W504 AromaticContact CZ-CZ3 3.84Å; F436-W504 HydrophobicContact CZ-CZ3 3.84Å
437	R	97.6	Very high	96.6	Very high	77 Å²	77	45.9 Å²	45.9	29%	0.291	22%	0.222	S	C	.	.	H	α-helix	trans	-59.5	-50.4	178.4	-178.3	-175	-60.9	159.1	18.4	111	V433 E434 R435 A440 V441 I478	V433-R437 PolarHBondContact O-N 2.98Å; V433-R437 VanDerWaalsContact O-N 3.1Å; E434-R437 VanDerWaalsContact CD-NH2 3.28Å; E434-R437 VanDerWaalsContact O-CB 3.3Å; E434-R437 WeakPolarHBondContact O-CB 3.36Å; E434-R437 PolarHBondContact O-N 3.39Å; E434-R437 IonicContact OE1-CZ 3.84Å; E434-R437 IonicContact OE1-NH1 3.82Å; E434-R437 IonicContact OE1-NH2 2.98Å; E434-R437 PolarHBondContact OE1-NH2 3.39Å; E434-R437 IonicContact OE2-CZ 3.82Å; E434-R437 IonicContact OE2-NE 2.65Å; E434-R437 IonicContact OE2-NH1 3Å; E434-R437 PolarHBondContact OE2-NH1 3.41Å; E434-R437 IonicContact OE2-NH2 3.46Å; E434-R437 PolarHBondContact OE2-NH2 3.35Å; E434-R437 VanDerWaalsContact OE2-NH2 3.13Å; R435-R437 VanDerWaalsContact C-N 3.26Å; R435-R437 PolarHBondContact O-N 2.91Å; R437-A440 PolarHBondContact O-N 3.27Å; R437-V441 WeakPolarHBondContact O-CG2 3.23Å; R437-V441 PolarHBondContact O-N 3.34Å; R437-V441 VanDerWaalsContact O-N 3.13Å; R437-I478 HydrophobicContact CB-CD1 3.85Å; R437-I478 HydrophobicContact CG-CD1 3.9Å
438	D	95.4	Very high	96.5	Very high	115 Å²	115	42.9 Å²	42.9	62%	0.615	20%	0.201	S	C	*	.	H	α-helix	trans	-63.3	-44.6	-178.3	-63.1	-22.9	0	0	0	110.9	E434 R435 A440 V441 H442	E434-D438 PolarHBondContact O-N 3.11Å; R435-D438 PolarHBondContact O-N 2.8Å; D438-A440 PolarHBondContact O-N 3.41Å; D438-V441 PolarHBondContact O-N 2.99Å; D438-H442 PolarHBondContact O-N 3.05Å
439	H	95.3	Very high	96.5	Very high	11 Å²	11	42.5 Å²	42.5	5%	0.051	20%	0.198	C	C	.	.	H	α-helix	trans	-65.4	-38.2	178.1	-171.9	63.3	0	0	0	112.5	E409 D410 I413 R435 F436 V441 H442 M443	E409-H439 IonicContact OE2-CE1 3.13Å; E409-H439 PolarHBondContact OE2-CE1 3.25Å; E409-H439 IonicContact OE2-CG 3.08Å; E409-H439 IonicContact OE2-ND1 3.79Å; E409-H439 PolarHBondContact OE2-ND1 2.95Å; D410-H439 PolarHBondContact N-NE2 3.06Å; I413-H439 HydrophobicContact CD1-CB 3.8Å; R435-H439 WeakPolarHBondContact O-CB 3.45Å; R435-H439 PolarHBondContact O-N 2.95Å; F436-H439 PolarHBondContact O-N 3.37Å; H439-V441 VanDerWaalsContact C-N 3.34Å; H439-V441 PolarHBondContact O-N 3.24Å; H439-H442 PolarHBondContact O-N 3.18Å; H439-M443 WeakPolarHBondContact CD2-CE 2.95Å; H439-M443 WeakPolarHBondContact NE2-CE 3.26Å; H439-M443 WeakPolarHBondContact O-CG 3.47Å; H439-M443 PolarHBondContact O-N 2.87Å
440	A	96.7	Very high	96.5	Very high	4 Å²	4	42.5 Å²	42.5	3%	0.033	20%	0.198	C	C	.	.	H	α-helix	trans	-65	-34.3	176.1	0	0	0	0	0	113.1	F436 R437 D438 M443 E444 A474 W504	F436-A440 HydrophobicContact CE1-CB 4.18Å; F436-A440 HydrophobicContact CZ-CB 4.24Å; F436-A440 WeakPolarHBondContact O-CB 3.34Å; F436-A440 PolarHBondContact O-N 3.32Å; R437-A440 PolarHBondContact O-N 3.27Å; D438-A440 PolarHBondContact O-N 3.41Å; A440-M443 PolarHBondContact O-N 2.86Å; A440-E444 PolarHBondContact O-N 3.1Å; A440-A474 HydrophobicContact CB-CB 3.73Å; A440-W504 HydrophobicContact CB-CH2 3.57Å; A440-W504 HydrophobicContact CB-CZ2 3.87Å
441	V	95.2	Very high	96.5	Very high	87 Å²	87	37.3 Å²	37.3	53%	0.527	17%	0.173	S	C	.	.	H	α-helix	trans	-64.3	-44.2	174.1	171.2	0	0	0	0	110.5	R437 D438 H439 E444 E445	R437-V441 WeakPolarHBondContact O-CG2 3.23Å; R437-V441 PolarHBondContact O-N 3.34Å; R437-V441 VanDerWaalsContact O-N 3.13Å; D438-V441 PolarHBondContact O-N 2.99Å; H439-V441 VanDerWaalsContact C-N 3.34Å; H439-V441 PolarHBondContact O-N 3.24Å; V441-E444 WeakPolarHBondContact O-CB 3.36Å; V441-E444 PolarHBondContact O-N 2.92Å; V441-E445 PolarHBondContact O-N 3.05Å; V441-E445 VanDerWaalsContact O-N 3.12Å
442	H	94.4	Very high	96.5	Very high	23 Å²	23	32.7 Å²	32.7	11%	0.106	15%	0.152	C	C	.	.	H	α-helix	trans	-62.4	-42.8	175.2	179.2	46.7	0	0	0	112.1	Y335 D438 H439 E444 E445 V446	Y335-H442 AromaticContact CD1-CE1 3.53Å; Y335-H442 AromaticContact CD1-ND1 4Å; Y335-H442 AromaticContact CD2-CE1 3.42Å; Y335-H442 VanDerWaalsContact CD2-CE1 3.42Å; Y335-H442 WeakPolarHBondContact CD2-CE1 3.24Å; Y335-H442 AromaticContact CD2-ND1 3.28Å; Y335-H442 VanDerWaalsContact CD2-ND1 3.28Å; Y335-H442 WeakPolarHBondContact CD2-ND1 3.43Å; Y335-H442 AromaticContact CE1-CE1 3.65Å; Y335-H442 AromaticContact CE1-ND1 3.77Å; Y335-H442 AromaticContact CE1-NE2 3.95Å; Y335-H442 HydrophobicContact CE2-CB 4.31Å; Y335-H442 AromaticContact CE2-CE1 3.58Å; Y335-H442 AromaticContact CE2-CG 3.78Å; Y335-H442 AromaticContact CE2-ND1 3.03Å; Y335-H442 WeakPolarHBondContact CE2-ND1 3.46Å; Y335-H442 AromaticContact CG-CE1 3.4Å; Y335-H442 AromaticContact CG-ND1 3.77Å; Y335-H442 AromaticContact CZ-CE1 3.68Å; Y335-H442 AromaticContact CZ-CG 3.61Å; Y335-H442 AromaticContact CZ-ND1 3.28Å; Y335-H442 VanDerWaalsContact CZ-ND1 3.28Å; D438-H442 PolarHBondContact O-N 3.05Å; H439-H442 PolarHBondContact O-N 3.18Å; H442-E444 VanDerWaalsContact C-N 3.32Å; H442-E444 PolarHBondContact O-N 3.23Å; H442-E445 WeakPolarHBondContact O-CB 3.43Å; H442-E445 PolarHBondContact O-N 2.98Å; H442-V446 PolarHBondContact O-N 2.75Å
443	M	95.3	Very high	96.4	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-61.1	-39.3	175.2	-71.6	-167.8	-128.5	0	0	113	M404 D410 H439 A440 E445 V446 C447 V470 W504 I508	M404-M443 HydrophobicContact SD-CB 4.24Å; M404-M443 HydrophobicContact SD-CG 3.71Å; D410-M443 HydrophobicContact CB-CE 3.76Å; H439-M443 WeakPolarHBondContact CD2-CE 2.95Å; H439-M443 WeakPolarHBondContact NE2-CE 3.26Å; H439-M443 WeakPolarHBondContact O-CG 3.47Å; H439-M443 PolarHBondContact O-N 2.87Å; A440-M443 PolarHBondContact O-N 2.86Å; M443-E445 VanDerWaalsContact C-N 3.3Å; M443-E445 PolarHBondContact O-N 3.23Å; M443-V446 PolarHBondContact O-N 3.13Å; M443-C447 PolarHBondContact O-N 3.33Å; M443-C447 PolarHBondContact O-SG 2.98Å; M443-V470 HydrophobicContact CB-CG1 4.44Å; M443-W504 HydrophobicContact CE-CZ2 3.42Å; M443-W504 VanDerWaalsContact CE-CZ2 3.42Å; M443-W504 HydrophobicContact SD-CH2 4.48Å; M443-W504 HydrophobicContact SD-CZ2 3.52Å; M443-W504 VanDerWaalsContact SD-CZ2 3.52Å; M443-I508 HydrophobicContact CE-CD1 4.41Å; M443-I508 HydrophobicContact SD-CD1 3.27Å; M443-I508 WeakPolarHBondContact SD-CD1 3.3Å; M443-I508 HydrophobicContact SD-CG1 3.95Å
444	E	95.4	Very high	96.3	Very high	38 Å²	38	31.4 Å²	31.4	18%	0.178	15%	0.146	C	C	.	.	H	α-helix	trans	-60.4	-42.5	175.3	-168.9	-170.6	139.9	0	0	111.1	A440 V441 H442 C447 R448 E467 V470 R471	A440-E444 PolarHBondContact O-N 3.1Å; V441-E444 WeakPolarHBondContact O-CB 3.36Å; V441-E444 PolarHBondContact O-N 2.92Å; H442-E444 VanDerWaalsContact C-N 3.32Å; H442-E444 PolarHBondContact O-N 3.23Å; E444-C447 WeakPolarHBondContact O-CB 3.5Å; E444-C447 PolarHBondContact O-N 3.31Å; E444-R448 PolarHBondContact O-N 3.14Å; E444-R448 IonicContact OE1-NH2 2.63Å; E444-R448 PolarHBondContact OE1-NH2 2.69Å; E444-E467 HydrophobicContact CG-CG 4.48Å; E444-V470 HydrophobicContact CB-CG1 4.09Å; E444-R471 HydrophobicContact CG-CB 4.38Å; E444-R471 IonicContact OE1-CZ 3.93Å; E444-R471 VanDerWaalsContact OE1-CZ 3.24Å; E444-R471 IonicContact OE1-NE 3.85Å; E444-R471 PolarHBondContact OE1-NE 2.91Å; E444-R471 IonicContact OE1-NH2 2.7Å; E444-R471 PolarHBondContact OE1-NH2 3.3Å; E444-R471 IonicContact OE2-NE 3.58Å
445	E	94.9	Very high	96	Very high	32 Å²	32	31.7 Å²	31.7	15%	0.15	15%	0.146	C	C	.	.	H	α-helix	trans	-60.8	-48.6	176.1	-171.2	-177.8	152.7	0	0	111.6	S333 V441 H442 M443 C447 R448 L449	S333-E445 VanDerWaalsContact CA-OE1 3.26Å; S333-E445 WeakPolarHBondContact CA-OE1 3.4Å; S333-E445 WeakPolarHBondContact CB-OE1 3.33Å; S333-E445 PolarHBondContact OG-OE1 3.45Å; V441-E445 PolarHBondContact O-N 3.05Å; V441-E445 VanDerWaalsContact O-N 3.12Å; H442-E445 WeakPolarHBondContact O-CB 3.43Å; H442-E445 PolarHBondContact O-N 2.98Å; M443-E445 VanDerWaalsContact C-N 3.3Å; M443-E445 PolarHBondContact O-N 3.23Å; E445-C447 VanDerWaalsContact C-N 3.29Å; E445-C447 PolarHBondContact O-N 3.31Å; E445-R448 WeakPolarHBondContact O-CA 3.46Å; E445-R448 WeakPolarHBondContact O-CB 3.49Å; E445-R448 PolarHBondContact O-N 2.93Å; E445-L449 WeakPolarHBondContact O-CG 3.26Å; E445-L449 PolarHBondContact O-N 3.15Å
446	V	96.1	Very high	95.8	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-58.5	-41.3	175.8	172.8	0	0	0	0	111.4	Q400 A401 M404 H442 M443 R448 L449 L450	Q400-V446 HydrophobicContact CB-CG2 4.42Å; A401-V446 HydrophobicContact CB-CG1 3.74Å; M404-V446 HydrophobicContact CB-CG2 4.39Å; M404-V446 HydrophobicContact SD-CB 3.97Å; M404-V446 HydrophobicContact SD-CG1 4Å; M404-V446 HydrophobicContact SD-CG2 3.94Å; H442-V446 PolarHBondContact O-N 2.75Å; M443-V446 PolarHBondContact O-N 3.13Å; V446-R448 VanDerWaalsContact C-N 3.31Å; V446-R448 PolarHBondContact O-N 3.3Å; V446-L449 PolarHBondContact O-N 3.07Å; V446-L450 HydrophobicContact CG1-CD1 4.34Å; V446-L450 WeakPolarHBondContact O-CG 3.46Å; V446-L450 PolarHBondContact O-N 3.22Å
447	C	96.8	Very high	95.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60.5	-41.6	174.9	-66.4	0	0	0	0	112	M443 E444 E445 L450 H451 E467 L511	M443-C447 PolarHBondContact O-N 3.33Å; M443-C447 PolarHBondContact O-SG 2.98Å; E444-C447 WeakPolarHBondContact O-CB 3.5Å; E444-C447 PolarHBondContact O-N 3.31Å; E445-C447 VanDerWaalsContact C-N 3.29Å; E445-C447 PolarHBondContact O-N 3.31Å; C447-L450 PolarHBondContact O-N 2.73Å; C447-H451 WeakPolarHBondContact O-CB 3.44Å; C447-H451 PolarHBondContact O-N 3.39Å; C447-E467 HydrophobicContact CB-CB 3.75Å; C447-E467 HydrophobicContact CB-CG 4.15Å; C447-L511 HydrophobicContact CB-CD1 4.48Å; C447-L511 WeakPolarHBondContact SG-CD1 3.13Å; C447-L511 WeakPolarHBondContact SG-CD2 3.47Å
448	R	95.9	Very high	95.2	Very high	61 Å²	61	29 Å²	29	23%	0.23	15%	0.149	C	C	.	.	H	α-helix	trans	-63.7	-44.6	177	-164.7	-172.5	-54.4	131.4	11.6	110.9	D329 E444 E445 V446 L450 H451 H452 E467	D329-R448 VanDerWaalsContact CG-CD 3.41Å; D329-R448 WeakPolarHBondContact OD1-CD 3.46Å; D329-R448 IonicContact OD1-CZ 3.1Å; D329-R448 IonicContact OD1-NE 2.67Å; D329-R448 IonicContact OD1-NH1 2.7Å; D329-R448 PolarHBondContact OD1-NH1 3.4Å; E444-R448 PolarHBondContact O-N 3.14Å; E444-R448 IonicContact OE1-NH2 2.63Å; E444-R448 PolarHBondContact OE1-NH2 2.69Å; E445-R448 WeakPolarHBondContact O-CA 3.46Å; E445-R448 WeakPolarHBondContact O-CB 3.49Å; E445-R448 PolarHBondContact O-N 2.93Å; V446-R448 VanDerWaalsContact C-N 3.31Å; V446-R448 PolarHBondContact O-N 3.3Å; R448-L450 PolarHBondContact O-N 3.48Å; R448-H451 CarbonylContact O-C 3.57Å; R448-H451 WeakPolarHBondContact O-CA 3.28Å; R448-H451 VanDerWaalsContact O-CB 3.28Å; R448-H451 WeakPolarHBondContact O-CB 3.42Å; R448-H451 PolarHBondContact O-N 3.35Å; R448-H452 PolarHBondContact O-CD2 2.84Å; R448-H452 PolarHBondContact O-N 2.87Å; R448-E467 HydrophobicContact CB-CG 4.26Å; R448-E467 IonicContact NE-OE1 3.78Å
449	L	97.5	Very high	95.2	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-60.6	-45.1	175.9	-60.5	-171.2	0	0	0	112.1	D329 F330 Q400 E445 V446 H451 H452 I453	D329-L449 HydrophobicContact CB-CD2 4.03Å; F330-L449 HydrophobicContact CD1-CD1 4.44Å; F330-L449 HydrophobicContact CD1-CD2 3.82Å; F330-L449 HydrophobicContact CD2-CD2 4.01Å; F330-L449 HydrophobicContact CE1-CB 4.12Å; F330-L449 HydrophobicContact CE1-CD2 3.86Å; F330-L449 HydrophobicContact CE1-CG 4.4Å; F330-L449 HydrophobicContact CE2-CD2 4.06Å; F330-L449 HydrophobicContact CG-CD2 3.89Å; F330-L449 HydrophobicContact CZ-CB 4.35Å; F330-L449 HydrophobicContact CZ-CD2 3.98Å; Q400-L449 HydrophobicContact CB-CD1 4.49Å; Q400-L449 VanDerWaalsContact CD-CD1 3.47Å; Q400-L449 HydrophobicContact CG-CD1 4.37Å; Q400-L449 VanDerWaalsContact OE1-CD1 3.27Å; E445-L449 WeakPolarHBondContact O-CG 3.26Å; E445-L449 PolarHBondContact O-N 3.15Å; V446-L449 PolarHBondContact O-N 3.07Å; L449-H451 PolarHBondContact O-N 3.41Å; L449-H452 PolarHBondContact O-N 3.14Å; L449-H452 VanDerWaalsContact O-N 3.14Å; L449-I453 PolarHBondContact O-N 3.46Å
450	L	97.5	Very high	95.2	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-58.8	-34.8	173.8	-71.1	174.9	0	0	0	112.1	L398 A401 V446 C447 R448 I453 S454 T463 L511 A515 V518	L398-L450 HydrophobicContact CD2-CD2 4.12Å; A401-L450 HydrophobicContact CB-CD1 4.29Å; A401-L450 HydrophobicContact CB-CD2 4.1Å; A401-L450 HydrophobicContact CB-CG 4.39Å; V446-L450 HydrophobicContact CG1-CD1 4.34Å; V446-L450 WeakPolarHBondContact O-CG 3.46Å; V446-L450 PolarHBondContact O-N 3.22Å; C447-L450 PolarHBondContact O-N 2.73Å; R448-L450 PolarHBondContact O-N 3.48Å; L450-I453 HydrophobicContact CD2-CD1 4.29Å; L450-I453 WeakPolarHBondContact O-CG1 3.38Å; L450-S454 PolarHBondContact O-N 3.4Å; L450-S454 PolarHBondContact O-OG 2.67Å; L450-T463 HydrophobicContact CB-CG2 4.18Å; L450-L511 HydrophobicContact CD1-CD1 4.14Å; L450-A515 HydrophobicContact CD1-CB 3.88Å; L450-A515 HydrophobicContact CD2-CB 4.39Å; L450-V518 HydrophobicContact CD2-CB 4.45Å; L450-V518 HydrophobicContact CD2-CG1 4.29Å
451	H	96.6	Very high	95.1	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.005	12%	0.12	C	C	.	.	H	α-helix	trans	-69	-41.9	175.1	-173.8	-160.8	0	0	0	112.3	Q285 T287 C447 R448 L449 I453 S454 H460 T463 G464 E467	Q285-H451 VanDerWaalsContact CD-CE1 3.45Å; T287-H451 WeakPolarHBondContact CG2-O 3.44Å; C447-H451 WeakPolarHBondContact O-CB 3.44Å; C447-H451 PolarHBondContact O-N 3.39Å; R448-H451 CarbonylContact O-C 3.57Å; R448-H451 WeakPolarHBondContact O-CA 3.28Å; R448-H451 VanDerWaalsContact O-CB 3.28Å; R448-H451 WeakPolarHBondContact O-CB 3.42Å; R448-H451 PolarHBondContact O-N 3.35Å; L449-H451 PolarHBondContact O-N 3.41Å; H451-I453 VanDerWaalsContact C-N 3.28Å; H451-I453 PolarHBondContact O-N 3.07Å; H451-S454 PolarHBondContact O-N 3.1Å; H451-H460 AromaticContact CD2-CE1 3.92Å; H451-H460 AromaticContact CD2-ND1 3.49Å; H451-H460 PolarHBondContact CD2-ND1 3.44Å; H451-H460 PolarHBondContact CD2-O 3.41Å; H451-H460 AromaticContact NE2-CE1 3.18Å; H451-H460 PolarHBondContact NE2-CE1 2.81Å; H451-H460 AromaticContact NE2-ND1 3.22Å; H451-H460 PolarHBondContact NE2-ND1 2.95Å; H451-H460 PolarHBondContact NE2-O 3Å; H451-T463 WeakPolarHBondContact CA-OG1 3.39Å; H451-G464 PolarHBondContact CD2-N 2.8Å; H451-G464 WeakPolarHBondContact CE1-CA 3.39Å; H451-G464 WeakPolarHBondContact ND1-CA 3.45Å; H451-E467 IonicContact CG-OE2 3.29Å; H451-E467 IonicContact ND1-OE2 2.66Å; H451-E467 PolarHBondContact ND1-OE2 2.71Å; H451-E467 VanDerWaalsContact ND1-OE2 3.15Å
452	H	97.3	Very high	95.1	Very high	9 Å²	9	21.9 Å²	21.9	4%	0.042	10%	0.104	C	C	.	.	H	α-helix	trans	-60.9	-33.5	177.2	-80.1	-77.3	0	0	0	114	A288 D289 M326 D329 F330 R448 L449	A288-H452 HydrophobicContact CB-CB 3.9Å; A288-H452 PolarHBondContact N-ND1 2.99Å; D289-H452 WeakPolarHBondContact CB-O 3.4Å; D289-H452 PolarHBondContact N-O 3.42Å; M326-H452 PolarHBondContact O-CE1 3.42Å; M326-H452 PolarHBondContact O-ND1 2.98Å; D329-H452 IonicContact OD2-CD2 3.69Å; D329-H452 IonicContact OD2-CE1 3.75Å; D329-H452 IonicContact OD2-NE2 3.69Å; D329-H452 PolarHBondContact OD2-NE2 3.24Å; F330-H452 HydrophobicContact CE2-CB 3.45Å; F330-H452 VanDerWaalsContact CE2-CB 3.45Å; F330-H452 AromaticContact CE2-CG 3.83Å; F330-H452 HydrophobicContact CZ-CB 3.53Å; R448-H452 PolarHBondContact O-CD2 2.84Å; R448-H452 PolarHBondContact O-N 2.87Å; L449-H452 PolarHBondContact O-N 3.14Å; L449-H452 VanDerWaalsContact O-N 3.14Å
453	I	96.7	Very high	95.2	Very high	5 Å²	5	20.9 Å²	20.9	3%	0.026	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-4.1	-176.6	69.1	174.3	0	0	0	114.1	F330 L393 Q394 L398 L449 L450 H451 F455 V518	F330-I453 HydrophobicContact CE1-CG2 3.94Å; F330-I453 HydrophobicContact CZ-CG2 3.67Å; L393-I453 HydrophobicContact CB-CG2 4.13Å; Q394-I453 HydrophobicContact CG-CB 3.99Å; Q394-I453 HydrophobicContact CG-CG2 4.33Å; L398-I453 HydrophobicContact CD2-CD1 4.27Å; L398-I453 HydrophobicContact CG-CD1 3.98Å; L449-I453 PolarHBondContact O-N 3.46Å; L450-I453 HydrophobicContact CD2-CD1 4.29Å; L450-I453 WeakPolarHBondContact O-CG1 3.38Å; H451-I453 VanDerWaalsContact C-N 3.28Å; H451-I453 PolarHBondContact O-N 3.07Å; I453-F455 PolarHBondContact O-N 3.01Å; I453-V518 HydrophobicContact CD1-CG1 3.77Å; I453-V518 HydrophobicContact CG1-CG1 3.89Å
454	S	95.1	Very high	95.2	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.007	10%	0.099	C	C	.	.			trans	-77.4	114	-179.7	-75.3	0	0	0	0	111.5	L450 H451 T463	L450-S454 PolarHBondContact O-N 3.4Å; L450-S454 PolarHBondContact O-OG 2.67Å; H451-S454 PolarHBondContact O-N 3.1Å; S454-T463 VanDerWaalsContact OG-CG2 3.26Å; S454-T463 WeakPolarHBondContact OG-CG2 3.44Å; S454-T463 PolarHBondContact OG-OG1 3.46Å; S454-T463 VanDerWaalsContact OG-OG1 3.13Å
455	F	91.1	Very high	95.1	Very high	81 Å²	81	20 Å²	20	36%	0.355	10%	0.095	S	C	.	.			trans	-110.4	-1.8	-170.7	63	-93.2	0	0	0	114.8	D289 I453 A521	D289-F455 HydrophobicContact CB-CB 4.5Å; D289-F455 VanDerWaalsContact CG-CB 3.45Å; D289-F455 VanDerWaalsContact OD2-CA 3.28Å; D289-F455 WeakPolarHBondContact OD2-CA 3.38Å; D289-F455 WeakPolarHBondContact OD2-CB 3.42Å; I453-F455 PolarHBondContact O-N 3.01Å; F455-A521 HydrophobicContact CE1-CB 3.98Å; F455-A521 HydrophobicContact CZ-CB 3.73Å; F455-A521 WeakPolarHBondContact CZ-O 3.26Å
456	T	92.1	Very high	95.1	Very high	48 Å²	48	19.2 Å²	19.2	29%	0.294	9%	0.094	S	C	.	.	S	Bend	trans	-102.4	143.1	169.4	71.2	0	0	0	0	109.5	G458 L459 H460	T456-G458 PolarHBondContact O-N 3.22Å; T456-G458 VanDerWaalsContact O-N 3.1Å; T456-L459 HydrophobicContact CG2-CD1 4.45Å; T456-L459 PolarHBondContact O-N 3.47Å; T456-L459 WeakPolarHBondContact OG1-CB 3.33Å; T456-L459 WeakPolarHBondContact OG1-CD1 3.34Å; T456-L459 VanDerWaalsContact OG1-CG 3.26Å; T456-L459 WeakPolarHBondContact OG1-CG 3.36Å; T456-L459 PolarHBondContact OG1-N 3.1Å; T456-H460 WeakPolarHBondContact O-CB 3.46Å; T456-H460 PolarHBondContact O-N 3.23Å
457	D	91.5	Very high	95	Very high	88 Å²	88	19.4 Å²	19.4	47%	0.471	10%	0.095	S	C	.	.	H	α-helix	trans	-47.4	-42.9	177.7	-81.3	1.2	0	0	0	112.8	E199 K200 V461	E199-D457 HydrophobicContact CB-CB 4.47Å; E199-D457 HydrophobicContact CG-CB 4.5Å; K200-D457 HydrophobicContact CB-CB 3.96Å; D457-V461 WeakPolarHBondContact O-CG2 3.4Å; D457-V461 PolarHBondContact O-N 3.44Å
458	G	93.1	Very high	94.8	Very high	3 Å²	3	21.4 Å²	21.4	3%	0.031	10%	0.103	C	C	.	.	H	α-helix	trans	-72.6	-33.3	-179.3	0	0	0	0	0	114.2	T456 R462	T456-G458 PolarHBondContact O-N 3.22Å; T456-G458 VanDerWaalsContact O-N 3.1Å; G458-R462 WeakPolarHBondContact O-CB 3.5Å; G458-R462 VanDerWaalsContact O-CG 3.26Å; G458-R462 WeakPolarHBondContact O-CG 3.46Å; G458-R462 PolarHBondContact O-N 2.87Å; G458-R462 PolarHBondContact O-NE 3.24Å
459	L	95	Very high	94.6	Very high	6 Å²	6	19 Å²	19	3%	0.031	10%	0.095	C	C	.	.	H	α-helix	trans	-76.4	-42.9	174.8	-73.3	172.5	0	0	0	111.3	T456 V461 R462 T463 L514 E517 V518 A521	T456-L459 HydrophobicContact CG2-CD1 4.45Å; T456-L459 PolarHBondContact O-N 3.47Å; T456-L459 WeakPolarHBondContact OG1-CB 3.33Å; T456-L459 WeakPolarHBondContact OG1-CD1 3.34Å; T456-L459 VanDerWaalsContact OG1-CG 3.26Å; T456-L459 WeakPolarHBondContact OG1-CG 3.36Å; T456-L459 PolarHBondContact OG1-N 3.1Å; L459-V461 PolarHBondContact O-N 3.33Å; L459-R462 VanDerWaalsContact CD2-NH2 3.35Å; L459-R462 PolarHBondContact O-N 2.92Å; L459-R462 VanDerWaalsContact O-N 3.14Å; L459-T463 WeakPolarHBondContact O-CB 3.26Å; L459-T463 WeakPolarHBondContact O-CG2 3.44Å; L459-T463 PolarHBondContact O-N 3.38Å; L459-T463 PolarHBondContact O-OG1 3.38Å; L459-L514 HydrophobicContact CD2-CD1 3.94Å; L459-E517 HydrophobicContact CD2-CB 4.08Å; L459-V518 HydrophobicContact CD1-CG2 4.44Å; L459-V518 HydrophobicContact CD2-CG2 3.96Å; L459-A521 HydrophobicContact CD1-CB 3.53Å
460	H	94.7	Very high	94.5	Very high	10 Å²	10	19.3 Å²	19.3	5%	0.046	10%	0.097	C	C	.	.	H	α-helix	trans	-56.1	-49.4	178.6	173.5	64.8	0	0	0	111.2	I282 Q285 I290 H451 T456 R462 T463 G464	I282-H460 PolarHBondContact O-NE2 3.13Å; Q285-H460 PolarHBondContact O-CE1 3.44Å; Q285-H460 PolarHBondContact O-NE2 2.96Å; I290-H460 VanDerWaalsContact CD1-CE1 3.44Å; I290-H460 WeakPolarHBondContact CD1-CE1 3.47Å; H451-H460 AromaticContact CD2-CE1 3.92Å; H451-H460 AromaticContact CD2-ND1 3.49Å; H451-H460 PolarHBondContact CD2-ND1 3.44Å; H451-H460 PolarHBondContact CD2-O 3.41Å; H451-H460 AromaticContact NE2-CE1 3.18Å; H451-H460 PolarHBondContact NE2-CE1 2.81Å; H451-H460 AromaticContact NE2-ND1 3.22Å; H451-H460 PolarHBondContact NE2-ND1 2.95Å; H451-H460 PolarHBondContact NE2-O 3Å; T456-H460 WeakPolarHBondContact O-CB 3.46Å; T456-H460 PolarHBondContact O-N 3.23Å; H460-R462 PolarHBondContact O-N 2.92Å; H460-T463 PolarHBondContact O-OG1 2.64Å; H460-G464 PolarHBondContact O-N 2.77Å; H460-G464 VanDerWaalsContact O-N 3.07Å
461	V	94.8	Very high	94.3	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.006	11%	0.108	C	C	.	.	H	α-helix	trans	-62.6	-41.5	176.4	170.7	0	0	0	0	112.6	K200 A203 Q204 V207 D457 L459 H465	K200-V461 HydrophobicContact CG-CG2 4.11Å; A203-V461 HydrophobicContact CB-CB 3.89Å; A203-V461 HydrophobicContact CB-CG1 3.82Å; A203-V461 HydrophobicContact CB-CG2 4.45Å; Q204-V461 HydrophobicContact CB-CG1 4.39Å; Q204-V461 HydrophobicContact CG-CB 4.47Å; Q204-V461 HydrophobicContact CG-CG1 3.64Å; Q204-V461 HydrophobicContact CG-CG2 3.92Å; V207-V461 HydrophobicContact CG2-CG1 3.93Å; D457-V461 WeakPolarHBondContact O-CG2 3.4Å; D457-V461 PolarHBondContact O-N 3.44Å; L459-V461 PolarHBondContact O-N 3.33Å; V461-H465 WeakPolarHBondContact O-CB 3.3Å; V461-H465 PolarHBondContact O-N 3.08Å
462	R	95.4	Very high	94.1	Very high	52 Å²	52	22.8 Å²	22.8	20%	0.196	11%	0.112	C	C	.	.	H	α-helix	trans	-75.4	-37.3	-175.2	-74	-173.6	-62.5	161	2.6	112.9	G458 L459 H460 H465 A466 L514 E517	G458-R462 WeakPolarHBondContact O-CB 3.5Å; G458-R462 VanDerWaalsContact O-CG 3.26Å; G458-R462 WeakPolarHBondContact O-CG 3.46Å; G458-R462 PolarHBondContact O-N 2.87Å; G458-R462 PolarHBondContact O-NE 3.24Å; L459-R462 VanDerWaalsContact CD2-NH2 3.35Å; L459-R462 PolarHBondContact O-N 2.92Å; L459-R462 VanDerWaalsContact O-N 3.14Å; H460-R462 PolarHBondContact O-N 2.92Å; R462-H465 PolarHBondContact O-N 3.08Å; R462-A466 PolarHBondContact O-N 2.89Å; R462-L514 HydrophobicContact CB-CD1 3.92Å; R462-L514 HydrophobicContact CB-CD2 4.18Å; R462-L514 WeakPolarHBondContact O-CD2 3.43Å; R462-E517 IonicContact CZ-OE2 3.38Å; R462-E517 IonicContact NH1-OE1 2.75Å; R462-E517 IonicContact NH1-OE2 3.05Å; R462-E517 PolarHBondContact NH1-OE2 3.16Å; R462-E517 IonicContact NH2-OE2 3.32Å; R462-E517 PolarHBondContact NH2-OE2 3.03Å
463	T	96.3	Very high	94.1	Very high	2 Å²	2	22.4 Å²	22.4	1%	0.012	11%	0.111	C	C	.	.	H	α-helix	trans	-71.2	-43.7	176.9	48.1	0	0	0	0	111.3	L450 H451 S454 L459 H460 H465 A466 E467 L514 V518	L450-T463 HydrophobicContact CB-CG2 4.18Å; H451-T463 WeakPolarHBondContact CA-OG1 3.39Å; S454-T463 VanDerWaalsContact OG-CG2 3.26Å; S454-T463 WeakPolarHBondContact OG-CG2 3.44Å; S454-T463 PolarHBondContact OG-OG1 3.46Å; S454-T463 VanDerWaalsContact OG-OG1 3.13Å; L459-T463 WeakPolarHBondContact O-CB 3.26Å; L459-T463 WeakPolarHBondContact O-CG2 3.44Å; L459-T463 PolarHBondContact O-N 3.38Å; L459-T463 PolarHBondContact O-OG1 3.38Å; H460-T463 PolarHBondContact O-OG1 2.64Å; T463-H465 VanDerWaalsContact C-N 3.25Å; T463-H465 PolarHBondContact O-N 3.38Å; T463-A466 WeakPolarHBondContact O-CB 3.36Å; T463-A466 PolarHBondContact O-N 2.98Å; T463-A466 VanDerWaalsContact O-N 3.07Å; T463-E467 PolarHBondContact O-N 2.84Å; T463-L514 HydrophobicContact CG2-CD1 4.21Å; T463-L514 HydrophobicContact CG2-CD2 3.7Å; T463-L514 HydrophobicContact CG2-CG 3.87Å; T463-V518 HydrophobicContact CG2-CG2 3.81Å
464	G	94.5	Very high	94.1	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.9	-34.7	170.8	0	0	0	0	0	112.8	H451 H460 R468	H451-G464 PolarHBondContact CD2-N 2.8Å; H451-G464 WeakPolarHBondContact CE1-CA 3.39Å; H451-G464 WeakPolarHBondContact ND1-CA 3.45Å; H460-G464 PolarHBondContact O-N 2.77Å; H460-G464 VanDerWaalsContact O-N 3.07Å; G464-R468 WeakPolarHBondContact O-CG 3.49Å; G464-R468 PolarHBondContact O-N 2.69Å; G464-R468 VanDerWaalsContact O-N 3.16Å
465	H	94.1	Very high	94.2	Very high	20 Å²	20	25.8 Å²	25.8	9%	0.093	13%	0.134	C	C	.	.	H	α-helix	trans	-66.5	-43.3	171.1	176.3	44.4	0	0	0	112.6	V207 I211 I282 V461 R462 T463 E467 R468 S469	V207-H465 HydrophobicContact CB-CB 4.32Å; V207-H465 HydrophobicContact CG1-CB 3.79Å; V207-H465 WeakPolarHBondContact CG1-ND1 3.34Å; V207-H465 HydrophobicContact CG2-CB 3.54Å; I211-H465 WeakPolarHBondContact CG1-CE1 3.47Å; I282-H465 HydrophobicContact CD1-CB 3.94Å; V461-H465 WeakPolarHBondContact O-CB 3.3Å; V461-H465 PolarHBondContact O-N 3.08Å; R462-H465 PolarHBondContact O-N 3.08Å; T463-H465 VanDerWaalsContact C-N 3.25Å; T463-H465 PolarHBondContact O-N 3.38Å; H465-E467 VanDerWaalsContact C-N 3.31Å; H465-E467 PolarHBondContact O-N 3.36Å; H465-R468 PolarHBondContact O-N 3.48Å; H465-S469 VanDerWaalsContact O-CB 3.24Å; H465-S469 WeakPolarHBondContact O-CB 3.38Å; H465-S469 PolarHBondContact O-N 3.36Å
466	A	94.8	Very high	94.6	Very high	16 Å²	16	22 Å²	22	13%	0.132	12%	0.117	C	C	.	.	H	α-helix	trans	-60	-44.4	-179.9	0	0	0	0	0	111	R462 T463 S469 V470 L511 L514	R462-A466 PolarHBondContact O-N 2.89Å; T463-A466 WeakPolarHBondContact O-CB 3.36Å; T463-A466 PolarHBondContact O-N 2.98Å; T463-A466 VanDerWaalsContact O-N 3.07Å; A466-S469 PolarHBondContact O-N 3.02Å; A466-V470 WeakPolarHBondContact O-CG2 3.47Å; A466-V470 PolarHBondContact O-N 3.09Å; A466-L511 HydrophobicContact CB-CD1 3.79Å; A466-L514 HydrophobicContact CB-CD2 3.9Å
467	E	94.1	Very high	94.8	Very high	4 Å²	4	19.7 Å²	19.7	2%	0.019	10%	0.103	C	C	.	.	H	α-helix	trans	-54.8	-55.4	172.9	-172.5	-165.7	162.2	0	0	111.8	E444 C447 R448 H451 T463 H465 S469 V470 R471	E444-E467 HydrophobicContact CG-CG 4.48Å; C447-E467 HydrophobicContact CB-CB 3.75Å; C447-E467 HydrophobicContact CB-CG 4.15Å; R448-E467 HydrophobicContact CB-CG 4.26Å; R448-E467 IonicContact NE-OE1 3.78Å; H451-E467 IonicContact CG-OE2 3.29Å; H451-E467 IonicContact ND1-OE2 2.66Å; H451-E467 PolarHBondContact ND1-OE2 2.71Å; H451-E467 VanDerWaalsContact ND1-OE2 3.15Å; T463-E467 PolarHBondContact O-N 2.84Å; H465-E467 VanDerWaalsContact C-N 3.31Å; H465-E467 PolarHBondContact O-N 3.36Å; E467-S469 VanDerWaalsContact C-N 3.28Å; E467-S469 PolarHBondContact O-N 3.37Å; E467-V470 PolarHBondContact O-N 3.33Å; E467-R471 WeakPolarHBondContact O-CB 3.48Å; E467-R471 PolarHBondContact O-N 2.89Å; E467-R471 IonicContact OE1-CZ 3.96Å; E467-R471 IonicContact OE1-NH1 3.75Å; E467-R471 IonicContact OE1-NH2 3.55Å; E467-R471 PolarHBondContact OE1-NH2 2.96Å
468	R	91.8	Very high	95.2	Very high	42 Å²	42	16.2 Å²	16.2	16%	0.158	9%	0.085	C	C	.	.	H	α-helix	trans	-62.5	-35	178.5	-68.8	-177.3	-166.9	-179.5	5.8	112.8	E278 P279 G464 H465 A472	E278-R468 WeakPolarHBondContact OE2-CD 3.4Å; E278-R468 IonicContact OE2-CZ 2.64Å; E278-R468 IonicContact OE2-NE 3.46Å; E278-R468 PolarHBondContact OE2-NE 3.04Å; E278-R468 VanDerWaalsContact OE2-NE 3.1Å; P279-R468 VanDerWaalsContact O-CZ 3.26Å; P279-R468 PolarHBondContact O-NH1 3.4Å; P279-R468 PolarHBondContact O-NH2 2.92Å; G464-R468 WeakPolarHBondContact O-CG 3.49Å; G464-R468 PolarHBondContact O-N 2.69Å; G464-R468 VanDerWaalsContact O-N 3.16Å; H465-R468 PolarHBondContact O-N 3.48Å; R468-A472 WeakPolarHBondContact O-CB 3.49Å; R468-A472 PolarHBondContact O-N 2.98Å
469	S	93.1	Very high	95.4	Very high	11 Å²	11	17 Å²	17	8%	0.077	9%	0.088	C	C	.	.	H	α-helix	trans	-67	-43.1	178.7	-172.8	0	0	0	0	111	H465 A466 E467 A472 L473	H465-S469 VanDerWaalsContact O-CB 3.24Å; H465-S469 WeakPolarHBondContact O-CB 3.38Å; H465-S469 PolarHBondContact O-N 3.36Å; A466-S469 PolarHBondContact O-N 3.02Å; E467-S469 VanDerWaalsContact C-N 3.28Å; E467-S469 PolarHBondContact O-N 3.37Å; S469-A472 PolarHBondContact O-N 3.23Å; S469-L473 WeakPolarHBondContact O-CB 3.14Å; S469-L473 PolarHBondContact O-N 3.45Å
470	V	94.5	Very high	95.6	Very high	5 Å²	5	16.7 Å²	16.7	3%	0.03	9%	0.086	C	C	.	.	H	α-helix	trans	-63.8	-49.9	175.7	165.6	0	0	0	0	110.3	M443 E444 A466 E467 A472 L473 A474 W504	M443-V470 HydrophobicContact CB-CG1 4.44Å; E444-V470 HydrophobicContact CB-CG1 4.09Å; A466-V470 WeakPolarHBondContact O-CG2 3.47Å; A466-V470 PolarHBondContact O-N 3.09Å; E467-V470 PolarHBondContact O-N 3.33Å; V470-A472 VanDerWaalsContact C-N 3.27Å; V470-A472 PolarHBondContact O-N 3.06Å; V470-L473 PolarHBondContact O-N 3Å; V470-L473 VanDerWaalsContact O-N 3.14Å; V470-A474 WeakPolarHBondContact O-CB 3.36Å; V470-A474 PolarHBondContact O-N 3.2Å; V470-W504 HydrophobicContact CG1-CH2 3.74Å; V470-W504 HydrophobicContact CG1-CZ3 4.2Å
471	R	93.8	Very high	95.7	Very high	62 Å²	62	16.2 Å²	16.2	23%	0.234	8%	0.084	C	C	.	.	H	α-helix	trans	-55.5	-39.4	175.8	-175.3	-177.3	-63.6	124.8	11	112.9	E278 E444 E467 P475	E278-R471 IonicContact OE1-CZ 3.58Å; E278-R471 IonicContact OE1-NE 2.71Å; E278-R471 IonicContact OE1-NH1 3.74Å; E278-R471 PolarHBondContact OE1-NH1 3.43Å; E278-R471 IonicContact OE2-NH1 3.54Å; E278-R471 PolarHBondContact OE2-NH1 3.38Å; E444-R471 HydrophobicContact CG-CB 4.38Å; E444-R471 IonicContact OE1-CZ 3.93Å; E444-R471 VanDerWaalsContact OE1-CZ 3.24Å; E444-R471 IonicContact OE1-NE 3.85Å; E444-R471 PolarHBondContact OE1-NE 2.91Å; E444-R471 IonicContact OE1-NH2 2.7Å; E444-R471 PolarHBondContact OE1-NH2 3.3Å; E444-R471 IonicContact OE2-NE 3.58Å; E467-R471 WeakPolarHBondContact O-CB 3.48Å; E467-R471 PolarHBondContact O-N 2.89Å; E467-R471 IonicContact OE1-CZ 3.96Å; E467-R471 IonicContact OE1-NH1 3.75Å; E467-R471 IonicContact OE1-NH2 3.55Å; E467-R471 PolarHBondContact OE1-NH2 2.96Å; R471-P475 WeakPolarHBondContact O-CD 3.31Å; R471-P475 WeakPolarHBondContact O-CG 3.43Å
472	A	93.3	Very high	95.9	Very high	12 Å²	12	21.7 Å²	21.7	10%	0.099	11%	0.105	C	C	.	.	H	α-helix	trans	-76.5	-33.5	179.3	0	0	0	0	0	113.4	R468 S469 V470 L476	R468-A472 WeakPolarHBondContact O-CB 3.49Å; R468-A472 PolarHBondContact O-N 2.98Å; S469-A472 PolarHBondContact O-N 3.23Å; V470-A472 VanDerWaalsContact C-N 3.27Å; V470-A472 PolarHBondContact O-N 3.06Å; A472-L476 WeakPolarHBondContact O-CG 3.45Å
473	L	96.2	Very high	96	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-87.1	-35.6	-173.4	-172.9	61.3	0	0	0	112.9	L218 S469 V470 L476 V477 F500 T503 W504 A507	L218-L473 HydrophobicContact CD1-CD1 4.41Å; S469-L473 WeakPolarHBondContact O-CB 3.14Å; S469-L473 PolarHBondContact O-N 3.45Å; V470-L473 PolarHBondContact O-N 3Å; V470-L473 VanDerWaalsContact O-N 3.14Å; L473-L476 WeakPolarHBondContact O-CA 3.4Å; L473-L476 WeakPolarHBondContact O-CB 3.28Å; L473-L476 PolarHBondContact O-N 3.32Å; L473-V477 HydrophobicContact CG-CG2 4.38Å; L473-V477 PolarHBondContact O-N 2.91Å; L473-V477 VanDerWaalsContact O-N 3.12Å; L473-F500 HydrophobicContact CD1-CD1 4.11Å; L473-F500 HydrophobicContact CD1-CE1 4.43Å; L473-T503 HydrophobicContact CD1-CG2 4.19Å; L473-T503 HydrophobicContact CD2-CG2 4.08Å; L473-W504 HydrophobicContact CB-CE3 4.14Å; L473-W504 HydrophobicContact CB-CZ3 4.28Å; L473-W504 HydrophobicContact CD2-CB 4.17Å; L473-W504 HydrophobicContact CD2-CE3 3.83Å; L473-W504 HydrophobicContact CG-CE3 3.85Å; L473-W504 HydrophobicContact CG-CZ3 4.48Å; L473-A507 HydrophobicContact CD2-CB 4.22Å
474	A	97.5	Very high	96.1	Very high	11 Å²	11	19.2 Å²	19.2	9%	0.091	10%	0.095	C	C	.	.	H	α-helix	trans	-56.4	-47.1	-176.7	0	0	0	0	0	112.8	F436 A440 V470 L476 V477 I478 W504	F436-A474 HydrophobicContact CE1-CB 4.26Å; F436-A474 HydrophobicContact CZ-CB 4.49Å; A440-A474 HydrophobicContact CB-CB 3.73Å; V470-A474 WeakPolarHBondContact O-CB 3.36Å; V470-A474 PolarHBondContact O-N 3.2Å; A474-L476 PolarHBondContact O-N 2.97Å; A474-V477 PolarHBondContact O-N 3.26Å; A474-I478 WeakPolarHBondContact O-CG1 3.47Å; A474-I478 PolarHBondContact O-N 3.07Å; A474-I478 VanDerWaalsContact O-N 3.17Å; A474-W504 HydrophobicContact CB-CH2 3.76Å; A474-W504 HydrophobicContact CB-CZ3 3.55Å
475	P	97.5	Very high	96.2	Very high	66 Å²	66	20.7 Å²	20.7	43%	0.429	11%	0.105	S	C	.	.	H	α-helix	trans	-60.6	-30.4	175.9	-23.5	35.3	0	0	0	113	R471 I478 L479	R471-P475 WeakPolarHBondContact O-CD 3.31Å; R471-P475 WeakPolarHBondContact O-CG 3.43Å; P475-I478 PolarHBondContact O-N 3.29Å; P475-L479 WeakPolarHBondContact O-CB 3.22Å; P475-L479 WeakPolarHBondContact O-CG 3.48Å; P475-L479 PolarHBondContact O-N 3.07Å
476	L	97.7	Very high	96.4	Very high	2 Å²	2	25 Å²	25	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-74.1	-37.5	-179.1	-58.2	177.8	0	0	0	112.7	I238 Q241 A472 L473 A474 I478 L479 A480 F500	I238-L476 HydrophobicContact CB-CD2 4.4Å; I238-L476 HydrophobicContact CG1-CD2 4.29Å; I238-L476 HydrophobicContact CG2-CD2 4.41Å; Q241-L476 HydrophobicContact CB-CD1 4.47Å; Q241-L476 HydrophobicContact CB-CD2 3.67Å; Q241-L476 HydrophobicContact CG-CD1 3.95Å; Q241-L476 HydrophobicContact CG-CD2 3.75Å; Q241-L476 HydrophobicContact CG-CG 4.19Å; A472-L476 WeakPolarHBondContact O-CG 3.45Å; L473-L476 WeakPolarHBondContact O-CA 3.4Å; L473-L476 WeakPolarHBondContact O-CB 3.28Å; L473-L476 PolarHBondContact O-N 3.32Å; A474-L476 PolarHBondContact O-N 2.97Å; L476-I478 VanDerWaalsContact C-N 3.34Å; L476-L479 PolarHBondContact O-N 3.29Å; L476-A480 VanDerWaalsContact O-CB 3.27Å; L476-A480 WeakPolarHBondContact O-CB 3.26Å; L476-A480 PolarHBondContact O-N 3.34Å; L476-F500 HydrophobicContact CB-CD1 3.82Å; L476-F500 HydrophobicContact CB-CE1 3.54Å; L476-F500 HydrophobicContact CB-CZ 4.41Å; L476-F500 HydrophobicContact CD1-CE1 3.99Å; L476-F500 HydrophobicContact CG-CE1 4.34Å
477	V	98.1	Very high	96.5	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62.6	-44.9	172	-180	0	0	0	0	109.9	F436 L473 A474 A480 G481 F500 W504	F436-V477 HydrophobicContact CD1-CB 4.41Å; F436-V477 HydrophobicContact CD1-CG1 4.14Å; F436-V477 HydrophobicContact CE1-CB 3.63Å; F436-V477 HydrophobicContact CE1-CG1 3.75Å; F436-V477 HydrophobicContact CE1-CG2 4.32Å; F436-V477 HydrophobicContact CE2-CG1 4.17Å; F436-V477 HydrophobicContact CZ-CB 3.72Å; F436-V477 HydrophobicContact CZ-CG1 3.76Å; F436-V477 HydrophobicContact CZ-CG2 3.93Å; L473-V477 HydrophobicContact CG-CG2 4.38Å; L473-V477 PolarHBondContact O-N 2.91Å; L473-V477 VanDerWaalsContact O-N 3.12Å; A474-V477 PolarHBondContact O-N 3.26Å; V477-A480 PolarHBondContact O-N 3.42Å; V477-G481 PolarHBondContact O-N 3.15Å; V477-F500 HydrophobicContact CG2-CB 4.28Å; V477-W504 HydrophobicContact CG2-CB 4.13Å; V477-W504 HydrophobicContact CG2-CE3 4.25Å
478	I	98.2	Very high	96.6	Very high	15 Å²	15	29.4 Å²	29.4	8%	0.077	15%	0.151	C	C	.	.	H	α-helix	trans	-61.1	-47.9	177.4	-64.7	164.4	0	0	0	111	V433 F436 R437 A474 P475 L476 A480 G481 R482	V433-I478 HydrophobicContact CG1-CB 4.25Å; V433-I478 HydrophobicContact CG1-CG1 4.26Å; V433-I478 HydrophobicContact CG1-CG2 3.89Å; F436-I478 HydrophobicContact CD1-CD1 4.43Å; F436-I478 HydrophobicContact CD1-CG1 3.85Å; F436-I478 HydrophobicContact CE1-CG1 4.07Å; R437-I478 HydrophobicContact CB-CD1 3.85Å; R437-I478 HydrophobicContact CG-CD1 3.9Å; A474-I478 WeakPolarHBondContact O-CG1 3.47Å; A474-I478 PolarHBondContact O-N 3.07Å; A474-I478 VanDerWaalsContact O-N 3.17Å; P475-I478 PolarHBondContact O-N 3.29Å; L476-I478 VanDerWaalsContact C-N 3.34Å; I478-A480 VanDerWaalsContact C-N 3.3Å; I478-A480 PolarHBondContact O-N 3.14Å; I478-G481 PolarHBondContact O-N 2.85Å; I478-R482 WeakPolarHBondContact O-CG 3.32Å; I478-R482 PolarHBondContact O-N 3.23Å
479	L	98.3	Very high	96.8	Very high	18 Å²	18	33.2 Å²	33.2	9%	0.094	18%	0.184	C	C	.	.	H	α-helix	trans	-64.5	-35	177.4	-72.5	171.9	0	0	0	112.1	A234 Q237 I238 P475 L476 G481 R482 T483	A234-L479 HydrophobicContact CB-CB 4.43Å; A234-L479 HydrophobicContact CB-CD2 3.93Å; Q237-L479 HydrophobicContact CB-CD1 3.93Å; I238-L479 HydrophobicContact CD1-CB 3.8Å; I238-L479 HydrophobicContact CG1-CB 3.58Å; I238-L479 HydrophobicContact CG1-CD1 4.19Å; P475-L479 WeakPolarHBondContact O-CB 3.22Å; P475-L479 WeakPolarHBondContact O-CG 3.48Å; P475-L479 PolarHBondContact O-N 3.07Å; L476-L479 PolarHBondContact O-N 3.29Å; L479-G481 VanDerWaalsContact C-N 3.34Å; L479-R482 PolarHBondContact O-N 3.48Å; L479-T483 WeakPolarHBondContact O-CB 3.37Å; L479-T483 PolarHBondContact O-N 3.4Å; L479-T483 PolarHBondContact O-OG1 3Å
480	A	98.3	Very high	97	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-66	-39.9	175.3	0	0	0	0	0	110.9	I238 L476 V477 I478 T483 Y484 L497 F500	I238-A480 HydrophobicContact CD1-CB 4.11Å; L476-A480 VanDerWaalsContact O-CB 3.27Å; L476-A480 WeakPolarHBondContact O-CB 3.26Å; L476-A480 PolarHBondContact O-N 3.34Å; V477-A480 PolarHBondContact O-N 3.42Å; I478-A480 VanDerWaalsContact C-N 3.3Å; I478-A480 PolarHBondContact O-N 3.14Å; A480-T483 PolarHBondContact O-N 3.47Å; A480-Y484 PolarHBondContact O-N 3.31Å; A480-L497 HydrophobicContact CB-CB 4.48Å; A480-L497 HydrophobicContact CB-CD1 4.18Å; A480-F500 HydrophobicContact CB-CB 4.13Å; A480-F500 HydrophobicContact CB-CD2 3.9Å; A480-F500 HydrophobicContact CB-CG 4.13Å
481	G	98.2	Very high	97.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59.4	-51.1	171.8	0	0	0	0	0	111.7	V477 I478 L479 T483 Y484 C485	V477-G481 PolarHBondContact O-N 3.15Å; I478-G481 PolarHBondContact O-N 2.85Å; L479-G481 VanDerWaalsContact C-N 3.34Å; G481-T483 VanDerWaalsContact C-N 3.32Å; G481-T483 PolarHBondContact O-N 3.41Å; G481-Y484 WeakPolarHBondContact O-CB 3.43Å; G481-Y484 PolarHBondContact O-N 2.88Å; G481-Y484 VanDerWaalsContact O-N 3.08Å; G481-C485 PolarHBondContact O-N 3.09Å; G481-C485 PolarHBondContact O-SG 2.9Å; G481-C485 VanDerWaalsContact O-SG 3.34Å
482	R	97.7	Very high	97.2	Very high	117 Å²	117	40 Å²	40	44%	0.442	21%	0.212	S	C	.	.	H	α-helix	trans	-57.9	-42.3	175.2	-70.3	176.8	-179.3	176.3	1	112.7	I478 L479 Y484 C485 L486	I478-R482 WeakPolarHBondContact O-CG 3.32Å; I478-R482 PolarHBondContact O-N 3.23Å; L479-R482 PolarHBondContact O-N 3.48Å; R482-Y484 VanDerWaalsContact C-N 3.28Å; R482-Y484 PolarHBondContact O-N 3.48Å; R482-C485 PolarHBondContact O-N 2.9Å; R482-L486 WeakPolarHBondContact O-CG 3.47Å; R482-L486 PolarHBondContact O-N 3.25Å
483	T	98.1	Very high	97.4	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.8	-39.1	177.1	-57.8	0	0	0	0	111.3	T225 A234 A235 L479 A480 G481 H487 A493	T225-T483 HydrophobicContact CG2-CG2 3.77Å; A234-T483 WeakPolarHBondContact CB-OG1 3.4Å; A235-T483 HydrophobicContact CB-CG2 4.15Å; L479-T483 WeakPolarHBondContact O-CB 3.37Å; L479-T483 PolarHBondContact O-N 3.4Å; L479-T483 PolarHBondContact O-OG1 3Å; A480-T483 PolarHBondContact O-N 3.47Å; G481-T483 VanDerWaalsContact C-N 3.32Å; G481-T483 PolarHBondContact O-N 3.41Å; T483-H487 PolarHBondContact O-N 3.2Å; T483-A493 HydrophobicContact CG2-CB 4.29Å
484	Y	98.2	Very high	97.5	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.008	22%	0.219	C	C	.	.	H	α-helix	trans	-67	-47.3	173.3	172	-92.2	0	0	0	111.8	A421 G424 V429 A480 G481 R482 L486 H487 P488 R494 L497	A421-Y484 WeakPolarHBondContact CA-OH 3.37Å; A421-Y484 HydrophobicContact CB-CD1 4.46Å; A421-Y484 HydrophobicContact CB-CE1 4.11Å; A421-Y484 HydrophobicContact CB-CE2 4.17Å; A421-Y484 PolarHBondContact O-OH 3.14Å; G424-Y484 WeakPolarHBondContact CA-OH 3.3Å; V429-Y484 HydrophobicContact CB-CD1 4.32Å; V429-Y484 HydrophobicContact CB-CE1 4.39Å; V429-Y484 HydrophobicContact CG1-CD1 4.07Å; V429-Y484 HydrophobicContact CG2-CD1 4.04Å; V429-Y484 HydrophobicContact CG2-CE1 3.79Å; A480-Y484 PolarHBondContact O-N 3.31Å; G481-Y484 WeakPolarHBondContact O-CB 3.43Å; G481-Y484 PolarHBondContact O-N 2.88Å; G481-Y484 VanDerWaalsContact O-N 3.08Å; R482-Y484 VanDerWaalsContact C-N 3.28Å; R482-Y484 PolarHBondContact O-N 3.48Å; Y484-L486 PolarHBondContact O-N 2.8Å; Y484-H487 CarbonylContact O-C 3.45Å; Y484-H487 WeakPolarHBondContact O-CA 3.42Å; Y484-H487 PolarHBondContact O-N 3.05Å; Y484-P488 WeakPolarHBondContact O-CA 3.46Å; Y484-R494 HydrophobicContact CD2-CB 3.86Å; Y484-R494 HydrophobicContact CD2-CG 4.43Å; Y484-R494 HydrophobicContact CE2-CB 3.89Å; Y484-R494 HydrophobicContact CE2-CG 4.18Å; Y484-L497 HydrophobicContact CD1-CD2 4.41Å; Y484-L497 HydrophobicContact CG-CD2 4.16Å
485	C	97.7	Very high	97.5	Very high	30 Å²	30	44.3 Å²	44.3	20%	0.203	23%	0.225	C	C	.	.	H	α-helix	trans	-60.9	-33.2	179.8	-62.2	0	0	0	0	112.8	V426 G481 R482 H487	V426-C485 HydrophobicContact CG1-CB 3.78Å; G481-C485 PolarHBondContact O-N 3.09Å; G481-C485 PolarHBondContact O-SG 2.9Å; G481-C485 VanDerWaalsContact O-SG 3.34Å; R482-C485 PolarHBondContact O-N 2.9Å; C485-H487 VanDerWaalsContact C-N 3.33Å
486	L	97.2	Very high	97.5	Very high	112 Å²	112	41.2 Å²	41.2	59%	0.586	21%	0.205	S	C	*	.	H	α-helix	trans	-72.1	-25	172.9	-69.1	172.7	0	0	0	113.3	R482 Y484	R482-L486 WeakPolarHBondContact O-CG 3.47Å; R482-L486 PolarHBondContact O-N 3.25Å; Y484-L486 PolarHBondContact O-N 2.8Å
487	H	97.1	Very high	97.5	Very high	54 Å²	54	41.1 Å²	41.1	25%	0.25	21%	0.205	C	C	.	.			trans	-137.9	60.4	-175	-56.3	-56.4	0	0	0	112.4	H229 T483 Y484 C485 S489 S490 A493	H229-H487 AromaticContact CD2-CD2 3.73Å; H229-H487 AromaticContact CE1-CD2 3.95Å; H229-H487 AromaticContact CE1-CG 3.69Å; H229-H487 AromaticContact CG-CD2 3.71Å; H229-H487 AromaticContact CG-NE2 3.88Å; H229-H487 AromaticContact ND1-CD2 3.9Å; H229-H487 AromaticContact ND1-CG 3.96Å; H229-H487 AromaticContact NE2-CD2 3.87Å; H229-H487 AromaticContact NE2-CG 3.86Å; T483-H487 PolarHBondContact O-N 3.2Å; Y484-H487 CarbonylContact O-C 3.45Å; Y484-H487 WeakPolarHBondContact O-CA 3.42Å; Y484-H487 PolarHBondContact O-N 3.05Å; C485-H487 VanDerWaalsContact C-N 3.33Å; H487-S489 VanDerWaalsContact C-N 3.26Å; H487-S489 PolarHBondContact O-N 2.87Å; H487-S490 WeakPolarHBondContact O-CB 3.32Å; H487-S490 PolarHBondContact O-N 3.41Å; H487-A493 HydrophobicContact CB-CB 4.46Å
488	P	96.2	Very high	97.5	Very high	58 Å²	58	43.1 Å²	43.1	38%	0.377	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-25.9	-168.5	24.7	-34.9	0	0	0	113.7	V426 Y484 S490	V426-P488 HydrophobicContact CG2-CB 3.55Å; V426-P488 HydrophobicContact CG2-CG 4.07Å; Y484-P488 WeakPolarHBondContact O-CA 3.46Å; P488-S490 VanDerWaalsContact C-N 3.26Å; P488-S490 PolarHBondContact O-N 3.46Å
489	S	95.9	Very high	97.4	Very high	122 Å²	122	44.2 Å²	44.2	85%	0.853	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-9.6	174	60.5	0	0	0	0	113.7	H487 R491	H487-S489 VanDerWaalsContact C-N 3.26Å; H487-S489 PolarHBondContact O-N 2.87Å; S489-R491 PolarHBondContact O-N 3.09Å
490	S	97.3	Very high	97.4	Very high	14 Å²	14	43.3 Å²	43.3	10%	0.098	22%	0.216	C	C	.	.			trans	-83.4	107	-176.9	-173.2	0	0	0	0	111.6	H229 H487 P488 I492 A493 R494	H229-S490 WeakPolarHBondContact NE2-CB 3.41Å; H229-S490 PolarHBondContact NE2-OG 3.42Å; H487-S490 WeakPolarHBondContact O-CB 3.32Å; H487-S490 PolarHBondContact O-N 3.41Å; P488-S490 VanDerWaalsContact C-N 3.26Å; P488-S490 PolarHBondContact O-N 3.46Å; S490-I492 PolarHBondContact O-N 2.9Å; S490-I492 PolarHBondContact OG-N 3.44Å; S490-A493 PolarHBondContact O-N 3.4Å; S490-A493 VanDerWaalsContact O-N 3.13Å; S490-A493 PolarHBondContact OG-N 3.5Å; S490-R494 PolarHBondContact O-N 2.7Å
491	R	96.8	Very high	97.4	Very high	170 Å²	170	43.3 Å²	43.3	64%	0.642	22%	0.216	S	C	*	.	H	α-helix	trans	-54	-35.1	169.7	-179.4	176.9	168.7	170.8	2.5	112.5	S489 R494 E495	S489-R491 PolarHBondContact O-N 3.09Å; R491-R494 PolarHBondContact O-N 2.98Å; R491-E495 HydrophobicContact CG-CG 4.34Å; R491-E495 WeakPolarHBondContact CG-OE1 3.33Å; R491-E495 IonicContact CZ-OE1 3.52Å; R491-E495 IonicContact NE-OE1 2.78Å; R491-E495 PolarHBondContact NE-OE1 3.19Å; R491-E495 IonicContact NH2-OE1 3.44Å; R491-E495 PolarHBondContact NH2-OE1 3.02Å; R491-E495 WeakPolarHBondContact O-CB 3.24Å; R491-E495 VanDerWaalsContact O-CG 3.28Å; R491-E495 WeakPolarHBondContact O-CG 3.41Å; R491-E495 PolarHBondContact O-N 3.47Å
492	I	96.7	Very high	97.3	Very high	35 Å²	35	48.1 Å²	48.1	18%	0.179	24%	0.239	C	C	.	.	H	α-helix	trans	-67.9	-43.1	179.3	-63.2	176.1	0	0	0	110.9	K224 R228 S490 R494 E495 N496	K224-I492 HydrophobicContact CD-CG2 4.17Å; K224-I492 HydrophobicContact CG-CD1 4.34Å; K224-I492 HydrophobicContact CG-CG2 3.98Å; R228-I492 HydrophobicContact CB-CD1 4.09Å; R228-I492 HydrophobicContact CG-CD1 3.92Å; S490-I492 PolarHBondContact O-N 2.9Å; S490-I492 PolarHBondContact OG-N 3.44Å; I492-R494 VanDerWaalsContact C-N 3.33Å; I492-R494 PolarHBondContact O-N 3.07Å; I492-E495 PolarHBondContact O-N 2.51Å; I492-N496 WeakPolarHBondContact O-CB 3.44Å; I492-N496 PolarHBondContact O-N 2.89Å
493	A	97.5	Very high	97.3	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.4	-39.4	176.4	0	0	0	0	0	111.6	T483 H487 S490 N496 L497	T483-A493 HydrophobicContact CG2-CB 4.29Å; H487-A493 HydrophobicContact CB-CB 4.46Å; S490-A493 PolarHBondContact O-N 3.4Å; S490-A493 VanDerWaalsContact O-N 3.13Å; S490-A493 PolarHBondContact OG-N 3.5Å; A493-N496 WeakPolarHBondContact O-CB 3.3Å; A493-N496 PolarHBondContact O-N 2.98Å; A493-L497 PolarHBondContact O-N 3.34Å
494	R	97.8	Very high	97.2	Very high	67 Å²	67	43 Å²	43	25%	0.253	22%	0.22	S	C	.	.	H	α-helix	trans	-65	-46.5	174.8	-175.5	167.8	57.8	82.6	-5.3	112.9	A421 Y484 S490 R491 I492 N496 L497 Q498	A421-R494 HydrophobicContact CB-CG 4.34Å; A421-R494 WeakPolarHBondContact O-CD 3.46Å; Y484-R494 HydrophobicContact CD2-CB 3.86Å; Y484-R494 HydrophobicContact CD2-CG 4.43Å; Y484-R494 HydrophobicContact CE2-CB 3.89Å; Y484-R494 HydrophobicContact CE2-CG 4.18Å; S490-R494 PolarHBondContact O-N 2.7Å; R491-R494 PolarHBondContact O-N 2.98Å; I492-R494 VanDerWaalsContact C-N 3.33Å; I492-R494 PolarHBondContact O-N 3.07Å; R494-N496 VanDerWaalsContact C-N 3.26Å; R494-N496 PolarHBondContact O-N 3.24Å; R494-L497 PolarHBondContact O-N 2.87Å; R494-Q498 WeakPolarHBondContact O-CG 3.48Å; R494-Q498 PolarHBondContact O-N 3.48Å
495	E	97.3	Very high	97.1	Very high	49 Å²	49	44.2 Å²	44.2	23%	0.229	23%	0.229	C	C	.	.	H	α-helix	trans	-56.7	-42.7	173.6	-77.8	170.8	-174.8	0	0	110.7	K224 R491 I492 Q498 V499	K224-E495 IonicContact NZ-OE2 3.01Å; K224-E495 PolarHBondContact NZ-OE2 3.17Å; R491-E495 HydrophobicContact CG-CG 4.34Å; R491-E495 WeakPolarHBondContact CG-OE1 3.33Å; R491-E495 IonicContact CZ-OE1 3.52Å; R491-E495 IonicContact NE-OE1 2.78Å; R491-E495 PolarHBondContact NE-OE1 3.19Å; R491-E495 IonicContact NH2-OE1 3.44Å; R491-E495 PolarHBondContact NH2-OE1 3.02Å; R491-E495 WeakPolarHBondContact O-CB 3.24Å; R491-E495 VanDerWaalsContact O-CG 3.28Å; R491-E495 WeakPolarHBondContact O-CG 3.41Å; R491-E495 PolarHBondContact O-N 3.47Å; I492-E495 PolarHBondContact O-N 2.51Å; E495-Q498 PolarHBondContact O-N 3.17Å; E495-V499 WeakPolarHBondContact O-CG2 3.16Å; E495-V499 PolarHBondContact O-N 2.73Å; E495-V499 VanDerWaalsContact O-N 3.07Å
496	N	97.4	Very high	97	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-61.3	-50.7	177.3	-168.7	69	0	0	0	111.7	T221 S222 T225 I492 A493 R494 Q498 V499 F500	T221-N496 VanDerWaalsContact C-OD1 3.23Å; T221-N496 WeakPolarHBondContact CB-OD1 3.37Å; T221-N496 PolarHBondContact O-OD1 3.45Å; T221-N496 PolarHBondContact OG1-OD1 3.49Å; S222-N496 PolarHBondContact N-OD1 2.99Å; T225-N496 WeakPolarHBondContact OG1-CB 3.46Å; I492-N496 WeakPolarHBondContact O-CB 3.44Å; I492-N496 PolarHBondContact O-N 2.89Å; A493-N496 WeakPolarHBondContact O-CB 3.3Å; A493-N496 PolarHBondContact O-N 2.98Å; R494-N496 VanDerWaalsContact C-N 3.26Å; R494-N496 PolarHBondContact O-N 3.24Å; N496-Q498 VanDerWaalsContact C-N 3.33Å; N496-Q498 PolarHBondContact O-N 3.44Å; N496-V499 PolarHBondContact O-N 2.98Å; N496-F500 VanDerWaalsContact O-CD2 3.27Å; N496-F500 WeakPolarHBondContact O-CD2 3.24Å; N496-F500 PolarHBondContact O-N 3.35Å; N496-F500 WeakPolarHBondContact OD1-CE2 3.47Å
497	L	98.1	Very high	96.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-55.1	-46.8	175.8	174.8	57	0	0	0	112.1	I417 A421 V429 A480 Y484 A493 R494 V499 F500 C501	I417-L497 HydrophobicContact CG2-CD1 4.02Å; I417-L497 HydrophobicContact CG2-CD2 3.92Å; I417-L497 HydrophobicContact CG2-CG 4.19Å; A421-L497 HydrophobicContact CB-CD2 3.9Å; V429-L497 HydrophobicContact CG1-CD2 4.19Å; A480-L497 HydrophobicContact CB-CB 4.48Å; A480-L497 HydrophobicContact CB-CD1 4.18Å; Y484-L497 HydrophobicContact CD1-CD2 4.41Å; Y484-L497 HydrophobicContact CG-CD2 4.16Å; A493-L497 PolarHBondContact O-N 3.34Å; R494-L497 PolarHBondContact O-N 2.87Å; L497-V499 PolarHBondContact O-N 3.08Å; L497-F500 PolarHBondContact O-N 2.78Å; L497-C501 PolarHBondContact O-N 3.03Å; L497-C501 PolarHBondContact O-SG 3.17Å; L497-C501 VanDerWaalsContact O-SG 3.36Å
498	Q	97.2	Very high	96.7	Very high	42 Å²	42	40.3 Å²	40.3	20%	0.196	21%	0.21	C	C	.	.	H	α-helix	trans	-58.6	-46.6	179.2	-72.7	177.2	-21.5	0	0	112.2	K418 R494 E495 N496 F500 C501 E502	K418-Q498 HydrophobicContact CG-CG 4.39Å; R494-Q498 WeakPolarHBondContact O-CG 3.48Å; R494-Q498 PolarHBondContact O-N 3.48Å; E495-Q498 PolarHBondContact O-N 3.17Å; N496-Q498 VanDerWaalsContact C-N 3.33Å; N496-Q498 PolarHBondContact O-N 3.44Å; Q498-F500 VanDerWaalsContact C-N 3.34Å; Q498-F500 PolarHBondContact O-N 3.24Å; Q498-C501 PolarHBondContact O-N 3.33Å; Q498-E502 WeakPolarHBondContact O-CG 3.47Å; Q498-E502 PolarHBondContact O-N 3.03Å
499	V	97.4	Very high	96.5	Very high	37 Å²	37	42.7 Å²	42.7	22%	0.224	22%	0.219	C	C	.	.	H	α-helix	trans	-64.8	-37	179.3	169.3	0	0	0	0	112.1	L218 T221 E495 N496 L497 E502 T503	L218-V499 HydrophobicContact CD2-CG1 3.79Å; T221-V499 HydrophobicContact CG2-CB 4.27Å; T221-V499 HydrophobicContact CG2-CG1 4.25Å; T221-V499 HydrophobicContact CG2-CG2 4.03Å; E495-V499 WeakPolarHBondContact O-CG2 3.16Å; E495-V499 PolarHBondContact O-N 2.73Å; E495-V499 VanDerWaalsContact O-N 3.07Å; N496-V499 PolarHBondContact O-N 2.98Å; L497-V499 PolarHBondContact O-N 3.08Å; V499-E502 PolarHBondContact O-N 3.49Å; V499-T503 WeakPolarHBondContact O-CB 3.42Å; V499-T503 PolarHBondContact O-N 2.98Å; V499-T503 PolarHBondContact O-OG1 3.42Å
500	F	97.9	Very high	96.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-67.7	-41	174.2	-86.4	-78.6	0	0	0	112.2	L218 I238 V242 L473 L476 V477 A480 N496 L497 Q498 T503 W504	L218-F500 HydrophobicContact CB-CZ 4.26Å; L218-F500 HydrophobicContact CD1-CD1 4.27Å; L218-F500 HydrophobicContact CD1-CE1 3.63Å; L218-F500 HydrophobicContact CD1-CZ 4.12Å; L218-F500 HydrophobicContact CD2-CD1 4.07Å; L218-F500 HydrophobicContact CD2-CD2 4.49Å; L218-F500 HydrophobicContact CD2-CE1 3.88Å; L218-F500 HydrophobicContact CD2-CE2 4.29Å; L218-F500 HydrophobicContact CD2-CG 4.36Å; L218-F500 HydrophobicContact CD2-CZ 3.98Å; L218-F500 HydrophobicContact CG-CE1 4.24Å; L218-F500 HydrophobicContact CG-CZ 4.36Å; I238-F500 HydrophobicContact CG2-CE1 4.25Å; I238-F500 HydrophobicContact CG2-CE2 3.61Å; I238-F500 HydrophobicContact CG2-CZ 3.31Å; V242-F500 HydrophobicContact CG2-CZ 4.22Å; L473-F500 HydrophobicContact CD1-CD1 4.11Å; L473-F500 HydrophobicContact CD1-CE1 4.43Å; L476-F500 HydrophobicContact CB-CD1 3.82Å; L476-F500 HydrophobicContact CB-CE1 3.54Å; L476-F500 HydrophobicContact CB-CZ 4.41Å; L476-F500 HydrophobicContact CD1-CE1 3.99Å; L476-F500 HydrophobicContact CG-CE1 4.34Å; V477-F500 HydrophobicContact CG2-CB 4.28Å; A480-F500 HydrophobicContact CB-CB 4.13Å; A480-F500 HydrophobicContact CB-CD2 3.9Å; A480-F500 HydrophobicContact CB-CG 4.13Å; N496-F500 VanDerWaalsContact O-CD2 3.27Å; N496-F500 WeakPolarHBondContact O-CD2 3.24Å; N496-F500 PolarHBondContact O-N 3.35Å; N496-F500 WeakPolarHBondContact OD1-CE2 3.47Å; L497-F500 PolarHBondContact O-N 2.78Å; Q498-F500 VanDerWaalsContact C-N 3.34Å; Q498-F500 PolarHBondContact O-N 3.24Å; F500-T503 PolarHBondContact O-N 3.02Å; F500-W504 PolarHBondContact O-N 3.4Å
501	C	97.7	Very high	96.3	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-62.1	-43.5	173.4	-68.2	0	0	0	0	112.1	L414 K418 L497 Q498 T503 W504 S505	L414-C501 HydrophobicContact CD2-CB 4.04Å; K418-C501 HydrophobicContact CD-CB 4.18Å; K418-C501 HydrophobicContact CG-CB 4.22Å; L497-C501 PolarHBondContact O-N 3.03Å; L497-C501 PolarHBondContact O-SG 3.17Å; L497-C501 VanDerWaalsContact O-SG 3.36Å; Q498-C501 PolarHBondContact O-N 3.33Å; C501-T503 VanDerWaalsContact C-N 3.34Å; C501-W504 WeakPolarHBondContact O-CB 3.44Å; C501-W504 PolarHBondContact O-N 2.99Å; C501-S505 PolarHBondContact O-N 3.05Å; C501-S505 PolarHBondContact O-OG 2.73Å
502	E	96.9	Very high	96.2	Very high	101 Å²	101	34.5 Å²	34.5	47%	0.472	18%	0.179	S	C	.	.	H	α-helix	trans	-62.9	-41.6	176.2	-73.2	168.3	-171.5	0	0	111.9	Q498 V499 W504 S505 L506	Q498-E502 WeakPolarHBondContact O-CG 3.47Å; Q498-E502 PolarHBondContact O-N 3.03Å; V499-E502 PolarHBondContact O-N 3.49Å; E502-W504 VanDerWaalsContact C-N 3.29Å; E502-W504 PolarHBondContact O-N 3.29Å; E502-S505 PolarHBondContact O-N 3.4Å; E502-L506 WeakPolarHBondContact O-CG 3.43Å; E502-L506 PolarHBondContact O-N 3.12Å
503	T	96.6	Very high	96.1	Very high	7 Å²	7	38.2 Å²	38.2	4%	0.043	19%	0.191	C	C	.	.	H	α-helix	trans	-64.1	-37	177.1	-58	0	0	0	0	111.8	R214 L218 L473 V499 F500 C501 A507	R214-T503 HydrophobicContact CG-CG2 3.54Å; L218-T503 HydrophobicContact CD1-CG2 4.22Å; L218-T503 HydrophobicContact CD2-CG2 4.35Å; L218-T503 WeakPolarHBondContact CD2-OG1 3.28Å; L218-T503 HydrophobicContact CG-CG2 4.5Å; L473-T503 HydrophobicContact CD1-CG2 4.19Å; L473-T503 HydrophobicContact CD2-CG2 4.08Å; V499-T503 WeakPolarHBondContact O-CB 3.42Å; V499-T503 PolarHBondContact O-N 2.98Å; V499-T503 PolarHBondContact O-OG1 3.42Å; F500-T503 PolarHBondContact O-N 3.02Å; C501-T503 VanDerWaalsContact C-N 3.34Å; T503-A507 PolarHBondContact O-N 2.83Å; T503-A507 VanDerWaalsContact O-N 3.13Å
504	W	97	Very high	96	Very high	1 Å²	1	38.7 Å²	38.7	0%	0.004	19%	0.194	C	C	.	.	H	α-helix	trans	-62.6	-51.8	172	-179.2	-81	0	0	0	111.5	L414 F436 A440 M443 V470 L473 A474 V477 F500 C501 E502 L506 A507 I508	L414-W504 HydrophobicContact CD1-CG 4.2Å; F436-W504 AromaticContact CE2-CD2 3.63Å; F436-W504 HydrophobicContact CE2-CD2 3.63Å; F436-W504 AromaticContact CE2-CE2 3.41Å; F436-W504 VanDerWaalsContact CE2-CE2 3.41Å; F436-W504 HydrophobicContact CE2-CE3 4.22Å; F436-W504 AromaticContact CE2-CG 3.97Å; F436-W504 HydrophobicContact CE2-CG 3.97Å; F436-W504 HydrophobicContact CE2-CH2 4.31Å; F436-W504 AromaticContact CE2-CZ2 3.75Å; F436-W504 HydrophobicContact CE2-CZ2 3.75Å; F436-W504 AromaticContact CE2-NE1 3.69Å; F436-W504 AromaticContact CZ-CD2 3.57Å; F436-W504 HydrophobicContact CZ-CD2 3.57Å; F436-W504 AromaticContact CZ-CE2 3.66Å; F436-W504 AromaticContact CZ-CE3 3.66Å; F436-W504 HydrophobicContact CZ-CE3 3.66Å; F436-W504 HydrophobicContact CZ-CG 4.22Å; F436-W504 AromaticContact CZ-CH2 3.84Å; F436-W504 HydrophobicContact CZ-CH2 3.84Å; F436-W504 AromaticContact CZ-CZ2 3.75Å; F436-W504 HydrophobicContact CZ-CZ2 3.75Å; F436-W504 AromaticContact CZ-CZ3 3.84Å; F436-W504 HydrophobicContact CZ-CZ3 3.84Å; A440-W504 HydrophobicContact CB-CH2 3.57Å; A440-W504 HydrophobicContact CB-CZ2 3.87Å; M443-W504 HydrophobicContact CE-CZ2 3.42Å; M443-W504 VanDerWaalsContact CE-CZ2 3.42Å; M443-W504 HydrophobicContact SD-CH2 4.48Å; M443-W504 HydrophobicContact SD-CZ2 3.52Å; M443-W504 VanDerWaalsContact SD-CZ2 3.52Å; V470-W504 HydrophobicContact CG1-CH2 3.74Å; V470-W504 HydrophobicContact CG1-CZ3 4.2Å; L473-W504 HydrophobicContact CB-CE3 4.14Å; L473-W504 HydrophobicContact CB-CZ3 4.28Å; L473-W504 HydrophobicContact CD2-CB 4.17Å; L473-W504 HydrophobicContact CD2-CE3 3.83Å; L473-W504 HydrophobicContact CG-CE3 3.85Å; L473-W504 HydrophobicContact CG-CZ3 4.48Å; A474-W504 HydrophobicContact CB-CH2 3.76Å; A474-W504 HydrophobicContact CB-CZ3 3.55Å; V477-W504 HydrophobicContact CG2-CB 4.13Å; V477-W504 HydrophobicContact CG2-CE3 4.25Å; F500-W504 PolarHBondContact O-N 3.4Å; C501-W504 WeakPolarHBondContact O-CB 3.44Å; C501-W504 PolarHBondContact O-N 2.99Å; E502-W504 VanDerWaalsContact C-N 3.29Å; E502-W504 PolarHBondContact O-N 3.29Å; W504-L506 PolarHBondContact O-N 3.43Å; W504-A507 WeakPolarHBondContact O-CA 3.43Å; W504-A507 WeakPolarHBondContact O-CB 3.48Å; W504-A507 PolarHBondContact O-N 2.92Å; W504-I508 HydrophobicContact CG-CG1 4.46Å; W504-I508 HydrophobicContact CZ2-CD1 4.12Å; W504-I508 WeakPolarHBondContact O-CG1 2.93Å; W504-I508 PolarHBondContact O-N 3Å
505	S	95.6	Very high	95.9	Very high	29 Å²	29	36 Å²	36	20%	0.203	19%	0.186	C	C	.	.	H	α-helix	trans	-55.4	-38.9	177.8	-59.8	0	0	0	0	112.5	L414 C501 E502 I508 N509	L414-S505 WeakPolarHBondContact CD1-OG 3.45Å; C501-S505 PolarHBondContact O-N 3.05Å; C501-S505 PolarHBondContact O-OG 2.73Å; E502-S505 PolarHBondContact O-N 3.4Å; S505-I508 PolarHBondContact O-N 3.07Å; S505-N509 PolarHBondContact O-N 3.33Å; S505-N509 PolarHBondContact O-ND2 3Å
506	L	94.5	Very high	95.8	Very high	100 Å²	100	40.1 Å²	40.1	52%	0.524	20%	0.203	S	C	.	.	H	α-helix	trans	-63.7	-39.7	174	-69.8	173.8	0	0	0	112.6	E502 W504 E510	E502-L506 WeakPolarHBondContact O-CG 3.43Å; E502-L506 PolarHBondContact O-N 3.12Å; W504-L506 PolarHBondContact O-N 3.43Å; L506-E510 PolarHBondContact O-N 2.67Å; L506-E510 VanDerWaalsContact O-N 3.15Å
507	A	94.2	Very high	95.6	Very high	9 Å²	9	42.6 Å²	42.6	7%	0.074	21%	0.214	C	C	.	.	H	α-helix	trans	-65	-38.8	176.3	0	0	0	0	0	112.1	L473 T503 W504 E510 L511	L473-A507 HydrophobicContact CD2-CB 4.22Å; T503-A507 PolarHBondContact O-N 2.83Å; T503-A507 VanDerWaalsContact O-N 3.13Å; W504-A507 WeakPolarHBondContact O-CA 3.43Å; W504-A507 WeakPolarHBondContact O-CB 3.48Å; W504-A507 PolarHBondContact O-N 2.92Å; A507-E510 PolarHBondContact O-N 2.7Å; A507-L511 PolarHBondContact O-N 3.26Å
508	I	94.4	Very high	95.5	Very high	5 Å²	5	42.6 Å²	42.6	3%	0.026	21%	0.214	C	C	.	.	H	α-helix	trans	-69.4	-40.2	178.4	-57.7	-41.6	0	0	0	111.7	F405 M443 W504 S505 E510 L511 A512	F405-I508 HydrophobicContact CD1-CG2 4.49Å; F405-I508 HydrophobicContact CE1-CG2 3.85Å; M443-I508 HydrophobicContact CE-CD1 4.41Å; M443-I508 HydrophobicContact SD-CD1 3.27Å; M443-I508 WeakPolarHBondContact SD-CD1 3.3Å; M443-I508 HydrophobicContact SD-CG1 3.95Å; W504-I508 HydrophobicContact CG-CG1 4.46Å; W504-I508 HydrophobicContact CZ2-CD1 4.12Å; W504-I508 WeakPolarHBondContact O-CG1 2.93Å; W504-I508 PolarHBondContact O-N 3Å; S505-I508 PolarHBondContact O-N 3.07Å; I508-E510 VanDerWaalsContact C-N 3.31Å; I508-E510 PolarHBondContact O-N 2.98Å; I508-L511 WeakPolarHBondContact O-CB 3.26Å; I508-L511 PolarHBondContact O-N 3.32Å; I508-L511 VanDerWaalsContact O-N 3.13Å; I508-A512 PolarHBondContact O-N 3.45Å
509	N	93.2	Very high	95.3	Very high	108 Å²	108	43.2 Å²	43.2	58%	0.578	22%	0.219	S	C	*	.	H	α-helix	trans	-60.3	-40.1	173.4	-75	-42.9	0	0	0	112.5	S505 A512 R513	S505-N509 PolarHBondContact O-N 3.33Å; S505-N509 PolarHBondContact O-ND2 3Å; N509-A512 PolarHBondContact O-N 2.78Å; N509-R513 PolarHBondContact O-N 2.92Å; N509-R513 VanDerWaalsContact O-N 3.15Å
510	E	93.1	Very high	95	Very high	95 Å²	95	42.8 Å²	42.8	44%	0.444	22%	0.216	S	C	.	.	H	α-helix	trans	-67.2	-38.3	173.9	-74.3	-63.2	161.9	0	0	112.3	L506 A507 I508 R513 L514	L506-E510 PolarHBondContact O-N 2.67Å; L506-E510 VanDerWaalsContact O-N 3.15Å; A507-E510 PolarHBondContact O-N 2.7Å; I508-E510 VanDerWaalsContact C-N 3.31Å; I508-E510 PolarHBondContact O-N 2.98Å; E510-R513 PolarHBondContact O-N 3.4Å; E510-R513 IonicContact OE2-CZ 3.03Å; E510-R513 VanDerWaalsContact OE2-CZ 3.29Å; E510-R513 IonicContact OE2-NE 2.75Å; E510-R513 PolarHBondContact OE2-NE 2.92Å; E510-R513 IonicContact OE2-NH2 3.6Å; E510-R513 PolarHBondContact OE2-NH2 2.91Å; E510-L514 WeakPolarHBondContact O-CB 3.38Å; E510-L514 PolarHBondContact O-N 3.41Å
511	L	94.7	Very high	94.7	Very high	3 Å²	3	44 Å²	44	2%	0.016	23%	0.226	C	C	.	.	H	α-helix	trans	-63.4	-41.9	174.4	-176	68.8	0	0	0	111.6	M404 F405 C447 L450 A466 A507 I508 R513 L514 A515	M404-L511 HydrophobicContact CE-CD2 4.28Å; F405-L511 HydrophobicContact CE1-CD2 4.5Å; F405-L511 HydrophobicContact CZ-CB 4.08Å; F405-L511 HydrophobicContact CZ-CD2 3.82Å; F405-L511 HydrophobicContact CZ-CG 3.73Å; C447-L511 HydrophobicContact CB-CD1 4.48Å; C447-L511 WeakPolarHBondContact SG-CD1 3.13Å; C447-L511 WeakPolarHBondContact SG-CD2 3.47Å; L450-L511 HydrophobicContact CD1-CD1 4.14Å; A466-L511 HydrophobicContact CB-CD1 3.79Å; A507-L511 PolarHBondContact O-N 3.26Å; I508-L511 WeakPolarHBondContact O-CB 3.26Å; I508-L511 PolarHBondContact O-N 3.32Å; I508-L511 VanDerWaalsContact O-N 3.13Å; L511-R513 VanDerWaalsContact C-N 3.35Å; L511-R513 PolarHBondContact O-N 3.3Å; L511-L514 CarbonylContact O-C 3.5Å; L511-L514 WeakPolarHBondContact O-CB 3.32Å; L511-L514 PolarHBondContact O-N 3.16Å; L511-L514 VanDerWaalsContact O-N 3.13Å; L511-A515 WeakPolarHBondContact O-CB 3.45Å; L511-A515 PolarHBondContact O-N 3.44Å
512	A	95.1	Very high	94.3	Very high	36 Å²	36	45.2 Å²	45.2	30%	0.298	23%	0.234	S	C	.	.	H	α-helix	trans	-60.7	-44.2	176.7	0	0	0	0	0	111.7	F405 I508 N509 L514 A515 K516	F405-A512 HydrophobicContact CD1-CB 3.9Å; F405-A512 HydrophobicContact CD2-CB 4.46Å; F405-A512 HydrophobicContact CE1-CB 3.59Å; F405-A512 HydrophobicContact CE2-CB 4.23Å; F405-A512 HydrophobicContact CG-CB 4.34Å; F405-A512 HydrophobicContact CZ-CB 3.78Å; F405-A512 VanDerWaalsContact CZ-N 3.33Å; I508-A512 PolarHBondContact O-N 3.45Å; N509-A512 PolarHBondContact O-N 2.78Å; A512-L514 VanDerWaalsContact C-N 3.33Å; A512-L514 PolarHBondContact O-N 3.18Å; A512-A515 PolarHBondContact O-N 3.17Å; A512-K516 PolarHBondContact O-N 3.34Å; A512-K516 VanDerWaalsContact O-N 3.14Å
513	R	94.9	Very high	93.6	Very high	112 Å²	112	45.4 Å²	45.4	42%	0.423	24%	0.235	S	C	.	.	H	α-helix	trans	-61.9	-42.1	173.5	-174.5	-178.5	67.5	95.3	-5.9	111.4	N509 E510 L511 K516 E517	N509-R513 PolarHBondContact O-N 2.92Å; N509-R513 VanDerWaalsContact O-N 3.15Å; E510-R513 PolarHBondContact O-N 3.4Å; E510-R513 IonicContact OE2-CZ 3.03Å; E510-R513 VanDerWaalsContact OE2-CZ 3.29Å; E510-R513 IonicContact OE2-NE 2.75Å; E510-R513 PolarHBondContact OE2-NE 2.92Å; E510-R513 IonicContact OE2-NH2 3.6Å; E510-R513 PolarHBondContact OE2-NH2 2.91Å; L511-R513 VanDerWaalsContact C-N 3.35Å; L511-R513 PolarHBondContact O-N 3.3Å; R513-K516 PolarHBondContact O-N 3.21Å; R513-E517 IonicContact CZ-OE1 3.96Å; R513-E517 IonicContact NH1-OE1 2.97Å; R513-E517 PolarHBondContact NH1-OE1 2.96Å; R513-E517 WeakPolarHBondContact O-CG 3.36Å; R513-E517 PolarHBondContact O-N 3.2Å
514	L	95.1	Very high	92.1	Very high	11 Å²	11	46.8 Å²	46.8	6%	0.058	25%	0.251	C	S	.	.	H	α-helix	trans	-66.4	-42.5	179.5	-176.7	60.1	0	0	0	112.2	L459 R462 T463 A466 E510 L511 A512 K516 E517 V518	L459-L514 HydrophobicContact CD2-CD1 3.94Å; R462-L514 HydrophobicContact CB-CD1 3.92Å; R462-L514 HydrophobicContact CB-CD2 4.18Å; R462-L514 WeakPolarHBondContact O-CD2 3.43Å; T463-L514 HydrophobicContact CG2-CD1 4.21Å; T463-L514 HydrophobicContact CG2-CD2 3.7Å; T463-L514 HydrophobicContact CG2-CG 3.87Å; A466-L514 HydrophobicContact CB-CD2 3.9Å; E510-L514 WeakPolarHBondContact O-CB 3.38Å; E510-L514 PolarHBondContact O-N 3.41Å; L511-L514 CarbonylContact O-C 3.5Å; L511-L514 WeakPolarHBondContact O-CB 3.32Å; L511-L514 PolarHBondContact O-N 3.16Å; L511-L514 VanDerWaalsContact O-N 3.13Å; A512-L514 VanDerWaalsContact C-N 3.33Å; A512-L514 PolarHBondContact O-N 3.18Å; L514-K516 VanDerWaalsContact C-N 3.29Å; L514-K516 PolarHBondContact O-N 2.92Å; L514-E517 WeakPolarHBondContact O-CB 3.47Å; L514-E517 PolarHBondContact O-N 3.46Å; L514-V518 WeakPolarHBondContact O-CG2 3.48Å; L514-V518 PolarHBondContact O-N 3.36Å
515	A	95.7	Very high	89.9	Confident	10 Å²	10	54.1 Å²	54.1	8%	0.083	28%	0.278	C	S	.	.	H	α-helix	trans	-58.4	-42.5	174.8	0	0	0	0	0	111.1	A401 F405 L450 L511 A512 E517 V518 D519	A401-A515 HydrophobicContact CB-CB 4.38Å; F405-A515 HydrophobicContact CD2-CB 4.49Å; F405-A515 HydrophobicContact CE2-CB 3.8Å; L450-A515 HydrophobicContact CD1-CB 3.88Å; L450-A515 HydrophobicContact CD2-CB 4.39Å; L511-A515 WeakPolarHBondContact O-CB 3.45Å; L511-A515 PolarHBondContact O-N 3.44Å; A512-A515 PolarHBondContact O-N 3.17Å; A515-E517 VanDerWaalsContact C-N 3.34Å; A515-E517 PolarHBondContact O-N 3.06Å; A515-V518 PolarHBondContact O-N 3.2Å; A515-D519 WeakPolarHBondContact O-CB 3.47Å; A515-D519 PolarHBondContact O-N 3.27Å
516	K	94.3	Very high	87.4	Confident	136 Å²	136	60.3 Å²	60.3	59%	0.591	30%	0.304	S	S	*	.	H	α-helix	trans	-62.1	-38.3	173	-173.6	176.7	-179.8	179.6	0	112.6	A512 R513 L514 D519 V520	A512-K516 PolarHBondContact O-N 3.34Å; A512-K516 VanDerWaalsContact O-N 3.14Å; R513-K516 PolarHBondContact O-N 3.21Å; L514-K516 VanDerWaalsContact C-N 3.29Å; L514-K516 PolarHBondContact O-N 2.92Å; K516-D519 PolarHBondContact O-N 3Å; K516-V520 HydrophobicContact CG-CG2 4.47Å; K516-V520 VanDerWaalsContact O-CB 3.26Å; K516-V520 WeakPolarHBondContact O-CB 3.41Å; K516-V520 WeakPolarHBondContact O-CG2 3.41Å; K516-V520 PolarHBondContact O-N 3.14Å
517	E	94.3	Very high	84.9	Confident	53 Å²	53	60.1 Å²	60.1	25%	0.248	31%	0.307	C	S	.	.	H	α-helix	trans	-67.8	-37.1	175.6	-71.5	179.5	-153.4	0	0	112.6	L459 R462 R513 L514 A515 A521	L459-E517 HydrophobicContact CD2-CB 4.08Å; R462-E517 IonicContact CZ-OE2 3.38Å; R462-E517 IonicContact NH1-OE1 2.75Å; R462-E517 IonicContact NH1-OE2 3.05Å; R462-E517 PolarHBondContact NH1-OE2 3.16Å; R462-E517 IonicContact NH2-OE2 3.32Å; R462-E517 PolarHBondContact NH2-OE2 3.03Å; R513-E517 IonicContact CZ-OE1 3.96Å; R513-E517 IonicContact NH1-OE1 2.97Å; R513-E517 PolarHBondContact NH1-OE1 2.96Å; R513-E517 WeakPolarHBondContact O-CG 3.36Å; R513-E517 PolarHBondContact O-N 3.2Å; L514-E517 WeakPolarHBondContact O-CB 3.47Å; L514-E517 PolarHBondContact O-N 3.46Å; A515-E517 VanDerWaalsContact C-N 3.34Å; A515-E517 PolarHBondContact O-N 3.06Å; E517-A521 WeakPolarHBondContact O-CB 3.21Å; E517-A521 PolarHBondContact O-N 3.38Å
518	V	95.3	Very high	82.1	Confident	0 Å²	0	64 Å²	64	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-65.3	-45.2	172.9	176.3	0	0	0	0	110.5	L398 L450 I453 L459 T463 L514 A515 V520 A521 C522	L398-V518 HydrophobicContact CD2-CG1 4.15Å; L450-V518 HydrophobicContact CD2-CB 4.45Å; L450-V518 HydrophobicContact CD2-CG1 4.29Å; I453-V518 HydrophobicContact CD1-CG1 3.77Å; I453-V518 HydrophobicContact CG1-CG1 3.89Å; L459-V518 HydrophobicContact CD1-CG2 4.44Å; L459-V518 HydrophobicContact CD2-CG2 3.96Å; T463-V518 HydrophobicContact CG2-CG2 3.81Å; L514-V518 WeakPolarHBondContact O-CG2 3.48Å; L514-V518 PolarHBondContact O-N 3.36Å; A515-V518 PolarHBondContact O-N 3.2Å; V518-V520 PolarHBondContact O-N 3.09Å; V518-A521 WeakPolarHBondContact O-CB 3.49Å; V518-A521 PolarHBondContact O-N 3.04Å; V518-A521 VanDerWaalsContact O-N 3.17Å; V518-C522 PolarHBondContact O-N 3.35Å; V518-C522 PolarHBondContact O-SG 3.46Å
519	D	93.9	Very high	79.3	Confident	54 Å²	54	71.4 Å²	71.4	29%	0.289	37%	0.374	S	S	.	.	H	α-helix	trans	-56.5	-51.2	176.6	176.1	39.9	0	0	0	111.9	L398 A515 K516 A521 C522 H523	L398-D519 HydrophobicContact CD1-CB 4.29Å; L398-D519 HydrophobicContact CD2-CB 3.87Å; A515-D519 WeakPolarHBondContact O-CB 3.47Å; A515-D519 PolarHBondContact O-N 3.27Å; K516-D519 PolarHBondContact O-N 3Å; D519-A521 VanDerWaalsContact C-N 3.28Å; D519-A521 PolarHBondContact O-N 2.86Å; D519-C522 PolarHBondContact O-N 3.01Å; D519-H523 PolarHBondContact O-N 3.02Å; D519-H523 PolarHBondContact O-ND1 3.04Å; D519-H523 IonicContact OD1-CE1 3.36Å; D519-H523 PolarHBondContact OD1-CE1 3.11Å; D519-H523 IonicContact OD1-CG 2.73Å; D519-H523 IonicContact OD1-ND1 3.2Å; D519-H523 PolarHBondContact OD1-ND1 2.81Å
520	V	91.2	Very high	76.6	Confident	28 Å²	28	76.1 Å²	76.1	17%	0.17	39%	0.389	C	S	.	.	H	α-helix	trans	-56.9	-41.2	175.8	160.5	0	0	0	0	111.5	K516 V518 G524 R525 V527	K516-V520 HydrophobicContact CG-CG2 4.47Å; K516-V520 VanDerWaalsContact O-CB 3.26Å; K516-V520 WeakPolarHBondContact O-CB 3.41Å; K516-V520 WeakPolarHBondContact O-CG2 3.41Å; K516-V520 PolarHBondContact O-N 3.14Å; V518-V520 PolarHBondContact O-N 3.09Å; V520-G524 PolarHBondContact O-N 3.32Å; V520-R525 WeakPolarHBondContact CG1-O 3.24Å; V520-R525 PolarHBondContact O-N 2.92Å; V520-V527 HydrophobicContact CG1-CG2 3.49Å; V520-V527 VanDerWaalsContact CG1-CG2 3.49Å
521	A	90.6	Very high	73.6	Confident	26 Å²	26	79.9 Å²	79.9	22%	0.215	41%	0.407	C	S	.	.	H	α-helix	trans	-67.5	-48.1	176.8	0	0	0	0	0	111.8	F455 L459 E517 V518 D519 H523 G524	F455-A521 HydrophobicContact CE1-CB 3.98Å; F455-A521 HydrophobicContact CZ-CB 3.73Å; F455-A521 WeakPolarHBondContact CZ-O 3.26Å; L459-A521 HydrophobicContact CD1-CB 3.53Å; E517-A521 WeakPolarHBondContact O-CB 3.21Å; E517-A521 PolarHBondContact O-N 3.38Å; V518-A521 WeakPolarHBondContact O-CB 3.49Å; V518-A521 PolarHBondContact O-N 3.04Å; V518-A521 VanDerWaalsContact O-N 3.17Å; D519-A521 VanDerWaalsContact C-N 3.28Å; D519-A521 PolarHBondContact O-N 2.86Å; A521-H523 VanDerWaalsContact C-N 3.33Å; A521-H523 PolarHBondContact O-N 3.27Å; A521-G524 PolarHBondContact O-N 2.85Å; A521-G524 VanDerWaalsContact O-N 3.16Å
522	C	89.1	Confident	70.6	Confident	25 Å²	25	85.4 Å²	85.4	17%	0.169	45%	0.445	C	S	.	.	H	α-helix	trans	-60.8	-40.3	-178.9	-64.8	0	0	0	0	112.3	Q394 L398 V518 D519 G524	Q394-C522 HydrophobicContact CG-CB 4.42Å; L398-C522 HydrophobicContact CD1-CB 4.09Å; V518-C522 PolarHBondContact O-N 3.35Å; V518-C522 PolarHBondContact O-SG 3.46Å; D519-C522 PolarHBondContact O-N 3.01Å; C522-G524 VanDerWaalsContact C-N 3.29Å; C522-G524 PolarHBondContact O-N 2.95Å
523	H	83.1	Confident	67.6	Low	105 Å²	105	93.5 Å²	93.5	49%	0.486	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	6.8	-179.8	-64.8	97.8	0	0	0	114.2	D519 A521 R525	D519-H523 PolarHBondContact O-N 3.02Å; D519-H523 PolarHBondContact O-ND1 3.04Å; D519-H523 IonicContact OD1-CE1 3.36Å; D519-H523 PolarHBondContact OD1-CE1 3.11Å; D519-H523 IonicContact OD1-CG 2.73Å; D519-H523 IonicContact OD1-ND1 3.2Å; D519-H523 PolarHBondContact OD1-ND1 2.81Å; A521-H523 VanDerWaalsContact C-N 3.33Å; A521-H523 PolarHBondContact O-N 3.27Å; H523-R525 HydrophobicContact CB-CG 4.35Å; H523-R525 PolarHBondContact O-N 3.32Å
524	G	64.2	Low	64.7	Low	36 Å²	36	95.9 Å²	95.9	37%	0.371	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.4	11.5	178.8	0	0	0	0	0	114.3	V520 A521 C522 Q526 Q561	V520-G524 PolarHBondContact O-N 3.32Å; A521-G524 PolarHBondContact O-N 2.85Å; A521-G524 VanDerWaalsContact O-N 3.16Å; C522-G524 VanDerWaalsContact C-N 3.29Å; C522-G524 PolarHBondContact O-N 2.95Å; G524-Q526 PolarHBondContact O-N 3.19Å; G524-Q561 PolarHBondContact O-NE2 3.29Å
525	R	50.6	Low	62.1	Low	155 Å²	155	99.7 Å²	99.7	59%	0.585	52%	0.515	S	S	*	.			trans	-74	66.7	173.8	-63.6	-171.2	-152.7	-160.9	8.2	108.2	V520 H523 V527	V520-R525 WeakPolarHBondContact CG1-O 3.24Å; V520-R525 PolarHBondContact O-N 2.92Å; H523-R525 HydrophobicContact CB-CG 4.35Å; H523-R525 PolarHBondContact O-N 3.32Å; R525-V527 PolarHBondContact O-N 3.43Å
526	Q	43.6	Very low	59.1	Low	160 Å²	160	106.8 Å²	106.8	75%	0.748	55%	0.551	S	S	*	*			trans	-49.9	122.3	170.5	-81.5	-171.6	1.8	0	0	108.5	G524 A528	G524-Q526 PolarHBondContact O-N 3.19Å; Q526-A528 VanDerWaalsContact C-N 3.26Å; Q526-A528 PolarHBondContact O-N 3.18Å
527	V	41.8	Very low	56.1	Low	96 Å²	96	105.7 Å²	105.7	58%	0.582	56%	0.558	S	S	*	*			trans	-49.6	89.2	173.9	-179.7	0	0	0	0	109	V520 R525 E529	V520-V527 HydrophobicContact CG1-CG2 3.49Å; V520-V527 VanDerWaalsContact CG1-CG2 3.49Å; R525-V527 PolarHBondContact O-N 3.43Å; V527-E529 HydrophobicContact CG1-CB 3.9Å; V527-E529 WeakPolarHBondContact CG1-O 3.39Å; V527-E529 PolarHBondContact O-N 3.35Å
528	A	35.8	Very low	53.2	Low	90 Å²	90	112.7 Å²	112.7	74%	0.744	59%	0.587	S	S	*	*			trans	-71.8	-3.1	155.4	0	0	0	0	0	110.6	Q526 K530	Q526-A528 VanDerWaalsContact C-N 3.26Å; Q526-A528 PolarHBondContact O-N 3.18Å; A528-K530 PolarHBondContact O-N 3.08Å; A528-K530 VanDerWaalsContact O-N 3.09Å
529	E	35.3	Very low	50.1	Low	161 Å²	161	118.6 Å²	118.6	75%	0.752	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	72.9	174.3	-69.2	-175	149.5	0	0	112	V527	V527-E529 HydrophobicContact CG1-CB 3.9Å; V527-E529 WeakPolarHBondContact CG1-O 3.39Å; V527-E529 PolarHBondContact O-N 3.35Å
530	K	36.8	Very low	46.9	Very low	207 Å²	207	119.5 Å²	119.5	90%	0.9	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-156	12.6	146.6	-113.1	174	-171.5	179.1	0	114.6	A528	A528-K530 PolarHBondContact O-N 3.08Å; A528-K530 VanDerWaalsContact O-N 3.09Å
531	Q	31.2	Very low	44.1	Very low	174 Å²	174	128.1 Å²	128.1	81%	0.813	68%	0.682	S	S	*	*	S	Bend	trans	-123.9	97	161.4	-81.8	177.6	-17.8	0	0	108.9	Y533	Q531-Y533 PolarHBondContact O-N 3.43Å; Q531-Y533 VanDerWaalsContact O-N 3.11Å
532	S	30.2	Very low	41.2	Very low	118 Å²	118	136.5 Å²	136.5	83%	0.825	72%	0.717	S	S	*	*			trans	-45.6	118.1	164	-52.1	0	0	0	0	109.6	M534	S532-M534 VanDerWaalsContact C-N 3.31Å; S532-M534 PolarHBondContact O-N 3.47Å
533	Y	32.6	Very low	38.5	Very low	207 Å²	207	139 Å²	139	81%	0.812	75%	0.746	S	S	*	*			trans	-69.8	87.3	175.5	-133.5	-94.3	0	0	0	108.5	Q531 S535	Q531-Y533 PolarHBondContact O-N 3.43Å; Q531-Y533 VanDerWaalsContact O-N 3.11Å; Y533-S535 VanDerWaalsContact C-N 3.3Å; Y533-S535 PolarHBondContact O-N 3.15Å; Y533-S535 VanDerWaalsContact O-N 3.09Å
534	M	34.1	Very low	36.1	Very low	162 Å²	162	139.2 Å²	139.2	80%	0.798	76%	0.76	S	S	*	*			trans	-74.6	90.7	161.3	-79.7	-60.6	-41.3	0	0	107.3	S532 L536	S532-M534 VanDerWaalsContact C-N 3.31Å; S532-M534 PolarHBondContact O-N 3.47Å; M534-L536 PolarHBondContact O-N 3.07Å; M534-L536 VanDerWaalsContact O-N 3.16Å
535	S	39.7	Very low	34.8	Very low	91 Å²	91	144.1 Å²	144.1	64%	0.636	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-58.1	118.5	170.7	48.3	0	0	0	0	109.5	Y533	Y533-S535 VanDerWaalsContact C-N 3.3Å; Y533-S535 PolarHBondContact O-N 3.15Å; Y533-S535 VanDerWaalsContact O-N 3.09Å
536	L	33.9	Very low	33.9	Very low	158 Å²	158	141.7 Å²	141.7	83%	0.827	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-56.8	143	177.2	-74.5	164.8	0	0	0	111.3	M534 K538	M534-L536 PolarHBondContact O-N 3.07Å; M534-L536 VanDerWaalsContact O-N 3.16Å; L536-K538 PolarHBondContact O-N 2.66Å
537	P	30.8	Very low	33.7	Very low	114 Å²	114	143.2 Å²	143.2	74%	0.74	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-60.7	135.8	175.9	-14.6	27.3	0	0	0	110.6	P539	P537-P539 WeakPolarHBondContact O-CD 3.39Å
538	K	33.3	Very low	33.4	Very low	200 Å²	200	144.5 Å²	144.5	87%	0.87	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-63.6	125.8	170.4	-77.1	-176.3	177.2	177.6	0	109.9	L536	L536-K538 PolarHBondContact O-N 2.66Å
539	P	29.4	Very low	33.4	Very low	124 Å²	124	146.7 Å²	146.7	81%	0.805	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-64	143.4	164.4	-15	29.9	0	0	0	109.8	P537	P537-P539 WeakPolarHBondContact O-CD 3.39Å
540	G	28.1	Very low	33.4	Very low	72 Å²	72	145.1 Å²	145.1	74%	0.742	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-64.5	159	-157.4	0	0	0	0	0	116.7
541	K	32.7	Very low	33.1	Very low	209 Å²	209	144.7 Å²	144.7	91%	0.909	81%	0.813	S	S	*	*			trans	-153.9	127.9	139.4	-104	170.6	-171.8	-176	0	108.3
542	H	29.2	Very low	33.1	Very low	203 Å²	203	142.3 Å²	142.3	94%	0.94	81%	0.811	S	S	*	*			trans	-45.6	145	179.6	-59.9	-89.9	0	0	0	113.6
543	G	33.2	Very low	33.5	Very low	76 Å²	76	140.6 Å²	140.6	78%	0.784	80%	0.799	S	S	*	*			trans	152.3	95.2	164.3	0	0	0	0	0	113.7	T545	G543-T545 PolarHBondContact O-N 2.91Å
544	S	30.9	Very low	34	Very low	110 Å²	110	137.1 Å²	137.1	77%	0.769	80%	0.799	S	S	*	*			trans	-50.4	125.4	168.7	49.5	0	0	0	0	113.1
545	T	38.9	Very low	34.8	Very low	140 Å²	140	132.9 Å²	132.9	86%	0.859	78%	0.779	S	S	*	*				164.8	124.4	128	36.8	0	0	0	0	109.7	G543 K547	G543-T545 PolarHBondContact O-N 2.91Å; T545-K547 PolarHBondContact O-N 3.42Å
546	A	30.1	Very low	35.6	Very low	104 Å²	104	133.4 Å²	133.4	86%	0.86	78%	0.775	S	S	*	*			trans	-70	123.9	-176.6	0	0	0	0	0	111.9
547	K	39.7	Very low	37.2	Very low	192 Å²	192	129.2 Å²	129.2	84%	0.835	76%	0.756	S	S	*	*			trans	-139.9	148.2	156.6	-73.4	-169.8	179.3	178.3	0	109.1	T545	T545-K547 PolarHBondContact O-N 3.42Å
548	P	36.3	Very low	39	Very low	122 Å²	122	130.7 Å²	130.7	79%	0.792	75%	0.753	S	S	*	*			trans	-68.8	135	-162.8	-4	18.9	0	0	0	111	V550	P548-V550 PolarHBondContact O-N 3.11Å; P548-V550 VanDerWaalsContact O-N 3.1Å
549	V	34.4	Very low	40.7	Very low	137 Å²	137	124 Å²	124	83%	0.83	72%	0.724	S	S	*	*			trans	-64.3	111	175.2	176.1	0	0	0	0	108.9	K551	V549-K551 PolarHBondContact O-N 3.38Å
550	V	37.1	Very low	42.8	Very low	127 Å²	127	122.9 Å²	122.9	77%	0.77	71%	0.709	S	S	*	*			trans	-55.8	128.6	169.7	175.9	0	0	0	0	109.1	P548 T552	P548-V550 PolarHBondContact O-N 3.11Å; P548-V550 VanDerWaalsContact O-N 3.1Å; V550-T552 PolarHBondContact O-N 3.5Å
551	K	29.8	Very low	45.1	Very low	198 Å²	198	123 Å²	123	86%	0.861	69%	0.69	S	S	*	*			trans	-50.3	117.2	176.7	-67.1	176.6	177.7	178.4	0	110.7	V549 S553	V549-K551 PolarHBondContact O-N 3.38Å; K551-S553 PolarHBondContact O-N 2.71Å
552	T	31.1	Very low	47.5	Very low	125 Å²	125	118.6 Å²	118.6	77%	0.767	67%	0.671	S	S	*	*			trans	-74.8	106	173.8	-34.3	0	0	0	0	108.8	V550	V550-T552 PolarHBondContact O-N 3.5Å
553	S	38.6	Very low	50	Low	82 Å²	82	109.5 Å²	109.5	57%	0.573	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-66.3	128.8	176	64.4	0	0	0	0	111.4	K551 K681	K551-S553 PolarHBondContact O-N 2.71Å; S553-K681 PolarHBondContact OG-NZ 2.98Å; S553-K681 VanDerWaalsContact OG-NZ 3.07Å
554	V	42.3	Very low	52.5	Low	133 Å²	133	106.9 Å²	106.9	81%	0.806	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-63.4	136	173.8	179.2	0	0	0	0	109.3
555	L	51.5	Low	55.2	Low	74 Å²	74	108.2 Å²	108.2	39%	0.387	59%	0.592	S	S	.	*	P	Polyproline II helix	trans	-69.2	146.4	169.2	-85.8	157.1	0	0	0	109	Q560 F685	L555-Q560 HydrophobicContact CB-CG 4.42Å; L555-F685 HydrophobicContact CD1-CD2 4.33Å; L555-F685 HydrophobicContact CD2-CD2 3.98Å; L555-F685 HydrophobicContact CD2-CG 4.43Å
556	D	57.1	Low	57.6	Low	101 Å²	101	102.2 Å²	102.2	54%	0.54	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-60.3	143.2	-177.1	-156.2	-11.2	0	0	0	111.5	E558 E559 Q560	D556-E558 VanDerWaalsContact C-N 3.29Å; D556-E558 PolarHBondContact O-N 3.11Å; D556-E559 HydrophobicContact CB-CG 4.41Å; D556-E559 PolarHBondContact O-N 3.28Å; D556-Q560 PolarHBondContact O-N 3.47Å
557	T	66.7	Low	60.4	Low	71 Å²	71	97.3 Å²	97.3	44%	0.436	51%	0.514	S	S	.	.	H	α-helix	trans	-69.2	-32.7	-170.4	-51	0	0	0	0	110.9	Q561	T557-Q561 VanDerWaalsContact O-CG 3.3Å; T557-Q561 WeakPolarHBondContact O-CG 3.43Å; T557-Q561 PolarHBondContact O-N 3.45Å
558	E	69.2	Low	62.8	Low	145 Å²	145	92.3 Å²	92.3	68%	0.678	50%	0.496	S	S	*	.	H	α-helix	trans	-67.5	-43.4	178.8	-170.7	177.5	-178.2	0	0	112.3	D556 Q560 Q561 K562	D556-E558 VanDerWaalsContact C-N 3.29Å; D556-E558 PolarHBondContact O-N 3.11Å; E558-Q560 VanDerWaalsContact C-N 3.35Å; E558-Q560 PolarHBondContact O-N 3.46Å; E558-Q561 WeakPolarHBondContact O-CB 3.25Å; E558-Q561 PolarHBondContact O-N 3.09Å; E558-K562 PolarHBondContact O-N 3.41Å
559	E	69.1	Low	65.5	Low	58 Å²	58	89.6 Å²	89.6	27%	0.271	47%	0.473	S	S	.	.	H	α-helix	trans	-59.6	-45.1	177	-78.9	-172.4	157.4	0	0	111.1	D556 Q561 K562 I563 F685	D556-E559 HydrophobicContact CB-CG 4.41Å; D556-E559 PolarHBondContact O-N 3.28Å; E559-Q561 VanDerWaalsContact C-N 3.35Å; E559-Q561 PolarHBondContact O-N 3.28Å; E559-K562 PolarHBondContact O-N 2.99Å; E559-I563 PolarHBondContact O-N 3.13Å; E559-F685 HydrophobicContact CB-CE1 3.7Å; E559-F685 HydrophobicContact CB-CE2 4.16Å; E559-F685 HydrophobicContact CB-CZ 3.46Å; E559-F685 VanDerWaalsContact CB-CZ 3.46Å; E559-F685 HydrophobicContact CG-CE1 3.96Å; E559-F685 HydrophobicContact CG-CZ 4.25Å; E559-F685 WeakPolarHBondContact O-CZ 3.17Å
560	Q	72	Confident	68.2	Low	101 Å²	101	83.1 Å²	83.1	47%	0.472	43%	0.433	S	S	.	.	H	α-helix	trans	-64	-37.4	176.7	-69.2	-173.4	-3.2	0	0	113	L555 D556 E558 A564	L555-Q560 HydrophobicContact CB-CG 4.42Å; D556-Q560 PolarHBondContact O-N 3.47Å; E558-Q560 VanDerWaalsContact C-N 3.35Å; E558-Q560 PolarHBondContact O-N 3.46Å; Q560-A564 WeakPolarHBondContact O-CB 3.43Å; Q560-A564 PolarHBondContact O-N 3.06Å
561	Q	77.9	Confident	70.8	Confident	76 Å²	76	80.3 Å²	80.3	36%	0.355	41%	0.411	S	S	.	.	H	α-helix	trans	-64.6	-40	176.6	-73.3	170.6	2.3	0	0	112	G524 T557 E558 E559 A564 K565	G524-Q561 PolarHBondContact O-NE2 3.29Å; T557-Q561 VanDerWaalsContact O-CG 3.3Å; T557-Q561 WeakPolarHBondContact O-CG 3.43Å; T557-Q561 PolarHBondContact O-N 3.45Å; E558-Q561 WeakPolarHBondContact O-CB 3.25Å; E558-Q561 PolarHBondContact O-N 3.09Å; E559-Q561 VanDerWaalsContact C-N 3.35Å; E559-Q561 PolarHBondContact O-N 3.28Å; Q561-A564 PolarHBondContact O-N 3.38Å; Q561-K565 PolarHBondContact O-N 3.48Å
562	K	82.3	Confident	73.8	Confident	116 Å²	116	76.4 Å²	76.4	50%	0.504	40%	0.398	S	S	.	.	H	α-helix	trans	-59.8	-48.9	177.4	-170.5	-169.2	178.1	-156.8	0	111.6	E558 E559 A564 K565 L566 D689	E558-K562 PolarHBondContact O-N 3.41Å; E559-K562 PolarHBondContact O-N 2.99Å; K562-A564 VanDerWaalsContact C-N 3.34Å; K562-A564 PolarHBondContact O-N 3.4Å; K562-K565 WeakPolarHBondContact O-CB 3.35Å; K562-K565 PolarHBondContact O-N 2.79Å; K562-L566 PolarHBondContact O-N 3.47Å; K562-L566 VanDerWaalsContact O-N 3.1Å; K562-D689 IonicContact NZ-OD2 3.41Å; K562-D689 PolarHBondContact NZ-OD2 3.46Å
563	I	82.6	Confident	76.7	Confident	12 Å²	12	71.3 Å²	71.3	6%	0.062	37%	0.367	C	S	.	.	H	α-helix	trans	-65.4	-38.9	177.7	-68.4	-173.7	0	0	0	111.2	E559 K565 L566 G567 T610 F685 V688 D689	E559-I563 PolarHBondContact O-N 3.13Å; I563-K565 VanDerWaalsContact C-N 3.32Å; I563-K565 PolarHBondContact O-N 2.91Å; I563-L566 PolarHBondContact O-N 3.13Å; I563-G567 PolarHBondContact O-N 2.64Å; I563-T610 HydrophobicContact CG2-CG2 3.58Å; I563-F685 HydrophobicContact CD1-CD2 4.06Å; I563-F685 HydrophobicContact CD1-CE1 3.86Å; I563-F685 HydrophobicContact CD1-CE2 3.31Å; I563-F685 HydrophobicContact CD1-CZ 3.14Å; I563-F685 HydrophobicContact CG1-CE1 4.41Å; I563-F685 HydrophobicContact CG1-CE2 4.28Å; I563-F685 HydrophobicContact CG1-CZ 3.72Å; I563-V688 HydrophobicContact CD1-CG1 3.97Å; I563-D689 HydrophobicContact CD1-CB 4.14Å; I563-D689 HydrophobicContact CG1-CB 4.19Å
564	A	85.2	Confident	79.2	Confident	21 Å²	21	67.5 Å²	67.5	17%	0.174	34%	0.34	C	S	.	.	H	α-helix	trans	-63.7	-37	176.6	0	0	0	0	0	112.5	Q560 Q561 K562 G567 L568	Q560-A564 WeakPolarHBondContact O-CB 3.43Å; Q560-A564 PolarHBondContact O-N 3.06Å; Q561-A564 PolarHBondContact O-N 3.38Å; K562-A564 VanDerWaalsContact C-N 3.34Å; K562-A564 PolarHBondContact O-N 3.4Å; A564-G567 PolarHBondContact O-N 2.94Å; A564-L568 PolarHBondContact O-N 3.14Å
565	K	88.2	Confident	81.5	Confident	138 Å²	138	64.2 Å²	64.2	60%	0.6	32%	0.322	S	S	*	.	H	α-helix	trans	-63.5	-49	173.6	-177.8	-176.6	174.3	-175.7	0	111.2	Q561 K562 I563 G567 L568 E569	Q561-K565 PolarHBondContact O-N 3.48Å; K562-K565 WeakPolarHBondContact O-CB 3.35Å; K562-K565 PolarHBondContact O-N 2.79Å; I563-K565 VanDerWaalsContact C-N 3.32Å; I563-K565 PolarHBondContact O-N 2.91Å; K565-G567 VanDerWaalsContact C-N 3.3Å; K565-G567 PolarHBondContact O-N 3.28Å; K565-L568 WeakPolarHBondContact O-CB 3.47Å; K565-L568 PolarHBondContact O-N 3.13Å; K565-L568 VanDerWaalsContact O-N 3.12Å; K565-E569 WeakPolarHBondContact CE-OE1 3.38Å; K565-E569 PolarHBondContact O-N 2.98Å
566	L	88.6	Confident	83.4	Confident	14 Å²	14	65.4 Å²	65.4	7%	0.073	33%	0.326	C	S	.	.	H	α-helix	trans	-60.7	-40.7	176.8	-68.4	179.4	0	0	0	112.2	K562 I563 L568 E569 M570 D689 I692 Q693	K562-L566 PolarHBondContact O-N 3.47Å; K562-L566 VanDerWaalsContact O-N 3.1Å; I563-L566 PolarHBondContact O-N 3.13Å; L566-L568 VanDerWaalsContact C-N 3.32Å; L566-L568 PolarHBondContact O-N 3.13Å; L566-E569 PolarHBondContact O-N 2.95Å; L566-M570 PolarHBondContact O-N 2.71Å; L566-D689 VanDerWaalsContact CD1-OD1 3.25Å; L566-D689 WeakPolarHBondContact CD1-OD1 3.23Å; L566-I692 HydrophobicContact CB-CG2 3.8Å; L566-Q693 HydrophobicContact CD1-CB 4.21Å
567	G	88.9	Confident	85	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-59.4	-41.5	173.7	0	0	0	0	0	112.5	I563 A564 K565 M570 K571 Y607	I563-G567 PolarHBondContact O-N 2.64Å; A564-G567 PolarHBondContact O-N 2.94Å; K565-G567 VanDerWaalsContact C-N 3.3Å; K565-G567 PolarHBondContact O-N 3.28Å; G567-M570 PolarHBondContact O-N 2.92Å; G567-K571 PolarHBondContact O-N 3.44Å; G567-Y607 VanDerWaalsContact C-CD2 3.47Å; G567-Y607 WeakPolarHBondContact O-CD2 3.39Å
568	L	90.2	Very high	86.2	Confident	88 Å²	88	59.9 Å²	59.9	46%	0.461	29%	0.294	S	S	.	.	H	α-helix	trans	-67	-41.6	177.9	-174.7	64.5	0	0	0	112.2	A564 K565 L566 M570 K571 L572	A564-L568 PolarHBondContact O-N 3.14Å; K565-L568 WeakPolarHBondContact O-CB 3.47Å; K565-L568 PolarHBondContact O-N 3.13Å; K565-L568 VanDerWaalsContact O-N 3.12Å; L566-L568 VanDerWaalsContact C-N 3.32Å; L566-L568 PolarHBondContact O-N 3.13Å; L568-M570 VanDerWaalsContact C-N 3.32Å; L568-M570 PolarHBondContact O-N 2.97Å; L568-K571 HydrophobicContact CD1-CD 4.21Å; L568-K571 WeakPolarHBondContact O-CB 3.46Å; L568-K571 PolarHBondContact O-N 3.14Å; L568-L572 PolarHBondContact O-N 3.24Å; L568-L572 VanDerWaalsContact O-N 3.09Å
569	E	92.1	Very high	87.1	Confident	65 Å²	65	55.3 Å²	55.3	30%	0.304	28%	0.281	S	S	.	.	H	α-helix	trans	-59.7	-43.7	173.4	-68.3	174.1	-167.8	0	0	111	K565 L566 K571 L572 L573 K696	K565-E569 WeakPolarHBondContact CE-OE1 3.38Å; K565-E569 PolarHBondContact O-N 2.98Å; L566-E569 PolarHBondContact O-N 2.95Å; E569-K571 VanDerWaalsContact C-N 3.33Å; E569-K571 PolarHBondContact O-N 3.26Å; E569-L572 PolarHBondContact O-N 2.93Å; E569-L573 PolarHBondContact O-N 3.33Å; E569-K696 HydrophobicContact CB-CD 3.76Å; E569-K696 HydrophobicContact CB-CG 4.49Å; E569-K696 WeakPolarHBondContact OE2-CD 3.13Å; E569-K696 IonicContact OE2-NZ 3.95Å; E569-K696 PolarHBondContact OE2-NZ 3.32Å
570	M	92.1	Very high	87.8	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61	-39.5	174.5	-176.1	172.5	56.3	0	0	112.2	L566 G567 L568 L572 L573 T574 A603 M606 I692 T695 K696	L566-M570 PolarHBondContact O-N 2.71Å; G567-M570 PolarHBondContact O-N 2.92Å; L568-M570 VanDerWaalsContact C-N 3.32Å; L568-M570 PolarHBondContact O-N 2.97Å; M570-L572 PolarHBondContact O-N 3.39Å; M570-L573 WeakPolarHBondContact O-CB 3.45Å; M570-L573 PolarHBondContact O-N 3.12Å; M570-T574 WeakPolarHBondContact O-CG2 3.34Å; M570-T574 PolarHBondContact O-N 3.41Å; M570-A603 WeakPolarHBondContact CE-O 3.49Å; M570-A603 HydrophobicContact CG-CB 4.14Å; M570-A603 HydrophobicContact SD-CB 4.19Å; M570-M606 HydrophobicContact CE-CB 3.64Å; M570-M606 HydrophobicContact SD-CB 4.24Å; M570-I692 HydrophobicContact CE-CD1 4.17Å; M570-I692 HydrophobicContact CE-CG2 4.31Å; M570-T695 HydrophobicContact SD-CG2 3.62Å; M570-K696 HydrophobicContact CB-CB 4.33Å; M570-K696 HydrophobicContact CB-CG 4.33Å
571	K	92.3	Very high	88.5	Confident	69 Å²	69	48.4 Å²	48.4	30%	0.3	25%	0.249	S	C	.	.	H	α-helix	trans	-60.7	-42.5	174.6	-174	-157.1	176.1	-172.4	0	112.1	G567 L568 E569 L573 T574 S575 Y604 Y607	G567-K571 PolarHBondContact O-N 3.44Å; L568-K571 HydrophobicContact CD1-CD 4.21Å; L568-K571 WeakPolarHBondContact O-CB 3.46Å; L568-K571 PolarHBondContact O-N 3.14Å; E569-K571 VanDerWaalsContact C-N 3.33Å; E569-K571 PolarHBondContact O-N 3.26Å; K571-L573 VanDerWaalsContact C-N 3.27Å; K571-L573 PolarHBondContact O-N 2.88Å; K571-T574 WeakPolarHBondContact CA-OG1 3.26Å; K571-T574 PolarHBondContact O-N 3.17Å; K571-T574 VanDerWaalsContact O-N 3.14Å; K571-T574 PolarHBondContact O-OG1 3.39Å; K571-S575 PolarHBondContact O-N 3.45Å; K571-S575 VanDerWaalsContact O-N 3.1Å; K571-S575 PolarHBondContact O-OG 3.33Å; K571-Y604 HydrophobicContact CG-CD2 4.36Å; K571-Y604 HydrophobicContact CG-CE2 4.28Å; K571-Y607 HydrophobicContact CB-CD1 4.07Å; K571-Y607 HydrophobicContact CB-CD2 3.96Å; K571-Y607 HydrophobicContact CB-CE1 4.38Å; K571-Y607 HydrophobicContact CB-CE2 4.23Å; K571-Y607 HydrophobicContact CB-CG 3.84Å; K571-Y607 HydrophobicContact CD-CD1 4.27Å; K571-Y607 HydrophobicContact CD-CE1 3.78Å; K571-Y607 HydrophobicContact CD-CE2 4.2Å; K571-Y607 HydrophobicContact CG-CD1 3.99Å; K571-Y607 HydrophobicContact CG-CE1 4Å; K571-Y607 HydrophobicContact CG-CG 4.29Å
572	L	92.5	Very high	88.7	Confident	115 Å²	115	50.7 Å²	50.7	60%	0.602	26%	0.259	S	S	*	.	H	α-helix	trans	-60.5	-41.4	177.8	-67.5	172.7	0	0	0	111	L568 E569 M570 T574 S575 E576	L568-L572 PolarHBondContact O-N 3.24Å; L568-L572 VanDerWaalsContact O-N 3.09Å; E569-L572 PolarHBondContact O-N 2.93Å; M570-L572 PolarHBondContact O-N 3.39Å; L572-T574 PolarHBondContact O-N 2.94Å; L572-S575 PolarHBondContact O-N 3.35Å; L572-E576 PolarHBondContact O-N 3.09Å
573	L	91.8	Very high	88.6	Confident	19 Å²	19	50.8 Å²	50.8	10%	0.099	26%	0.26	C	S	.	.	H	α-helix	trans	-64.4	-35.9	174.4	-65.7	169.7	0	0	0	112.9	E569 M570 K571 S575 E576 V577 K696 M699 N700	E569-L573 PolarHBondContact O-N 3.33Å; M570-L573 WeakPolarHBondContact O-CB 3.45Å; M570-L573 PolarHBondContact O-N 3.12Å; K571-L573 VanDerWaalsContact C-N 3.27Å; K571-L573 PolarHBondContact O-N 2.88Å; L573-S575 VanDerWaalsContact C-N 3.34Å; L573-E576 PolarHBondContact O-N 3.5Å; L573-V577 PolarHBondContact O-N 3.39Å; L573-K696 HydrophobicContact CD1-CG 3.73Å; L573-K696 WeakPolarHBondContact CD1-O 3.42Å; L573-M699 HydrophobicContact CB-CB 4.4Å; L573-M699 HydrophobicContact CB-CG 3.87Å; L573-M699 HydrophobicContact CD1-CB 4.31Å; L573-N700 HydrophobicContact CD1-CB 3.91Å; L573-N700 HydrophobicContact CD2-CB 4.1Å
574	T	91.7	Very high	88.4	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.012	26%	0.257	C	S	.	.	H	α-helix	trans	-61.3	-43.6	172.9	61.5	0	0	0	0	111.7	M570 K571 L572 E576 V577 D578 S600 A603 M699	M570-T574 WeakPolarHBondContact O-CG2 3.34Å; M570-T574 PolarHBondContact O-N 3.41Å; K571-T574 WeakPolarHBondContact CA-OG1 3.26Å; K571-T574 PolarHBondContact O-N 3.17Å; K571-T574 VanDerWaalsContact O-N 3.14Å; K571-T574 PolarHBondContact O-OG1 3.39Å; L572-T574 PolarHBondContact O-N 2.94Å; T574-E576 VanDerWaalsContact C-N 3.32Å; T574-E576 PolarHBondContact O-N 2.96Å; T574-V577 PolarHBondContact O-N 3.34Å; T574-D578 WeakPolarHBondContact O-CB 3.41Å; T574-D578 VanDerWaalsContact O-CG 3.26Å; T574-D578 PolarHBondContact O-N 3.08Å; T574-S600 WeakPolarHBondContact CB-OG 3.25Å; T574-S600 WeakPolarHBondContact CG2-O 3.35Å; T574-S600 PolarHBondContact O-OG 3.49Å; T574-A603 HydrophobicContact CG2-CB 3.6Å; T574-M699 HydrophobicContact CG2-CE 4.24Å
575	S	90.3	Very high	87.3	Confident	63 Å²	63	51.2 Å²	51.2	44%	0.441	26%	0.259	S	S	.	.	H	α-helix	trans	-66.1	-34.7	177.4	-58.7	0	0	0	0	112.4	K571 L572 L573 A579	K571-S575 PolarHBondContact O-N 3.45Å; K571-S575 VanDerWaalsContact O-N 3.1Å; K571-S575 PolarHBondContact O-OG 3.33Å; L572-S575 PolarHBondContact O-N 3.35Å; L573-S575 VanDerWaalsContact C-N 3.34Å; S575-A579 VanDerWaalsContact O-CB 3.26Å; S575-A579 WeakPolarHBondContact O-CB 3.36Å; S575-A579 PolarHBondContact O-N 2.94Å
576	E	91	Very high	86	Confident	99 Å²	99	49.1 Å²	49.1	46%	0.463	25%	0.252	S	S	.	.	H	α-helix	trans	-66.5	-46.6	174.7	-172.8	174.5	-176.9	0	0	112	L572 L573 T574 D578 A579 E580 A703	L572-E576 PolarHBondContact O-N 3.09Å; L573-E576 PolarHBondContact O-N 3.5Å; T574-E576 VanDerWaalsContact C-N 3.32Å; T574-E576 PolarHBondContact O-N 2.96Å; E576-D578 PolarHBondContact O-N 3.47Å; E576-A579 PolarHBondContact O-N 2.98Å; E576-E580 WeakPolarHBondContact O-CB 3.32Å; E576-E580 PolarHBondContact O-N 3.05Å; E576-A703 HydrophobicContact CG-CB 4.43Å
577	V	91.3	Very high	84.9	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63	-41.8	175.4	168.6	0	0	0	0	111.8	L573 T574 E580 A581 A596 M699 I702 A703	L573-V577 PolarHBondContact O-N 3.39Å; T574-V577 PolarHBondContact O-N 3.34Å; V577-E580 PolarHBondContact O-N 3.08Å; V577-A581 WeakPolarHBondContact O-CB 3.38Å; V577-A581 PolarHBondContact O-N 3.26Å; V577-A596 HydrophobicContact CG1-CB 3.91Å; V577-M699 HydrophobicContact CB-CE 3.54Å; V577-M699 HydrophobicContact CG1-CE 3.88Å; V577-M699 HydrophobicContact CG2-CE 3.38Å; V577-M699 HydrophobicContact CG2-SD 4.45Å; V577-I702 HydrophobicContact CG2-CG2 4.3Å; V577-A703 HydrophobicContact CG2-CB 3.71Å
578	D	91	Very high	83.5	Confident	56 Å²	56	55 Å²	55	30%	0.299	28%	0.282	S	S	.	.	H	α-helix	trans	-63.3	-45.5	177	-72.6	-23.9	0	0	0	111.1	T574 E576 E580 A581 E582 S600	T574-D578 WeakPolarHBondContact O-CB 3.41Å; T574-D578 VanDerWaalsContact O-CG 3.26Å; T574-D578 PolarHBondContact O-N 3.08Å; E576-D578 PolarHBondContact O-N 3.47Å; D578-E580 PolarHBondContact O-N 2.97Å; D578-A581 PolarHBondContact O-N 3.44Å; D578-E582 WeakPolarHBondContact O-CB 3.35Å; D578-E582 WeakPolarHBondContact O-CG 3.5Å; D578-E582 PolarHBondContact O-N 3.03Å; D578-S600 WeakPolarHBondContact OD1-CB 3.47Å; D578-S600 PolarHBondContact OD1-OG 3.28Å; D578-S600 PolarHBondContact OD2-OG 2.76Å
579	A	88.5	Confident	82.4	Confident	50 Å²	50	58.1 Å²	58.1	41%	0.413	29%	0.294	S	S	.	.	H	α-helix	trans	-63.7	-39.6	177.3	0	0	0	0	0	112.3	S575 E576 E582 K583	S575-A579 VanDerWaalsContact O-CB 3.26Å; S575-A579 WeakPolarHBondContact O-CB 3.36Å; S575-A579 PolarHBondContact O-N 2.94Å; E576-A579 PolarHBondContact O-N 2.98Å; A579-E582 PolarHBondContact O-N 3.35Å; A579-K583 PolarHBondContact O-N 2.72Å
580	E	84.2	Confident	81.9	Confident	13 Å²	13	55.7 Å²	55.7	6%	0.061	28%	0.283	C	S	.	.	H	α-helix	trans	-67.3	-44.8	174.7	-167.1	66.9	-145.5	0	0	110.9	E576 V577 D578 E582 K583 W584 V706 T707	E576-E580 WeakPolarHBondContact O-CB 3.32Å; E576-E580 PolarHBondContact O-N 3.05Å; V577-E580 PolarHBondContact O-N 3.08Å; D578-E580 PolarHBondContact O-N 2.97Å; E580-E582 VanDerWaalsContact C-N 3.26Å; E580-E582 PolarHBondContact O-N 3.14Å; E580-K583 VanDerWaalsContact O-CB 3.29Å; E580-K583 WeakPolarHBondContact O-CB 3.34Å; E580-K583 PolarHBondContact O-N 2.92Å; E580-K583 WeakPolarHBondContact OE1-CD 3.44Å; E580-K583 IonicContact OE1-NZ 3.96Å; E580-K583 WeakPolarHBondContact OE2-CE 3.49Å; E580-K583 IonicContact OE2-NZ 3.15Å; E580-K583 PolarHBondContact OE2-NZ 2.99Å; E580-W584 VanDerWaalsContact O-CD1 3.24Å; E580-V706 HydrophobicContact CB-CG1 4.06Å; E580-V706 HydrophobicContact CG-CB 4.21Å; E580-V706 HydrophobicContact CG-CG1 3.63Å; E580-T707 WeakPolarHBondContact CG-OG1 3.48Å; E580-T707 PolarHBondContact OE2-OG1 3.18Å
581	A	85.1	Confident	81.8	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-63.9	-28.6	177.3	0	0	0	0	0	113	V577 D578 K583 W584 V593 K597	V577-A581 WeakPolarHBondContact O-CB 3.38Å; V577-A581 PolarHBondContact O-N 3.26Å; D578-A581 PolarHBondContact O-N 3.44Å; A581-K583 VanDerWaalsContact C-N 3.31Å; A581-W584 PolarHBondContact O-N 3.41Å; A581-V593 HydrophobicContact CB-CG1 4.23Å; A581-K597 HydrophobicContact CB-CG 4.13Å
582	E	82.4	Confident	81.7	Confident	124 Å²	124	55.6 Å²	55.6	58%	0.579	29%	0.286	S	S	*	.	H	α-helix	trans	-67.2	-28.2	171.9	-80.2	178.4	-179.9	0	0	112.8	D578 A579 E580 W584 D585	D578-E582 WeakPolarHBondContact O-CB 3.35Å; D578-E582 WeakPolarHBondContact O-CG 3.5Å; D578-E582 PolarHBondContact O-N 3.03Å; A579-E582 PolarHBondContact O-N 3.35Å; E580-E582 VanDerWaalsContact C-N 3.26Å; E580-E582 PolarHBondContact O-N 3.14Å; E582-W584 PolarHBondContact O-N 3.17Å; E582-D585 WeakPolarHBondContact O-CB 3.34Å; E582-D585 PolarHBondContact O-N 3.31Å; E582-D585 VanDerWaalsContact O-N 3.17Å
583	K	80.5	Confident	81.6	Confident	118 Å²	118	50.2 Å²	50.2	51%	0.513	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-21.5	173.8	-59.9	174.2	-173.1	170.1	0	112.6	A579 E580 A581 D585 F710	A579-K583 PolarHBondContact O-N 2.72Å; E580-K583 VanDerWaalsContact O-CB 3.29Å; E580-K583 WeakPolarHBondContact O-CB 3.34Å; E580-K583 PolarHBondContact O-N 2.92Å; E580-K583 WeakPolarHBondContact OE1-CD 3.44Å; E580-K583 IonicContact OE1-NZ 3.96Å; E580-K583 WeakPolarHBondContact OE2-CE 3.49Å; E580-K583 IonicContact OE2-NZ 3.15Å; E580-K583 PolarHBondContact OE2-NZ 2.99Å; A581-K583 VanDerWaalsContact C-N 3.31Å; K583-D585 VanDerWaalsContact C-N 3.26Å; K583-D585 PolarHBondContact O-N 3.36Å; K583-F710 HydrophobicContact CB-CD2 4.33Å; K583-F710 HydrophobicContact CB-CE1 4.23Å; K583-F710 HydrophobicContact CB-CE2 3.81Å; K583-F710 HydrophobicContact CB-CZ 3.76Å; K583-F710 HydrophobicContact CD-CD1 4.44Å; K583-F710 HydrophobicContact CD-CE1 4.18Å; K583-F710 WeakPolarHBondContact O-CE2 3.48Å
584	W	79.2	Confident	81.6	Confident	3 Å²	3	54.1 Å²	54.1	1%	0.011	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	23.2	176.7	-62.9	67.8	0	0	0	112.8	E580 A581 E582 E586 Y587 A588 N590 I592 V593 C709 F710 A713 F720	E580-W584 VanDerWaalsContact O-CD1 3.24Å; A581-W584 PolarHBondContact O-N 3.41Å; E582-W584 PolarHBondContact O-N 3.17Å; W584-E586 PolarHBondContact O-N 3.34Å; W584-Y587 HydrophobicContact CE3-CD2 4.42Å; W584-Y587 CarbonylContact O-C 3.55Å; W584-Y587 WeakPolarHBondContact O-CA 3.47Å; W584-Y587 PolarHBondContact O-N 3.21Å; W584-A588 PolarHBondContact O-N 3.05Å; W584-N590 WeakPolarHBondContact CZ3-ND2 3.03Å; W584-I592 HydrophobicContact CH2-CD1 4.43Å; W584-V593 HydrophobicContact CB-CG2 3.43Å; W584-V593 VanDerWaalsContact CB-CG2 3.43Å; W584-V593 HydrophobicContact CD2-CG2 3.72Å; W584-V593 HydrophobicContact CE3-CG2 3.87Å; W584-V593 HydrophobicContact CG-CG2 3.59Å; W584-C709 HydrophobicContact CH2-CB 3.87Å; W584-C709 VanDerWaalsContact CZ2-C 3.46Å; W584-C709 HydrophobicContact CZ2-CB 3.65Å; W584-F710 AromaticContact CD1-CD2 3.51Å; W584-F710 AromaticContact CD2-CD2 3.93Å; W584-F710 HydrophobicContact CD2-CD2 3.93Å; W584-F710 AromaticContact CE2-CD2 3.61Å; W584-F710 AromaticContact CG-CD2 3.92Å; W584-F710 HydrophobicContact CG-CD2 3.92Å; W584-F710 HydrophobicContact CG-CE2 4.44Å; W584-F710 HydrophobicContact CZ2-CB 3.73Å; W584-F710 HydrophobicContact CZ2-CD2 4.28Å; W584-F710 AromaticContact NE1-CD2 3.32Å; W584-F710 VanDerWaalsContact NE1-CD2 3.32Å; W584-F710 AromaticContact NE1-CG 3.68Å; W584-A713 HydrophobicContact CH2-CB 3.99Å; W584-A713 HydrophobicContact CZ3-CB 4.18Å; W584-F720 HydrophobicContact CE3-CE2 4.37Å; W584-F720 HydrophobicContact CH2-CE2 4.44Å; W584-F720 AromaticContact CH2-CZ 3.93Å; W584-F720 HydrophobicContact CH2-CZ 3.93Å; W584-F720 HydrophobicContact CZ3-CE1 4.3Å; W584-F720 AromaticContact CZ3-CE2 3.58Å; W584-F720 HydrophobicContact CZ3-CE2 3.58Å; W584-F720 AromaticContact CZ3-CZ 3.41Å; W584-F720 HydrophobicContact CZ3-CZ 3.41Å; W584-F720 VanDerWaalsContact CZ3-CZ 3.41Å
585	D	62.4	Low	81.6	Confident	39 Å²	39	56.1 Å²	56.1	21%	0.209	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-53.3	-38.8	-168.8	-143.4	-12.7	0	0	0	112	N36 K40 E582 K583 Y587 A588	N36-D585 VanDerWaalsContact CB-OD2 3.32Å; N36-D585 WeakPolarHBondContact CB-OD2 3.11Å; N36-D585 PolarHBondContact ND2-OD2 3.39Å; K40-D585 WeakPolarHBondContact CE-O 3.01Å; K40-D585 PolarHBondContact NZ-O 2.82Å; K40-D585 IonicContact NZ-OD1 2.67Å; K40-D585 PolarHBondContact NZ-OD1 3.39Å; E582-D585 WeakPolarHBondContact O-CB 3.34Å; E582-D585 PolarHBondContact O-N 3.31Å; E582-D585 VanDerWaalsContact O-N 3.17Å; K583-D585 VanDerWaalsContact C-N 3.26Å; K583-D585 PolarHBondContact O-N 3.36Å; D585-Y587 PolarHBondContact O-N 2.7Å; D585-Y587 VanDerWaalsContact O-N 3.12Å; D585-A588 PolarHBondContact O-N 3.49Å
586	E	60	Low	81.8	Confident	95 Å²	95	53.1 Å²	53.1	44%	0.444	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-58.3	-22.7	174.5	-64.6	-162.6	138.5	0	0	114.7	E39 W584	E39-E586 HydrophobicContact CB-CG 3.93Å; E39-E586 VanDerWaalsContact CB-OE1 3.22Å; E39-E586 WeakPolarHBondContact CB-OE1 3.46Å; E39-E586 HydrophobicContact CG-CG 4.2Å; E39-E586 WeakPolarHBondContact CG-OE1 3.47Å; W584-E586 PolarHBondContact O-N 3.34Å
587	Y	65.7	Low	81.9	Confident	98 Å²	98	52.5 Å²	52.5	38%	0.384	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-118.7	35.3	-177.4	-51	-79.2	0	0	0	111.7	W584 D585 E589 N590 F720	W584-Y587 HydrophobicContact CE3-CD2 4.42Å; W584-Y587 CarbonylContact O-C 3.55Å; W584-Y587 WeakPolarHBondContact O-CA 3.47Å; W584-Y587 PolarHBondContact O-N 3.21Å; D585-Y587 PolarHBondContact O-N 2.7Å; D585-Y587 VanDerWaalsContact O-N 3.12Å; Y587-E589 PolarHBondContact O-N 3.32Å; Y587-N590 WeakPolarHBondContact O-CA 3.42Å; Y587-N590 WeakPolarHBondContact O-CB 3.39Å; Y587-N590 PolarHBondContact O-N 3.43Å; Y587-F720 AromaticContact CD1-CD2 3.87Å; Y587-F720 HydrophobicContact CD1-CD2 3.87Å; Y587-F720 HydrophobicContact CE1-CD2 4.11Å; Y587-F720 HydrophobicContact CG-CD2 4.27Å
588	A	59.8	Low	82.1	Confident	40 Å²	40	54.6 Å²	54.6	33%	0.331	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-20.6	177	0	0	0	0	0	114	W584 D585	W584-A588 PolarHBondContact O-N 3.05Å; D585-A588 PolarHBondContact O-N 3.49Å
589	E	65.6	Low	82.3	Confident	152 Å²	152	51.9 Å²	51.9	71%	0.71	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-8.7	173.4	-66	-153.6	167.9	0	0	114.9	Y587 D591 K594	Y587-E589 PolarHBondContact O-N 3.32Å; E589-D591 PolarHBondContact O-N 2.84Å; E589-K594 WeakPolarHBondContact O-CE 3.22Å; E589-K594 PolarHBondContact O-NZ 3.36Å
590	N	83.1	Confident	82.6	Confident	15 Å²	15	49.6 Å²	49.6	8%	0.08	24%	0.237	C	C	.	.			trans	-61.3	131.4	179.1	-172.2	-38.8	0	0	0	110.9	W584 Y587 I592 V593 K594 F720	W584-N590 WeakPolarHBondContact CZ3-ND2 3.03Å; Y587-N590 WeakPolarHBondContact O-CA 3.42Å; Y587-N590 WeakPolarHBondContact O-CB 3.39Å; Y587-N590 PolarHBondContact O-N 3.43Å; N590-I592 PolarHBondContact O-N 3.18Å; N590-I592 VanDerWaalsContact OD1-CB 3.27Å; N590-I592 WeakPolarHBondContact OD1-CB 3.45Å; N590-I592 WeakPolarHBondContact OD1-CG1 3.44Å; N590-I592 PolarHBondContact OD1-N 3.43Å; N590-V593 HydrophobicContact CB-CB 4.35Å; N590-V593 HydrophobicContact CB-CG2 4.01Å; N590-V593 PolarHBondContact O-N 2.93Å; N590-V593 VanDerWaalsContact O-N 3.16Å; N590-K594 PolarHBondContact O-N 3.25Å; N590-F720 WeakPolarHBondContact ND2-CD1 3.41Å; N590-F720 WeakPolarHBondContact ND2-CD2 3.4Å; N590-F720 WeakPolarHBondContact ND2-CE1 3.46Å; N590-F720 WeakPolarHBondContact ND2-CE2 3.07Å; N590-F720 VanDerWaalsContact ND2-CG 3.3Å; N590-F720 WeakPolarHBondContact ND2-CG 3.28Å; N590-F720 VanDerWaalsContact ND2-CZ 3.28Å; N590-F720 WeakPolarHBondContact ND2-CZ 3.46Å
591	D	88.8	Confident	83.2	Confident	66 Å²	66	52.3 Å²	52.3	35%	0.353	26%	0.258	S	S	.	.	H	α-helix	trans	-58.7	-32.9	179.7	-87.8	-41.9	0	0	0	113.6	E589 R595 T639	E589-D591 PolarHBondContact O-N 2.84Å; D591-R595 VanDerWaalsContact CG-NH1 3.25Å; D591-R595 WeakPolarHBondContact O-CB 3.34Å; D591-R595 VanDerWaalsContact O-CD 3.27Å; D591-R595 WeakPolarHBondContact O-CD 3.5Å; D591-R595 WeakPolarHBondContact O-CG 3.09Å; D591-R595 PolarHBondContact O-N 3.38Å; D591-R595 VanDerWaalsContact O-N 3.09Å; D591-R595 PolarHBondContact O-NH1 3.43Å; D591-R595 IonicContact OD1-CZ 3.52Å; D591-R595 IonicContact OD1-NH1 3.15Å; D591-R595 PolarHBondContact OD1-NH1 2.99Å; D591-R595 IonicContact OD1-NH2 2.67Å; D591-T639 HydrophobicContact CB-CG2 3.55Å
592	I	91.3	Very high	83.8	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-64.5	-50	175.2	-60	177.3	0	0	0	109.8	W584 N590 R595 A596 M636 T639 V640 F643 C709 F720	W584-I592 HydrophobicContact CH2-CD1 4.43Å; N590-I592 PolarHBondContact O-N 3.18Å; N590-I592 VanDerWaalsContact OD1-CB 3.27Å; N590-I592 WeakPolarHBondContact OD1-CB 3.45Å; N590-I592 WeakPolarHBondContact OD1-CG1 3.44Å; N590-I592 PolarHBondContact OD1-N 3.43Å; I592-R595 PolarHBondContact O-N 2.99Å; I592-A596 WeakPolarHBondContact O-CB 3.49Å; I592-A596 PolarHBondContact O-N 2.7Å; I592-M636 HydrophobicContact CG2-CE 3.53Å; I592-M636 HydrophobicContact CG2-SD 4.07Å; I592-T639 HydrophobicContact CG1-CG2 3.59Å; I592-V640 HydrophobicContact CD1-CG2 4.2Å; I592-V640 HydrophobicContact CG1-CG2 4.14Å; I592-V640 HydrophobicContact CG2-CG2 4.39Å; I592-F643 HydrophobicContact CD1-CB 4.13Å; I592-F643 HydrophobicContact CD1-CD1 4.27Å; I592-F643 HydrophobicContact CD1-CG 4.07Å; I592-C709 HydrophobicContact CD1-CB 4.39Å; I592-C709 HydrophobicContact CG2-CB 4.43Å; I592-F720 HydrophobicContact CD1-CE1 4.37Å
593	V	90	Very high	84.5	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.012	24%	0.235	C	C	.	.	H	α-helix	trans	-65.4	-43.9	-178.6	178.2	0	0	0	0	111.1	A581 W584 N590 R595 A596 K597	A581-V593 HydrophobicContact CB-CG1 4.23Å; W584-V593 HydrophobicContact CB-CG2 3.43Å; W584-V593 VanDerWaalsContact CB-CG2 3.43Å; W584-V593 HydrophobicContact CD2-CG2 3.72Å; W584-V593 HydrophobicContact CE3-CG2 3.87Å; W584-V593 HydrophobicContact CG-CG2 3.59Å; N590-V593 HydrophobicContact CB-CB 4.35Å; N590-V593 HydrophobicContact CB-CG2 4.01Å; N590-V593 PolarHBondContact O-N 2.93Å; N590-V593 VanDerWaalsContact O-N 3.16Å; V593-R595 VanDerWaalsContact C-N 3.35Å; V593-R595 PolarHBondContact O-N 3.05Å; V593-A596 PolarHBondContact O-N 3.3Å; V593-K597 HydrophobicContact CG1-CD 4.35Å; V593-K597 WeakPolarHBondContact O-CG 3.48Å; V593-K597 PolarHBondContact O-N 2.9Å
594	K	91.2	Very high	85.2	Confident	101 Å²	101	46.4 Å²	46.4	44%	0.439	23%	0.229	S	C	.	.	H	α-helix	trans	-59	-46.1	176.8	-76.8	172.7	174.4	156.8	0	111.7	E589 N590 S598	E589-K594 WeakPolarHBondContact O-CE 3.22Å; E589-K594 PolarHBondContact O-NZ 3.36Å; N590-K594 PolarHBondContact O-N 3.25Å; K594-S598 VanDerWaalsContact O-CB 3.3Å; K594-S598 WeakPolarHBondContact O-CB 3.28Å; K594-S598 PolarHBondContact O-N 3.27Å
595	R	93.2	Very high	85.9	Confident	44 Å²	44	47.9 Å²	47.9	17%	0.166	24%	0.237	C	C	.	.	H	α-helix	trans	-67	-42.3	178.4	-73.1	165.1	179.1	63.5	-4.7	111.4	D591 I592 V593 K597 S598 M599 K635 M636 T639	D591-R595 VanDerWaalsContact CG-NH1 3.25Å; D591-R595 WeakPolarHBondContact O-CB 3.34Å; D591-R595 VanDerWaalsContact O-CD 3.27Å; D591-R595 WeakPolarHBondContact O-CD 3.5Å; D591-R595 WeakPolarHBondContact O-CG 3.09Å; D591-R595 PolarHBondContact O-N 3.38Å; D591-R595 VanDerWaalsContact O-N 3.09Å; D591-R595 PolarHBondContact O-NH1 3.43Å; D591-R595 IonicContact OD1-CZ 3.52Å; D591-R595 IonicContact OD1-NH1 3.15Å; D591-R595 PolarHBondContact OD1-NH1 2.99Å; D591-R595 IonicContact OD1-NH2 2.67Å; I592-R595 PolarHBondContact O-N 2.99Å; V593-R595 VanDerWaalsContact C-N 3.35Å; V593-R595 PolarHBondContact O-N 3.05Å; R595-K597 PolarHBondContact O-N 3.37Å; R595-S598 WeakPolarHBondContact O-CB 3.44Å; R595-S598 PolarHBondContact O-N 3.23Å; R595-M599 WeakPolarHBondContact O-CB 3.34Å; R595-M599 VanDerWaalsContact O-CG 3.28Å; R595-M599 WeakPolarHBondContact O-CG 3.42Å; R595-M599 PolarHBondContact O-N 3.06Å; R595-K635 PolarHBondContact NE-O 3.23Å; R595-M636 HydrophobicContact CB-CB 4.32Å; R595-M636 HydrophobicContact CB-SD 3.88Å; R595-T639 VanDerWaalsContact CZ-OG1 3.26Å; R595-T639 PolarHBondContact NE-OG1 2.85Å; R595-T639 VanDerWaalsContact NE-OG1 3.11Å; R595-T639 PolarHBondContact NH2-OG1 3.48Å
596	A	93.5	Very high	87.6	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-57.9	-48.5	175.7	0	0	0	0	0	112.5	V577 I592 V593 S598 M599 S600 V706	V577-A596 HydrophobicContact CG1-CB 3.91Å; I592-A596 WeakPolarHBondContact O-CB 3.49Å; I592-A596 PolarHBondContact O-N 2.7Å; V593-A596 PolarHBondContact O-N 3.3Å; A596-S598 PolarHBondContact O-N 3.19Å; A596-M599 PolarHBondContact O-N 3.09Å; A596-S600 WeakPolarHBondContact O-CB 3.19Å; A596-S600 PolarHBondContact O-N 3.35Å; A596-V706 HydrophobicContact CB-CG2 3.66Å
597	K	93.1	Very high	89.2	Confident	86 Å²	86	42.6 Å²	42.6	37%	0.374	21%	0.21	S	C	.	.	H	α-helix	trans	-64.6	-38.6	176.3	-71.6	-175.1	176.8	-174.9	0	112.6	A581 V593 R595 S600 S601	A581-K597 HydrophobicContact CB-CG 4.13Å; V593-K597 HydrophobicContact CG1-CD 4.35Å; V593-K597 WeakPolarHBondContact O-CG 3.48Å; V593-K597 PolarHBondContact O-N 2.9Å; R595-K597 PolarHBondContact O-N 3.37Å; K597-S600 PolarHBondContact O-N 2.97Å; K597-S601 PolarHBondContact O-N 3.32Å
598	S	94.7	Very high	90.3	Very high	43 Å²	43	39.4 Å²	39.4	30%	0.301	20%	0.199	S	C	.	.	H	α-helix	trans	-59.5	-49.9	174.4	-171.7	0	0	0	0	110.7	K594 R595 A596 S601 M602	K594-S598 VanDerWaalsContact O-CB 3.3Å; K594-S598 WeakPolarHBondContact O-CB 3.28Å; K594-S598 PolarHBondContact O-N 3.27Å; R595-S598 WeakPolarHBondContact O-CB 3.44Å; R595-S598 PolarHBondContact O-N 3.23Å; A596-S598 PolarHBondContact O-N 3.19Å; S598-S601 PolarHBondContact O-N 3.35Å; S598-M602 WeakPolarHBondContact O-CE 3.5Å; S598-M602 WeakPolarHBondContact O-CG 3.42Å; S598-M602 PolarHBondContact O-N 3.2Å; S598-M602 VanDerWaalsContact O-N 3.09Å; S598-M602 WeakPolarHBondContact OG-CE 3.44Å
599	M	96.4	Very high	91.9	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62	-44.4	176.6	-68.8	-176.3	71.6	0	0	112.2	R595 A596 S601 M602 A603 F629 E632 A633 M636 I702	R595-M599 WeakPolarHBondContact O-CB 3.34Å; R595-M599 VanDerWaalsContact O-CG 3.28Å; R595-M599 WeakPolarHBondContact O-CG 3.42Å; R595-M599 PolarHBondContact O-N 3.06Å; A596-M599 PolarHBondContact O-N 3.09Å; M599-S601 PolarHBondContact O-N 3.5Å; M599-M602 HydrophobicContact CG-CE 4.47Å; M599-M602 PolarHBondContact O-N 3.16Å; M599-A603 WeakPolarHBondContact O-CB 3.4Å; M599-A603 PolarHBondContact O-N 3.45Å; M599-F629 HydrophobicContact CB-CD2 4.31Å; M599-F629 HydrophobicContact CB-CE2 3.78Å; M599-F629 HydrophobicContact CB-CZ 4.47Å; M599-F629 HydrophobicContact CE-CD1 4.34Å; M599-F629 HydrophobicContact CE-CD2 4.36Å; M599-F629 HydrophobicContact CE-CE1 3.79Å; M599-F629 HydrophobicContact CE-CE2 3.82Å; M599-F629 HydrophobicContact CE-CZ 3.5Å; M599-F629 HydrophobicContact CG-CE2 4.32Å; M599-F629 VanDerWaalsContact O-CE2 3.31Å; M599-F629 WeakPolarHBondContact O-CE2 3.48Å; M599-E632 HydrophobicContact CG-CB 4.03Å; M599-E632 HydrophobicContact CG-CG 3.85Å; M599-A633 HydrophobicContact CE-CB 3.5Å; M599-A633 HydrophobicContact SD-CB 4.14Å; M599-M636 HydrophobicContact SD-CB 4.35Å; M599-I702 HydrophobicContact CE-CB 4.47Å; M599-I702 HydrophobicContact CE-CD1 3.61Å; M599-I702 HydrophobicContact CE-CG1 3.49Å; M599-I702 VanDerWaalsContact CE-CG1 3.49Å; M599-I702 HydrophobicContact CE-CG2 4.46Å; M599-I702 HydrophobicContact SD-CD1 3.7Å; M599-I702 HydrophobicContact SD-CG1 4.09Å; M599-I702 HydrophobicContact SD-CG2 4.28Å
600	S	95.5	Very high	93	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.014	16%	0.164	C	C	.	.	H	α-helix	trans	-55.7	-48	175.4	-179.2	0	0	0	0	112.3	T574 D578 A596 K597 M602 A603 Y604	T574-S600 WeakPolarHBondContact CB-OG 3.25Å; T574-S600 WeakPolarHBondContact CG2-O 3.35Å; T574-S600 PolarHBondContact O-OG 3.49Å; D578-S600 WeakPolarHBondContact OD1-CB 3.47Å; D578-S600 PolarHBondContact OD1-OG 3.28Å; D578-S600 PolarHBondContact OD2-OG 2.76Å; A596-S600 WeakPolarHBondContact O-CB 3.19Å; A596-S600 PolarHBondContact O-N 3.35Å; K597-S600 PolarHBondContact O-N 2.97Å; S600-M602 VanDerWaalsContact C-N 3.35Å; S600-M602 PolarHBondContact O-N 3.39Å; S600-A603 PolarHBondContact O-N 3.05Å; S600-Y604 WeakPolarHBondContact O-CB 3.31Å; S600-Y604 PolarHBondContact O-N 3.47Å
601	S	96.2	Very high	93.1	Very high	70 Å²	70	38.4 Å²	38.4	49%	0.49	18%	0.183	S	C	.	.	H	α-helix	trans	-60.3	-42.8	177.4	-175.3	0	0	0	0	112.7	K597 S598 M599 Y604 N605	K597-S601 PolarHBondContact O-N 3.32Å; S598-S601 PolarHBondContact O-N 3.35Å; M599-S601 PolarHBondContact O-N 3.5Å; S601-Y604 PolarHBondContact O-N 3.39Å; S601-N605 PolarHBondContact O-N 3.34Å; S601-N605 VanDerWaalsContact O-N 3.08Å; S601-N605 PolarHBondContact O-ND2 3.37Å
602	M	96.9	Very high	92.7	Very high	21 Å²	21	37.8 Å²	37.8	10%	0.103	19%	0.192	C	C	.	.	H	α-helix	trans	-64.9	-47	177.8	-69.5	-169.1	-97.1	0	0	112	S598 M599 S600 Y604 N605 M606 Q625 F628 F629 E632	S598-M602 WeakPolarHBondContact O-CE 3.5Å; S598-M602 WeakPolarHBondContact O-CG 3.42Å; S598-M602 PolarHBondContact O-N 3.2Å; S598-M602 VanDerWaalsContact O-N 3.09Å; S598-M602 WeakPolarHBondContact OG-CE 3.44Å; M599-M602 HydrophobicContact CG-CE 4.47Å; M599-M602 PolarHBondContact O-N 3.16Å; S600-M602 VanDerWaalsContact C-N 3.35Å; S600-M602 PolarHBondContact O-N 3.39Å; M602-Y604 VanDerWaalsContact C-N 3.31Å; M602-Y604 PolarHBondContact O-N 3.47Å; M602-N605 PolarHBondContact O-N 2.91Å; M602-M606 WeakPolarHBondContact O-CG 3.41Å; M602-M606 PolarHBondContact O-N 2.85Å; M602-M606 VanDerWaalsContact O-N 3.11Å; M602-Q625 PolarHBondContact SD-NE2 3.11Å; M602-F628 HydrophobicContact SD-CB 4.01Å; M602-F629 HydrophobicContact CB-CD2 3.86Å; M602-F629 HydrophobicContact SD-CB 4.46Å; M602-E632 HydrophobicContact CE-CB 3.55Å; M602-E632 HydrophobicContact CE-CG 3.67Å
603	A	96.6	Very high	92.1	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63.5	-36	176.2	0	0	0	0	0	112	M570 T574 M599 S600 N605 M606 Y607 F629 M699	M570-A603 WeakPolarHBondContact CE-O 3.49Å; M570-A603 HydrophobicContact CG-CB 4.14Å; M570-A603 HydrophobicContact SD-CB 4.19Å; T574-A603 HydrophobicContact CG2-CB 3.6Å; M599-A603 WeakPolarHBondContact O-CB 3.4Å; M599-A603 PolarHBondContact O-N 3.45Å; S600-A603 PolarHBondContact O-N 3.05Å; A603-N605 PolarHBondContact O-N 3.34Å; A603-M606 WeakPolarHBondContact O-CB 3.46Å; A603-M606 PolarHBondContact O-N 3.15Å; A603-Y607 PolarHBondContact O-N 3.29Å; A603-F629 HydrophobicContact CB-CE2 3.88Å; A603-F629 HydrophobicContact CB-CZ 4.49Å; A603-M699 HydrophobicContact CB-CG 4.45Å; A603-M699 HydrophobicContact CB-SD 4.22Å
604	Y	96	Very high	91.8	Very high	96 Å²	96	43.4 Å²	43.4	38%	0.376	23%	0.229	S	C	.	.	H	α-helix	trans	-64	-40.6	175	-175.4	-105.4	0	0	0	112	K571 S600 S601 M602 M606 Y607 L608	K571-Y604 HydrophobicContact CG-CD2 4.36Å; K571-Y604 HydrophobicContact CG-CE2 4.28Å; S600-Y604 WeakPolarHBondContact O-CB 3.31Å; S600-Y604 PolarHBondContact O-N 3.47Å; S601-Y604 PolarHBondContact O-N 3.39Å; M602-Y604 VanDerWaalsContact C-N 3.31Å; M602-Y604 PolarHBondContact O-N 3.47Å; Y604-M606 VanDerWaalsContact C-N 3.32Å; Y604-M606 PolarHBondContact O-N 3.41Å; Y604-Y607 AromaticContact CD2-CD1 3.84Å; Y604-Y607 HydrophobicContact CD2-CD1 3.84Å; Y604-Y607 HydrophobicContact CD2-CE1 4.44Å; Y604-Y607 AromaticContact CE2-CD1 3.71Å; Y604-Y607 HydrophobicContact CE2-CD1 3.71Å; Y604-Y607 AromaticContact CE2-CE1 3.85Å; Y604-Y607 HydrophobicContact CE2-CE1 3.85Å; Y604-Y607 WeakPolarHBondContact O-CB 3.38Å; Y604-Y607 PolarHBondContact O-N 3.37Å; Y604-L608 HydrophobicContact CD1-CD1 3.99Å; Y604-L608 HydrophobicContact CD1-CG 4.26Å; Y604-L608 HydrophobicContact CE1-CD1 3.62Å; Y604-L608 HydrophobicContact CE1-CD2 4.22Å; Y604-L608 HydrophobicContact CE1-CG 3.94Å; Y604-L608 WeakPolarHBondContact O-CG 3.46Å; Y604-L608 PolarHBondContact O-N 3.05Å
605	N	95.1	Very high	91.6	Very high	34 Å²	34	42.4 Å²	42.4	18%	0.182	23%	0.232	C	C	.	.	H	α-helix	trans	-63.2	-38.1	173.5	-72.8	-30.6	0	0	0	112.1	S601 M602 A603 Y607 L608 F609 P615 L616	S601-N605 PolarHBondContact O-N 3.34Å; S601-N605 VanDerWaalsContact O-N 3.08Å; S601-N605 PolarHBondContact O-ND2 3.37Å; M602-N605 PolarHBondContact O-N 2.91Å; A603-N605 PolarHBondContact O-N 3.34Å; N605-Y607 VanDerWaalsContact C-N 3.34Å; N605-L608 PolarHBondContact O-N 3.47Å; N605-F609 PolarHBondContact O-N 2.82Å; N605-P615 HydrophobicContact CB-CG 4.12Å; N605-P615 WeakPolarHBondContact OD1-CD 3.44Å; N605-P615 WeakPolarHBondContact OD1-CG 3.41Å; N605-L616 HydrophobicContact CB-CD1 4.17Å; N605-L616 HydrophobicContact CB-CG 4.34Å; N605-L616 WeakPolarHBondContact O-CD1 3.36Å
606	M	96.4	Very high	91.5	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65.9	-35.9	173.4	-62.6	-178.8	66.7	0	0	111.7	M570 M602 A603 Y604 F609 T610 L616 L622 Q625 A626 V691 I692 T695	M570-M606 HydrophobicContact CE-CB 3.64Å; M570-M606 HydrophobicContact SD-CB 4.24Å; M602-M606 WeakPolarHBondContact O-CG 3.41Å; M602-M606 PolarHBondContact O-N 2.85Å; M602-M606 VanDerWaalsContact O-N 3.11Å; A603-M606 WeakPolarHBondContact O-CB 3.46Å; A603-M606 PolarHBondContact O-N 3.15Å; Y604-M606 VanDerWaalsContact C-N 3.32Å; Y604-M606 PolarHBondContact O-N 3.41Å; M606-F609 WeakPolarHBondContact O-CB 3.5Å; M606-F609 PolarHBondContact O-N 2.99Å; M606-T610 WeakPolarHBondContact O-CG2 3.46Å; M606-T610 PolarHBondContact O-N 3.13Å; M606-L616 HydrophobicContact CG-CD1 4.17Å; M606-L622 HydrophobicContact CB-CD1 3.9Å; M606-L622 HydrophobicContact CE-CD1 3.69Å; M606-L622 HydrophobicContact CE-CG 4.25Å; M606-L622 HydrophobicContact CG-CD1 3.78Å; M606-Q625 HydrophobicContact CG-CB 4.36Å; M606-Q625 HydrophobicContact CG-CG 3.75Å; M606-Q625 HydrophobicContact SD-CG 4.22Å; M606-A626 HydrophobicContact CE-CB 3.93Å; M606-A626 HydrophobicContact SD-CB 4.43Å; M606-V691 HydrophobicContact CE-CG1 3.78Å; M606-I692 HydrophobicContact CB-CD1 4.21Å; M606-I692 HydrophobicContact CE-CD1 4.16Å; M606-T695 HydrophobicContact CE-CG2 4.02Å; M606-T695 VanDerWaalsContact CE-OG1 3.27Å; M606-T695 WeakPolarHBondContact CE-OG1 3.33Å; M606-T695 HydrophobicContact SD-CG2 3.7Å
607	Y	93.7	Very high	91	Very high	23 Å²	23	48 Å²	48	9%	0.09	26%	0.259	C	S	.	.	H	α-helix	trans	-63	-47.9	171.2	151.7	-107.2	0	0	0	111	G567 K571 A603 Y604 N605 F609 T610 R611	G567-Y607 VanDerWaalsContact C-CD2 3.47Å; G567-Y607 WeakPolarHBondContact O-CD2 3.39Å; K571-Y607 HydrophobicContact CB-CD1 4.07Å; K571-Y607 HydrophobicContact CB-CD2 3.96Å; K571-Y607 HydrophobicContact CB-CE1 4.38Å; K571-Y607 HydrophobicContact CB-CE2 4.23Å; K571-Y607 HydrophobicContact CB-CG 3.84Å; K571-Y607 HydrophobicContact CD-CD1 4.27Å; K571-Y607 HydrophobicContact CD-CE1 3.78Å; K571-Y607 HydrophobicContact CD-CE2 4.2Å; K571-Y607 HydrophobicContact CG-CD1 3.99Å; K571-Y607 HydrophobicContact CG-CE1 4Å; K571-Y607 HydrophobicContact CG-CG 4.29Å; A603-Y607 PolarHBondContact O-N 3.29Å; Y604-Y607 AromaticContact CD2-CD1 3.84Å; Y604-Y607 HydrophobicContact CD2-CD1 3.84Å; Y604-Y607 HydrophobicContact CD2-CE1 4.44Å; Y604-Y607 AromaticContact CE2-CD1 3.71Å; Y604-Y607 HydrophobicContact CE2-CD1 3.71Å; Y604-Y607 AromaticContact CE2-CE1 3.85Å; Y604-Y607 HydrophobicContact CE2-CE1 3.85Å; Y604-Y607 WeakPolarHBondContact O-CB 3.38Å; Y604-Y607 PolarHBondContact O-N 3.37Å; N605-Y607 VanDerWaalsContact C-N 3.34Å; Y607-F609 PolarHBondContact O-N 3.1Å; Y607-T610 WeakPolarHBondContact O-CB 3.2Å; Y607-T610 PolarHBondContact O-N 3.39Å; Y607-T610 PolarHBondContact O-OG1 3.15Å; Y607-R611 HydrophobicContact CD2-CG 4.21Å; Y607-R611 HydrophobicContact CE2-CG 3.59Å; Y607-R611 PolarHBondContact O-N 3.03Å
608	L	90.3	Very high	90.8	Very high	31 Å²	31	47.1 Å²	47.1	16%	0.162	26%	0.26	C	S	.	.	H	α-helix	trans	-58.3	-37.5	179.2	-69.2	178.8	0	0	0	111.6	Y604 N605 T610 R611 G612 N613	Y604-L608 HydrophobicContact CD1-CD1 3.99Å; Y604-L608 HydrophobicContact CD1-CG 4.26Å; Y604-L608 HydrophobicContact CE1-CD1 3.62Å; Y604-L608 HydrophobicContact CE1-CD2 4.22Å; Y604-L608 HydrophobicContact CE1-CG 3.94Å; Y604-L608 WeakPolarHBondContact O-CG 3.46Å; Y604-L608 PolarHBondContact O-N 3.05Å; N605-L608 PolarHBondContact O-N 3.47Å; L608-T610 VanDerWaalsContact C-N 3.33Å; L608-T610 PolarHBondContact O-N 3.37Å; L608-R611 CarbonylContact O-C 3.6Å; L608-R611 WeakPolarHBondContact O-CA 3.19Å; L608-R611 WeakPolarHBondContact O-CB 3.48Å; L608-R611 PolarHBondContact O-N 3Å; L608-G612 PolarHBondContact O-N 3.2Å; L608-N613 CarbonylContact C-O 3.54Å; L608-N613 HydrophobicContact CB-CB 4.38Å; L608-N613 WeakPolarHBondContact CB-O 3.26Å; L608-N613 HydrophobicContact CD2-CB 4.38Å; L608-N613 CarbonylContact O-C 3.33Å; L608-N613 WeakPolarHBondContact O-CA 3.22Å; L608-N613 PolarHBondContact O-N 3.34Å
609	F	91.7	Very high	90.6	Very high	40 Å²	40	46.3 Å²	46.3	18%	0.175	26%	0.256	C	S	.	.	H	α-helix	trans	-56.3	-44.3	173.3	177.4	-92.4	0	0	0	112.3	N605 M606 Y607 R611 G612 N613 L616 T618 L622 V688	N605-F609 PolarHBondContact O-N 2.82Å; M606-F609 WeakPolarHBondContact O-CB 3.5Å; M606-F609 PolarHBondContact O-N 2.99Å; Y607-F609 PolarHBondContact O-N 3.1Å; F609-R611 PolarHBondContact O-N 2.65Å; F609-R611 VanDerWaalsContact O-N 3.11Å; F609-G612 PolarHBondContact O-N 3.37Å; F609-N613 PolarHBondContact N-O 3Å; F609-L616 HydrophobicContact CB-CB 4.14Å; F609-L616 HydrophobicContact CB-CD1 4.18Å; F609-L616 HydrophobicContact CD2-CB 3.87Å; F609-L616 HydrophobicContact CG-CB 4.39Å; F609-T618 WeakPolarHBondContact CE2-O 3.44Å; F609-L622 HydrophobicContact CB-CD1 4.29Å; F609-L622 HydrophobicContact CD1-CB 4.38Å; F609-L622 HydrophobicContact CD1-CD1 3.86Å; F609-L622 HydrophobicContact CD1-CD2 3.94Å; F609-L622 HydrophobicContact CD1-CG 4.28Å; F609-L622 HydrophobicContact CE1-CB 4.3Å; F609-L622 HydrophobicContact CE1-CD1 4.45Å; F609-L622 HydrophobicContact CE1-CD2 3.74Å; F609-L622 HydrophobicContact CE1-CG 4.39Å; F609-L622 HydrophobicContact CE2-CB 4.44Å; F609-L622 HydrophobicContact CG-CD1 4.09Å; F609-L622 HydrophobicContact CZ-CB 4.32Å; F609-L622 HydrophobicContact CZ-CD2 4.42Å; F609-V688 HydrophobicContact CE1-CG1 3.99Å
610	T	89.6	Confident	90.3	Very high	20 Å²	20	52.5 Å²	52.5	12%	0.123	29%	0.285	C	S	.	.	H	α-helix	trans	-61.7	-20	176.2	71.4	0	0	0	0	113.6	I563 M606 Y607 L608 I692	I563-T610 HydrophobicContact CG2-CG2 3.58Å; M606-T610 WeakPolarHBondContact O-CG2 3.46Å; M606-T610 PolarHBondContact O-N 3.13Å; Y607-T610 WeakPolarHBondContact O-CB 3.2Å; Y607-T610 PolarHBondContact O-N 3.39Å; Y607-T610 PolarHBondContact O-OG1 3.15Å; L608-T610 VanDerWaalsContact C-N 3.33Å; L608-T610 PolarHBondContact O-N 3.37Å; T610-I692 HydrophobicContact CG2-CD1 3.76Å; T610-I692 HydrophobicContact CG2-CG1 4.09Å; T610-I692 HydrophobicContact CG2-CG2 4.3Å
611	R	85.5	Confident	90.1	Very high	126 Å²	126	54.9 Å²	54.9	48%	0.475	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	7.1	177.1	-59	-71.9	-81	179	-3.9	112.6	Y607 L608 F609 N613	Y607-R611 HydrophobicContact CD2-CG 4.21Å; Y607-R611 HydrophobicContact CE2-CG 3.59Å; Y607-R611 PolarHBondContact O-N 3.03Å; L608-R611 CarbonylContact O-C 3.6Å; L608-R611 WeakPolarHBondContact O-CA 3.19Å; L608-R611 WeakPolarHBondContact O-CB 3.48Å; L608-R611 PolarHBondContact O-N 3Å; F609-R611 PolarHBondContact O-N 2.65Å; F609-R611 VanDerWaalsContact O-N 3.11Å; R611-N613 PolarHBondContact O-N 3.17Å; R611-N613 PolarHBondContact O-ND2 3.28Å; R611-N613 VanDerWaalsContact O-ND2 3.08Å
612	G	80.6	Confident	90	Very high	53 Å²	53	51.6 Å²	51.6	55%	0.546	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	68	19.2	-175.3	0	0	0	0	0	114.3	L608 F609	L608-G612 PolarHBondContact O-N 3.2Å; F609-G612 PolarHBondContact O-N 3.37Å
613	N	78.2	Confident	89.9	Confident	96 Å²	96	51.8 Å²	51.8	51%	0.513	28%	0.275	S	S	.	.			trans	-120	176.7	-174.9	-76	-58	0	0	0	111.5	L608 F609 R611	L608-N613 CarbonylContact C-O 3.54Å; L608-N613 HydrophobicContact CB-CB 4.38Å; L608-N613 WeakPolarHBondContact CB-O 3.26Å; L608-N613 HydrophobicContact CD2-CB 4.38Å; L608-N613 CarbonylContact O-C 3.33Å; L608-N613 WeakPolarHBondContact O-CA 3.22Å; L608-N613 PolarHBondContact O-N 3.34Å; F609-N613 PolarHBondContact N-O 3Å; R611-N613 PolarHBondContact O-N 3.17Å; R611-N613 PolarHBondContact O-ND2 3.28Å; R611-N613 VanDerWaalsContact O-ND2 3.08Å
614	G	83.2	Confident	89.9	Confident	26 Å²	26	53.7 Å²	53.7	27%	0.268	29%	0.287	S	S	.	.	S	Bend	trans	82.5	-171.4	173.1	0	0	0	0	0	114.6	K617	G614-K617 WeakPolarHBondContact O-CE 3.37Å; G614-K617 PolarHBondContact O-NZ 2.91Å
615	P	88	Confident	89.9	Confident	79 Å²	79	50.5 Å²	50.5	51%	0.513	28%	0.275	S	S	.	.	S	Bend	trans	-78	-26.3	-171.2	29.4	-33.9	0	0	0	113.5	N605 K617	N605-P615 HydrophobicContact CB-CG 4.12Å; N605-P615 WeakPolarHBondContact OD1-CD 3.44Å; N605-P615 WeakPolarHBondContact OD1-CG 3.41Å; P615-K617 PolarHBondContact O-N 3.21Å
616	L	89.8	Confident	89.9	Confident	15 Å²	15	48.9 Å²	48.9	8%	0.079	27%	0.266	C	S	.	.			trans	-77.6	120.3	179.6	-48.8	177.9	0	0	0	109	N605 M606 F609 D621 L622 Q625	N605-L616 HydrophobicContact CB-CD1 4.17Å; N605-L616 HydrophobicContact CB-CG 4.34Å; N605-L616 WeakPolarHBondContact O-CD1 3.36Å; M606-L616 HydrophobicContact CG-CD1 4.17Å; F609-L616 HydrophobicContact CB-CB 4.14Å; F609-L616 HydrophobicContact CB-CD1 4.18Å; F609-L616 HydrophobicContact CD2-CB 3.87Å; F609-L616 HydrophobicContact CG-CB 4.39Å; L616-D621 HydrophobicContact CB-CB 4.04Å; L616-D621 HydrophobicContact CD2-CB 3.99Å; L616-L622 HydrophobicContact CD1-CD1 4.17Å; L616-Q625 HydrophobicContact CD1-CB 4.02Å; L616-Q625 HydrophobicContact CD1-CG 4Å; L616-Q625 HydrophobicContact CD2-CB 4.01Å; L616-Q625 HydrophobicContact CD2-CG 4.29Å
617	K	83.5	Confident	89.9	Confident	148 Å²	148	52.2 Å²	52.2	64%	0.643	28%	0.282	S	S	*	.			trans	-109.5	-21.4	-174.7	-60.9	-52.7	-172.6	-168.8	0	113.1	G614 P615 D621	G614-K617 WeakPolarHBondContact O-CE 3.37Å; G614-K617 PolarHBondContact O-NZ 2.91Å; P615-K617 PolarHBondContact O-N 3.21Å; K617-D621 WeakPolarHBondContact CA-OD2 2.98Å; K617-D621 PolarHBondContact N-OD2 3.34Å
618	T	89.3	Confident	90	Very high	66 Å²	66	56.3 Å²	56.3	41%	0.405	30%	0.3	S	S	.	.	S	Bend	trans	-130	158.8	-174.2	69.9	0	0	0	0	111.1	F609 H620 D621 L622	F609-T618 WeakPolarHBondContact CE2-O 3.44Å; T618-H620 PolarHBondContact O-N 3.48Å; T618-H620 PolarHBondContact OG1-N 2.88Å; T618-D621 PolarHBondContact N-OD2 3.13Å; T618-D621 WeakPolarHBondContact O-CB 3.47Å; T618-D621 PolarHBondContact O-N 3.06Å; T618-D621 VanDerWaalsContact O-N 3.07Å; T618-D621 PolarHBondContact OG1-N 3.49Å; T618-D621 VanDerWaalsContact OG1-N 3.09Å; T618-D621 PolarHBondContact OG1-OD1 3.12Å; T618-D621 PolarHBondContact OG1-OD2 2.96Å; T618-L622 PolarHBondContact O-N 3.48Å; T618-L622 VanDerWaalsContact O-N 3.15Å
619	A	89.6	Confident	90.3	Very high	27 Å²	27	54.8 Å²	54.8	22%	0.223	29%	0.292	C	S	.	.	H	α-helix	trans	-58.9	-30.8	171.9	0	0	0	0	0	111.8	L622 F623 T684 V688	A619-L622 WeakPolarHBondContact O-CB 3.44Å; A619-L622 PolarHBondContact O-N 2.9Å; A619-F623 HydrophobicContact CB-CE2 4.2Å; A619-F623 HydrophobicContact CB-CZ 4.23Å; A619-F623 WeakPolarHBondContact O-CD1 3.15Å; A619-F623 WeakPolarHBondContact O-CD2 3.27Å; A619-F623 WeakPolarHBondContact O-CG 3.3Å; A619-F623 PolarHBondContact O-N 3.01Å; A619-T684 HydrophobicContact CB-CG2 4Å; A619-V688 HydrophobicContact CB-CG2 4.04Å
620	H	89.9	Confident	90.5	Very high	129 Å²	129	52.9 Å²	52.9	60%	0.597	28%	0.284	S	S	*	.	H	α-helix	trans	-62.7	-45.6	172.8	-178.1	-74.2	0	0	0	111.6	T618 L622 F623 T624	T618-H620 PolarHBondContact O-N 3.48Å; T618-H620 PolarHBondContact OG1-N 2.88Å; H620-L622 VanDerWaalsContact C-N 3.27Å; H620-L622 PolarHBondContact O-N 2.95Å; H620-F623 PolarHBondContact O-N 3.28Å; H620-F623 VanDerWaalsContact O-N 3.16Å; H620-T624 PolarHBondContact CE1-OG1 2.97Å; H620-T624 PolarHBondContact O-N 3.45Å; H620-T624 PolarHBondContact O-OG1 3.02Å
621	D	92	Very high	90.8	Very high	53 Å²	53	56.7 Å²	56.7	28%	0.283	30%	0.3	S	S	.	.	H	α-helix	trans	-59.6	-40.6	176.5	-53.3	-34.6	0	0	0	111.3	L616 K617 T618 T624 Q625	L616-D621 HydrophobicContact CB-CB 4.04Å; L616-D621 HydrophobicContact CD2-CB 3.99Å; K617-D621 WeakPolarHBondContact CA-OD2 2.98Å; K617-D621 PolarHBondContact N-OD2 3.34Å; T618-D621 PolarHBondContact N-OD2 3.13Å; T618-D621 WeakPolarHBondContact O-CB 3.47Å; T618-D621 PolarHBondContact O-N 3.06Å; T618-D621 VanDerWaalsContact O-N 3.07Å; T618-D621 PolarHBondContact OG1-N 3.49Å; T618-D621 VanDerWaalsContact OG1-N 3.09Å; T618-D621 PolarHBondContact OG1-OD1 3.12Å; T618-D621 PolarHBondContact OG1-OD2 2.96Å; D621-T624 PolarHBondContact O-N 3.27Å; D621-Q625 VanDerWaalsContact O-CB 3.31Å; D621-Q625 WeakPolarHBondContact O-CB 3.16Å; D621-Q625 PolarHBondContact O-N 2.93Å
622	L	94.7	Very high	91.3	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-60.7	-45.8	175	-177.8	75.8	0	0	0	112	M606 F609 L616 T618 A619 H620 Q625 A626 V688 V691 I692	M606-L622 HydrophobicContact CB-CD1 3.9Å; M606-L622 HydrophobicContact CE-CD1 3.69Å; M606-L622 HydrophobicContact CE-CG 4.25Å; M606-L622 HydrophobicContact CG-CD1 3.78Å; F609-L622 HydrophobicContact CB-CD1 4.29Å; F609-L622 HydrophobicContact CD1-CB 4.38Å; F609-L622 HydrophobicContact CD1-CD1 3.86Å; F609-L622 HydrophobicContact CD1-CD2 3.94Å; F609-L622 HydrophobicContact CD1-CG 4.28Å; F609-L622 HydrophobicContact CE1-CB 4.3Å; F609-L622 HydrophobicContact CE1-CD1 4.45Å; F609-L622 HydrophobicContact CE1-CD2 3.74Å; F609-L622 HydrophobicContact CE1-CG 4.39Å; F609-L622 HydrophobicContact CE2-CB 4.44Å; F609-L622 HydrophobicContact CG-CD1 4.09Å; F609-L622 HydrophobicContact CZ-CB 4.32Å; F609-L622 HydrophobicContact CZ-CD2 4.42Å; L616-L622 HydrophobicContact CD1-CD1 4.17Å; T618-L622 PolarHBondContact O-N 3.48Å; T618-L622 VanDerWaalsContact O-N 3.15Å; A619-L622 WeakPolarHBondContact O-CB 3.44Å; A619-L622 PolarHBondContact O-N 2.9Å; H620-L622 VanDerWaalsContact C-N 3.27Å; H620-L622 PolarHBondContact O-N 2.95Å; L622-Q625 PolarHBondContact O-N 2.99Å; L622-A626 WeakPolarHBondContact O-CB 3.36Å; L622-A626 PolarHBondContact O-N 3.13Å; L622-V688 HydrophobicContact CD2-CB 4.25Å; L622-V688 HydrophobicContact CD2-CG1 3.68Å; L622-V688 HydrophobicContact CD2-CG2 4.07Å; L622-V691 HydrophobicContact CD2-CG1 4.47Å; L622-V691 HydrophobicContact CG-CG1 4.49Å; L622-I692 HydrophobicContact CD1-CD1 3.8Å; L622-I692 HydrophobicContact CD2-CD1 4.14Å; L622-I692 HydrophobicContact CD2-CG1 4.35Å
623	F	95.1	Very high	92.1	Very high	25 Å²	25	49.4 Å²	49.4	11%	0.11	26%	0.258	C	S	.	.	H	α-helix	trans	-64	-46.2	179.2	-64.8	-19.4	0	0	0	111.5	A619 H620 Q625 A626 E627 V674 K687 V688 V691	A619-F623 HydrophobicContact CB-CE2 4.2Å; A619-F623 HydrophobicContact CB-CZ 4.23Å; A619-F623 WeakPolarHBondContact O-CD1 3.15Å; A619-F623 WeakPolarHBondContact O-CD2 3.27Å; A619-F623 WeakPolarHBondContact O-CG 3.3Å; A619-F623 PolarHBondContact O-N 3.01Å; H620-F623 PolarHBondContact O-N 3.28Å; H620-F623 VanDerWaalsContact O-N 3.16Å; F623-Q625 VanDerWaalsContact C-N 3.32Å; F623-Q625 PolarHBondContact O-N 3.33Å; F623-A626 WeakPolarHBondContact O-CB 3.43Å; F623-A626 PolarHBondContact O-N 3.44Å; F623-A626 VanDerWaalsContact O-N 3.16Å; F623-E627 PolarHBondContact O-N 3.39Å; F623-V674 HydrophobicContact CB-CG1 3.76Å; F623-V674 HydrophobicContact CG-CG1 4.47Å; F623-K687 HydrophobicContact CE1-CD 4.18Å; F623-K687 HydrophobicContact CE1-CG 3.83Å; F623-K687 HydrophobicContact CE2-CD 4Å; F623-K687 HydrophobicContact CE2-CG 4.47Å; F623-K687 HydrophobicContact CZ-CB 4.27Å; F623-K687 HydrophobicContact CZ-CD 3.68Å; F623-K687 HydrophobicContact CZ-CG 3.67Å; F623-V688 HydrophobicContact CE1-CG2 3.96Å; F623-V688 HydrophobicContact CZ-CG2 3.94Å; F623-V691 HydrophobicContact CD1-CG2 4.09Å; F623-V691 HydrophobicContact CE1-CG2 4.08Å
624	T	94.9	Very high	92.9	Very high	41 Å²	41	47.1 Å²	47.1	25%	0.252	25%	0.245	S	C	.	.	H	α-helix	trans	-59.7	-41.6	173.5	-60.5	0	0	0	0	111.8	H620 D621 A626 E627 F628	H620-T624 PolarHBondContact CE1-OG1 2.97Å; H620-T624 PolarHBondContact O-N 3.45Å; H620-T624 PolarHBondContact O-OG1 3.02Å; D621-T624 PolarHBondContact O-N 3.27Å; T624-A626 VanDerWaalsContact C-N 3.32Å; T624-A626 PolarHBondContact O-N 3.5Å; T624-E627 PolarHBondContact O-N 2.66Å; T624-F628 HydrophobicContact CG2-CD2 3.92Å; T624-F628 HydrophobicContact CG2-CE2 3.46Å; T624-F628 VanDerWaalsContact CG2-CE2 3.46Å; T624-F628 HydrophobicContact CG2-CZ 4.38Å; T624-F628 WeakPolarHBondContact O-CD2 3.46Å; T624-F628 PolarHBondContact O-N 3.15Å; T624-F628 VanDerWaalsContact O-N 3.12Å
625	Q	96.1	Very high	93.4	Very high	29 Å²	29	50.4 Å²	50.4	14%	0.136	25%	0.252	C	S	.	.	H	α-helix	trans	-62.4	-39.1	175.9	-172.4	64.8	71.7	0	0	112.2	M602 M606 L616 D621 L622 F623 F628 F629	M602-Q625 PolarHBondContact SD-NE2 3.11Å; M606-Q625 HydrophobicContact CG-CB 4.36Å; M606-Q625 HydrophobicContact CG-CG 3.75Å; M606-Q625 HydrophobicContact SD-CG 4.22Å; L616-Q625 HydrophobicContact CD1-CB 4.02Å; L616-Q625 HydrophobicContact CD1-CG 4Å; L616-Q625 HydrophobicContact CD2-CB 4.01Å; L616-Q625 HydrophobicContact CD2-CG 4.29Å; D621-Q625 VanDerWaalsContact O-CB 3.31Å; D621-Q625 WeakPolarHBondContact O-CB 3.16Å; D621-Q625 PolarHBondContact O-N 2.93Å; L622-Q625 PolarHBondContact O-N 2.99Å; F623-Q625 VanDerWaalsContact C-N 3.32Å; F623-Q625 PolarHBondContact O-N 3.33Å; Q625-F628 PolarHBondContact O-N 2.88Å; Q625-F629 WeakPolarHBondContact O-CB 3.4Å; Q625-F629 PolarHBondContact O-N 3.18Å
626	A	96.6	Very high	93.8	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-68.3	-34	176.6	0	0	0	0	0	112.7	M606 L622 F623 T624 F629 A630 L670 V674 V691	M606-A626 HydrophobicContact CE-CB 3.93Å; M606-A626 HydrophobicContact SD-CB 4.43Å; L622-A626 WeakPolarHBondContact O-CB 3.36Å; L622-A626 PolarHBondContact O-N 3.13Å; F623-A626 WeakPolarHBondContact O-CB 3.43Å; F623-A626 PolarHBondContact O-N 3.44Å; F623-A626 VanDerWaalsContact O-N 3.16Å; T624-A626 VanDerWaalsContact C-N 3.32Å; T624-A626 PolarHBondContact O-N 3.5Å; A626-F629 PolarHBondContact O-N 2.93Å; A626-A630 PolarHBondContact O-N 2.76Å; A626-L670 HydrophobicContact CB-CD1 4.15Å; A626-L670 HydrophobicContact CB-CD2 4.48Å; A626-L670 HydrophobicContact CB-CG 4.43Å; A626-V674 HydrophobicContact CB-CG2 3.7Å; A626-V691 HydrophobicContact CB-CG1 3.63Å
627	E	95	Very high	94.1	Very high	69 Å²	69	48.1 Å²	48.1	32%	0.322	23%	0.233	S	C	.	.	H	α-helix	trans	-62.3	-49.9	171.2	-72.6	176.7	151.5	0	0	111.1	F623 T624 F629 A630 E631 V674	F623-E627 PolarHBondContact O-N 3.39Å; T624-E627 PolarHBondContact O-N 2.66Å; E627-F629 VanDerWaalsContact C-N 3.28Å; E627-F629 PolarHBondContact O-N 3.28Å; E627-A630 PolarHBondContact O-N 3.38Å; E627-E631 WeakPolarHBondContact O-CG 3.22Å; E627-E631 PolarHBondContact O-N 3.07Å; E627-V674 HydrophobicContact CG-CB 4.2Å; E627-V674 HydrophobicContact CG-CG1 3.54Å
628	F	96.1	Very high	94.6	Very high	109 Å²	109	49.4 Å²	49.4	48%	0.478	23%	0.234	S	C	.	.	H	α-helix	trans	-61.1	-37.8	176	-71.2	-55.4	0	0	0	112.4	M602 T624 Q625 E631 E632	M602-F628 HydrophobicContact SD-CB 4.01Å; T624-F628 HydrophobicContact CG2-CD2 3.92Å; T624-F628 HydrophobicContact CG2-CE2 3.46Å; T624-F628 VanDerWaalsContact CG2-CE2 3.46Å; T624-F628 HydrophobicContact CG2-CZ 4.38Å; T624-F628 WeakPolarHBondContact O-CD2 3.46Å; T624-F628 PolarHBondContact O-N 3.15Å; T624-F628 VanDerWaalsContact O-N 3.12Å; Q625-F628 PolarHBondContact O-N 2.88Å; F628-E631 PolarHBondContact O-N 3.4Å; F628-E632 WeakPolarHBondContact O-CB 3.38Å; F628-E632 PolarHBondContact O-N 2.72Å
629	F	97.2	Very high	94.9	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.7	-45.1	175.2	-173.6	-94.5	0	0	0	111.8	M599 M602 A603 Q625 A626 E627 E632 A633 L670 T695 L698 M699	M599-F629 HydrophobicContact CB-CD2 4.31Å; M599-F629 HydrophobicContact CB-CE2 3.78Å; M599-F629 HydrophobicContact CB-CZ 4.47Å; M599-F629 HydrophobicContact CE-CD1 4.34Å; M599-F629 HydrophobicContact CE-CD2 4.36Å; M599-F629 HydrophobicContact CE-CE1 3.79Å; M599-F629 HydrophobicContact CE-CE2 3.82Å; M599-F629 HydrophobicContact CE-CZ 3.5Å; M599-F629 HydrophobicContact CG-CE2 4.32Å; M599-F629 VanDerWaalsContact O-CE2 3.31Å; M599-F629 WeakPolarHBondContact O-CE2 3.48Å; M602-F629 HydrophobicContact CB-CD2 3.86Å; M602-F629 HydrophobicContact SD-CB 4.46Å; A603-F629 HydrophobicContact CB-CE2 3.88Å; A603-F629 HydrophobicContact CB-CZ 4.49Å; Q625-F629 WeakPolarHBondContact O-CB 3.4Å; Q625-F629 PolarHBondContact O-N 3.18Å; A626-F629 PolarHBondContact O-N 2.93Å; E627-F629 VanDerWaalsContact C-N 3.28Å; E627-F629 PolarHBondContact O-N 3.28Å; F629-E632 PolarHBondContact O-N 3.13Å; F629-A633 WeakPolarHBondContact O-CB 3.35Å; F629-A633 PolarHBondContact O-N 3.08Å; F629-L670 HydrophobicContact CD1-CD2 3.95Å; F629-T695 HydrophobicContact CD1-CG2 3.96Å; F629-T695 HydrophobicContact CE1-CG2 3.73Å; F629-T695 HydrophobicContact CE2-CG2 4.32Å; F629-T695 HydrophobicContact CG-CG2 4.34Å; F629-T695 HydrophobicContact CZ-CG2 3.93Å; F629-L698 HydrophobicContact CD1-CD2 3.87Å; F629-L698 HydrophobicContact CD1-CG 4.48Å; F629-L698 HydrophobicContact CE1-CB 4.05Å; F629-L698 HydrophobicContact CE1-CD2 3.56Å; F629-L698 HydrophobicContact CE1-CG 3.68Å; F629-L698 HydrophobicContact CZ-CG 4.49Å; F629-M699 HydrophobicContact CE2-SD 4.02Å; F629-M699 HydrophobicContact CZ-CB 4.26Å; F629-M699 HydrophobicContact CZ-SD 3.82Å
630	A	96.3	Very high	95.1	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-66.2	-36.4	176.4	0	0	0	0	0	112.8	A626 E627 N634 L670 Q671	A626-A630 PolarHBondContact O-N 2.76Å; E627-A630 PolarHBondContact O-N 3.38Å; A630-N634 PolarHBondContact O-N 3.39Å; A630-N634 VanDerWaalsContact O-N 3.08Å; A630-N634 PolarHBondContact O-ND2 3.33Å; A630-L670 HydrophobicContact CB-CD2 4.11Å; A630-L670 HydrophobicContact CB-CG 4.47Å; A630-Q671 HydrophobicContact CB-CG 4.01Å
631	E	94.7	Very high	95.3	Very high	99 Å²	99	45.4 Å²	45.4	46%	0.463	20%	0.202	S	C	.	.	H	α-helix	trans	-64.6	-42.9	174	-73.9	-178.1	177.3	0	0	111.8	E627 F628 N634 K635	E627-E631 WeakPolarHBondContact O-CG 3.22Å; E627-E631 PolarHBondContact O-N 3.07Å; F628-E631 PolarHBondContact O-N 3.4Å; E631-N634 WeakPolarHBondContact O-CB 3.39Å; E631-N634 PolarHBondContact O-N 2.85Å; E631-K635 WeakPolarHBondContact O-CG 3.37Å; E631-K635 PolarHBondContact O-N 3.1Å; E631-K635 VanDerWaalsContact O-N 3.08Å
632	E	96.2	Very high	95.3	Very high	27 Å²	27	49.1 Å²	49.1	13%	0.126	22%	0.217	C	C	.	.	H	α-helix	trans	-67.8	-38.9	178.7	-159.3	67.5	-173.1	0	0	111.9	M599 M602 F628 F629 N634 K635 M636	M599-E632 HydrophobicContact CG-CB 4.03Å; M599-E632 HydrophobicContact CG-CG 3.85Å; M602-E632 HydrophobicContact CE-CB 3.55Å; M602-E632 HydrophobicContact CE-CG 3.67Å; F628-E632 WeakPolarHBondContact O-CB 3.38Å; F628-E632 PolarHBondContact O-N 2.72Å; F629-E632 PolarHBondContact O-N 3.13Å; E632-N634 VanDerWaalsContact C-N 3.31Å; E632-N634 PolarHBondContact O-N 3.4Å; E632-K635 WeakPolarHBondContact O-CB 3.36Å; E632-K635 PolarHBondContact O-N 3.46Å; E632-K635 VanDerWaalsContact O-N 3.11Å; E632-K635 WeakPolarHBondContact OE2-CD 3.43Å; E632-K635 IonicContact OE2-NZ 3.73Å; E632-K635 PolarHBondContact OE2-NZ 3.13Å; E632-M636 PolarHBondContact O-N 3.26Å
633	A	96.9	Very high	95.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.7	-39.2	171.6	0	0	0	0	0	112.6	M599 F629 M636 Y637 I663 C667 L698	M599-A633 HydrophobicContact CE-CB 3.5Å; M599-A633 HydrophobicContact SD-CB 4.14Å; F629-A633 WeakPolarHBondContact O-CB 3.35Å; F629-A633 PolarHBondContact O-N 3.08Å; A633-M636 WeakPolarHBondContact O-CB 3.48Å; A633-M636 PolarHBondContact O-N 3.38Å; A633-Y637 PolarHBondContact O-N 3Å; A633-I663 HydrophobicContact CB-CG2 4.43Å; A633-C667 WeakPolarHBondContact CB-SG 3.27Å; A633-L698 HydrophobicContact CB-CD1 4.27Å; A633-L698 HydrophobicContact CB-CD2 3.86Å; A633-L698 HydrophobicContact CB-CG 4.42Å
634	N	95.3	Very high	94.9	Very high	47 Å²	47	48.6 Å²	48.6	25%	0.251	22%	0.216	S	C	.	.	H	α-helix	trans	-66	-35.5	173.7	-82.8	-60.3	0	0	0	112.7	A630 E631 E632 R638	A630-N634 PolarHBondContact O-N 3.39Å; A630-N634 VanDerWaalsContact O-N 3.08Å; A630-N634 PolarHBondContact O-ND2 3.33Å; E631-N634 WeakPolarHBondContact O-CB 3.39Å; E631-N634 PolarHBondContact O-N 2.85Å; E632-N634 VanDerWaalsContact C-N 3.31Å; E632-N634 PolarHBondContact O-N 3.4Å; N634-R638 WeakPolarHBondContact O-CG 3.24Å; N634-R638 PolarHBondContact O-N 3.32Å
635	K	95.3	Very high	94.7	Very high	95 Å²	95	55.1 Å²	55.1	41%	0.413	24%	0.237	S	C	.	.	H	α-helix	trans	-68	-39.4	172.5	-63.3	175.3	-158.3	155.7	0	111.1	R595 E631 E632 R638 T639	R595-K635 PolarHBondContact NE-O 3.23Å; E631-K635 WeakPolarHBondContact O-CG 3.37Å; E631-K635 PolarHBondContact O-N 3.1Å; E631-K635 VanDerWaalsContact O-N 3.08Å; E632-K635 WeakPolarHBondContact O-CB 3.36Å; E632-K635 PolarHBondContact O-N 3.46Å; E632-K635 VanDerWaalsContact O-N 3.11Å; E632-K635 WeakPolarHBondContact OE2-CD 3.43Å; E632-K635 IonicContact OE2-NZ 3.73Å; E632-K635 PolarHBondContact OE2-NZ 3.13Å; K635-R638 PolarHBondContact O-N 3.11Å; K635-T639 PolarHBondContact O-N 2.62Å; K635-T639 VanDerWaalsContact O-N 3.07Å; K635-T639 PolarHBondContact O-OG1 3.1Å
636	M	95.4	Very high	94.3	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-58.7	-47	174.5	-178.3	69.4	167.7	0	0	110.8	I592 R595 M599 E632 A633 R638 T639 V640 I702 L705 V706	I592-M636 HydrophobicContact CG2-CE 3.53Å; I592-M636 HydrophobicContact CG2-SD 4.07Å; R595-M636 HydrophobicContact CB-CB 4.32Å; R595-M636 HydrophobicContact CB-SD 3.88Å; M599-M636 HydrophobicContact SD-CB 4.35Å; E632-M636 PolarHBondContact O-N 3.26Å; A633-M636 WeakPolarHBondContact O-CB 3.48Å; A633-M636 PolarHBondContact O-N 3.38Å; M636-R638 VanDerWaalsContact C-N 3.32Å; M636-R638 PolarHBondContact O-N 3.36Å; M636-T639 PolarHBondContact O-N 3.26Å; M636-V640 HydrophobicContact CE-CG2 3.97Å; M636-V640 HydrophobicContact CG-CG2 4.32Å; M636-V640 WeakPolarHBondContact O-CB 3.31Å; M636-V640 WeakPolarHBondContact O-CG2 3.14Å; M636-V640 PolarHBondContact O-N 3.02Å; M636-V640 HydrophobicContact SD-CG2 4.04Å; M636-I702 HydrophobicContact CG-CD1 4.02Å; M636-L705 HydrophobicContact CE-CD2 3.98Å; M636-L705 HydrophobicContact CE-CG 4.44Å; M636-L705 HydrophobicContact CG-CD2 3.94Å; M636-V706 HydrophobicContact CE-CG2 3.67Å
637	Y	96.7	Very high	93.9	Very high	47 Å²	47	58.6 Å²	58.6	18%	0.184	25%	0.253	C	S	.	.	H	α-helix	trans	-53.9	-46.1	175.4	172.6	-91.5	0	0	0	112.5	A633 R641 L660 I663 P664	A633-Y637 PolarHBondContact O-N 3Å; Y637-R641 VanDerWaalsContact O-CB 3.24Å; Y637-R641 WeakPolarHBondContact O-CB 3.47Å; Y637-R641 PolarHBondContact O-N 3.4Å; Y637-R641 PolarHBondContact OH-NH1 2.96Å; Y637-L660 HydrophobicContact CD2-CD1 3.49Å; Y637-L660 VanDerWaalsContact CD2-CD1 3.49Å; Y637-L660 HydrophobicContact CD2-CG 3.79Å; Y637-L660 WeakPolarHBondContact CD2-O 3.34Å; Y637-L660 HydrophobicContact CE2-CD1 4.06Å; Y637-L660 HydrophobicContact CE2-CD2 4.47Å; Y637-L660 HydrophobicContact CE2-CG 3.82Å; Y637-L660 WeakPolarHBondContact CE2-O 3.45Å; Y637-L660 HydrophobicContact CG-CD1 4.19Å; Y637-I663 HydrophobicContact CD2-CB 4.38Å; Y637-P664 HydrophobicContact CD2-CG 3.68Å; Y637-P664 HydrophobicContact CE2-CG 3.52Å; Y637-P664 HydrophobicContact CG-CG 4.28Å
638	R	94.5	Very high	93.5	Very high	175 Å²	175	58.4 Å²	58.4	66%	0.66	26%	0.258	S	S	*	.	H	α-helix	trans	-64.9	-47.6	179.6	-66.3	178.8	-167.6	-149.7	2.7	112.1	N634 K635 M636 V640 R641 E642	N634-R638 WeakPolarHBondContact O-CG 3.24Å; N634-R638 PolarHBondContact O-N 3.32Å; K635-R638 PolarHBondContact O-N 3.11Å; M636-R638 VanDerWaalsContact C-N 3.32Å; M636-R638 PolarHBondContact O-N 3.36Å; R638-V640 PolarHBondContact O-N 3.29Å; R638-R641 PolarHBondContact O-N 3.5Å; R638-E642 PolarHBondContact O-N 3.36Å
639	T	93.9	Very high	93.1	Very high	17 Å²	17	57 Å²	57	10%	0.104	28%	0.275	C	S	.	.	H	α-helix	trans	-61	-44.3	178.8	-62	0	0	0	0	111.5	D591 I592 R595 K635 M636 R641 E642 F643	D591-T639 HydrophobicContact CB-CG2 3.55Å; I592-T639 HydrophobicContact CG1-CG2 3.59Å; R595-T639 VanDerWaalsContact CZ-OG1 3.26Å; R595-T639 PolarHBondContact NE-OG1 2.85Å; R595-T639 VanDerWaalsContact NE-OG1 3.11Å; R595-T639 PolarHBondContact NH2-OG1 3.48Å; K635-T639 PolarHBondContact O-N 2.62Å; K635-T639 VanDerWaalsContact O-N 3.07Å; K635-T639 PolarHBondContact O-OG1 3.1Å; M636-T639 PolarHBondContact O-N 3.26Å; T639-R641 VanDerWaalsContact C-N 3.35Å; T639-E642 PolarHBondContact O-N 3.45Å; T639-F643 PolarHBondContact O-N 3.41Å
640	V	94.5	Very high	92.8	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-70.6	-33.2	178.8	177.3	0	0	0	0	111.5	I592 M636 R638 E642 F643 C644 L656 L660 L705 C709	I592-V640 HydrophobicContact CD1-CG2 4.2Å; I592-V640 HydrophobicContact CG1-CG2 4.14Å; I592-V640 HydrophobicContact CG2-CG2 4.39Å; M636-V640 HydrophobicContact CE-CG2 3.97Å; M636-V640 HydrophobicContact CG-CG2 4.32Å; M636-V640 WeakPolarHBondContact O-CB 3.31Å; M636-V640 WeakPolarHBondContact O-CG2 3.14Å; M636-V640 PolarHBondContact O-N 3.02Å; M636-V640 HydrophobicContact SD-CG2 4.04Å; R638-V640 PolarHBondContact O-N 3.29Å; V640-E642 VanDerWaalsContact C-N 3.33Å; V640-E642 PolarHBondContact O-N 3.21Å; V640-F643 WeakPolarHBondContact O-CB 3.24Å; V640-F643 PolarHBondContact O-N 3.32Å; V640-C644 PolarHBondContact O-N 3.36Å; V640-C644 PolarHBondContact O-SG 3.35Å; V640-L656 HydrophobicContact CG1-CD1 3.92Å; V640-L656 HydrophobicContact CG1-CG 4.48Å; V640-L660 HydrophobicContact CB-CD1 3.85Å; V640-L660 HydrophobicContact CG1-CD1 3.84Å; V640-L660 HydrophobicContact CG1-CD2 4.18Å; V640-L660 HydrophobicContact CG1-CG 4.5Å; V640-L705 HydrophobicContact CB-CD2 4.46Å; V640-L705 HydrophobicContact CG1-CD1 3.99Å; V640-L705 HydrophobicContact CG1-CG 4.32Å; V640-L705 HydrophobicContact CG2-CD2 4Å; V640-L705 HydrophobicContact CG2-CG 4.3Å; V640-C709 VanDerWaalsContact CG1-SG 3.54Å
641	R	94	Very high	92.5	Very high	121 Å²	121	61.5 Å²	61.5	46%	0.457	31%	0.31	S	S	.	.	H	α-helix	trans	-64.3	-37.5	173.7	-170.5	170.2	-178.8	171	-3.2	112.3	Y637 R638 T639 C644 Y645 L660	Y637-R641 VanDerWaalsContact O-CB 3.24Å; Y637-R641 WeakPolarHBondContact O-CB 3.47Å; Y637-R641 PolarHBondContact O-N 3.4Å; Y637-R641 PolarHBondContact OH-NH1 2.96Å; R638-R641 PolarHBondContact O-N 3.5Å; T639-R641 VanDerWaalsContact C-N 3.35Å; R641-C644 WeakPolarHBondContact O-CB 3.33Å; R641-C644 PolarHBondContact O-N 2.97Å; R641-Y645 WeakPolarHBondContact O-CD2 3.33Å; R641-L660 HydrophobicContact CB-CD2 4.08Å
642	E	91	Very high	92.2	Very high	130 Å²	130	59 Å²	59	61%	0.607	30%	0.298	S	S	*	.	H	α-helix	trans	-64.3	-47.4	172	-73.5	170.1	-177.1	0	0	111	R638 T639 V640 C644 Y645	R638-E642 PolarHBondContact O-N 3.36Å; T639-E642 PolarHBondContact O-N 3.45Å; V640-E642 VanDerWaalsContact C-N 3.33Å; V640-E642 PolarHBondContact O-N 3.21Å; E642-C644 VanDerWaalsContact C-N 3.27Å; E642-C644 PolarHBondContact O-N 3.19Å; E642-Y645 WeakPolarHBondContact O-CB 3.29Å; E642-Y645 PolarHBondContact O-N 2.92Å
643	F	91.1	Very high	92.1	Very high	7 Å²	7	59.7 Å²	59.7	3%	0.031	30%	0.301	C	S	.	.	H	α-helix	trans	-56.5	-38	174.8	173	-110.5	0	0	0	112.8	I592 T639 V640 Y645 E646 V647 L656 C709 C712 A713 I718 F720	I592-F643 HydrophobicContact CD1-CB 4.13Å; I592-F643 HydrophobicContact CD1-CD1 4.27Å; I592-F643 HydrophobicContact CD1-CG 4.07Å; T639-F643 PolarHBondContact O-N 3.41Å; V640-F643 WeakPolarHBondContact O-CB 3.24Å; V640-F643 PolarHBondContact O-N 3.32Å; F643-Y645 PolarHBondContact O-N 2.84Å; F643-Y645 VanDerWaalsContact O-N 3.12Å; F643-E646 PolarHBondContact O-N 3.44Å; F643-V647 HydrophobicContact CD1-CG2 4.22Å; F643-V647 HydrophobicContact CE1-CG2 3.78Å; F643-V647 HydrophobicContact CE2-CG2 4.39Å; F643-V647 HydrophobicContact CZ-CG2 3.89Å; F643-V647 PolarHBondContact O-N 3.23Å; F643-L656 HydrophobicContact CD1-CD2 4Å; F643-L656 HydrophobicContact CE1-CD2 3.9Å; F643-C709 HydrophobicContact CE1-CB 4.15Å; F643-C712 HydrophobicContact CE1-CB 3.9Å; F643-C712 HydrophobicContact CZ-CB 3.9Å; F643-A713 HydrophobicContact CE2-CB 4.25Å; F643-A713 HydrophobicContact CZ-CB 3.95Å; F643-I718 HydrophobicContact CD2-CG2 4.48Å; F643-I718 HydrophobicContact CE2-CB 4.28Å; F643-I718 HydrophobicContact CE2-CD1 3.8Å; F643-I718 HydrophobicContact CE2-CG2 4.04Å; F643-I718 HydrophobicContact CZ-CD1 4.04Å; F643-F720 AromaticContact CD2-CE1 3.46Å; F643-F720 HydrophobicContact CD2-CE1 3.46Å; F643-F720 VanDerWaalsContact CD2-CE1 3.46Å; F643-F720 AromaticContact CD2-CZ 3.88Å; F643-F720 HydrophobicContact CD2-CZ 3.88Å; F643-F720 AromaticContact CE2-CE1 3.59Å; F643-F720 HydrophobicContact CE2-CE1 3.59Å; F643-F720 AromaticContact CE2-CZ 3.48Å; F643-F720 HydrophobicContact CE2-CZ 3.48Å; F643-F720 VanDerWaalsContact CE2-CZ 3.48Å; F643-F720 HydrophobicContact CG-CE1 4.41Å; F643-F720 HydrophobicContact CZ-CZ 4.26Å
644	C	91.9	Very high	91.8	Very high	7 Å²	7	64.1 Å²	64.1	5%	0.047	33%	0.325	C	S	.	.	H	α-helix	trans	-59.8	-22.6	177.1	-70.4	0	0	0	0	114	V640 R641 E642 E646 K653 L656 L657	V640-C644 PolarHBondContact O-N 3.36Å; V640-C644 PolarHBondContact O-SG 3.35Å; R641-C644 WeakPolarHBondContact O-CB 3.33Å; R641-C644 PolarHBondContact O-N 2.97Å; E642-C644 VanDerWaalsContact C-N 3.27Å; E642-C644 PolarHBondContact O-N 3.19Å; C644-E646 VanDerWaalsContact C-N 3.3Å; C644-K653 WeakPolarHBondContact O-CE 3.44Å; C644-K653 PolarHBondContact O-NZ 3.3Å; C644-L656 VanDerWaalsContact SG-CD2 3.54Å; C644-L657 HydrophobicContact CB-CD2 4.15Å
645	Y	90.2	Very high	91.7	Very high	178 Å²	178	67.4 Å²	67.4	70%	0.698	34%	0.339	S	S	*	.	H	α-helix	trans	-72.7	-25.4	174.7	-67.8	-64.7	0	0	0	112.8	R641 E642 F643	R641-Y645 WeakPolarHBondContact O-CD2 3.33Å; E642-Y645 WeakPolarHBondContact O-CB 3.29Å; E642-Y645 PolarHBondContact O-N 2.92Å; F643-Y645 PolarHBondContact O-N 2.84Å; F643-Y645 VanDerWaalsContact O-N 3.12Å
646	E	87.1	Confident	91.6	Very high	100 Å²	100	62.9 Å²	62.9	47%	0.467	32%	0.319	S	S	.	.	H	α-helix	trans	-84.3	-20.7	178.4	-58.1	-174.8	174.7	0	0	112.2	F643 C644 P648 I718	F643-E646 PolarHBondContact O-N 3.44Å; C644-E646 VanDerWaalsContact C-N 3.3Å; E646-P648 WeakPolarHBondContact O-CD 3.43Å; E646-I718 HydrophobicContact CB-CD1 4.36Å; E646-I718 HydrophobicContact CB-CG2 3.84Å; E646-I718 WeakPolarHBondContact OE2-CG2 3.36Å
647	V	88.3	Confident	91.5	Very high	2 Å²	2	65.4 Å²	65.4	1%	0.012	33%	0.332	C	S	.	.	S	Bend	trans	-76.5	124.3	178	-171.6	0	0	0	0	110.8	F643 K653 L656 C712 F716 I718	F643-V647 HydrophobicContact CD1-CG2 4.22Å; F643-V647 HydrophobicContact CE1-CG2 3.78Å; F643-V647 HydrophobicContact CE2-CG2 4.39Å; F643-V647 HydrophobicContact CZ-CG2 3.89Å; F643-V647 PolarHBondContact O-N 3.23Å; V647-K653 HydrophobicContact CB-CD 4.27Å; V647-K653 HydrophobicContact CB-CG 4.3Å; V647-K653 HydrophobicContact CG1-CB 3.8Å; V647-K653 HydrophobicContact CG1-CD 4.32Å; V647-K653 HydrophobicContact CG1-CG 4.12Å; V647-K653 WeakPolarHBondContact O-CD 3.42Å; V647-K653 WeakPolarHBondContact O-CE 3.2Å; V647-K653 PolarHBondContact O-NZ 2.94Å; V647-L656 HydrophobicContact CG2-CD2 4.43Å; V647-C712 HydrophobicContact CG1-CB 4.15Å; V647-C712 HydrophobicContact CG2-CB 3.97Å; V647-F716 HydrophobicContact CG1-CD2 3.79Å; V647-F716 HydrophobicContact CG1-CE2 3.81Å; V647-I718 HydrophobicContact CB-CD1 4.29Å; V647-I718 HydrophobicContact CG2-CD1 3.69Å
648	P	86.3	Confident	91.4	Very high	66 Å²	66	68.7 Å²	68.7	43%	0.429	35%	0.349	S	S	.	.			trans	-61.3	151.3	172.3	-22.8	34.4	0	0	0	112.7	E646 S650 F716	E646-P648 WeakPolarHBondContact O-CD 3.43Å; P648-S650 PolarHBondContact O-N 3.02Å; P648-S650 PolarHBondContact O-OG 2.95Å; P648-F716 HydrophobicContact CB-CD1 4.35Å; P648-F716 HydrophobicContact CB-CE1 4.3Å; P648-F716 HydrophobicContact CG-CB 4.43Å; P648-F716 HydrophobicContact CG-CD1 3.74Å; P648-F716 HydrophobicContact CG-CE1 4.19Å; P648-F716 HydrophobicContact CG-CG 4.07Å
649	G	89	Confident	91.3	Very high	79 Å²	79	60.9 Å²	60.9	81%	0.814	32%	0.321	S	S	*	.	S	Bend	trans	-56.5	112.3	175.3	0	0	0	0	0	111.4
650	S	89.6	Confident	91.4	Very high	21 Å²	21	60.2 Å²	60.2	15%	0.147	32%	0.317	C	S	.	.	S	Bend	trans	-156.5	166.5	-171.3	56.3	0	0	0	0	110.9	P648 E652 K653 N654 F716	P648-S650 PolarHBondContact O-N 3.02Å; P648-S650 PolarHBondContact O-OG 2.95Å; S650-E652 VanDerWaalsContact C-N 3.26Å; S650-E652 PolarHBondContact O-N 3.48Å; S650-K653 PolarHBondContact O-N 3.25Å; S650-K653 WeakPolarHBondContact OG-CB 3.36Å; S650-K653 PolarHBondContact OG-N 2.97Å; S650-N654 PolarHBondContact O-N 3Å; S650-F716 VanDerWaalsContact CB-CZ 3.48Å; S650-F716 WeakPolarHBondContact OG-CE2 3.46Å; S650-F716 VanDerWaalsContact OG-CZ 3.29Å; S650-F716 WeakPolarHBondContact OG-CZ 3.15Å
651	A	89.8	Confident	91.4	Very high	73 Å²	73	66.7 Å²	66.7	60%	0.603	35%	0.347	S	S	*	.	H	α-helix	trans	-60.6	-39.8	174.1	0	0	0	0	0	111.2	K653 N654 E655	A651-K653 VanDerWaalsContact C-N 3.34Å; A651-K653 PolarHBondContact O-N 3.27Å; A651-N654 WeakPolarHBondContact O-CB 3.49Å; A651-N654 PolarHBondContact O-N 3.43Å; A651-N654 VanDerWaalsContact O-N 3.14Å; A651-E655 PolarHBondContact O-N 3.22Å
652	E	90.1	Very high	91.4	Very high	46 Å²	46	66.5 Å²	66.5	22%	0.215	35%	0.347	C	S	.	.	H	α-helix	trans	-63.3	-39.4	178	-64.8	75	-168.3	0	0	111.9	S650 N654 E655 L656 V711 K715 F716	S650-E652 VanDerWaalsContact C-N 3.26Å; S650-E652 PolarHBondContact O-N 3.48Å; E652-N654 VanDerWaalsContact C-N 3.33Å; E652-N654 PolarHBondContact O-N 2.92Å; E652-E655 PolarHBondContact O-N 3.43Å; E652-L656 WeakPolarHBondContact O-CB 3.48Å; E652-L656 PolarHBondContact O-N 2.93Å; E652-V711 HydrophobicContact CG-CG1 3.98Å; E652-K715 HydrophobicContact CG-CD 4.05Å; E652-K715 IonicContact OE1-NZ 3.48Å; E652-K715 PolarHBondContact OE1-NZ 3.36Å; E652-K715 IonicContact OE2-NZ 2.58Å; E652-K715 PolarHBondContact OE2-NZ 3.44Å; E652-F716 HydrophobicContact CB-CE2 4.49Å
653	K	92.8	Very high	91.6	Very high	42 Å²	42	60.3 Å²	60.3	18%	0.183	32%	0.318	C	S	.	.	H	α-helix	trans	-61.9	-41	173.9	-174	176.9	-172.7	157.2	0	112	C644 V647 S650 A651 L656 L657	C644-K653 WeakPolarHBondContact O-CE 3.44Å; C644-K653 PolarHBondContact O-NZ 3.3Å; V647-K653 HydrophobicContact CB-CD 4.27Å; V647-K653 HydrophobicContact CB-CG 4.3Å; V647-K653 HydrophobicContact CG1-CB 3.8Å; V647-K653 HydrophobicContact CG1-CD 4.32Å; V647-K653 HydrophobicContact CG1-CG 4.12Å; V647-K653 WeakPolarHBondContact O-CD 3.42Å; V647-K653 WeakPolarHBondContact O-CE 3.2Å; V647-K653 PolarHBondContact O-NZ 2.94Å; S650-K653 PolarHBondContact O-N 3.25Å; S650-K653 WeakPolarHBondContact OG-CB 3.36Å; S650-K653 PolarHBondContact OG-N 2.97Å; A651-K653 VanDerWaalsContact C-N 3.34Å; A651-K653 PolarHBondContact O-N 3.27Å; K653-L656 PolarHBondContact O-N 3.01Å; K653-L657 HydrophobicContact CG-CD1 4.16Å; K653-L657 WeakPolarHBondContact O-CB 3.35Å; K653-L657 WeakPolarHBondContact O-CG 3.27Å; K653-L657 PolarHBondContact O-N 3.43Å
654	N	91.9	Very high	91.8	Very high	94 Å²	94	62.1 Å²	62.1	50%	0.503	33%	0.33	S	S	.	.	H	α-helix	trans	-66.3	-41.6	179.7	-69.1	-26.5	0	0	0	111.3	S650 A651 E652 L657 Q658	S650-N654 PolarHBondContact O-N 3Å; A651-N654 WeakPolarHBondContact O-CB 3.49Å; A651-N654 PolarHBondContact O-N 3.43Å; A651-N654 VanDerWaalsContact O-N 3.14Å; E652-N654 VanDerWaalsContact C-N 3.33Å; E652-N654 PolarHBondContact O-N 2.92Å; N654-L657 PolarHBondContact O-N 2.85Å; N654-Q658 VanDerWaalsContact O-CG 3.28Å; N654-Q658 WeakPolarHBondContact O-CG 3.16Å; N654-Q658 PolarHBondContact O-N 2.74Å
655	E	91.4	Very high	91.9	Very high	116 Å²	116	65.6 Å²	65.6	54%	0.542	35%	0.351	S	S	.	.	H	α-helix	trans	-64.6	-42.1	175.5	-173	175.6	-174.2	0	0	112.2	A651 E652 L657 Q658 T659	A651-E655 PolarHBondContact O-N 3.22Å; E652-E655 PolarHBondContact O-N 3.43Å; E655-L657 PolarHBondContact O-N 3.22Å; E655-Q658 PolarHBondContact O-N 3.26Å; E655-T659 PolarHBondContact O-N 3.05Å; E655-T659 VanDerWaalsContact O-N 3.08Å; E655-T659 PolarHBondContact O-OG1 3.26Å; E655-T659 VanDerWaalsContact O-OG1 3.09Å
656	L	93.4	Very high	92.1	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-58.6	-46.6	173.7	175.6	61.4	0	0	0	111.5	V640 F643 C644 V647 E652 K653 T659 L660 L705 C709	V640-L656 HydrophobicContact CG1-CD1 3.92Å; V640-L656 HydrophobicContact CG1-CG 4.48Å; F643-L656 HydrophobicContact CD1-CD2 4Å; F643-L656 HydrophobicContact CE1-CD2 3.9Å; C644-L656 VanDerWaalsContact SG-CD2 3.54Å; V647-L656 HydrophobicContact CG2-CD2 4.43Å; E652-L656 WeakPolarHBondContact O-CB 3.48Å; E652-L656 PolarHBondContact O-N 2.93Å; K653-L656 PolarHBondContact O-N 3.01Å; L656-T659 PolarHBondContact O-N 2.75Å; L656-L660 VanDerWaalsContact O-CB 3.28Å; L656-L660 WeakPolarHBondContact O-CB 3.28Å; L656-L660 PolarHBondContact O-N 3.39Å; L656-L705 HydrophobicContact CD1-CD1 3.87Å; L656-C709 VanDerWaalsContact CD1-SG 3.56Å
657	L	94.4	Very high	92.5	Very high	53 Å²	53	53.9 Å²	53.9	28%	0.277	30%	0.303	S	S	.	.	H	α-helix	trans	-65.2	-41.9	178.3	-73.9	172	0	0	0	112.2	C644 K653 N654 E655 T659 L660 E661	C644-L657 HydrophobicContact CB-CD2 4.15Å; K653-L657 HydrophobicContact CG-CD1 4.16Å; K653-L657 WeakPolarHBondContact O-CB 3.35Å; K653-L657 WeakPolarHBondContact O-CG 3.27Å; K653-L657 PolarHBondContact O-N 3.43Å; N654-L657 PolarHBondContact O-N 2.85Å; E655-L657 PolarHBondContact O-N 3.22Å; L657-T659 VanDerWaalsContact C-N 3.28Å; L657-T659 PolarHBondContact O-N 2.87Å; L657-L660 HydrophobicContact CD2-CD2 4.33Å; L657-L660 PolarHBondContact O-N 3.47Å; L657-E661 WeakPolarHBondContact O-CG 3.45Å; L657-E661 PolarHBondContact O-N 3.38Å
658	Q	93.6	Very high	92.8	Very high	115 Å²	115	59.1 Å²	59.1	54%	0.537	33%	0.327	S	S	.	.	H	α-helix	trans	-59.4	-39.4	176.8	-76.2	175	18.3	0	0	112.4	N654 E655	N654-Q658 VanDerWaalsContact O-CG 3.28Å; N654-Q658 WeakPolarHBondContact O-CG 3.16Å; N654-Q658 PolarHBondContact O-N 2.74Å; E655-Q658 PolarHBondContact O-N 3.26Å
659	T	93.2	Very high	93.2	Very high	11 Å²	11	60 Å²	60	7%	0.067	33%	0.325	C	S	.	.	H	α-helix	trans	-72	-43.4	176	-53.2	0	0	0	0	110.9	E655 L656 L657 E661 R662 K704 L705	E655-T659 PolarHBondContact O-N 3.05Å; E655-T659 VanDerWaalsContact O-N 3.08Å; E655-T659 PolarHBondContact O-OG1 3.26Å; E655-T659 VanDerWaalsContact O-OG1 3.09Å; L656-T659 PolarHBondContact O-N 2.75Å; L657-T659 VanDerWaalsContact C-N 3.28Å; L657-T659 PolarHBondContact O-N 2.87Å; T659-E661 VanDerWaalsContact C-N 3.31Å; T659-E661 PolarHBondContact O-N 3.43Å; T659-R662 PolarHBondContact O-N 3.31Å; T659-K704 HydrophobicContact CG2-CB 3.81Å; T659-L705 HydrophobicContact CG2-CB 4.12Å; T659-L705 HydrophobicContact CG2-CD1 4.18Å
660	L	95.6	Very high	93.5	Very high	3 Å²	3	56.2 Å²	56.2	2%	0.016	29%	0.286	C	S	.	.	H	α-helix	trans	-60.6	-37.1	179.7	-176.6	64.5	0	0	0	112.9	Y637 V640 R641 L656 L657 R662 I663 P664 L705	Y637-L660 HydrophobicContact CD2-CD1 3.49Å; Y637-L660 VanDerWaalsContact CD2-CD1 3.49Å; Y637-L660 HydrophobicContact CD2-CG 3.79Å; Y637-L660 WeakPolarHBondContact CD2-O 3.34Å; Y637-L660 HydrophobicContact CE2-CD1 4.06Å; Y637-L660 HydrophobicContact CE2-CD2 4.47Å; Y637-L660 HydrophobicContact CE2-CG 3.82Å; Y637-L660 WeakPolarHBondContact CE2-O 3.45Å; Y637-L660 HydrophobicContact CG-CD1 4.19Å; V640-L660 HydrophobicContact CB-CD1 3.85Å; V640-L660 HydrophobicContact CG1-CD1 3.84Å; V640-L660 HydrophobicContact CG1-CD2 4.18Å; V640-L660 HydrophobicContact CG1-CG 4.5Å; R641-L660 HydrophobicContact CB-CD2 4.08Å; L656-L660 VanDerWaalsContact O-CB 3.28Å; L656-L660 WeakPolarHBondContact O-CB 3.28Å; L656-L660 PolarHBondContact O-N 3.39Å; L657-L660 HydrophobicContact CD2-CD2 4.33Å; L657-L660 PolarHBondContact O-N 3.47Å; L660-R662 PolarHBondContact O-N 3.2Å; L660-I663 PolarHBondContact O-N 2.69Å; L660-P664 WeakPolarHBondContact O-CD 3.4Å; L660-L705 HydrophobicContact CB-CD1 3.98Å; L660-L705 HydrophobicContact CD1-CD1 4.1Å; L660-L705 HydrophobicContact CD1-CD2 4.27Å
661	E	94.8	Very high	93.6	Very high	137 Å²	137	57.4 Å²	57.4	64%	0.64	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-18.6	-179.5	-77.5	-179.7	177.5	0	0	114.1	L657 T659	L657-E661 WeakPolarHBondContact O-CG 3.45Å; L657-E661 PolarHBondContact O-N 3.38Å; T659-E661 VanDerWaalsContact C-N 3.31Å; T659-E661 PolarHBondContact O-N 3.43Å
662	R	94.4	Very high	93.8	Very high	117 Å²	117	58 Å²	58	44%	0.442	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-25.5	178.2	-64.8	173.4	-178.2	169	4	113.4	T659 L660 T665 H666 E701	T659-R662 PolarHBondContact O-N 3.31Å; L660-R662 PolarHBondContact O-N 3.2Å; R662-T665 WeakPolarHBondContact O-CB 3.27Å; R662-T665 PolarHBondContact O-N 3.46Å; R662-H666 PolarHBondContact O-CD2 3.49Å; R662-H666 PolarHBondContact O-N 3.06Å; R662-E701 WeakPolarHBondContact CD-OE2 3.39Å; R662-E701 IonicContact NH1-OE1 3.34Å; R662-E701 IonicContact NH1-OE2 2.82Å; R662-E701 PolarHBondContact NH1-OE2 3.4Å
663	I	95.4	Very high	93.9	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-56.9	-48	-175.8	-58.1	-61.8	0	0	0	112.5	A633 Y637 L660 T665 H666 C667 L698 E701 I702 L705	A633-I663 HydrophobicContact CB-CG2 4.43Å; Y637-I663 HydrophobicContact CD2-CB 4.38Å; L660-I663 PolarHBondContact O-N 2.69Å; I663-T665 VanDerWaalsContact C-N 3.27Å; I663-T665 PolarHBondContact O-N 3.21Å; I663-H666 PolarHBondContact O-N 3.09Å; I663-C667 PolarHBondContact O-N 3.21Å; I663-C667 PolarHBondContact O-SG 3.03Å; I663-L698 HydrophobicContact CD1-CD1 3.96Å; I663-L698 HydrophobicContact CG2-CD1 4.2Å; I663-E701 HydrophobicContact CD1-CB 3.7Å; I663-I702 HydrophobicContact CD1-CD1 3.86Å; I663-I702 HydrophobicContact CD1-CG1 4.25Å; I663-L705 HydrophobicContact CD1-CD2 4.43Å; I663-L705 HydrophobicContact CG1-CD2 4.19Å
664	P	95.2	Very high	93.9	Very high	45 Å²	45	56.5 Å²	56.5	29%	0.292	28%	0.281	S	S	.	.	H	α-helix	trans	-59.5	-35.2	-179.9	-25.4	36.5	0	0	0	113.7	Y637 L660 C667 Q668	Y637-P664 HydrophobicContact CD2-CG 3.68Å; Y637-P664 HydrophobicContact CE2-CG 3.52Å; Y637-P664 HydrophobicContact CG-CG 4.28Å; L660-P664 WeakPolarHBondContact O-CD 3.4Å; P664-C667 PolarHBondContact O-N 3.35Å; P664-Q668 WeakPolarHBondContact O-CB 3.41Å; P664-Q668 PolarHBondContact O-N 2.96Å
665	T	93.9	Very high	93.8	Very high	79 Å²	79	58.8 Å²	58.8	49%	0.485	29%	0.287	S	S	.	.	H	α-helix	trans	-64.2	-49.2	179.3	-56.7	0	0	0	0	111.1	R662 I663 Q668 Q669	R662-T665 WeakPolarHBondContact O-CB 3.27Å; R662-T665 PolarHBondContact O-N 3.46Å; I663-T665 VanDerWaalsContact C-N 3.27Å; I663-T665 PolarHBondContact O-N 3.21Å; T665-Q668 PolarHBondContact O-N 2.74Å; T665-Q669 WeakPolarHBondContact O-CG 3.36Å; T665-Q669 PolarHBondContact O-N 3.16Å
666	H	94.7	Very high	93.5	Very high	31 Å²	31	55.2 Å²	55.2	14%	0.144	28%	0.275	C	S	.	.	H	α-helix	trans	-63.7	-41.5	176.7	-73.9	-58.6	0	0	0	112.2	R662 I663 Q668 Q669 L670 E694 L698	R662-H666 PolarHBondContact O-CD2 3.49Å; R662-H666 PolarHBondContact O-N 3.06Å; I663-H666 PolarHBondContact O-N 3.09Å; H666-Q668 VanDerWaalsContact C-N 3.32Å; H666-Q668 PolarHBondContact O-N 3.32Å; H666-Q669 PolarHBondContact O-N 3.36Å; H666-L670 WeakPolarHBondContact O-CB 3.27Å; H666-L670 PolarHBondContact O-N 2.9Å; H666-E694 IonicContact CE1-OE1 3.46Å; H666-E694 IonicContact CG-OE1 3.96Å; H666-E694 IonicContact ND1-OE1 3.47Å; H666-E694 PolarHBondContact ND1-OE1 3.39Å; H666-L698 HydrophobicContact CB-CB 4Å; H666-L698 HydrophobicContact CB-CD1 3.83Å; H666-L698 HydrophobicContact CB-CD2 4.46Å; H666-L698 HydrophobicContact CB-CG 4.29Å
667	C	95.5	Very high	93	Very high	1 Å²	1	61.3 Å²	61.3	1%	0.007	31%	0.314	C	S	.	.	H	α-helix	trans	-57.8	-44.8	174	-70.7	0	0	0	0	111.9	A633 I663 P664 Q671	A633-C667 WeakPolarHBondContact CB-SG 3.27Å; I663-C667 PolarHBondContact O-N 3.21Å; I663-C667 PolarHBondContact O-SG 3.03Å; P664-C667 PolarHBondContact O-N 3.35Å; C667-Q671 WeakPolarHBondContact O-CB 3.43Å; C667-Q671 VanDerWaalsContact O-CG 3.28Å; C667-Q671 WeakPolarHBondContact O-CG 3.29Å; C667-Q671 PolarHBondContact O-N 3.22Å
668	Q	93.7	Very high	92.4	Very high	112 Å²	112	61 Å²	61	52%	0.523	31%	0.314	S	S	.	.	H	α-helix	trans	-66.3	-43.2	178.7	-176.4	61.4	36.1	0	0	111.4	P664 T665 H666 Q671 V672	P664-Q668 WeakPolarHBondContact O-CB 3.41Å; P664-Q668 PolarHBondContact O-N 2.96Å; T665-Q668 PolarHBondContact O-N 2.74Å; H666-Q668 VanDerWaalsContact C-N 3.32Å; H666-Q668 PolarHBondContact O-N 3.32Å; Q668-Q671 PolarHBondContact O-N 2.98Å; Q668-V672 WeakPolarHBondContact O-CB 3.34Å; Q668-V672 VanDerWaalsContact O-CG2 3.25Å; Q668-V672 WeakPolarHBondContact O-CG2 3.47Å; Q668-V672 PolarHBondContact O-N 3.4Å
669	Q	94.5	Very high	91.7	Very high	84 Å²	84	62 Å²	62	39%	0.393	33%	0.328	S	S	.	.	H	α-helix	trans	-60.4	-47.2	176.6	-74.5	171.5	-21.8	0	0	111.2	T665 H666 Q671 V672 L673 E694	T665-Q669 WeakPolarHBondContact O-CG 3.36Å; T665-Q669 PolarHBondContact O-N 3.16Å; H666-Q669 PolarHBondContact O-N 3.36Å; Q669-Q671 PolarHBondContact O-N 3.11Å; Q669-V672 PolarHBondContact O-N 3.32Å; Q669-L673 WeakPolarHBondContact O-CB 3.37Å; Q669-L673 WeakPolarHBondContact O-CG 3.39Å; Q669-L673 PolarHBondContact O-N 3.3Å; Q669-E694 HydrophobicContact CB-CG 4.08Å; Q669-E694 PolarHBondContact OE1-OE1 3.48Å
670	L	95.3	Very high	91.1	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-62.8	-43.3	177.7	-172.2	56.9	0	0	0	112	A626 F629 A630 H666 V672 L673 V674 V691 E694 L698	A626-L670 HydrophobicContact CB-CD1 4.15Å; A626-L670 HydrophobicContact CB-CD2 4.48Å; A626-L670 HydrophobicContact CB-CG 4.43Å; F629-L670 HydrophobicContact CD1-CD2 3.95Å; A630-L670 HydrophobicContact CB-CD2 4.11Å; A630-L670 HydrophobicContact CB-CG 4.47Å; H666-L670 WeakPolarHBondContact O-CB 3.27Å; H666-L670 PolarHBondContact O-N 2.9Å; L670-V672 PolarHBondContact O-N 3.38Å; L670-L673 PolarHBondContact O-N 2.87Å; L670-V674 HydrophobicContact CD1-CG2 4.35Å; L670-V674 WeakPolarHBondContact O-CG2 3.36Å; L670-V674 PolarHBondContact O-N 3.29Å; L670-V691 HydrophobicContact CD1-CG1 4.16Å; L670-E694 HydrophobicContact CB-CG 4.09Å; L670-E694 HydrophobicContact CD1-CB 4.18Å; L670-E694 HydrophobicContact CD1-CG 4.38Å; L670-L698 HydrophobicContact CD2-CD2 4.29Å
671	Q	92.9	Very high	90.2	Very high	47 Å²	47	70.1 Å²	70.1	22%	0.22	38%	0.376	C	S	.	.	H	α-helix	trans	-63.9	-39.4	176.4	-75.8	-178.8	9.8	0	0	112.8	A630 C667 Q668 Q669 K675	A630-Q671 HydrophobicContact CB-CG 4.01Å; C667-Q671 WeakPolarHBondContact O-CB 3.43Å; C667-Q671 VanDerWaalsContact O-CG 3.28Å; C667-Q671 WeakPolarHBondContact O-CG 3.29Å; C667-Q671 PolarHBondContact O-N 3.22Å; Q668-Q671 PolarHBondContact O-N 2.98Å; Q669-Q671 PolarHBondContact O-N 3.11Å; Q671-K675 WeakPolarHBondContact O-CB 3.37Å; Q671-K675 VanDerWaalsContact O-CG 3.28Å; Q671-K675 WeakPolarHBondContact O-CG 3.4Å; Q671-K675 PolarHBondContact O-N 3.15Å
672	V	92.6	Very high	89.6	Confident	86 Å²	86	68.4 Å²	68.4	52%	0.521	37%	0.371	S	S	.	.	H	α-helix	trans	-65.1	-45.2	175.5	169.3	0	0	0	0	110.5	Q668 Q669 L670 V674 K675 S676	Q668-V672 WeakPolarHBondContact O-CB 3.34Å; Q668-V672 VanDerWaalsContact O-CG2 3.25Å; Q668-V672 WeakPolarHBondContact O-CG2 3.47Å; Q668-V672 PolarHBondContact O-N 3.4Å; Q669-V672 PolarHBondContact O-N 3.32Å; L670-V672 PolarHBondContact O-N 3.38Å; V672-V674 PolarHBondContact O-N 2.99Å; V672-K675 PolarHBondContact O-N 2.55Å; V672-S676 PolarHBondContact O-N 2.79Å
673	L	92.9	Very high	89.1	Confident	46 Å²	46	64.6 Å²	64.6	24%	0.241	36%	0.364	C	S	.	.	H	α-helix	trans	-58.8	-49.1	177.4	-75.1	172.3	0	0	0	111.2	Q669 L670 K675 S676 K687 V691 E694	Q669-L673 WeakPolarHBondContact O-CB 3.37Å; Q669-L673 WeakPolarHBondContact O-CG 3.39Å; Q669-L673 PolarHBondContact O-N 3.3Å; L670-L673 PolarHBondContact O-N 2.87Å; L673-K675 PolarHBondContact O-N 2.74Å; L673-S676 PolarHBondContact O-N 3.47Å; L673-S676 PolarHBondContact O-OG 3.48Å; L673-K687 WeakPolarHBondContact O-CE 3.16Å; L673-V691 HydrophobicContact CB-CG2 4.2Å; L673-E694 HydrophobicContact CD1-CB 3.69Å; L673-E694 HydrophobicContact CD1-CG 3.99Å
674	V	92.9	Very high	88.7	Confident	9 Å²	9	66.7 Å²	66.7	6%	0.055	38%	0.377	C	S	.	.	H	α-helix	trans	-67.6	-37.9	-177.7	176.8	0	0	0	0	112.4	F623 A626 E627 L670 V672 S676 K687 V691	F623-V674 HydrophobicContact CB-CG1 3.76Å; F623-V674 HydrophobicContact CG-CG1 4.47Å; A626-V674 HydrophobicContact CB-CG2 3.7Å; E627-V674 HydrophobicContact CG-CB 4.2Å; E627-V674 HydrophobicContact CG-CG1 3.54Å; L670-V674 HydrophobicContact CD1-CG2 4.35Å; L670-V674 WeakPolarHBondContact O-CG2 3.36Å; L670-V674 PolarHBondContact O-N 3.29Å; V672-V674 PolarHBondContact O-N 2.99Å; V674-S676 VanDerWaalsContact C-N 3.33Å; V674-S676 PolarHBondContact O-N 3.49Å; V674-K687 WeakPolarHBondContact O-CE 3.33Å; V674-K687 PolarHBondContact O-NZ 3.41Å; V674-V691 HydrophobicContact CG2-CG1 4.47Å; V674-V691 HydrophobicContact CG2-CG2 3.95Å
675	K	89.4	Confident	88.3	Confident	143 Å²	143	65.6 Å²	65.6	62%	0.622	37%	0.368	S	S	*	.	H	α-helix	trans	-77.4	-15.8	179.2	-69.5	175.3	-179.2	174.9	0	114	Q671 V672 L673	Q671-K675 WeakPolarHBondContact O-CB 3.37Å; Q671-K675 VanDerWaalsContact O-CG 3.28Å; Q671-K675 WeakPolarHBondContact O-CG 3.4Å; Q671-K675 PolarHBondContact O-N 3.15Å; V672-K675 PolarHBondContact O-N 2.55Å; L673-K675 PolarHBondContact O-N 2.74Å
676	S	85.7	Confident	88	Confident	41 Å²	41	65.5 Å²	65.5	29%	0.287	36%	0.364	S	S	.	.	S	Bend	trans	-62.8	126.7	179.1	69.5	0	0	0	0	111.2	V672 L673 V674 K687	V672-S676 PolarHBondContact O-N 2.79Å; L673-S676 PolarHBondContact O-N 3.47Å; L673-S676 PolarHBondContact O-OG 3.48Å; V674-S676 VanDerWaalsContact C-N 3.33Å; V674-S676 PolarHBondContact O-N 3.49Å; S676-K687 PolarHBondContact O-NZ 2.94Å
677	P	83.1	Confident	87.9	Confident	127 Å²	127	64.9 Å²	64.9	83%	0.825	36%	0.361	S	S	*	.			trans	-69.7	136.4	176.5	27.8	-32.7	0	0	0	109.9
678	T	82	Confident	87.8	Confident	46 Å²	46	65.4 Å²	65.4	28%	0.282	36%	0.364	S	S	.	.			trans	-129	131.7	174.6	48.9	0	0	0	0	110.4	A683 K687	T678-A683 HydrophobicContact CG2-CB 4.46Å; T678-K687 HydrophobicContact CG2-CB 3.83Å; T678-K687 HydrophobicContact CG2-CD 3.47Å; T678-K687 VanDerWaalsContact CG2-CD 3.47Å; T678-K687 HydrophobicContact CG2-CG 4.24Å
679	V	78.9	Confident	87.7	Confident	138 Å²	138	60.9 Å²	60.9	84%	0.836	34%	0.344	S	S	*	.			trans	-122.3	127.6	178.7	-176.4	0	0	0	0	108.7	A683	V679-A683 WeakPolarHBondContact O-CB 3.46Å
680	G	79.7	Confident	87.7	Confident	47 Å²	47	59.1 Å²	59.1	49%	0.485	34%	0.34	S	S	.	.	S	Bend	trans	99.8	161.3	-178.7	0	0	0	0	0	113.8	T684	G680-T684 WeakPolarHBondContact O-CB 3.35Å; G680-T684 PolarHBondContact O-N 2.72Å; G680-T684 VanDerWaalsContact O-N 3.08Å; G680-T684 PolarHBondContact O-OG1 2.96Å
681	K	77.8	Confident	87.7	Confident	136 Å²	136	59.1 Å²	59.1	59%	0.591	34%	0.34	S	S	*	.	H	α-helix	trans	-65.6	-51.6	-174.9	-67.4	-175	-178.7	-178.3	0	112.2	S553 A683 T684 F685	S553-K681 PolarHBondContact OG-NZ 2.98Å; S553-K681 VanDerWaalsContact OG-NZ 3.07Å; K681-A683 PolarHBondContact O-N 3.12Å; K681-T684 PolarHBondContact O-N 2.92Å; K681-F685 WeakPolarHBondContact O-CB 3.18Å; K681-F685 PolarHBondContact O-N 3.48Å
682	L	80.5	Confident	87.8	Confident	102 Å²	102	56.9 Å²	56.9	53%	0.534	33%	0.33	S	S	.	.	H	α-helix	trans	-63.2	-42	-178.7	-176.1	63	0	0	0	112	F685 N686	L682-F685 WeakPolarHBondContact O-CB 3.3Å; L682-F685 PolarHBondContact O-N 3.08Å; L682-N686 PolarHBondContact O-N 2.71Å
683	A	84.5	Confident	87.9	Confident	37 Å²	37	55.6 Å²	55.6	31%	0.306	32%	0.318	S	S	.	.	H	α-helix	trans	-63.8	-42.7	176.4	0	0	0	0	0	112.1	T678 V679 K681 F685 K687	T678-A683 HydrophobicContact CG2-CB 4.46Å; V679-A683 WeakPolarHBondContact O-CB 3.46Å; K681-A683 PolarHBondContact O-N 3.12Å; A683-F685 VanDerWaalsContact C-N 3.33Å; A683-K687 WeakPolarHBondContact O-CB 3.42Å; A683-K687 PolarHBondContact O-N 3.5Å
684	T	86.8	Confident	88	Confident	43 Å²	43	54.4 Å²	54.4	26%	0.264	31%	0.311	S	S	.	.	H	α-helix	trans	-62	-42.2	174.1	-55.2	0	0	0	0	111.1	A619 G680 K681 K687 V688	A619-T684 HydrophobicContact CB-CG2 4Å; G680-T684 WeakPolarHBondContact O-CB 3.35Å; G680-T684 PolarHBondContact O-N 2.72Å; G680-T684 VanDerWaalsContact O-N 3.08Å; G680-T684 PolarHBondContact O-OG1 2.96Å; K681-T684 PolarHBondContact O-N 2.92Å; T684-K687 PolarHBondContact O-N 3.37Å; T684-V688 WeakPolarHBondContact O-CG2 3.31Å; T684-V688 PolarHBondContact O-N 3.31Å
685	F	87.4	Confident	88.2	Confident	23 Å²	23	54 Å²	54	10%	0.101	31%	0.309	C	S	.	.	H	α-helix	trans	-62	-49.6	177.7	-176.5	-88.9	0	0	0	112.2	L555 E559 I563 K681 L682 A683 K687 V688 D689	L555-F685 HydrophobicContact CD1-CD2 4.33Å; L555-F685 HydrophobicContact CD2-CD2 3.98Å; L555-F685 HydrophobicContact CD2-CG 4.43Å; E559-F685 HydrophobicContact CB-CE1 3.7Å; E559-F685 HydrophobicContact CB-CE2 4.16Å; E559-F685 HydrophobicContact CB-CZ 3.46Å; E559-F685 VanDerWaalsContact CB-CZ 3.46Å; E559-F685 HydrophobicContact CG-CE1 3.96Å; E559-F685 HydrophobicContact CG-CZ 4.25Å; E559-F685 WeakPolarHBondContact O-CZ 3.17Å; I563-F685 HydrophobicContact CD1-CD2 4.06Å; I563-F685 HydrophobicContact CD1-CE1 3.86Å; I563-F685 HydrophobicContact CD1-CE2 3.31Å; I563-F685 HydrophobicContact CD1-CZ 3.14Å; I563-F685 HydrophobicContact CG1-CE1 4.41Å; I563-F685 HydrophobicContact CG1-CE2 4.28Å; I563-F685 HydrophobicContact CG1-CZ 3.72Å; K681-F685 WeakPolarHBondContact O-CB 3.18Å; K681-F685 PolarHBondContact O-N 3.48Å; L682-F685 WeakPolarHBondContact O-CB 3.3Å; L682-F685 PolarHBondContact O-N 3.08Å; A683-F685 VanDerWaalsContact C-N 3.33Å; F685-K687 PolarHBondContact O-N 3.09Å; F685-V688 WeakPolarHBondContact O-CA 3.33Å; F685-V688 WeakPolarHBondContact O-CB 3.34Å; F685-V688 PolarHBondContact O-N 3.07Å; F685-D689 PolarHBondContact O-N 3.34Å
686	N	88	Confident	88.5	Confident	77 Å²	77	48.6 Å²	48.6	41%	0.412	29%	0.285	S	S	.	.	H	α-helix	trans	-59.7	-35.7	176.8	-71.6	-16.9	0	0	0	112.3	L682 S690	L682-N686 PolarHBondContact O-N 2.71Å; N686-S690 WeakPolarHBondContact O-CB 3.48Å; N686-S690 PolarHBondContact O-N 3.36Å; N686-S690 PolarHBondContact O-OG 2.97Å
687	K	92.6	Very high	89	Confident	18 Å²	18	49 Å²	49	8%	0.078	28%	0.284	C	S	.	.	H	α-helix	trans	-68.9	-40.3	173.7	178.4	175.7	168.2	176.2	0	112.2	F623 L673 V674 S676 T678 A683 T684 F685 S690 V691	F623-K687 HydrophobicContact CE1-CD 4.18Å; F623-K687 HydrophobicContact CE1-CG 3.83Å; F623-K687 HydrophobicContact CE2-CD 4Å; F623-K687 HydrophobicContact CE2-CG 4.47Å; F623-K687 HydrophobicContact CZ-CB 4.27Å; F623-K687 HydrophobicContact CZ-CD 3.68Å; F623-K687 HydrophobicContact CZ-CG 3.67Å; L673-K687 WeakPolarHBondContact O-CE 3.16Å; V674-K687 WeakPolarHBondContact O-CE 3.33Å; V674-K687 PolarHBondContact O-NZ 3.41Å; S676-K687 PolarHBondContact O-NZ 2.94Å; T678-K687 HydrophobicContact CG2-CB 3.83Å; T678-K687 HydrophobicContact CG2-CD 3.47Å; T678-K687 VanDerWaalsContact CG2-CD 3.47Å; T678-K687 HydrophobicContact CG2-CG 4.24Å; A683-K687 WeakPolarHBondContact O-CB 3.42Å; A683-K687 PolarHBondContact O-N 3.5Å; T684-K687 PolarHBondContact O-N 3.37Å; F685-K687 PolarHBondContact O-N 3.09Å; K687-S690 PolarHBondContact O-N 3.44Å; K687-V691 HydrophobicContact CG-CG2 4.35Å; K687-V691 WeakPolarHBondContact O-CB 3.36Å; K687-V691 VanDerWaalsContact O-CG2 3.23Å; K687-V691 WeakPolarHBondContact O-CG2 3.41Å; K687-V691 PolarHBondContact O-N 3.24Å
688	V	92.7	Very high	89.6	Confident	11 Å²	11	42.9 Å²	42.9	7%	0.067	25%	0.245	C	C	.	.	H	α-helix	trans	-59.1	-49.4	172.2	169.1	0	0	0	0	110.4	I563 F609 A619 L622 F623 T684 F685 S690 V691 I692	I563-V688 HydrophobicContact CD1-CG1 3.97Å; F609-V688 HydrophobicContact CE1-CG1 3.99Å; A619-V688 HydrophobicContact CB-CG2 4.04Å; L622-V688 HydrophobicContact CD2-CB 4.25Å; L622-V688 HydrophobicContact CD2-CG1 3.68Å; L622-V688 HydrophobicContact CD2-CG2 4.07Å; F623-V688 HydrophobicContact CE1-CG2 3.96Å; F623-V688 HydrophobicContact CZ-CG2 3.94Å; T684-V688 WeakPolarHBondContact O-CG2 3.31Å; T684-V688 PolarHBondContact O-N 3.31Å; F685-V688 WeakPolarHBondContact O-CA 3.33Å; F685-V688 WeakPolarHBondContact O-CB 3.34Å; F685-V688 PolarHBondContact O-N 3.07Å; V688-S690 VanDerWaalsContact C-N 3.34Å; V688-S690 PolarHBondContact O-N 2.9Å; V688-V691 PolarHBondContact O-N 2.92Å; V688-I692 HydrophobicContact CG1-CG1 4.39Å; V688-I692 VanDerWaalsContact O-CG1 3.32Å; V688-I692 WeakPolarHBondContact O-CG1 3.41Å; V688-I692 PolarHBondContact O-N 3.04Å
689	D	91.5	Very high	90.2	Very high	18 Å²	18	40.7 Å²	40.7	10%	0.096	23%	0.231	C	C	.	.	H	α-helix	trans	-55.7	-48.2	177.2	-170.3	48.7	0	0	0	111.2	K562 I563 L566 F685 V691 I692 Q693	K562-D689 IonicContact NZ-OD2 3.41Å; K562-D689 PolarHBondContact NZ-OD2 3.46Å; I563-D689 HydrophobicContact CD1-CB 4.14Å; I563-D689 HydrophobicContact CG1-CB 4.19Å; L566-D689 VanDerWaalsContact CD1-OD1 3.25Å; L566-D689 WeakPolarHBondContact CD1-OD1 3.23Å; F685-D689 PolarHBondContact O-N 3.34Å; D689-V691 PolarHBondContact O-N 3.39Å; D689-I692 PolarHBondContact O-N 2.95Å; D689-Q693 WeakPolarHBondContact O-CB 3.46Å; D689-Q693 PolarHBondContact O-N 3.35Å
690	S	94.2	Very high	91	Very high	46 Å²	46	37 Å²	37	32%	0.322	21%	0.206	S	C	.	.	H	α-helix	trans	-63.7	-41.2	179	-56.7	0	0	0	0	112.7	N686 K687 V688 Q693 E694	N686-S690 WeakPolarHBondContact O-CB 3.48Å; N686-S690 PolarHBondContact O-N 3.36Å; N686-S690 PolarHBondContact O-OG 2.97Å; K687-S690 PolarHBondContact O-N 3.44Å; V688-S690 VanDerWaalsContact C-N 3.34Å; V688-S690 PolarHBondContact O-N 2.9Å; S690-Q693 PolarHBondContact O-N 3.49Å; S690-E694 WeakPolarHBondContact O-CB 3.4Å; S690-E694 PolarHBondContact O-N 3.27Å
691	V	95.8	Very high	91.7	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65.7	-44.1	177.5	166.4	0	0	0	0	110.9	M606 L622 F623 A626 L670 L673 V674 K687 V688 D689 E694 T695	M606-V691 HydrophobicContact CE-CG1 3.78Å; L622-V691 HydrophobicContact CD2-CG1 4.47Å; L622-V691 HydrophobicContact CG-CG1 4.49Å; F623-V691 HydrophobicContact CD1-CG2 4.09Å; F623-V691 HydrophobicContact CE1-CG2 4.08Å; A626-V691 HydrophobicContact CB-CG1 3.63Å; L670-V691 HydrophobicContact CD1-CG1 4.16Å; L673-V691 HydrophobicContact CB-CG2 4.2Å; V674-V691 HydrophobicContact CG2-CG1 4.47Å; V674-V691 HydrophobicContact CG2-CG2 3.95Å; K687-V691 HydrophobicContact CG-CG2 4.35Å; K687-V691 WeakPolarHBondContact O-CB 3.36Å; K687-V691 VanDerWaalsContact O-CG2 3.23Å; K687-V691 WeakPolarHBondContact O-CG2 3.41Å; K687-V691 PolarHBondContact O-N 3.24Å; V688-V691 PolarHBondContact O-N 2.92Å; D689-V691 PolarHBondContact O-N 3.39Å; V691-E694 PolarHBondContact O-N 3.27Å; V691-T695 WeakPolarHBondContact O-CB 3.37Å; V691-T695 PolarHBondContact O-N 3.01Å; V691-T695 PolarHBondContact O-OG1 3.08Å; V691-T695 VanDerWaalsContact O-OG1 3.04Å
692	I	94.8	Very high	92.5	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.1	-45	176.6	-64.8	-67.2	0	0	0	110.8	L566 M570 M606 T610 L622 V688 D689 K696	L566-I692 HydrophobicContact CB-CG2 3.8Å; M570-I692 HydrophobicContact CE-CD1 4.17Å; M570-I692 HydrophobicContact CE-CG2 4.31Å; M606-I692 HydrophobicContact CB-CD1 4.21Å; M606-I692 HydrophobicContact CE-CD1 4.16Å; T610-I692 HydrophobicContact CG2-CD1 3.76Å; T610-I692 HydrophobicContact CG2-CG1 4.09Å; T610-I692 HydrophobicContact CG2-CG2 4.3Å; L622-I692 HydrophobicContact CD1-CD1 3.8Å; L622-I692 HydrophobicContact CD2-CD1 4.14Å; L622-I692 HydrophobicContact CD2-CG1 4.35Å; V688-I692 HydrophobicContact CG1-CG1 4.39Å; V688-I692 VanDerWaalsContact O-CG1 3.32Å; V688-I692 WeakPolarHBondContact O-CG1 3.41Å; V688-I692 PolarHBondContact O-N 3.04Å; D689-I692 PolarHBondContact O-N 2.95Å; I692-K696 WeakPolarHBondContact O-CB 3.33Å; I692-K696 PolarHBondContact O-N 3.35Å
693	Q	95	Very high	93.1	Very high	60 Å²	60	24 Å²	24	28%	0.28	13%	0.133	S	C	.	.	H	α-helix	trans	-61.2	-44.6	178.2	177.4	61.3	56.3	0	0	112	L566 D689 S690 K696 N697	L566-Q693 HydrophobicContact CD1-CB 4.21Å; D689-Q693 WeakPolarHBondContact O-CB 3.46Å; D689-Q693 PolarHBondContact O-N 3.35Å; S690-Q693 PolarHBondContact O-N 3.49Å; Q693-K696 VanDerWaalsContact NE2-CE 3.29Å; Q693-K696 WeakPolarHBondContact O-CB 3.41Å; Q693-K696 PolarHBondContact O-N 3.43Å; Q693-N697 PolarHBondContact NE2-OD1 3.49Å; Q693-N697 VanDerWaalsContact O-CG 3.23Å; Q693-N697 PolarHBondContact O-N 3.01Å; Q693-N697 PolarHBondContact O-ND2 3.37Å; Q693-N697 PolarHBondContact O-OD1 3.35Å
694	E	95.7	Very high	93.6	Very high	21 Å²	21	26 Å²	26	10%	0.098	14%	0.135	C	C	.	.	H	α-helix	trans	-72.6	-37.9	-178.1	-166.4	55.1	-144.4	0	0	112	H666 Q669 L670 L673 S690 V691 K696 N697 L698	H666-E694 IonicContact CE1-OE1 3.46Å; H666-E694 IonicContact CG-OE1 3.96Å; H666-E694 IonicContact ND1-OE1 3.47Å; H666-E694 PolarHBondContact ND1-OE1 3.39Å; Q669-E694 HydrophobicContact CB-CG 4.08Å; Q669-E694 PolarHBondContact OE1-OE1 3.48Å; L670-E694 HydrophobicContact CB-CG 4.09Å; L670-E694 HydrophobicContact CD1-CB 4.18Å; L670-E694 HydrophobicContact CD1-CG 4.38Å; L673-E694 HydrophobicContact CD1-CB 3.69Å; L673-E694 HydrophobicContact CD1-CG 3.99Å; S690-E694 WeakPolarHBondContact O-CB 3.4Å; S690-E694 PolarHBondContact O-N 3.27Å; V691-E694 PolarHBondContact O-N 3.27Å; E694-K696 VanDerWaalsContact C-N 3.32Å; E694-K696 PolarHBondContact O-N 3.07Å; E694-N697 PolarHBondContact O-N 3.28Å; E694-N697 PolarHBondContact OE2-ND2 3.4Å; E694-L698 PolarHBondContact O-N 2.95Å
695	T	96.3	Very high	94	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-59.9	-41.9	170.1	-64.4	0	0	0	0	111.5	M570 M606 F629 V691 L698 M699	M570-T695 HydrophobicContact SD-CG2 3.62Å; M606-T695 HydrophobicContact CE-CG2 4.02Å; M606-T695 VanDerWaalsContact CE-OG1 3.27Å; M606-T695 WeakPolarHBondContact CE-OG1 3.33Å; M606-T695 HydrophobicContact SD-CG2 3.7Å; F629-T695 HydrophobicContact CD1-CG2 3.96Å; F629-T695 HydrophobicContact CE1-CG2 3.73Å; F629-T695 HydrophobicContact CE2-CG2 4.32Å; F629-T695 HydrophobicContact CG-CG2 4.34Å; F629-T695 HydrophobicContact CZ-CG2 3.93Å; V691-T695 WeakPolarHBondContact O-CB 3.37Å; V691-T695 PolarHBondContact O-N 3.01Å; V691-T695 PolarHBondContact O-OG1 3.08Å; V691-T695 VanDerWaalsContact O-OG1 3.04Å; T695-L698 PolarHBondContact O-N 3.23Å; T695-M699 WeakPolarHBondContact O-CB 3.46Å; T695-M699 PolarHBondContact O-N 2.96Å
696	K	95.3	Very high	94.2	Very high	30 Å²	30	22.9 Å²	22.9	13%	0.13	12%	0.118	C	C	.	.	H	α-helix	trans	-59.7	-46.8	175.2	-175.1	-162.2	78	-179	0	111.4	E569 M570 L573 I692 Q693 E694 M699 N700	E569-K696 HydrophobicContact CB-CD 3.76Å; E569-K696 HydrophobicContact CB-CG 4.49Å; E569-K696 WeakPolarHBondContact OE2-CD 3.13Å; E569-K696 IonicContact OE2-NZ 3.95Å; E569-K696 PolarHBondContact OE2-NZ 3.32Å; M570-K696 HydrophobicContact CB-CB 4.33Å; M570-K696 HydrophobicContact CB-CG 4.33Å; L573-K696 HydrophobicContact CD1-CG 3.73Å; L573-K696 WeakPolarHBondContact CD1-O 3.42Å; I692-K696 WeakPolarHBondContact O-CB 3.33Å; I692-K696 PolarHBondContact O-N 3.35Å; Q693-K696 VanDerWaalsContact NE2-CE 3.29Å; Q693-K696 WeakPolarHBondContact O-CB 3.41Å; Q693-K696 PolarHBondContact O-N 3.43Å; E694-K696 VanDerWaalsContact C-N 3.32Å; E694-K696 PolarHBondContact O-N 3.07Å; K696-M699 PolarHBondContact O-N 3.38Å; K696-N700 PolarHBondContact O-N 3.18Å
697	N	95.7	Very high	94.4	Very high	48 Å²	48	21.4 Å²	21.4	26%	0.257	11%	0.111	S	C	.	.	H	α-helix	trans	-58.8	-48.3	178	-66.5	-18.1	0	0	0	111.1	Q693 E694 M699 N700 E701	Q693-N697 PolarHBondContact NE2-OD1 3.49Å; Q693-N697 VanDerWaalsContact O-CG 3.23Å; Q693-N697 PolarHBondContact O-N 3.01Å; Q693-N697 PolarHBondContact O-ND2 3.37Å; Q693-N697 PolarHBondContact O-OD1 3.35Å; E694-N697 PolarHBondContact O-N 3.28Å; E694-N697 PolarHBondContact OE2-ND2 3.4Å; N697-M699 PolarHBondContact O-N 3.36Å; N697-N700 WeakPolarHBondContact O-CB 3.43Å; N697-N700 PolarHBondContact O-N 3.44Å; N697-E701 PolarHBondContact O-N 2.92Å
698	L	96.2	Very high	94.4	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61.7	-42.8	176.6	179.4	49.2	0	0	0	111.7	F629 A633 I663 H666 L670 E694 T695 N700 E701 I702	F629-L698 HydrophobicContact CD1-CD2 3.87Å; F629-L698 HydrophobicContact CD1-CG 4.48Å; F629-L698 HydrophobicContact CE1-CB 4.05Å; F629-L698 HydrophobicContact CE1-CD2 3.56Å; F629-L698 HydrophobicContact CE1-CG 3.68Å; F629-L698 HydrophobicContact CZ-CG 4.49Å; A633-L698 HydrophobicContact CB-CD1 4.27Å; A633-L698 HydrophobicContact CB-CD2 3.86Å; A633-L698 HydrophobicContact CB-CG 4.42Å; I663-L698 HydrophobicContact CD1-CD1 3.96Å; I663-L698 HydrophobicContact CG2-CD1 4.2Å; H666-L698 HydrophobicContact CB-CB 4Å; H666-L698 HydrophobicContact CB-CD1 3.83Å; H666-L698 HydrophobicContact CB-CD2 4.46Å; H666-L698 HydrophobicContact CB-CG 4.29Å; L670-L698 HydrophobicContact CD2-CD2 4.29Å; E694-L698 PolarHBondContact O-N 2.95Å; T695-L698 PolarHBondContact O-N 3.23Å; L698-N700 VanDerWaalsContact C-N 3.29Å; L698-N700 PolarHBondContact O-N 3.06Å; L698-E701 PolarHBondContact O-N 2.93Å; L698-I702 HydrophobicContact CD1-CG1 4.18Å; L698-I702 VanDerWaalsContact O-CG1 3.24Å; L698-I702 WeakPolarHBondContact O-CG1 3.48Å; L698-I702 PolarHBondContact O-N 3.37Å
699	M	95.2	Very high	94.4	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-62.5	-35.6	178.6	-164.5	62.1	-173.4	0	0	112.6	L573 T574 V577 A603 F629 T695 K696 N697 I702 A703	L573-M699 HydrophobicContact CB-CB 4.4Å; L573-M699 HydrophobicContact CB-CG 3.87Å; L573-M699 HydrophobicContact CD1-CB 4.31Å; T574-M699 HydrophobicContact CG2-CE 4.24Å; V577-M699 HydrophobicContact CB-CE 3.54Å; V577-M699 HydrophobicContact CG1-CE 3.88Å; V577-M699 HydrophobicContact CG2-CE 3.38Å; V577-M699 HydrophobicContact CG2-SD 4.45Å; A603-M699 HydrophobicContact CB-CG 4.45Å; A603-M699 HydrophobicContact CB-SD 4.22Å; F629-M699 HydrophobicContact CE2-SD 4.02Å; F629-M699 HydrophobicContact CZ-CB 4.26Å; F629-M699 HydrophobicContact CZ-SD 3.82Å; T695-M699 WeakPolarHBondContact O-CB 3.46Å; T695-M699 PolarHBondContact O-N 2.96Å; K696-M699 PolarHBondContact O-N 3.38Å; N697-M699 PolarHBondContact O-N 3.36Å; M699-I702 PolarHBondContact O-N 3.38Å; M699-A703 PolarHBondContact O-N 2.7Å
700	N	94.5	Very high	94.4	Very high	59 Å²	59	22.2 Å²	22.2	32%	0.316	12%	0.115	S	C	.	.	H	α-helix	trans	-64.5	-42.2	174	-174.7	48	0	0	0	112.2	L573 K696 N697 L698 I702 A703 K704	L573-N700 HydrophobicContact CD1-CB 3.91Å; L573-N700 HydrophobicContact CD2-CB 4.1Å; K696-N700 PolarHBondContact O-N 3.18Å; N697-N700 WeakPolarHBondContact O-CB 3.43Å; N697-N700 PolarHBondContact O-N 3.44Å; L698-N700 VanDerWaalsContact C-N 3.29Å; L698-N700 PolarHBondContact O-N 3.06Å; N700-I702 VanDerWaalsContact C-N 3.31Å; N700-A703 PolarHBondContact O-N 2.94Å; N700-K704 PolarHBondContact ND2-NZ 3.19Å; N700-K704 WeakPolarHBondContact O-CG 3.37Å; N700-K704 PolarHBondContact O-N 3.42Å
701	E	95.2	Very high	94.2	Very high	13 Å²	13	23 Å²	23	6%	0.061	12%	0.117	C	C	.	.	H	α-helix	trans	-67.8	-33.2	174.2	-63	-56.4	118	0	0	111.7	R662 I663 N697 L698 K704 L705	R662-E701 WeakPolarHBondContact CD-OE2 3.39Å; R662-E701 IonicContact NH1-OE1 3.34Å; R662-E701 IonicContact NH1-OE2 2.82Å; R662-E701 PolarHBondContact NH1-OE2 3.4Å; I663-E701 HydrophobicContact CD1-CB 3.7Å; N697-E701 PolarHBondContact O-N 2.92Å; L698-E701 PolarHBondContact O-N 2.93Å; E701-K704 PolarHBondContact O-N 2.97Å; E701-K704 IonicContact OE1-NZ 3.25Å; E701-K704 PolarHBondContact OE1-NZ 3.13Å; E701-L705 VanDerWaalsContact O-CB 3.28Å; E701-L705 WeakPolarHBondContact O-CB 3.36Å; E701-L705 PolarHBondContact O-N 3.26Å
702	I	95.2	Very high	93.9	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-66.6	-40.9	174.2	-65.3	-74.5	0	0	0	111.6	V577 M599 M636 I663 L698 M699 N700 L705 V706	V577-I702 HydrophobicContact CG2-CG2 4.3Å; M599-I702 HydrophobicContact CE-CB 4.47Å; M599-I702 HydrophobicContact CE-CD1 3.61Å; M599-I702 HydrophobicContact CE-CG1 3.49Å; M599-I702 VanDerWaalsContact CE-CG1 3.49Å; M599-I702 HydrophobicContact CE-CG2 4.46Å; M599-I702 HydrophobicContact SD-CD1 3.7Å; M599-I702 HydrophobicContact SD-CG1 4.09Å; M599-I702 HydrophobicContact SD-CG2 4.28Å; M636-I702 HydrophobicContact CG-CD1 4.02Å; I663-I702 HydrophobicContact CD1-CD1 3.86Å; I663-I702 HydrophobicContact CD1-CG1 4.25Å; L698-I702 HydrophobicContact CD1-CG1 4.18Å; L698-I702 VanDerWaalsContact O-CG1 3.24Å; L698-I702 WeakPolarHBondContact O-CG1 3.48Å; L698-I702 PolarHBondContact O-N 3.37Å; M699-I702 PolarHBondContact O-N 3.38Å; N700-I702 VanDerWaalsContact C-N 3.31Å; I702-L705 HydrophobicContact CD1-CD2 4.4Å; I702-L705 WeakPolarHBondContact O-CB 3.45Å; I702-L705 PolarHBondContact O-N 3.22Å; I702-V706 HydrophobicContact CG2-CG2 4.28Å; I702-V706 VanDerWaalsContact O-CG2 3.27Å; I702-V706 WeakPolarHBondContact O-CG2 3.48Å; I702-V706 PolarHBondContact O-N 3.46Å
703	A	93.1	Very high	93.5	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.008	12%	0.122	C	C	.	.	H	α-helix	trans	-55.6	-53.3	173.7	0	0	0	0	0	111.4	E576 V577 M699 N700 L705 V706 T707	E576-A703 HydrophobicContact CG-CB 4.43Å; V577-A703 HydrophobicContact CG2-CB 3.71Å; M699-A703 PolarHBondContact O-N 2.7Å; N700-A703 PolarHBondContact O-N 2.94Å; A703-L705 VanDerWaalsContact C-N 3.28Å; A703-L705 PolarHBondContact O-N 2.75Å; A703-V706 PolarHBondContact O-N 3.2Å; A703-T707 PolarHBondContact O-N 3.46Å; A703-T707 VanDerWaalsContact O-N 3.09Å; A703-T707 PolarHBondContact O-OG1 2.96Å; A703-T707 VanDerWaalsContact O-OG1 3.12Å
704	K	94.2	Very high	93.1	Very high	79 Å²	79	24.4 Å²	24.4	34%	0.343	13%	0.132	S	C	.	.	H	α-helix	trans	-58.7	-39.3	176	-63.4	171.8	-166.5	166.8	0	112.5	T659 N700 E701 T707 S708	T659-K704 HydrophobicContact CG2-CB 3.81Å; N700-K704 PolarHBondContact ND2-NZ 3.19Å; N700-K704 WeakPolarHBondContact O-CG 3.37Å; N700-K704 PolarHBondContact O-N 3.42Å; E701-K704 PolarHBondContact O-N 2.97Å; E701-K704 IonicContact OE1-NZ 3.25Å; E701-K704 PolarHBondContact OE1-NZ 3.13Å; K704-T707 PolarHBondContact O-N 3.32Å; K704-S708 WeakPolarHBondContact O-CB 3.45Å; K704-S708 PolarHBondContact O-N 3.47Å; K704-S708 PolarHBondContact O-OG 2.86Å
705	L	94.9	Very high	92.7	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-64.9	-46.1	-179.9	-169	70	0	0	0	111.5	M636 V640 L656 T659 L660 I663 E701 I702 A703 S708 C709	M636-L705 HydrophobicContact CE-CD2 3.98Å; M636-L705 HydrophobicContact CE-CG 4.44Å; M636-L705 HydrophobicContact CG-CD2 3.94Å; V640-L705 HydrophobicContact CB-CD2 4.46Å; V640-L705 HydrophobicContact CG1-CD1 3.99Å; V640-L705 HydrophobicContact CG1-CG 4.32Å; V640-L705 HydrophobicContact CG2-CD2 4Å; V640-L705 HydrophobicContact CG2-CG 4.3Å; L656-L705 HydrophobicContact CD1-CD1 3.87Å; T659-L705 HydrophobicContact CG2-CB 4.12Å; T659-L705 HydrophobicContact CG2-CD1 4.18Å; L660-L705 HydrophobicContact CB-CD1 3.98Å; L660-L705 HydrophobicContact CD1-CD1 4.1Å; L660-L705 HydrophobicContact CD1-CD2 4.27Å; I663-L705 HydrophobicContact CD1-CD2 4.43Å; I663-L705 HydrophobicContact CG1-CD2 4.19Å; E701-L705 VanDerWaalsContact O-CB 3.28Å; E701-L705 WeakPolarHBondContact O-CB 3.36Å; E701-L705 PolarHBondContact O-N 3.26Å; I702-L705 HydrophobicContact CD1-CD2 4.4Å; I702-L705 WeakPolarHBondContact O-CB 3.45Å; I702-L705 PolarHBondContact O-N 3.22Å; A703-L705 VanDerWaalsContact C-N 3.28Å; A703-L705 PolarHBondContact O-N 2.75Å; L705-S708 PolarHBondContact O-N 3.46Å; L705-C709 WeakPolarHBondContact O-CB 3.44Å; L705-C709 PolarHBondContact O-N 3.1Å; L705-C709 PolarHBondContact O-SG 3Å
706	V	93.1	Very high	92.3	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63.4	-43.5	178.6	179.6	0	0	0	0	110.4	E580 A596 M636 I702 A703 C709 F710	E580-V706 HydrophobicContact CB-CG1 4.06Å; E580-V706 HydrophobicContact CG-CB 4.21Å; E580-V706 HydrophobicContact CG-CG1 3.63Å; A596-V706 HydrophobicContact CB-CG2 3.66Å; M636-V706 HydrophobicContact CE-CG2 3.67Å; I702-V706 HydrophobicContact CG2-CG2 4.28Å; I702-V706 VanDerWaalsContact O-CG2 3.27Å; I702-V706 WeakPolarHBondContact O-CG2 3.48Å; I702-V706 PolarHBondContact O-N 3.46Å; A703-V706 PolarHBondContact O-N 3.2Å; V706-C709 PolarHBondContact O-N 2.96Å; V706-F710 PolarHBondContact O-N 3.43Å
707	T	92.2	Very high	91.4	Very high	45 Å²	45	38.4 Å²	38.4	28%	0.276	20%	0.195	S	C	.	.	H	α-helix	trans	-61.9	-46	175.7	-55.1	0	0	0	0	111.7	E580 A703 K704 C709 F710 V711	E580-T707 WeakPolarHBondContact CG-OG1 3.48Å; E580-T707 PolarHBondContact OE2-OG1 3.18Å; A703-T707 PolarHBondContact O-N 3.46Å; A703-T707 VanDerWaalsContact O-N 3.09Å; A703-T707 PolarHBondContact O-OG1 2.96Å; A703-T707 VanDerWaalsContact O-OG1 3.12Å; K704-T707 PolarHBondContact O-N 3.32Å; T707-C709 PolarHBondContact O-N 3.29Å; T707-F710 WeakPolarHBondContact O-CB 3.47Å; T707-F710 PolarHBondContact O-N 3.12Å; T707-F710 VanDerWaalsContact O-N 3.11Å; T707-V711 WeakPolarHBondContact O-CG2 3.43Å; T707-V711 PolarHBondContact O-N 3.07Å
708	S	92.5	Very high	90.6	Very high	15 Å²	15	36.9 Å²	36.9	11%	0.105	19%	0.186	C	C	.	.	H	α-helix	trans	-63.4	-40.6	178.8	-60	0	0	0	0	112.1	K704 L705 F710 V711 C712	K704-S708 WeakPolarHBondContact O-CB 3.45Å; K704-S708 PolarHBondContact O-N 3.47Å; K704-S708 PolarHBondContact O-OG 2.86Å; L705-S708 PolarHBondContact O-N 3.46Å; S708-F710 VanDerWaalsContact C-N 3.29Å; S708-F710 PolarHBondContact O-N 2.99Å; S708-V711 PolarHBondContact O-N 2.91Å; S708-C712 PolarHBondContact O-N 3.18Å; S708-C712 PolarHBondContact O-SG 3.49Å
709	C	92.2	Very high	88.9	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.1	-40.6	173.1	-74.7	0	0	0	0	111.6	W584 I592 V640 F643 L656 L705 V706 T707 C712 A713	W584-C709 HydrophobicContact CH2-CB 3.87Å; W584-C709 VanDerWaalsContact CZ2-C 3.46Å; W584-C709 HydrophobicContact CZ2-CB 3.65Å; I592-C709 HydrophobicContact CD1-CB 4.39Å; I592-C709 HydrophobicContact CG2-CB 4.43Å; V640-C709 VanDerWaalsContact CG1-SG 3.54Å; F643-C709 HydrophobicContact CE1-CB 4.15Å; L656-C709 VanDerWaalsContact CD1-SG 3.56Å; L705-C709 WeakPolarHBondContact O-CB 3.44Å; L705-C709 PolarHBondContact O-N 3.1Å; L705-C709 PolarHBondContact O-SG 3Å; V706-C709 PolarHBondContact O-N 2.96Å; T707-C709 PolarHBondContact O-N 3.29Å; C709-C712 PolarHBondContact O-N 3.06Å; C709-A713 VanDerWaalsContact O-CB 3.29Å; C709-A713 WeakPolarHBondContact O-CB 3.3Å; C709-A713 PolarHBondContact O-N 3.19Å
710	F	90.3	Very high	87.1	Confident	50 Å²	50	45.4 Å²	45.4	22%	0.219	23%	0.226	C	C	.	.	H	α-helix	trans	-66.5	-46.1	-178.5	-176.5	-108.9	0	0	0	110.8	K583 W584 V706 T707 S708 C712 A713 T714	K583-F710 HydrophobicContact CB-CD2 4.33Å; K583-F710 HydrophobicContact CB-CE1 4.23Å; K583-F710 HydrophobicContact CB-CE2 3.81Å; K583-F710 HydrophobicContact CB-CZ 3.76Å; K583-F710 HydrophobicContact CD-CD1 4.44Å; K583-F710 HydrophobicContact CD-CE1 4.18Å; K583-F710 WeakPolarHBondContact O-CE2 3.48Å; W584-F710 AromaticContact CD1-CD2 3.51Å; W584-F710 AromaticContact CD2-CD2 3.93Å; W584-F710 HydrophobicContact CD2-CD2 3.93Å; W584-F710 AromaticContact CE2-CD2 3.61Å; W584-F710 AromaticContact CG-CD2 3.92Å; W584-F710 HydrophobicContact CG-CD2 3.92Å; W584-F710 HydrophobicContact CG-CE2 4.44Å; W584-F710 HydrophobicContact CZ2-CB 3.73Å; W584-F710 HydrophobicContact CZ2-CD2 4.28Å; W584-F710 AromaticContact NE1-CD2 3.32Å; W584-F710 VanDerWaalsContact NE1-CD2 3.32Å; W584-F710 AromaticContact NE1-CG 3.68Å; V706-F710 PolarHBondContact O-N 3.43Å; T707-F710 WeakPolarHBondContact O-CB 3.47Å; T707-F710 PolarHBondContact O-N 3.12Å; T707-F710 VanDerWaalsContact O-N 3.11Å; S708-F710 VanDerWaalsContact C-N 3.29Å; S708-F710 PolarHBondContact O-N 2.99Å; F710-C712 VanDerWaalsContact C-N 3.35Å; F710-C712 PolarHBondContact O-N 3.49Å; F710-A713 PolarHBondContact O-N 2.94Å; F710-T714 HydrophobicContact CD1-CG2 4.34Å; F710-T714 HydrophobicContact CD2-CG2 4.14Å; F710-T714 HydrophobicContact CE1-CG2 3.96Å; F710-T714 HydrophobicContact CE2-CG2 3.77Å; F710-T714 HydrophobicContact CG-CG2 4.43Å; F710-T714 HydrophobicContact CZ-CG2 3.67Å; F710-T714 WeakPolarHBondContact O-CB 3.48Å; F710-T714 WeakPolarHBondContact O-CG2 3.36Å; F710-T714 PolarHBondContact O-N 3.43Å; F710-T714 PolarHBondContact O-OG1 2.88Å
711	V	89.9	Confident	84.7	Confident	61 Å²	61	52.8 Å²	52.8	37%	0.37	25%	0.249	S	C	.	.	H	α-helix	trans	-58.8	-45.9	175.9	172.6	0	0	0	0	110.8	E652 T707 S708 T714 K715	E652-V711 HydrophobicContact CG-CG1 3.98Å; T707-V711 WeakPolarHBondContact O-CG2 3.43Å; T707-V711 PolarHBondContact O-N 3.07Å; S708-V711 PolarHBondContact O-N 2.91Å; V711-T714 PolarHBondContact O-OG1 3.41Å; V711-T714 VanDerWaalsContact O-OG1 3.11Å; V711-K715 WeakPolarHBondContact O-CB 3.31Å; V711-K715 PolarHBondContact O-N 2.89Å
712	C	90.1	Very high	81.8	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-64	-46.2	177.4	-69.1	0	0	0	0	112.1	F643 V647 S708 C709 F710 T714 K715 F716	F643-C712 HydrophobicContact CE1-CB 3.9Å; F643-C712 HydrophobicContact CZ-CB 3.9Å; V647-C712 HydrophobicContact CG1-CB 4.15Å; V647-C712 HydrophobicContact CG2-CB 3.97Å; S708-C712 PolarHBondContact O-N 3.18Å; S708-C712 PolarHBondContact O-SG 3.49Å; C709-C712 PolarHBondContact O-N 3.06Å; F710-C712 VanDerWaalsContact C-N 3.35Å; F710-C712 PolarHBondContact O-N 3.49Å; C712-T714 PolarHBondContact O-N 3.43Å; C712-K715 PolarHBondContact O-N 3.35Å; C712-F716 VanDerWaalsContact O-CD2 3.26Å; C712-F716 WeakPolarHBondContact O-CD2 3.21Å; C712-F716 PolarHBondContact O-N 3.13Å; C712-F716 VanDerWaalsContact O-N 3.09Å
713	A	87.5	Confident	78.8	Confident	11 Å²	11	59.7 Å²	59.7	9%	0.091	31%	0.309	C	S	.	.	H	α-helix	trans	-62.9	-43.9	-177.8	0	0	0	0	0	111.8	W584 F643 C709 F710 E717 I718 F720	W584-A713 HydrophobicContact CH2-CB 3.99Å; W584-A713 HydrophobicContact CZ3-CB 4.18Å; F643-A713 HydrophobicContact CE2-CB 4.25Å; F643-A713 HydrophobicContact CZ-CB 3.95Å; C709-A713 VanDerWaalsContact O-CB 3.29Å; C709-A713 WeakPolarHBondContact O-CB 3.3Å; C709-A713 PolarHBondContact O-N 3.19Å; F710-A713 PolarHBondContact O-N 2.94Å; A713-E717 WeakPolarHBondContact O-CA 3.32Å; A713-E717 PolarHBondContact O-N 2.82Å; A713-E717 VanDerWaalsContact O-N 3.12Å; A713-I718 PolarHBondContact O-N 3.01Å; A713-F720 HydrophobicContact CB-CE2 3.89Å; A713-F720 HydrophobicContact CB-CZ 3.82Å
714	T	85.8	Confident	75.8	Confident	80 Å²	80	65.6 Å²	65.6	49%	0.491	35%	0.345	S	S	.	.	H	α-helix	trans	-71.2	-41.5	179	51.9	0	0	0	0	112.4	F710 V711 C712	F710-T714 HydrophobicContact CD1-CG2 4.34Å; F710-T714 HydrophobicContact CD2-CG2 4.14Å; F710-T714 HydrophobicContact CE1-CG2 3.96Å; F710-T714 HydrophobicContact CE2-CG2 3.77Å; F710-T714 HydrophobicContact CG-CG2 4.43Å; F710-T714 HydrophobicContact CZ-CG2 3.67Å; F710-T714 WeakPolarHBondContact O-CB 3.48Å; F710-T714 WeakPolarHBondContact O-CG2 3.36Å; F710-T714 PolarHBondContact O-N 3.43Å; F710-T714 PolarHBondContact O-OG1 2.88Å; V711-T714 PolarHBondContact O-OG1 3.41Å; V711-T714 VanDerWaalsContact O-OG1 3.11Å; C712-T714 PolarHBondContact O-N 3.43Å
715	K	87.5	Confident	72.6	Confident	112 Å²	112	68 Å²	68	49%	0.487	37%	0.366	S	S	.	.	H	α-helix	trans	-68.7	-35	-178.2	-173	176	-176.5	-175.6	0	113.3	E652 V711 C712	E652-K715 HydrophobicContact CG-CD 4.05Å; E652-K715 IonicContact OE1-NZ 3.48Å; E652-K715 PolarHBondContact OE1-NZ 3.36Å; E652-K715 IonicContact OE2-NZ 2.58Å; E652-K715 PolarHBondContact OE2-NZ 3.44Å; V711-K715 WeakPolarHBondContact O-CB 3.31Å; V711-K715 PolarHBondContact O-N 2.89Å; C712-K715 PolarHBondContact O-N 3.35Å
716	F	86.8	Confident	69.5	Low	58 Å²	58	73.2 Å²	73.2	25%	0.254	40%	0.402	S	S	.	.	H	α-helix	trans	-108	7.5	-174.8	-60.3	-67.3	0	0	0	114	V647 P648 S650 E652 C712 I718	V647-F716 HydrophobicContact CG1-CD2 3.79Å; V647-F716 HydrophobicContact CG1-CE2 3.81Å; P648-F716 HydrophobicContact CB-CD1 4.35Å; P648-F716 HydrophobicContact CB-CE1 4.3Å; P648-F716 HydrophobicContact CG-CB 4.43Å; P648-F716 HydrophobicContact CG-CD1 3.74Å; P648-F716 HydrophobicContact CG-CE1 4.19Å; P648-F716 HydrophobicContact CG-CG 4.07Å; S650-F716 VanDerWaalsContact CB-CZ 3.48Å; S650-F716 WeakPolarHBondContact OG-CE2 3.46Å; S650-F716 VanDerWaalsContact OG-CZ 3.29Å; S650-F716 WeakPolarHBondContact OG-CZ 3.15Å; E652-F716 HydrophobicContact CB-CE2 4.49Å; C712-F716 VanDerWaalsContact O-CD2 3.26Å; C712-F716 WeakPolarHBondContact O-CD2 3.21Å; C712-F716 PolarHBondContact O-N 3.13Å; C712-F716 VanDerWaalsContact O-N 3.09Å; F716-I718 HydrophobicContact CB-CD1 4.04Å; F716-I718 HydrophobicContact CB-CG1 3.86Å; F716-I718 PolarHBondContact O-N 2.96Å
717	E	78.1	Confident	66.4	Low	174 Å²	174	78.3 Å²	78.3	81%	0.813	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	43.3	178.5	-60.5	-175.9	169.6	0	0	113.1	A713 E719	A713-E717 WeakPolarHBondContact O-CA 3.32Å; A713-E717 PolarHBondContact O-N 2.82Å; A713-E717 VanDerWaalsContact O-N 3.12Å; E717-E719 PolarHBondContact O-N 3.35Å; E717-E719 VanDerWaalsContact O-N 3.15Å
718	I	77.8	Confident	63.4	Low	16 Å²	16	81.5 Å²	81.5	8%	0.082	46%	0.462	C	S	.	.			trans	-74.1	107.9	-175.3	-60.1	172	0	0	0	109.2	F643 E646 V647 A713 F716 F720	F643-I718 HydrophobicContact CD2-CG2 4.48Å; F643-I718 HydrophobicContact CE2-CB 4.28Å; F643-I718 HydrophobicContact CE2-CD1 3.8Å; F643-I718 HydrophobicContact CE2-CG2 4.04Å; F643-I718 HydrophobicContact CZ-CD1 4.04Å; E646-I718 HydrophobicContact CB-CD1 4.36Å; E646-I718 HydrophobicContact CB-CG2 3.84Å; E646-I718 WeakPolarHBondContact OE2-CG2 3.36Å; V647-I718 HydrophobicContact CB-CD1 4.29Å; V647-I718 HydrophobicContact CG2-CD1 3.69Å; A713-I718 PolarHBondContact O-N 3.01Å; F716-I718 HydrophobicContact CB-CD1 4.04Å; F716-I718 HydrophobicContact CB-CG1 3.86Å; F716-I718 PolarHBondContact O-N 2.96Å; I718-F720 PolarHBondContact O-N 3.16Å
719	E	60.3	Low	60.3	Low	125 Å²	125	91.6 Å²	91.6	58%	0.584	50%	0.498	S	S	*	.			trans	-73.1	109.1	173.6	-81.9	-163.4	147.9	0	0	110.7	K44 E717 R721	K44-E719 IonicContact NZ-OE1 3.52Å; K44-E719 PolarHBondContact NZ-OE1 3.41Å; E717-E719 PolarHBondContact O-N 3.35Å; E717-E719 VanDerWaalsContact O-N 3.15Å; E719-R721 PolarHBondContact O-N 3.07Å
720	F	57.3	Low	57.1	Low	54 Å²	54	99.5 Å²	99.5	24%	0.237	54%	0.539	C	S	.	.			trans	-64.6	97.8	175.5	-66.5	-81.1	0	0	0	111.9	W584 Y587 N590 I592 F643 A713 I718 S722	W584-F720 HydrophobicContact CE3-CE2 4.37Å; W584-F720 HydrophobicContact CH2-CE2 4.44Å; W584-F720 AromaticContact CH2-CZ 3.93Å; W584-F720 HydrophobicContact CH2-CZ 3.93Å; W584-F720 HydrophobicContact CZ3-CE1 4.3Å; W584-F720 AromaticContact CZ3-CE2 3.58Å; W584-F720 HydrophobicContact CZ3-CE2 3.58Å; W584-F720 AromaticContact CZ3-CZ 3.41Å; W584-F720 HydrophobicContact CZ3-CZ 3.41Å; W584-F720 VanDerWaalsContact CZ3-CZ 3.41Å; Y587-F720 AromaticContact CD1-CD2 3.87Å; Y587-F720 HydrophobicContact CD1-CD2 3.87Å; Y587-F720 HydrophobicContact CE1-CD2 4.11Å; Y587-F720 HydrophobicContact CG-CD2 4.27Å; N590-F720 WeakPolarHBondContact ND2-CD1 3.41Å; N590-F720 WeakPolarHBondContact ND2-CD2 3.4Å; N590-F720 WeakPolarHBondContact ND2-CE1 3.46Å; N590-F720 WeakPolarHBondContact ND2-CE2 3.07Å; N590-F720 VanDerWaalsContact ND2-CG 3.3Å; N590-F720 WeakPolarHBondContact ND2-CG 3.28Å; N590-F720 VanDerWaalsContact ND2-CZ 3.28Å; N590-F720 WeakPolarHBondContact ND2-CZ 3.46Å; I592-F720 HydrophobicContact CD1-CE1 4.37Å; F643-F720 AromaticContact CD2-CE1 3.46Å; F643-F720 HydrophobicContact CD2-CE1 3.46Å; F643-F720 VanDerWaalsContact CD2-CE1 3.46Å; F643-F720 AromaticContact CD2-CZ 3.88Å; F643-F720 HydrophobicContact CD2-CZ 3.88Å; F643-F720 AromaticContact CE2-CE1 3.59Å; F643-F720 HydrophobicContact CE2-CE1 3.59Å; F643-F720 AromaticContact CE2-CZ 3.48Å; F643-F720 HydrophobicContact CE2-CZ 3.48Å; F643-F720 VanDerWaalsContact CE2-CZ 3.48Å; F643-F720 HydrophobicContact CG-CE1 4.41Å; F643-F720 HydrophobicContact CZ-CZ 4.26Å; A713-F720 HydrophobicContact CB-CE2 3.89Å; A713-F720 HydrophobicContact CB-CZ 3.82Å; I718-F720 PolarHBondContact O-N 3.16Å; F720-S722 PolarHBondContact O-N 2.97Å
721	R	44.7	Very low	54.3	Low	214 Å²	214	104.9 Å²	104.9	81%	0.808	57%	0.57	S	S	*	*			trans	-81.5	106.4	163.2	-72.7	-171.2	-179	-152	1.1	108.4	E719 G723	E719-R721 PolarHBondContact O-N 3.07Å; R721-G723 PolarHBondContact O-N 3.49Å
722	S	35.4	Very low	51.5	Low	93 Å²	93	110 Å²	110	65%	0.65	59%	0.594	S	S	*	*			trans	-53.9	110.9	167.8	-162.1	0	0	0	0	108.9	F720 V724	F720-S722 PolarHBondContact O-N 2.97Å; S722-V724 PolarHBondContact O-N 3.29Å
723	G	31.5	Very low	48.7	Very low	66 Å²	66	118.3 Å²	118.3	68%	0.68	63%	0.632	S	S	*	*			trans	-65.9	102.5	-178.4	0	0	0	0	0	110.5	R721 V725	R721-G723 PolarHBondContact O-N 3.49Å; G723-V725 PolarHBondContact O-N 3.11Å; G723-V725 VanDerWaalsContact O-N 3.13Å
724	V	29.2	Very low	46	Very low	125 Å²	125	127.2 Å²	127.2	76%	0.758	67%	0.672	S	S	*	*			trans	-67.9	107.8	157.5	-172.3	0	0	0	0	106.3	S722 S726	S722-V724 PolarHBondContact O-N 3.29Å; V724-S726 VanDerWaalsContact C-N 3.35Å; V724-S726 PolarHBondContact O-N 2.78Å
725	V	28.4	Very low	43.4	Very low	129 Å²	129	125.5 Å²	125.5	78%	0.782	67%	0.671	S	S	*	*			trans	-47.3	100.8	161.2	178.6	0	0	0	0	107.9	G723	G723-V725 PolarHBondContact O-N 3.11Å; G723-V725 VanDerWaalsContact O-N 3.13Å
726	S	29.5	Very low	40.8	Very low	109 Å²	109	125.8 Å²	125.8	76%	0.762	69%	0.687	S	S	*	*			trans	-103.1	72.1	164.6	-69.4	0	0	0	0	107.7	V724 S728	V724-S726 VanDerWaalsContact C-N 3.35Å; V724-S726 PolarHBondContact O-N 2.78Å; S726-S728 VanDerWaalsContact C-N 3.32Å; S726-S728 PolarHBondContact O-N 3.43Å
727	S	27	Very low	38.2	Very low	107 Å²	107	130 Å²	130	75%	0.748	71%	0.712	S	S	*	*			trans	-74.6	92.6	151.8	-161.9	0	0	0	0	106.3
728	S	29.1	Very low	36.1	Very low	113 Å²	113	131.5 Å²	131.5	79%	0.79	71%	0.712	S	S	*	*			trans	-142.8	96.8	161.9	-87.9	0	0	0	0	109	S726 L730	S726-S728 VanDerWaalsContact C-N 3.32Å; S726-S728 PolarHBondContact O-N 3.43Å; S728-L730 PolarHBondContact O-N 2.78Å
729	R	27.8	Very low	34.1	Very low	227 Å²	227	138.8 Å²	138.8	86%	0.857	75%	0.745	S	S	*	*			trans	-45	129	150.6	-76.4	175.9	-178.8	-179.4	-0.5	109.1	L731	R729-L731 PolarHBondContact O-N 3.3Å
730	L	26.2	Very low	32.9	Very low	165 Å²	165	137.4 Å²	137.4	86%	0.864	75%	0.747	S	S	*	*			trans	22.5	90.1	130.4	-68.4	160.5	0	0	0	115	S728	S728-L730 PolarHBondContact O-N 2.78Å
731	L	30.2	Very low	31.9	Very low	164 Å²	164	143 Å²	143	86%	0.859	77%	0.774	S	S	*	*			trans	-132.8	94.4	148.8	-78.2	178.8	0	0	0	108.1	R729	R729-L731 PolarHBondContact O-N 3.3Å
732	L	31.7	Very low	31.3	Very low	168 Å²	168	143.4 Å²	143.4	88%	0.88	78%	0.775	S	S	*	*			trans	17.8	109.1	144.6	-63	165.9	0	0	0	116.9
733	H	30.9	Very low	31.2	Very low	174 Å²	174	144.6 Å²	144.6	81%	0.806	78%	0.783	S	S	*	*			trans	-62.5	118.6	156.3	-169.1	-11.2	0	0	0	109.2	G735	H733-G735 PolarHBondContact O-N 3.44Å
734	E	31.8	Very low	31.2	Very low	199 Å²	199	144.8 Å²	144.8	93%	0.93	79%	0.785	S	S	*	*			trans	-72.8	108.7	151.6	-90.8	-175.1	140.8	0	0	106.7
735	G	31	Very low	31.3	Very low	44 Å²	44	147.6 Å²	147.6	45%	0.454	79%	0.79	S	S	.	*			trans	-145.1	135	175.1	0	0	0	0	0	109	H733	H733-G735 PolarHBondContact O-N 3.44Å
736	S	33.2	Very low	31.5	Very low	118 Å²	118	146.9 Å²	146.9	83%	0.825	79%	0.79	S	S	*	*			trans	65.7	119.1	154.4	66.7	0	0	0	0	120.4
737	D	31.4	Very low	31.7	Very low	146 Å²	146	147.3 Å²	147.3	78%	0.781	79%	0.794	S	S	*	*	S	Bend	trans	-44.7	133.7	140.5	-81	-47.2	0	0	0	111.9
738	Y	34.1	Very low	32.2	Very low	206 Å²	206	147.4 Å²	147.4	81%	0.808	79%	0.792	S	S	*	*	S	Bend	trans	44	122.7	149.9	-75.2	-103.9	0	0	0	117.3
739	E	35.9	Very low	32	Very low	169 Å²	169	153.8 Å²	153.8	79%	0.79	80%	0.799	S	S	*	*			cis	-166.5	160.9	24.5	-122	-179.4	-175.9	0	0	108.2
740	P	34.3	Very low	32.3	Very low	96 Å²	96	154.7 Å²	154.7	62%	0.623	80%	0.802	S	S	*	*			trans	-94.1	150.6	-174.8	35.7	-27.7	0	0	0	111.8
741	H	36	Very low	32.4	Very low	171 Å²	171	157.8 Å²	157.8	79%	0.792	80%	0.802	S	S	*	*				178	120.4	125.5	-88.2	-49.5	0	0	0	113.2
742	R	32.8	Very low	32.5	Very low	223 Å²	223	156.2 Å²	156.2	84%	0.842	80%	0.8	S	S	*	*			trans	61.6	112.6	135.7	-86.4	-175.8	173.8	-176.2	-1.4	121.8
743	S	32.9	Very low	32.8	Very low	118 Å²	118	153.7 Å²	153.7	83%	0.825	79%	0.794	S	S	*	*				77.4	131	120.4	64.7	0	0	0	0	121
744	G	32	Very low	32.7	Very low	69 Å²	69	151 Å²	151	71%	0.711	80%	0.795	S	S	*	*			trans	127.7	88.8	135.6	0	0	0	0	0	117.4
745	E	31.6	Very low	33.1	Very low	185 Å²	185	148 Å²	148	86%	0.864	79%	0.789	S	S	*	*			trans	55.8	128.5	132.6	-65.5	-179.3	140.3	0	0	123.7
746	S	32.4	Very low	33.2	Very low	113 Å²	113	157.5 Å²	157.5	79%	0.79	81%	0.811	S	S	*	*				91.4	112.2	127.2	62.8	0	0	0	0	122.6
747	S	33.3	Very low	33.5	Very low	119 Å²	119	163.9 Å²	163.9	83%	0.832	82%	0.817	S	S	*	*			trans	36.5	174.7	136.4	-86.6	0	0	0	0	121.6
748	P	37.6	Very low	33.7	Very low	109 Å²	109	162.3 Å²	162.3	71%	0.708	82%	0.818	S	S	*	*			cis	-139.6	-179.9	3.2	23.5	4.6	0	0	0	116.7
749	W	25.9	Very low	33.8	Very low	247 Å²	247	164.2 Å²	164.2	94%	0.936	82%	0.823	S	S	*	*			trans	5.6	134.9	156.8	-60.4	94	0	0	0	122
750	R	32.8	Very low	34.1	Very low	245 Å²	245	161.8 Å²	161.8	93%	0.925	83%	0.825	S	S	*	*			trans	-162	135.6	138.7	-132.2	174.3	-87	-106.3	3.3	116.1
751	R	28.5	Very low	34.3	Very low	230 Å²	230	165.7 Å²	165.7	87%	0.868	84%	0.835	S	S	*	*			trans	-78.7	170.2	166.5	-116.3	-170.1	-93.7	-155.5	-5.4	111.5
752	T	32.9	Very low	34.6	Very low	131 Å²	131	163.5 Å²	163.5	80%	0.804	84%	0.836	S	S	*	*			trans	122.7	161.9	150.1	62.4	0	0	0	0	115.3
753	P	37.1	Very low	35	Very low	116 Å²	116	163.6 Å²	163.6	75%	0.753	84%	0.837	S	S	*	*			cis	-135.6	172.1	-10.5	17.4	8.7	0	0	0	116.5
754	S	29.4	Very low	35.5	Very low	118 Å²	118	164.7 Å²	164.7	83%	0.825	84%	0.838	S	S	*	*			trans	-78.3	151.4	173.3	-171.7	0	0	0	0	113.7
755	V	40.8	Very low	36.4	Very low	135 Å²	135	165 Å²	165	82%	0.818	84%	0.842	S	S	*	*			trans	-118.9	120.7	174.5	175.8	0	0	0	0	110.7
756	R	33	Very low	37.1	Very low	243 Å²	243	163 Å²	163	92%	0.917	84%	0.837	S	S	*	*			trans	-80.4	144.7	168.9	-91	-178.4	175.9	-173.7	-0.9	111.4
757	R	39.6	Very low	37.9	Very low	253 Å²	253	166 Å²	166	96%	0.955	84%	0.838	S	S	*	*			trans	-131.2	143.8	151.6	-98.1	-174.7	175.9	-174.6	-0.3	110.3
758	S	35.5	Very low	38.5	Very low	112 Å²	112	171.8 Å²	171.8	78%	0.783	86%	0.86	S	S	*	*			trans	-114.5	165.7	-162.9	43.9	0	0	0	0	114.3
759	R	35.4	Very low	38.5	Very low	246 Å²	246	175 Å²	175	93%	0.928	87%	0.867	S	S	*	*			trans	83.7	131.1	171.3	-72.4	179.8	162.6	178.5	-5.4	115
760	S	41.7	Very low	39.2	Very low	119 Å²	119	171.2 Å²	171.2	83%	0.832	86%	0.864	S	S	*	*			cis	-162.9	153.6	33.6	42.1	0	0	0	0	111.4
761	Q	38.8	Very low	39.6	Very low	178 Å²	178	167.1 Å²	167.1	83%	0.832	86%	0.86	S	S	*	*			trans	-102.2	162.4	171.6	-100.2	-175.3	-8.9	0	0	110.6
762	P	42.2	Very low	40.2	Very low	125 Å²	125	163.4 Å²	163.4	81%	0.812	86%	0.86	S	S	*	*				-135.6	136.2	116.5	33.5	-19.5	0	0	0	115.4
763	R	41	Very low	40.7	Very low	225 Å²	225	165.4 Å²	165.4	85%	0.849	86%	0.863	S	S	*	*			trans	-15.8	151.5	140.6	-90.3	-175.6	-177	-170.5	0.3	116.1
764	V	44	Very low	40.9	Very low	140 Å²	140	168.7 Å²	168.7	85%	0.848	87%	0.871	S	S	*	*			cis	-159.2	154.4	24.4	176.2	0	0	0	0	107.7
765	G	51.7	Low	41.7	Very low	77 Å²	77	172.3 Å²	172.3	79%	0.794	87%	0.874	S	S	*	*			trans	169.1	84.7	154.5	0	0	0	0	0	113.3
766	D	46.5	Very low	41.8	Very low	143 Å²	143	175.2 Å²	175.2	77%	0.765	88%	0.878	S	S	*	*			trans	-90.3	155.9	173.5	-102.3	-35.1	0	0	0	112
767	H	47.9	Very low	42.5	Very low	174 Å²	174	169.5 Å²	169.5	81%	0.806	88%	0.875	S	S	*	*			trans	99.3	115.7	156.2	-63.1	-45.4	0	0	0	120
768	N	46	Very low	42.8	Very low	242 Å²	242	161.9 Å²	161.9	100%	1.294	87%	0.868	S	S	*	*			trans	76.5	0	172.5	-80.7	1.8	0	0	0	118.8

Retrieved 768 of 768 residues in 398.7 ms (Link to these results)

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