A0A077Z491_TRITR Loading...

Proton myo inositol cotransporter

AlphaFold DB , UniProt , Accession A0A077Z491, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 626 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	32.1	Very low	29.2	Very low	235 Å²	235	127.8 Å²	127.8	100%	1.158	74%	0.735	S	S	*	*				0	100.5	0	-87.2	173.7	172.7	0	0	107.6	Q3	M1-Q3 PolarHBondContact O-N 3.48Å
2	V	31.9	Very low	29.2	Very low	138 Å²	138	125.9 Å²	125.9	84%	0.836	74%	0.735	S	S	*	*			trans	-88.6	99.1	163.3	177.8	0	0	0	0	104.7	V4	V2-V4 HydrophobicContact CG1-CG2 4.39Å; V2-V4 PolarHBondContact O-N 2.99Å; V2-V4 VanDerWaalsContact O-N 3.1Å
3	Q	24.3	Very low	29.6	Very low	183 Å²	183	125.4 Å²	125.4	86%	0.855	72%	0.718	S	S	*	*			trans	-70.2	99.8	170.3	-99.2	175.6	-42.3	0	0	106.8	M1 S5	M1-Q3 PolarHBondContact O-N 3.48Å; Q3-S5 PolarHBondContact O-N 2.88Å; Q3-S5 VanDerWaalsContact O-N 3.15Å
4	V	31.6	Very low	29.6	Very low	114 Å²	114	120 Å²	120	69%	0.691	70%	0.704	S	S	*	*			trans	-70.9	104	164.9	179.5	0	0	0	0	105.9	V2 I6	V2-V4 HydrophobicContact CG1-CG2 4.39Å; V2-V4 PolarHBondContact O-N 2.99Å; V2-V4 VanDerWaalsContact O-N 3.1Å; V4-I6 PolarHBondContact O-N 3.34Å; V4-I6 VanDerWaalsContact O-N 3.11Å
5	S	26.1	Very low	29.5	Very low	100 Å²	100	124.9 Å²	124.9	70%	0.699	72%	0.717	S	S	*	*			trans	-65.8	104.8	167.5	52.3	0	0	0	0	107.5	Q3 D7	Q3-S5 PolarHBondContact O-N 2.88Å; Q3-S5 VanDerWaalsContact O-N 3.15Å; S5-D7 PolarHBondContact O-N 3.1Å
6	I	29.8	Very low	29.9	Very low	142 Å²	142	120.1 Å²	120.1	73%	0.728	69%	0.688	S	S	*	*			trans	-74.1	108.5	169.4	-60.6	172.9	0	0	0	105.6	V4 S8	V4-I6 PolarHBondContact O-N 3.34Å; V4-I6 VanDerWaalsContact O-N 3.11Å; I6-S8 PolarHBondContact O-N 3.15Å
7	D	27.4	Very low	30	Very low	117 Å²	117	119.8 Å²	119.8	63%	0.626	68%	0.684	S	S	*	*			trans	-52.7	129.7	176.1	-82.1	-32.6	0	0	0	110.4	S5 T9 V10	S5-D7 PolarHBondContact O-N 3.1Å; D7-T9 PolarHBondContact O-N 2.89Å; D7-V10 PolarHBondContact O-N 2.8Å
8	S	29.1	Very low	30.6	Very low	104 Å²	104	116.4 Å²	116.4	73%	0.727	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-64.4	2.2	-177.7	48.2	0	0	0	0	114.7	I6 V10 S11	I6-S8 PolarHBondContact O-N 3.15Å; S8-V10 PolarHBondContact O-N 3.11Å; S8-S11 PolarHBondContact O-N 2.9Å; S8-S11 PolarHBondContact O-OG 2.87Å
9	T	27.9	Very low	31	Very low	98 Å²	98	120.5 Å²	120.5	60%	0.601	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-71.8	-13.5	173.7	42.4	0	0	0	0	113.3	D7 S11	D7-T9 PolarHBondContact O-N 2.89Å; T9-S11 VanDerWaalsContact C-N 3.27Å; T9-S11 PolarHBondContact O-N 3.2Å
10	V	32	Very low	31.7	Very low	69 Å²	69	119.5 Å²	119.5	42%	0.418	67%	0.666	S	S	.	*	G	3₁₀ helix	trans	-75.4	-15.1	175.7	-174	0	0	0	0	112.7	D7 S8 S12 F13 P608	D7-V10 PolarHBondContact O-N 2.8Å; S8-V10 PolarHBondContact O-N 3.11Å; V10-S12 VanDerWaalsContact C-N 3.28Å; V10-S12 PolarHBondContact O-N 3.35Å; V10-F13 HydrophobicContact CG1-CD2 4.49Å; V10-F13 PolarHBondContact O-N 2.97Å; V10-P608 HydrophobicContact CG1-CG 4.22Å
11	S	29.4	Very low	32.7	Very low	106 Å²	106	114.5 Å²	114.5	74%	0.741	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-69.2	-19.1	-179.2	63.9	0	0	0	0	114.6	S8 T9 F13	S8-S11 PolarHBondContact O-N 2.9Å; S8-S11 PolarHBondContact O-OG 2.87Å; T9-S11 VanDerWaalsContact C-N 3.27Å; T9-S11 PolarHBondContact O-N 3.2Å; S11-F13 VanDerWaalsContact C-N 3.3Å; S11-F13 PolarHBondContact O-N 3.46Å
12	S	28.4	Very low	33.7	Very low	105 Å²	105	112.4 Å²	112.4	73%	0.734	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-84.1	2.3	177.8	72.8	0	0	0	0	114.5	V10	V10-S12 VanDerWaalsContact C-N 3.28Å; V10-S12 PolarHBondContact O-N 3.35Å
13	F	34.4	Very low	35	Very low	119 Å²	119	110.1 Å²	110.1	52%	0.522	61%	0.605	S	S	.	*	G	3₁₀ helix	trans	-85.2	-4	-179.9	-80.3	-92.8	0	0	0	114.4	V10 S11 Q15	V10-F13 HydrophobicContact CG1-CD2 4.49Å; V10-F13 PolarHBondContact O-N 2.97Å; S11-F13 VanDerWaalsContact C-N 3.3Å; S11-F13 PolarHBondContact O-N 3.46Å; F13-Q15 PolarHBondContact O-N 3.41Å
14	G	30	Very low	36.9	Very low	50 Å²	50	103.1 Å²	103.1	52%	0.515	58%	0.575	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.6	2.5	-164.8	0	0	0	0	0	118.8
15	Q	27.5	Very low	38.5	Very low	193 Å²	193	100.1 Å²	100.1	90%	0.902	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.7	45	-176.6	-75.1	-171.3	-24.5	0	0	113.3	F13 D17	F13-Q15 PolarHBondContact O-N 3.41Å; Q15-D17 PolarHBondContact O-N 3.21Å
16	L	35.8	Very low	40.5	Very low	49 Å²	49	102.4 Å²	102.4	26%	0.257	56%	0.564	S	S	.	*			trans	-87.2	98	170.8	-132.4	82.8	0	0	0	108.9	L18 T236 K239 V612	L16-L18 PolarHBondContact O-N 2.98Å; L16-T236 HydrophobicContact CD2-CG2 3.67Å; L16-T236 HydrophobicContact CG-CG2 4.19Å; L16-K239 HydrophobicContact CD1-CD 4.42Å; L16-V612 WeakPolarHBondContact O-CG1 3.48Å
17	D	32.2	Very low	42.2	Very low	115 Å²	115	95.8 Å²	95.8	62%	0.615	53%	0.531	S	S	*	.			trans	-54.4	97	154	-95.7	-18.9	0	0	0	106.7	Q15 R19	Q15-D17 PolarHBondContact O-N 3.21Å; D17-R19 PolarHBondContact O-N 3.24Å
18	L	41.6	Very low	44.2	Very low	58 Å²	58	94.2 Å²	94.2	30%	0.304	52%	0.521	S	S	.	.			trans	-68.3	67.2	169.6	-84.7	156	0	0	0	107.8	L16 L240 I613	L16-L18 PolarHBondContact O-N 2.98Å; L18-L240 HydrophobicContact CD2-CD1 4.3Å; L18-L240 HydrophobicContact CD2-CD2 4.18Å; L18-I613 HydrophobicContact CD1-CD1 4.43Å; L18-I613 HydrophobicContact CD1-CG1 3.61Å
19	R	36.9	Very low	46.2	Very low	194 Å²	194	93 Å²	93	73%	0.732	51%	0.509	S	S	*	.			trans	-54.5	132.1	161.3	-70.5	-175.3	179.8	-172.4	-0.3	105.8	D17 T21	D17-R19 PolarHBondContact O-N 3.24Å; R19-T21 PolarHBondContact O-N 2.78Å
20	P	45.7	Very low	48.1	Very low	100 Å²	100	88.8 Å²	88.8	65%	0.649	48%	0.483	S	S	*	.			trans	-53	116.3	172	21.3	-30.5	0	0	0	106.7	K22	P20-K22 PolarHBondContact O-N 3.2Å; P20-K22 VanDerWaalsContact O-N 3.11Å
21	T	52.2	Low	49.8	Very low	15 Å²	15	86.1 Å²	86.1	9%	0.092	47%	0.467	C	S	.	.			trans	-45.6	122.6	172.9	46.3	0	0	0	0	107	R19 I23 Y231 L240	R19-T21 PolarHBondContact O-N 2.78Å; T21-I23 PolarHBondContact O-N 3.23Å; T21-Y231 WeakPolarHBondContact CB-O 3.31Å; T21-Y231 WeakPolarHBondContact CG2-O 3.42Å; T21-L240 HydrophobicContact CG2-CD1 4.05Å
22	K	53.9	Low	51.9	Low	192 Å²	192	86 Å²	86	84%	0.835	46%	0.458	S	S	*	.			trans	-50.1	123.1	-178.8	-76.8	-177.2	178.2	178.3	0	107.7	P20 T24	P20-K22 PolarHBondContact O-N 3.2Å; P20-K22 VanDerWaalsContact O-N 3.11Å; K22-T24 PolarHBondContact O-N 2.99Å
23	I	58.2	Low	54.2	Low	90 Å²	90	82.4 Å²	82.4	46%	0.462	43%	0.43	S	S	.	.			trans	-56.4	111.5	176.4	-58.1	177.2	0	0	0	106.8	T21 V27 I28	T21-I23 PolarHBondContact O-N 3.23Å; I23-V27 HydrophobicContact CG2-CB 4.2Å; I23-V27 HydrophobicContact CG2-CG1 4.1Å; I23-I28 HydrophobicContact CG2-CD1 4.07Å; I23-I28 HydrophobicContact CG2-CG1 3.54Å
24	T	65.7	Low	55.9	Low	35 Å²	35	76.8 Å²	76.8	22%	0.215	41%	0.405	C	S	.	.			trans	-72.7	148.3	-179.9	65.9	0	0	0	0	109	K22 K26 V27 I28 S229	K22-T24 PolarHBondContact O-N 2.99Å; T24-K26 PolarHBondContact O-N 2.93Å; T24-K26 VanDerWaalsContact O-N 3.08Å; T24-V27 PolarHBondContact O-N 3.43Å; T24-V27 WeakPolarHBondContact OG1-CG2 3.19Å; T24-V27 PolarHBondContact OG1-N 3.45Å; T24-I28 PolarHBondContact O-N 3.39Å; T24-S229 PolarHBondContact OG1-O 2.89Å; T24-S229 VanDerWaalsContact OG1-O 3.14Å
25	G	64.8	Low	58.1	Low	52 Å²	52	74.6 Å²	74.6	54%	0.536	38%	0.381	S	S	.	.	H	α-helix	trans	-54.5	-30.3	175.4	0	0	0	0	0	112.5	I28 V29	G25-I28 PolarHBondContact O-N 3.12Å; G25-V29 WeakPolarHBondContact O-CG2 3.26Å; G25-V29 PolarHBondContact O-N 2.91Å
26	K	66.8	Low	60.8	Low	147 Å²	147	67.6 Å²	67.6	64%	0.639	35%	0.349	S	S	*	.	H	α-helix	trans	-62.5	-44.1	172.5	-71.2	-173.9	177.6	-177.9	0	112.7	T24 I28 V29 L30	T24-K26 PolarHBondContact O-N 2.93Å; T24-K26 VanDerWaalsContact O-N 3.08Å; K26-I28 VanDerWaalsContact C-N 3.29Å; K26-I28 PolarHBondContact O-N 2.93Å; K26-V29 PolarHBondContact O-N 3.47Å; K26-L30 WeakPolarHBondContact O-CB 3.25Å; K26-L30 PolarHBondContact O-N 3.42Å
27	V	66.7	Low	63.2	Low	4 Å²	4	65.3 Å²	65.3	2%	0.024	34%	0.338	C	S	.	.	H	α-helix	trans	-62.7	-37.8	176.1	171.6	0	0	0	0	110.9	I23 T24 L30 T31 I150 M154 I230	I23-V27 HydrophobicContact CG2-CB 4.2Å; I23-V27 HydrophobicContact CG2-CG1 4.1Å; T24-V27 PolarHBondContact O-N 3.43Å; T24-V27 WeakPolarHBondContact OG1-CG2 3.19Å; T24-V27 PolarHBondContact OG1-N 3.45Å; V27-L30 PolarHBondContact O-N 3.33Å; V27-T31 VanDerWaalsContact O-CB 3.31Å; V27-T31 WeakPolarHBondContact O-CB 3.48Å; V27-T31 PolarHBondContact O-N 2.97Å; V27-T31 PolarHBondContact O-OG1 2.83Å; V27-I150 HydrophobicContact CG1-CD1 4.41Å; V27-M154 HydrophobicContact CG1-CE 4.34Å; V27-I230 HydrophobicContact CG2-CB 4.4Å; V27-I230 HydrophobicContact CG2-CG1 4.39Å; V27-I230 HydrophobicContact CG2-CG2 4.25Å
28	I	69.1	Low	65.9	Low	84 Å²	84	59.9 Å²	59.9	43%	0.431	31%	0.308	S	S	.	.	H	α-helix	trans	-64.9	-50.9	176.6	-59.9	178	0	0	0	110.6	I23 T24 G25 K26 L30 T31 L32	I23-I28 HydrophobicContact CG2-CD1 4.07Å; I23-I28 HydrophobicContact CG2-CG1 3.54Å; T24-I28 PolarHBondContact O-N 3.39Å; G25-I28 PolarHBondContact O-N 3.12Å; K26-I28 VanDerWaalsContact C-N 3.29Å; K26-I28 PolarHBondContact O-N 2.93Å; I28-L30 VanDerWaalsContact C-N 3.3Å; I28-L30 PolarHBondContact O-N 3.17Å; I28-T31 WeakPolarHBondContact O-CB 3.34Å; I28-T31 PolarHBondContact O-N 3.17Å; I28-L32 HydrophobicContact CG2-CD1 3.96Å; I28-L32 HydrophobicContact CG2-CG 4.4Å; I28-L32 WeakPolarHBondContact O-CG 3.44Å; I28-L32 PolarHBondContact O-N 3.46Å
29	V	71.5	Confident	68.4	Low	78 Å²	78	58 Å²	58	47%	0.473	30%	0.298	S	S	.	.	H	α-helix	trans	-60.2	-42.4	177.2	173.2	0	0	0	0	110.8	G25 K26 T31 L32 M33 M207	G25-V29 WeakPolarHBondContact O-CG2 3.26Å; G25-V29 PolarHBondContact O-N 2.91Å; K26-V29 PolarHBondContact O-N 3.47Å; V29-T31 VanDerWaalsContact C-N 3.33Å; V29-T31 PolarHBondContact O-N 3.22Å; V29-L32 PolarHBondContact O-N 3.22Å; V29-M33 HydrophobicContact CG1-CG 4.25Å; V29-M33 WeakPolarHBondContact O-CB 3.39Å; V29-M33 WeakPolarHBondContact O-CG 3.38Å; V29-M33 PolarHBondContact O-N 3.06Å; V29-M207 HydrophobicContact CG1-SD 4.25Å
30	L	67.5	Low	71.1	Confident	9 Å²	9	49.1 Å²	49.1	5%	0.047	27%	0.265	C	S	.	.	H	α-helix	trans	-59.7	-45	176.4	-170.2	146.8	0	0	0	112.1	K26 V27 I28 A34 Y141 T145 M207 P208	K26-L30 WeakPolarHBondContact O-CB 3.25Å; K26-L30 PolarHBondContact O-N 3.42Å; V27-L30 PolarHBondContact O-N 3.33Å; I28-L30 VanDerWaalsContact C-N 3.3Å; I28-L30 PolarHBondContact O-N 3.17Å; L30-A34 WeakPolarHBondContact O-CB 3.35Å; L30-A34 PolarHBondContact O-N 3.08Å; L30-Y141 HydrophobicContact CD2-CE1 3.93Å; L30-Y141 HydrophobicContact CG-CE1 4.18Å; L30-T145 HydrophobicContact CD1-CG2 4.3Å; L30-T145 HydrophobicContact CD2-CG2 4.33Å; L30-T145 WeakPolarHBondContact CD2-OG1 3.46Å; L30-M207 HydrophobicContact CB-CE 3.34Å; L30-M207 HydrophobicContact CD1-CE 3.67Å; L30-M207 HydrophobicContact CG-CE 3.42Å; L30-M207 VanDerWaalsContact CG-CE 3.42Å; L30-P208 HydrophobicContact CD1-CG 3.96Å
31	T	67	Low	73.3	Confident	14 Å²	14	45.3 Å²	45.3	9%	0.086	24%	0.238	C	C	.	.	H	α-helix	trans	-62.3	-53.5	177.1	-58	0	0	0	0	109.7	V27 I28 V29 M33 A34 V35 M154	V27-T31 VanDerWaalsContact O-CB 3.31Å; V27-T31 WeakPolarHBondContact O-CB 3.48Å; V27-T31 PolarHBondContact O-N 2.97Å; V27-T31 PolarHBondContact O-OG1 2.83Å; I28-T31 WeakPolarHBondContact O-CB 3.34Å; I28-T31 PolarHBondContact O-N 3.17Å; V29-T31 VanDerWaalsContact C-N 3.33Å; V29-T31 PolarHBondContact O-N 3.22Å; T31-M33 PolarHBondContact O-N 3.34Å; T31-A34 PolarHBondContact O-N 3.13Å; T31-V35 HydrophobicContact CG2-CG2 4.08Å; T31-V35 WeakPolarHBondContact O-CB 3.48Å; T31-V35 WeakPolarHBondContact O-CG2 3.49Å; T31-V35 PolarHBondContact O-N 2.91Å; T31-M154 HydrophobicContact CG2-CB 4.42Å; T31-M154 HydrophobicContact CG2-CE 4.02Å; T31-M154 HydrophobicContact CG2-CG 4.21Å; T31-M154 HydrophobicContact CG2-SD 3.27Å; T31-M154 WeakPolarHBondContact CG2-SD 3.35Å; T31-M154 WeakPolarHBondContact OG1-CE 3.4Å
32	L	74.8	Confident	75.3	Confident	103 Å²	103	44.6 Å²	44.6	54%	0.539	23%	0.234	S	C	.	.	H	α-helix	trans	-57	-49.2	-177.9	-71.2	171.8	0	0	0	111.2	I28 V29 V35 M36	I28-L32 HydrophobicContact CG2-CD1 3.96Å; I28-L32 HydrophobicContact CG2-CG 4.4Å; I28-L32 WeakPolarHBondContact O-CG 3.44Å; I28-L32 PolarHBondContact O-N 3.46Å; V29-L32 PolarHBondContact O-N 3.22Å; L32-V35 PolarHBondContact O-N 3.09Å; L32-M36 WeakPolarHBondContact O-CG 3.46Å; L32-M36 PolarHBondContact O-N 3.27Å
33	M	75.2	Confident	77.2	Confident	30 Å²	30	35.7 Å²	35.7	15%	0.148	20%	0.195	C	C	.	.	H	α-helix	trans	-69.5	-37.8	-177.2	-68.2	-51.4	-44.9	0	0	114	V29 T31 V35 M36 Q200 G203 M207	V29-M33 HydrophobicContact CG1-CG 4.25Å; V29-M33 WeakPolarHBondContact O-CB 3.39Å; V29-M33 WeakPolarHBondContact O-CG 3.38Å; V29-M33 PolarHBondContact O-N 3.06Å; T31-M33 PolarHBondContact O-N 3.34Å; M33-V35 VanDerWaalsContact C-N 3.31Å; M33-M36 HydrophobicContact CE-CG 4.5Å; M33-Q200 HydrophobicContact CE-CG 4.44Å; M33-Q200 PolarHBondContact O-NE2 3.28Å; M33-G203 VanDerWaalsContact CE-CA 3.41Å; M33-M207 HydrophobicContact CB-CG 4.25Å; M33-M207 HydrophobicContact CB-SD 4.11Å; M33-M207 HydrophobicContact CG-SD 4.17Å
34	A	70.8	Confident	78.9	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-67.8	-37.3	175.2	0	0	0	0	0	111.4	L30 T31 M36 I138 Y141 I142 F204	L30-A34 WeakPolarHBondContact O-CB 3.35Å; L30-A34 PolarHBondContact O-N 3.08Å; T31-A34 PolarHBondContact O-N 3.13Å; A34-M36 VanDerWaalsContact C-N 3.34Å; A34-I138 WeakPolarHBondContact O-CG2 3.42Å; A34-Y141 HydrophobicContact CB-CD1 3.78Å; A34-Y141 HydrophobicContact CB-CE1 3.87Å; A34-I142 HydrophobicContact CB-CD1 4.4Å; A34-I142 HydrophobicContact CB-CG1 3.92Å; A34-F204 HydrophobicContact CB-CE2 4.37Å
35	V	75.9	Confident	80.2	Confident	4 Å²	4	30.2 Å²	30.2	2%	0.024	17%	0.165	C	C	.	.	H	α-helix	trans	-74.9	-24.5	-177.6	169.8	0	0	0	0	111.2	T31 L32 M33 S37 G38 I142 M157 F158 L161	T31-V35 HydrophobicContact CG2-CG2 4.08Å; T31-V35 WeakPolarHBondContact O-CB 3.48Å; T31-V35 WeakPolarHBondContact O-CG2 3.49Å; T31-V35 PolarHBondContact O-N 2.91Å; L32-V35 PolarHBondContact O-N 3.09Å; M33-V35 VanDerWaalsContact C-N 3.31Å; V35-S37 PolarHBondContact O-N 3.31Å; V35-S37 VanDerWaalsContact O-N 3.07Å; V35-G38 WeakPolarHBondContact O-CA 3.31Å; V35-G38 PolarHBondContact O-N 3.39Å; V35-I142 HydrophobicContact CG2-CD1 3.73Å; V35-M157 VanDerWaalsContact CG1-C 3.45Å; V35-M157 HydrophobicContact CG1-CB 4.12Å; V35-M157 WeakPolarHBondContact CG1-O 3.37Å; V35-M157 HydrophobicContact CG2-CB 4.3Å; V35-F158 HydrophobicContact CG2-CB 4.44Å; V35-L161 HydrophobicContact CB-CD1 4.09Å; V35-L161 HydrophobicContact CG1-CB 3.9Å; V35-L161 HydrophobicContact CG1-CD1 3.34Å; V35-L161 HydrophobicContact CG1-CG 3.46Å; V35-L161 VanDerWaalsContact CG1-CG 3.46Å; V35-L161 WeakPolarHBondContact O-CD1 3.49Å
36	M	85.3	Confident	81.6	Confident	46 Å²	46	28 Å²	28	23%	0.227	14%	0.142	C	C	.	.	H	α-helix	trans	-54.2	-27	177.8	-79.3	-54.3	-63.2	0	0	114.5	L32 M33 A34 G38 F39 L40 L161 Q200	L32-M36 WeakPolarHBondContact O-CG 3.46Å; L32-M36 PolarHBondContact O-N 3.27Å; M33-M36 HydrophobicContact CE-CG 4.5Å; A34-M36 VanDerWaalsContact C-N 3.34Å; M36-G38 PolarHBondContact O-N 2.89Å; M36-F39 HydrophobicContact CE-CB 4.29Å; M36-F39 HydrophobicContact CE-CD1 4.49Å; M36-F39 HydrophobicContact CE-CG 4.4Å; M36-F39 WeakPolarHBondContact O-CA 3.35Å; M36-F39 VanDerWaalsContact O-CB 3.22Å; M36-F39 WeakPolarHBondContact O-CB 3.49Å; M36-F39 PolarHBondContact O-N 3.49Å; M36-L40 PolarHBondContact O-N 3.01Å; M36-L161 HydrophobicContact SD-CD1 3.87Å; M36-Q200 HydrophobicContact CB-CB 4.43Å; M36-Q200 HydrophobicContact CB-CG 4.13Å
37	S	85.3	Confident	83	Confident	2 Å²	2	21 Å²	21	1%	0.014	11%	0.112	C	C	.	.	H	α-helix	trans	-64.3	-26.1	172.5	-85.3	0	0	0	0	113.5	V35 F39 L40 F41 I138 Q200	V35-S37 PolarHBondContact O-N 3.31Å; V35-S37 VanDerWaalsContact O-N 3.07Å; S37-F39 PolarHBondContact O-N 2.92Å; S37-L40 PolarHBondContact O-N 3.36Å; S37-F41 PolarHBondContact O-N 3.05Å; S37-I138 WeakPolarHBondContact OG-CD1 3.46Å; S37-Q200 VanDerWaalsContact CA-OE1 3.25Å; S37-Q200 PolarHBondContact OG-NE2 2.91Å; S37-Q200 PolarHBondContact OG-OE1 3.45Å
38	G	89.7	Confident	84.2	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-58.8	-42.1	171.7	0	0	0	0	0	109.8	V35 M36 L40 F41 G42 I162	V35-G38 WeakPolarHBondContact O-CA 3.31Å; V35-G38 PolarHBondContact O-N 3.39Å; M36-G38 PolarHBondContact O-N 2.89Å; G38-L40 PolarHBondContact O-N 3.36Å; G38-F41 PolarHBondContact O-N 3.42Å; G38-G42 PolarHBondContact O-N 3.34Å; G38-I162 WeakPolarHBondContact O-CA 3.42Å; G38-I162 WeakPolarHBondContact O-CG1 3.35Å
39	F	93.5	Very high	85.3	Confident	20 Å²	20	17.4 Å²	17.4	9%	0.088	9%	0.094	C	C	.	.	H	α-helix	trans	-59.7	-45.7	174.4	179.7	-85.6	0	0	0	112.3	M36 S37 F41 G42 Y43 L161 F164 G165 V168 P196	M36-F39 HydrophobicContact CE-CB 4.29Å; M36-F39 HydrophobicContact CE-CD1 4.49Å; M36-F39 HydrophobicContact CE-CG 4.4Å; M36-F39 WeakPolarHBondContact O-CA 3.35Å; M36-F39 VanDerWaalsContact O-CB 3.22Å; M36-F39 WeakPolarHBondContact O-CB 3.49Å; M36-F39 PolarHBondContact O-N 3.49Å; S37-F39 PolarHBondContact O-N 2.92Å; F39-F41 PolarHBondContact O-N 2.91Å; F39-G42 PolarHBondContact O-N 3.49Å; F39-Y43 AromaticContact CE1-CD2 3.99Å; F39-Y43 HydrophobicContact CE1-CD2 3.99Å; F39-Y43 HydrophobicContact CZ-CD2 4.04Å; F39-Y43 VanDerWaalsContact O-CB 3.26Å; F39-Y43 WeakPolarHBondContact O-CB 3.32Å; F39-Y43 PolarHBondContact O-N 3.04Å; F39-L161 WeakPolarHBondContact CA-O 3.27Å; F39-L161 HydrophobicContact CB-CB 4.27Å; F39-L161 PolarHBondContact N-O 3.33Å; F39-F164 AromaticContact CD2-CD1 3.6Å; F39-F164 HydrophobicContact CD2-CD1 3.6Å; F39-F164 HydrophobicContact CD2-CE1 4.08Å; F39-F164 HydrophobicContact CD2-CG 4.38Å; F39-F164 AromaticContact CE2-CD1 3.84Å; F39-F164 HydrophobicContact CE2-CD1 3.84Å; F39-F164 AromaticContact CE2-CE1 3.94Å; F39-F164 HydrophobicContact CE2-CE1 3.94Å; F39-G165 VanDerWaalsContact CD2-CA 3.45Å; F39-V168 HydrophobicContact CE2-CB 3.9Å; F39-V168 HydrophobicContact CE2-CG1 4.18Å; F39-V168 HydrophobicContact CE2-CG2 3.97Å; F39-V168 HydrophobicContact CZ-CB 4.07Å; F39-V168 HydrophobicContact CZ-CG1 3.89Å; F39-V168 HydrophobicContact CZ-CG2 4.5Å; F39-P196 HydrophobicContact CD1-CB 3.82Å; F39-P196 HydrophobicContact CD1-CG 4.34Å; F39-P196 HydrophobicContact CE1-CB 3.55Å; F39-P196 HydrophobicContact CE1-CG 3.79Å
40	L	93.2	Very high	86.3	Confident	6 Å²	6	13.7 Å²	13.7	3%	0.031	7%	0.072	C	C	.	.	H	α-helix	trans	-61.1	-44.6	178	-63.4	-178.7	0	0	0	112.3	M36 S37 G38 Y43 D44 F104 P196 A197	M36-L40 PolarHBondContact O-N 3.01Å; S37-L40 PolarHBondContact O-N 3.36Å; G38-L40 PolarHBondContact O-N 3.36Å; L40-Y43 PolarHBondContact O-N 3.41Å; L40-D44 PolarHBondContact O-N 3.28Å; L40-F104 HydrophobicContact CB-CE1 4.4Å; L40-F104 HydrophobicContact CB-CE2 4.35Å; L40-F104 HydrophobicContact CB-CZ 4.28Å; L40-F104 HydrophobicContact CD1-CB 4.45Å; L40-F104 HydrophobicContact CD1-CD2 3.77Å; L40-F104 HydrophobicContact CD1-CE2 4.19Å; L40-F104 HydrophobicContact CD1-CG 4.12Å; L40-P196 HydrophobicContact CD2-CB 3.72Å; L40-P196 HydrophobicContact CD2-CG 3.75Å; L40-A197 HydrophobicContact CD1-CB 3.97Å; L40-A197 HydrophobicContact CD2-CB 3.93Å
41	F	91.8	Very high	87.6	Confident	21 Å²	21	13.2 Å²	13.2	9%	0.092	7%	0.069	C	C	.	.	H	α-helix	trans	-63.8	-44.9	177.8	171.6	-127.3	0	0	0	111.7	S37 G38 F39 T45 I131 I162 W529	S37-F41 PolarHBondContact O-N 3.05Å; G38-F41 PolarHBondContact O-N 3.42Å; F39-F41 PolarHBondContact O-N 2.91Å; F41-T45 WeakPolarHBondContact CE2-OG1 3.48Å; F41-T45 WeakPolarHBondContact O-CB 3.43Å; F41-T45 PolarHBondContact O-N 3.43Å; F41-T45 VanDerWaalsContact O-N 3.1Å; F41-T45 PolarHBondContact O-OG1 3.26Å; F41-I131 HydrophobicContact CD2-CD1 4.16Å; F41-I131 HydrophobicContact CD2-CG1 4.25Å; F41-I131 HydrophobicContact CD2-CG2 3.9Å; F41-I131 HydrophobicContact CE2-CG2 4.22Å; F41-I162 HydrophobicContact CD1-CD1 3.69Å; F41-I162 HydrophobicContact CD1-CG1 3.84Å; F41-I162 HydrophobicContact CD1-CG2 4.02Å; F41-I162 HydrophobicContact CE1-CD1 4.06Å; F41-I162 HydrophobicContact CE1-CG1 4.5Å; F41-I162 HydrophobicContact CE1-CG2 4.1Å; F41-W529 HydrophobicContact CD2-CH2 4.21Å; F41-W529 HydrophobicContact CE1-CH2 4.28Å; F41-W529 AromaticContact CE2-CH2 3.42Å; F41-W529 HydrophobicContact CE2-CH2 3.42Å; F41-W529 VanDerWaalsContact CE2-CH2 3.42Å; F41-W529 HydrophobicContact CE2-CZ2 4.37Å; F41-W529 HydrophobicContact CE2-CZ3 4.15Å; F41-W529 AromaticContact CZ-CH2 3.47Å; F41-W529 HydrophobicContact CZ-CH2 3.47Å; F41-W529 VanDerWaalsContact CZ-CH2 3.47Å; F41-W529 HydrophobicContact CZ-CZ2 4.41Å; F41-W529 HydrophobicContact CZ-CZ3 4.23Å
42	G	93.6	Very high	88.7	Confident	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-61.4	-43.2	175.1	0	0	0	0	0	112.8	G38 F39 T45 G46 I162 G165 L166	G38-G42 PolarHBondContact O-N 3.34Å; F39-G42 PolarHBondContact O-N 3.49Å; G42-T45 PolarHBondContact O-N 3.44Å; G42-G46 PolarHBondContact O-N 2.94Å; G42-I162 VanDerWaalsContact CA-O 3.29Å; G42-I162 WeakPolarHBondContact CA-O 3.45Å; G42-G165 VanDerWaalsContact C-C 3.48Å; G42-L166 WeakPolarHBondContact O-CA 3.43Å; G42-L166 VanDerWaalsContact O-CD2 3.3Å; G42-L166 WeakPolarHBondContact O-CD2 3.29Å; G42-L166 WeakPolarHBondContact O-CG 3.35Å; G42-L166 PolarHBondContact O-N 3.2Å
43	Y	95.7	Very high	89.2	Confident	4 Å²	4	8 Å²	8	2%	0.016	4%	0.041	C	C	.	.	H	α-helix	trans	-61.9	-52	178.6	-173.5	-71.2	0	0	0	111	F39 L40 T45 G46 V47 G165 A169 L172 M189 A193	F39-Y43 AromaticContact CE1-CD2 3.99Å; F39-Y43 HydrophobicContact CE1-CD2 3.99Å; F39-Y43 HydrophobicContact CZ-CD2 4.04Å; F39-Y43 VanDerWaalsContact O-CB 3.26Å; F39-Y43 WeakPolarHBondContact O-CB 3.32Å; F39-Y43 PolarHBondContact O-N 3.04Å; L40-Y43 PolarHBondContact O-N 3.41Å; Y43-T45 VanDerWaalsContact C-N 3.25Å; Y43-T45 PolarHBondContact O-N 3.13Å; Y43-G46 PolarHBondContact O-N 2.94Å; Y43-G46 VanDerWaalsContact O-N 3.13Å; Y43-V47 HydrophobicContact CD1-CB 4.11Å; Y43-V47 HydrophobicContact CD1-CG1 4.15Å; Y43-V47 HydrophobicContact CE1-CB 3.83Å; Y43-V47 HydrophobicContact CE1-CG1 4.12Å; Y43-V47 HydrophobicContact CE1-CG2 3.9Å; Y43-V47 WeakPolarHBondContact O-CB 3.46Å; Y43-V47 VanDerWaalsContact O-CG1 3.28Å; Y43-V47 WeakPolarHBondContact O-CG1 3.3Å; Y43-V47 PolarHBondContact O-N 3.49Å; Y43-G165 WeakPolarHBondContact CA-O 3.5Å; Y43-A169 HydrophobicContact CD1-CB 4.36Å; Y43-A169 HydrophobicContact CD2-CB 4.01Å; Y43-A169 HydrophobicContact CE2-CB 4.34Å; Y43-A169 HydrophobicContact CG-CB 4.02Å; Y43-A169 WeakPolarHBondContact O-CB 3.31Å; Y43-L172 HydrophobicContact CE2-CD1 3.54Å; Y43-M189 PolarHBondContact OH-O 3.41Å; Y43-A193 HydrophobicContact CD1-CB 3.72Å; Y43-A193 HydrophobicContact CE1-CB 3.58Å
44	D	93.8	Very high	89.8	Confident	10 Å²	10	6.8 Å²	6.8	5%	0.053	4%	0.035	C	C	.	.	H	α-helix	trans	-60.4	-36.8	-179.7	180	66.9	0	0	0	112.3	L40 V47 V48 R124 V127 I131	L40-D44 PolarHBondContact O-N 3.28Å; D44-V47 WeakPolarHBondContact O-CG1 3.28Å; D44-V48 WeakPolarHBondContact O-CG2 3.46Å; D44-R124 IonicContact OD1-NH1 3.53Å; D44-R124 PolarHBondContact OD1-NH1 2.87Å; D44-R124 IonicContact OD2-NH1 2.8Å; D44-V127 HydrophobicContact CB-CG1 4.33Å; D44-I131 WeakPolarHBondContact OD2-CD1 3.4Å
45	T	92.4	Very high	90.6	Very high	1 Å²	1	6.8 Å²	6.8	1%	0.006	4%	0.035	C	C	.	.	H	α-helix	trans	-67.5	-43.7	175.4	-60.3	0	0	0	0	111.6	F41 G42 Y43 L166 M300 Y301	F41-T45 WeakPolarHBondContact CE2-OG1 3.48Å; F41-T45 WeakPolarHBondContact O-CB 3.43Å; F41-T45 PolarHBondContact O-N 3.43Å; F41-T45 VanDerWaalsContact O-N 3.1Å; F41-T45 PolarHBondContact O-OG1 3.26Å; G42-T45 PolarHBondContact O-N 3.44Å; Y43-T45 VanDerWaalsContact C-N 3.25Å; Y43-T45 PolarHBondContact O-N 3.13Å; T45-L166 HydrophobicContact CG2-CD2 3.7Å; T45-M300 HydrophobicContact CG2-CB 3.8Å; T45-M300 HydrophobicContact CG2-CE 3.91Å; T45-M300 HydrophobicContact CG2-SD 4.38Å; T45-Y301 HydrophobicContact CG2-CD1 3.89Å; T45-Y301 HydrophobicContact CG2-CE1 3.58Å
46	G	93.2	Very high	90.8	Very high	5 Å²	5	9 Å²	9	5%	0.052	5%	0.045	C	C	.	.	H	α-helix	trans	-74.1	-40.5	-175.5	0	0	0	0	0	113.1	G42 Y43 V48 S49	G42-G46 PolarHBondContact O-N 2.94Å; Y43-G46 PolarHBondContact O-N 2.94Å; Y43-G46 VanDerWaalsContact O-N 3.13Å; G46-V48 PolarHBondContact O-N 3.39Å; G46-S49 VanDerWaalsContact O-CB 3.22Å; G46-S49 WeakPolarHBondContact O-CB 3.21Å; G46-S49 PolarHBondContact O-N 3.13Å
47	V	96	Very high	90.5	Very high	1 Å²	1	10 Å²	10	1%	0.006	5%	0.053	C	C	.	.	H	α-helix	trans	-65.5	-28.6	-176	72	0	0	0	0	112.4	Y43 D44 S49 A51 A169 D173 M189 L190	Y43-V47 HydrophobicContact CD1-CB 4.11Å; Y43-V47 HydrophobicContact CD1-CG1 4.15Å; Y43-V47 HydrophobicContact CE1-CB 3.83Å; Y43-V47 HydrophobicContact CE1-CG1 4.12Å; Y43-V47 HydrophobicContact CE1-CG2 3.9Å; Y43-V47 WeakPolarHBondContact O-CB 3.46Å; Y43-V47 VanDerWaalsContact O-CG1 3.28Å; Y43-V47 WeakPolarHBondContact O-CG1 3.3Å; Y43-V47 PolarHBondContact O-N 3.49Å; D44-V47 WeakPolarHBondContact O-CG1 3.28Å; V47-S49 PolarHBondContact O-N 3.29Å; V47-A51 WeakPolarHBondContact O-CB 3.2Å; V47-A51 PolarHBondContact O-N 3.28Å; V47-A169 HydrophobicContact CB-CB 4.11Å; V47-D173 VanDerWaalsContact CA-OD2 3.31Å; V47-D173 WeakPolarHBondContact CA-OD2 3.41Å; V47-D173 VanDerWaalsContact CG2-OD1 3.3Å; V47-D173 WeakPolarHBondContact CG2-OD1 3.11Å; V47-D173 VanDerWaalsContact O-OD2 3.12Å; V47-M189 HydrophobicContact CG2-CB 3.7Å; V47-M189 WeakPolarHBondContact CG2-O 3.29Å; V47-L190 HydrophobicContact CB-CD2 4.5Å; V47-L190 HydrophobicContact CG1-CD2 3.78Å; V47-L190 HydrophobicContact CG2-CD2 3.94Å
48	V	93.7	Very high	90.3	Very high	4 Å²	4	12 Å²	12	2%	0.024	7%	0.065	C	C	.	.	H	α-helix	trans	-59.1	-38.9	174.1	175	0	0	0	0	110.1	D44 G46 G50 M52 V70 R124	D44-V48 WeakPolarHBondContact O-CG2 3.46Å; G46-V48 PolarHBondContact O-N 3.39Å; V48-G50 PolarHBondContact O-N 3.2Å; V48-M52 HydrophobicContact CG1-CE 4.06Å; V48-M52 WeakPolarHBondContact O-CB 3.07Å; V48-M52 PolarHBondContact O-N 2.96Å; V48-V70 HydrophobicContact CG1-CG2 3.86Å; V48-R124 VanDerWaalsContact CG2-CZ 3.45Å
49	S	92.3	Very high	89.9	Confident	7 Å²	7	13.8 Å²	13.8	5%	0.049	7%	0.073	C	C	.	.	H	α-helix	trans	-60.1	-49.8	-175.3	173.5	0	0	0	0	112.5	G46 V47 M300 Y301 S303 A304	G46-S49 VanDerWaalsContact O-CB 3.22Å; G46-S49 WeakPolarHBondContact O-CB 3.21Å; G46-S49 PolarHBondContact O-N 3.13Å; V47-S49 PolarHBondContact O-N 3.29Å; S49-M300 WeakPolarHBondContact CB-O 3.29Å; S49-Y301 VanDerWaalsContact CA-O 3.26Å; S49-Y301 WeakPolarHBondContact CA-O 3.38Å; S49-S303 WeakPolarHBondContact OG-CB 3.47Å; S49-S303 PolarHBondContact OG-N 2.97Å; S49-A304 WeakPolarHBondContact O-CB 3.32Å; S49-A304 WeakPolarHBondContact OG-CB 3.36Å; S49-A304 PolarHBondContact OG-N 2.66Å
50	G	92	Very high	88.9	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-77.1	-44.4	178.9	0	0	0	0	0	112.2	V48 M52 L53 D173	V48-G50 PolarHBondContact O-N 3.2Å; G50-M52 PolarHBondContact O-N 3.27Å; G50-L53 PolarHBondContact O-N 3.47Å; G50-D173 WeakPolarHBondContact CA-OD2 3.47Å; G50-D173 PolarHBondContact N-OD2 3.21Å
51	A	93.4	Very high	88.3	Confident	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-60.5	-34	-179.6	0	0	0	0	0	112.6	V47 L53 I54 M55 W186 M189 L190	V47-A51 WeakPolarHBondContact O-CB 3.2Å; V47-A51 PolarHBondContact O-N 3.28Å; A51-L53 VanDerWaalsContact C-N 3.34Å; A51-L53 PolarHBondContact O-N 2.9Å; A51-I54 PolarHBondContact O-N 3.17Å; A51-M55 HydrophobicContact CB-CE 3.94Å; A51-M55 WeakPolarHBondContact O-CB 3.35Å; A51-M55 WeakPolarHBondContact O-CG 3.37Å; A51-M55 PolarHBondContact O-N 2.94Å; A51-W186 HydrophobicContact CB-CB 4.41Å; A51-M189 HydrophobicContact CB-CB 4.39Å; A51-M189 HydrophobicContact CB-SD 4.05Å; A51-L190 HydrophobicContact CB-CD2 4.13Å; A51-L190 HydrophobicContact CB-CG 4.35Å
52	M	90.1	Very high	87.7	Confident	1 Å²	1	17.6 Å²	17.6	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-61.1	-39.6	-179.5	-170	65.5	78.4	0	0	112.4	V48 G50 I54 M55 K56 L61 Q66 I69 V70	V48-M52 HydrophobicContact CG1-CE 4.06Å; V48-M52 WeakPolarHBondContact O-CB 3.07Å; V48-M52 PolarHBondContact O-N 2.96Å; G50-M52 PolarHBondContact O-N 3.27Å; M52-I54 PolarHBondContact O-N 2.94Å; M52-M55 HydrophobicContact SD-CE 4.41Å; M52-K56 WeakPolarHBondContact O-CB 3.38Å; M52-K56 PolarHBondContact O-N 3.12Å; M52-L61 HydrophobicContact SD-CD1 4.43Å; M52-Q66 HydrophobicContact CE-CB 4.2Å; M52-Q66 HydrophobicContact CG-CG 4.3Å; M52-Q66 HydrophobicContact SD-CB 3.9Å; M52-Q66 HydrophobicContact SD-CG 3.64Å; M52-I69 HydrophobicContact CE-CB 4.42Å; M52-I69 HydrophobicContact CE-CG2 4.2Å; M52-V70 HydrophobicContact CE-CG2 3.57Å
53	L	86.7	Confident	87	Confident	6 Å²	6	18.9 Å²	18.9	3%	0.031	10%	0.102	C	C	.	.	H	α-helix	trans	-62.6	-28.4	179.2	-70	-173.6	0	0	0	112.9	G50 A51 A304 A318 I319	G50-L53 PolarHBondContact O-N 3.47Å; A51-L53 VanDerWaalsContact C-N 3.34Å; A51-L53 PolarHBondContact O-N 2.9Å; L53-A304 HydrophobicContact CD1-CB 3.53Å; L53-A304 HydrophobicContact CG-CB 4.07Å; L53-A318 HydrophobicContact CD1-CB 4.25Å; L53-I319 HydrophobicContact CD1-CG1 4.03Å
54	I	86.7	Confident	86.4	Confident	4 Å²	4	23.6 Å²	23.6	2%	0.021	13%	0.126	C	C	.	.	H	α-helix	trans	-91	-47.2	179.8	-57.5	162.6	0	0	0	110.4	A51 M52 K56 V57 V58 D182 N185 W186 M189	A51-I54 PolarHBondContact O-N 3.17Å; M52-I54 PolarHBondContact O-N 2.94Å; I54-K56 PolarHBondContact O-N 2.91Å; I54-V57 PolarHBondContact O-N 3.35Å; I54-V58 HydrophobicContact CG2-CG2 4.09Å; I54-V58 PolarHBondContact O-N 3.26Å; I54-D182 HydrophobicContact CG2-CB 4.21Å; I54-N185 WeakPolarHBondContact CG2-OD1 3.48Å; I54-W186 HydrophobicContact CB-CB 4.44Å; I54-W186 HydrophobicContact CG2-CB 4.42Å; I54-M189 HydrophobicContact CD1-CE 3.42Å; I54-M189 VanDerWaalsContact CD1-CE 3.42Å; I54-M189 HydrophobicContact CD1-SD 4.08Å
55	M	87.7	Confident	86.1	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-58.2	-33.1	176.8	-72	-172.7	-59.7	0	0	112.1	A51 M52 V57 V58 F59 L61 L120 W186 L190	A51-M55 HydrophobicContact CB-CE 3.94Å; A51-M55 WeakPolarHBondContact O-CB 3.35Å; A51-M55 WeakPolarHBondContact O-CG 3.37Å; A51-M55 PolarHBondContact O-N 2.94Å; M52-M55 HydrophobicContact SD-CE 4.41Å; M55-V57 PolarHBondContact O-N 3.14Å; M55-V58 PolarHBondContact O-N 3.18Å; M55-F59 HydrophobicContact CB-CD2 4.28Å; M55-F59 HydrophobicContact CG-CD2 4.43Å; M55-F59 PolarHBondContact O-N 2.69Å; M55-L61 HydrophobicContact CB-CD1 3.95Å; M55-L120 HydrophobicContact SD-CD1 3.89Å; M55-L120 HydrophobicContact SD-CD2 4.34Å; M55-W186 HydrophobicContact CG-CB 4.09Å; M55-W186 HydrophobicContact CG-CD2 3.92Å; M55-W186 HydrophobicContact CG-CE3 4.05Å; M55-W186 HydrophobicContact CG-CG 3.92Å; M55-W186 HydrophobicContact SD-CD2 4.49Å; M55-W186 HydrophobicContact SD-CE3 4.02Å; M55-L190 HydrophobicContact SD-CD1 4Å
56	K	81.7	Confident	85.8	Confident	52 Å²	52	26.1 Å²	26.1	23%	0.226	14%	0.135	C	C	.	.	H	α-helix	trans	-54.6	-40.5	173	-179.7	178.1	179.8	179.6	0	112.2	M52 I54 D60 L61	M52-K56 WeakPolarHBondContact O-CB 3.38Å; M52-K56 PolarHBondContact O-N 3.12Å; I54-K56 PolarHBondContact O-N 2.91Å; K56-D60 VanDerWaalsContact O-CA 3.32Å; K56-D60 WeakPolarHBondContact O-CA 3.42Å; K56-D60 PolarHBondContact O-N 3.43Å; K56-L61 PolarHBondContact O-N 3.38Å; K56-L61 VanDerWaalsContact O-N 3.08Å
57	V	77.5	Confident	85.6	Confident	65 Å²	65	26.4 Å²	26.4	39%	0.394	14%	0.135	S	C	.	.	H	α-helix	trans	-81.1	-42.1	-179.8	-179.3	0	0	0	0	111.2	I54 M55	I54-V57 PolarHBondContact O-N 3.35Å; M55-V57 PolarHBondContact O-N 3.14Å
58	V	81.1	Confident	85.3	Confident	44 Å²	44	28.9 Å²	28.9	27%	0.267	15%	0.148	S	C	.	.	H	α-helix	trans	-70.1	-40	-176.1	174.9	0	0	0	0	112.9	I54 M55 D182	I54-V58 HydrophobicContact CG2-CG2 4.09Å; I54-V58 PolarHBondContact O-N 3.26Å; M55-V58 PolarHBondContact O-N 3.18Å; V58-D182 HydrophobicContact CG2-CB 3.87Å; V58-D182 WeakPolarHBondContact CG2-O 3.42Å
59	F	81	Confident	85.2	Confident	39 Å²	39	28.7 Å²	28.7	17%	0.171	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107	6.7	-176.5	-69.1	-71	0	0	0	113.7	M55 L61 L120 W186	M55-F59 HydrophobicContact CB-CD2 4.28Å; M55-F59 HydrophobicContact CG-CD2 4.43Å; M55-F59 PolarHBondContact O-N 2.69Å; F59-L61 HydrophobicContact CB-CD1 4.35Å; F59-L61 HydrophobicContact CB-CD2 3.59Å; F59-L61 HydrophobicContact CB-CG 3.79Å; F59-L61 PolarHBondContact O-N 3.1Å; F59-L120 HydrophobicContact CD2-CD1 3.95Å; F59-L120 HydrophobicContact CE2-CD1 3.65Å; F59-L120 HydrophobicContact CZ-CD1 4.19Å; F59-W186 AromaticContact CE2-CE2 3.97Å; F59-W186 AromaticContact CE2-CH2 3.67Å; F59-W186 HydrophobicContact CE2-CH2 3.67Å; F59-W186 AromaticContact CE2-CZ2 3.44Å; F59-W186 HydrophobicContact CE2-CZ2 3.44Å; F59-W186 VanDerWaalsContact CE2-CZ2 3.44Å; F59-W186 HydrophobicContact CE2-CZ3 4.39Å; F59-W186 AromaticContact CZ-CH2 3.77Å; F59-W186 HydrophobicContact CZ-CH2 3.77Å; F59-W186 AromaticContact CZ-CZ2 3.6Å; F59-W186 HydrophobicContact CZ-CZ2 3.6Å
60	D	72.3	Confident	85.1	Confident	54 Å²	54	28.5 Å²	28.5	29%	0.289	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.4	57.8	-178.6	-173.2	47.9	0	0	0	112.1	K56 D62	K56-D60 VanDerWaalsContact O-CA 3.32Å; K56-D60 WeakPolarHBondContact O-CA 3.42Å; K56-D60 PolarHBondContact O-N 3.43Å; D60-D62 PolarHBondContact O-N 2.76Å
61	L	80.9	Confident	85	Confident	4 Å²	4	28.8 Å²	28.8	2%	0.021	15%	0.147	C	C	.	.			trans	-87.7	108.5	-172.5	-53.7	173.3	0	0	0	110.7	M52 M55 K56 F59 W65 Q66 I69 R117	M52-L61 HydrophobicContact SD-CD1 4.43Å; M55-L61 HydrophobicContact CB-CD1 3.95Å; K56-L61 PolarHBondContact O-N 3.38Å; K56-L61 VanDerWaalsContact O-N 3.08Å; F59-L61 HydrophobicContact CB-CD1 4.35Å; F59-L61 HydrophobicContact CB-CD2 3.59Å; F59-L61 HydrophobicContact CB-CG 3.79Å; F59-L61 PolarHBondContact O-N 3.1Å; L61-W65 HydrophobicContact CB-CB 4.14Å; L61-W65 HydrophobicContact CD2-CB 3.95Å; L61-W65 HydrophobicContact CD2-CG 4.46Å; L61-Q66 HydrophobicContact CB-CG 3.93Å; L61-Q66 PolarHBondContact O-NE2 3.43Å; L61-I69 HydrophobicContact CD1-CD1 3.58Å; L61-I69 HydrophobicContact CD2-CD1 4.13Å; L61-I69 HydrophobicContact CG-CD1 4.49Å; L61-R117 HydrophobicContact CD2-CB 4.43Å
62	D	79.2	Confident	85.1	Confident	69 Å²	69	30.7 Å²	30.7	37%	0.369	16%	0.159	S	C	.	.			trans	-60.9	168.6	164.1	73.7	6.7	0	0	0	111.7	D60 I64 W65 Q66	D60-D62 PolarHBondContact O-N 2.76Å; D62-I64 PolarHBondContact O-N 3.43Å; D62-I64 WeakPolarHBondContact OD1-CB 3.39Å; D62-I64 PolarHBondContact OD1-N 3.16Å; D62-W65 PolarHBondContact O-N 2.94Å; D62-W65 WeakPolarHBondContact OD1-CB 3.2Å; D62-W65 PolarHBondContact OD1-N 3.14Å; D62-Q66 WeakPolarHBondContact O-CG 3.3Å; D62-Q66 PolarHBondContact O-N 3.46Å
63	D	79.2	Confident	85.3	Confident	27 Å²	27	31 Å²	31	14%	0.144	16%	0.161	C	C	.	.	H	α-helix	trans	-61.3	-29.9	-178.3	-76.3	14.3	0	0	0	112.2	Q66 E67 L540 R544	D63-Q66 PolarHBondContact O-N 3.04Å; D63-Q66 PolarHBondContact OD1-NE2 2.89Å; D63-E67 WeakPolarHBondContact O-CB 3.43Å; D63-E67 VanDerWaalsContact O-CG 3.27Å; D63-E67 WeakPolarHBondContact O-CG 3.48Å; D63-E67 PolarHBondContact O-N 3.48Å; D63-L540 HydrophobicContact CB-CB 4.26Å; D63-L540 HydrophobicContact CB-CD1 3.93Å; D63-R544 VanDerWaalsContact CG-CZ 3.48Å; D63-R544 IonicContact OD1-NH2 3.41Å; D63-R544 PolarHBondContact OD1-NH2 2.9Å; D63-R544 IonicContact OD2-CZ 2.7Å; D63-R544 IonicContact OD2-NE 3Å; D63-R544 PolarHBondContact OD2-NE 2.9Å; D63-R544 IonicContact OD2-NH2 3.46Å; D63-R544 PolarHBondContact OD2-NH2 2.88Å
64	I	84	Confident	85.7	Confident	102 Å²	102	30.8 Å²	30.8	52%	0.523	16%	0.16	S	C	.	.	H	α-helix	trans	-67.1	-45.3	178.1	-62.5	173.3	0	0	0	109.7	D62 E67 I68	D62-I64 PolarHBondContact O-N 3.43Å; D62-I64 WeakPolarHBondContact OD1-CB 3.39Å; D62-I64 PolarHBondContact OD1-N 3.16Å; I64-E67 PolarHBondContact O-N 3.14Å; I64-I68 HydrophobicContact CG2-CD1 3.82Å; I64-I68 HydrophobicContact CG2-CG1 4.42Å; I64-I68 WeakPolarHBondContact O-CB 3.38Å; I64-I68 WeakPolarHBondContact O-CG1 3.46Å; I64-I68 PolarHBondContact O-N 3.22Å
65	W	86.5	Confident	86.1	Confident	61 Å²	61	31.4 Å²	31.4	23%	0.231	17%	0.167	C	C	.	.	H	α-helix	trans	-66.4	-39.3	177.3	-84.2	111.3	0	0	0	112.5	L61 D62 I68 I69 R117	L61-W65 HydrophobicContact CB-CB 4.14Å; L61-W65 HydrophobicContact CD2-CB 3.95Å; L61-W65 HydrophobicContact CD2-CG 4.46Å; D62-W65 PolarHBondContact O-N 2.94Å; D62-W65 WeakPolarHBondContact OD1-CB 3.2Å; D62-W65 PolarHBondContact OD1-N 3.14Å; W65-I68 HydrophobicContact CE3-CB 4.47Å; W65-I68 HydrophobicContact CE3-CD1 4.34Å; W65-I68 HydrophobicContact CE3-CG2 4.31Å; W65-I68 HydrophobicContact CZ3-CG2 4.36Å; W65-I68 PolarHBondContact O-N 3.5Å; W65-I69 VanDerWaalsContact O-CG1 3.32Å; W65-I69 WeakPolarHBondContact O-CG1 3.27Å; W65-I69 PolarHBondContact O-N 3.5Å; W65-R117 HydrophobicContact CH2-CG 4.4Å; W65-R117 VanDerWaalsContact CZ2-CZ 3.49Å; W65-R117 HydrophobicContact CZ3-CG 4.35Å
66	Q	87.7	Confident	86.5	Confident	4 Å²	4	32 Å²	32	2%	0.019	17%	0.171	C	C	.	.	H	α-helix	trans	-60.3	-47.9	172.4	-65.2	174	56.7	0	0	110.6	M52 L61 D62 D63 I68 I69 V70 L540	M52-Q66 HydrophobicContact CE-CB 4.2Å; M52-Q66 HydrophobicContact CG-CG 4.3Å; M52-Q66 HydrophobicContact SD-CB 3.9Å; M52-Q66 HydrophobicContact SD-CG 3.64Å; L61-Q66 HydrophobicContact CB-CG 3.93Å; L61-Q66 PolarHBondContact O-NE2 3.43Å; D62-Q66 WeakPolarHBondContact O-CG 3.3Å; D62-Q66 PolarHBondContact O-N 3.46Å; D63-Q66 PolarHBondContact O-N 3.04Å; D63-Q66 PolarHBondContact OD1-NE2 2.89Å; Q66-I68 VanDerWaalsContact C-N 3.33Å; Q66-I68 PolarHBondContact O-N 3.3Å; Q66-I69 PolarHBondContact O-N 3.37Å; Q66-V70 WeakPolarHBondContact O-CG2 3.49Å; Q66-V70 PolarHBondContact O-N 2.86Å; Q66-L540 HydrophobicContact CB-CD1 4.44Å
67	E	88.1	Confident	87.2	Confident	11 Å²	11	29.5 Å²	29.5	5%	0.051	16%	0.161	C	C	.	.	H	α-helix	trans	-59.7	-40.8	175.4	-75.7	177.3	163.5	0	0	111.5	D63 I64 S71 L540 S541	D63-E67 WeakPolarHBondContact O-CB 3.43Å; D63-E67 VanDerWaalsContact O-CG 3.27Å; D63-E67 WeakPolarHBondContact O-CG 3.48Å; D63-E67 PolarHBondContact O-N 3.48Å; I64-E67 PolarHBondContact O-N 3.14Å; E67-S71 WeakPolarHBondContact O-CA 3.27Å; E67-S71 WeakPolarHBondContact O-CB 3.5Å; E67-S71 PolarHBondContact O-N 3.42Å; E67-S71 PolarHBondContact O-OG 3.2Å; E67-L540 HydrophobicContact CG-CB 4.38Å; E67-L540 HydrophobicContact CG-CD1 4.12Å; E67-L540 HydrophobicContact CG-CG 4.33Å; E67-L540 WeakPolarHBondContact OE1-CA 3.19Å; E67-L540 VanDerWaalsContact OE1-CB 3.25Å; E67-L540 WeakPolarHBondContact OE1-CB 2.96Å; E67-L540 PolarHBondContact OE1-N 3.27Å; E67-S541 PolarHBondContact OE1-N 3.1Å; E67-S541 PolarHBondContact OE1-OG 3.46Å; E67-S541 PolarHBondContact OE2-OG 3.37Å
68	I	90.4	Very high	88	Confident	52 Å²	52	26.6 Å²	26.6	27%	0.267	14%	0.143	S	C	.	.	H	α-helix	trans	-63.1	-48.3	176.4	-73.2	167.4	0	0	0	111.4	I64 W65 Q66 V70 S71 V72 V121	I64-I68 HydrophobicContact CG2-CD1 3.82Å; I64-I68 HydrophobicContact CG2-CG1 4.42Å; I64-I68 WeakPolarHBondContact O-CB 3.38Å; I64-I68 WeakPolarHBondContact O-CG1 3.46Å; I64-I68 PolarHBondContact O-N 3.22Å; W65-I68 HydrophobicContact CE3-CB 4.47Å; W65-I68 HydrophobicContact CE3-CD1 4.34Å; W65-I68 HydrophobicContact CE3-CG2 4.31Å; W65-I68 HydrophobicContact CZ3-CG2 4.36Å; W65-I68 PolarHBondContact O-N 3.5Å; Q66-I68 VanDerWaalsContact C-N 3.33Å; Q66-I68 PolarHBondContact O-N 3.3Å; I68-V70 VanDerWaalsContact C-N 3.28Å; I68-V70 PolarHBondContact O-N 3.01Å; I68-S71 WeakPolarHBondContact CA-OG 3.22Å; I68-S71 PolarHBondContact O-N 2.93Å; I68-S71 PolarHBondContact O-OG 3.12Å; I68-V72 HydrophobicContact CG2-CG2 3.96Å; I68-V72 WeakPolarHBondContact O-CB 3.22Å; I68-V72 WeakPolarHBondContact O-CG2 3.34Å; I68-V72 PolarHBondContact O-N 3.3Å; I68-V121 HydrophobicContact CG2-CG2 4.29Å
69	I	90.2	Very high	88.7	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-59.3	-42.3	-178.3	-72.8	166.3	0	0	0	110.9	M52 L61 W65 Q66 T73 R124	M52-I69 HydrophobicContact CE-CB 4.42Å; M52-I69 HydrophobicContact CE-CG2 4.2Å; L61-I69 HydrophobicContact CD1-CD1 3.58Å; L61-I69 HydrophobicContact CD2-CD1 4.13Å; L61-I69 HydrophobicContact CG-CD1 4.49Å; W65-I69 VanDerWaalsContact O-CG1 3.32Å; W65-I69 WeakPolarHBondContact O-CG1 3.27Å; W65-I69 PolarHBondContact O-N 3.5Å; Q66-I69 PolarHBondContact O-N 3.37Å; I69-T73 PolarHBondContact O-OG1 2.96Å; I69-R124 HydrophobicContact CG2-CG 4.28Å
70	V	89.8	Confident	89.3	Confident	3 Å²	3	29.6 Å²	29.6	2%	0.018	16%	0.159	C	C	.	.	H	α-helix	trans	-72.1	-51.9	177.3	177.7	0	0	0	0	111	V48 M52 Q66 I68 V72 T73 V74 Y301 Y302	V48-V70 HydrophobicContact CG1-CG2 3.86Å; M52-V70 HydrophobicContact CE-CG2 3.57Å; Q66-V70 WeakPolarHBondContact O-CG2 3.49Å; Q66-V70 PolarHBondContact O-N 2.86Å; I68-V70 VanDerWaalsContact C-N 3.28Å; I68-V70 PolarHBondContact O-N 3.01Å; V70-V72 PolarHBondContact O-N 3.44Å; V70-T73 WeakPolarHBondContact O-CB 3.32Å; V70-T73 PolarHBondContact O-N 3.3Å; V70-V74 PolarHBondContact O-N 3.31Å; V70-Y301 HydrophobicContact CG1-CD1 4.16Å; V70-Y301 HydrophobicContact CG1-CD2 3.26Å; V70-Y301 HydrophobicContact CG1-CE2 3.73Å; V70-Y301 HydrophobicContact CG1-CG 3.55Å; V70-Y302 HydrophobicContact CG2-CE1 4.37Å
71	S	91.2	Very high	90.3	Very high	6 Å²	6	27 Å²	27	4%	0.042	15%	0.145	C	C	.	.	H	α-helix	trans	-66.4	-34.4	-171.6	62	0	0	0	0	113.7	E67 I68 T73 V74 G75 L533 L537	E67-S71 WeakPolarHBondContact O-CA 3.27Å; E67-S71 WeakPolarHBondContact O-CB 3.5Å; E67-S71 PolarHBondContact O-N 3.42Å; E67-S71 PolarHBondContact O-OG 3.2Å; I68-S71 WeakPolarHBondContact CA-OG 3.22Å; I68-S71 PolarHBondContact O-N 2.93Å; I68-S71 PolarHBondContact O-OG 3.12Å; S71-T73 VanDerWaalsContact C-N 3.3Å; S71-T73 PolarHBondContact O-N 3.06Å; S71-V74 CarbonylContact O-C 3.6Å; S71-V74 PolarHBondContact O-N 3.35Å; S71-V74 VanDerWaalsContact O-N 3.16Å; S71-G75 PolarHBondContact O-N 2.84Å; S71-L533 VanDerWaalsContact O-CD1 3.28Å; S71-L533 WeakPolarHBondContact O-CD1 3.32Å; S71-L537 WeakPolarHBondContact OG-CD2 3.09Å
72	V	94.6	Very high	90.7	Very high	39 Å²	39	30.8 Å²	30.8	24%	0.236	17%	0.165	C	C	.	.	H	α-helix	trans	-63.4	-38.5	179.9	168.2	0	0	0	0	111.4	I68 V70 V74 G75 A76 V121 I125	I68-V72 HydrophobicContact CG2-CG2 3.96Å; I68-V72 WeakPolarHBondContact O-CB 3.22Å; I68-V72 WeakPolarHBondContact O-CG2 3.34Å; I68-V72 PolarHBondContact O-N 3.3Å; V70-V72 PolarHBondContact O-N 3.44Å; V72-V74 VanDerWaalsContact C-N 3.32Å; V72-V74 PolarHBondContact O-N 3Å; V72-G75 PolarHBondContact O-N 3.39Å; V72-A76 WeakPolarHBondContact O-CB 3.49Å; V72-A76 PolarHBondContact O-N 3Å; V72-V121 HydrophobicContact CG1-CG1 4.07Å; V72-V121 HydrophobicContact CG2-CG1 4.37Å; V72-I125 HydrophobicContact CG1-CB 4.38Å; V72-I125 HydrophobicContact CG1-CD1 3.91Å; V72-I125 HydrophobicContact CG1-CG1 3.14Å
73	T	94.8	Very high	91.1	Very high	8 Å²	8	32.5 Å²	32.5	5%	0.049	17%	0.17	C	C	.	.	H	α-helix	trans	-58.2	-47.9	173.7	-46.7	0	0	0	0	110.8	I69 V70 S71 A76 A77 R124 V127 G128 I131	I69-T73 PolarHBondContact O-OG1 2.96Å; V70-T73 WeakPolarHBondContact O-CB 3.32Å; V70-T73 PolarHBondContact O-N 3.3Å; S71-T73 VanDerWaalsContact C-N 3.3Å; S71-T73 PolarHBondContact O-N 3.06Å; T73-A76 PolarHBondContact O-N 2.96Å; T73-A77 WeakPolarHBondContact O-CB 3.35Å; T73-A77 PolarHBondContact O-N 3.2Å; T73-R124 VanDerWaalsContact OG1-CB 3.32Å; T73-R124 WeakPolarHBondContact OG1-CB 3.43Å; T73-R124 WeakPolarHBondContact OG1-CD 3.38Å; T73-V127 HydrophobicContact CG2-CG1 4.48Å; T73-G128 WeakPolarHBondContact O-CA 3.47Å; T73-I131 HydrophobicContact CG2-CD1 4.01Å
74	V	94.1	Very high	91.4	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.012	16%	0.163	C	C	.	.	H	α-helix	trans	-69.3	-39.1	-178.7	179	0	0	0	0	111.5	V70 S71 V72 A77 A78 Y301 W529 N532 L533	V70-V74 PolarHBondContact O-N 3.31Å; S71-V74 CarbonylContact O-C 3.6Å; S71-V74 PolarHBondContact O-N 3.35Å; S71-V74 VanDerWaalsContact O-N 3.16Å; V72-V74 VanDerWaalsContact C-N 3.32Å; V72-V74 PolarHBondContact O-N 3Å; V74-A77 WeakPolarHBondContact O-CB 3.14Å; V74-A77 PolarHBondContact O-N 2.93Å; V74-A78 PolarHBondContact O-N 3.34Å; V74-Y301 HydrophobicContact CG2-CE2 4.03Å; V74-Y301 WeakPolarHBondContact CG2-OH 3.42Å; V74-W529 HydrophobicContact CG1-CE3 4.14Å; V74-W529 VanDerWaalsContact CG1-O 3.27Å; V74-W529 WeakPolarHBondContact CG1-O 3.48Å; V74-N532 HydrophobicContact CG1-CB 3.59Å; V74-N532 WeakPolarHBondContact CG1-OD1 3.48Å; V74-L533 HydrophobicContact CG1-CB 3.94Å; V74-L533 VanDerWaalsContact CG1-N 3.3Å
75	G	95.3	Very high	91.3	Very high	16 Å²	16	26.3 Å²	26.3	17%	0.165	14%	0.138	C	C	.	.	H	α-helix	trans	-65.3	-43.7	176.5	0	0	0	0	0	111.9	S71 V72 A77 A78 V79	S71-G75 PolarHBondContact O-N 2.84Å; V72-G75 PolarHBondContact O-N 3.39Å; G75-A77 VanDerWaalsContact C-N 3.34Å; G75-A78 WeakPolarHBondContact O-CB 3.13Å; G75-A78 PolarHBondContact O-N 2.96Å; G75-V79 WeakPolarHBondContact O-CG2 3.39Å; G75-V79 PolarHBondContact O-N 3.46Å
76	A	96.7	Very high	91.3	Very high	12 Å²	12	29.4 Å²	29.4	10%	0.099	15%	0.149	C	C	.	.	H	α-helix	trans	-60.9	-44.1	170.6	0	0	0	0	0	110.9	V72 T73 A78 V79 F80 I125	V72-A76 WeakPolarHBondContact O-CB 3.49Å; V72-A76 PolarHBondContact O-N 3Å; T73-A76 PolarHBondContact O-N 2.96Å; A76-A78 VanDerWaalsContact C-N 3.29Å; A76-A78 PolarHBondContact O-N 3.01Å; A76-V79 PolarHBondContact O-N 2.69Å; A76-F80 WeakPolarHBondContact O-CB 3.47Å; A76-F80 VanDerWaalsContact O-CD2 3.3Å; A76-F80 WeakPolarHBondContact O-CD2 3.34Å; A76-F80 PolarHBondContact O-N 2.99Å; A76-I125 HydrophobicContact CB-CG2 4.36Å
77	A	95.7	Very high	91.4	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-58.4	-39.4	175.7	0	0	0	0	0	112.6	T73 V74 G75 A81 G128 I131 G132 W529	T73-A77 WeakPolarHBondContact O-CB 3.35Å; T73-A77 PolarHBondContact O-N 3.2Å; V74-A77 WeakPolarHBondContact O-CB 3.14Å; V74-A77 PolarHBondContact O-N 2.93Å; G75-A77 VanDerWaalsContact C-N 3.34Å; A77-A81 WeakPolarHBondContact O-CB 3.34Å; A77-A81 PolarHBondContact O-N 3.13Å; A77-G128 WeakPolarHBondContact CA-O 3.46Å; A77-G128 WeakPolarHBondContact CB-O 3.26Å; A77-G128 PolarHBondContact N-O 3Å; A77-I131 HydrophobicContact CB-CB 4.21Å; A77-I131 HydrophobicContact CB-CG2 3.96Å; A77-G132 WeakPolarHBondContact O-CA 3.18Å; A77-W529 HydrophobicContact CB-CB 4.45Å; A77-W529 HydrophobicContact CB-CD2 3.76Å; A77-W529 HydrophobicContact CB-CE3 4.1Å; A77-W529 HydrophobicContact CB-CG 3.9Å
78	A	94.9	Very high	91.4	Very high	4 Å²	4	30.8 Å²	30.8	3%	0.033	16%	0.155	C	C	.	.	H	α-helix	trans	-61.9	-53.7	174.7	0	0	0	0	0	111.7	V74 G75 A76 F80 A81 L82 F526 W529	V74-A78 PolarHBondContact O-N 3.34Å; G75-A78 WeakPolarHBondContact O-CB 3.13Å; G75-A78 PolarHBondContact O-N 2.96Å; A76-A78 VanDerWaalsContact C-N 3.29Å; A76-A78 PolarHBondContact O-N 3.01Å; A78-F80 VanDerWaalsContact C-N 3.34Å; A78-F80 PolarHBondContact O-N 3.31Å; A78-A81 PolarHBondContact O-N 3.19Å; A78-L82 PolarHBondContact O-N 3.46Å; A78-F526 HydrophobicContact CB-CD2 4.19Å; A78-F526 HydrophobicContact CB-CE2 4.33Å; A78-F526 WeakPolarHBondContact O-CD2 3.46Å; A78-W529 VanDerWaalsContact CA-CB 3.4Å; A78-W529 HydrophobicContact CB-CB 3.53Å
79	V	95.1	Very high	91.2	Very high	77 Å²	77	31.1 Å²	31.1	47%	0.467	16%	0.158	S	C	.	.	H	α-helix	trans	-57	-49.4	-179.1	173.4	0	0	0	0	110.7	G75 A76 L82 F83	G75-V79 WeakPolarHBondContact O-CG2 3.39Å; G75-V79 PolarHBondContact O-N 3.46Å; A76-V79 PolarHBondContact O-N 2.69Å; V79-L82 WeakPolarHBondContact O-CB 3.28Å; V79-L82 PolarHBondContact O-N 3.44Å; V79-F83 HydrophobicContact CG1-CD2 4.39Å; V79-F83 HydrophobicContact CG1-CE2 3.91Å; V79-F83 WeakPolarHBondContact O-CD2 3.38Å
80	F	94.8	Very high	91	Very high	69 Å²	69	38.8 Å²	38.8	30%	0.303	19%	0.186	S	C	.	.	H	α-helix	trans	-74.1	-27.2	-176.6	-80.8	-82.4	0	0	0	113.8	A76 A78 L82 F83 G84 A129 I133	A76-F80 WeakPolarHBondContact O-CB 3.47Å; A76-F80 VanDerWaalsContact O-CD2 3.3Å; A76-F80 WeakPolarHBondContact O-CD2 3.34Å; A76-F80 PolarHBondContact O-N 2.99Å; A78-F80 VanDerWaalsContact C-N 3.34Å; A78-F80 PolarHBondContact O-N 3.31Å; F80-L82 VanDerWaalsContact C-N 3.3Å; F80-L82 PolarHBondContact O-N 3.19Å; F80-F83 PolarHBondContact O-N 2.81Å; F80-G84 PolarHBondContact O-N 3.41Å; F80-G84 VanDerWaalsContact O-N 3.1Å; F80-A129 HydrophobicContact CD1-CB 4.13Å; F80-A129 HydrophobicContact CD2-CB 3.4Å; F80-A129 HydrophobicContact CE1-CB 4.15Å; F80-A129 HydrophobicContact CE2-CB 3.43Å; F80-A129 VanDerWaalsContact CE2-CB 3.43Å; F80-A129 HydrophobicContact CG-CB 3.77Å; F80-A129 HydrophobicContact CZ-CB 3.81Å; F80-I133 HydrophobicContact CB-CG1 4.04Å; F80-I133 HydrophobicContact CD1-CD1 4Å; F80-I133 HydrophobicContact CD1-CG1 4.13Å; F80-I133 HydrophobicContact CG-CG1 4.49Å
81	A	92.2	Very high	91.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-64.4	-34.1	171.7	0	0	0	0	0	112.8	A77 A78 F83 G84 G132 T525	A77-A81 WeakPolarHBondContact O-CB 3.34Å; A77-A81 PolarHBondContact O-N 3.13Å; A78-A81 PolarHBondContact O-N 3.19Å; A81-F83 VanDerWaalsContact C-N 3.3Å; A81-F83 PolarHBondContact O-N 3.44Å; A81-G84 PolarHBondContact O-N 3.4Å; A81-G132 WeakPolarHBondContact CA-O 3.11Å; A81-T525 HydrophobicContact CB-CG2 3.67Å
82	L	89.3	Confident	91.1	Very high	84 Å²	84	42.2 Å²	42.2	44%	0.44	20%	0.2	S	C	.	.	H	α-helix	trans	-63.2	-38	177.3	-171.7	67	0	0	0	111.8	A78 V79 F80 F526	A78-L82 PolarHBondContact O-N 3.46Å; V79-L82 WeakPolarHBondContact O-CB 3.28Å; V79-L82 PolarHBondContact O-N 3.44Å; F80-L82 VanDerWaalsContact C-N 3.3Å; F80-L82 PolarHBondContact O-N 3.19Å; L82-F526 HydrophobicContact CB-CB 4.42Å; L82-F526 HydrophobicContact CB-CD2 4.2Å; L82-F526 HydrophobicContact CB-CG 4.49Å; L82-F526 HydrophobicContact CD1-CB 4.26Å; L82-F526 HydrophobicContact CD1-CG 4.19Å
83	F	89.1	Confident	90.9	Very high	104 Å²	104	40.7 Å²	40.7	46%	0.456	19%	0.191	S	C	.	.	H	α-helix	trans	-82.7	-13.7	177.3	-61.1	-70.1	0	0	0	113.5	V79 F80 A81 G85 W86 F87	V79-F83 HydrophobicContact CG1-CD2 4.39Å; V79-F83 HydrophobicContact CG1-CE2 3.91Å; V79-F83 WeakPolarHBondContact O-CD2 3.38Å; F80-F83 PolarHBondContact O-N 2.81Å; A81-F83 VanDerWaalsContact C-N 3.3Å; A81-F83 PolarHBondContact O-N 3.44Å; F83-G85 PolarHBondContact O-N 3.41Å; F83-W86 PolarHBondContact O-N 3.11Å; F83-W86 VanDerWaalsContact O-N 3.16Å; F83-F87 HydrophobicContact CB-CD2 3.91Å; F83-F87 HydrophobicContact CB-CE2 3.55Å; F83-F87 HydrophobicContact CB-CZ 4.31Å; F83-F87 WeakPolarHBondContact O-CD2 3.4Å; F83-F87 PolarHBondContact O-N 2.95Å
84	G	85.2	Confident	90.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-53.4	-46.2	-177.1	0	0	0	0	0	113.8	F80 A81 W86 F87 N88 S136	F80-G84 PolarHBondContact O-N 3.41Å; F80-G84 VanDerWaalsContact O-N 3.1Å; A81-G84 PolarHBondContact O-N 3.4Å; G84-W86 PolarHBondContact O-N 3.02Å; G84-F87 WeakPolarHBondContact O-CB 3.19Å; G84-F87 PolarHBondContact O-N 3.3Å; G84-N88 WeakPolarHBondContact O-CB 3.21Å; G84-N88 PolarHBondContact O-N 3.31Å; G84-N88 PolarHBondContact O-ND2 2.95Å; G84-N88 VanDerWaalsContact O-ND2 3.12Å; G84-S136 WeakPolarHBondContact CA-OG 3.46Å
85	G	81.8	Confident	90.7	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62.7	-41.2	179.1	0	0	0	0	0	113.5	F83 N88 D89 S518 S522	F83-G85 PolarHBondContact O-N 3.41Å; G85-N88 PolarHBondContact O-N 3.2Å; G85-D89 PolarHBondContact O-N 3.1Å; G85-S518 VanDerWaalsContact CA-OG 3.24Å; G85-S518 WeakPolarHBondContact CA-OG 3.5Å; G85-S518 PolarHBondContact O-OG 2.91Å; G85-S522 WeakPolarHBondContact CA-OG 3.35Å; G85-S522 PolarHBondContact N-OG 3.23Å
86	W	85.8	Confident	90.6	Very high	125 Å²	125	48.6 Å²	48.6	47%	0.473	22%	0.22	S	C	.	.	H	α-helix	trans	-64.8	-43.5	175.5	179.5	85.6	0	0	0	111.6	F83 G84 N88 D89 R90 F91	F83-W86 PolarHBondContact O-N 3.11Å; F83-W86 VanDerWaalsContact O-N 3.16Å; G84-W86 PolarHBondContact O-N 3.02Å; W86-N88 VanDerWaalsContact C-N 3.35Å; W86-N88 PolarHBondContact O-N 3.08Å; W86-D89 PolarHBondContact O-N 3.46Å; W86-R90 WeakPolarHBondContact O-CB 3.27Å; W86-R90 PolarHBondContact O-N 3.09Å; W86-F91 HydrophobicContact CH2-CE2 4.37Å; W86-F91 HydrophobicContact CZ3-CE2 4.03Å
87	F	89.5	Confident	90.4	Very high	43 Å²	43	48.1 Å²	48.1	19%	0.189	22%	0.215	C	C	.	.	H	α-helix	trans	-60.5	-44.5	174.9	-74	-49.8	0	0	0	112	F83 G84 D89 R90 F91 I96	F83-F87 HydrophobicContact CB-CD2 3.91Å; F83-F87 HydrophobicContact CB-CE2 3.55Å; F83-F87 HydrophobicContact CB-CZ 4.31Å; F83-F87 WeakPolarHBondContact O-CD2 3.4Å; F83-F87 PolarHBondContact O-N 2.95Å; G84-F87 WeakPolarHBondContact O-CB 3.19Å; G84-F87 PolarHBondContact O-N 3.3Å; F87-D89 PolarHBondContact O-N 3.41Å; F87-R90 PolarHBondContact O-N 3.03Å; F87-F91 AromaticContact CD1-CD2 3.99Å; F87-F91 HydrophobicContact CD1-CD2 3.99Å; F87-F91 AromaticContact CD1-CE2 3.89Å; F87-F91 HydrophobicContact CD1-CE2 3.89Å; F87-F91 HydrophobicContact CE1-CE2 4.41Å; F87-F91 WeakPolarHBondContact O-CB 3.28Å; F87-F91 PolarHBondContact O-N 3.23Å; F87-I96 HydrophobicContact CB-CD1 3.71Å; F87-I96 HydrophobicContact CB-CG1 4.04Å; F87-I96 HydrophobicContact CD1-CD1 4.44Å; F87-I96 HydrophobicContact CG-CD1 4.26Å
88	N	89.1	Confident	90.4	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.011	22%	0.223	C	C	.	.	H	α-helix	trans	-62.3	-42.5	-179.4	-70.7	-26.1	0	0	0	112.1	G84 G85 W86 G92 R93 T137 W213	G84-N88 WeakPolarHBondContact O-CB 3.21Å; G84-N88 PolarHBondContact O-N 3.31Å; G84-N88 PolarHBondContact O-ND2 2.95Å; G84-N88 VanDerWaalsContact O-ND2 3.12Å; G85-N88 PolarHBondContact O-N 3.2Å; W86-N88 VanDerWaalsContact C-N 3.35Å; W86-N88 PolarHBondContact O-N 3.08Å; N88-G92 WeakPolarHBondContact O-CA 3.49Å; N88-G92 PolarHBondContact O-N 3.12Å; N88-G92 VanDerWaalsContact O-N 3.16Å; N88-R93 PolarHBondContact O-NH1 3.16Å; N88-T137 VanDerWaalsContact CG-OG1 3.3Å; N88-T137 PolarHBondContact ND2-OG1 3.06Å; N88-T137 VanDerWaalsContact ND2-OG1 3.15Å; N88-T137 WeakPolarHBondContact OD1-CB 3.31Å; N88-T137 WeakPolarHBondContact OD1-CG2 3.41Å; N88-T137 PolarHBondContact OD1-OG1 3.1Å; N88-W213 PolarHBondContact O-NE1 3.5Å
89	D	84.9	Confident	90.4	Very high	58 Å²	58	53 Å²	53	31%	0.31	24%	0.24	S	C	.	.	H	α-helix	trans	-74.7	-37.1	-178.6	-67.7	-21.7	0	0	0	111.8	G85 W86 F87 R93 W213 S518 H519	G85-D89 PolarHBondContact O-N 3.1Å; W86-D89 PolarHBondContact O-N 3.46Å; F87-D89 PolarHBondContact O-N 3.41Å; D89-R93 IonicContact OD1-CZ 2.93Å; D89-R93 IonicContact OD1-NH1 3.06Å; D89-R93 PolarHBondContact OD1-NH1 2.9Å; D89-R93 VanDerWaalsContact OD1-NH1 3.13Å; D89-R93 IonicContact OD1-NH2 3.19Å; D89-W213 PolarHBondContact O-NE1 3.07Å; D89-S518 PolarHBondContact OD1-OG 2.73Å; D89-S518 WeakPolarHBondContact OD2-CB 3.37Å; D89-S518 PolarHBondContact OD2-OG 3.49Å; D89-H519 IonicContact OD2-NE2 4Å
90	R	87.8	Confident	90.3	Very high	162 Å²	162	49.3 Å²	49.3	61%	0.611	22%	0.218	S	C	*	.	H	α-helix	trans	-77.3	-44	-179.3	-174.2	170.6	-175.5	139.8	1	114.1	W86 F87	W86-R90 WeakPolarHBondContact O-CB 3.27Å; W86-R90 PolarHBondContact O-N 3.09Å; F87-R90 PolarHBondContact O-N 3.03Å
91	F	91.3	Very high	90.3	Very high	81 Å²	81	46 Å²	46	36%	0.355	20%	0.204	S	C	.	.	H	α-helix	trans	-107.4	-12.3	-169.4	-62.6	-70.4	0	0	0	114.2	W86 F87 K95 I96	W86-F91 HydrophobicContact CH2-CE2 4.37Å; W86-F91 HydrophobicContact CZ3-CE2 4.03Å; F87-F91 AromaticContact CD1-CD2 3.99Å; F87-F91 HydrophobicContact CD1-CD2 3.99Å; F87-F91 AromaticContact CD1-CE2 3.89Å; F87-F91 HydrophobicContact CD1-CE2 3.89Å; F87-F91 HydrophobicContact CE1-CE2 4.41Å; F87-F91 WeakPolarHBondContact O-CB 3.28Å; F87-F91 PolarHBondContact O-N 3.23Å; F91-K95 WeakPolarHBondContact O-CD 3.17Å; F91-I96 HydrophobicContact CB-CD1 3.98Å; F91-I96 HydrophobicContact CB-CG1 4.18Å; F91-I96 HydrophobicContact CD2-CD1 4.15Å; F91-I96 HydrophobicContact CG-CD1 4.41Å
92	G	90.2	Very high	90.6	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	22%	0.223	C	C	.	.			trans	87.5	167.7	-170.6	0	0	0	0	0	111.8	N88 I96 E209 W213	N88-G92 WeakPolarHBondContact O-CA 3.49Å; N88-G92 PolarHBondContact O-N 3.12Å; N88-G92 VanDerWaalsContact O-N 3.16Å; G92-I96 WeakPolarHBondContact O-CG1 3.42Å; G92-E209 WeakPolarHBondContact CA-OE2 3.23Å; G92-W213 VanDerWaalsContact N-CZ2 3.3Å
93	R	90.6	Very high	90.9	Very high	8 Å²	8	47.1 Å²	47.1	3%	0.03	21%	0.212	C	C	.	.	H	α-helix	trans	-81.1	-36.6	-173.7	-69	61.7	165.8	135.3	4.4	110	N88 D89 K95 I96 I97 T137 Y141 E144 E209	N88-R93 PolarHBondContact O-NH1 3.16Å; D89-R93 IonicContact OD1-CZ 2.93Å; D89-R93 IonicContact OD1-NH1 3.06Å; D89-R93 PolarHBondContact OD1-NH1 2.9Å; D89-R93 VanDerWaalsContact OD1-NH1 3.13Å; D89-R93 IonicContact OD1-NH2 3.19Å; R93-K95 PolarHBondContact O-N 3.39Å; R93-I96 PolarHBondContact O-N 3.1Å; R93-I97 WeakPolarHBondContact O-CG1 3.08Å; R93-I97 PolarHBondContact O-N 2.59Å; R93-T137 HydrophobicContact CB-CG2 3.9Å; R93-T137 HydrophobicContact CG-CG2 4.12Å; R93-Y141 HydrophobicContact CB-CD2 3.74Å; R93-Y141 HydrophobicContact CB-CG 4.41Å; R93-Y141 HydrophobicContact CG-CD2 4.47Å; R93-E144 IonicContact CZ-OE1 3.43Å; R93-E144 IonicContact CZ-OE2 3.59Å; R93-E144 IonicContact NE-OE1 2.67Å; R93-E144 IonicContact NE-OE2 2.59Å; R93-E144 PolarHBondContact NE-OE2 2.67Å; R93-E144 IonicContact NH2-OE1 3.73Å; R93-E144 PolarHBondContact NH2-OE1 3.03Å; R93-E144 IonicContact NH2-OE2 2.62Å; R93-E144 PolarHBondContact NH2-OE2 3.07Å; R93-E209 WeakPolarHBondContact CA-OE1 3.11Å; R93-E209 WeakPolarHBondContact CB-OE1 3.21Å; R93-E209 VanDerWaalsContact N-CD 3.31Å; R93-E209 PolarHBondContact N-OE1 2.86Å; R93-E209 PolarHBondContact N-OE2 2.67Å
94	K	92.3	Very high	91.2	Very high	53 Å²	53	42.3 Å²	42.3	23%	0.23	19%	0.191	C	C	.	.	H	α-helix	trans	-61.4	-50.5	-176.3	175.2	179.9	-178.4	167.3	0	112.5	I96 I97 L98 F204 L205 M207 E209	K94-I96 PolarHBondContact O-N 2.88Å; K94-I97 PolarHBondContact O-N 3.48Å; K94-L98 HydrophobicContact CG-CD1 4.1Å; K94-L98 WeakPolarHBondContact O-CG 3.24Å; K94-L98 PolarHBondContact O-N 3.37Å; K94-F204 HydrophobicContact CB-CE1 4.21Å; K94-F204 HydrophobicContact CG-CD1 4.31Å; K94-F204 HydrophobicContact CG-CE1 3.98Å; K94-L205 PolarHBondContact NZ-O 2.65Å; K94-M207 VanDerWaalsContact CD-O 3.3Å; K94-M207 WeakPolarHBondContact CD-O 3.24Å; K94-M207 WeakPolarHBondContact CE-O 3.4Å; K94-M207 PolarHBondContact NZ-O 3.1Å; K94-E209 VanDerWaalsContact CB-OE2 3.26Å; K94-E209 WeakPolarHBondContact CB-OE2 3.27Å; K94-E209 PolarHBondContact N-OE1 3.4Å; K94-E209 PolarHBondContact N-OE2 3Å
95	K	93.4	Very high	91.8	Very high	133 Å²	133	44 Å²	44	58%	0.578	20%	0.2	S	C	*	.	H	α-helix	trans	-62.4	-36.3	-177.6	-64.7	-175.2	-173.3	170.9	0	111.8	F91 R93 L98 L99	F91-K95 WeakPolarHBondContact O-CD 3.17Å; R93-K95 PolarHBondContact O-N 3.39Å; K95-L98 PolarHBondContact O-N 2.9Å; K95-L99 WeakPolarHBondContact O-CB 3.36Å; K95-L99 PolarHBondContact O-N 3.38Å
96	I	93.6	Very high	92.6	Very high	6 Å²	6	47.1 Å²	47.1	3%	0.031	22%	0.219	C	C	.	.	H	α-helix	trans	-72.9	-38.4	-179	-63.7	-53.3	0	0	0	111.6	F87 F91 G92 R93 K94 L99 S100 I133 T137	F87-I96 HydrophobicContact CB-CD1 3.71Å; F87-I96 HydrophobicContact CB-CG1 4.04Å; F87-I96 HydrophobicContact CD1-CD1 4.44Å; F87-I96 HydrophobicContact CG-CD1 4.26Å; F91-I96 HydrophobicContact CB-CD1 3.98Å; F91-I96 HydrophobicContact CB-CG1 4.18Å; F91-I96 HydrophobicContact CD2-CD1 4.15Å; F91-I96 HydrophobicContact CG-CD1 4.41Å; G92-I96 WeakPolarHBondContact O-CG1 3.42Å; R93-I96 PolarHBondContact O-N 3.1Å; K94-I96 PolarHBondContact O-N 2.88Å; I96-L99 PolarHBondContact O-N 3.46Å; I96-S100 PolarHBondContact O-N 3.13Å; I96-I133 HydrophobicContact CG2-CG2 3.1Å; I96-T137 HydrophobicContact CB-CG2 4.35Å; I96-T137 HydrophobicContact CG2-CG2 4.17Å; I96-T137 WeakPolarHBondContact CG2-OG1 3.4Å
97	I	92.5	Very high	93.2	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-64.4	-44.4	171.9	-67.4	166	0	0	0	110.8	R93 K94 L99 S100 C101 T137 I138 Y141 F204	R93-I97 WeakPolarHBondContact O-CG1 3.08Å; R93-I97 PolarHBondContact O-N 2.59Å; K94-I97 PolarHBondContact O-N 3.48Å; I97-L99 VanDerWaalsContact C-N 3.33Å; I97-L99 PolarHBondContact O-N 3.25Å; I97-S100 PolarHBondContact O-N 3.05Å; I97-S100 VanDerWaalsContact O-N 3.16Å; I97-S100 PolarHBondContact O-OG 2.8Å; I97-C101 PolarHBondContact O-N 2.87Å; I97-C101 PolarHBondContact O-SG 3.22Å; I97-T137 HydrophobicContact CD1-CG2 4.02Å; I97-T137 HydrophobicContact CG1-CG2 3.71Å; I97-I138 HydrophobicContact CD1-CG1 4.36Å; I97-I138 HydrophobicContact CG1-CG1 4.32Å; I97-Y141 HydrophobicContact CD1-CD1 4.31Å; I97-Y141 HydrophobicContact CD1-CD2 4.41Å; I97-Y141 HydrophobicContact CD1-CG 4Å; I97-F204 HydrophobicContact CB-CD1 4.15Å; I97-F204 HydrophobicContact CB-CE1 3.84Å; I97-F204 HydrophobicContact CB-CE2 4.49Å; I97-F204 HydrophobicContact CB-CZ 4.03Å; I97-F204 HydrophobicContact CD1-CE1 3.93Å; I97-F204 HydrophobicContact CD1-CE2 3.89Å; I97-F204 HydrophobicContact CD1-CZ 3.32Å; I97-F204 HydrophobicContact CG1-CE1 4.48Å; I97-F204 HydrophobicContact CG1-CZ 4.26Å; I97-F204 HydrophobicContact CG2-CD1 3.77Å; I97-F204 HydrophobicContact CG2-CD2 3.8Å; I97-F204 HydrophobicContact CG2-CE1 3.82Å; I97-F204 HydrophobicContact CG2-CE2 3.82Å; I97-F204 HydrophobicContact CG2-CG 3.78Å; I97-F204 HydrophobicContact CG2-CZ 3.84Å
98	L	94.3	Very high	93.5	Very high	31 Å²	31	39.3 Å²	39.3	16%	0.162	19%	0.188	C	C	.	.	H	α-helix	trans	-60.7	-41.9	175.9	-68.7	171.4	0	0	0	112.1	K94 K95 S100 C101 V102 L201 F204 L205	K94-L98 HydrophobicContact CG-CD1 4.1Å; K94-L98 WeakPolarHBondContact O-CG 3.24Å; K94-L98 PolarHBondContact O-N 3.37Å; K95-L98 PolarHBondContact O-N 2.9Å; L98-S100 VanDerWaalsContact C-N 3.35Å; L98-S100 PolarHBondContact O-N 3.31Å; L98-C101 WeakPolarHBondContact O-CB 3.33Å; L98-C101 PolarHBondContact O-N 3.36Å; L98-V102 PolarHBondContact O-N 2.86Å; L98-V102 VanDerWaalsContact O-N 3.11Å; L98-L201 HydrophobicContact CD2-CD1 3.8Å; L98-F204 HydrophobicContact CD2-CB 4.04Å; L98-F204 HydrophobicContact CD2-CD1 4.17Å; L98-F204 HydrophobicContact CG-CD1 4.23Å; L98-L205 HydrophobicContact CD1-CD2 4.13Å; L98-L205 HydrophobicContact CD2-CD2 3.92Å; L98-L205 HydrophobicContact CD2-CG 4.23Å
99	L	94.9	Very high	93.9	Very high	76 Å²	76	43.3 Å²	43.3	40%	0.398	21%	0.213	S	C	.	.	H	α-helix	trans	-58.7	-45.5	173.7	177	62.5	0	0	0	111.4	K95 I96 I97 C101 V102 L103 I133	K95-L99 WeakPolarHBondContact O-CB 3.36Å; K95-L99 PolarHBondContact O-N 3.38Å; I96-L99 PolarHBondContact O-N 3.46Å; I97-L99 VanDerWaalsContact C-N 3.33Å; I97-L99 PolarHBondContact O-N 3.25Å; L99-C101 VanDerWaalsContact C-N 3.3Å; L99-C101 PolarHBondContact O-N 2.99Å; L99-V102 PolarHBondContact O-N 3.28Å; L99-L103 HydrophobicContact CD1-CG 4.42Å; L99-L103 HydrophobicContact CG-CD1 4.25Å; L99-L103 WeakPolarHBondContact O-CG 3.41Å; L99-L103 PolarHBondContact O-N 2.78Å; L99-I133 HydrophobicContact CD2-CD1 4.49Å
100	S	94.5	Very high	94.5	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61.1	-37.7	176.4	67.8	0	0	0	0	112.7	I96 I97 L98 V102 L103 F104	I96-S100 PolarHBondContact O-N 3.13Å; I97-S100 PolarHBondContact O-N 3.05Å; I97-S100 VanDerWaalsContact O-N 3.16Å; I97-S100 PolarHBondContact O-OG 2.8Å; L98-S100 VanDerWaalsContact C-N 3.35Å; L98-S100 PolarHBondContact O-N 3.31Å; S100-V102 PolarHBondContact O-N 3.24Å; S100-L103 PolarHBondContact O-N 2.5Å; S100-F104 WeakPolarHBondContact O-CD2 3.38Å; S100-F104 PolarHBondContact O-N 3.45Å
101	C	95	Very high	94.9	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.6	-42.1	176.7	-62.2	0	0	0	0	111.5	I97 L98 L99 F104 I105 L201	I97-C101 PolarHBondContact O-N 2.87Å; I97-C101 PolarHBondContact O-SG 3.22Å; L98-C101 WeakPolarHBondContact O-CB 3.33Å; L98-C101 PolarHBondContact O-N 3.36Å; L99-C101 VanDerWaalsContact C-N 3.3Å; L99-C101 PolarHBondContact O-N 2.99Å; C101-F104 PolarHBondContact O-N 3.4Å; C101-I105 VanDerWaalsContact O-CG1 3.31Å; C101-I105 WeakPolarHBondContact O-CG1 3.33Å; C101-I105 PolarHBondContact O-N 2.99Å; C101-L201 HydrophobicContact CB-CB 3.89Å; C101-L201 HydrophobicContact CB-CD1 3.85Å; C101-L201 HydrophobicContact CB-CG 4.44Å
102	V	96.7	Very high	95.1	Very high	66 Å²	66	32 Å²	32	40%	0.4	17%	0.171	S	C	.	.	H	α-helix	trans	-62.6	-44	175.5	174.2	0	0	0	0	111	L98 L99 S100 I105 V106 L201	L98-V102 PolarHBondContact O-N 2.86Å; L98-V102 VanDerWaalsContact O-N 3.11Å; L99-V102 PolarHBondContact O-N 3.28Å; S100-V102 PolarHBondContact O-N 3.24Å; V102-I105 PolarHBondContact O-N 3.38Å; V102-V106 HydrophobicContact CG1-CG2 4.33Å; V102-V106 WeakPolarHBondContact O-CG2 3.48Å; V102-V106 PolarHBondContact O-N 3.37Å; V102-L201 HydrophobicContact CG2-CD1 4.19Å; V102-L201 HydrophobicContact CG2-CD2 4.4Å
103	L	96.9	Very high	95.3	Very high	40 Å²	40	35 Å²	35	21%	0.209	20%	0.196	C	C	.	.	H	α-helix	trans	-62.7	-42.2	177	-67.8	173.7	0	0	0	111.8	L99 S100 I105 V106 G107 I126 A129 A130 I133	L99-L103 HydrophobicContact CD1-CG 4.42Å; L99-L103 HydrophobicContact CG-CD1 4.25Å; L99-L103 WeakPolarHBondContact O-CG 3.41Å; L99-L103 PolarHBondContact O-N 2.78Å; S100-L103 PolarHBondContact O-N 2.5Å; L103-I105 PolarHBondContact O-N 2.91Å; L103-V106 PolarHBondContact O-N 3.05Å; L103-G107 PolarHBondContact O-N 3.44Å; L103-I126 HydrophobicContact CB-CG2 4.32Å; L103-I126 HydrophobicContact CD2-CG2 4.17Å; L103-I126 VanDerWaalsContact O-CG2 3.29Å; L103-I126 WeakPolarHBondContact O-CG2 3.37Å; L103-A129 HydrophobicContact CD1-CB 4.41Å; L103-A130 HydrophobicContact CB-CB 3.67Å; L103-I133 HydrophobicContact CD1-CD1 4.21Å
104	F	95.9	Very high	95.4	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.018	20%	0.195	C	C	.	.	H	α-helix	trans	-58.2	-48.3	173.3	-84.8	-64.1	0	0	0	111.8	L40 S100 C101 G107 S108 V127 A130 I131 A197	L40-F104 HydrophobicContact CB-CE1 4.4Å; L40-F104 HydrophobicContact CB-CE2 4.35Å; L40-F104 HydrophobicContact CB-CZ 4.28Å; L40-F104 HydrophobicContact CD1-CB 4.45Å; L40-F104 HydrophobicContact CD1-CD2 3.77Å; L40-F104 HydrophobicContact CD1-CE2 4.19Å; L40-F104 HydrophobicContact CD1-CG 4.12Å; S100-F104 WeakPolarHBondContact O-CD2 3.38Å; S100-F104 PolarHBondContact O-N 3.45Å; C101-F104 PolarHBondContact O-N 3.4Å; F104-G107 PolarHBondContact O-N 2.97Å; F104-S108 WeakPolarHBondContact O-CB 3.11Å; F104-S108 PolarHBondContact O-N 2.7Å; F104-S108 PolarHBondContact O-OG 3.35Å; F104-V127 HydrophobicContact CD1-CG1 4.01Å; F104-V127 HydrophobicContact CE1-CG1 3.86Å; F104-A130 HydrophobicContact CB-CB 4.45Å; F104-A130 HydrophobicContact CD1-CB 3.92Å; F104-A130 HydrophobicContact CD2-CB 3.53Å; F104-A130 HydrophobicContact CE1-CB 3.99Å; F104-A130 HydrophobicContact CE2-CB 3.6Å; F104-A130 HydrophobicContact CG-CB 3.68Å; F104-A130 HydrophobicContact CZ-CB 3.84Å; F104-I131 HydrophobicContact CE1-CD1 4.42Å; F104-I131 HydrophobicContact CE1-CG1 3.69Å; F104-I131 HydrophobicContact CZ-CB 4.46Å; F104-I131 HydrophobicContact CZ-CG1 3.58Å; F104-A197 HydrophobicContact CB-CB 3.85Å
105	I	97.3	Very high	95.3	Very high	36 Å²	36	40.2 Å²	40.2	19%	0.185	22%	0.222	C	C	.	.	H	α-helix	trans	-59.8	-50.9	179.2	-65.8	164.3	0	0	0	110.9	C101 V102 L103 G107 S108 V109 A197 L198 L201	C101-I105 VanDerWaalsContact O-CG1 3.31Å; C101-I105 WeakPolarHBondContact O-CG1 3.33Å; C101-I105 PolarHBondContact O-N 2.99Å; V102-I105 PolarHBondContact O-N 3.38Å; L103-I105 PolarHBondContact O-N 2.91Å; I105-G107 VanDerWaalsContact C-N 3.35Å; I105-G107 PolarHBondContact O-N 3.4Å; I105-S108 PolarHBondContact O-N 3.2Å; I105-V109 HydrophobicContact CG2-CG2 4.49Å; I105-V109 VanDerWaalsContact O-CG2 3.29Å; I105-V109 WeakPolarHBondContact O-CG2 3.31Å; I105-V109 PolarHBondContact O-N 3.43Å; I105-A197 HydrophobicContact CG1-CB 3.62Å; I105-L198 HydrophobicContact CD1-CB 4.23Å; I105-L198 HydrophobicContact CD1-CD1 4.27Å; I105-L201 HydrophobicContact CD1-CB 4.35Å; I105-L201 HydrophobicContact CD1-CD2 3.79Å
106	V	98	Very high	95.1	Very high	65 Å²	65	35.7 Å²	35.7	39%	0.394	21%	0.207	S	C	.	.	H	α-helix	trans	-61.7	-45.1	-179.2	172.5	0	0	0	0	110.7	V102 L103 V109 I110 I126	V102-V106 HydrophobicContact CG1-CG2 4.33Å; V102-V106 WeakPolarHBondContact O-CG2 3.48Å; V102-V106 PolarHBondContact O-N 3.37Å; L103-V106 PolarHBondContact O-N 3.05Å; V106-V109 PolarHBondContact O-N 3.43Å; V106-I110 HydrophobicContact CG1-CD1 3.79Å; V106-I110 VanDerWaalsContact O-CG1 3.29Å; V106-I110 WeakPolarHBondContact O-CG1 3.36Å; V106-I110 PolarHBondContact O-N 2.89Å; V106-I126 HydrophobicContact CG1-CD1 4.42Å; V106-I126 HydrophobicContact CG1-CG2 4.44Å
107	G	97.6	Very high	94.9	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-60.8	-47.7	177.5	0	0	0	0	0	112.5	L103 F104 I105 V109 I110 L111	L103-G107 PolarHBondContact O-N 3.44Å; F104-G107 PolarHBondContact O-N 2.97Å; I105-G107 VanDerWaalsContact C-N 3.35Å; I105-G107 PolarHBondContact O-N 3.4Å; G107-V109 PolarHBondContact O-N 3.16Å; G107-I110 PolarHBondContact O-N 3.12Å; G107-L111 VanDerWaalsContact O-CG 3.29Å; G107-L111 WeakPolarHBondContact O-CG 3.43Å; G107-L111 PolarHBondContact O-N 3.1Å
108	S	97.2	Very high	94.8	Very high	4 Å²	4	44 Å²	44	3%	0.028	24%	0.242	C	C	.	.	H	α-helix	trans	-63.3	-39.5	177.5	-61.7	0	0	0	0	112.9	F104 I105 L111 G112 A193	F104-S108 WeakPolarHBondContact O-CB 3.11Å; F104-S108 PolarHBondContact O-N 2.7Å; F104-S108 PolarHBondContact O-OG 3.35Å; I105-S108 PolarHBondContact O-N 3.2Å; S108-L111 PolarHBondContact O-N 3.41Å; S108-G112 PolarHBondContact O-N 2.75Å; S108-A193 VanDerWaalsContact OG-CB 3.32Å; S108-A193 WeakPolarHBondContact OG-CB 3.29Å
109	V	97.3	Very high	94.8	Very high	86 Å²	86	45.2 Å²	45.2	52%	0.521	25%	0.251	S	S	.	.	H	α-helix	trans	-64.2	-43.7	175.3	170.2	0	0	0	0	111	I105 V106 G107 L111 G112 A113 A194	I105-V109 HydrophobicContact CG2-CG2 4.49Å; I105-V109 VanDerWaalsContact O-CG2 3.29Å; I105-V109 WeakPolarHBondContact O-CG2 3.31Å; I105-V109 PolarHBondContact O-N 3.43Å; V106-V109 PolarHBondContact O-N 3.43Å; G107-V109 PolarHBondContact O-N 3.16Å; V109-L111 VanDerWaalsContact C-N 3.34Å; V109-L111 PolarHBondContact O-N 3.18Å; V109-G112 PolarHBondContact O-N 3.31Å; V109-A113 WeakPolarHBondContact O-CB 3.32Å; V109-A113 PolarHBondContact O-N 2.97Å; V109-A194 HydrophobicContact CG2-CB 4.29Å
110	I	97.6	Very high	94.7	Very high	43 Å²	43	41.6 Å²	41.6	22%	0.221	23%	0.232	C	C	.	.	H	α-helix	trans	-62	-43	176.3	-69.8	166.1	0	0	0	110.7	V106 G107 A113 A114 V119 I126	V106-I110 HydrophobicContact CG1-CD1 3.79Å; V106-I110 VanDerWaalsContact O-CG1 3.29Å; V106-I110 WeakPolarHBondContact O-CG1 3.36Å; V106-I110 PolarHBondContact O-N 2.89Å; G107-I110 PolarHBondContact O-N 3.12Å; I110-A113 CarbonylContact O-C 3.59Å; I110-A113 PolarHBondContact O-N 2.67Å; I110-A114 WeakPolarHBondContact O-CB 3.43Å; I110-A114 PolarHBondContact O-N 3.19Å; I110-V119 HydrophobicContact CG2-CG1 3.83Å; I110-I126 HydrophobicContact CD1-CD1 3.43Å; I110-I126 VanDerWaalsContact CD1-CD1 3.43Å
111	L	96.1	Very high	94.7	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-61.8	-45.4	177.4	-70.5	171.2	0	0	0	112	G107 S108 V109 A113 A114 L120 R124 V127 L190	G107-L111 VanDerWaalsContact O-CG 3.29Å; G107-L111 WeakPolarHBondContact O-CG 3.43Å; G107-L111 PolarHBondContact O-N 3.1Å; S108-L111 PolarHBondContact O-N 3.41Å; V109-L111 VanDerWaalsContact C-N 3.34Å; V109-L111 PolarHBondContact O-N 3.18Å; L111-A113 VanDerWaalsContact C-N 3.3Å; L111-A113 PolarHBondContact O-N 3.44Å; L111-A114 WeakPolarHBondContact O-CB 3.35Å; L111-A114 PolarHBondContact O-N 3.3Å; L111-L120 HydrophobicContact CD2-CD2 4Å; L111-L120 WeakPolarHBondContact CD2-O 3.47Å; L111-R124 HydrophobicContact CD2-CG 3.95Å; L111-V127 HydrophobicContact CD1-CG2 3.97Å; L111-L190 HydrophobicContact CB-CB 3.87Å; L111-L190 HydrophobicContact CB-CD1 4.14Å; L111-L190 HydrophobicContact CD2-CD1 4.46Å
112	G	94.7	Very high	94.8	Very high	17 Å²	17	46.3 Å²	46.3	18%	0.175	26%	0.26	C	S	.	.	H	α-helix	trans	-64.9	-32.9	176.7	0	0	0	0	0	113.4	S108 V109 R187	S108-G112 PolarHBondContact O-N 2.75Å; V109-G112 PolarHBondContact O-N 3.31Å; G112-R187 WeakPolarHBondContact O-CB 3.48Å; G112-R187 WeakPolarHBondContact O-CD 3.39Å; G112-R187 WeakPolarHBondContact O-CG 3.12Å; G112-R187 PolarHBondContact O-NH1 2.55Å
113	A	94.9	Very high	94.8	Very high	64 Å²	64	43.2 Å²	43.2	53%	0.529	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	4.3	179.8	0	0	0	0	0	114.4	V109 I110 L111 E115 R187	V109-A113 WeakPolarHBondContact O-CB 3.32Å; V109-A113 PolarHBondContact O-N 2.97Å; I110-A113 CarbonylContact O-C 3.59Å; I110-A113 PolarHBondContact O-N 2.67Å; L111-A113 VanDerWaalsContact C-N 3.3Å; L111-A113 PolarHBondContact O-N 3.44Å; A113-E115 PolarHBondContact O-N 2.82Å; A113-R187 VanDerWaalsContact C-NH1 3.35Å
114	A	93.5	Very high	94.8	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.231	C	C	.	.			trans	-68.9	120.1	-171.4	0	0	0	0	0	112.7	I110 L111 V119 L120 W186 R187	I110-A114 WeakPolarHBondContact O-CB 3.43Å; I110-A114 PolarHBondContact O-N 3.19Å; L111-A114 WeakPolarHBondContact O-CB 3.35Å; L111-A114 PolarHBondContact O-N 3.3Å; A114-V119 HydrophobicContact CB-CB 4.01Å; A114-V119 HydrophobicContact CB-CG1 3.82Å; A114-L120 HydrophobicContact CB-CD2 3.53Å; A114-L120 HydrophobicContact CB-CG 3.77Å; A114-W186 HydrophobicContact CB-CH2 4.35Å; A114-W186 WeakPolarHBondContact O-CH2 2.87Å; A114-R187 PolarHBondContact O-NH1 3.47Å; A114-R187 PolarHBondContact O-NH2 3.05Å
115	E	90	Very high	94.8	Very high	171 Å²	171	44.6 Å²	44.6	80%	0.799	25%	0.248	S	C	*	.			trans	-93.6	-14.7	177.2	-67.7	-178.2	174.9	0	0	113.2	A113	A113-E115 PolarHBondContact O-N 2.82Å
116	S	89.7	Confident	94.9	Very high	38 Å²	38	44.6 Å²	44.6	27%	0.266	25%	0.248	S	C	.	.	S	Bend	trans	-137.9	161.2	179	88.3	0	0	0	0	111.7	E118 V119 L120	S116-E118 WeakPolarHBondContact CB-OE2 3.22Å; S116-E118 PolarHBondContact O-N 2.89Å; S116-E118 PolarHBondContact OG-N 3.2Å; S116-E118 PolarHBondContact OG-OE2 2.82Å; S116-V119 PolarHBondContact O-N 3.35Å; S116-V119 VanDerWaalsContact O-N 3.14Å; S116-V119 PolarHBondContact OG-N 3.15Å; S116-L120 PolarHBondContact O-N 3.11Å; S116-L120 VanDerWaalsContact O-N 3.17Å
117	R	87.8	Confident	94.8	Very high	90 Å²	90	41.6 Å²	41.6	34%	0.34	23%	0.23	S	C	.	.	H	α-helix	trans	-59.3	-30.8	175.6	65.5	-175.5	178.6	-168.7	-2.1	112.7	L61 W65 L120 V121	L61-R117 HydrophobicContact CD2-CB 4.43Å; W65-R117 HydrophobicContact CH2-CG 4.4Å; W65-R117 VanDerWaalsContact CZ2-CZ 3.49Å; W65-R117 HydrophobicContact CZ3-CG 4.35Å; R117-L120 WeakPolarHBondContact O-CB 3.31Å; R117-L120 PolarHBondContact O-N 2.88Å; R117-V121 WeakPolarHBondContact O-CG2 3.25Å; R117-V121 PolarHBondContact O-N 2.81Å; R117-V121 VanDerWaalsContact O-N 3.13Å
118	E	91.1	Very high	94.7	Very high	92 Å²	92	41.6 Å²	41.6	43%	0.43	23%	0.23	S	C	.	.	H	α-helix	trans	-69.9	-37.6	177.3	-58.7	73.2	-157.3	0	0	111.5	S116 L120 V121 V122	S116-E118 WeakPolarHBondContact CB-OE2 3.22Å; S116-E118 PolarHBondContact O-N 2.89Å; S116-E118 PolarHBondContact OG-N 3.2Å; S116-E118 PolarHBondContact OG-OE2 2.82Å; E118-L120 VanDerWaalsContact C-N 3.34Å; E118-V121 WeakPolarHBondContact O-CB 3.33Å; E118-V121 PolarHBondContact O-N 2.8Å; E118-V122 PolarHBondContact O-N 3.29Å; E118-V122 VanDerWaalsContact O-N 3.1Å
119	V	94.5	Very high	94.7	Very high	56 Å²	56	41.7 Å²	41.7	34%	0.339	23%	0.231	S	C	.	.	H	α-helix	trans	-68	-36.2	174.9	-177.7	0	0	0	0	111	I110 A114 S116 V121 V122 G123	I110-V119 HydrophobicContact CG2-CG1 3.83Å; A114-V119 HydrophobicContact CB-CB 4.01Å; A114-V119 HydrophobicContact CB-CG1 3.82Å; S116-V119 PolarHBondContact O-N 3.35Å; S116-V119 VanDerWaalsContact O-N 3.14Å; S116-V119 PolarHBondContact OG-N 3.15Å; V119-V121 VanDerWaalsContact C-N 3.32Å; V119-V121 PolarHBondContact O-N 2.97Å; V119-V122 PolarHBondContact O-N 3.32Å; V119-G123 PolarHBondContact O-N 3.36Å
120	L	92.7	Very high	94.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-57.4	-46.2	171.2	-72.3	175.1	0	0	0	111.3	M55 F59 L111 A114 S116 R117 E118 V122 G123 R124 W186 L190	M55-L120 HydrophobicContact SD-CD1 3.89Å; M55-L120 HydrophobicContact SD-CD2 4.34Å; F59-L120 HydrophobicContact CD2-CD1 3.95Å; F59-L120 HydrophobicContact CE2-CD1 3.65Å; F59-L120 HydrophobicContact CZ-CD1 4.19Å; L111-L120 HydrophobicContact CD2-CD2 4Å; L111-L120 WeakPolarHBondContact CD2-O 3.47Å; A114-L120 HydrophobicContact CB-CD2 3.53Å; A114-L120 HydrophobicContact CB-CG 3.77Å; S116-L120 PolarHBondContact O-N 3.11Å; S116-L120 VanDerWaalsContact O-N 3.17Å; R117-L120 WeakPolarHBondContact O-CB 3.31Å; R117-L120 PolarHBondContact O-N 2.88Å; E118-L120 VanDerWaalsContact C-N 3.34Å; L120-V122 VanDerWaalsContact C-N 3.32Å; L120-V122 PolarHBondContact O-N 3.32Å; L120-G123 PolarHBondContact O-N 3.27Å; L120-R124 WeakPolarHBondContact O-CB 3.36Å; L120-R124 WeakPolarHBondContact O-CG 3.43Å; L120-R124 PolarHBondContact O-N 3.48Å; L120-W186 HydrophobicContact CD2-CH2 4.3Å; L120-W186 HydrophobicContact CD2-CZ3 3.77Å; L120-L190 HydrophobicContact CD2-CD1 4.25Å
121	V	94.8	Very high	94.4	Very high	25 Å²	25	35.7 Å²	35.7	15%	0.152	20%	0.197	C	C	.	.	H	α-helix	trans	-58.8	-43.7	177	172.7	0	0	0	0	110.9	I68 V72 R117 E118 V119 G123 R124 I125	I68-V121 HydrophobicContact CG2-CG2 4.29Å; V72-V121 HydrophobicContact CG1-CG1 4.07Å; V72-V121 HydrophobicContact CG2-CG1 4.37Å; R117-V121 WeakPolarHBondContact O-CG2 3.25Å; R117-V121 PolarHBondContact O-N 2.81Å; R117-V121 VanDerWaalsContact O-N 3.13Å; E118-V121 WeakPolarHBondContact O-CB 3.33Å; E118-V121 PolarHBondContact O-N 2.8Å; V119-V121 VanDerWaalsContact C-N 3.32Å; V119-V121 PolarHBondContact O-N 2.97Å; V121-G123 PolarHBondContact O-N 2.95Å; V121-R124 PolarHBondContact O-N 3.09Å; V121-I125 HydrophobicContact CG1-CD1 4.1Å; V121-I125 VanDerWaalsContact O-CG1 3.31Å; V121-I125 WeakPolarHBondContact O-CG1 3.5Å; V121-I125 PolarHBondContact O-N 3.43Å
122	V	96.6	Very high	94.2	Very high	74 Å²	74	35.6 Å²	35.6	45%	0.448	20%	0.196	S	C	.	.	H	α-helix	trans	-60.6	-47.1	176.2	174.7	0	0	0	0	111.6	E118 V119 L120 R124 I125 I126	E118-V122 PolarHBondContact O-N 3.29Å; E118-V122 VanDerWaalsContact O-N 3.1Å; V119-V122 PolarHBondContact O-N 3.32Å; L120-V122 VanDerWaalsContact C-N 3.32Å; L120-V122 PolarHBondContact O-N 3.32Å; V122-R124 VanDerWaalsContact C-N 3.32Å; V122-R124 PolarHBondContact O-N 3.21Å; V122-I125 PolarHBondContact O-N 2.9Å; V122-I126 HydrophobicContact CG1-CD1 4.12Å; V122-I126 WeakPolarHBondContact O-CG1 3.38Å; V122-I126 PolarHBondContact O-N 3.25Å
123	G	96.9	Very high	94.1	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58.3	-44.2	176.1	0	0	0	0	0	112.1	V119 L120 V121 I126 V127	V119-G123 PolarHBondContact O-N 3.36Å; L120-G123 PolarHBondContact O-N 3.27Å; V121-G123 PolarHBondContact O-N 2.95Å; G123-I126 PolarHBondContact O-N 3.4Å; G123-V127 WeakPolarHBondContact O-CG2 3.4Å; G123-V127 PolarHBondContact O-N 3.33Å
124	R	95.9	Very high	93.8	Very high	1 Å²	1	32.1 Å²	32.1	0%	0.004	16%	0.164	C	C	.	.	H	α-helix	trans	-63.5	-38.8	176.6	-74.4	-51.6	-176.3	172	-2	113.5	D44 V48 I69 T73 L111 L120 V121 V122 I126 V127 G128	D44-R124 IonicContact OD1-NH1 3.53Å; D44-R124 PolarHBondContact OD1-NH1 2.87Å; D44-R124 IonicContact OD2-NH1 2.8Å; V48-R124 VanDerWaalsContact CG2-CZ 3.45Å; I69-R124 HydrophobicContact CG2-CG 4.28Å; T73-R124 VanDerWaalsContact OG1-CB 3.32Å; T73-R124 WeakPolarHBondContact OG1-CB 3.43Å; T73-R124 WeakPolarHBondContact OG1-CD 3.38Å; L111-R124 HydrophobicContact CD2-CG 3.95Å; L120-R124 WeakPolarHBondContact O-CB 3.36Å; L120-R124 WeakPolarHBondContact O-CG 3.43Å; L120-R124 PolarHBondContact O-N 3.48Å; V121-R124 PolarHBondContact O-N 3.09Å; V122-R124 VanDerWaalsContact C-N 3.32Å; V122-R124 PolarHBondContact O-N 3.21Å; R124-I126 VanDerWaalsContact C-N 3.33Å; R124-I126 PolarHBondContact O-N 2.83Å; R124-V127 PolarHBondContact O-N 2.98Å; R124-G128 PolarHBondContact O-N 3.4Å
125	I	97.4	Very high	93.5	Very high	73 Å²	73	32.3 Å²	32.3	37%	0.374	17%	0.166	S	C	.	.	H	α-helix	trans	-60.1	-45.2	173.9	-68.9	168	0	0	0	110.6	V72 A76 V121 V122 G128 A129	V72-I125 HydrophobicContact CG1-CB 4.38Å; V72-I125 HydrophobicContact CG1-CD1 3.91Å; V72-I125 HydrophobicContact CG1-CG1 3.14Å; A76-I125 HydrophobicContact CB-CG2 4.36Å; V121-I125 HydrophobicContact CG1-CD1 4.1Å; V121-I125 VanDerWaalsContact O-CG1 3.31Å; V121-I125 WeakPolarHBondContact O-CG1 3.5Å; V121-I125 PolarHBondContact O-N 3.43Å; V122-I125 PolarHBondContact O-N 2.9Å; I125-G128 PolarHBondContact O-N 3.48Å; I125-A129 PolarHBondContact O-N 3.22Å
126	I	97.7	Very high	93.2	Very high	36 Å²	36	24.2 Å²	24.2	19%	0.185	13%	0.128	C	C	.	.	H	α-helix	trans	-66.8	-44.7	-177.7	-66.5	167.5	0	0	0	110.7	L103 V106 I110 V122 G123 R124 G128 A129 A130	L103-I126 HydrophobicContact CB-CG2 4.32Å; L103-I126 HydrophobicContact CD2-CG2 4.17Å; L103-I126 VanDerWaalsContact O-CG2 3.29Å; L103-I126 WeakPolarHBondContact O-CG2 3.37Å; V106-I126 HydrophobicContact CG1-CD1 4.42Å; V106-I126 HydrophobicContact CG1-CG2 4.44Å; I110-I126 HydrophobicContact CD1-CD1 3.43Å; I110-I126 VanDerWaalsContact CD1-CD1 3.43Å; V122-I126 HydrophobicContact CG1-CD1 4.12Å; V122-I126 WeakPolarHBondContact O-CG1 3.38Å; V122-I126 PolarHBondContact O-N 3.25Å; G123-I126 PolarHBondContact O-N 3.4Å; R124-I126 VanDerWaalsContact C-N 3.33Å; R124-I126 PolarHBondContact O-N 2.83Å; I126-G128 VanDerWaalsContact C-N 3.34Å; I126-A129 WeakPolarHBondContact O-CB 3.44Å; I126-A129 PolarHBondContact O-N 3.49Å; I126-A130 PolarHBondContact O-N 3.5Å; I126-A130 VanDerWaalsContact O-N 3.12Å
127	V	96.5	Very high	93	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.006	12%	0.116	C	C	.	.	H	α-helix	trans	-62	-43.4	173.7	174	0	0	0	0	110.9	D44 T73 F104 L111 G123 R124 A129 A130 I131	D44-V127 HydrophobicContact CB-CG1 4.33Å; T73-V127 HydrophobicContact CG2-CG1 4.48Å; F104-V127 HydrophobicContact CD1-CG1 4.01Å; F104-V127 HydrophobicContact CE1-CG1 3.86Å; L111-V127 HydrophobicContact CD1-CG2 3.97Å; G123-V127 WeakPolarHBondContact O-CG2 3.4Å; G123-V127 PolarHBondContact O-N 3.33Å; R124-V127 PolarHBondContact O-N 2.98Å; V127-A129 VanDerWaalsContact C-N 3.32Å; V127-A129 PolarHBondContact O-N 3.33Å; V127-A130 WeakPolarHBondContact O-CA 3.3Å; V127-A130 VanDerWaalsContact O-CB 3.27Å; V127-A130 WeakPolarHBondContact O-CB 3.41Å; V127-A130 PolarHBondContact O-N 3.45Å; V127-I131 HydrophobicContact CG1-CD1 3.92Å; V127-I131 HydrophobicContact CG1-CG1 4.37Å; V127-I131 WeakPolarHBondContact O-CG1 3.35Å; V127-I131 PolarHBondContact O-N 3.24Å
128	G	96	Very high	93	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-59.2	-40.9	176.1	0	0	0	0	0	112.9	T73 A77 R124 I125 I126 A130 I131 G132	T73-G128 WeakPolarHBondContact O-CA 3.47Å; A77-G128 WeakPolarHBondContact CA-O 3.46Å; A77-G128 WeakPolarHBondContact CB-O 3.26Å; A77-G128 PolarHBondContact N-O 3Å; R124-G128 PolarHBondContact O-N 3.4Å; I125-G128 PolarHBondContact O-N 3.48Å; I126-G128 VanDerWaalsContact C-N 3.34Å; G128-A130 VanDerWaalsContact C-N 3.32Å; G128-A130 PolarHBondContact O-N 2.92Å; G128-I131 PolarHBondContact O-N 3.35Å; G128-G132 PolarHBondContact O-N 2.88Å
129	A	95.9	Very high	92.4	Very high	6 Å²	6	14.1 Å²	14.1	5%	0.05	8%	0.082	C	C	.	.	H	α-helix	trans	-60.2	-42.5	172.7	0	0	0	0	0	112	F80 L103 I125 I126 V127 G132 I133	F80-A129 HydrophobicContact CD1-CB 4.13Å; F80-A129 HydrophobicContact CD2-CB 3.4Å; F80-A129 HydrophobicContact CE1-CB 4.15Å; F80-A129 HydrophobicContact CE2-CB 3.43Å; F80-A129 VanDerWaalsContact CE2-CB 3.43Å; F80-A129 HydrophobicContact CG-CB 3.77Å; F80-A129 HydrophobicContact CZ-CB 3.81Å; L103-A129 HydrophobicContact CD1-CB 4.41Å; I125-A129 PolarHBondContact O-N 3.22Å; I126-A129 WeakPolarHBondContact O-CB 3.44Å; I126-A129 PolarHBondContact O-N 3.49Å; V127-A129 VanDerWaalsContact C-N 3.32Å; V127-A129 PolarHBondContact O-N 3.33Å; A129-G132 PolarHBondContact O-N 3Å; A129-I133 WeakPolarHBondContact O-CG1 3.37Å; A129-I133 PolarHBondContact O-N 3.1Å; A129-I133 VanDerWaalsContact O-N 3.14Å
130	A	95.4	Very high	91.7	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-61.5	-45.2	175.4	0	0	0	0	0	112	L103 F104 I126 V127 G128 S134	L103-A130 HydrophobicContact CB-CB 3.67Å; F104-A130 HydrophobicContact CB-CB 4.45Å; F104-A130 HydrophobicContact CD1-CB 3.92Å; F104-A130 HydrophobicContact CD2-CB 3.53Å; F104-A130 HydrophobicContact CE1-CB 3.99Å; F104-A130 HydrophobicContact CE2-CB 3.6Å; F104-A130 HydrophobicContact CG-CB 3.68Å; F104-A130 HydrophobicContact CZ-CB 3.84Å; I126-A130 PolarHBondContact O-N 3.5Å; I126-A130 VanDerWaalsContact O-N 3.12Å; V127-A130 WeakPolarHBondContact O-CA 3.3Å; V127-A130 VanDerWaalsContact O-CB 3.27Å; V127-A130 WeakPolarHBondContact O-CB 3.41Å; V127-A130 PolarHBondContact O-N 3.45Å; G128-A130 VanDerWaalsContact C-N 3.32Å; G128-A130 PolarHBondContact O-N 2.92Å; A130-S134 WeakPolarHBondContact O-CB 3.46Å; A130-S134 PolarHBondContact O-N 2.96Å; A130-S134 PolarHBondContact O-OG 3.35Å
131	I	94.1	Very high	91.4	Very high	4 Å²	4	11.9 Å²	11.9	2%	0.021	7%	0.069	C	C	.	.	H	α-helix	trans	-60.7	-48.5	176.4	-67.1	169	0	0	0	110.8	F41 D44 T73 A77 F104 V127 G128 I133 S134 S135 W529	F41-I131 HydrophobicContact CD2-CD1 4.16Å; F41-I131 HydrophobicContact CD2-CG1 4.25Å; F41-I131 HydrophobicContact CD2-CG2 3.9Å; F41-I131 HydrophobicContact CE2-CG2 4.22Å; D44-I131 WeakPolarHBondContact OD2-CD1 3.4Å; T73-I131 HydrophobicContact CG2-CD1 4.01Å; A77-I131 HydrophobicContact CB-CB 4.21Å; A77-I131 HydrophobicContact CB-CG2 3.96Å; F104-I131 HydrophobicContact CE1-CD1 4.42Å; F104-I131 HydrophobicContact CE1-CG1 3.69Å; F104-I131 HydrophobicContact CZ-CB 4.46Å; F104-I131 HydrophobicContact CZ-CG1 3.58Å; V127-I131 HydrophobicContact CG1-CD1 3.92Å; V127-I131 HydrophobicContact CG1-CG1 4.37Å; V127-I131 WeakPolarHBondContact O-CG1 3.35Å; V127-I131 PolarHBondContact O-N 3.24Å; G128-I131 PolarHBondContact O-N 3.35Å; I131-I133 PolarHBondContact O-N 2.99Å; I131-S134 WeakPolarHBondContact CA-OG 3.37Å; I131-S134 PolarHBondContact O-N 3.48Å; I131-S134 PolarHBondContact O-OG 3.5Å; I131-S134 VanDerWaalsContact O-OG 3.06Å; I131-S135 WeakPolarHBondContact O-CB 3.48Å; I131-S135 PolarHBondContact O-N 3.17Å; I131-S135 PolarHBondContact O-OG 3.3Å; I131-W529 HydrophobicContact CG2-CH2 3.57Å; I131-W529 HydrophobicContact CG2-CZ2 3.4Å; I131-W529 VanDerWaalsContact CG2-CZ2 3.4Å; I131-W529 HydrophobicContact CG2-CZ3 4.35Å
132	G	92.8	Very high	90.8	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-60.3	-49.2	-177.1	0	0	0	0	0	113.1	A77 A81 G128 A129	A77-G132 WeakPolarHBondContact O-CA 3.18Å; A81-G132 WeakPolarHBondContact CA-O 3.11Å; G128-G132 PolarHBondContact O-N 2.88Å; A129-G132 PolarHBondContact O-N 3Å
133	I	91.4	Very high	89.9	Confident	4 Å²	4	7.5 Å²	7.5	2%	0.021	4%	0.042	C	C	.	.	H	α-helix	trans	-61.9	-55.5	177.9	-66.4	175.9	0	0	0	110	F80 I96 L99 L103 A129 I131 S135 S136 T137	F80-I133 HydrophobicContact CB-CG1 4.04Å; F80-I133 HydrophobicContact CD1-CD1 4Å; F80-I133 HydrophobicContact CD1-CG1 4.13Å; F80-I133 HydrophobicContact CG-CG1 4.49Å; I96-I133 HydrophobicContact CG2-CG2 3.1Å; L99-I133 HydrophobicContact CD2-CD1 4.49Å; L103-I133 HydrophobicContact CD1-CD1 4.21Å; A129-I133 WeakPolarHBondContact O-CG1 3.37Å; A129-I133 PolarHBondContact O-N 3.1Å; A129-I133 VanDerWaalsContact O-N 3.14Å; I131-I133 PolarHBondContact O-N 2.99Å; I133-S135 VanDerWaalsContact C-N 3.34Å; I133-S135 PolarHBondContact O-N 3.19Å; I133-S136 PolarHBondContact O-N 3.27Å; I133-S136 PolarHBondContact O-OG 2.95Å; I133-T137 PolarHBondContact O-N 3.35Å; I133-T137 PolarHBondContact O-OG1 3.05Å
134	S	89.7	Confident	89.2	Confident	3 Å²	3	8.4 Å²	8.4	2%	0.021	5%	0.047	C	C	.	.	H	α-helix	trans	-60.5	-40.6	-174.2	62.9	0	0	0	0	112.6	A130 I131 S136 T137 I138	A130-S134 WeakPolarHBondContact O-CB 3.46Å; A130-S134 PolarHBondContact O-N 2.96Å; A130-S134 PolarHBondContact O-OG 3.35Å; I131-S134 WeakPolarHBondContact CA-OG 3.37Å; I131-S134 PolarHBondContact O-N 3.48Å; I131-S134 PolarHBondContact O-OG 3.5Å; I131-S134 VanDerWaalsContact O-OG 3.06Å; S134-S136 PolarHBondContact O-N 3.34Å; S134-T137 PolarHBondContact O-N 3.18Å; S134-T137 VanDerWaalsContact O-N 3.08Å; S134-I138 VanDerWaalsContact O-CD1 3.27Å; S134-I138 WeakPolarHBondContact O-CD1 3.32Å; S134-I138 VanDerWaalsContact O-CG1 3.3Å; S134-I138 WeakPolarHBondContact O-CG1 3.5Å; S134-I138 PolarHBondContact O-N 3.45Å
135	S	86.5	Confident	88.5	Confident	5 Å²	5	8.4 Å²	8.4	4%	0.035	5%	0.047	C	C	.	.	H	α-helix	trans	-60.6	-29.9	-179.4	-61.8	0	0	0	0	113.9	I131 I133 P139 W529	I131-S135 WeakPolarHBondContact O-CB 3.48Å; I131-S135 PolarHBondContact O-N 3.17Å; I131-S135 PolarHBondContact O-OG 3.3Å; I133-S135 VanDerWaalsContact C-N 3.34Å; I133-S135 PolarHBondContact O-N 3.19Å; S135-P139 VanDerWaalsContact O-CD 3.26Å; S135-P139 WeakPolarHBondContact O-CD 3.43Å; S135-P139 WeakPolarHBondContact O-CG 3.35Å; S135-W529 WeakPolarHBondContact OG-CZ2 3.42Å
136	S	83.1	Confident	87.6	Confident	1 Å²	1	5.1 Å²	5.1	1%	0.007	3%	0.031	C	C	.	.	H	α-helix	trans	-84.7	-33.7	175.6	73.7	0	0	0	0	112.4	G84 I133 S134	G84-S136 WeakPolarHBondContact CA-OG 3.46Å; I133-S136 PolarHBondContact O-N 3.27Å; I133-S136 PolarHBondContact O-OG 2.95Å; S134-S136 PolarHBondContact O-N 3.34Å
137	T	87.1	Confident	86.5	Confident	0 Å²	0	3.5 Å²	3.5	0%	0	2%	0.022	C	C	.	.	H	α-helix	trans	-84.8	-39.3	-171.2	-54	0	0	0	0	113	N88 R93 I96 I97 I133 S134 A140 Y141	N88-T137 VanDerWaalsContact CG-OG1 3.3Å; N88-T137 PolarHBondContact ND2-OG1 3.06Å; N88-T137 VanDerWaalsContact ND2-OG1 3.15Å; N88-T137 WeakPolarHBondContact OD1-CB 3.31Å; N88-T137 WeakPolarHBondContact OD1-CG2 3.41Å; N88-T137 PolarHBondContact OD1-OG1 3.1Å; R93-T137 HydrophobicContact CB-CG2 3.9Å; R93-T137 HydrophobicContact CG-CG2 4.12Å; I96-T137 HydrophobicContact CB-CG2 4.35Å; I96-T137 HydrophobicContact CG2-CG2 4.17Å; I96-T137 WeakPolarHBondContact CG2-OG1 3.4Å; I97-T137 HydrophobicContact CD1-CG2 4.02Å; I97-T137 HydrophobicContact CG1-CG2 3.71Å; I133-T137 PolarHBondContact O-N 3.35Å; I133-T137 PolarHBondContact O-OG1 3.05Å; S134-T137 PolarHBondContact O-N 3.18Å; S134-T137 VanDerWaalsContact O-N 3.08Å; T137-A140 PolarHBondContact O-N 3.07Å; T137-Y141 WeakPolarHBondContact O-CB 3.39Å; T137-Y141 PolarHBondContact O-N 2.69Å
138	I	86.1	Confident	85.1	Confident	1 Å²	1	5.9 Å²	5.9	1%	0.005	4%	0.038	C	C	.	.	H	α-helix	trans	-69.8	-48.5	-171.5	-64.6	152.8	0	0	0	112.6	A34 S37 I97 S134 A140 Y141 I142 F158	A34-I138 WeakPolarHBondContact O-CG2 3.42Å; S37-I138 WeakPolarHBondContact OG-CD1 3.46Å; I97-I138 HydrophobicContact CD1-CG1 4.36Å; I97-I138 HydrophobicContact CG1-CG1 4.32Å; S134-I138 VanDerWaalsContact O-CD1 3.27Å; S134-I138 WeakPolarHBondContact O-CD1 3.32Å; S134-I138 VanDerWaalsContact O-CG1 3.3Å; S134-I138 WeakPolarHBondContact O-CG1 3.5Å; S134-I138 PolarHBondContact O-N 3.45Å; I138-A140 PolarHBondContact O-N 3.13Å; I138-Y141 PolarHBondContact O-N 2.8Å; I138-Y141 VanDerWaalsContact O-N 3.14Å; I138-I142 HydrophobicContact CG2-CD1 3.68Å; I138-I142 HydrophobicContact CG2-CG1 4.2Å; I138-I142 WeakPolarHBondContact O-CG1 3.36Å; I138-I142 PolarHBondContact O-N 3.03Å; I138-F158 HydrophobicContact CB-CE2 4.32Å; I138-F158 HydrophobicContact CD1-CE2 3.97Å; I138-F158 HydrophobicContact CD1-CZ 4.34Å; I138-F158 HydrophobicContact CG2-CD2 3.81Å; I138-F158 HydrophobicContact CG2-CE2 3.75Å; I138-F158 HydrophobicContact CG2-CZ 4.48Å
139	P	79.5	Confident	83.8	Confident	7 Å²	7	10.4 Å²	10.4	5%	0.045	6%	0.059	C	C	.	.	H	α-helix	trans	-59	-36.2	176.2	-23.8	35.4	0	0	0	111.7	S135 A143	S135-P139 VanDerWaalsContact O-CD 3.26Å; S135-P139 WeakPolarHBondContact O-CD 3.43Å; S135-P139 WeakPolarHBondContact O-CG 3.35Å; P139-A143 WeakPolarHBondContact O-CB 3.24Å; P139-A143 PolarHBondContact O-N 3.45Å
140	A	80.6	Confident	82.6	Confident	9 Å²	9	10.7 Å²	10.7	7%	0.074	6%	0.059	C	C	.	.	H	α-helix	trans	-66.5	-46.8	175	0	0	0	0	0	111.8	T137 I138 A143 E144	T137-A140 PolarHBondContact O-N 3.07Å; I138-A140 PolarHBondContact O-N 3.13Å; A140-A143 PolarHBondContact O-N 2.94Å; A140-E144 WeakPolarHBondContact O-CB 3.09Å; A140-E144 WeakPolarHBondContact O-CG 3.3Å; A140-E144 PolarHBondContact O-N 3.01Å
141	Y	85.3	Confident	81.5	Confident	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-57.8	-52.1	176	-178.9	-100.1	0	0	0	110.8	L30 A34 R93 I97 T137 I138 A143 E144 T145 F204 P208	L30-Y141 HydrophobicContact CD2-CE1 3.93Å; L30-Y141 HydrophobicContact CG-CE1 4.18Å; A34-Y141 HydrophobicContact CB-CD1 3.78Å; A34-Y141 HydrophobicContact CB-CE1 3.87Å; R93-Y141 HydrophobicContact CB-CD2 3.74Å; R93-Y141 HydrophobicContact CB-CG 4.41Å; R93-Y141 HydrophobicContact CG-CD2 4.47Å; I97-Y141 HydrophobicContact CD1-CD1 4.31Å; I97-Y141 HydrophobicContact CD1-CD2 4.41Å; I97-Y141 HydrophobicContact CD1-CG 4Å; T137-Y141 WeakPolarHBondContact O-CB 3.39Å; T137-Y141 PolarHBondContact O-N 2.69Å; I138-Y141 PolarHBondContact O-N 2.8Å; I138-Y141 VanDerWaalsContact O-N 3.14Å; Y141-A143 VanDerWaalsContact C-N 3.31Å; Y141-A143 PolarHBondContact O-N 2.9Å; Y141-E144 PolarHBondContact O-N 3.14Å; Y141-E144 VanDerWaalsContact O-N 3.13Å; Y141-T145 HydrophobicContact CD1-CG2 4.48Å; Y141-T145 HydrophobicContact CD2-CG2 4.09Å; Y141-T145 HydrophobicContact CE1-CG2 4.19Å; Y141-T145 HydrophobicContact CE2-CG2 3.78Å; Y141-T145 HydrophobicContact CG-CG2 4.44Å; Y141-T145 WeakPolarHBondContact O-CB 3.48Å; Y141-T145 WeakPolarHBondContact O-CG2 3.43Å; Y141-T145 PolarHBondContact O-N 3.36Å; Y141-T145 PolarHBondContact O-OG1 2.65Å; Y141-F204 HydrophobicContact CD1-CE2 4.49Å; Y141-F204 HydrophobicContact CD1-CZ 4.22Å; Y141-F204 HydrophobicContact CE1-CE2 4.05Å; Y141-F204 AromaticContact CE1-CZ 3.81Å; Y141-F204 HydrophobicContact CE1-CZ 3.81Å; Y141-F204 HydrophobicContact CE2-CZ 4.19Å; Y141-F204 AromaticContact CZ-CZ 3.79Å; Y141-P208 PolarHBondContact OH-O 3.26Å; Y141-P208 VanDerWaalsContact OH-O 3.07Å
142	I	82.2	Confident	80.3	Confident	2 Å²	2	11.6 Å²	11.6	1%	0.01	6%	0.064	C	C	.	.	H	α-helix	trans	-57.2	-44.1	177.1	-66.8	172.3	0	0	0	110.9	A34 V35 I138 E144 S146 M154 I155 F158	A34-I142 HydrophobicContact CB-CD1 4.4Å; A34-I142 HydrophobicContact CB-CG1 3.92Å; V35-I142 HydrophobicContact CG2-CD1 3.73Å; I138-I142 HydrophobicContact CG2-CD1 3.68Å; I138-I142 HydrophobicContact CG2-CG1 4.2Å; I138-I142 WeakPolarHBondContact O-CG1 3.36Å; I138-I142 PolarHBondContact O-N 3.03Å; I142-E144 VanDerWaalsContact C-N 3.32Å; I142-E144 PolarHBondContact O-N 2.81Å; I142-S146 WeakPolarHBondContact O-CB 2.94Å; I142-S146 PolarHBondContact O-N 3.18Å; I142-S146 PolarHBondContact O-OG 3.29Å; I142-M154 HydrophobicContact CG2-CB 3.43Å; I142-M154 VanDerWaalsContact CG2-CB 3.43Å; I142-I155 HydrophobicContact CG2-CG1 3.97Å; I142-F158 HydrophobicContact CD1-CB 4.28Å
143	A	78.5	Confident	79.2	Confident	4 Å²	4	17.4 Å²	17.4	3%	0.033	9%	0.086	C	C	.	.	H	α-helix	trans	-65.1	-34.6	179.7	0	0	0	0	0	113.3	P139 A140 Y141 R151	P139-A143 WeakPolarHBondContact O-CB 3.24Å; P139-A143 PolarHBondContact O-N 3.45Å; A140-A143 PolarHBondContact O-N 2.94Å; Y141-A143 VanDerWaalsContact C-N 3.31Å; Y141-A143 PolarHBondContact O-N 2.9Å; A143-R151 HydrophobicContact CB-CG 4.36Å; A143-R151 PolarHBondContact O-NE 3.36Å
144	E	81	Confident	78.4	Confident	19 Å²	19	18.3 Å²	18.3	9%	0.089	9%	0.09	C	C	.	.	H	α-helix	trans	-84.9	-21.8	-177.9	-66.7	172.2	-176.4	0	0	113.3	R93 A140 Y141 I142 S210 P211 R212	R93-E144 IonicContact CZ-OE1 3.43Å; R93-E144 IonicContact CZ-OE2 3.59Å; R93-E144 IonicContact NE-OE1 2.67Å; R93-E144 IonicContact NE-OE2 2.59Å; R93-E144 PolarHBondContact NE-OE2 2.67Å; R93-E144 IonicContact NH2-OE1 3.73Å; R93-E144 PolarHBondContact NH2-OE1 3.03Å; R93-E144 IonicContact NH2-OE2 2.62Å; R93-E144 PolarHBondContact NH2-OE2 3.07Å; A140-E144 WeakPolarHBondContact O-CB 3.09Å; A140-E144 WeakPolarHBondContact O-CG 3.3Å; A140-E144 PolarHBondContact O-N 3.01Å; Y141-E144 PolarHBondContact O-N 3.14Å; Y141-E144 VanDerWaalsContact O-N 3.13Å; I142-E144 VanDerWaalsContact C-N 3.32Å; I142-E144 PolarHBondContact O-N 2.81Å; E144-S210 VanDerWaalsContact CB-OG 3.31Å; E144-S210 WeakPolarHBondContact CB-OG 3.09Å; E144-S210 WeakPolarHBondContact OE2-CB 3.2Å; E144-S210 PolarHBondContact OE2-OG 3.11Å; E144-P211 WeakPolarHBondContact O-CG 3.11Å; E144-R212 HydrophobicContact CB-CB 4.26Å; E144-R212 HydrophobicContact CB-CG 4.33Å; E144-R212 HydrophobicContact CG-CB 4.17Å; E144-R212 HydrophobicContact CG-CG 4.45Å
145	T	82.5	Confident	77.8	Confident	1 Å²	1	18.5 Å²	18.5	1%	0.006	9%	0.091	C	C	.	.	H	α-helix	trans	-105.7	-0.2	178.6	61.2	0	0	0	0	114.1	L30 Y141 I230	L30-T145 HydrophobicContact CD1-CG2 4.3Å; L30-T145 HydrophobicContact CD2-CG2 4.33Å; L30-T145 WeakPolarHBondContact CD2-OG1 3.46Å; Y141-T145 HydrophobicContact CD1-CG2 4.48Å; Y141-T145 HydrophobicContact CD2-CG2 4.09Å; Y141-T145 HydrophobicContact CE1-CG2 4.19Å; Y141-T145 HydrophobicContact CE2-CG2 3.78Å; Y141-T145 HydrophobicContact CG-CG2 4.44Å; Y141-T145 WeakPolarHBondContact O-CB 3.48Å; Y141-T145 WeakPolarHBondContact O-CG2 3.43Å; Y141-T145 PolarHBondContact O-N 3.36Å; Y141-T145 PolarHBondContact O-OG1 2.65Å; T145-I230 WeakPolarHBondContact O-CD1 3.34Å
146	S	78.4	Confident	77.3	Confident	5 Å²	5	18.7 Å²	18.7	4%	0.035	9%	0.092	C	C	.	.	S	Bend	trans	-109.3	138.7	179.5	-57.4	0	0	0	0	112	I142	I142-S146 WeakPolarHBondContact O-CB 2.94Å; I142-S146 PolarHBondContact O-N 3.18Å; I142-S146 PolarHBondContact O-OG 3.29Å
147	P	73.4	Confident	77.2	Confident	2 Å²	2	21.5 Å²	21.5	1%	0.013	11%	0.106	C	C	.	.			trans	-55.6	145.8	169.5	-22.8	31.1	0	0	0	112.3	H149 I150 R151 I230 Y231	P147-H149 VanDerWaalsContact C-N 3.26Å; P147-H149 WeakPolarHBondContact CB-CE1 3.38Å; P147-H149 PolarHBondContact O-N 3.47Å; P147-H149 VanDerWaalsContact O-N 3.13Å; P147-I150 HydrophobicContact CB-CD1 4.4Å; P147-I150 HydrophobicContact CB-CG1 4.15Å; P147-I150 HydrophobicContact CG-CD1 3.89Å; P147-I150 HydrophobicContact CG-CG1 4.12Å; P147-I150 PolarHBondContact O-N 3.39Å; P147-R151 WeakPolarHBondContact O-CB 3.44Å; P147-R151 PolarHBondContact O-N 2.93Å; P147-I230 HydrophobicContact CG-CG2 3.76Å; P147-Y231 HydrophobicContact CB-CE1 4.11Å; P147-Y231 HydrophobicContact CG-CE1 4.36Å
148	P	68.7	Low	77.1	Confident	50 Å²	50	22.4 Å²	22.4	33%	0.325	11%	0.11	S	C	.	.	H	α-helix	trans	-53.6	-37.4	-177.6	-26.6	32.9	0	0	0	114.7	I150	P148-I150 PolarHBondContact O-N 3.32Å
149	H	67	Low	77.2	Confident	96 Å²	96	23.3 Å²	23.3	44%	0.444	11%	0.114	S	C	.	.	H	α-helix	trans	-75.3	-20.4	-175.3	65.1	-83.8	0	0	0	114.5	P147	P147-H149 VanDerWaalsContact C-N 3.26Å; P147-H149 WeakPolarHBondContact CB-CE1 3.38Å; P147-H149 PolarHBondContact O-N 3.47Å; P147-H149 VanDerWaalsContact O-N 3.13Å
150	I	70.8	Confident	77.7	Confident	12 Å²	12	23.8 Å²	23.8	6%	0.062	12%	0.116	C	C	.	.	H	α-helix	trans	-112.6	-5.8	174.7	65	-171	0	0	0	113.4	V27 P147 P148 G152 R153 M154	V27-I150 HydrophobicContact CG1-CD1 4.41Å; P147-I150 HydrophobicContact CB-CD1 4.4Å; P147-I150 HydrophobicContact CB-CG1 4.15Å; P147-I150 HydrophobicContact CG-CD1 3.89Å; P147-I150 HydrophobicContact CG-CG1 4.12Å; P147-I150 PolarHBondContact O-N 3.39Å; P148-I150 PolarHBondContact O-N 3.32Å; I150-G152 VanDerWaalsContact C-N 3.34Å; I150-G152 PolarHBondContact O-N 2.85Å; I150-R153 WeakPolarHBondContact O-CA 3.41Å; I150-R153 WeakPolarHBondContact O-CB 3.36Å; I150-R153 PolarHBondContact O-N 3.34Å; I150-M154 HydrophobicContact CD1-CE 3.72Å; I150-M154 HydrophobicContact CG1-CE 4.16Å; I150-M154 HydrophobicContact CG1-CG 4.4Å; I150-M154 WeakPolarHBondContact O-CG 3.36Å; I150-M154 PolarHBondContact O-N 3.22Å
151	R	74.2	Confident	78.2	Confident	17 Å²	17	24.7 Å²	24.7	6%	0.064	12%	0.119	C	C	.	.	H	α-helix	trans	-51	-49.6	-176.2	-174.4	-176.1	-63.9	134.5	2	113	A143 P147 R153 M154 I155	A143-R151 HydrophobicContact CB-CG 4.36Å; A143-R151 PolarHBondContact O-NE 3.36Å; P147-R151 WeakPolarHBondContact O-CB 3.44Å; P147-R151 PolarHBondContact O-N 2.93Å; R151-R153 VanDerWaalsContact C-N 3.3Å; R151-R153 PolarHBondContact O-N 3.03Å; R151-M154 PolarHBondContact O-N 3.24Å; R151-M154 VanDerWaalsContact O-N 3.14Å; R151-I155 HydrophobicContact CG-CD1 4.11Å; R151-I155 WeakPolarHBondContact O-CG1 3.4Å; R151-I155 PolarHBondContact O-N 3.08Å
152	G	67.8	Low	78.6	Confident	5 Å²	5	25.2 Å²	25.2	5%	0.052	12%	0.122	C	C	.	.	H	α-helix	trans	-59.4	-41	178.6	0	0	0	0	0	112.4	I150 M154 I155 V156	I150-G152 VanDerWaalsContact C-N 3.34Å; I150-G152 PolarHBondContact O-N 2.85Å; G152-M154 VanDerWaalsContact C-N 3.34Å; G152-M154 PolarHBondContact O-N 2.82Å; G152-I155 PolarHBondContact O-N 3.14Å; G152-V156 WeakPolarHBondContact O-CB 3.48Å; G152-V156 VanDerWaalsContact O-CG2 3.26Å; G152-V156 WeakPolarHBondContact O-CG2 3.11Å; G152-V156 PolarHBondContact O-N 3.15Å
153	R	70.6	Confident	79.2	Confident	123 Å²	123	25.1 Å²	25.1	46%	0.464	12%	0.122	S	C	.	.	H	α-helix	trans	-63.3	-39.9	175.8	-65.5	176.2	62.3	-178.1	-0.7	111.8	I150 R151 V156 M157 E341	I150-R153 WeakPolarHBondContact O-CA 3.41Å; I150-R153 WeakPolarHBondContact O-CB 3.36Å; I150-R153 PolarHBondContact O-N 3.34Å; R151-R153 VanDerWaalsContact C-N 3.3Å; R151-R153 PolarHBondContact O-N 3.03Å; R153-V156 PolarHBondContact O-N 3.37Å; R153-M157 WeakPolarHBondContact O-CG 3.39Å; R153-M157 PolarHBondContact O-N 3.25Å; R153-E341 HydrophobicContact CG-CG 3.69Å
154	M	74.4	Confident	80	Confident	22 Å²	22	28.4 Å²	28.4	11%	0.108	14%	0.135	C	C	.	.	H	α-helix	trans	-68.3	-38.7	178.8	-59.8	-43.4	-167	0	0	112.4	V27 T31 I142 I150 R151 G152 V156 M157 F158	V27-M154 HydrophobicContact CG1-CE 4.34Å; T31-M154 HydrophobicContact CG2-CB 4.42Å; T31-M154 HydrophobicContact CG2-CE 4.02Å; T31-M154 HydrophobicContact CG2-CG 4.21Å; T31-M154 HydrophobicContact CG2-SD 3.27Å; T31-M154 WeakPolarHBondContact CG2-SD 3.35Å; T31-M154 WeakPolarHBondContact OG1-CE 3.4Å; I142-M154 HydrophobicContact CG2-CB 3.43Å; I142-M154 VanDerWaalsContact CG2-CB 3.43Å; I150-M154 HydrophobicContact CD1-CE 3.72Å; I150-M154 HydrophobicContact CG1-CE 4.16Å; I150-M154 HydrophobicContact CG1-CG 4.4Å; I150-M154 WeakPolarHBondContact O-CG 3.36Å; I150-M154 PolarHBondContact O-N 3.22Å; R151-M154 PolarHBondContact O-N 3.24Å; R151-M154 VanDerWaalsContact O-N 3.14Å; G152-M154 VanDerWaalsContact C-N 3.34Å; G152-M154 PolarHBondContact O-N 2.82Å; M154-V156 VanDerWaalsContact C-N 3.34Å; M154-M157 WeakPolarHBondContact O-CB 3.18Å; M154-M157 PolarHBondContact O-N 2.93Å; M154-F158 PolarHBondContact O-N 3.13Å
155	I	76	Confident	80.7	Confident	7 Å²	7	27.5 Å²	27.5	4%	0.036	13%	0.131	C	C	.	.	H	α-helix	trans	-66.7	-38.7	174.1	-63.6	170.2	0	0	0	110.5	I142 R151 G152 M157 F158 A509	I142-I155 HydrophobicContact CG2-CG1 3.97Å; R151-I155 HydrophobicContact CG-CD1 4.11Å; R151-I155 WeakPolarHBondContact O-CG1 3.4Å; R151-I155 PolarHBondContact O-N 3.08Å; G152-I155 PolarHBondContact O-N 3.14Å; I155-M157 VanDerWaalsContact C-N 3.33Å; I155-M157 PolarHBondContact O-N 2.93Å; I155-F158 VanDerWaalsContact O-CB 3.25Å; I155-F158 WeakPolarHBondContact O-CB 3.48Å; I155-F158 PolarHBondContact O-N 3.44Å; I155-A509 HydrophobicContact CD1-CB 3.96Å
156	V	76.4	Confident	81.4	Confident	9 Å²	9	27.7 Å²	27.7	6%	0.055	13%	0.132	C	C	.	.	H	α-helix	trans	-70	-29.9	176.6	174.3	0	0	0	0	112.2	G152 R153 M154 F158 Q159 L160 I337 V340	G152-V156 WeakPolarHBondContact O-CB 3.48Å; G152-V156 VanDerWaalsContact O-CG2 3.26Å; G152-V156 WeakPolarHBondContact O-CG2 3.11Å; G152-V156 PolarHBondContact O-N 3.15Å; R153-V156 PolarHBondContact O-N 3.37Å; M154-V156 VanDerWaalsContact C-N 3.34Å; V156-F158 PolarHBondContact O-N 3.05Å; V156-Q159 WeakPolarHBondContact O-CB 3.22Å; V156-Q159 PolarHBondContact O-N 3.33Å; V156-Q159 VanDerWaalsContact O-N 3.09Å; V156-L160 PolarHBondContact O-N 3.04Å; V156-L160 VanDerWaalsContact O-N 3.08Å; V156-I337 HydrophobicContact CG1-CB 4.01Å; V156-I337 HydrophobicContact CG1-CD1 4.1Å; V156-I337 HydrophobicContact CG1-CG1 3.58Å; V156-I337 HydrophobicContact CG1-CG2 4.1Å; V156-V340 HydrophobicContact CG2-CG1 4.29Å
157	M	80.4	Confident	82.3	Confident	61 Å²	61	30.3 Å²	30.3	30%	0.3	14%	0.141	S	C	.	.	H	α-helix	trans	-61.2	-32.8	171.1	-75	-66.5	167.2	0	0	112	V35 R153 M154 I155 Q159 L160 L161 I337	V35-M157 VanDerWaalsContact CG1-C 3.45Å; V35-M157 HydrophobicContact CG1-CB 4.12Å; V35-M157 WeakPolarHBondContact CG1-O 3.37Å; V35-M157 HydrophobicContact CG2-CB 4.3Å; R153-M157 WeakPolarHBondContact O-CG 3.39Å; R153-M157 PolarHBondContact O-N 3.25Å; M154-M157 WeakPolarHBondContact O-CB 3.18Å; M154-M157 PolarHBondContact O-N 2.93Å; I155-M157 VanDerWaalsContact C-N 3.33Å; I155-M157 PolarHBondContact O-N 2.93Å; M157-Q159 VanDerWaalsContact C-N 3.3Å; M157-Q159 PolarHBondContact O-N 2.91Å; M157-L160 WeakPolarHBondContact O-CB 3.34Å; M157-L160 PolarHBondContact O-N 3.06Å; M157-L160 VanDerWaalsContact O-N 3.12Å; M157-L160 HydrophobicContact SD-CD2 3.69Å; M157-L161 PolarHBondContact O-N 2.9Å; M157-I337 HydrophobicContact CE-CD1 3.93Å; M157-I337 HydrophobicContact CE-CG2 4.42Å; M157-I337 HydrophobicContact SD-CD1 4.05Å
158	F	85.1	Confident	83.4	Confident	18 Å²	18	31.7 Å²	31.7	8%	0.079	15%	0.149	C	C	.	.	H	α-helix	trans	-58.8	-44.2	172.6	179.7	-106.5	0	0	0	111.2	V35 I138 I142 M154 I155 V156 L160 L161 I162	V35-F158 HydrophobicContact CG2-CB 4.44Å; I138-F158 HydrophobicContact CB-CE2 4.32Å; I138-F158 HydrophobicContact CD1-CE2 3.97Å; I138-F158 HydrophobicContact CD1-CZ 4.34Å; I138-F158 HydrophobicContact CG2-CD2 3.81Å; I138-F158 HydrophobicContact CG2-CE2 3.75Å; I138-F158 HydrophobicContact CG2-CZ 4.48Å; I142-F158 HydrophobicContact CD1-CB 4.28Å; M154-F158 PolarHBondContact O-N 3.13Å; I155-F158 VanDerWaalsContact O-CB 3.25Å; I155-F158 WeakPolarHBondContact O-CB 3.48Å; I155-F158 PolarHBondContact O-N 3.44Å; V156-F158 PolarHBondContact O-N 3.05Å; F158-L160 VanDerWaalsContact C-N 3.32Å; F158-L160 PolarHBondContact O-N 3.27Å; F158-L161 PolarHBondContact O-N 2.92Å; F158-I162 HydrophobicContact CD1-CD1 3.9Å; F158-I162 HydrophobicContact CE1-CD1 3.63Å; F158-I162 HydrophobicContact CE1-CG1 4.38Å; F158-I162 HydrophobicContact CZ-CD1 4.24Å; F158-I162 WeakPolarHBondContact O-CG1 3.37Å; F158-I162 PolarHBondContact O-N 2.73Å
159	Q	87.8	Confident	84.8	Confident	20 Å²	20	29.3 Å²	29.3	9%	0.093	13%	0.134	C	C	.	.	H	α-helix	trans	-61.1	-38.9	173.4	-175.9	62.5	47.8	0	0	112.4	V156 M157 L161 I162 T163 T333	V156-Q159 WeakPolarHBondContact O-CB 3.22Å; V156-Q159 PolarHBondContact O-N 3.33Å; V156-Q159 VanDerWaalsContact O-N 3.09Å; M157-Q159 VanDerWaalsContact C-N 3.3Å; M157-Q159 PolarHBondContact O-N 2.91Å; Q159-L161 VanDerWaalsContact C-N 3.31Å; Q159-L161 PolarHBondContact O-N 2.97Å; Q159-I162 WeakPolarHBondContact O-CB 3.37Å; Q159-I162 PolarHBondContact O-N 3.37Å; Q159-T163 WeakPolarHBondContact O-CG2 3.38Å; Q159-T163 PolarHBondContact O-N 2.78Å; Q159-T163 PolarHBondContact O-OG1 2.87Å; Q159-T333 HydrophobicContact CG-CG2 4.29Å
160	L	90.7	Very high	86.2	Confident	17 Å²	17	25 Å²	25	9%	0.089	12%	0.116	C	C	.	.	H	α-helix	trans	-60.5	-40.5	175.6	-176.2	67.9	0	0	0	112.2	V156 M157 F158 T163 F164 F330 T333 F334 I337	V156-L160 PolarHBondContact O-N 3.04Å; V156-L160 VanDerWaalsContact O-N 3.08Å; M157-L160 WeakPolarHBondContact O-CB 3.34Å; M157-L160 PolarHBondContact O-N 3.06Å; M157-L160 VanDerWaalsContact O-N 3.12Å; M157-L160 HydrophobicContact SD-CD2 3.69Å; F158-L160 VanDerWaalsContact C-N 3.32Å; F158-L160 PolarHBondContact O-N 3.27Å; L160-T163 PolarHBondContact O-N 3.19Å; L160-T163 PolarHBondContact O-OG1 3.31Å; L160-T163 VanDerWaalsContact O-OG1 3.05Å; L160-F164 WeakPolarHBondContact O-CB 3.32Å; L160-F164 PolarHBondContact O-N 3Å; L160-F330 HydrophobicContact CD1-CD2 3.93Å; L160-F330 HydrophobicContact CD1-CE2 3.63Å; L160-F330 HydrophobicContact CG-CE2 4.1Å; L160-T333 HydrophobicContact CB-CG2 4.18Å; L160-T333 HydrophobicContact CD1-CG2 3.9Å; L160-F334 HydrophobicContact CD1-CD2 4.15Å; L160-F334 HydrophobicContact CD1-CE1 4.28Å; L160-F334 HydrophobicContact CD1-CE2 3.87Å; L160-F334 HydrophobicContact CD1-CG 4.49Å; L160-F334 HydrophobicContact CD1-CZ 3.94Å; L160-F334 HydrophobicContact CD2-CE1 4.03Å; L160-F334 HydrophobicContact CD2-CZ 4.12Å; L160-I337 HydrophobicContact CB-CD1 4.07Å; L160-I337 HydrophobicContact CD1-CD1 4.35Å; L160-I337 HydrophobicContact CD2-CD1 3.96Å; L160-I337 HydrophobicContact CG-CD1 4.35Å
161	L	91.9	Very high	87.5	Confident	28 Å²	28	27.4 Å²	27.4	15%	0.147	13%	0.128	C	C	.	.	H	α-helix	trans	-73.6	-28.3	176.4	-72.2	-162.3	0	0	0	113.1	V35 M36 F39 M157 F158 Q159 F164 G165	V35-L161 HydrophobicContact CB-CD1 4.09Å; V35-L161 HydrophobicContact CG1-CB 3.9Å; V35-L161 HydrophobicContact CG1-CD1 3.34Å; V35-L161 HydrophobicContact CG1-CG 3.46Å; V35-L161 VanDerWaalsContact CG1-CG 3.46Å; V35-L161 WeakPolarHBondContact O-CD1 3.49Å; M36-L161 HydrophobicContact SD-CD1 3.87Å; F39-L161 WeakPolarHBondContact CA-O 3.27Å; F39-L161 HydrophobicContact CB-CB 4.27Å; F39-L161 PolarHBondContact N-O 3.33Å; M157-L161 PolarHBondContact O-N 2.9Å; F158-L161 PolarHBondContact O-N 2.92Å; Q159-L161 VanDerWaalsContact C-N 3.31Å; Q159-L161 PolarHBondContact O-N 2.97Å; L161-F164 HydrophobicContact CD2-CB 4.22Å; L161-F164 HydrophobicContact CD2-CD1 3.97Å; L161-F164 HydrophobicContact CD2-CG 4.49Å; L161-F164 PolarHBondContact O-N 3.18Å; L161-G165 PolarHBondContact O-N 3.13Å
162	I	93	Very high	88.6	Confident	12 Å²	12	28.8 Å²	28.8	6%	0.062	14%	0.137	C	C	.	.	H	α-helix	trans	-58.8	-50.1	168.1	-63.2	170.3	0	0	0	110.3	G38 F41 G42 F158 Q159 F164 G165 L166	G38-I162 WeakPolarHBondContact O-CA 3.42Å; G38-I162 WeakPolarHBondContact O-CG1 3.35Å; F41-I162 HydrophobicContact CD1-CD1 3.69Å; F41-I162 HydrophobicContact CD1-CG1 3.84Å; F41-I162 HydrophobicContact CD1-CG2 4.02Å; F41-I162 HydrophobicContact CE1-CD1 4.06Å; F41-I162 HydrophobicContact CE1-CG1 4.5Å; F41-I162 HydrophobicContact CE1-CG2 4.1Å; G42-I162 VanDerWaalsContact CA-O 3.29Å; G42-I162 WeakPolarHBondContact CA-O 3.45Å; F158-I162 HydrophobicContact CD1-CD1 3.9Å; F158-I162 HydrophobicContact CE1-CD1 3.63Å; F158-I162 HydrophobicContact CE1-CG1 4.38Å; F158-I162 HydrophobicContact CZ-CD1 4.24Å; F158-I162 WeakPolarHBondContact O-CG1 3.37Å; F158-I162 PolarHBondContact O-N 2.73Å; Q159-I162 WeakPolarHBondContact O-CB 3.37Å; Q159-I162 PolarHBondContact O-N 3.37Å; I162-F164 VanDerWaalsContact C-N 3.32Å; I162-F164 PolarHBondContact O-N 3.32Å; I162-G165 PolarHBondContact O-N 2.88Å; I162-L166 HydrophobicContact CG2-CD1 4.23Å; I162-L166 WeakPolarHBondContact O-CG 3.37Å; I162-L166 PolarHBondContact O-N 3.3Å
163	T	95.1	Very high	90	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-70.6	-30.9	-178.4	62	0	0	0	0	112.5	Q159 L160 W167 N329 T333	Q159-T163 WeakPolarHBondContact O-CG2 3.38Å; Q159-T163 PolarHBondContact O-N 2.78Å; Q159-T163 PolarHBondContact O-OG1 2.87Å; L160-T163 PolarHBondContact O-N 3.19Å; L160-T163 PolarHBondContact O-OG1 3.31Å; L160-T163 VanDerWaalsContact O-OG1 3.05Å; T163-W167 PolarHBondContact O-N 3Å; T163-W167 VanDerWaalsContact O-N 3.14Å; T163-N329 WeakPolarHBondContact CB-OD1 3.44Å; T163-N329 WeakPolarHBondContact CG2-OD1 3.11Å; T163-T333 WeakPolarHBondContact CB-OG1 3.28Å; T163-T333 VanDerWaalsContact CG2-OG1 3.23Å; T163-T333 WeakPolarHBondContact CG2-OG1 3.36Å; T163-T333 PolarHBondContact OG1-OG1 2.87Å
164	F	95.7	Very high	91.1	Very high	73 Å²	73	22.7 Å²	22.7	32%	0.32	11%	0.113	S	C	.	.	H	α-helix	trans	-65.7	-43.6	170.2	-173.5	-129.3	0	0	0	112.5	F39 L160 L161 I162 W167 V168 F330	F39-F164 AromaticContact CD2-CD1 3.6Å; F39-F164 HydrophobicContact CD2-CD1 3.6Å; F39-F164 HydrophobicContact CD2-CE1 4.08Å; F39-F164 HydrophobicContact CD2-CG 4.38Å; F39-F164 AromaticContact CE2-CD1 3.84Å; F39-F164 HydrophobicContact CE2-CD1 3.84Å; F39-F164 AromaticContact CE2-CE1 3.94Å; F39-F164 HydrophobicContact CE2-CE1 3.94Å; L160-F164 WeakPolarHBondContact O-CB 3.32Å; L160-F164 PolarHBondContact O-N 3Å; L161-F164 HydrophobicContact CD2-CB 4.22Å; L161-F164 HydrophobicContact CD2-CD1 3.97Å; L161-F164 HydrophobicContact CD2-CG 4.49Å; L161-F164 PolarHBondContact O-N 3.18Å; I162-F164 VanDerWaalsContact C-N 3.32Å; I162-F164 PolarHBondContact O-N 3.32Å; F164-W167 HydrophobicContact CD2-CE3 4.24Å; F164-W167 HydrophobicContact CE2-CE3 4.42Å; F164-W167 PolarHBondContact O-N 3.18Å; F164-V168 HydrophobicContact CD2-CG2 4.07Å; F164-V168 HydrophobicContact CE1-CG2 4.23Å; F164-V168 HydrophobicContact CE2-CG2 3.62Å; F164-V168 HydrophobicContact CZ-CG2 3.7Å; F164-V168 WeakPolarHBondContact O-CG2 3.38Å; F164-V168 PolarHBondContact O-N 2.78Å; F164-F330 HydrophobicContact CB-CD2 3.74Å; F164-F330 HydrophobicContact CB-CE2 3.65Å; F164-F330 HydrophobicContact CD2-CD2 4.21Å; F164-F330 HydrophobicContact CD2-CE1 4.41Å; F164-F330 AromaticContact CD2-CE2 3.86Å; F164-F330 HydrophobicContact CD2-CE2 3.86Å; F164-F330 AromaticContact CD2-CZ 3.95Å; F164-F330 HydrophobicContact CD2-CZ 3.95Å; F164-F330 HydrophobicContact CG-CD2 4.43Å; F164-F330 HydrophobicContact CG-CE2 4.04Å
165	G	96	Very high	92.1	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60.2	-44.4	175.7	0	0	0	0	0	112.4	F39 G42 Y43 L161 I162 W167 V168 A169	F39-G165 VanDerWaalsContact CD2-CA 3.45Å; G42-G165 VanDerWaalsContact C-C 3.48Å; Y43-G165 WeakPolarHBondContact CA-O 3.5Å; L161-G165 PolarHBondContact O-N 3.13Å; I162-G165 PolarHBondContact O-N 2.88Å; G165-W167 VanDerWaalsContact C-N 3.34Å; G165-W167 PolarHBondContact O-N 3.04Å; G165-V168 PolarHBondContact O-N 2.79Å; G165-A169 WeakPolarHBondContact O-CB 3.49Å; G165-A169 PolarHBondContact O-N 3.47Å
166	L	96.2	Very high	93.1	Very high	5 Å²	5	25.8 Å²	25.8	3%	0.026	14%	0.135	C	C	.	.	H	α-helix	trans	-56.4	-47.3	174.4	-77	164.6	0	0	0	111.8	G42 T45 I162 G170 M300	G42-L166 WeakPolarHBondContact O-CA 3.43Å; G42-L166 VanDerWaalsContact O-CD2 3.3Å; G42-L166 WeakPolarHBondContact O-CD2 3.29Å; G42-L166 WeakPolarHBondContact O-CG 3.35Å; G42-L166 PolarHBondContact O-N 3.2Å; T45-L166 HydrophobicContact CG2-CD2 3.7Å; I162-L166 HydrophobicContact CG2-CD1 4.23Å; I162-L166 WeakPolarHBondContact O-CG 3.37Å; I162-L166 PolarHBondContact O-N 3.3Å; L166-G170 PolarHBondContact O-N 2.84Å; L166-M300 HydrophobicContact CD1-SD 3.52Å; L166-M300 VanDerWaalsContact CD1-SD 3.52Å; L166-M300 HydrophobicContact CD2-CB 4.49Å; L166-M300 HydrophobicContact CD2-SD 4.07Å; L166-M300 HydrophobicContact CG-SD 4.49Å
167	W	97.6	Very high	93.7	Very high	59 Å²	59	26 Å²	26	22%	0.223	14%	0.137	C	C	.	.	H	α-helix	trans	-67.8	-45.7	-178.8	-177.9	31.5	0	0	0	112.5	T163 F164 G165 A169 G170 L171 A323 F330 F331	T163-W167 PolarHBondContact O-N 3Å; T163-W167 VanDerWaalsContact O-N 3.14Å; F164-W167 HydrophobicContact CD2-CE3 4.24Å; F164-W167 HydrophobicContact CE2-CE3 4.42Å; F164-W167 PolarHBondContact O-N 3.18Å; G165-W167 VanDerWaalsContact C-N 3.34Å; G165-W167 PolarHBondContact O-N 3.04Å; W167-A169 VanDerWaalsContact C-N 3.31Å; W167-A169 PolarHBondContact O-N 3.36Å; W167-G170 PolarHBondContact O-N 3.43Å; W167-L171 HydrophobicContact CD2-CD1 4.34Å; W167-L171 HydrophobicContact CZ2-CD1 4.24Å; W167-L171 WeakPolarHBondContact O-CG 3.33Å; W167-L171 PolarHBondContact O-N 3.06Å; W167-A323 VanDerWaalsContact CD1-O 3.29Å; W167-F330 HydrophobicContact CB-CB 4.4Å; W167-F330 HydrophobicContact CD2-CD1 4.49Å; W167-F330 HydrophobicContact CE3-CB 4.26Å; W167-F330 AromaticContact CE3-CD1 3.43Å; W167-F330 HydrophobicContact CE3-CD1 3.43Å; W167-F330 VanDerWaalsContact CE3-CD1 3.43Å; W167-F330 AromaticContact CE3-CE1 3.95Å; W167-F330 HydrophobicContact CE3-CE1 3.95Å; W167-F330 AromaticContact CE3-CG 3.97Å; W167-F330 HydrophobicContact CE3-CG 3.97Å; W167-F330 AromaticContact CZ3-CD1 3.54Å; W167-F330 HydrophobicContact CZ3-CD1 3.54Å; W167-F330 AromaticContact CZ3-CE1 3.71Å; W167-F330 HydrophobicContact CZ3-CE1 3.71Å; W167-F330 HydrophobicContact CZ3-CG 4.5Å; W167-F331 AromaticContact CH2-CE2 3.85Å; W167-F331 HydrophobicContact CH2-CE2 3.85Å; W167-F331 AromaticContact CH2-CZ 3.78Å; W167-F331 HydrophobicContact CH2-CZ 3.78Å; W167-F331 HydrophobicContact CZ2-CE2 4.28Å; W167-F331 HydrophobicContact CZ3-CE2 4.14Å; W167-F331 AromaticContact CZ3-CZ 3.98Å; W167-F331 HydrophobicContact CZ3-CZ 3.98Å
168	V	97.3	Very high	94.2	Very high	31 Å²	31	29.8 Å²	29.8	19%	0.188	15%	0.149	C	C	.	.	H	α-helix	trans	-62.5	-39.6	177.4	171.7	0	0	0	0	111.3	F39 F164 G165 L171 L172	F39-V168 HydrophobicContact CE2-CB 3.9Å; F39-V168 HydrophobicContact CE2-CG1 4.18Å; F39-V168 HydrophobicContact CE2-CG2 3.97Å; F39-V168 HydrophobicContact CZ-CB 4.07Å; F39-V168 HydrophobicContact CZ-CG1 3.89Å; F39-V168 HydrophobicContact CZ-CG2 4.5Å; F164-V168 HydrophobicContact CD2-CG2 4.07Å; F164-V168 HydrophobicContact CE1-CG2 4.23Å; F164-V168 HydrophobicContact CE2-CG2 3.62Å; F164-V168 HydrophobicContact CZ-CG2 3.7Å; F164-V168 WeakPolarHBondContact O-CG2 3.38Å; F164-V168 PolarHBondContact O-N 2.78Å; G165-V168 PolarHBondContact O-N 2.79Å; V168-L171 PolarHBondContact O-N 3.32Å; V168-L172 HydrophobicContact CG1-CD1 3.83Å; V168-L172 HydrophobicContact CG1-CG 4.38Å; V168-L172 WeakPolarHBondContact O-CB 3.34Å; V168-L172 WeakPolarHBondContact O-CG 3.26Å; V168-L172 PolarHBondContact O-N 3.42Å
169	A	97.3	Very high	94.4	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.8	-47.2	173	0	0	0	0	0	111.7	Y43 V47 G165 W167 L171 L172 D173	Y43-A169 HydrophobicContact CD1-CB 4.36Å; Y43-A169 HydrophobicContact CD2-CB 4.01Å; Y43-A169 HydrophobicContact CE2-CB 4.34Å; Y43-A169 HydrophobicContact CG-CB 4.02Å; Y43-A169 WeakPolarHBondContact O-CB 3.31Å; V47-A169 HydrophobicContact CB-CB 4.11Å; G165-A169 WeakPolarHBondContact O-CB 3.49Å; G165-A169 PolarHBondContact O-N 3.47Å; W167-A169 VanDerWaalsContact C-N 3.31Å; W167-A169 PolarHBondContact O-N 3.36Å; A169-L171 VanDerWaalsContact C-N 3.31Å; A169-L171 PolarHBondContact O-N 2.98Å; A169-L172 PolarHBondContact O-N 3.28Å; A169-L172 VanDerWaalsContact O-N 3.16Å; A169-D173 WeakPolarHBondContact O-CB 3.2Å; A169-D173 PolarHBondContact O-N 3.37Å
170	G	96.7	Very high	93.9	Very high	7 Å²	7	39.2 Å²	39.2	7%	0.072	19%	0.194	C	C	.	.	H	α-helix	trans	-59.9	-38.3	175.6	0	0	0	0	0	113.5	L166 W167 A174 A323	L166-G170 PolarHBondContact O-N 2.84Å; W167-G170 PolarHBondContact O-N 3.43Å; G170-A174 WeakPolarHBondContact O-CB 3.4Å; G170-A174 PolarHBondContact O-N 3.23Å; G170-A323 VanDerWaalsContact C-CB 3.48Å; G170-A323 WeakPolarHBondContact O-CB 3.38Å
171	L	97.4	Very high	93.5	Very high	61 Å²	61	42.4 Å²	42.4	32%	0.319	21%	0.211	S	C	.	.	H	α-helix	trans	-66.7	-40.3	175.3	-70.7	175.6	0	0	0	112.3	W167 V168 A169 A174 A175 W320 A323	W167-L171 HydrophobicContact CD2-CD1 4.34Å; W167-L171 HydrophobicContact CZ2-CD1 4.24Å; W167-L171 WeakPolarHBondContact O-CG 3.33Å; W167-L171 PolarHBondContact O-N 3.06Å; V168-L171 PolarHBondContact O-N 3.32Å; A169-L171 VanDerWaalsContact C-N 3.31Å; A169-L171 PolarHBondContact O-N 2.98Å; L171-A174 PolarHBondContact O-N 2.95Å; L171-A175 VanDerWaalsContact O-CB 3.31Å; L171-A175 WeakPolarHBondContact O-CB 3.5Å; L171-A175 PolarHBondContact O-N 3.02Å; L171-W320 HydrophobicContact CD2-CZ3 3.86Å; L171-A323 HydrophobicContact CD2-CB 4.48Å
172	L	97.1	Very high	92.8	Very high	46 Å²	46	43 Å²	43	24%	0.241	21%	0.214	C	C	.	.	H	α-helix	trans	-71.7	-40.1	178.2	-73.1	168.5	0	0	0	111.6	Y43 V168 A169 A174 A175 F176 V192	Y43-L172 HydrophobicContact CE2-CD1 3.54Å; V168-L172 HydrophobicContact CG1-CD1 3.83Å; V168-L172 HydrophobicContact CG1-CG 4.38Å; V168-L172 WeakPolarHBondContact O-CB 3.34Å; V168-L172 WeakPolarHBondContact O-CG 3.26Å; V168-L172 PolarHBondContact O-N 3.42Å; A169-L172 PolarHBondContact O-N 3.28Å; A169-L172 VanDerWaalsContact O-N 3.16Å; L172-A174 VanDerWaalsContact C-N 3.31Å; L172-A174 PolarHBondContact O-N 3.46Å; L172-A175 PolarHBondContact O-N 2.85Å; L172-F176 HydrophobicContact CB-CD2 4.22Å; L172-F176 HydrophobicContact CB-CE2 4.05Å; L172-F176 HydrophobicContact CD2-CE2 4.04Å; L172-F176 HydrophobicContact CD2-CZ 4.23Å; L172-F176 WeakPolarHBondContact O-CB 3.39Å; L172-F176 WeakPolarHBondContact O-CD2 3.46Å; L172-F176 WeakPolarHBondContact O-CG 3.45Å; L172-F176 PolarHBondContact O-N 3.31Å; L172-V192 HydrophobicContact CD1-CG1 4.36Å
173	D	96.5	Very high	92.3	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-57.8	-47.1	171.1	-74.3	-2.9	0	0	0	110.4	V47 G50 A169 A175 F176 S177 M189 I319	V47-D173 VanDerWaalsContact CA-OD2 3.31Å; V47-D173 WeakPolarHBondContact CA-OD2 3.41Å; V47-D173 VanDerWaalsContact CG2-OD1 3.3Å; V47-D173 WeakPolarHBondContact CG2-OD1 3.11Å; V47-D173 VanDerWaalsContact O-OD2 3.12Å; G50-D173 WeakPolarHBondContact CA-OD2 3.47Å; G50-D173 PolarHBondContact N-OD2 3.21Å; A169-D173 WeakPolarHBondContact O-CB 3.2Å; A169-D173 PolarHBondContact O-N 3.37Å; D173-A175 PolarHBondContact O-N 2.59Å; D173-F176 PolarHBondContact O-N 3.09Å; D173-S177 VanDerWaalsContact O-CB 3.25Å; D173-S177 WeakPolarHBondContact O-CB 3.45Å; D173-S177 PolarHBondContact O-N 2.96Å; D173-M189 HydrophobicContact CB-CE 4.41Å; D173-M189 HydrophobicContact CB-SD 4.18Å; D173-M189 WeakPolarHBondContact O-CE 3.46Å; D173-M189 WeakPolarHBondContact OD1-CB 3.37Å; D173-M189 VanDerWaalsContact OD1-CG 3.3Å; D173-M189 WeakPolarHBondContact OD1-CG 3.08Å; D173-I319 HydrophobicContact CB-CG2 3.67Å
174	A	95.4	Very high	92	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.9	-44	178.2	0	0	0	0	0	111.5	G170 L171 L172 S177 Y178 I319 W320	G170-A174 WeakPolarHBondContact O-CB 3.4Å; G170-A174 PolarHBondContact O-N 3.23Å; L171-A174 PolarHBondContact O-N 2.95Å; L172-A174 VanDerWaalsContact C-N 3.31Å; L172-A174 PolarHBondContact O-N 3.46Å; A174-S177 PolarHBondContact O-N 3.03Å; A174-S177 PolarHBondContact O-OG 2.93Å; A174-Y178 VanDerWaalsContact O-CD2 3.3Å; A174-Y178 WeakPolarHBondContact O-CD2 3.16Å; A174-I319 HydrophobicContact CB-CG2 3.91Å; A174-W320 HydrophobicContact CB-CD2 3.56Å; A174-W320 HydrophobicContact CB-CE3 3.87Å; A174-W320 HydrophobicContact CB-CG 3.98Å; A174-W320 HydrophobicContact CB-CH2 4.2Å; A174-W320 HydrophobicContact CB-CZ2 3.93Å; A174-W320 HydrophobicContact CB-CZ3 4.17Å
175	A	95.7	Very high	91.8	Very high	51 Å²	51	46 Å²	46	42%	0.421	24%	0.236	S	C	.	.	H	α-helix	trans	-65.2	-45.5	178.7	0	0	0	0	0	112.7	L171 L172 D173 S177 Y178	L171-A175 VanDerWaalsContact O-CB 3.31Å; L171-A175 WeakPolarHBondContact O-CB 3.5Å; L171-A175 PolarHBondContact O-N 3.02Å; L172-A175 PolarHBondContact O-N 2.85Å; D173-A175 PolarHBondContact O-N 2.59Å; A175-S177 VanDerWaalsContact C-N 3.3Å; A175-S177 PolarHBondContact O-N 3.12Å; A175-Y178 PolarHBondContact O-N 3.06Å
176	F	95.3	Very high	91.6	Very high	42 Å²	42	46 Å²	46	18%	0.184	24%	0.236	C	C	.	.	H	α-helix	trans	-73.6	-21.6	178.6	-65.3	-44.3	0	0	0	112.5	L172 D173 Y178 I179 N185 L188 M189 V192	L172-F176 HydrophobicContact CB-CD2 4.22Å; L172-F176 HydrophobicContact CB-CE2 4.05Å; L172-F176 HydrophobicContact CD2-CE2 4.04Å; L172-F176 HydrophobicContact CD2-CZ 4.23Å; L172-F176 WeakPolarHBondContact O-CB 3.39Å; L172-F176 WeakPolarHBondContact O-CD2 3.46Å; L172-F176 WeakPolarHBondContact O-CG 3.45Å; L172-F176 PolarHBondContact O-N 3.31Å; D173-F176 PolarHBondContact O-N 3.09Å; F176-Y178 PolarHBondContact O-N 3.19Å; F176-Y178 VanDerWaalsContact O-N 3.16Å; F176-I179 HydrophobicContact CB-CD1 4.41Å; F176-I179 HydrophobicContact CD1-CD1 3.86Å; F176-I179 WeakPolarHBondContact O-CB 3.39Å; F176-I179 PolarHBondContact O-N 2.96Å; F176-N185 VanDerWaalsContact O-CB 3.29Å; F176-N185 WeakPolarHBondContact O-CB 3.16Å; F176-L188 HydrophobicContact CD1-CB 4.3Å; F176-L188 HydrophobicContact CD1-CD1 4.19Å; F176-L188 HydrophobicContact CD2-CB 4.14Å; F176-L188 HydrophobicContact CE1-CB 4.37Å; F176-L188 HydrophobicContact CE1-CD1 4.28Å; F176-L188 HydrophobicContact CE2-CB 4.2Å; F176-L188 HydrophobicContact CG-CB 4.2Å; F176-L188 HydrophobicContact CZ-CB 4.32Å; F176-M189 HydrophobicContact CB-CE 3.86Å; F176-M189 HydrophobicContact CB-CG 3.99Å; F176-M189 HydrophobicContact CD2-CG 4.01Å; F176-M189 HydrophobicContact CG-CG 4.49Å; F176-V192 HydrophobicContact CE2-CG2 4.11Å; F176-V192 HydrophobicContact CZ-CG2 4.1Å
177	S	90.6	Very high	91.6	Very high	15 Å²	15	48.5 Å²	48.5	11%	0.105	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-16.9	174.7	77.2	0	0	0	0	113.9	D173 A174 A175 I179 T316	D173-S177 VanDerWaalsContact O-CB 3.25Å; D173-S177 WeakPolarHBondContact O-CB 3.45Å; D173-S177 PolarHBondContact O-N 2.96Å; A174-S177 PolarHBondContact O-N 3.03Å; A174-S177 PolarHBondContact O-OG 2.93Å; A175-S177 VanDerWaalsContact C-N 3.3Å; A175-S177 PolarHBondContact O-N 3.12Å; S177-I179 VanDerWaalsContact C-N 3.29Å; S177-T316 WeakPolarHBondContact OG-CG2 3.1Å; S177-T316 PolarHBondContact OG-OG1 3.01Å
178	Y	90	Very high	91.5	Very high	139 Å²	139	48.7 Å²	48.7	55%	0.545	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-11.5	172.3	-71.7	-77.9	0	0	0	113.8	A174 A175 F176 H180 T316 W320	A174-Y178 VanDerWaalsContact O-CD2 3.3Å; A174-Y178 WeakPolarHBondContact O-CD2 3.16Å; A175-Y178 PolarHBondContact O-N 3.06Å; F176-Y178 PolarHBondContact O-N 3.19Å; F176-Y178 VanDerWaalsContact O-N 3.16Å; Y178-H180 PolarHBondContact O-N 3.35Å; Y178-T316 HydrophobicContact CD1-CG2 4.45Å; Y178-T316 HydrophobicContact CE1-CG2 3.92Å; Y178-T316 HydrophobicContact CE2-CG2 4.03Å; Y178-W320 HydrophobicContact CE2-CZ2 4.16Å; Y178-W320 AromaticContact CE2-NE1 3.42Å; Y178-W320 AromaticContact CZ-NE1 3.61Å; Y178-W320 PolarHBondContact OH-NE1 3.13Å
179	I	89.6	Confident	91.4	Very high	56 Å²	56	47.2 Å²	47.2	29%	0.287	24%	0.241	S	C	.	.			trans	-73.4	113.9	174.4	-62.3	171	0	0	0	107.6	F176 S177 D181 V184 N185 L188	F176-I179 HydrophobicContact CB-CD1 4.41Å; F176-I179 HydrophobicContact CD1-CD1 3.86Å; F176-I179 WeakPolarHBondContact O-CB 3.39Å; F176-I179 PolarHBondContact O-N 2.96Å; S177-I179 VanDerWaalsContact C-N 3.29Å; I179-D181 HydrophobicContact CG2-CB 4.36Å; I179-D181 PolarHBondContact O-N 3.45Å; I179-V184 HydrophobicContact CG2-CB 4.37Å; I179-V184 HydrophobicContact CG2-CG1 4.41Å; I179-N185 HydrophobicContact CB-CB 4.09Å; I179-N185 HydrophobicContact CG2-CB 4.47Å; I179-N185 PolarHBondContact O-ND2 3.41Å; I179-L188 HydrophobicContact CD1-CD1 3.65Å
180	H	77.7	Confident	91.3	Very high	181 Å²	181	47.3 Å²	47.3	84%	0.838	24%	0.242	S	C	*	.	S	Bend	trans	-62	-22.2	-177	-64.3	-65.3	0	0	0	114.5	Y178 D182	Y178-H180 PolarHBondContact O-N 3.35Å; H180-D182 PolarHBondContact O-N 2.91Å
181	D	81.3	Confident	91.3	Very high	83 Å²	83	48 Å²	48	44%	0.444	25%	0.248	S	C	.	.			trans	-81.9	100.1	175.5	-169.4	-10.6	0	0	0	110.1	I179 N183 V184 N185	I179-D181 HydrophobicContact CG2-CB 4.36Å; I179-D181 PolarHBondContact O-N 3.45Å; D181-N183 PolarHBondContact O-N 2.82Å; D181-N183 VanDerWaalsContact O-N 3.13Å; D181-N183 WeakPolarHBondContact OD1-CA 3.36Å; D181-N183 WeakPolarHBondContact OD1-CB 3.19Å; D181-N183 PolarHBondContact OD1-N 3.37Å; D181-V184 HydrophobicContact CB-CB 4.16Å; D181-V184 HydrophobicContact CB-CG2 4.08Å; D181-V184 PolarHBondContact O-N 3.03Å; D181-V184 WeakPolarHBondContact OD2-CG2 3.45Å; D181-N185 PolarHBondContact O-N 3.31Å; D181-N185 VanDerWaalsContact O-N 3.09Å
182	D	77.1	Confident	91.2	Very high	41 Å²	41	46.8 Å²	46.8	22%	0.219	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-14.4	174.4	-85	-2.3	0	0	0	112.9	I54 V58 H180 N185 W186 R315	I54-D182 HydrophobicContact CG2-CB 4.21Å; V58-D182 HydrophobicContact CG2-CB 3.87Å; V58-D182 WeakPolarHBondContact CG2-O 3.42Å; H180-D182 PolarHBondContact O-N 2.91Å; D182-N185 WeakPolarHBondContact CA-OD1 3.18Å; D182-N185 PolarHBondContact O-OD1 3.33Å; D182-N185 VanDerWaalsContact O-OD1 3.09Å; D182-N185 PolarHBondContact OD1-ND2 3.15Å; D182-W186 PolarHBondContact O-NE1 3.48Å; D182-R315 IonicContact OD1-NH2 3.04Å; D182-R315 IonicContact OD2-CZ 3.54Å; D182-R315 IonicContact OD2-NH1 3.26Å; D182-R315 PolarHBondContact OD2-NH1 3.33Å; D182-R315 IonicContact OD2-NH2 3.83Å; D182-R315 PolarHBondContact OD2-NH2 3.45Å
183	N	82.4	Confident	91	Very high	88 Å²	88	45.1 Å²	45.1	47%	0.471	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-17.4	170.1	-80.5	-48.6	0	0	0	113.8	D181 R187	D181-N183 PolarHBondContact O-N 2.82Å; D181-N183 VanDerWaalsContact O-N 3.13Å; D181-N183 WeakPolarHBondContact OD1-CA 3.36Å; D181-N183 WeakPolarHBondContact OD1-CB 3.19Å; D181-N183 PolarHBondContact OD1-N 3.37Å; N183-R187 WeakPolarHBondContact O-CD 3.27Å; N183-R187 VanDerWaalsContact O-CG 3.25Å; N183-R187 WeakPolarHBondContact O-CG 3.21Å; N183-R187 PolarHBondContact O-NE 2.82Å
184	V	89.3	Confident	91	Very high	58 Å²	58	45.9 Å²	45.9	35%	0.352	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-38.4	-176.5	175.6	0	0	0	0	111.6	I179 D181 R187 L188	I179-V184 HydrophobicContact CG2-CB 4.37Å; I179-V184 HydrophobicContact CG2-CG1 4.41Å; D181-V184 HydrophobicContact CB-CB 4.16Å; D181-V184 HydrophobicContact CB-CG2 4.08Å; D181-V184 PolarHBondContact O-N 3.03Å; D181-V184 WeakPolarHBondContact OD2-CG2 3.45Å; V184-R187 PolarHBondContact O-N 3.06Å; V184-L188 HydrophobicContact CG1-CD1 3.73Å; V184-L188 HydrophobicContact CG1-CG 4.1Å; V184-L188 WeakPolarHBondContact O-CG 3.3Å; V184-L188 PolarHBondContact O-N 2.87Å; V184-L188 VanDerWaalsContact O-N 3.08Å
185	N	90.6	Very high	91	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-59.3	-57	-171.4	56.9	15.3	0	0	0	113.7	I54 F176 I179 D181 D182 R187 L188 M189	I54-N185 WeakPolarHBondContact CG2-OD1 3.48Å; F176-N185 VanDerWaalsContact O-CB 3.29Å; F176-N185 WeakPolarHBondContact O-CB 3.16Å; I179-N185 HydrophobicContact CB-CB 4.09Å; I179-N185 HydrophobicContact CG2-CB 4.47Å; I179-N185 PolarHBondContact O-ND2 3.41Å; D181-N185 PolarHBondContact O-N 3.31Å; D181-N185 VanDerWaalsContact O-N 3.09Å; D182-N185 WeakPolarHBondContact CA-OD1 3.18Å; D182-N185 PolarHBondContact O-OD1 3.33Å; D182-N185 VanDerWaalsContact O-OD1 3.09Å; D182-N185 PolarHBondContact OD1-ND2 3.15Å; N185-R187 VanDerWaalsContact C-N 3.29Å; N185-R187 PolarHBondContact O-N 3.22Å; N185-L188 PolarHBondContact O-N 2.75Å; N185-M189 HydrophobicContact CB-CE 4.44Å; N185-M189 WeakPolarHBondContact O-CG 3.43Å; N185-M189 PolarHBondContact O-N 3.38Å
186	W	93	Very high	90.9	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-67.8	-29.4	-178.7	68	-95.4	0	0	0	112.4	A51 I54 M55 F59 A114 L120 D182 L188 M189 L190	A51-W186 HydrophobicContact CB-CB 4.41Å; I54-W186 HydrophobicContact CB-CB 4.44Å; I54-W186 HydrophobicContact CG2-CB 4.42Å; M55-W186 HydrophobicContact CG-CB 4.09Å; M55-W186 HydrophobicContact CG-CD2 3.92Å; M55-W186 HydrophobicContact CG-CE3 4.05Å; M55-W186 HydrophobicContact CG-CG 3.92Å; M55-W186 HydrophobicContact SD-CD2 4.49Å; M55-W186 HydrophobicContact SD-CE3 4.02Å; F59-W186 AromaticContact CE2-CE2 3.97Å; F59-W186 AromaticContact CE2-CH2 3.67Å; F59-W186 HydrophobicContact CE2-CH2 3.67Å; F59-W186 AromaticContact CE2-CZ2 3.44Å; F59-W186 HydrophobicContact CE2-CZ2 3.44Å; F59-W186 VanDerWaalsContact CE2-CZ2 3.44Å; F59-W186 HydrophobicContact CE2-CZ3 4.39Å; F59-W186 AromaticContact CZ-CH2 3.77Å; F59-W186 HydrophobicContact CZ-CH2 3.77Å; F59-W186 AromaticContact CZ-CZ2 3.6Å; F59-W186 HydrophobicContact CZ-CZ2 3.6Å; A114-W186 HydrophobicContact CB-CH2 4.35Å; A114-W186 WeakPolarHBondContact O-CH2 2.87Å; L120-W186 HydrophobicContact CD2-CH2 4.3Å; L120-W186 HydrophobicContact CD2-CZ3 3.77Å; D182-W186 PolarHBondContact O-NE1 3.48Å; W186-L188 VanDerWaalsContact C-N 3.34Å; W186-M189 WeakPolarHBondContact O-CB 3.38Å; W186-M189 PolarHBondContact O-N 3Å; W186-L190 HydrophobicContact CE3-CD1 3.96Å; W186-L190 HydrophobicContact CZ3-CD1 4.26Å; W186-L190 WeakPolarHBondContact O-CG 3.38Å; W186-L190 PolarHBondContact O-N 3.38Å; W186-L190 VanDerWaalsContact O-N 3.1Å
187	R	95.4	Very high	90.8	Very high	58 Å²	58	47 Å²	47	22%	0.219	24%	0.244	C	C	.	.	H	α-helix	trans	-63.1	-42.8	174.1	-67.2	-175.6	-176.3	-78.8	-7.5	111.1	G112 A113 A114 N183 V184 N185 G191	G112-R187 WeakPolarHBondContact O-CB 3.48Å; G112-R187 WeakPolarHBondContact O-CD 3.39Å; G112-R187 WeakPolarHBondContact O-CG 3.12Å; G112-R187 PolarHBondContact O-NH1 2.55Å; A113-R187 VanDerWaalsContact C-NH1 3.35Å; A114-R187 PolarHBondContact O-NH1 3.47Å; A114-R187 PolarHBondContact O-NH2 3.05Å; N183-R187 WeakPolarHBondContact O-CD 3.27Å; N183-R187 VanDerWaalsContact O-CG 3.25Å; N183-R187 WeakPolarHBondContact O-CG 3.21Å; N183-R187 PolarHBondContact O-NE 2.82Å; V184-R187 PolarHBondContact O-N 3.06Å; N185-R187 VanDerWaalsContact C-N 3.29Å; N185-R187 PolarHBondContact O-N 3.22Å; R187-G191 WeakPolarHBondContact O-CA 3.26Å; R187-G191 PolarHBondContact O-N 3.11Å
188	L	95.6	Very high	91.1	Very high	64 Å²	64	50.5 Å²	50.5	34%	0.335	26%	0.26	S	S	.	.	H	α-helix	trans	-66.9	-42.8	175.7	-69.4	175.8	0	0	0	111.3	F176 I179 V184 N185 W186 L190 G191 V192	F176-L188 HydrophobicContact CD1-CB 4.3Å; F176-L188 HydrophobicContact CD1-CD1 4.19Å; F176-L188 HydrophobicContact CD2-CB 4.14Å; F176-L188 HydrophobicContact CE1-CB 4.37Å; F176-L188 HydrophobicContact CE1-CD1 4.28Å; F176-L188 HydrophobicContact CE2-CB 4.2Å; F176-L188 HydrophobicContact CG-CB 4.2Å; F176-L188 HydrophobicContact CZ-CB 4.32Å; I179-L188 HydrophobicContact CD1-CD1 3.65Å; V184-L188 HydrophobicContact CG1-CD1 3.73Å; V184-L188 HydrophobicContact CG1-CG 4.1Å; V184-L188 WeakPolarHBondContact O-CG 3.3Å; V184-L188 PolarHBondContact O-N 2.87Å; V184-L188 VanDerWaalsContact O-N 3.08Å; N185-L188 PolarHBondContact O-N 2.75Å; W186-L188 VanDerWaalsContact C-N 3.34Å; L188-L190 PolarHBondContact O-N 3.23Å; L188-G191 PolarHBondContact O-N 3.21Å; L188-V192 VanDerWaalsContact O-CB 3.27Å; L188-V192 WeakPolarHBondContact O-CB 3.48Å; L188-V192 WeakPolarHBondContact O-CG2 3.46Å; L188-V192 PolarHBondContact O-N 3.48Å
189	M	95.4	Very high	91.2	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-50.9	-55.5	176.2	-66.8	174.2	-171.7	0	0	110.8	Y43 V47 A51 I54 D173 F176 N185 W186	Y43-M189 PolarHBondContact OH-O 3.41Å; V47-M189 HydrophobicContact CG2-CB 3.7Å; V47-M189 WeakPolarHBondContact CG2-O 3.29Å; A51-M189 HydrophobicContact CB-CB 4.39Å; A51-M189 HydrophobicContact CB-SD 4.05Å; I54-M189 HydrophobicContact CD1-CE 3.42Å; I54-M189 VanDerWaalsContact CD1-CE 3.42Å; I54-M189 HydrophobicContact CD1-SD 4.08Å; D173-M189 HydrophobicContact CB-CE 4.41Å; D173-M189 HydrophobicContact CB-SD 4.18Å; D173-M189 WeakPolarHBondContact O-CE 3.46Å; D173-M189 WeakPolarHBondContact OD1-CB 3.37Å; D173-M189 VanDerWaalsContact OD1-CG 3.3Å; D173-M189 WeakPolarHBondContact OD1-CG 3.08Å; F176-M189 HydrophobicContact CB-CE 3.86Å; F176-M189 HydrophobicContact CB-CG 3.99Å; F176-M189 HydrophobicContact CD2-CG 4.01Å; F176-M189 HydrophobicContact CG-CG 4.49Å; N185-M189 HydrophobicContact CB-CE 4.44Å; N185-M189 WeakPolarHBondContact O-CG 3.43Å; N185-M189 PolarHBondContact O-N 3.38Å; W186-M189 WeakPolarHBondContact O-CB 3.38Å; W186-M189 PolarHBondContact O-N 3Å
190	L	96	Very high	91.3	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-75	-40.1	-177.7	-58.8	179.3	0	0	0	113.4	V47 A51 M55 L111 L120 W186 L188 A193	V47-L190 HydrophobicContact CB-CD2 4.5Å; V47-L190 HydrophobicContact CG1-CD2 3.78Å; V47-L190 HydrophobicContact CG2-CD2 3.94Å; A51-L190 HydrophobicContact CB-CD2 4.13Å; A51-L190 HydrophobicContact CB-CG 4.35Å; M55-L190 HydrophobicContact SD-CD1 4Å; L111-L190 HydrophobicContact CB-CB 3.87Å; L111-L190 HydrophobicContact CB-CD1 4.14Å; L111-L190 HydrophobicContact CD2-CD1 4.46Å; L120-L190 HydrophobicContact CD2-CD1 4.25Å; W186-L190 HydrophobicContact CE3-CD1 3.96Å; W186-L190 HydrophobicContact CZ3-CD1 4.26Å; W186-L190 WeakPolarHBondContact O-CG 3.38Å; W186-L190 PolarHBondContact O-N 3.38Å; W186-L190 VanDerWaalsContact O-N 3.1Å; L188-L190 PolarHBondContact O-N 3.23Å; L190-A193 WeakPolarHBondContact O-CB 3.38Å
191	G	95.3	Very high	92	Very high	21 Å²	21	38.9 Å²	38.9	22%	0.216	21%	0.213	C	C	.	.	H	α-helix	trans	-71.1	-34.5	-174.3	0	0	0	0	0	113.8	R187 L188 A193 A194	R187-G191 WeakPolarHBondContact O-CA 3.26Å; R187-G191 PolarHBondContact O-N 3.11Å; L188-G191 PolarHBondContact O-N 3.21Å; G191-A193 PolarHBondContact O-N 3.02Å; G191-A193 VanDerWaalsContact O-N 3.12Å; G191-A194 WeakPolarHBondContact O-CB 3.48Å; G191-A194 PolarHBondContact O-N 3.32Å; G191-A194 VanDerWaalsContact O-N 3.08Å
192	V	95.8	Very high	92.5	Very high	36 Å²	36	39.2 Å²	39.2	22%	0.218	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-21.8	180	164.8	0	0	0	0	112.5	L172 F176 L188 A194 I195 P196	L172-V192 HydrophobicContact CD1-CG1 4.36Å; F176-V192 HydrophobicContact CE2-CG2 4.11Å; F176-V192 HydrophobicContact CZ-CG2 4.1Å; L188-V192 VanDerWaalsContact O-CB 3.27Å; L188-V192 WeakPolarHBondContact O-CB 3.48Å; L188-V192 WeakPolarHBondContact O-CG2 3.46Å; L188-V192 PolarHBondContact O-N 3.48Å; V192-A194 PolarHBondContact O-N 3.07Å; V192-I195 HydrophobicContact CG1-CD1 4.37Å; V192-I195 WeakPolarHBondContact O-CB 3.49Å; V192-I195 PolarHBondContact O-N 3.16Å; V192-P196 VanDerWaalsContact O-CD 3.23Å; V192-P196 WeakPolarHBondContact O-CD 3.27Å
193	A	94.1	Very high	93.1	Very high	10 Å²	10	38 Å²	38	8%	0.083	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-21.1	173.1	0	0	0	0	0	113.9	Y43 S108 L190 G191 I195 P196 A197	Y43-A193 HydrophobicContact CD1-CB 3.72Å; Y43-A193 HydrophobicContact CE1-CB 3.58Å; S108-A193 VanDerWaalsContact OG-CB 3.32Å; S108-A193 WeakPolarHBondContact OG-CB 3.29Å; L190-A193 WeakPolarHBondContact O-CB 3.38Å; G191-A193 PolarHBondContact O-N 3.02Å; G191-A193 VanDerWaalsContact O-N 3.12Å; A193-I195 VanDerWaalsContact C-N 3.27Å; A193-I195 PolarHBondContact O-N 2.98Å; A193-P196 VanDerWaalsContact O-CD 3.29Å; A193-P196 WeakPolarHBondContact O-CD 3.49Å; A193-P196 VanDerWaalsContact O-CG 3.3Å; A193-P196 WeakPolarHBondContact O-CG 3.37Å; A193-A197 PolarHBondContact O-N 3.14Å
194	A	96.1	Very high	93.5	Very high	18 Å²	18	33.9 Å²	33.9	15%	0.149	19%	0.189	C	C	.	.	H	α-helix	trans	-64.2	-30.2	174.1	0	0	0	0	0	113	V109 G191 V192 A197 L198	V109-A194 HydrophobicContact CG2-CB 4.29Å; G191-A194 WeakPolarHBondContact O-CB 3.48Å; G191-A194 PolarHBondContact O-N 3.32Å; G191-A194 VanDerWaalsContact O-N 3.08Å; V192-A194 PolarHBondContact O-N 3.07Å; A194-A197 PolarHBondContact O-N 2.64Å; A194-L198 WeakPolarHBondContact O-CB 3.35Å; A194-L198 PolarHBondContact O-N 2.92Å
195	I	95.1	Very high	93.5	Very high	103 Å²	103	35.5 Å²	35.5	53%	0.528	20%	0.196	S	C	.	.	H	α-helix	trans	-65.3	-57.1	-178.5	-60.8	177.1	0	0	0	112	V192 A193 A197 L198 I199	V192-I195 HydrophobicContact CG1-CD1 4.37Å; V192-I195 WeakPolarHBondContact O-CB 3.49Å; V192-I195 PolarHBondContact O-N 3.16Å; A193-I195 VanDerWaalsContact C-N 3.27Å; A193-I195 PolarHBondContact O-N 2.98Å; I195-A197 PolarHBondContact O-N 3.01Å; I195-L198 WeakPolarHBondContact O-CB 3.4Å; I195-L198 PolarHBondContact O-N 2.89Å; I195-L198 VanDerWaalsContact O-N 3.16Å; I195-I199 HydrophobicContact CG2-CD1 4.17Å; I195-I199 WeakPolarHBondContact O-CG1 3.4Å; I195-I199 PolarHBondContact O-N 3.38Å
196	P	93.1	Very high	93.4	Very high	14 Å²	14	43.5 Å²	43.5	9%	0.091	23%	0.231	C	C	.	.	H	α-helix	trans	-61.8	-30.7	176.7	26	-35.6	0	0	0	111.8	F39 L40 V192 A193 I199 Q200	F39-P196 HydrophobicContact CD1-CB 3.82Å; F39-P196 HydrophobicContact CD1-CG 4.34Å; F39-P196 HydrophobicContact CE1-CB 3.55Å; F39-P196 HydrophobicContact CE1-CG 3.79Å; L40-P196 HydrophobicContact CD2-CB 3.72Å; L40-P196 HydrophobicContact CD2-CG 3.75Å; V192-P196 VanDerWaalsContact O-CD 3.23Å; V192-P196 WeakPolarHBondContact O-CD 3.27Å; A193-P196 VanDerWaalsContact O-CD 3.29Å; A193-P196 WeakPolarHBondContact O-CD 3.49Å; A193-P196 VanDerWaalsContact O-CG 3.3Å; A193-P196 WeakPolarHBondContact O-CG 3.37Å; P196-I199 PolarHBondContact O-N 3.33Å; P196-Q200 PolarHBondContact O-N 3.31Å
197	A	94.3	Very high	93.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-68	-38.4	176.6	0	0	0	0	0	111.8	L40 F104 I105 A193 A194 I195 Q200 L201	L40-A197 HydrophobicContact CD1-CB 3.97Å; L40-A197 HydrophobicContact CD2-CB 3.93Å; F104-A197 HydrophobicContact CB-CB 3.85Å; I105-A197 HydrophobicContact CG1-CB 3.62Å; A193-A197 PolarHBondContact O-N 3.14Å; A194-A197 PolarHBondContact O-N 2.64Å; I195-A197 PolarHBondContact O-N 3.01Å; A197-Q200 PolarHBondContact O-N 3.37Å; A197-L201 WeakPolarHBondContact O-CB 3.19Å; A197-L201 PolarHBondContact O-N 3.05Å
198	L	95.1	Very high	92.8	Very high	87 Å²	87	43.3 Å²	43.3	46%	0.455	24%	0.236	S	C	.	.	H	α-helix	trans	-66.2	-42.3	172.9	-178.7	62.2	0	0	0	112.1	I105 A194 I195 Q200 L201 I202	I105-L198 HydrophobicContact CD1-CB 4.23Å; I105-L198 HydrophobicContact CD1-CD1 4.27Å; A194-L198 WeakPolarHBondContact O-CB 3.35Å; A194-L198 PolarHBondContact O-N 2.92Å; I195-L198 WeakPolarHBondContact O-CB 3.4Å; I195-L198 PolarHBondContact O-N 2.89Å; I195-L198 VanDerWaalsContact O-N 3.16Å; L198-Q200 VanDerWaalsContact C-N 3.29Å; L198-Q200 PolarHBondContact O-N 3.14Å; L198-L201 HydrophobicContact CD1-CD2 4.43Å; L198-L201 PolarHBondContact O-N 3.33Å; L198-I202 HydrophobicContact CD1-CD1 4.12Å; L198-I202 HydrophobicContact CD1-CG1 4.33Å; L198-I202 HydrophobicContact CG-CD1 4.06Å; L198-I202 WeakPolarHBondContact O-CG1 3.26Å; L198-I202 PolarHBondContact O-N 3.06Å
199	I	92.5	Very high	92.7	Very high	98 Å²	98	41.3 Å²	41.3	50%	0.503	23%	0.225	S	C	.	.	H	α-helix	trans	-58.9	-45.6	174.5	-67	168.8	0	0	0	109.8	I195 P196 G203	I195-I199 HydrophobicContact CG2-CD1 4.17Å; I195-I199 WeakPolarHBondContact O-CG1 3.4Å; I195-I199 PolarHBondContact O-N 3.38Å; P196-I199 PolarHBondContact O-N 3.33Å; I199-G203 PolarHBondContact O-N 3.24Å
200	Q	91.4	Very high	92.4	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-63	-46.1	176.8	-171.4	178.8	1.7	0	0	111.6	M33 M36 S37 P196 A197 L198 I202 G203 F204	M33-Q200 HydrophobicContact CE-CG 4.44Å; M33-Q200 PolarHBondContact O-NE2 3.28Å; M36-Q200 HydrophobicContact CB-CB 4.43Å; M36-Q200 HydrophobicContact CB-CG 4.13Å; S37-Q200 VanDerWaalsContact CA-OE1 3.25Å; S37-Q200 PolarHBondContact OG-NE2 2.91Å; S37-Q200 PolarHBondContact OG-OE1 3.45Å; P196-Q200 PolarHBondContact O-N 3.31Å; A197-Q200 PolarHBondContact O-N 3.37Å; L198-Q200 VanDerWaalsContact C-N 3.29Å; L198-Q200 PolarHBondContact O-N 3.14Å; Q200-I202 VanDerWaalsContact C-N 3.35Å; Q200-I202 PolarHBondContact O-N 3.5Å; Q200-G203 PolarHBondContact O-N 3.43Å; Q200-F204 VanDerWaalsContact O-CB 3.24Å; Q200-F204 WeakPolarHBondContact O-CB 3.4Å; Q200-F204 PolarHBondContact O-N 2.89Å
201	L	93.8	Very high	92.1	Very high	34 Å²	34	41.2 Å²	41.2	18%	0.178	22%	0.224	C	C	.	.	H	α-helix	trans	-54.1	-52.6	178.7	-180	64.5	0	0	0	110.8	L98 C101 V102 I105 A197 L198 F204 L205	L98-L201 HydrophobicContact CD2-CD1 3.8Å; C101-L201 HydrophobicContact CB-CB 3.89Å; C101-L201 HydrophobicContact CB-CD1 3.85Å; C101-L201 HydrophobicContact CB-CG 4.44Å; V102-L201 HydrophobicContact CG2-CD1 4.19Å; V102-L201 HydrophobicContact CG2-CD2 4.4Å; I105-L201 HydrophobicContact CD1-CB 4.35Å; I105-L201 HydrophobicContact CD1-CD2 3.79Å; A197-L201 WeakPolarHBondContact O-CB 3.19Å; A197-L201 PolarHBondContact O-N 3.05Å; L198-L201 HydrophobicContact CD1-CD2 4.43Å; L198-L201 PolarHBondContact O-N 3.33Å; L201-F204 PolarHBondContact O-N 2.93Å; L201-L205 WeakPolarHBondContact O-CG 3.36Å; L201-L205 PolarHBondContact O-N 3.48Å
202	I	92.3	Very high	91.7	Very high	89 Å²	89	41.2 Å²	41.2	46%	0.456	22%	0.218	S	C	.	.	H	α-helix	trans	-61.1	-49.5	-178.8	-66.4	168.7	0	0	0	110.7	L198 Q200 F204 L205 F206	L198-I202 HydrophobicContact CD1-CD1 4.12Å; L198-I202 HydrophobicContact CD1-CG1 4.33Å; L198-I202 HydrophobicContact CG-CD1 4.06Å; L198-I202 WeakPolarHBondContact O-CG1 3.26Å; L198-I202 PolarHBondContact O-N 3.06Å; Q200-I202 VanDerWaalsContact C-N 3.35Å; Q200-I202 PolarHBondContact O-N 3.5Å; I202-F204 VanDerWaalsContact C-N 3.31Å; I202-F204 PolarHBondContact O-N 2.7Å; I202-L205 WeakPolarHBondContact O-CB 3.5Å; I202-L205 PolarHBondContact O-N 3.04Å; I202-F206 HydrophobicContact CG2-CE2 4.27Å; I202-F206 VanDerWaalsContact O-CD2 3.23Å; I202-F206 WeakPolarHBondContact O-CD2 3.48Å; I202-F206 VanDerWaalsContact O-CE2 3.31Å; I202-F206 WeakPolarHBondContact O-CE2 3.33Å
203	G	88.6	Confident	91.4	Very high	17 Å²	17	40.6 Å²	40.6	18%	0.175	21%	0.212	C	C	.	.	H	α-helix	trans	-68.1	-31.3	-178.4	0	0	0	0	0	113	M33 I199 Q200 F206	M33-G203 VanDerWaalsContact CE-CA 3.41Å; I199-G203 PolarHBondContact O-N 3.24Å; Q200-G203 PolarHBondContact O-N 3.43Å; G203-F206 PolarHBondContact O-N 2.91Å
204	F	89.9	Confident	91.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-75.5	-21.3	179.5	-148.7	-84	0	0	0	113.2	A34 K94 I97 L98 Y141 Q200 L201 I202 F206 M207	A34-F204 HydrophobicContact CB-CE2 4.37Å; K94-F204 HydrophobicContact CB-CE1 4.21Å; K94-F204 HydrophobicContact CG-CD1 4.31Å; K94-F204 HydrophobicContact CG-CE1 3.98Å; I97-F204 HydrophobicContact CB-CD1 4.15Å; I97-F204 HydrophobicContact CB-CE1 3.84Å; I97-F204 HydrophobicContact CB-CE2 4.49Å; I97-F204 HydrophobicContact CB-CZ 4.03Å; I97-F204 HydrophobicContact CD1-CE1 3.93Å; I97-F204 HydrophobicContact CD1-CE2 3.89Å; I97-F204 HydrophobicContact CD1-CZ 3.32Å; I97-F204 HydrophobicContact CG1-CE1 4.48Å; I97-F204 HydrophobicContact CG1-CZ 4.26Å; I97-F204 HydrophobicContact CG2-CD1 3.77Å; I97-F204 HydrophobicContact CG2-CD2 3.8Å; I97-F204 HydrophobicContact CG2-CE1 3.82Å; I97-F204 HydrophobicContact CG2-CE2 3.82Å; I97-F204 HydrophobicContact CG2-CG 3.78Å; I97-F204 HydrophobicContact CG2-CZ 3.84Å; L98-F204 HydrophobicContact CD2-CB 4.04Å; L98-F204 HydrophobicContact CD2-CD1 4.17Å; L98-F204 HydrophobicContact CG-CD1 4.23Å; Y141-F204 HydrophobicContact CD1-CE2 4.49Å; Y141-F204 HydrophobicContact CD1-CZ 4.22Å; Y141-F204 HydrophobicContact CE1-CE2 4.05Å; Y141-F204 AromaticContact CE1-CZ 3.81Å; Y141-F204 HydrophobicContact CE1-CZ 3.81Å; Y141-F204 HydrophobicContact CE2-CZ 4.19Å; Y141-F204 AromaticContact CZ-CZ 3.79Å; Q200-F204 VanDerWaalsContact O-CB 3.24Å; Q200-F204 WeakPolarHBondContact O-CB 3.4Å; Q200-F204 PolarHBondContact O-N 2.89Å; L201-F204 PolarHBondContact O-N 2.93Å; I202-F204 VanDerWaalsContact C-N 3.31Å; I202-F204 PolarHBondContact O-N 2.7Å; F204-F206 PolarHBondContact O-N 3.21Å; F204-M207 HydrophobicContact CD1-CB 4.3Å; F204-M207 HydrophobicContact CD2-CB 4.49Å; F204-M207 HydrophobicContact CD2-CG 4.05Å; F204-M207 HydrophobicContact CE1-CB 4.2Å; F204-M207 HydrophobicContact CE2-CB 4.43Å; F204-M207 HydrophobicContact CE2-CG 4.29Å; F204-M207 HydrophobicContact CG-CB 4.42Å; F204-M207 HydrophobicContact CG-CG 4.2Å; F204-M207 HydrophobicContact CZ-CB 4.28Å; F204-M207 WeakPolarHBondContact O-CB 3.32Å; F204-M207 PolarHBondContact O-N 2.86Å; F204-M207 VanDerWaalsContact O-N 3.07Å
205	L	90.7	Very high	90.9	Very high	92 Å²	92	39.4 Å²	39.4	48%	0.482	20%	0.201	S	C	.	.	H	α-helix	trans	-56.7	-35	173.8	-73.3	170.9	0	0	0	112.2	K94 L98 L201 I202 M207	K94-L205 PolarHBondContact NZ-O 2.65Å; L98-L205 HydrophobicContact CD1-CD2 4.13Å; L98-L205 HydrophobicContact CD2-CD2 3.92Å; L98-L205 HydrophobicContact CD2-CG 4.23Å; L201-L205 WeakPolarHBondContact O-CG 3.36Å; L201-L205 PolarHBondContact O-N 3.48Å; I202-L205 WeakPolarHBondContact O-CB 3.5Å; I202-L205 PolarHBondContact O-N 3.04Å; L205-M207 VanDerWaalsContact C-N 3.32Å
206	F	88.5	Confident	90.3	Very high	170 Å²	170	38.4 Å²	38.4	75%	0.746	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-4.2	-179.1	-56.8	-74.8	0	0	0	114	I202 G203 F204	I202-F206 HydrophobicContact CG2-CE2 4.27Å; I202-F206 VanDerWaalsContact O-CD2 3.23Å; I202-F206 WeakPolarHBondContact O-CD2 3.48Å; I202-F206 VanDerWaalsContact O-CE2 3.31Å; I202-F206 WeakPolarHBondContact O-CE2 3.33Å; G203-F206 PolarHBondContact O-N 2.91Å; F204-F206 PolarHBondContact O-N 3.21Å
207	M	86	Confident	90	Very high	13 Å²	13	41.8 Å²	41.8	6%	0.064	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-82.8	147.8	-177.4	-58.3	-51.8	-41.5	0	0	112.1	V29 L30 M33 K94 F204 L205	V29-M207 HydrophobicContact CG1-SD 4.25Å; L30-M207 HydrophobicContact CB-CE 3.34Å; L30-M207 HydrophobicContact CD1-CE 3.67Å; L30-M207 HydrophobicContact CG-CE 3.42Å; L30-M207 VanDerWaalsContact CG-CE 3.42Å; M33-M207 HydrophobicContact CB-CG 4.25Å; M33-M207 HydrophobicContact CB-SD 4.11Å; M33-M207 HydrophobicContact CG-SD 4.17Å; K94-M207 VanDerWaalsContact CD-O 3.3Å; K94-M207 WeakPolarHBondContact CD-O 3.24Å; K94-M207 WeakPolarHBondContact CE-O 3.4Å; K94-M207 PolarHBondContact NZ-O 3.1Å; F204-M207 HydrophobicContact CD1-CB 4.3Å; F204-M207 HydrophobicContact CD2-CB 4.49Å; F204-M207 HydrophobicContact CD2-CG 4.05Å; F204-M207 HydrophobicContact CE1-CB 4.2Å; F204-M207 HydrophobicContact CE2-CB 4.43Å; F204-M207 HydrophobicContact CE2-CG 4.29Å; F204-M207 HydrophobicContact CG-CB 4.42Å; F204-M207 HydrophobicContact CG-CG 4.2Å; F204-M207 HydrophobicContact CZ-CB 4.28Å; F204-M207 WeakPolarHBondContact O-CB 3.32Å; F204-M207 PolarHBondContact O-N 2.86Å; F204-M207 VanDerWaalsContact O-N 3.07Å; L205-M207 VanDerWaalsContact C-N 3.32Å
208	P	89.6	Confident	89.6	Confident	41 Å²	41	44.5 Å²	44.5	27%	0.266	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-75.2	170	175.8	33.2	-32.9	0	0	0	111	L30 Y141 I226	L30-P208 HydrophobicContact CD1-CG 3.96Å; Y141-P208 PolarHBondContact OH-O 3.26Å; Y141-P208 VanDerWaalsContact OH-O 3.07Å; P208-I226 HydrophobicContact CB-CD1 3.84Å; P208-I226 HydrophobicContact CB-CG1 4.06Å
209	E	92.2	Very high	89.3	Confident	21 Å²	21	45.4 Å²	45.4	10%	0.098	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-79.8	162.7	167.8	-175.5	53.9	-94.2	0	0	110.3	G92 R93 K94 W213 L214	G92-E209 WeakPolarHBondContact CA-OE2 3.23Å; R93-E209 WeakPolarHBondContact CA-OE1 3.11Å; R93-E209 WeakPolarHBondContact CB-OE1 3.21Å; R93-E209 VanDerWaalsContact N-CD 3.31Å; R93-E209 PolarHBondContact N-OE1 2.86Å; R93-E209 PolarHBondContact N-OE2 2.67Å; K94-E209 VanDerWaalsContact CB-OE2 3.26Å; K94-E209 WeakPolarHBondContact CB-OE2 3.27Å; K94-E209 PolarHBondContact N-OE1 3.4Å; K94-E209 PolarHBondContact N-OE2 3Å; E209-W213 HydrophobicContact CG-CD2 4.3Å; E209-W213 HydrophobicContact CG-CE3 3.41Å; E209-W213 VanDerWaalsContact CG-CE3 3.41Å; E209-W213 HydrophobicContact CG-CZ3 3.76Å; E209-L214 HydrophobicContact CB-CD1 4.15Å; E209-L214 HydrophobicContact CB-CD2 4.35Å; E209-L214 HydrophobicContact CB-CG 4.23Å; E209-L214 HydrophobicContact CG-CD2 4.22Å; E209-L214 HydrophobicContact CG-CG 4.12Å
210	S	89.9	Confident	89.2	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-58	126.4	174.7	163.4	0	0	0	0	111.7	E144 R212 W213 L214	E144-S210 VanDerWaalsContact CB-OG 3.31Å; E144-S210 WeakPolarHBondContact CB-OG 3.09Å; E144-S210 WeakPolarHBondContact OE2-CB 3.2Å; E144-S210 PolarHBondContact OE2-OG 3.11Å; S210-R212 VanDerWaalsContact C-N 3.28Å; S210-R212 PolarHBondContact O-N 3.05Å; S210-R212 PolarHBondContact OG-N 2.9Å; S210-W213 PolarHBondContact O-N 3.24Å; S210-W213 PolarHBondContact OG-N 2.93Å; S210-L214 WeakPolarHBondContact O-CG 3.49Å; S210-L214 PolarHBondContact O-N 3.26Å
211	P	90	Very high	89.1	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-64.9	-34.1	178.8	26.8	-33.8	0	0	0	111.7	E144 L214 A215 A223 I226 F227 I230	E144-P211 WeakPolarHBondContact O-CG 3.11Å; P211-L214 PolarHBondContact O-N 3.39Å; P211-A215 WeakPolarHBondContact O-CB 3.47Å; P211-A215 PolarHBondContact O-N 3.47Å; P211-A223 HydrophobicContact CB-CB 4.48Å; P211-A223 VanDerWaalsContact O-CB 3.28Å; P211-A223 WeakPolarHBondContact O-CB 3.48Å; P211-I226 HydrophobicContact CB-CB 4.07Å; P211-I226 HydrophobicContact CB-CG2 3.83Å; P211-I226 HydrophobicContact CG-CG2 3.92Å; P211-F227 HydrophobicContact CB-CD1 4.12Å; P211-F227 HydrophobicContact CB-CD2 3.92Å; P211-F227 HydrophobicContact CB-CE1 3.97Å; P211-F227 HydrophobicContact CB-CE2 3.77Å; P211-F227 HydrophobicContact CB-CG 4.09Å; P211-F227 HydrophobicContact CB-CZ 3.79Å; P211-F227 HydrophobicContact CG-CD1 4.08Å; P211-F227 HydrophobicContact CG-CE1 3.76Å; P211-F227 HydrophobicContact CG-CE2 4.42Å; P211-F227 HydrophobicContact CG-CZ 3.95Å; P211-I230 HydrophobicContact CG-CD1 4.23Å
212	R	87.7	Confident	89	Confident	21 Å²	21	53 Å²	53	8%	0.079	28%	0.276	C	S	.	.	H	α-helix	trans	-68.2	-38.3	177.2	-67.4	-173.2	173.7	-140.9	-5.1	111.7	E144 S210 N216 F227 I248 N514 E579	E144-R212 HydrophobicContact CB-CB 4.26Å; E144-R212 HydrophobicContact CB-CG 4.33Å; E144-R212 HydrophobicContact CG-CB 4.17Å; E144-R212 HydrophobicContact CG-CG 4.45Å; S210-R212 VanDerWaalsContact C-N 3.28Å; S210-R212 PolarHBondContact O-N 3.05Å; S210-R212 PolarHBondContact OG-N 2.9Å; R212-N216 WeakPolarHBondContact O-CB 3.29Å; R212-N216 VanDerWaalsContact O-CG 3.29Å; R212-N216 PolarHBondContact O-N 3.02Å; R212-F227 HydrophobicContact CG-CZ 3.89Å; R212-I248 HydrophobicContact CG-CD1 4.05Å; R212-N514 PolarHBondContact NH1-OD1 2.76Å; R212-E579 IonicContact NH1-OE1 2.82Å
213	W	87.8	Confident	88.9	Confident	24 Å²	24	48.8 Å²	48.8	9%	0.091	25%	0.254	C	S	.	.	H	α-helix	trans	-69	-39.8	174.3	-179.2	80.8	0	0	0	112.2	N88 D89 G92 E209 S210 N216 N217	N88-W213 PolarHBondContact O-NE1 3.5Å; D89-W213 PolarHBondContact O-NE1 3.07Å; G92-W213 VanDerWaalsContact N-CZ2 3.3Å; E209-W213 HydrophobicContact CG-CD2 4.3Å; E209-W213 HydrophobicContact CG-CE3 3.41Å; E209-W213 VanDerWaalsContact CG-CE3 3.41Å; E209-W213 HydrophobicContact CG-CZ3 3.76Å; S210-W213 PolarHBondContact O-N 3.24Å; S210-W213 PolarHBondContact OG-N 2.93Å; W213-N216 PolarHBondContact O-N 2.88Å; W213-N217 WeakPolarHBondContact CZ2-ND2 3.28Å; W213-N217 PolarHBondContact NE1-ND2 3.27Å; W213-N217 VanDerWaalsContact NE1-ND2 3.16Å; W213-N217 PolarHBondContact O-N 3.14Å; W213-N217 VanDerWaalsContact O-N 3.1Å; W213-N217 PolarHBondContact O-ND2 3Å
214	L	90.9	Very high	89	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-61.4	-47.7	175.4	-71.9	169.6	0	0	0	111.7	E209 S210 P211 N216 N217 G218 R219 E222 A223 I226	E209-L214 HydrophobicContact CB-CD1 4.15Å; E209-L214 HydrophobicContact CB-CD2 4.35Å; E209-L214 HydrophobicContact CB-CG 4.23Å; E209-L214 HydrophobicContact CG-CD2 4.22Å; E209-L214 HydrophobicContact CG-CG 4.12Å; S210-L214 WeakPolarHBondContact O-CG 3.49Å; S210-L214 PolarHBondContact O-N 3.26Å; P211-L214 PolarHBondContact O-N 3.39Å; L214-N216 VanDerWaalsContact C-N 3.31Å; L214-N216 PolarHBondContact O-N 2.74Å; L214-N217 CarbonylContact O-C 3.59Å; L214-N217 PolarHBondContact O-N 2.89Å; L214-N217 VanDerWaalsContact O-N 3.14Å; L214-G218 PolarHBondContact O-N 3.49Å; L214-R219 HydrophobicContact CB-CB 4.17Å; L214-R219 HydrophobicContact CD2-CB 4.07Å; L214-R219 WeakPolarHBondContact O-CA 3.36Å; L214-R219 WeakPolarHBondContact O-CB 3.38Å; L214-R219 PolarHBondContact O-N 3.43Å; L214-E222 HydrophobicContact CD1-CB 4.14Å; L214-A223 HydrophobicContact CB-CB 3.97Å; L214-I226 HydrophobicContact CD1-CD1 3.37Å
215	A	88.5	Confident	88.9	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.008	28%	0.283	C	S	.	.	H	α-helix	trans	-59.3	-43	174.8	0	0	0	0	0	111.5	P211 N217 G218 A223 L245 I248	P211-A215 WeakPolarHBondContact O-CB 3.47Å; P211-A215 PolarHBondContact O-N 3.47Å; A215-N217 PolarHBondContact O-N 3.38Å; A215-G218 PolarHBondContact O-N 2.84Å; A215-G218 VanDerWaalsContact O-N 3.08Å; A215-A223 HydrophobicContact CB-CB 3.94Å; A215-L245 HydrophobicContact CB-CD2 3.84Å; A215-I248 HydrophobicContact CB-CD1 4.35Å; A215-I248 HydrophobicContact CB-CG2 4.02Å
216	N	83.1	Confident	88.8	Confident	82 Å²	82	52.1 Å²	52.1	44%	0.439	27%	0.265	S	S	.	.	H	α-helix	trans	-61.4	-27.9	177.4	-81.3	-14.1	0	0	0	113.9	R212 W213 L214 Q252	R212-N216 WeakPolarHBondContact O-CB 3.29Å; R212-N216 VanDerWaalsContact O-CG 3.29Å; R212-N216 PolarHBondContact O-N 3.02Å; W213-N216 PolarHBondContact O-N 2.88Å; L214-N216 VanDerWaalsContact C-N 3.31Å; L214-N216 PolarHBondContact O-N 2.74Å; N216-Q252 VanDerWaalsContact CA-NE2 3.31Å; N216-Q252 PolarHBondContact O-NE2 3.37Å; N216-Q252 VanDerWaalsContact O-NE2 3.13Å
217	N	86.7	Confident	88.7	Confident	86 Å²	86	44.2 Å²	44.2	46%	0.46	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	20	177.5	-74.7	-44.1	0	0	0	113.6	W213 L214 A215 R219	W213-N217 WeakPolarHBondContact CZ2-ND2 3.28Å; W213-N217 PolarHBondContact NE1-ND2 3.27Å; W213-N217 VanDerWaalsContact NE1-ND2 3.16Å; W213-N217 PolarHBondContact O-N 3.14Å; W213-N217 VanDerWaalsContact O-N 3.1Å; W213-N217 PolarHBondContact O-ND2 3Å; L214-N217 CarbonylContact O-C 3.59Å; L214-N217 PolarHBondContact O-N 2.89Å; L214-N217 VanDerWaalsContact O-N 3.14Å; A215-N217 PolarHBondContact O-N 3.38Å; N217-R219 PolarHBondContact O-N 3.02Å
218	G	85.7	Confident	88.6	Confident	56 Å²	56	44.3 Å²	44.3	58%	0.577	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.2	3.3	175.6	0	0	0	0	0	115.1	L214 A215 T220	L214-G218 PolarHBondContact O-N 3.49Å; A215-G218 PolarHBondContact O-N 2.84Å; A215-G218 VanDerWaalsContact O-N 3.08Å; G218-T220 PolarHBondContact O-N 3.31Å
219	R	90.1	Very high	88.3	Confident	107 Å²	107	43.6 Å²	43.6	40%	0.404	23%	0.228	S	C	.	.			trans	-86.3	60.2	176.2	-62.7	174.2	71.1	-171.4	10.3	110.3	L214 N217 E221 E222 A223	L214-R219 HydrophobicContact CB-CB 4.17Å; L214-R219 HydrophobicContact CD2-CB 4.07Å; L214-R219 WeakPolarHBondContact O-CA 3.36Å; L214-R219 WeakPolarHBondContact O-CB 3.38Å; L214-R219 PolarHBondContact O-N 3.43Å; N217-R219 PolarHBondContact O-N 3.02Å; R219-E221 PolarHBondContact O-N 3.42Å; R219-E222 VanDerWaalsContact CZ-CD 3.48Å; R219-E222 IonicContact CZ-OE1 3.66Å; R219-E222 IonicContact CZ-OE2 3.89Å; R219-E222 IonicContact NE-OE1 2.76Å; R219-E222 PolarHBondContact NE-OE1 2.9Å; R219-E222 IonicContact NE-OE2 3.54Å; R219-E222 IonicContact NH2-OE1 3.17Å; R219-E222 PolarHBondContact NH2-OE1 3.4Å; R219-E222 IonicContact NH2-OE2 3.87Å; R219-E222 PolarHBondContact NH2-OE2 2.71Å; R219-A223 WeakPolarHBondContact O-CB 3.4Å; R219-A223 PolarHBondContact O-N 3.45Å; R219-A223 VanDerWaalsContact O-N 3.14Å
220	T	89.5	Confident	87.7	Confident	49 Å²	49	43 Å²	43	30%	0.301	23%	0.225	S	C	.	.	H	α-helix	trans	-69.1	-31.9	-171.7	50.5	0	0	0	0	113.9	G218 A223 F224	G218-T220 PolarHBondContact O-N 3.31Å; T220-A223 PolarHBondContact O-N 3.21Å; T220-F224 WeakPolarHBondContact O-CB 3.25Å; T220-F224 PolarHBondContact O-N 2.88Å
221	E	90.4	Very high	87.3	Confident	161 Å²	161	43.6 Å²	43.6	75%	0.752	23%	0.228	S	C	*	.	H	α-helix	trans	-66.2	-49.7	178.5	-66.5	-177.6	171	0	0	111	R219 A223 F224 D225	R219-E221 PolarHBondContact O-N 3.42Å; E221-A223 VanDerWaalsContact C-N 3.3Å; E221-A223 PolarHBondContact O-N 3.14Å; E221-F224 WeakPolarHBondContact O-CB 3.3Å; E221-F224 PolarHBondContact O-N 2.82Å; E221-F224 VanDerWaalsContact O-N 3.1Å; E221-D225 PolarHBondContact O-N 3.35Å
222	E	91.4	Very high	86.7	Confident	82 Å²	82	44.1 Å²	44.1	38%	0.383	23%	0.233	S	C	.	.	H	α-helix	trans	-63.9	-37.3	176.6	-64.3	-178.9	-125	0	0	112.3	L214 R219 F224 D225 I226	L214-E222 HydrophobicContact CD1-CB 4.14Å; R219-E222 VanDerWaalsContact CZ-CD 3.48Å; R219-E222 IonicContact CZ-OE1 3.66Å; R219-E222 IonicContact CZ-OE2 3.89Å; R219-E222 IonicContact NE-OE1 2.76Å; R219-E222 PolarHBondContact NE-OE1 2.9Å; R219-E222 IonicContact NE-OE2 3.54Å; R219-E222 IonicContact NH2-OE1 3.17Å; R219-E222 PolarHBondContact NH2-OE1 3.4Å; R219-E222 IonicContact NH2-OE2 3.87Å; R219-E222 PolarHBondContact NH2-OE2 2.71Å; E222-F224 VanDerWaalsContact C-N 3.3Å; E222-F224 PolarHBondContact O-N 2.81Å; E222-D225 PolarHBondContact O-N 3.07Å; E222-I226 WeakPolarHBondContact O-CD1 3.49Å; E222-I226 WeakPolarHBondContact O-CG1 3.42Å; E222-I226 PolarHBondContact O-N 3.07Å; E222-I226 VanDerWaalsContact O-N 3.1Å
223	A	89.5	Confident	86.2	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-61.2	-41.5	173.8	0	0	0	0	0	111.4	P211 L214 A215 R219 T220 E221 I226 F227 L245	P211-A223 HydrophobicContact CB-CB 4.48Å; P211-A223 VanDerWaalsContact O-CB 3.28Å; P211-A223 WeakPolarHBondContact O-CB 3.48Å; L214-A223 HydrophobicContact CB-CB 3.97Å; A215-A223 HydrophobicContact CB-CB 3.94Å; R219-A223 WeakPolarHBondContact O-CB 3.4Å; R219-A223 PolarHBondContact O-N 3.45Å; R219-A223 VanDerWaalsContact O-N 3.14Å; T220-A223 PolarHBondContact O-N 3.21Å; E221-A223 VanDerWaalsContact C-N 3.3Å; E221-A223 PolarHBondContact O-N 3.14Å; A223-I226 PolarHBondContact O-N 3.42Å; A223-F227 WeakPolarHBondContact O-CB 3.41Å; A223-F227 WeakPolarHBondContact O-CD2 3.13Å; A223-F227 PolarHBondContact O-N 2.96Å; A223-L245 HydrophobicContact CB-CD2 3.98Å
224	F	91.1	Very high	85.9	Confident	56 Å²	56	52.3 Å²	52.3	25%	0.246	28%	0.28	C	S	.	.	H	α-helix	trans	-63.6	-44.2	176.8	-178.4	-107	0	0	0	112.2	T220 E221 E222 I226 F227 T228 V238 A241 K242 L245	T220-F224 WeakPolarHBondContact O-CB 3.25Å; T220-F224 PolarHBondContact O-N 2.88Å; E221-F224 WeakPolarHBondContact O-CB 3.3Å; E221-F224 PolarHBondContact O-N 2.82Å; E221-F224 VanDerWaalsContact O-N 3.1Å; E222-F224 VanDerWaalsContact C-N 3.3Å; E222-F224 PolarHBondContact O-N 2.81Å; F224-I226 VanDerWaalsContact C-N 3.29Å; F224-I226 PolarHBondContact O-N 2.99Å; F224-F227 PolarHBondContact O-N 3.47Å; F224-T228 HydrophobicContact CD1-CG2 4.27Å; F224-T228 HydrophobicContact CD2-CG2 4.18Å; F224-T228 HydrophobicContact CE1-CG2 3.86Å; F224-T228 HydrophobicContact CE2-CG2 3.73Å; F224-T228 HydrophobicContact CG-CG2 4.44Å; F224-T228 HydrophobicContact CZ-CG2 3.58Å; F224-T228 WeakPolarHBondContact O-CB 3.46Å; F224-T228 WeakPolarHBondContact O-CG2 3.39Å; F224-T228 PolarHBondContact O-N 3.36Å; F224-T228 PolarHBondContact O-OG1 3.12Å; F224-V238 HydrophobicContact CZ-CG1 4.06Å; F224-A241 HydrophobicContact CD2-CB 4.12Å; F224-A241 HydrophobicContact CE2-CB 3.96Å; F224-K242 HydrophobicContact CD2-CG 4.45Å; F224-K242 HydrophobicContact CE2-CG 3.71Å; F224-K242 HydrophobicContact CZ-CG 4.48Å; F224-L245 HydrophobicContact CB-CD1 3.69Å; F224-L245 HydrophobicContact CD2-CD1 3.71Å; F224-L245 HydrophobicContact CG-CD1 4.17Å
225	D	88.3	Confident	85.4	Confident	102 Å²	102	58.7 Å²	58.7	55%	0.545	31%	0.31	S	S	.	.	H	α-helix	trans	-61.5	-37.9	177.2	-70.3	-17.8	0	0	0	112.1	E221 E222 T228 S229	E221-D225 PolarHBondContact O-N 3.35Å; E222-D225 PolarHBondContact O-N 3.07Å; D225-T228 WeakPolarHBondContact CA-OG1 3.28Å; D225-T228 PolarHBondContact O-OG1 3.3Å; D225-S229 WeakPolarHBondContact O-CB 3.31Å; D225-S229 PolarHBondContact O-N 2.83Å
226	I	87.1	Confident	84.9	Confident	21 Å²	21	60.4 Å²	60.4	11%	0.108	32%	0.32	C	S	.	.	H	α-helix	trans	-73.3	-44.8	177.2	-66.5	160.7	0	0	0	110.7	P208 P211 L214 E222 A223 F224 T228 S229 I230	P208-I226 HydrophobicContact CB-CD1 3.84Å; P208-I226 HydrophobicContact CB-CG1 4.06Å; P211-I226 HydrophobicContact CB-CB 4.07Å; P211-I226 HydrophobicContact CB-CG2 3.83Å; P211-I226 HydrophobicContact CG-CG2 3.92Å; L214-I226 HydrophobicContact CD1-CD1 3.37Å; E222-I226 WeakPolarHBondContact O-CD1 3.49Å; E222-I226 WeakPolarHBondContact O-CG1 3.42Å; E222-I226 PolarHBondContact O-N 3.07Å; E222-I226 VanDerWaalsContact O-N 3.1Å; A223-I226 PolarHBondContact O-N 3.42Å; F224-I226 VanDerWaalsContact C-N 3.29Å; F224-I226 PolarHBondContact O-N 2.99Å; I226-T228 PolarHBondContact O-N 3.04Å; I226-S229 WeakPolarHBondContact O-CB 3.23Å; I226-S229 PolarHBondContact O-N 2.93Å; I226-S229 VanDerWaalsContact O-N 3.13Å; I226-S229 PolarHBondContact O-OG 2.71Å; I226-I230 HydrophobicContact CG2-CD1 3.82Å; I226-I230 HydrophobicContact CG2-CG1 4.49Å; I226-I230 WeakPolarHBondContact O-CG1 3.47Å; I226-I230 PolarHBondContact O-N 3.26Å
227	F	86.3	Confident	84.8	Confident	4 Å²	4	56.5 Å²	56.5	2%	0.018	30%	0.3	C	S	.	.	H	α-helix	trans	-59.8	-43.8	176.3	-82.1	-55	0	0	0	112.4	P211 R212 A223 F224 S229 I230 Y231 A241 D244 L245 I248	P211-F227 HydrophobicContact CB-CD1 4.12Å; P211-F227 HydrophobicContact CB-CD2 3.92Å; P211-F227 HydrophobicContact CB-CE1 3.97Å; P211-F227 HydrophobicContact CB-CE2 3.77Å; P211-F227 HydrophobicContact CB-CG 4.09Å; P211-F227 HydrophobicContact CB-CZ 3.79Å; P211-F227 HydrophobicContact CG-CD1 4.08Å; P211-F227 HydrophobicContact CG-CE1 3.76Å; P211-F227 HydrophobicContact CG-CE2 4.42Å; P211-F227 HydrophobicContact CG-CZ 3.95Å; R212-F227 HydrophobicContact CG-CZ 3.89Å; A223-F227 WeakPolarHBondContact O-CB 3.41Å; A223-F227 WeakPolarHBondContact O-CD2 3.13Å; A223-F227 PolarHBondContact O-N 2.96Å; F224-F227 PolarHBondContact O-N 3.47Å; F227-S229 VanDerWaalsContact C-N 3.31Å; F227-S229 PolarHBondContact O-N 3.39Å; F227-I230 PolarHBondContact O-N 2.94Å; F227-I230 VanDerWaalsContact O-N 3.14Å; F227-Y231 HydrophobicContact CB-CD2 4.38Å; F227-Y231 HydrophobicContact CB-CE2 4.44Å; F227-Y231 AromaticContact CD1-CE2 3.86Å; F227-Y231 HydrophobicContact CD1-CE2 3.86Å; F227-Y231 HydrophobicContact CG-CE2 4.5Å; F227-Y231 WeakPolarHBondContact O-CD2 3.5Å; F227-Y231 PolarHBondContact O-N 3.37Å; F227-A241 HydrophobicContact CB-CB 3.59Å; F227-D244 HydrophobicContact CE1-CB 4.37Å; F227-D244 HydrophobicContact CZ-CB 4.29Å; F227-L245 HydrophobicContact CD2-CD2 3.96Å; F227-L245 HydrophobicContact CD2-CG 3.97Å; F227-L245 HydrophobicContact CE2-CD2 3.76Å; F227-L245 HydrophobicContact CE2-CG 4.1Å; F227-I248 HydrophobicContact CE2-CD1 4.17Å; F227-I248 HydrophobicContact CZ-CD1 4.03Å
228	T	85.5	Confident	84.6	Confident	15 Å²	15	54.4 Å²	54.4	9%	0.092	29%	0.29	C	S	.	.	H	α-helix	trans	-63.9	-36.2	174.9	51.5	0	0	0	0	111.5	F224 D225 I226 I230 G232 V238 A241	F224-T228 HydrophobicContact CD1-CG2 4.27Å; F224-T228 HydrophobicContact CD2-CG2 4.18Å; F224-T228 HydrophobicContact CE1-CG2 3.86Å; F224-T228 HydrophobicContact CE2-CG2 3.73Å; F224-T228 HydrophobicContact CG-CG2 4.44Å; F224-T228 HydrophobicContact CZ-CG2 3.58Å; F224-T228 WeakPolarHBondContact O-CB 3.46Å; F224-T228 WeakPolarHBondContact O-CG2 3.39Å; F224-T228 PolarHBondContact O-N 3.36Å; F224-T228 PolarHBondContact O-OG1 3.12Å; D225-T228 WeakPolarHBondContact CA-OG1 3.28Å; D225-T228 PolarHBondContact O-OG1 3.3Å; I226-T228 PolarHBondContact O-N 3.04Å; T228-I230 VanDerWaalsContact C-N 3.28Å; T228-I230 PolarHBondContact O-N 3.32Å; T228-G232 CarbonylContact O-C 3.46Å; T228-G232 VanDerWaalsContact O-CA 3.24Å; T228-G232 WeakPolarHBondContact O-CA 3.37Å; T228-G232 PolarHBondContact O-N 3.43Å; T228-G232 VanDerWaalsContact O-O 3.04Å; T228-V238 HydrophobicContact CG2-CG2 4.16Å; T228-A241 HydrophobicContact CG2-CB 3.79Å
229	S	82.5	Confident	84.5	Confident	27 Å²	27	56.1 Å²	56.1	19%	0.189	28%	0.281	C	S	.	.	H	α-helix	trans	-66.1	-28	173.5	84.3	0	0	0	0	114.4	T24 D225 I226 F227	T24-S229 PolarHBondContact OG1-O 2.89Å; T24-S229 VanDerWaalsContact OG1-O 3.14Å; D225-S229 WeakPolarHBondContact O-CB 3.31Å; D225-S229 PolarHBondContact O-N 2.83Å; I226-S229 WeakPolarHBondContact O-CB 3.23Å; I226-S229 PolarHBondContact O-N 2.93Å; I226-S229 VanDerWaalsContact O-N 3.13Å; I226-S229 PolarHBondContact O-OG 2.71Å; F227-S229 VanDerWaalsContact C-N 3.31Å; F227-S229 PolarHBondContact O-N 3.39Å
230	I	79.7	Confident	84	Confident	7 Å²	7	53 Å²	53	4%	0.036	27%	0.273	C	S	.	.	H	α-helix	trans	-81.6	-50	179.5	-69	163.6	0	0	0	110.6	V27 T145 P147 P211 I226 F227 T228	V27-I230 HydrophobicContact CG2-CB 4.4Å; V27-I230 HydrophobicContact CG2-CG1 4.39Å; V27-I230 HydrophobicContact CG2-CG2 4.25Å; T145-I230 WeakPolarHBondContact O-CD1 3.34Å; P147-I230 HydrophobicContact CG-CG2 3.76Å; P211-I230 HydrophobicContact CG-CD1 4.23Å; I226-I230 HydrophobicContact CG2-CD1 3.82Å; I226-I230 HydrophobicContact CG2-CG1 4.49Å; I226-I230 WeakPolarHBondContact O-CG1 3.47Å; I226-I230 PolarHBondContact O-N 3.26Å; F227-I230 PolarHBondContact O-N 2.94Å; F227-I230 VanDerWaalsContact O-N 3.14Å; T228-I230 VanDerWaalsContact C-N 3.28Å; T228-I230 PolarHBondContact O-N 3.32Å
231	Y	81.1	Confident	83.8	Confident	14 Å²	14	50.7 Å²	50.7	6%	0.055	26%	0.259	C	S	.	.	H	α-helix	trans	-80.7	-17	-178.7	-63.3	-49.9	0	0	0	113.3	T21 P147 F227 L240 A241 D244	T21-Y231 WeakPolarHBondContact CB-O 3.31Å; T21-Y231 WeakPolarHBondContact CG2-O 3.42Å; P147-Y231 HydrophobicContact CB-CE1 4.11Å; P147-Y231 HydrophobicContact CG-CE1 4.36Å; F227-Y231 HydrophobicContact CB-CD2 4.38Å; F227-Y231 HydrophobicContact CB-CE2 4.44Å; F227-Y231 AromaticContact CD1-CE2 3.86Å; F227-Y231 HydrophobicContact CD1-CE2 3.86Å; F227-Y231 HydrophobicContact CG-CE2 4.5Å; F227-Y231 WeakPolarHBondContact O-CD2 3.5Å; F227-Y231 PolarHBondContact O-N 3.37Å; Y231-L240 HydrophobicContact CD1-CD1 4.43Å; Y231-L240 HydrophobicContact CD2-CB 3.9Å; Y231-L240 HydrophobicContact CE2-CB 4.25Å; Y231-L240 HydrophobicContact CG-CB 4.05Å; Y231-A241 HydrophobicContact CD2-CB 4.15Å; Y231-D244 PolarHBondContact OH-OD2 3.49Å
232	G	77.6	Confident	83.6	Confident	11 Å²	11	48.4 Å²	48.4	11%	0.113	25%	0.246	C	C	.	.			trans	103.5	154	-175.3	0	0	0	0	0	112.3	T228 D234 G237	T228-G232 CarbonylContact O-C 3.46Å; T228-G232 VanDerWaalsContact O-CA 3.24Å; T228-G232 WeakPolarHBondContact O-CA 3.37Å; T228-G232 PolarHBondContact O-N 3.43Å; T228-G232 VanDerWaalsContact O-O 3.04Å; G232-D234 PolarHBondContact O-N 2.87Å; G232-G237 WeakPolarHBondContact O-CA 3.44Å
233	N	77.8	Confident	83.3	Confident	138 Å²	138	46.5 Å²	46.5	74%	0.738	25%	0.245	S	C	*	.	S	Bend	trans	-84.5	9.4	-179.6	-65.3	-0	0	0	0	112.6
234	D	80.4	Confident	83	Confident	78 Å²	78	47.7 Å²	47.7	42%	0.417	25%	0.251	S	S	.	.	S	Bend	trans	-78.5	165.2	174.8	69.3	-35.7	0	0	0	110.9	G232 T236 G237 V238	G232-D234 PolarHBondContact O-N 2.87Å; D234-T236 PolarHBondContact O-N 3.41Å; D234-T236 WeakPolarHBondContact OD2-CB 3.24Å; D234-T236 PolarHBondContact OD2-OG1 3.04Å; D234-G237 PolarHBondContact O-N 3Å; D234-G237 VanDerWaalsContact O-N 3.07Å; D234-G237 PolarHBondContact OD1-N 3.15Å; D234-V238 PolarHBondContact O-N 3.48Å
235	E	80.3	Confident	82.7	Confident	136 Å²	136	45.5 Å²	45.5	64%	0.636	24%	0.242	S	C	*	.	H	α-helix	trans	-57.8	-34.8	-177.3	-162.1	-172.6	152.4	0	0	112.1	K239	E235-K239 WeakPolarHBondContact O-CB 3.36Å; E235-K239 VanDerWaalsContact O-CG 3.28Å; E235-K239 WeakPolarHBondContact O-CG 3.29Å; E235-K239 PolarHBondContact O-N 3.43Å; E235-K239 VanDerWaalsContact OE1-CE 3.27Å; E235-K239 WeakPolarHBondContact OE1-CE 3.43Å; E235-K239 IonicContact OE1-NZ 3.13Å; E235-K239 PolarHBondContact OE1-NZ 3.18Å
236	T	79.8	Confident	82.7	Confident	36 Å²	36	45.2 Å²	45.2	22%	0.221	24%	0.24	C	C	.	.	H	α-helix	trans	-63	-51.4	174.1	-42.7	0	0	0	0	111.3	L16 D234 V238 K239 L240	L16-T236 HydrophobicContact CD2-CG2 3.67Å; L16-T236 HydrophobicContact CG-CG2 4.19Å; D234-T236 PolarHBondContact O-N 3.41Å; D234-T236 WeakPolarHBondContact OD2-CB 3.24Å; D234-T236 PolarHBondContact OD2-OG1 3.04Å; T236-V238 VanDerWaalsContact C-N 3.33Å; T236-V238 PolarHBondContact O-N 2.97Å; T236-K239 PolarHBondContact O-N 3.2Å; T236-L240 HydrophobicContact CG2-CD1 4.37Å; T236-L240 WeakPolarHBondContact O-CG 3.27Å; T236-L240 PolarHBondContact O-N 3.46Å
237	G	79.4	Confident	82.4	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.9	-37.6	-179.5	0	0	0	0	0	113	G232 D234 L240 A241	G232-G237 WeakPolarHBondContact O-CA 3.44Å; D234-G237 PolarHBondContact O-N 3Å; D234-G237 VanDerWaalsContact O-N 3.07Å; D234-G237 PolarHBondContact OD1-N 3.15Å; G237-L240 PolarHBondContact O-N 2.87Å; G237-A241 WeakPolarHBondContact O-CB 3.2Å; G237-A241 PolarHBondContact O-N 3.27Å
238	V	83.9	Confident	82.2	Confident	43 Å²	43	48 Å²	48	26%	0.261	25%	0.254	S	S	.	.	H	α-helix	trans	-63.5	-42.7	172.9	171.1	0	0	0	0	111.9	F224 T228 D234 T236 A241 K242	F224-V238 HydrophobicContact CZ-CG1 4.06Å; T228-V238 HydrophobicContact CG2-CG2 4.16Å; D234-V238 PolarHBondContact O-N 3.48Å; T236-V238 VanDerWaalsContact C-N 3.33Å; T236-V238 PolarHBondContact O-N 2.97Å; V238-A241 PolarHBondContact O-N 3Å; V238-K242 WeakPolarHBondContact O-CG 3.34Å; V238-K242 PolarHBondContact O-N 2.86Å
239	K	82.5	Confident	82.2	Confident	91 Å²	91	51.3 Å²	51.3	40%	0.396	27%	0.268	S	S	.	.	H	α-helix	trans	-63.7	-43.2	176.5	-76.5	172.4	-175.4	168.5	0	111.7	L16 E235 T236 K242 A243	L16-K239 HydrophobicContact CD1-CD 4.42Å; E235-K239 WeakPolarHBondContact O-CB 3.36Å; E235-K239 VanDerWaalsContact O-CG 3.28Å; E235-K239 WeakPolarHBondContact O-CG 3.29Å; E235-K239 PolarHBondContact O-N 3.43Å; E235-K239 VanDerWaalsContact OE1-CE 3.27Å; E235-K239 WeakPolarHBondContact OE1-CE 3.43Å; E235-K239 IonicContact OE1-NZ 3.13Å; E235-K239 PolarHBondContact OE1-NZ 3.18Å; T236-K239 PolarHBondContact O-N 3.2Å; K239-K242 PolarHBondContact O-N 3.46Å; K239-A243 WeakPolarHBondContact O-CB 3.22Å; K239-A243 PolarHBondContact O-N 3.24Å
240	L	80.5	Confident	82.2	Confident	43 Å²	43	56.4 Å²	56.4	23%	0.225	29%	0.289	C	S	.	.	H	α-helix	trans	-63.5	-43.5	176.5	-71	171.8	0	0	0	112.1	L18 T21 Y231 T236 G237 K242 A243 D244	L18-L240 HydrophobicContact CD2-CD1 4.3Å; L18-L240 HydrophobicContact CD2-CD2 4.18Å; T21-L240 HydrophobicContact CG2-CD1 4.05Å; Y231-L240 HydrophobicContact CD1-CD1 4.43Å; Y231-L240 HydrophobicContact CD2-CB 3.9Å; Y231-L240 HydrophobicContact CE2-CB 4.25Å; Y231-L240 HydrophobicContact CG-CB 4.05Å; T236-L240 HydrophobicContact CG2-CD1 4.37Å; T236-L240 WeakPolarHBondContact O-CG 3.27Å; T236-L240 PolarHBondContact O-N 3.46Å; G237-L240 PolarHBondContact O-N 2.87Å; L240-K242 VanDerWaalsContact C-N 3.32Å; L240-K242 PolarHBondContact O-N 3.38Å; L240-A243 PolarHBondContact O-N 3.07Å; L240-D244 PolarHBondContact O-N 3.11Å
241	A	84.2	Confident	82.1	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-59.2	-42.3	175.7	0	0	0	0	0	112.2	F224 F227 T228 Y231 G237 V238 L245	F224-A241 HydrophobicContact CD2-CB 4.12Å; F224-A241 HydrophobicContact CE2-CB 3.96Å; F227-A241 HydrophobicContact CB-CB 3.59Å; T228-A241 HydrophobicContact CG2-CB 3.79Å; Y231-A241 HydrophobicContact CD2-CB 4.15Å; G237-A241 WeakPolarHBondContact O-CB 3.2Å; G237-A241 PolarHBondContact O-N 3.27Å; V238-A241 PolarHBondContact O-N 3Å; A241-L245 WeakPolarHBondContact O-CG 3.37Å; A241-L245 PolarHBondContact O-N 3.24Å
242	K	87.4	Confident	82.1	Confident	112 Å²	112	60.5 Å²	60.5	49%	0.487	31%	0.309	S	S	.	.	H	α-helix	trans	-65.8	-46.5	175.4	-71	-177.2	-178	179.7	0	111.9	F224 V238 K239 L240 D244 L245 D246	F224-K242 HydrophobicContact CD2-CG 4.45Å; F224-K242 HydrophobicContact CE2-CG 3.71Å; F224-K242 HydrophobicContact CZ-CG 4.48Å; V238-K242 WeakPolarHBondContact O-CG 3.34Å; V238-K242 PolarHBondContact O-N 2.86Å; K239-K242 PolarHBondContact O-N 3.46Å; L240-K242 VanDerWaalsContact C-N 3.32Å; L240-K242 PolarHBondContact O-N 3.38Å; K242-D244 VanDerWaalsContact C-N 3.32Å; K242-D244 PolarHBondContact O-N 3.4Å; K242-L245 PolarHBondContact O-N 3.2Å; K242-L245 VanDerWaalsContact O-N 3.12Å; K242-D246 VanDerWaalsContact O-CG 3.26Å; K242-D246 PolarHBondContact O-N 3.11Å
243	A	84.2	Confident	82.3	Confident	43 Å²	43	64.5 Å²	64.5	36%	0.355	33%	0.328	S	S	.	.	H	α-helix	trans	-58	-43.6	179.1	0	0	0	0	0	112.2	K239 L240 D246 I247	K239-A243 WeakPolarHBondContact O-CB 3.22Å; K239-A243 PolarHBondContact O-N 3.24Å; L240-A243 PolarHBondContact O-N 3.07Å; A243-D246 PolarHBondContact O-N 3.18Å; A243-I247 VanDerWaalsContact O-CG1 3.27Å; A243-I247 WeakPolarHBondContact O-CG1 3.43Å; A243-I247 PolarHBondContact O-N 3.41Å
244	D	82.3	Confident	82.4	Confident	25 Å²	25	63.4 Å²	63.4	13%	0.134	32%	0.318	C	S	.	.	H	α-helix	trans	-62.3	-42.4	175.5	-96.3	6.4	0	0	0	112.1	F227 Y231 L240 K242 I248	F227-D244 HydrophobicContact CE1-CB 4.37Å; F227-D244 HydrophobicContact CZ-CB 4.29Å; Y231-D244 PolarHBondContact OH-OD2 3.49Å; L240-D244 PolarHBondContact O-N 3.11Å; K242-D244 VanDerWaalsContact C-N 3.32Å; K242-D244 PolarHBondContact O-N 3.4Å; D244-I248 WeakPolarHBondContact O-CD1 3.31Å; D244-I248 WeakPolarHBondContact O-CG1 3.31Å; D244-I248 PolarHBondContact O-N 3.47Å
245	L	86.5	Confident	82.1	Confident	10 Å²	10	63.1 Å²	63.1	5%	0.052	31%	0.311	C	S	.	.	H	α-helix	trans	-66.1	-39.6	176.7	-74.9	173.2	0	0	0	112.6	A215 A223 F224 F227 A241 K242 I248 K249	A215-L245 HydrophobicContact CB-CD2 3.84Å; A223-L245 HydrophobicContact CB-CD2 3.98Å; F224-L245 HydrophobicContact CB-CD1 3.69Å; F224-L245 HydrophobicContact CD2-CD1 3.71Å; F224-L245 HydrophobicContact CG-CD1 4.17Å; F227-L245 HydrophobicContact CD2-CD2 3.96Å; F227-L245 HydrophobicContact CD2-CG 3.97Å; F227-L245 HydrophobicContact CE2-CD2 3.76Å; F227-L245 HydrophobicContact CE2-CG 4.1Å; A241-L245 WeakPolarHBondContact O-CG 3.37Å; A241-L245 PolarHBondContact O-N 3.24Å; K242-L245 PolarHBondContact O-N 3.2Å; K242-L245 VanDerWaalsContact O-N 3.12Å; L245-I248 PolarHBondContact O-N 3.23Å; L245-K249 WeakPolarHBondContact O-CB 3.44Å; L245-K249 VanDerWaalsContact O-CG 3.32Å; L245-K249 WeakPolarHBondContact O-CG 3.19Å; L245-K249 PolarHBondContact O-N 3.36Å
246	D	86.9	Confident	82	Confident	96 Å²	96	61.1 Å²	61.1	51%	0.513	30%	0.302	S	S	.	.	H	α-helix	trans	-66.3	-41.2	179	-67.9	-22.8	0	0	0	110.8	K242 A243 I248 K249 E250	K242-D246 VanDerWaalsContact O-CG 3.26Å; K242-D246 PolarHBondContact O-N 3.11Å; A243-D246 PolarHBondContact O-N 3.18Å; D246-I248 PolarHBondContact O-N 3.4Å; D246-K249 PolarHBondContact O-N 3.28Å; D246-E250 WeakPolarHBondContact O-CB 3.36Å; D246-E250 PolarHBondContact O-N 3.03Å
247	I	81.5	Confident	82	Confident	69 Å²	69	66.1 Å²	66.1	35%	0.354	32%	0.321	S	S	.	.	H	α-helix	trans	-61	-44.7	172.6	-68.2	165.1	0	0	0	111	A243 K249 E250 I251	A243-I247 VanDerWaalsContact O-CG1 3.27Å; A243-I247 WeakPolarHBondContact O-CG1 3.43Å; A243-I247 PolarHBondContact O-N 3.41Å; I247-K249 VanDerWaalsContact C-N 3.34Å; I247-K249 PolarHBondContact O-N 2.96Å; I247-E250 PolarHBondContact O-N 3.37Å; I247-I251 HydrophobicContact CG2-CD1 3.91Å; I247-I251 VanDerWaalsContact O-CG1 3.29Å; I247-I251 WeakPolarHBondContact O-CG1 3.48Å; I247-I251 PolarHBondContact O-N 3.33Å
248	I	81.9	Confident	81.7	Confident	13 Å²	13	69.9 Å²	69.9	7%	0.067	34%	0.338	C	S	.	.	H	α-helix	trans	-62.1	-44.6	178.6	-69	162.9	0	0	0	110.4	R212 A215 F227 D244 L245 D246 I251 Q252	R212-I248 HydrophobicContact CG-CD1 4.05Å; A215-I248 HydrophobicContact CB-CD1 4.35Å; A215-I248 HydrophobicContact CB-CG2 4.02Å; F227-I248 HydrophobicContact CE2-CD1 4.17Å; F227-I248 HydrophobicContact CZ-CD1 4.03Å; D244-I248 WeakPolarHBondContact O-CD1 3.31Å; D244-I248 WeakPolarHBondContact O-CG1 3.31Å; D244-I248 PolarHBondContact O-N 3.47Å; L245-I248 PolarHBondContact O-N 3.23Å; D246-I248 PolarHBondContact O-N 3.4Å; I248-I251 PolarHBondContact O-N 2.84Å; I248-Q252 HydrophobicContact CG2-CG 4.47Å; I248-Q252 WeakPolarHBondContact O-CG 3.44Å; I248-Q252 PolarHBondContact O-N 3.25Å
249	K	85.4	Confident	81.2	Confident	86 Å²	86	72.7 Å²	72.7	37%	0.374	35%	0.347	S	S	.	.	H	α-helix	trans	-61.9	-45	176.8	-75.4	173.6	-178.6	175.3	0	112.1	L245 D246 I247 I251 Q252 D253	L245-K249 WeakPolarHBondContact O-CB 3.44Å; L245-K249 VanDerWaalsContact O-CG 3.32Å; L245-K249 WeakPolarHBondContact O-CG 3.19Å; L245-K249 PolarHBondContact O-N 3.36Å; D246-K249 PolarHBondContact O-N 3.28Å; I247-K249 VanDerWaalsContact C-N 3.34Å; I247-K249 PolarHBondContact O-N 2.96Å; K249-I251 VanDerWaalsContact C-N 3.31Å; K249-I251 PolarHBondContact O-N 3.3Å; K249-Q252 WeakPolarHBondContact O-CB 3.32Å; K249-Q252 PolarHBondContact O-N 3.48Å; K249-Q252 VanDerWaalsContact O-N 3.12Å; K249-D253 WeakPolarHBondContact O-CB 3.45Å; K249-D253 PolarHBondContact O-N 2.87Å
250	E	83	Confident	81.1	Confident	134 Å²	134	74.8 Å²	74.8	63%	0.626	36%	0.358	S	S	*	.	H	α-helix	trans	-59.4	-43.5	177.6	-174	178.4	-172.8	0	0	111.5	D246 I247 D253 Q254	D246-E250 WeakPolarHBondContact O-CB 3.36Å; D246-E250 PolarHBondContact O-N 3.03Å; I247-E250 PolarHBondContact O-N 3.37Å; E250-D253 PolarHBondContact O-N 3.41Å; E250-Q254 WeakPolarHBondContact O-CB 3.41Å; E250-Q254 PolarHBondContact O-N 2.83Å
251	I	78	Confident	80.9	Confident	50 Å²	50	76.7 Å²	76.7	26%	0.256	38%	0.38	S	S	.	.	H	α-helix	trans	-63.7	-41.7	175.3	-67.1	169	0	0	0	111	I247 I248 K249 R255	I247-I251 HydrophobicContact CG2-CD1 3.91Å; I247-I251 VanDerWaalsContact O-CG1 3.29Å; I247-I251 WeakPolarHBondContact O-CG1 3.48Å; I247-I251 PolarHBondContact O-N 3.33Å; I248-I251 PolarHBondContact O-N 2.84Å; K249-I251 VanDerWaalsContact C-N 3.31Å; K249-I251 PolarHBondContact O-N 3.3Å; I251-R255 WeakPolarHBondContact O-CB 3.09Å; I251-R255 VanDerWaalsContact O-CG 3.31Å; I251-R255 WeakPolarHBondContact O-CG 3.02Å; I251-R255 PolarHBondContact O-N 3.08Å
252	Q	79.8	Confident	80.2	Confident	57 Å²	57	82.9 Å²	82.9	27%	0.266	41%	0.407	S	S	.	.	H	α-helix	trans	-63.4	-47	177.1	-76.3	-178.7	-61.8	0	0	111.5	N216 I248 K249 Q254 R255 Q256	N216-Q252 VanDerWaalsContact CA-NE2 3.31Å; N216-Q252 PolarHBondContact O-NE2 3.37Å; N216-Q252 VanDerWaalsContact O-NE2 3.13Å; I248-Q252 HydrophobicContact CG2-CG 4.47Å; I248-Q252 WeakPolarHBondContact O-CG 3.44Å; I248-Q252 PolarHBondContact O-N 3.25Å; K249-Q252 WeakPolarHBondContact O-CB 3.32Å; K249-Q252 PolarHBondContact O-N 3.48Å; K249-Q252 VanDerWaalsContact O-N 3.12Å; Q252-Q254 VanDerWaalsContact C-N 3.33Å; Q252-Q254 PolarHBondContact O-N 3.27Å; Q252-R255 PolarHBondContact O-N 2.98Å; Q252-Q256 WeakPolarHBondContact O-CB 3.34Å; Q252-Q256 PolarHBondContact O-N 3.28Å
253	D	83.4	Confident	79.4	Confident	95 Å²	95	79.4 Å²	79.4	51%	0.508	40%	0.402	S	S	.	.	H	α-helix	trans	-62.4	-41.4	178.7	-73.5	-12.6	0	0	0	111.3	K249 E250 Q256 K257	K249-D253 WeakPolarHBondContact O-CB 3.45Å; K249-D253 PolarHBondContact O-N 2.87Å; E250-D253 PolarHBondContact O-N 3.41Å; D253-Q256 PolarHBondContact O-N 3.34Å; D253-K257 WeakPolarHBondContact O-CB 3.27Å; D253-K257 VanDerWaalsContact O-CG 3.25Å; D253-K257 WeakPolarHBondContact O-CG 3.32Å; D253-K257 PolarHBondContact O-N 3.18Å
254	Q	78.4	Confident	78.6	Confident	115 Å²	115	85.3 Å²	85.3	54%	0.537	42%	0.423	S	S	.	.	H	α-helix	trans	-62	-44.8	175	-172.8	176.1	-2.9	0	0	111.3	E250 Q252 K257 E258	E250-Q254 WeakPolarHBondContact O-CB 3.41Å; E250-Q254 PolarHBondContact O-N 2.83Å; Q252-Q254 VanDerWaalsContact C-N 3.33Å; Q252-Q254 PolarHBondContact O-N 3.27Å; Q254-K257 PolarHBondContact O-N 3.22Å; Q254-E258 WeakPolarHBondContact O-CG 3.21Å; Q254-E258 PolarHBondContact O-N 3.41Å
255	R	75.1	Confident	77.8	Confident	72 Å²	72	87.6 Å²	87.6	27%	0.272	43%	0.431	S	S	.	.	H	α-helix	trans	-68.1	-37.1	177.6	-73.1	179.8	102.8	-175.3	12.1	112.6	I251 Q252 E258 K259 W515	I251-R255 WeakPolarHBondContact O-CB 3.09Å; I251-R255 VanDerWaalsContact O-CG 3.31Å; I251-R255 WeakPolarHBondContact O-CG 3.02Å; I251-R255 PolarHBondContact O-N 3.08Å; Q252-R255 PolarHBondContact O-N 2.98Å; R255-E258 PolarHBondContact O-N 3.23Å; R255-K259 WeakPolarHBondContact O-CB 3.34Å; R255-K259 WeakPolarHBondContact O-CG 3.28Å; R255-K259 PolarHBondContact O-N 3.1Å; R255-W515 PolarHBondContact NH2-O 3.5Å
256	Q	79	Confident	77.4	Confident	94 Å²	94	90.7 Å²	90.7	44%	0.439	45%	0.454	S	S	.	.	H	α-helix	trans	-63.8	-45.9	177	-176.8	59.7	20	0	0	110.2	Q252 D253 E258 K259 E260	Q252-Q256 WeakPolarHBondContact O-CB 3.34Å; Q252-Q256 PolarHBondContact O-N 3.28Å; D253-Q256 PolarHBondContact O-N 3.34Å; Q256-E258 VanDerWaalsContact C-N 3.29Å; Q256-E258 PolarHBondContact O-N 3.43Å; Q256-K259 PolarHBondContact O-N 3Å; Q256-E260 WeakPolarHBondContact CG-OE1 3.25Å; Q256-E260 PolarHBondContact NE2-OE1 3.12Å; Q256-E260 WeakPolarHBondContact O-CB 3.45Å; Q256-E260 WeakPolarHBondContact O-CG 3.21Å; Q256-E260 PolarHBondContact O-N 3.32Å
257	K	79.7	Confident	77.1	Confident	141 Å²	141	88.5 Å²	88.5	61%	0.613	44%	0.442	S	S	*	.	H	α-helix	trans	-58.2	-39.9	171.9	-71.3	168.3	-175.3	170.5	0	112.2	D253 Q254 A261	D253-K257 WeakPolarHBondContact O-CB 3.27Å; D253-K257 VanDerWaalsContact O-CG 3.25Å; D253-K257 WeakPolarHBondContact O-CG 3.32Å; D253-K257 PolarHBondContact O-N 3.18Å; Q254-K257 PolarHBondContact O-N 3.22Å; K257-A261 VanDerWaalsContact O-CB 3.26Å; K257-A261 WeakPolarHBondContact O-CB 3.45Å; K257-A261 PolarHBondContact O-N 3.26Å
258	E	72.7	Confident	77.1	Confident	79 Å²	79	90 Å²	90	37%	0.369	45%	0.446	S	S	.	.	H	α-helix	trans	-68.5	-40.9	176	-75	-172.6	152.5	0	0	113.2	Q254 R255 Q256 A261 K262	Q254-E258 WeakPolarHBondContact O-CG 3.21Å; Q254-E258 PolarHBondContact O-N 3.41Å; R255-E258 PolarHBondContact O-N 3.23Å; Q256-E258 VanDerWaalsContact C-N 3.29Å; Q256-E258 PolarHBondContact O-N 3.43Å; E258-A261 PolarHBondContact O-N 3.47Å; E258-K262 WeakPolarHBondContact O-CB 3.5Å; E258-K262 PolarHBondContact O-N 2.89Å
259	K	73.6	Confident	77.2	Confident	101 Å²	101	94.5 Å²	94.5	44%	0.439	47%	0.47	S	S	.	.	H	α-helix	trans	-62.1	-43.8	174.9	-78.3	-176.2	177.3	-165.8	0	111.1	R255 Q256 G263	R255-K259 WeakPolarHBondContact O-CB 3.34Å; R255-K259 WeakPolarHBondContact O-CG 3.28Å; R255-K259 PolarHBondContact O-N 3.1Å; Q256-K259 PolarHBondContact O-N 3Å; K259-G263 CarbonylContact O-C 3.59Å; K259-G263 WeakPolarHBondContact O-CA 3.33Å; K259-G263 PolarHBondContact O-N 3.49Å
260	E	79.1	Confident	77.2	Confident	136 Å²	136	92.7 Å²	92.7	64%	0.636	46%	0.463	S	S	*	.	H	α-helix	trans	-63.9	-41.6	175.8	-72.9	169.4	-170.7	0	0	111.7	Q256	Q256-E260 WeakPolarHBondContact CG-OE1 3.25Å; Q256-E260 PolarHBondContact NE2-OE1 3.12Å; Q256-E260 WeakPolarHBondContact O-CB 3.45Å; Q256-E260 WeakPolarHBondContact O-CG 3.21Å; Q256-E260 PolarHBondContact O-N 3.32Å
261	A	76.3	Confident	77.4	Confident	82 Å²	82	86.3 Å²	86.3	68%	0.678	43%	0.433	S	S	*	.	H	α-helix	trans	-76.3	-31.9	-178.3	0	0	0	0	0	114.5	K257 E258	K257-A261 VanDerWaalsContact O-CB 3.26Å; K257-A261 WeakPolarHBondContact O-CB 3.45Å; K257-A261 PolarHBondContact O-N 3.26Å; E258-A261 PolarHBondContact O-N 3.47Å
262	K	69.8	Low	78	Confident	131 Å²	131	87.3 Å²	87.3	57%	0.57	44%	0.438	S	S	*	.	H	α-helix	trans	-123.8	1.7	-168.8	-63.8	175.3	-175.9	161.7	0	114.5	E258	E258-K262 WeakPolarHBondContact O-CB 3.5Å; E258-K262 PolarHBondContact O-N 2.89Å
263	G	71.8	Confident	78.4	Confident	38 Å²	38	93.6 Å²	93.6	39%	0.392	46%	0.459	S	S	.	.			trans	75.8	165.5	-174.2	0	0	0	0	0	113.5	K259 K265	K259-G263 CarbonylContact O-C 3.59Å; K259-G263 WeakPolarHBondContact O-CA 3.33Å; K259-G263 PolarHBondContact O-N 3.49Å; G263-K265 PolarHBondContact O-N 2.83Å
264	E	66.3	Low	78.6	Confident	167 Å²	167	92.6 Å²	92.6	78%	0.78	45%	0.451	S	S	*	.			trans	-69.7	112.1	175.3	-171	165.8	-146.2	0	0	110.1
265	K	66.6	Low	79.1	Confident	73 Å²	73	92.6 Å²	92.6	32%	0.317	45%	0.447	S	S	.	.			trans	-101.6	146.5	175.8	-70.7	175.4	-176.9	167.3	0	110.1	G263 I267 E270	G263-K265 PolarHBondContact O-N 2.83Å; K265-I267 PolarHBondContact O-N 2.68Å; K265-E270 HydrophobicContact CB-CG 3.82Å; K265-E270 WeakPolarHBondContact CB-OE1 3.22Å; K265-E270 HydrophobicContact CD-CG 4.24Å; K265-E270 WeakPolarHBondContact CD-OE1 3.18Å
266	S	78	Confident	79.8	Confident	76 Å²	76	91 Å²	91	53%	0.531	44%	0.442	S	S	.	.			trans	-59	122.8	167.1	174.2	0	0	0	0	109.5	F268 L269 E270	S266-F268 PolarHBondContact O-N 3.49Å; S266-F268 VanDerWaalsContact O-N 3.17Å; S266-L269 WeakPolarHBondContact O-CB 3.42Å; S266-L269 PolarHBondContact O-N 3.4Å; S266-E270 PolarHBondContact O-N 3Å
267	I	80	Confident	80.4	Confident	49 Å²	49	86.5 Å²	86.5	25%	0.251	42%	0.421	S	S	.	.	H	α-helix	trans	-53.2	-38.7	179.8	-64.5	167.9	0	0	0	110.6	K265 L269 E270 M271 W515 H519	K265-I267 PolarHBondContact O-N 2.68Å; I267-L269 PolarHBondContact O-N 2.87Å; I267-E270 WeakPolarHBondContact O-CB 3.45Å; I267-E270 PolarHBondContact O-N 3.21Å; I267-M271 HydrophobicContact CG2-CG 4.41Å; I267-M271 HydrophobicContact CG2-SD 4.22Å; I267-M271 VanDerWaalsContact O-CG 3.31Å; I267-M271 WeakPolarHBondContact O-CG 3.02Å; I267-M271 PolarHBondContact O-N 3.38Å; I267-W515 HydrophobicContact CG2-CE3 4.21Å; I267-W515 HydrophobicContact CG2-CZ3 3.95Å; I267-H519 WeakPolarHBondContact CD1-NE2 3.49Å; I267-H519 HydrophobicContact CG2-CB 4.46Å
268	F	81.4	Confident	81.1	Confident	102 Å²	102	84.8 Å²	84.8	45%	0.447	41%	0.411	S	S	.	.	H	α-helix	trans	-60	-43.7	177.3	-179.3	-104.8	0	0	0	112.8	S266 E270 M271 I272 I523	S266-F268 PolarHBondContact O-N 3.49Å; S266-F268 VanDerWaalsContact O-N 3.17Å; F268-E270 VanDerWaalsContact C-N 3.3Å; F268-E270 PolarHBondContact O-N 2.85Å; F268-M271 WeakPolarHBondContact O-CB 3.39Å; F268-M271 PolarHBondContact O-N 2.92Å; F268-I272 HydrophobicContact CD1-CD1 3.98Å; F268-I272 HydrophobicContact CE1-CD1 3.35Å; F268-I272 HydrophobicContact CE1-CG1 4.48Å; F268-I272 HydrophobicContact CE2-CD1 4.11Å; F268-I272 HydrophobicContact CZ-CD1 3.44Å; F268-I272 VanDerWaalsContact CZ-CD1 3.44Å; F268-I272 HydrophobicContact CZ-CG1 4.42Å; F268-I272 PolarHBondContact O-N 3.34Å; F268-I272 VanDerWaalsContact O-N 3.13Å; F268-I523 HydrophobicContact CD2-CD1 3.71Å; F268-I523 HydrophobicContact CE2-CD1 3.77Å
269	L	83.9	Confident	82.2	Confident	107 Å²	107	81.5 Å²	81.5	56%	0.56	40%	0.395	S	S	*	.	H	α-helix	trans	-67.1	-35.7	178.8	-172.8	64.5	0	0	0	111.2	S266 I267 R273	S266-L269 WeakPolarHBondContact O-CB 3.42Å; S266-L269 PolarHBondContact O-N 3.4Å; I267-L269 PolarHBondContact O-N 2.87Å; L269-R273 VanDerWaalsContact O-CB 3.27Å; L269-R273 WeakPolarHBondContact O-CB 3.41Å; L269-R273 PolarHBondContact O-N 3.45Å; L269-R273 VanDerWaalsContact O-N 3.09Å
270	E	85.7	Confident	83.2	Confident	48 Å²	48	76.7 Å²	76.7	22%	0.224	38%	0.375	C	S	.	.	H	α-helix	trans	-65.7	-40	174	-62	-166.7	146.4	0	0	112.2	K265 S266 I267 F268 I272 R273 Q274 W515	K265-E270 HydrophobicContact CB-CG 3.82Å; K265-E270 WeakPolarHBondContact CB-OE1 3.22Å; K265-E270 HydrophobicContact CD-CG 4.24Å; K265-E270 WeakPolarHBondContact CD-OE1 3.18Å; S266-E270 PolarHBondContact O-N 3Å; I267-E270 WeakPolarHBondContact O-CB 3.45Å; I267-E270 PolarHBondContact O-N 3.21Å; F268-E270 VanDerWaalsContact C-N 3.3Å; F268-E270 PolarHBondContact O-N 2.85Å; E270-I272 PolarHBondContact O-N 3.41Å; E270-R273 PolarHBondContact O-N 3.47Å; E270-Q274 PolarHBondContact O-N 2.83Å; E270-W515 HydrophobicContact CB-CH2 4.01Å; E270-W515 HydrophobicContact CB-CZ3 4.11Å
271	M	87.5	Confident	84	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-62.6	-40.2	176.7	-71.6	177.9	64.9	0	0	112.9	I267 F268 R273 T277 R278 L281 F512 W515 A516 H519	I267-M271 HydrophobicContact CG2-CG 4.41Å; I267-M271 HydrophobicContact CG2-SD 4.22Å; I267-M271 VanDerWaalsContact O-CG 3.31Å; I267-M271 WeakPolarHBondContact O-CG 3.02Å; I267-M271 PolarHBondContact O-N 3.38Å; F268-M271 WeakPolarHBondContact O-CB 3.39Å; F268-M271 PolarHBondContact O-N 2.92Å; M271-R273 VanDerWaalsContact C-N 3.35Å; M271-T277 WeakPolarHBondContact CA-OG1 3.42Å; M271-T277 PolarHBondContact O-OG1 3.22Å; M271-R278 PolarHBondContact O-N 2.92Å; M271-R278 VanDerWaalsContact O-N 3.13Å; M271-L281 HydrophobicContact CE-CD1 4.48Å; M271-F512 HydrophobicContact CE-CD1 4.34Å; M271-F512 HydrophobicContact CE-CE1 4.21Å; M271-W515 HydrophobicContact CG-CH2 3.81Å; M271-W515 HydrophobicContact CG-CZ3 3.85Å; M271-A516 HydrophobicContact CE-CB 4.18Å; M271-A516 HydrophobicContact CG-CB 3.82Å; M271-A516 HydrophobicContact SD-CB 3.86Å; M271-H519 HydrophobicContact SD-CB 3.85Å
272	I	90.1	Very high	84.9	Confident	71 Å²	71	70 Å²	70	36%	0.364	33%	0.333	S	S	.	.	H	α-helix	trans	-72.2	-34	177.6	-68.2	176.3	0	0	0	111.3	F268 E270 R278	F268-I272 HydrophobicContact CD1-CD1 3.98Å; F268-I272 HydrophobicContact CE1-CD1 3.35Å; F268-I272 HydrophobicContact CE1-CG1 4.48Å; F268-I272 HydrophobicContact CE2-CD1 4.11Å; F268-I272 HydrophobicContact CZ-CD1 3.44Å; F268-I272 VanDerWaalsContact CZ-CD1 3.44Å; F268-I272 HydrophobicContact CZ-CG1 4.42Å; F268-I272 PolarHBondContact O-N 3.34Å; F268-I272 VanDerWaalsContact O-N 3.13Å; E270-I272 PolarHBondContact O-N 3.41Å; I272-R278 WeakPolarHBondContact O-CD 3.42Å; I272-R278 PolarHBondContact O-NH1 3.39Å
273	R	88.3	Confident	86.2	Confident	188 Å²	188	63.8 Å²	63.8	71%	0.709	31%	0.307	S	S	*	.	H	α-helix	trans	-74.9	-42.4	-176.5	-172.8	173	-179.5	163	1.1	112.3	L269 E270 M271	L269-R273 VanDerWaalsContact O-CB 3.27Å; L269-R273 WeakPolarHBondContact O-CB 3.41Å; L269-R273 PolarHBondContact O-N 3.45Å; L269-R273 VanDerWaalsContact O-N 3.09Å; E270-R273 PolarHBondContact O-N 3.47Å; M271-R273 VanDerWaalsContact C-N 3.35Å
274	Q	87.9	Confident	87.4	Confident	75 Å²	75	62 Å²	62	35%	0.35	29%	0.288	S	S	.	.	S	Bend	trans	-74.6	128.8	178.2	-69.5	-172.3	14.9	0	0	110.2	E270 E276 T277 R278 W515	E270-Q274 PolarHBondContact O-N 2.83Å; Q274-E276 PolarHBondContact O-N 2.99Å; Q274-T277 VanDerWaalsContact CB-OG1 3.3Å; Q274-T277 WeakPolarHBondContact CB-OG1 3.35Å; Q274-T277 PolarHBondContact O-OG1 2.68Å; Q274-R278 WeakPolarHBondContact O-CB 3.27Å; Q274-R278 PolarHBondContact O-N 2.91Å; Q274-W515 VanDerWaalsContact OE1-CZ2 3.24Å
275	R	89.1	Confident	88.9	Confident	115 Å²	115	55.2 Å²	55.2	43%	0.434	26%	0.259	S	S	.	.	H	α-helix	trans	-60.8	-32	-175.9	175.5	-174.1	170.5	165.3	-6.4	111.9	K279 G587	R275-K279 VanDerWaalsContact O-CB 3.29Å; R275-K279 WeakPolarHBondContact O-CB 2.91Å; R275-K279 PolarHBondContact O-N 3.44Å; R275-G587 PolarHBondContact NH2-O 3.16Å; R275-G587 VanDerWaalsContact NH2-O 3.1Å
276	E	89.8	Confident	90.4	Very high	37 Å²	37	54 Å²	54	17%	0.173	26%	0.256	C	S	.	.	H	α-helix	trans	-77.8	-48.7	-168	-76.7	45.8	108.5	0	0	110.1	Q274 K279 A280 M585 K586	Q274-E276 PolarHBondContact O-N 2.99Å; E276-K279 PolarHBondContact O-N 3.32Å; E276-A280 WeakPolarHBondContact O-CB 3.16Å; E276-A280 PolarHBondContact O-N 2.89Å; E276-M585 HydrophobicContact CB-CB 4.03Å; E276-M585 HydrophobicContact CG-CB 4.24Å; E276-K586 VanDerWaalsContact CD-CG 3.4Å; E276-K586 HydrophobicContact CG-CB 4.22Å; E276-K586 HydrophobicContact CG-CD 4.39Å; E276-K586 HydrophobicContact CG-CG 3.32Å
277	T	91.4	Very high	91.3	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.006	23%	0.23	C	C	.	.	H	α-helix	trans	-71	-34.5	173.8	45.9	0	0	0	0	111.9	M271 Q274 A280 L281 P513 W515 A516	M271-T277 WeakPolarHBondContact CA-OG1 3.42Å; M271-T277 PolarHBondContact O-OG1 3.22Å; Q274-T277 VanDerWaalsContact CB-OG1 3.3Å; Q274-T277 WeakPolarHBondContact CB-OG1 3.35Å; Q274-T277 PolarHBondContact O-OG1 2.68Å; T277-A280 PolarHBondContact O-N 2.82Å; T277-L281 VanDerWaalsContact O-CB 3.22Å; T277-L281 WeakPolarHBondContact O-CB 3.31Å; T277-L281 PolarHBondContact O-N 2.8Å; T277-P513 HydrophobicContact CG2-CG 3.56Å; T277-W515 HydrophobicContact CG2-CH2 4Å; T277-W515 HydrophobicContact CG2-CZ2 3.46Å; T277-W515 VanDerWaalsContact CG2-CZ2 3.46Å; T277-A516 HydrophobicContact CG2-CB 4.13Å
278	R	94.2	Very high	92.2	Very high	104 Å²	104	48.1 Å²	48.1	39%	0.392	22%	0.218	S	C	.	.	H	α-helix	trans	-60.7	-44.7	170.9	-178.1	174.9	63.9	-141.4	7.2	111.6	M271 I272 Q274 L281 V282	M271-R278 PolarHBondContact O-N 2.92Å; M271-R278 VanDerWaalsContact O-N 3.13Å; I272-R278 WeakPolarHBondContact O-CD 3.42Å; I272-R278 PolarHBondContact O-NH1 3.39Å; Q274-R278 WeakPolarHBondContact O-CB 3.27Å; Q274-R278 PolarHBondContact O-N 2.91Å; R278-L281 PolarHBondContact O-N 3.21Å; R278-V282 WeakPolarHBondContact O-CG2 3.42Å; R278-V282 PolarHBondContact O-N 3.07Å
279	K	94.7	Very high	92.9	Very high	10 Å²	10	44 Å²	44	4%	0.043	20%	0.202	C	C	.	.	H	α-helix	trans	-64.4	-46.5	176.8	-175.9	-170.9	179.9	-178.4	0	111.3	R275 E276 L281 V282 I283 I584 M585 G587 S588 W589	R275-K279 VanDerWaalsContact O-CB 3.29Å; R275-K279 WeakPolarHBondContact O-CB 2.91Å; R275-K279 PolarHBondContact O-N 3.44Å; E276-K279 PolarHBondContact O-N 3.32Å; K279-L281 VanDerWaalsContact C-N 3.31Å; K279-L281 PolarHBondContact O-N 3.42Å; K279-V282 PolarHBondContact O-N 2.94Å; K279-I283 HydrophobicContact CD-CD1 4.48Å; K279-I283 HydrophobicContact CG-CD1 3.87Å; K279-I283 WeakPolarHBondContact O-CG1 3.38Å; K279-I283 PolarHBondContact O-N 3.28Å; K279-I584 PolarHBondContact NZ-O 3.16Å; K279-M585 WeakPolarHBondContact CD-O 2.97Å; K279-M585 HydrophobicContact CD-SD 4.17Å; K279-M585 HydrophobicContact CG-SD 4.43Å; K279-M585 PolarHBondContact NZ-O 3.1Å; K279-G587 PolarHBondContact NZ-O 3.03Å; K279-S588 PolarHBondContact NZ-O 3.36Å; K279-W589 HydrophobicContact CB-CH2 4.23Å; K279-W589 HydrophobicContact CB-CZ2 4.43Å; K279-W589 HydrophobicContact CB-CZ3 4.47Å; K279-W589 HydrophobicContact CG-CD2 4.37Å; K279-W589 HydrophobicContact CG-CE3 4.02Å; K279-W589 HydrophobicContact CG-CH2 4.17Å; K279-W589 HydrophobicContact CG-CZ2 4.5Å; K279-W589 HydrophobicContact CG-CZ3 3.91Å
280	A	94.9	Very high	93.6	Very high	1 Å²	1	40 Å²	40	1%	0.008	18%	0.18	C	C	.	.	H	α-helix	trans	-57.9	-44.5	175.3	0	0	0	0	0	111.3	E276 T277 V282 I283 G284 I511 F512 M585	E276-A280 WeakPolarHBondContact O-CB 3.16Å; E276-A280 PolarHBondContact O-N 2.89Å; T277-A280 PolarHBondContact O-N 2.82Å; A280-V282 PolarHBondContact O-N 2.94Å; A280-I283 PolarHBondContact O-N 3.29Å; A280-G284 PolarHBondContact O-N 3.16Å; A280-I511 HydrophobicContact CB-CB 4.28Å; A280-I511 HydrophobicContact CB-CD1 4.3Å; A280-I511 HydrophobicContact CB-CG1 4.21Å; A280-I511 VanDerWaalsContact O-CD1 3.22Å; A280-I511 WeakPolarHBondContact O-CD1 3.47Å; A280-F512 HydrophobicContact CB-CD1 3.94Å; A280-F512 HydrophobicContact CB-CE1 3.93Å; A280-M585 HydrophobicContact CB-CG 4.48Å; A280-M585 HydrophobicContact CB-SD 4.27Å
281	L	95.5	Very high	94.1	Very high	22 Å²	22	37.9 Å²	37.9	12%	0.115	17%	0.17	C	C	.	.	H	α-helix	trans	-61.7	-46.3	178.1	-175.3	63	0	0	0	111.9	M271 T277 R278 K279 G284 C285 F512 I523 T524	M271-L281 HydrophobicContact CE-CD1 4.48Å; T277-L281 VanDerWaalsContact O-CB 3.22Å; T277-L281 WeakPolarHBondContact O-CB 3.31Å; T277-L281 PolarHBondContact O-N 2.8Å; R278-L281 PolarHBondContact O-N 3.21Å; K279-L281 VanDerWaalsContact C-N 3.31Å; K279-L281 PolarHBondContact O-N 3.42Å; L281-G284 PolarHBondContact O-N 3.01Å; L281-C285 WeakPolarHBondContact O-CB 3.48Å; L281-C285 PolarHBondContact O-N 3.18Å; L281-C285 PolarHBondContact O-SG 3.35Å; L281-F512 HydrophobicContact CB-CE1 4.15Å; L281-F512 HydrophobicContact CD1-CE1 4.29Å; L281-F512 HydrophobicContact CD1-CZ 4.23Å; L281-I523 HydrophobicContact CD1-CB 4.06Å; L281-I523 HydrophobicContact CD1-CD1 4.28Å; L281-I523 HydrophobicContact CD1-CG2 3.79Å; L281-T524 HydrophobicContact CD1-CG2 4.32Å
282	V	96.7	Very high	94.6	Very high	55 Å²	55	38.1 Å²	38.1	33%	0.333	17%	0.171	S	C	.	.	H	α-helix	trans	-64	-45.9	178.1	170.1	0	0	0	0	111.5	R278 K279 A280 G284 C285 L286 W589	R278-V282 WeakPolarHBondContact O-CG2 3.42Å; R278-V282 PolarHBondContact O-N 3.07Å; K279-V282 PolarHBondContact O-N 2.94Å; A280-V282 PolarHBondContact O-N 2.94Å; V282-G284 VanDerWaalsContact C-N 3.34Å; V282-G284 PolarHBondContact O-N 3.39Å; V282-C285 PolarHBondContact O-N 3.36Å; V282-L286 HydrophobicContact CG1-CD1 3.7Å; V282-L286 HydrophobicContact CG1-CG 4.33Å; V282-L286 WeakPolarHBondContact O-CB 3.25Å; V282-L286 VanDerWaalsContact O-CG 3.25Å; V282-L286 WeakPolarHBondContact O-CG 3.33Å; V282-L286 PolarHBondContact O-N 3.41Å; V282-W589 HydrophobicContact CB-CH2 3.77Å; V282-W589 HydrophobicContact CB-CZ3 3.98Å; V282-W589 HydrophobicContact CG1-CH2 3.83Å; V282-W589 HydrophobicContact CG1-CZ3 3.72Å; V282-W589 HydrophobicContact CG2-CH2 4.02Å
283	I	96.9	Very high	94.8	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-60	-47.7	176.6	-69	168.2	0	0	0	110.2	K279 A280 C285 L286 L287 I511 I569 V570 M585	K279-I283 HydrophobicContact CD-CD1 4.48Å; K279-I283 HydrophobicContact CG-CD1 3.87Å; K279-I283 WeakPolarHBondContact O-CG1 3.38Å; K279-I283 PolarHBondContact O-N 3.28Å; A280-I283 PolarHBondContact O-N 3.29Å; I283-C285 PolarHBondContact O-N 3.5Å; I283-L286 PolarHBondContact O-N 3.45Å; I283-L287 HydrophobicContact CG2-CD1 3.97Å; I283-L287 HydrophobicContact CG2-CG 4.47Å; I283-L287 WeakPolarHBondContact O-CB 3.48Å; I283-L287 WeakPolarHBondContact O-CG 3.46Å; I283-L287 PolarHBondContact O-N 3.18Å; I283-I511 HydrophobicContact CG2-CD1 4.49Å; I283-I569 HydrophobicContact CG1-CB 4.41Å; I283-I569 HydrophobicContact CG1-CD1 3.98Å; I283-I569 HydrophobicContact CG1-CG1 4.11Å; I283-V570 HydrophobicContact CG2-CG2 4.26Å; I283-M585 HydrophobicContact CD1-SD 4.32Å
284	G	96.4	Very high	95.2	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-60.3	-43.7	179.8	0	0	0	0	0	113.5	A280 L281 V282 M288 N508	A280-G284 PolarHBondContact O-N 3.16Å; L281-G284 PolarHBondContact O-N 3.01Å; V282-G284 VanDerWaalsContact C-N 3.34Å; V282-G284 PolarHBondContact O-N 3.39Å; G284-M288 WeakPolarHBondContact O-CG 3.39Å; G284-M288 PolarHBondContact O-N 3.34Å; G284-N508 WeakPolarHBondContact CA-OD1 3.49Å; G284-N508 PolarHBondContact O-ND2 3.33Å
285	C	97.7	Very high	95.5	Very high	24 Å²	24	24 Å²	24	16%	0.162	11%	0.113	C	C	.	.	H	α-helix	trans	-66.6	-47.1	176	-66.9	0	0	0	0	111.2	L281 V282 I283 L287 M288 V289 V527	L281-C285 WeakPolarHBondContact O-CB 3.48Å; L281-C285 PolarHBondContact O-N 3.18Å; L281-C285 PolarHBondContact O-SG 3.35Å; V282-C285 PolarHBondContact O-N 3.36Å; I283-C285 PolarHBondContact O-N 3.5Å; C285-L287 VanDerWaalsContact C-N 3.3Å; C285-L287 PolarHBondContact O-N 3.32Å; C285-M288 PolarHBondContact O-N 3.38Å; C285-V289 VanDerWaalsContact O-CG2 3.28Å; C285-V289 WeakPolarHBondContact O-CG2 3.02Å; C285-V289 PolarHBondContact O-N 2.91Å; C285-V527 HydrophobicContact CB-CG1 4.19Å; C285-V527 HydrophobicContact CB-CG2 4.33Å
286	L	98.1	Very high	95.7	Very high	49 Å²	49	18.6 Å²	18.6	26%	0.257	9%	0.092	S	C	.	.	H	α-helix	trans	-62.3	-37.2	179.6	-71.7	170.6	0	0	0	112.3	V282 I283 M288 V289 F290 I565 I569	V282-L286 HydrophobicContact CG1-CD1 3.7Å; V282-L286 HydrophobicContact CG1-CG 4.33Å; V282-L286 WeakPolarHBondContact O-CB 3.25Å; V282-L286 VanDerWaalsContact O-CG 3.25Å; V282-L286 WeakPolarHBondContact O-CG 3.33Å; V282-L286 PolarHBondContact O-N 3.41Å; I283-L286 PolarHBondContact O-N 3.45Å; L286-M288 VanDerWaalsContact C-N 3.31Å; L286-M288 PolarHBondContact O-N 3.48Å; L286-V289 PolarHBondContact O-N 3.46Å; L286-F290 HydrophobicContact CD2-CE2 4.1Å; L286-F290 WeakPolarHBondContact O-CD2 3.45Å; L286-F290 PolarHBondContact O-N 3.09Å; L286-I565 HydrophobicContact CD1-CG2 4.09Å; L286-I569 HydrophobicContact CD1-CD1 3.53Å
287	L	97.9	Very high	95.7	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-55.8	-46.5	171.4	-80.9	168.6	0	0	0	111.6	I283 C285 Q291 L349 P504 I507 F566 V570	I283-L287 HydrophobicContact CG2-CD1 3.97Å; I283-L287 HydrophobicContact CG2-CG 4.47Å; I283-L287 WeakPolarHBondContact O-CB 3.48Å; I283-L287 WeakPolarHBondContact O-CG 3.46Å; I283-L287 PolarHBondContact O-N 3.18Å; C285-L287 VanDerWaalsContact C-N 3.3Å; C285-L287 PolarHBondContact O-N 3.32Å; L287-Q291 WeakPolarHBondContact O-CB 3.31Å; L287-Q291 PolarHBondContact O-N 2.64Å; L287-L349 HydrophobicContact CD2-CD1 4.47Å; L287-L349 HydrophobicContact CD2-CD2 3.57Å; L287-P504 HydrophobicContact CB-CB 4.18Å; L287-P504 HydrophobicContact CD2-CG 4.43Å; L287-I507 HydrophobicContact CD1-CB 4.05Å; L287-I507 HydrophobicContact CD1-CD1 4.33Å; L287-I507 HydrophobicContact CD1-CG2 3.65Å; L287-F566 HydrophobicContact CD2-CD1 3.96Å; L287-F566 HydrophobicContact CD2-CE1 3.75Å; L287-F566 HydrophobicContact CD2-CG 4.48Å; L287-F566 HydrophobicContact CD2-CZ 4.05Å; L287-F566 HydrophobicContact CG-CE1 4.31Å; L287-V570 HydrophobicContact CD1-CG2 4.49Å; L287-V570 HydrophobicContact CD2-CG2 3.85Å; L287-V570 HydrophobicContact CG-CG2 4.2Å
288	M	97.2	Very high	95.5	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-71.7	-40.7	179.8	-64.8	-61.4	-173.9	0	0	112.6	G284 C285 L286 Q291 Q292 P504 W505 N508 T524 V527 N528	G284-M288 WeakPolarHBondContact O-CG 3.39Å; G284-M288 PolarHBondContact O-N 3.34Å; C285-M288 PolarHBondContact O-N 3.38Å; L286-M288 VanDerWaalsContact C-N 3.31Å; L286-M288 PolarHBondContact O-N 3.48Å; M288-Q291 PolarHBondContact O-N 3.33Å; M288-Q292 WeakPolarHBondContact O-CG 3.14Å; M288-Q292 PolarHBondContact O-N 2.82Å; M288-P504 HydrophobicContact SD-CB 4.5Å; M288-W505 HydrophobicContact CE-CD2 3.65Å; M288-W505 HydrophobicContact CE-CE3 3.83Å; M288-W505 HydrophobicContact CE-CG 4.04Å; M288-W505 HydrophobicContact CE-CH2 4.47Å; M288-W505 HydrophobicContact CE-CZ2 4.29Å; M288-W505 HydrophobicContact CE-CZ3 4.25Å; M288-W505 HydrophobicContact SD-CZ2 4.39Å; M288-N508 HydrophobicContact CE-CB 4.19Å; M288-N508 WeakPolarHBondContact CE-ND2 3.32Å; M288-T524 WeakPolarHBondContact CG-O 3.09Å; M288-V527 HydrophobicContact CB-CG1 4.22Å; M288-N528 HydrophobicContact CB-CB 3.93Å; M288-N528 HydrophobicContact CG-CB 4.06Å; M288-N528 HydrophobicContact SD-CB 3.85Å
289	V	98.1	Very high	95.4	Very high	17 Å²	17	12.3 Å²	12.3	10%	0.103	7%	0.068	C	C	.	.	H	α-helix	trans	-56.1	-55.1	176.3	170.6	0	0	0	0	110.9	C285 L286 Q292 L293 V527 F531	C285-V289 VanDerWaalsContact O-CG2 3.28Å; C285-V289 WeakPolarHBondContact O-CG2 3.02Å; C285-V289 PolarHBondContact O-N 2.91Å; L286-V289 PolarHBondContact O-N 3.46Å; V289-Q292 PolarHBondContact O-N 3.38Å; V289-L293 HydrophobicContact CG1-CD1 3.57Å; V289-L293 HydrophobicContact CG1-CG 4.24Å; V289-L293 WeakPolarHBondContact O-CB 3.48Å; V289-L293 VanDerWaalsContact O-CG 3.28Å; V289-L293 WeakPolarHBondContact O-CG 3.28Å; V289-L293 PolarHBondContact O-N 3.14Å; V289-V527 HydrophobicContact CG2-CG1 3.6Å; V289-F531 HydrophobicContact CG1-CD1 3.96Å; V289-F531 HydrophobicContact CG1-CE1 3.75Å; V289-F531 HydrophobicContact CG1-CG 4.42Å; V289-F531 HydrophobicContact CG1-CZ 4.06Å; V289-F531 HydrophobicContact CG2-CD1 4.4Å; V289-F531 HydrophobicContact CG2-CD2 3.73Å; V289-F531 HydrophobicContact CG2-CE1 4.22Å; V289-F531 HydrophobicContact CG2-CE2 3.52Å; V289-F531 HydrophobicContact CG2-CG 4.16Å; V289-F531 HydrophobicContact CG2-CZ 3.78Å
290	F	97.9	Very high	95.4	Very high	22 Å²	22	13 Å²	13	10%	0.096	7%	0.071	C	C	.	.	H	α-helix	trans	-78.5	-20.8	-175.6	-74.5	-73.2	0	0	0	113.7	L286 S294 V558 I561 I565 F566	L286-F290 HydrophobicContact CD2-CE2 4.1Å; L286-F290 WeakPolarHBondContact O-CD2 3.45Å; L286-F290 PolarHBondContact O-N 3.09Å; F290-S294 PolarHBondContact O-N 3.34Å; F290-V558 HydrophobicContact CD1-CG1 4.12Å; F290-V558 WeakPolarHBondContact CD1-O 3.39Å; F290-V558 HydrophobicContact CE1-CG1 4.06Å; F290-V558 WeakPolarHBondContact CE1-O 3.45Å; F290-I561 HydrophobicContact CE1-CB 4.14Å; F290-I561 HydrophobicContact CE1-CG2 3.91Å; F290-I561 HydrophobicContact CZ-CG2 3.86Å; F290-I565 HydrophobicContact CD2-CD1 4.33Å; F290-I565 HydrophobicContact CE2-CD1 3.36Å; F290-I565 HydrophobicContact CZ-CD1 3.54Å; F290-F566 HydrophobicContact CB-CE1 4Å; F290-F566 HydrophobicContact CB-CE2 4.34Å; F290-F566 HydrophobicContact CB-CZ 3.54Å; F290-F566 HydrophobicContact CD2-CE1 4.42Å
291	Q	96.8	Very high	95.2	Very high	3 Å²	3	13.4 Å²	13.4	1%	0.014	7%	0.073	C	C	.	.	H	α-helix	trans	-62.7	-47.4	165.7	-178.8	-172.6	70	0	0	110.2	L287 M288 S294 F496 L500 G501 N528	L287-Q291 WeakPolarHBondContact O-CB 3.31Å; L287-Q291 PolarHBondContact O-N 2.64Å; M288-Q291 PolarHBondContact O-N 3.33Å; Q291-S294 WeakPolarHBondContact O-CB 3.41Å; Q291-S294 PolarHBondContact O-N 3.25Å; Q291-S294 PolarHBondContact O-OG 3.2Å; Q291-F496 HydrophobicContact CG-CE2 3.92Å; Q291-F496 HydrophobicContact CG-CZ 3.67Å; Q291-L500 HydrophobicContact CB-CD1 4.4Å; Q291-L500 HydrophobicContact CG-CG 4.43Å; Q291-L500 PolarHBondContact NE2-O 3.02Å; Q291-G501 PolarHBondContact NE2-O 2.78Å; Q291-N528 PolarHBondContact OE1-OD1 3.39Å
292	Q	96.2	Very high	95	Very high	5 Å²	5	12.3 Å²	12.3	2%	0.023	7%	0.067	C	C	.	.	H	α-helix	trans	-77.1	-41.5	-175.8	-65.1	-57.2	-32.8	0	0	113.4	M288 V289 S294 G295 N297 N528 F531 N532	M288-Q292 WeakPolarHBondContact O-CG 3.14Å; M288-Q292 PolarHBondContact O-N 2.82Å; V289-Q292 PolarHBondContact O-N 3.38Å; Q292-S294 PolarHBondContact O-N 2.93Å; Q292-G295 PolarHBondContact O-N 3.18Å; Q292-N297 PolarHBondContact NE2-ND2 3.38Å; Q292-N297 PolarHBondContact OE1-ND2 3.16Å; Q292-N528 WeakPolarHBondContact CG-O 3.38Å; Q292-N528 WeakPolarHBondContact CG-OD1 3.06Å; Q292-N528 PolarHBondContact NE2-OD1 2.86Å; Q292-F531 HydrophobicContact CB-CB 3.91Å; Q292-N532 HydrophobicContact CG-CB 4.37Å
293	L	95.2	Very high	94.8	Very high	36 Å²	36	9.9 Å²	9.9	19%	0.188	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-7.9	174.6	-68.5	179.4	0	0	0	113.9	V289 G295 F531 V535 Y555 V558	V289-L293 HydrophobicContact CG1-CD1 3.57Å; V289-L293 HydrophobicContact CG1-CG 4.24Å; V289-L293 WeakPolarHBondContact O-CB 3.48Å; V289-L293 VanDerWaalsContact O-CG 3.28Å; V289-L293 WeakPolarHBondContact O-CG 3.28Å; V289-L293 PolarHBondContact O-N 3.14Å; L293-G295 PolarHBondContact O-N 3.17Å; L293-F531 HydrophobicContact CD1-CD1 4.15Å; L293-F531 HydrophobicContact CD1-CE1 4.24Å; L293-F531 HydrophobicContact CD2-CD1 3.96Å; L293-F531 HydrophobicContact CG-CD1 3.95Å; L293-V535 HydrophobicContact CD2-CG2 3.81Å; L293-Y555 WeakPolarHBondContact O-CD1 2.9Å; L293-V558 HydrophobicContact CB-CG1 3.63Å; L293-V558 HydrophobicContact CD1-CG1 3.89Å; L293-V558 HydrophobicContact CG-CG1 4.37Å
294	S	96	Very high	94.7	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.052	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-7.5	167.6	78.2	0	0	0	0	113.5	F290 Q291 Q292 Y492 S559	F290-S294 PolarHBondContact O-N 3.34Å; Q291-S294 WeakPolarHBondContact O-CB 3.41Å; Q291-S294 PolarHBondContact O-N 3.25Å; Q291-S294 PolarHBondContact O-OG 3.2Å; Q292-S294 PolarHBondContact O-N 2.93Å; S294-Y492 PolarHBondContact O-OH 2.72Å; S294-S559 WeakPolarHBondContact CA-OG 3.48Å; S294-S559 WeakPolarHBondContact CB-OG 3.38Å
295	G	94.1	Very high	94.4	Very high	1 Å²	1	10.5 Å²	10.5	1%	0.01	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.5	11.1	174.9	0	0	0	0	0	115.3	Q292 L293 N297 T298 V299 Y492	Q292-G295 PolarHBondContact O-N 3.18Å; L293-G295 PolarHBondContact O-N 3.17Å; G295-N297 PolarHBondContact O-N 2.66Å; G295-T298 WeakPolarHBondContact O-CB 3.39Å; G295-T298 PolarHBondContact O-N 2.91Å; G295-V299 WeakPolarHBondContact O-CG2 3.25Å; G295-V299 PolarHBondContact O-N 2.72Å; G295-Y492 VanDerWaalsContact C-OH 3.28Å
296	I	94.5	Very high	94.2	Very high	2 Å²	2	9.5 Å²	9.5	1%	0.01	5%	0.05	C	C	.	.	H	α-helix	trans	-63	-50.3	-166.5	-176.1	62.9	0	0	0	113.8	T298 V299 M300 Y492 L493 F496	I296-T298 VanDerWaalsContact C-N 3.28Å; I296-T298 PolarHBondContact O-N 2.8Å; I296-V299 PolarHBondContact O-N 2.95Å; I296-M300 HydrophobicContact CD1-CG 4.38Å; I296-M300 HydrophobicContact CD1-SD 4.34Å; I296-M300 HydrophobicContact CG1-CE 3.94Å; I296-M300 HydrophobicContact CG1-SD 4.24Å; I296-M300 VanDerWaalsContact O-CG 3.32Å; I296-M300 WeakPolarHBondContact O-CG 3.29Å; I296-M300 PolarHBondContact O-N 3.42Å; I296-Y492 WeakPolarHBondContact CA-OH 3.44Å; I296-Y492 HydrophobicContact CB-CE1 4.43Å; I296-Y492 WeakPolarHBondContact CB-OH 3.29Å; I296-Y492 HydrophobicContact CD1-CD1 4.24Å; I296-Y492 HydrophobicContact CD1-CE1 3.42Å; I296-Y492 VanDerWaalsContact CD1-CE1 3.42Å; I296-Y492 HydrophobicContact CG1-CE1 4.49Å; I296-Y492 PolarHBondContact N-OH 3.47Å; I296-L493 HydrophobicContact CD1-CD2 3.57Å; I296-F496 HydrophobicContact CB-CD2 3.92Å; I296-F496 HydrophobicContact CB-CE1 4.28Å; I296-F496 HydrophobicContact CB-CE2 3.57Å; I296-F496 HydrophobicContact CB-CG 4.43Å; I296-F496 HydrophobicContact CB-CZ 3.8Å; I296-F496 HydrophobicContact CD1-CB 4.05Å; I296-F496 HydrophobicContact CD1-CD1 3.71Å; I296-F496 HydrophobicContact CD1-CD2 3.91Å; I296-F496 HydrophobicContact CD1-CE1 4.13Å; I296-F496 HydrophobicContact CD1-CE2 4.33Å; I296-F496 HydrophobicContact CD1-CG 3.6Å; I296-F496 HydrophobicContact CD1-CZ 4.45Å; I296-F496 HydrophobicContact CG1-CD1 3.67Å; I296-F496 HydrophobicContact CG1-CD2 3.83Å; I296-F496 HydrophobicContact CG1-CE1 3.55Å; I296-F496 HydrophobicContact CG1-CE2 3.73Å; I296-F496 HydrophobicContact CG1-CG 3.83Å; I296-F496 HydrophobicContact CG1-CZ 3.6Å; I296-F496 HydrophobicContact CG2-CD2 4.46Å; I296-F496 HydrophobicContact CG2-CE1 4.29Å; I296-F496 HydrophobicContact CG2-CE2 3.63Å; I296-F496 HydrophobicContact CG2-CZ 3.54Å
297	N	89.4	Confident	94	Very high	8 Å²	8	7.2 Å²	7.2	4%	0.043	4%	0.038	C	C	.	.	H	α-helix	trans	-65.6	-37.6	-177.1	-82.9	-48.8	0	0	0	110.8	Q292 G295 M300 Y301 N532	Q292-N297 PolarHBondContact NE2-ND2 3.38Å; Q292-N297 PolarHBondContact OE1-ND2 3.16Å; G295-N297 PolarHBondContact O-N 2.66Å; N297-M300 HydrophobicContact CB-CE 4.33Å; N297-M300 CarbonylContact O-C 3.51Å; N297-M300 PolarHBondContact O-N 2.83Å; N297-M300 VanDerWaalsContact O-N 3.17Å; N297-M300 WeakPolarHBondContact OD1-CE 3.41Å; N297-Y301 VanDerWaalsContact C-CD2 3.43Å; N297-Y301 HydrophobicContact CB-CD2 4.27Å; N297-Y301 HydrophobicContact CB-CE2 3.59Å; N297-Y301 WeakPolarHBondContact O-CD2 3.49Å; N297-Y301 PolarHBondContact O-N 3Å; N297-N532 WeakPolarHBondContact CB-ND2 3.34Å; N297-N532 PolarHBondContact ND2-ND2 3.28Å
298	T	87.2	Confident	93.7	Very high	1 Å²	1	8.8 Å²	8.8	1%	0.006	5%	0.045	C	C	.	.	H	α-helix	trans	-61.5	-46.8	171.9	-60.5	0	0	0	0	113.1	G295 I296 M300 Y301 Y302 V535 F539	G295-T298 WeakPolarHBondContact O-CB 3.39Å; G295-T298 PolarHBondContact O-N 2.91Å; I296-T298 VanDerWaalsContact C-N 3.28Å; I296-T298 PolarHBondContact O-N 2.8Å; T298-M300 PolarHBondContact O-N 3.05Å; T298-Y301 PolarHBondContact O-N 2.89Å; T298-Y302 HydrophobicContact CG2-CD2 3.8Å; T298-Y302 HydrophobicContact CG2-CE2 4.22Å; T298-Y302 WeakPolarHBondContact O-CB 3.44Å; T298-Y302 WeakPolarHBondContact O-CD2 3.29Å; T298-Y302 PolarHBondContact O-N 3.14Å; T298-V535 WeakPolarHBondContact OG1-CG1 3.47Å; T298-F539 HydrophobicContact CG2-CB 3.3Å; T298-F539 HydrophobicContact CG2-CD1 3.28Å; T298-F539 HydrophobicContact CG2-CD2 3.4Å; T298-F539 VanDerWaalsContact CG2-CD2 3.4Å; T298-F539 HydrophobicContact CG2-CE1 3.84Å; T298-F539 HydrophobicContact CG2-CE2 3.94Å; T298-F539 HydrophobicContact CG2-CG 3.01Å; T298-F539 HydrophobicContact CG2-CZ 4.13Å
299	V	92.5	Very high	93.4	Very high	2 Å²	2	10 Å²	10	1%	0.012	5%	0.052	C	C	.	.	H	α-helix	trans	-60	-34	174.7	169	0	0	0	0	111	G295 I296 S303 I306 M489 Y492 L493 F552	G295-V299 WeakPolarHBondContact O-CG2 3.25Å; G295-V299 PolarHBondContact O-N 2.72Å; I296-V299 PolarHBondContact O-N 2.95Å; V299-S303 WeakPolarHBondContact O-CA 3.43Å; V299-S303 WeakPolarHBondContact O-CB 3.37Å; V299-S303 PolarHBondContact O-N 3.34Å; V299-S303 VanDerWaalsContact O-N 3.13Å; V299-I306 HydrophobicContact CB-CD1 4.31Å; V299-I306 HydrophobicContact CG1-CD1 4.38Å; V299-I306 HydrophobicContact CG2-CD1 4.17Å; V299-M489 HydrophobicContact CG1-CE 3.48Å; V299-M489 VanDerWaalsContact CG1-CE 3.48Å; V299-M489 HydrophobicContact CG1-CG 4.02Å; V299-M489 HydrophobicContact CG1-SD 4.24Å; V299-M489 WeakPolarHBondContact O-CE 3.4Å; V299-Y492 HydrophobicContact CB-CD1 4.41Å; V299-Y492 HydrophobicContact CB-CE1 3.87Å; V299-Y492 HydrophobicContact CG1-CD1 3.9Å; V299-Y492 HydrophobicContact CG1-CE1 3.85Å; V299-Y492 HydrophobicContact CG2-CD1 4.45Å; V299-Y492 HydrophobicContact CG2-CE1 3.9Å; V299-L493 HydrophobicContact CG1-CD2 4.26Å; V299-F552 HydrophobicContact CG2-CE1 4.29Å
300	M	93.4	Very high	93.2	Very high	23 Å²	23	9.3 Å²	9.3	11%	0.113	5%	0.047	C	C	.	.	H	α-helix	trans	-74.7	-48.3	176	-65.8	-175.4	-56.8	0	0	112.5	T45 S49 L166 I296 N297 T298 Y302 S303 L493	T45-M300 HydrophobicContact CG2-CB 3.8Å; T45-M300 HydrophobicContact CG2-CE 3.91Å; T45-M300 HydrophobicContact CG2-SD 4.38Å; S49-M300 WeakPolarHBondContact CB-O 3.29Å; L166-M300 HydrophobicContact CD1-SD 3.52Å; L166-M300 VanDerWaalsContact CD1-SD 3.52Å; L166-M300 HydrophobicContact CD2-CB 4.49Å; L166-M300 HydrophobicContact CD2-SD 4.07Å; L166-M300 HydrophobicContact CG-SD 4.49Å; I296-M300 HydrophobicContact CD1-CG 4.38Å; I296-M300 HydrophobicContact CD1-SD 4.34Å; I296-M300 HydrophobicContact CG1-CE 3.94Å; I296-M300 HydrophobicContact CG1-SD 4.24Å; I296-M300 VanDerWaalsContact O-CG 3.32Å; I296-M300 WeakPolarHBondContact O-CG 3.29Å; I296-M300 PolarHBondContact O-N 3.42Å; N297-M300 HydrophobicContact CB-CE 4.33Å; N297-M300 CarbonylContact O-C 3.51Å; N297-M300 PolarHBondContact O-N 2.83Å; N297-M300 VanDerWaalsContact O-N 3.17Å; N297-M300 WeakPolarHBondContact OD1-CE 3.41Å; T298-M300 PolarHBondContact O-N 3.05Å; M300-Y302 VanDerWaalsContact C-N 3.3Å; M300-Y302 PolarHBondContact O-N 3.22Å; M300-S303 PolarHBondContact O-N 3.41Å; M300-L493 HydrophobicContact CG-CD2 4.14Å
301	Y	91.8	Very high	92.9	Very high	10 Å²	10	8.8 Å²	8.8	4%	0.039	5%	0.049	C	C	.	.	H	α-helix	trans	-62.5	-36.5	179.9	-60.5	-44.6	0	0	0	112.6	T45 S49 V70 V74 N297 T298 N532 S536	T45-Y301 HydrophobicContact CG2-CD1 3.89Å; T45-Y301 HydrophobicContact CG2-CE1 3.58Å; S49-Y301 VanDerWaalsContact CA-O 3.26Å; S49-Y301 WeakPolarHBondContact CA-O 3.38Å; V70-Y301 HydrophobicContact CG1-CD1 4.16Å; V70-Y301 HydrophobicContact CG1-CD2 3.26Å; V70-Y301 HydrophobicContact CG1-CE2 3.73Å; V70-Y301 HydrophobicContact CG1-CG 3.55Å; V74-Y301 HydrophobicContact CG2-CE2 4.03Å; V74-Y301 WeakPolarHBondContact CG2-OH 3.42Å; N297-Y301 VanDerWaalsContact C-CD2 3.43Å; N297-Y301 HydrophobicContact CB-CD2 4.27Å; N297-Y301 HydrophobicContact CB-CE2 3.59Å; N297-Y301 WeakPolarHBondContact O-CD2 3.49Å; N297-Y301 PolarHBondContact O-N 3Å; T298-Y301 PolarHBondContact O-N 2.89Å; Y301-N532 PolarHBondContact OH-ND2 3.47Å; Y301-S536 WeakPolarHBondContact CE2-OG 2.93Å
302	Y	90.3	Very high	92.7	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.051	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	24.6	-178.1	-59.5	-67.9	0	0	0	111.9	V70 T298 M300 A304 T305 I306 F539 L540	V70-Y302 HydrophobicContact CG2-CE1 4.37Å; T298-Y302 HydrophobicContact CG2-CD2 3.8Å; T298-Y302 HydrophobicContact CG2-CE2 4.22Å; T298-Y302 WeakPolarHBondContact O-CB 3.44Å; T298-Y302 WeakPolarHBondContact O-CD2 3.29Å; T298-Y302 PolarHBondContact O-N 3.14Å; M300-Y302 VanDerWaalsContact C-N 3.3Å; M300-Y302 PolarHBondContact O-N 3.22Å; Y302-A304 PolarHBondContact O-N 2.9Å; Y302-T305 CarbonylContact O-C 3.58Å; Y302-T305 WeakPolarHBondContact O-CB 3.4Å; Y302-T305 PolarHBondContact O-N 2.64Å; Y302-I306 WeakPolarHBondContact O-CB 3.46Å; Y302-I306 VanDerWaalsContact O-CG1 3.23Å; Y302-I306 WeakPolarHBondContact O-CG1 3.49Å; Y302-I306 PolarHBondContact O-N 3.28Å; Y302-F539 AromaticContact CD2-CD1 3.63Å; Y302-F539 HydrophobicContact CD2-CD1 3.63Å; Y302-F539 HydrophobicContact CD2-CE1 4.03Å; Y302-F539 AromaticContact CE2-CD1 3.99Å; Y302-F539 HydrophobicContact CE2-CD1 3.99Å; Y302-F539 HydrophobicContact CG-CD1 4.31Å; Y302-F539 HydrophobicContact CG-CE1 4.35Å; Y302-L540 HydrophobicContact CE1-CD1 3.98Å; Y302-L540 HydrophobicContact CE1-CG 4.43Å
303	S	94.5	Very high	92.3	Very high	3 Å²	3	13.5 Å²	13.5	2%	0.021	7%	0.067	C	C	.	.	H	α-helix	trans	-57.1	-52.8	-174.3	171.3	0	0	0	0	112.5	S49 V299 M300 T305 I306 V307 A322 M489	S49-S303 WeakPolarHBondContact OG-CB 3.47Å; S49-S303 PolarHBondContact OG-N 2.97Å; V299-S303 WeakPolarHBondContact O-CA 3.43Å; V299-S303 WeakPolarHBondContact O-CB 3.37Å; V299-S303 PolarHBondContact O-N 3.34Å; V299-S303 VanDerWaalsContact O-N 3.13Å; M300-S303 PolarHBondContact O-N 3.41Å; S303-T305 VanDerWaalsContact C-N 3.31Å; S303-T305 PolarHBondContact O-N 3.46Å; S303-I306 PolarHBondContact O-N 2.73Å; S303-V307 WeakPolarHBondContact O-CG2 3.39Å; S303-V307 PolarHBondContact O-N 2.94Å; S303-A322 WeakPolarHBondContact OG-CB 3.44Å; S303-M489 WeakPolarHBondContact OG-CE 3.4Å
304	A	93.9	Very high	91.9	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-66.6	-35.8	179.7	0	0	0	0	0	111.2	S49 L53 Y302 V307 Q308 I319 A322	S49-A304 WeakPolarHBondContact O-CB 3.32Å; S49-A304 WeakPolarHBondContact OG-CB 3.36Å; S49-A304 PolarHBondContact OG-N 2.66Å; L53-A304 HydrophobicContact CD1-CB 3.53Å; L53-A304 HydrophobicContact CG-CB 4.07Å; Y302-A304 PolarHBondContact O-N 2.9Å; A304-V307 PolarHBondContact O-N 3.07Å; A304-Q308 PolarHBondContact O-N 3.31Å; A304-I319 HydrophobicContact CB-CG1 4.26Å; A304-A322 HydrophobicContact CB-CB 4.04Å
305	T	90.5	Very high	91.5	Very high	15 Å²	15	16.1 Å²	16.1	9%	0.092	8%	0.083	C	C	.	.	H	α-helix	trans	-61.2	-46.1	171.5	-49.9	0	0	0	0	111.6	Y302 S303 V307 Q308 L309	Y302-T305 CarbonylContact O-C 3.58Å; Y302-T305 WeakPolarHBondContact O-CB 3.4Å; Y302-T305 PolarHBondContact O-N 2.64Å; S303-T305 VanDerWaalsContact C-N 3.31Å; S303-T305 PolarHBondContact O-N 3.46Å; T305-V307 VanDerWaalsContact C-N 3.29Å; T305-V307 PolarHBondContact O-N 3.49Å; T305-Q308 CarbonylContact O-C 3.58Å; T305-Q308 WeakPolarHBondContact O-CB 3.33Å; T305-Q308 PolarHBondContact O-N 3.28Å; T305-Q308 VanDerWaalsContact O-N 3.09Å; T305-L309 HydrophobicContact CG2-CD1 4.47Å; T305-L309 HydrophobicContact CG2-CG 4.38Å; T305-L309 VanDerWaalsContact O-CG 3.28Å; T305-L309 WeakPolarHBondContact O-CG 3.42Å; T305-L309 PolarHBondContact O-N 3.44Å
306	I	92.4	Very high	91.3	Very high	3 Å²	3	17 Å²	17	2%	0.015	9%	0.089	C	C	.	.	H	α-helix	trans	-61.5	-39.7	177.9	-71.4	165.2	0	0	0	110.7	V299 Y302 S303 L309 G310 F367 M489 F539 F552	V299-I306 HydrophobicContact CB-CD1 4.31Å; V299-I306 HydrophobicContact CG1-CD1 4.38Å; V299-I306 HydrophobicContact CG2-CD1 4.17Å; Y302-I306 WeakPolarHBondContact O-CB 3.46Å; Y302-I306 VanDerWaalsContact O-CG1 3.23Å; Y302-I306 WeakPolarHBondContact O-CG1 3.49Å; Y302-I306 PolarHBondContact O-N 3.28Å; S303-I306 PolarHBondContact O-N 2.73Å; I306-L309 PolarHBondContact O-N 2.92Å; I306-G310 PolarHBondContact O-N 3.4Å; I306-F367 HydrophobicContact CG2-CE2 4.26Å; I306-F367 HydrophobicContact CG2-CZ 4.09Å; I306-M489 HydrophobicContact CG2-SD 4.31Å; I306-F539 HydrophobicContact CD1-CZ 4.19Å; I306-F539 HydrophobicContact CG1-CE1 4.48Å; I306-F539 HydrophobicContact CG1-CZ 4.28Å; I306-F552 HydrophobicContact CD1-CZ 4.37Å; I306-F552 HydrophobicContact CG2-CZ 4.45Å
307	V	95.2	Very high	91.2	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.006	11%	0.109	C	C	.	.	H	α-helix	trans	-62.8	-43.3	173.7	173.8	0	0	0	0	111	S303 A304 T305 G310 V312 A318 M321 I486	S303-V307 WeakPolarHBondContact O-CG2 3.39Å; S303-V307 PolarHBondContact O-N 2.94Å; A304-V307 PolarHBondContact O-N 3.07Å; T305-V307 VanDerWaalsContact C-N 3.29Å; T305-V307 PolarHBondContact O-N 3.49Å; V307-G310 WeakPolarHBondContact O-CA 3.44Å; V307-G310 PolarHBondContact O-N 2.77Å; V307-G310 VanDerWaalsContact O-N 3.11Å; V307-V312 HydrophobicContact CG1-CB 3.87Å; V307-V312 HydrophobicContact CG1-CG1 4.3Å; V307-V312 HydrophobicContact CG1-CG2 3.61Å; V307-A318 HydrophobicContact CB-CB 4.36Å; V307-A318 HydrophobicContact CG1-CB 3.99Å; V307-M321 HydrophobicContact CG1-CB 3.88Å; V307-M321 HydrophobicContact CG1-CG 4.39Å; V307-M321 HydrophobicContact CG2-CB 4.31Å; V307-I486 HydrophobicContact CG1-CD1 4.12Å; V307-I486 HydrophobicContact CG1-CG1 4.26Å; V307-I486 HydrophobicContact CG2-CG1 4.29Å
308	Q	91.2	Very high	91.4	Very high	33 Å²	33	20.5 Å²	20.5	15%	0.154	11%	0.107	C	C	.	.	H	α-helix	trans	-65.8	-42.7	176.7	-175.3	172.5	54	0	0	112	A304 T305 G310 G311 V312 Y476	A304-Q308 PolarHBondContact O-N 3.31Å; T305-Q308 CarbonylContact O-C 3.58Å; T305-Q308 WeakPolarHBondContact O-CB 3.33Å; T305-Q308 PolarHBondContact O-N 3.28Å; T305-Q308 VanDerWaalsContact O-N 3.09Å; Q308-G310 PolarHBondContact O-N 2.62Å; Q308-G310 VanDerWaalsContact O-N 3.12Å; Q308-G311 WeakPolarHBondContact O-CA 3.34Å; Q308-G311 PolarHBondContact O-N 2.97Å; Q308-V312 PolarHBondContact O-N 2.7Å; Q308-Y476 HydrophobicContact CG-CD1 3.47Å; Q308-Y476 VanDerWaalsContact CG-CD1 3.47Å; Q308-Y476 HydrophobicContact CG-CE1 3.81Å; Q308-Y476 HydrophobicContact CG-CG 4.28Å; Q308-Y476 WeakPolarHBondContact O-CB 3.28Å
309	L	91.1	Very high	91.8	Very high	26 Å²	26	20.5 Å²	20.5	14%	0.136	11%	0.107	C	C	.	.	H	α-helix	trans	-57.5	-26.5	171.6	-67.8	179.1	0	0	0	112	T305 I306 G311 F367 G475 R548	T305-L309 HydrophobicContact CG2-CD1 4.47Å; T305-L309 HydrophobicContact CG2-CG 4.38Å; T305-L309 VanDerWaalsContact O-CG 3.28Å; T305-L309 WeakPolarHBondContact O-CG 3.42Å; T305-L309 PolarHBondContact O-N 3.44Å; I306-L309 PolarHBondContact O-N 2.92Å; L309-G311 PolarHBondContact O-N 2.93Å; L309-F367 HydrophobicContact CB-CE1 3.95Å; L309-F367 HydrophobicContact CB-CZ 4.25Å; L309-G475 VanDerWaalsContact CD2-O 3.23Å; L309-G475 WeakPolarHBondContact CD2-O 3.47Å; L309-R548 PolarHBondContact O-NH1 3.5Å
310	G	93	Very high	92	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.01	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-1.9	172.3	0	0	0	0	0	114.7	I306 V307 Q308 T479 S482	I306-G310 PolarHBondContact O-N 3.4Å; V307-G310 WeakPolarHBondContact O-CA 3.44Å; V307-G310 PolarHBondContact O-N 2.77Å; V307-G310 VanDerWaalsContact O-N 3.11Å; Q308-G310 PolarHBondContact O-N 2.62Å; Q308-G310 VanDerWaalsContact O-N 3.12Å; G310-T479 WeakPolarHBondContact O-CG2 3.32Å; G310-S482 WeakPolarHBondContact O-CA 3.26Å; G310-S482 WeakPolarHBondContact O-CB 3.22Å
311	G	91.9	Very high	92.1	Very high	12 Å²	12	26.7 Å²	26.7	12%	0.124	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	99	12.4	178	0	0	0	0	0	115.3	Q308 L309 R313 C477	Q308-G311 WeakPolarHBondContact O-CA 3.34Å; Q308-G311 PolarHBondContact O-N 2.97Å; L309-G311 PolarHBondContact O-N 2.93Å; G311-R313 PolarHBondContact O-N 2.92Å; G311-C477 WeakPolarHBondContact CA-O 3.49Å
312	V	93	Very high	92.3	Very high	12 Å²	12	26.4 Å²	26.4	7%	0.073	13%	0.132	C	C	.	.			trans	-81.6	108.2	174.7	179.8	0	0	0	0	109.8	V307 Q308 L317 A318 I486	V307-V312 HydrophobicContact CG1-CB 3.87Å; V307-V312 HydrophobicContact CG1-CG1 4.3Å; V307-V312 HydrophobicContact CG1-CG2 3.61Å; Q308-V312 PolarHBondContact O-N 2.7Å; V312-L317 HydrophobicContact CG1-CB 4.13Å; V312-L317 HydrophobicContact CG1-CD2 3.95Å; V312-L317 HydrophobicContact CG1-CG 3.96Å; V312-A318 HydrophobicContact CG1-CB 4.06Å; V312-I486 HydrophobicContact CG2-CD1 4.17Å
313	R	87	Confident	92.6	Very high	95 Å²	95	26.5 Å²	26.5	36%	0.358	13%	0.133	S	C	.	.			trans	-67.2	-51	-174.4	-55.8	172.7	64.7	80.4	30.5	114	G311 R315 Y416 F472 D473 Y476	G311-R313 PolarHBondContact O-N 2.92Å; R313-R315 PolarHBondContact O-N 3.39Å; R313-Y416 PolarHBondContact NH1-OH 3Å; R313-F472 PolarHBondContact NH2-O 3.38Å; R313-D473 IonicContact CZ-OD1 2.77Å; R313-D473 IonicContact NH1-OD1 2.81Å; R313-D473 PolarHBondContact NH1-OD1 3.35Å; R313-D473 IonicContact NH1-OD2 2.8Å; R313-D473 IonicContact NH2-OD1 3.27Å; R313-D473 PolarHBondContact NH2-OD1 3.41Å; R313-Y476 HydrophobicContact CB-CE2 4.35Å; R313-Y476 HydrophobicContact CG-CE2 3.86Å
314	S	87.4	Confident	92.8	Very high	56 Å²	56	29.9 Å²	29.9	39%	0.392	15%	0.153	S	C	.	.			trans	-70.7	125.3	-174.2	166.2	0	0	0	0	110.8	L317 A318	S314-L317 PolarHBondContact O-N 3.18Å; S314-L317 PolarHBondContact OG-N 3.43Å; S314-L317 VanDerWaalsContact OG-N 3.17Å; S314-A318 WeakPolarHBondContact O-CB 3.21Å; S314-A318 PolarHBondContact O-N 3.35Å
315	R	87.1	Confident	92.9	Very high	34 Å²	34	29.9 Å²	29.9	13%	0.128	15%	0.153	C	C	.	.	H	α-helix	trans	-57.2	-52.3	175	-66.3	-171.9	-68.2	172.9	2.3	110.5	D182 R313 L317 A318 I319 E461	D182-R315 IonicContact OD1-NH2 3.04Å; D182-R315 IonicContact OD2-CZ 3.54Å; D182-R315 IonicContact OD2-NH1 3.26Å; D182-R315 PolarHBondContact OD2-NH1 3.33Å; D182-R315 IonicContact OD2-NH2 3.83Å; D182-R315 PolarHBondContact OD2-NH2 3.45Å; R313-R315 PolarHBondContact O-N 3.39Å; R315-L317 VanDerWaalsContact C-N 3.33Å; R315-L317 PolarHBondContact O-N 2.73Å; R315-A318 WeakPolarHBondContact O-CB 3.19Å; R315-A318 PolarHBondContact O-N 3.14Å; R315-A318 VanDerWaalsContact O-N 3.13Å; R315-I319 VanDerWaalsContact O-CG1 3.24Å; R315-I319 WeakPolarHBondContact O-CG1 3.11Å; R315-I319 PolarHBondContact O-N 3.37Å; R315-E461 IonicContact CZ-OE1 2.75Å; R315-E461 VanDerWaalsContact CZ-OE1 3.3Å; R315-E461 IonicContact NE-OE1 2.82Å; R315-E461 PolarHBondContact NE-OE1 3.04Å; R315-E461 IonicContact NH2-OE1 3.26Å; R315-E461 PolarHBondContact NH2-OE1 3.5Å
316	T	90.4	Very high	93.1	Very high	21 Å²	21	29.9 Å²	29.9	13%	0.129	15%	0.154	C	C	.	.	H	α-helix	trans	-56.8	-43.3	177.7	-57.2	0	0	0	0	112.5	S177 Y178 I319 W320	S177-T316 WeakPolarHBondContact OG-CG2 3.1Å; S177-T316 PolarHBondContact OG-OG1 3.01Å; Y178-T316 HydrophobicContact CD1-CG2 4.45Å; Y178-T316 HydrophobicContact CE1-CG2 3.92Å; Y178-T316 HydrophobicContact CE2-CG2 4.03Å; T316-I319 PolarHBondContact O-N 3.36Å; T316-W320 VanDerWaalsContact O-CD1 3.26Å; T316-W320 PolarHBondContact O-N 2.94Å
317	L	92.9	Very high	93.4	Very high	82 Å²	82	30 Å²	30	43%	0.429	16%	0.155	S	C	.	.	H	α-helix	trans	-65.7	-41.8	176.8	-175.4	61.5	0	0	0	111.9	V312 S314 R315 I319 W320 M321	V312-L317 HydrophobicContact CG1-CB 4.13Å; V312-L317 HydrophobicContact CG1-CD2 3.95Å; V312-L317 HydrophobicContact CG1-CG 3.96Å; S314-L317 PolarHBondContact O-N 3.18Å; S314-L317 PolarHBondContact OG-N 3.43Å; S314-L317 VanDerWaalsContact OG-N 3.17Å; R315-L317 VanDerWaalsContact C-N 3.33Å; R315-L317 PolarHBondContact O-N 2.73Å; L317-I319 VanDerWaalsContact C-N 3.31Å; L317-I319 PolarHBondContact O-N 3.02Å; L317-W320 PolarHBondContact O-N 3.41Å; L317-M321 HydrophobicContact CD1-CE 4Å; L317-M321 HydrophobicContact CG-CE 4.49Å; L317-M321 VanDerWaalsContact O-CG 3.27Å; L317-M321 WeakPolarHBondContact O-CG 3.32Å; L317-M321 PolarHBondContact O-N 3.01Å
318	A	93.7	Very high	93.5	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-61.2	-40.8	176.2	0	0	0	0	0	111.6	L53 V307 V312 S314 R315 M321 A322	L53-A318 HydrophobicContact CD1-CB 4.25Å; V307-A318 HydrophobicContact CB-CB 4.36Å; V307-A318 HydrophobicContact CG1-CB 3.99Å; V312-A318 HydrophobicContact CG1-CB 4.06Å; S314-A318 WeakPolarHBondContact O-CB 3.21Å; S314-A318 PolarHBondContact O-N 3.35Å; R315-A318 WeakPolarHBondContact O-CB 3.19Å; R315-A318 PolarHBondContact O-N 3.14Å; R315-A318 VanDerWaalsContact O-N 3.13Å; A318-M321 PolarHBondContact O-N 2.94Å; A318-A322 WeakPolarHBondContact O-CB 3.29Å; A318-A322 PolarHBondContact O-N 2.69Å
319	I	94.6	Very high	93.7	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-65.2	-43.6	175.2	-61.7	167.4	0	0	0	110.9	L53 D173 A174 A304 R315 T316 L317 M321 A322 A323	L53-I319 HydrophobicContact CD1-CG1 4.03Å; D173-I319 HydrophobicContact CB-CG2 3.67Å; A174-I319 HydrophobicContact CB-CG2 3.91Å; A304-I319 HydrophobicContact CB-CG1 4.26Å; R315-I319 VanDerWaalsContact O-CG1 3.24Å; R315-I319 WeakPolarHBondContact O-CG1 3.11Å; R315-I319 PolarHBondContact O-N 3.37Å; T316-I319 PolarHBondContact O-N 3.36Å; L317-I319 VanDerWaalsContact C-N 3.31Å; L317-I319 PolarHBondContact O-N 3.02Å; I319-M321 PolarHBondContact O-N 3Å; I319-A322 WeakPolarHBondContact O-CB 3.39Å; I319-A322 PolarHBondContact O-N 3.4Å; I319-A323 WeakPolarHBondContact O-CB 3.4Å; I319-A323 PolarHBondContact O-N 3.05Å
320	W	96.8	Very high	93.9	Very high	89 Å²	89	33.5 Å²	33.5	34%	0.337	17%	0.169	S	C	.	.	H	α-helix	trans	-60.6	-43.2	174.2	-88.4	115	0	0	0	112.7	L171 A174 Y178 T316 L317 A323 V324	L171-W320 HydrophobicContact CD2-CZ3 3.86Å; A174-W320 HydrophobicContact CB-CD2 3.56Å; A174-W320 HydrophobicContact CB-CE3 3.87Å; A174-W320 HydrophobicContact CB-CG 3.98Å; A174-W320 HydrophobicContact CB-CH2 4.2Å; A174-W320 HydrophobicContact CB-CZ2 3.93Å; A174-W320 HydrophobicContact CB-CZ3 4.17Å; Y178-W320 HydrophobicContact CE2-CZ2 4.16Å; Y178-W320 AromaticContact CE2-NE1 3.42Å; Y178-W320 AromaticContact CZ-NE1 3.61Å; Y178-W320 PolarHBondContact OH-NE1 3.13Å; T316-W320 VanDerWaalsContact O-CD1 3.26Å; T316-W320 PolarHBondContact O-N 2.94Å; L317-W320 PolarHBondContact O-N 3.41Å; W320-A323 WeakPolarHBondContact O-CB 3.42Å; W320-A323 PolarHBondContact O-N 2.96Å; W320-V324 WeakPolarHBondContact O-CG2 3.44Å; W320-V324 PolarHBondContact O-N 3.5Å
321	M	96	Very high	94.1	Very high	65 Å²	65	39 Å²	39	32%	0.32	19%	0.193	S	C	.	.	H	α-helix	trans	-63.3	-42.9	176.5	-70.5	-65.9	178.9	0	0	111.1	V307 L317 A318 I319 A323 V324 T325 I486	V307-M321 HydrophobicContact CG1-CB 3.88Å; V307-M321 HydrophobicContact CG1-CG 4.39Å; V307-M321 HydrophobicContact CG2-CB 4.31Å; L317-M321 HydrophobicContact CD1-CE 4Å; L317-M321 HydrophobicContact CG-CE 4.49Å; L317-M321 VanDerWaalsContact O-CG 3.27Å; L317-M321 WeakPolarHBondContact O-CG 3.32Å; L317-M321 PolarHBondContact O-N 3.01Å; A318-M321 PolarHBondContact O-N 2.94Å; I319-M321 PolarHBondContact O-N 3Å; M321-A323 VanDerWaalsContact C-N 3.33Å; M321-A323 PolarHBondContact O-N 3.45Å; M321-V324 PolarHBondContact O-N 2.9Å; M321-T325 VanDerWaalsContact O-CG2 3.25Å; M321-T325 WeakPolarHBondContact O-CG2 3.21Å; M321-T325 PolarHBondContact O-N 3.16Å; M321-I486 HydrophobicContact CG-CD1 4.44Å
322	A	95.7	Very high	94.2	Very high	5 Å²	5	39.4 Å²	39.4	4%	0.041	19%	0.194	C	C	.	.	H	α-helix	trans	-58.3	-43.7	172.5	0	0	0	0	0	111.9	S303 A304 A318 I319 V324 T325 S326	S303-A322 WeakPolarHBondContact OG-CB 3.44Å; A304-A322 HydrophobicContact CB-CB 4.04Å; A318-A322 WeakPolarHBondContact O-CB 3.29Å; A318-A322 PolarHBondContact O-N 2.69Å; I319-A322 WeakPolarHBondContact O-CB 3.39Å; I319-A322 PolarHBondContact O-N 3.4Å; A322-V324 PolarHBondContact O-N 3.29Å; A322-T325 PolarHBondContact O-N 3.41Å; A322-T325 PolarHBondContact O-OG1 3.47Å; A322-S326 PolarHBondContact O-N 3.4Å; A322-S326 PolarHBondContact O-OG 2.92Å; A322-S326 VanDerWaalsContact O-OG 3.08Å
323	A	97.1	Very high	94.2	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.008	19%	0.19	C	C	.	.	H	α-helix	trans	-61.7	-41.2	175.4	0	0	0	0	0	112.2	W167 G170 L171 I319 W320 M321 S326 G327	W167-A323 VanDerWaalsContact CD1-O 3.29Å; G170-A323 VanDerWaalsContact C-CB 3.48Å; G170-A323 WeakPolarHBondContact O-CB 3.38Å; L171-A323 HydrophobicContact CD2-CB 4.48Å; I319-A323 WeakPolarHBondContact O-CB 3.4Å; I319-A323 PolarHBondContact O-N 3.05Å; W320-A323 WeakPolarHBondContact O-CB 3.42Å; W320-A323 PolarHBondContact O-N 2.96Å; M321-A323 VanDerWaalsContact C-N 3.33Å; M321-A323 PolarHBondContact O-N 3.45Å; A323-S326 PolarHBondContact O-N 3.43Å; A323-G327 PolarHBondContact O-N 3.39Å
324	V	97.1	Very high	94.5	Very high	74 Å²	74	39 Å²	39	45%	0.448	19%	0.194	S	C	.	.	H	α-helix	trans	-62.4	-46.8	174.6	170.5	0	0	0	0	110.8	W320 M321 A322 S326 G327 F328	W320-V324 WeakPolarHBondContact O-CG2 3.44Å; W320-V324 PolarHBondContact O-N 3.5Å; M321-V324 PolarHBondContact O-N 2.9Å; A322-V324 PolarHBondContact O-N 3.29Å; V324-S326 VanDerWaalsContact C-N 3.27Å; V324-S326 PolarHBondContact O-N 2.97Å; V324-G327 WeakPolarHBondContact O-CA 3.27Å; V324-G327 PolarHBondContact O-N 3.01Å; V324-F328 HydrophobicContact CG1-CD2 4.02Å; V324-F328 HydrophobicContact CG1-CE2 3.91Å; V324-F328 WeakPolarHBondContact O-CD2 3.44Å; V324-F328 PolarHBondContact O-N 2.67Å
325	T	96.2	Very high	94.7	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.006	20%	0.197	C	C	.	.	H	α-helix	trans	-60.6	-37.8	177.6	70.6	0	0	0	0	112.1	M321 A322 F328 N329 I486 T490	M321-T325 VanDerWaalsContact O-CG2 3.25Å; M321-T325 WeakPolarHBondContact O-CG2 3.21Å; M321-T325 PolarHBondContact O-N 3.16Å; A322-T325 PolarHBondContact O-N 3.41Å; A322-T325 PolarHBondContact O-OG1 3.47Å; T325-F328 PolarHBondContact O-N 3.34Å; T325-N329 PolarHBondContact O-N 3.17Å; T325-I486 HydrophobicContact CG2-CG2 4.28Å; T325-T490 VanDerWaalsContact CG2-OG1 3.26Å; T325-T490 WeakPolarHBondContact CG2-OG1 3.34Å
326	S	96.3	Very high	94.8	Very high	15 Å²	15	39 Å²	39	11%	0.105	19%	0.192	C	C	.	.	H	α-helix	trans	-69.1	-33.4	174.3	-60.7	0	0	0	0	112.5	A322 A323 V324 N329 F330	A322-S326 PolarHBondContact O-N 3.4Å; A322-S326 PolarHBondContact O-OG 2.92Å; A322-S326 VanDerWaalsContact O-OG 3.08Å; A323-S326 PolarHBondContact O-N 3.43Å; V324-S326 VanDerWaalsContact C-N 3.27Å; V324-S326 PolarHBondContact O-N 2.97Å; S326-N329 VanDerWaalsContact O-CB 3.29Å; S326-N329 WeakPolarHBondContact O-CB 3.49Å; S326-N329 PolarHBondContact O-N 3.44Å; S326-F330 PolarHBondContact O-N 3.38Å
327	G	97.2	Very high	94.6	Very high	4 Å²	4	39 Å²	39	4%	0.041	19%	0.191	C	C	.	.	H	α-helix	trans	-61.8	-45.3	171.1	0	0	0	0	0	112	A323 V324 N329 F330 F331	A323-G327 PolarHBondContact O-N 3.39Å; V324-G327 WeakPolarHBondContact O-CA 3.27Å; V324-G327 PolarHBondContact O-N 3.01Å; G327-N329 VanDerWaalsContact C-N 3.33Å; G327-N329 PolarHBondContact O-N 3.39Å; G327-F330 WeakPolarHBondContact O-CB 2.96Å; G327-F330 PolarHBondContact O-N 3.14Å; G327-F331 WeakPolarHBondContact O-CD2 3.35Å; G327-F331 PolarHBondContact O-N 2.99Å
328	F	97.1	Very high	94.3	Very high	108 Å²	108	41.4 Å²	41.4	47%	0.474	20%	0.195	S	C	.	.	H	α-helix	trans	-60.2	-41.6	173.2	-85.5	-82.1	0	0	0	112.1	V324 T325 F330 F331 C332 T490 C494	V324-F328 HydrophobicContact CG1-CD2 4.02Å; V324-F328 HydrophobicContact CG1-CE2 3.91Å; V324-F328 WeakPolarHBondContact O-CD2 3.44Å; V324-F328 PolarHBondContact O-N 2.67Å; T325-F328 PolarHBondContact O-N 3.34Å; F328-F330 VanDerWaalsContact C-N 3.32Å; F328-F330 PolarHBondContact O-N 3.26Å; F328-F331 PolarHBondContact O-N 2.93Å; F328-C332 WeakPolarHBondContact O-CB 3.32Å; F328-C332 PolarHBondContact O-N 3.36Å; F328-C332 PolarHBondContact O-SG 2.98Å; F328-C332 VanDerWaalsContact O-SG 3.34Å; F328-T490 HydrophobicContact CB-CG2 3.64Å; F328-T490 HydrophobicContact CD1-CG2 4.17Å; F328-T490 HydrophobicContact CD2-CG2 3.74Å; F328-T490 HydrophobicContact CE2-CG2 4.44Å; F328-T490 HydrophobicContact CG-CG2 3.58Å; F328-C494 PolarHBondContact O-SG 3.44Å; F328-C494 VanDerWaalsContact O-SG 3.38Å
329	N	95.6	Very high	94.1	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-55.2	-45.6	172.8	-177.9	-107.2	0	0	0	112.2	T163 T325 S326 G327 T333 L493 S497	T163-N329 WeakPolarHBondContact CB-OD1 3.44Å; T163-N329 WeakPolarHBondContact CG2-OD1 3.11Å; T325-N329 PolarHBondContact O-N 3.17Å; S326-N329 VanDerWaalsContact O-CB 3.29Å; S326-N329 WeakPolarHBondContact O-CB 3.49Å; S326-N329 PolarHBondContact O-N 3.44Å; G327-N329 VanDerWaalsContact C-N 3.33Å; G327-N329 PolarHBondContact O-N 3.39Å; N329-T333 PolarHBondContact O-N 3Å; N329-T333 VanDerWaalsContact O-N 3.12Å; N329-T333 PolarHBondContact O-OG1 2.97Å; N329-L493 HydrophobicContact CB-CB 3.94Å; N329-L493 HydrophobicContact CB-CD1 4.44Å; N329-L493 PolarHBondContact ND2-O 2.87Å; N329-S497 WeakPolarHBondContact ND2-CB 3.35Å; N329-S497 PolarHBondContact O-OG 3.32Å
330	F	96.3	Very high	93.6	Very high	23 Å²	23	44.3 Å²	44.3	10%	0.101	21%	0.211	C	C	.	.	H	α-helix	trans	-60.9	-52.8	175	171.3	-111.1	0	0	0	112.5	L160 F164 W167 S326 G327 F328 C332 T333 F334	L160-F330 HydrophobicContact CD1-CD2 3.93Å; L160-F330 HydrophobicContact CD1-CE2 3.63Å; L160-F330 HydrophobicContact CG-CE2 4.1Å; F164-F330 HydrophobicContact CB-CD2 3.74Å; F164-F330 HydrophobicContact CB-CE2 3.65Å; F164-F330 HydrophobicContact CD2-CD2 4.21Å; F164-F330 HydrophobicContact CD2-CE1 4.41Å; F164-F330 AromaticContact CD2-CE2 3.86Å; F164-F330 HydrophobicContact CD2-CE2 3.86Å; F164-F330 AromaticContact CD2-CZ 3.95Å; F164-F330 HydrophobicContact CD2-CZ 3.95Å; F164-F330 HydrophobicContact CG-CD2 4.43Å; F164-F330 HydrophobicContact CG-CE2 4.04Å; W167-F330 HydrophobicContact CB-CB 4.4Å; W167-F330 HydrophobicContact CD2-CD1 4.49Å; W167-F330 HydrophobicContact CE3-CB 4.26Å; W167-F330 AromaticContact CE3-CD1 3.43Å; W167-F330 HydrophobicContact CE3-CD1 3.43Å; W167-F330 VanDerWaalsContact CE3-CD1 3.43Å; W167-F330 AromaticContact CE3-CE1 3.95Å; W167-F330 HydrophobicContact CE3-CE1 3.95Å; W167-F330 AromaticContact CE3-CG 3.97Å; W167-F330 HydrophobicContact CE3-CG 3.97Å; W167-F330 AromaticContact CZ3-CD1 3.54Å; W167-F330 HydrophobicContact CZ3-CD1 3.54Å; W167-F330 AromaticContact CZ3-CE1 3.71Å; W167-F330 HydrophobicContact CZ3-CE1 3.71Å; W167-F330 HydrophobicContact CZ3-CG 4.5Å; S326-F330 PolarHBondContact O-N 3.38Å; G327-F330 WeakPolarHBondContact O-CB 2.96Å; G327-F330 PolarHBondContact O-N 3.14Å; F328-F330 VanDerWaalsContact C-N 3.32Å; F328-F330 PolarHBondContact O-N 3.26Å; F330-C332 PolarHBondContact O-N 3.45Å; F330-T333 WeakPolarHBondContact O-CB 3.25Å; F330-T333 PolarHBondContact O-N 2.99Å; F330-T333 VanDerWaalsContact O-N 3.08Å; F330-T333 PolarHBondContact O-OG1 3.47Å; F330-F334 HydrophobicContact CD1-CE2 4.5Å; F330-F334 AromaticContact CE1-CE2 3.9Å; F330-F334 HydrophobicContact CE1-CE2 3.9Å; F330-F334 HydrophobicContact CE2-CE2 4.02Å; F330-F334 HydrophobicContact CE2-CZ 4.37Å; F330-F334 AromaticContact CZ-CE2 3.64Å; F330-F334 HydrophobicContact CZ-CE2 3.64Å; F330-F334 AromaticContact CZ-CZ 3.95Å; F330-F334 HydrophobicContact CZ-CZ 3.95Å
331	F	96	Very high	92.9	Very high	116 Å²	116	42.8 Å²	42.8	51%	0.509	21%	0.207	S	C	.	.	H	α-helix	trans	-65.6	-38.6	-178.5	-70.6	-65.6	0	0	0	113	W167 G327 F328 T333 F334	W167-F331 AromaticContact CH2-CE2 3.85Å; W167-F331 HydrophobicContact CH2-CE2 3.85Å; W167-F331 AromaticContact CH2-CZ 3.78Å; W167-F331 HydrophobicContact CH2-CZ 3.78Å; W167-F331 HydrophobicContact CZ2-CE2 4.28Å; W167-F331 HydrophobicContact CZ3-CE2 4.14Å; W167-F331 AromaticContact CZ3-CZ 3.98Å; W167-F331 HydrophobicContact CZ3-CZ 3.98Å; G327-F331 WeakPolarHBondContact O-CD2 3.35Å; G327-F331 PolarHBondContact O-N 2.99Å; F328-F331 PolarHBondContact O-N 2.93Å; F331-T333 PolarHBondContact O-N 3.33Å; F331-F334 WeakPolarHBondContact O-CB 3.34Å; F331-F334 PolarHBondContact O-N 3.34Å
332	C	95.4	Very high	92.3	Very high	20 Å²	20	48.2 Å²	48.2	14%	0.135	22%	0.224	C	C	.	.	H	α-helix	trans	-64.9	-24.1	174.4	-75.4	0	0	0	0	112.5	F328 F330 F334 I335 G336 C494 V498	F328-C332 WeakPolarHBondContact O-CB 3.32Å; F328-C332 PolarHBondContact O-N 3.36Å; F328-C332 PolarHBondContact O-SG 2.98Å; F328-C332 VanDerWaalsContact O-SG 3.34Å; F330-C332 PolarHBondContact O-N 3.45Å; C332-F334 VanDerWaalsContact C-N 3.29Å; C332-F334 PolarHBondContact O-N 3.38Å; C332-I335 WeakPolarHBondContact O-CB 2.94Å; C332-I335 PolarHBondContact O-N 2.87Å; C332-I335 VanDerWaalsContact O-N 3.14Å; C332-G336 PolarHBondContact O-N 3.32Å; C332-C494 HydrophobicContact CB-CB 3.7Å; C332-C494 WeakPolarHBondContact CB-SG 3.48Å; C332-C494 WeakPolarHBondContact SG-CB 3.22Å; C332-C494 CovalentContact SG-SG 2.06Å; C332-C494 PolarHBondContact SG-SG 3.43Å; C332-V498 HydrophobicContact CB-CG2 4.43Å; C332-V498 WeakPolarHBondContact O-CG2 3.23Å
333	T	93.3	Very high	91.9	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.006	24%	0.238	C	C	.	.	H	α-helix	trans	-61.9	-36.2	175.1	-53.8	0	0	0	0	111.8	Q159 L160 T163 N329 F330 F331 I335 G336 I337 S497	Q159-T333 HydrophobicContact CG-CG2 4.29Å; L160-T333 HydrophobicContact CB-CG2 4.18Å; L160-T333 HydrophobicContact CD1-CG2 3.9Å; T163-T333 WeakPolarHBondContact CB-OG1 3.28Å; T163-T333 VanDerWaalsContact CG2-OG1 3.23Å; T163-T333 WeakPolarHBondContact CG2-OG1 3.36Å; T163-T333 PolarHBondContact OG1-OG1 2.87Å; N329-T333 PolarHBondContact O-N 3Å; N329-T333 VanDerWaalsContact O-N 3.12Å; N329-T333 PolarHBondContact O-OG1 2.97Å; F330-T333 WeakPolarHBondContact O-CB 3.25Å; F330-T333 PolarHBondContact O-N 2.99Å; F330-T333 VanDerWaalsContact O-N 3.08Å; F330-T333 PolarHBondContact O-OG1 3.47Å; F331-T333 PolarHBondContact O-N 3.33Å; T333-I335 VanDerWaalsContact C-N 3.26Å; T333-I335 PolarHBondContact O-N 3.13Å; T333-G336 CarbonylContact O-C 3.57Å; T333-G336 WeakPolarHBondContact O-CA 3.02Å; T333-G336 PolarHBondContact O-N 3.48Å; T333-I337 VanDerWaalsContact O-CG1 3.22Å; T333-I337 WeakPolarHBondContact O-CG1 3.34Å; T333-I337 PolarHBondContact O-N 3.29Å; T333-S497 WeakPolarHBondContact OG1-CB 3.46Å
334	F	92.3	Very high	91.4	Very high	98 Å²	98	50 Å²	50	43%	0.43	24%	0.239	S	C	.	.	H	α-helix	trans	-58.3	-38	175.3	-72.7	-83.1	0	0	0	112.7	L160 F330 F331 C332 G336 I337 Y338	L160-F334 HydrophobicContact CD1-CD2 4.15Å; L160-F334 HydrophobicContact CD1-CE1 4.28Å; L160-F334 HydrophobicContact CD1-CE2 3.87Å; L160-F334 HydrophobicContact CD1-CG 4.49Å; L160-F334 HydrophobicContact CD1-CZ 3.94Å; L160-F334 HydrophobicContact CD2-CE1 4.03Å; L160-F334 HydrophobicContact CD2-CZ 4.12Å; F330-F334 HydrophobicContact CD1-CE2 4.5Å; F330-F334 AromaticContact CE1-CE2 3.9Å; F330-F334 HydrophobicContact CE1-CE2 3.9Å; F330-F334 HydrophobicContact CE2-CE2 4.02Å; F330-F334 HydrophobicContact CE2-CZ 4.37Å; F330-F334 AromaticContact CZ-CE2 3.64Å; F330-F334 HydrophobicContact CZ-CE2 3.64Å; F330-F334 AromaticContact CZ-CZ 3.95Å; F330-F334 HydrophobicContact CZ-CZ 3.95Å; F331-F334 WeakPolarHBondContact O-CB 3.34Å; F331-F334 PolarHBondContact O-N 3.34Å; C332-F334 VanDerWaalsContact C-N 3.29Å; C332-F334 PolarHBondContact O-N 3.38Å; F334-G336 VanDerWaalsContact C-N 3.3Å; F334-I337 PolarHBondContact O-N 2.93Å; F334-Y338 PolarHBondContact O-N 3.17Å
335	I	92.5	Very high	91.1	Very high	88 Å²	88	46.9 Å²	46.9	45%	0.451	22%	0.219	S	C	.	.	H	α-helix	trans	-62.9	-42.5	174.4	-57.5	173.3	0	0	0	109.5	C332 T333 Y338 L339 V498	C332-I335 WeakPolarHBondContact O-CB 2.94Å; C332-I335 PolarHBondContact O-N 2.87Å; C332-I335 VanDerWaalsContact O-N 3.14Å; T333-I335 VanDerWaalsContact C-N 3.26Å; T333-I335 PolarHBondContact O-N 3.13Å; I335-Y338 PolarHBondContact O-N 2.78Å; I335-L339 HydrophobicContact CG2-CD1 3.73Å; I335-L339 HydrophobicContact CG2-CG 4.13Å; I335-L339 WeakPolarHBondContact O-CB 3.45Å; I335-L339 WeakPolarHBondContact O-CG 3.43Å; I335-L339 PolarHBondContact O-N 3.34Å; I335-V498 HydrophobicContact CB-CG2 4.2Å; I335-V498 HydrophobicContact CG2-CG2 4.25Å
336	G	88.8	Confident	91.1	Very high	3 Å²	3	49.3 Å²	49.3	3%	0.031	23%	0.228	C	C	.	.	H	α-helix	trans	-57.4	-48	173.2	0	0	0	0	0	113	C332 T333 F334 Y338 L339 V340 V498	C332-G336 PolarHBondContact O-N 3.32Å; T333-G336 CarbonylContact O-C 3.57Å; T333-G336 WeakPolarHBondContact O-CA 3.02Å; T333-G336 PolarHBondContact O-N 3.48Å; F334-G336 VanDerWaalsContact C-N 3.3Å; G336-Y338 VanDerWaalsContact C-N 3.28Å; G336-Y338 PolarHBondContact O-N 3.04Å; G336-L339 PolarHBondContact O-N 3.4Å; G336-V340 WeakPolarHBondContact O-CB 3.44Å; G336-V340 VanDerWaalsContact O-CG2 3.25Å; G336-V340 WeakPolarHBondContact O-CG2 3.21Å; G336-V340 PolarHBondContact O-N 3.32Å; G336-V498 WeakPolarHBondContact CA-O 3.39Å
337	I	85.4	Confident	91	Very high	20 Å²	20	53.8 Å²	53.8	10%	0.103	25%	0.25	C	S	.	.	H	α-helix	trans	-56.2	-45.8	177.1	-44.6	-159.3	0	0	0	111.1	V156 M157 L160 T333 F334	V156-I337 HydrophobicContact CG1-CB 4.01Å; V156-I337 HydrophobicContact CG1-CD1 4.1Å; V156-I337 HydrophobicContact CG1-CG1 3.58Å; V156-I337 HydrophobicContact CG1-CG2 4.1Å; M157-I337 HydrophobicContact CE-CD1 3.93Å; M157-I337 HydrophobicContact CE-CG2 4.42Å; M157-I337 HydrophobicContact SD-CD1 4.05Å; L160-I337 HydrophobicContact CB-CD1 4.07Å; L160-I337 HydrophobicContact CD1-CD1 4.35Å; L160-I337 HydrophobicContact CD2-CD1 3.96Å; L160-I337 HydrophobicContact CG-CD1 4.35Å; T333-I337 VanDerWaalsContact O-CG1 3.22Å; T333-I337 WeakPolarHBondContact O-CG1 3.34Å; T333-I337 PolarHBondContact O-N 3.29Å; F334-I337 PolarHBondContact O-N 2.93Å
338	Y	88	Confident	90.8	Very high	132 Å²	132	54.1 Å²	54.1	52%	0.518	25%	0.251	S	S	.	.	H	α-helix	trans	-65.3	-46.2	179.5	179.6	-100.2	0	0	0	112.5	F334 I335 G336 R342	F334-Y338 PolarHBondContact O-N 3.17Å; I335-Y338 PolarHBondContact O-N 2.78Å; G336-Y338 VanDerWaalsContact C-N 3.28Å; G336-Y338 PolarHBondContact O-N 3.04Å; Y338-R342 WeakPolarHBondContact O-CB 3.39Å; Y338-R342 PolarHBondContact O-N 3.07Å; Y338-R342 VanDerWaalsContact O-N 3.14Å; Y338-R342 WeakPolarHBondContact OH-CD 3.12Å; Y338-R342 PolarHBondContact OH-NH1 3.25Å
339	L	88.9	Confident	90.8	Very high	60 Å²	60	49 Å²	49	31%	0.314	23%	0.229	S	C	.	.	H	α-helix	trans	-72.6	-38.2	-176	-71	179.3	0	0	0	112.8	I335 G336 E341 R342 A343 V348 V498	I335-L339 HydrophobicContact CG2-CD1 3.73Å; I335-L339 HydrophobicContact CG2-CG 4.13Å; I335-L339 WeakPolarHBondContact O-CB 3.45Å; I335-L339 WeakPolarHBondContact O-CG 3.43Å; I335-L339 PolarHBondContact O-N 3.34Å; G336-L339 PolarHBondContact O-N 3.4Å; L339-E341 PolarHBondContact O-N 3.31Å; L339-R342 PolarHBondContact O-N 3.39Å; L339-A343 WeakPolarHBondContact O-CA 3.33Å; L339-A343 VanDerWaalsContact O-CB 3.28Å; L339-A343 WeakPolarHBondContact O-CB 3.33Å; L339-A343 PolarHBondContact O-N 3.45Å; L339-V348 HydrophobicContact CB-CG2 3.77Å; L339-V348 WeakPolarHBondContact O-CG2 3.48Å; L339-V498 HydrophobicContact CD1-CG1 3.97Å
340	V	84.8	Confident	90.9	Very high	4 Å²	4	49.5 Å²	49.5	2%	0.024	23%	0.232	C	C	.	.	H	α-helix	trans	-58.4	-39.5	180	167.1	0	0	0	0	111.1	V156 G336 G344 R345 V348 V503	V156-V340 HydrophobicContact CG2-CG1 4.29Å; G336-V340 WeakPolarHBondContact O-CB 3.44Å; G336-V340 VanDerWaalsContact O-CG2 3.25Å; G336-V340 WeakPolarHBondContact O-CG2 3.21Å; G336-V340 PolarHBondContact O-N 3.32Å; V340-G344 WeakPolarHBondContact O-CA 3.44Å; V340-G344 PolarHBondContact O-N 2.91Å; V340-R345 HydrophobicContact CG1-CG 4.24Å; V340-R345 PolarHBondContact O-NH1 2.83Å; V340-V348 HydrophobicContact CG2-CB 4.35Å; V340-V348 HydrophobicContact CG2-CG1 3.87Å; V340-V503 HydrophobicContact CG2-CG2 3.63Å
341	E	80.2	Confident	91	Very high	57 Å²	57	50.4 Å²	50.4	27%	0.266	25%	0.248	S	C	.	.	H	α-helix	trans	-77.8	-38.4	177.9	-69.3	-62.2	102.4	0	0	112.5	R153 L339 R345 K574	R153-E341 HydrophobicContact CG-CG 3.69Å; L339-E341 PolarHBondContact O-N 3.31Å; E341-R345 IonicContact OE1-CZ 3.1Å; E341-R345 VanDerWaalsContact OE1-CZ 3.26Å; E341-R345 IonicContact OE1-NH1 3.4Å; E341-R345 PolarHBondContact OE1-NH1 3.1Å; E341-R345 IonicContact OE1-NH2 2.68Å; E341-R345 PolarHBondContact OE1-NH2 2.88Å; E341-K574 WeakPolarHBondContact O-CE 3.21Å; E341-K574 PolarHBondContact O-NZ 3.41Å
342	R	84.9	Confident	91.1	Very high	178 Å²	178	45.2 Å²	45.2	67%	0.672	23%	0.225	S	C	*	.	H	α-helix	trans	-79.3	-52	-178	-164.7	171.6	-174.9	-170.8	-0.9	112.6	Y338 L339 K574	Y338-R342 WeakPolarHBondContact O-CB 3.39Å; Y338-R342 PolarHBondContact O-N 3.07Å; Y338-R342 VanDerWaalsContact O-N 3.14Å; Y338-R342 WeakPolarHBondContact OH-CD 3.12Å; Y338-R342 PolarHBondContact OH-NH1 3.25Å; L339-R342 PolarHBondContact O-N 3.39Å; R342-K574 PolarHBondContact O-NZ 2.89Å
343	A	86.9	Confident	91.2	Very high	41 Å²	41	44.3 Å²	44.3	34%	0.339	22%	0.22	S	C	.	.	H	α-helix	trans	-88.8	-19.1	-170.7	0	0	0	0	0	114.5	L339 L347 V348	L339-A343 WeakPolarHBondContact O-CA 3.33Å; L339-A343 VanDerWaalsContact O-CB 3.28Å; L339-A343 WeakPolarHBondContact O-CB 3.33Å; L339-A343 PolarHBondContact O-N 3.45Å; A343-L347 HydrophobicContact CB-CD2 4.2Å; A343-V348 HydrophobicContact CB-CG2 3.96Å
344	G	87.1	Confident	91.4	Very high	2 Å²	2	48.3 Å²	48.3	2%	0.021	24%	0.24	C	C	.	.			trans	92	162.5	-173.7	0	0	0	0	0	112.9	V340 V348	V340-G344 WeakPolarHBondContact O-CA 3.44Å; V340-G344 PolarHBondContact O-N 2.91Å; G344-V348 VanDerWaalsContact O-CG2 3.25Å; G344-V348 WeakPolarHBondContact O-CG2 3.41Å; G344-V348 PolarHBondContact O-N 2.98Å
345	R	90.8	Very high	91.7	Very high	10 Å²	10	44.2 Å²	44.2	4%	0.038	23%	0.225	C	C	.	.	H	α-helix	trans	-72.5	-42.2	-169.8	-73.8	69.3	172.3	133.5	-1.1	110.5	V340 E341 V348 L349 V503 I507 E572	V340-R345 HydrophobicContact CG1-CG 4.24Å; V340-R345 PolarHBondContact O-NH1 2.83Å; E341-R345 IonicContact OE1-CZ 3.1Å; E341-R345 VanDerWaalsContact OE1-CZ 3.26Å; E341-R345 IonicContact OE1-NH1 3.4Å; E341-R345 PolarHBondContact OE1-NH1 3.1Å; E341-R345 IonicContact OE1-NH2 2.68Å; E341-R345 PolarHBondContact OE1-NH2 2.88Å; R345-V348 PolarHBondContact O-N 3.21Å; R345-L349 WeakPolarHBondContact O-CB 3.24Å; R345-L349 PolarHBondContact O-N 3.05Å; R345-V503 HydrophobicContact CB-CG1 3.9Å; R345-V503 HydrophobicContact CG-CG1 4.36Å; R345-I507 HydrophobicContact CB-CD1 4.33Å; R345-I507 HydrophobicContact CB-CG1 4.3Å; R345-E572 PolarHBondContact N-OE1 2.65Å; R345-E572 PolarHBondContact N-OE2 2.89Å; R345-E572 VanDerWaalsContact N-OE2 3.15Å
346	R	94.5	Very high	92	Very high	52 Å²	52	40 Å²	40	20%	0.196	20%	0.204	C	C	.	.	H	α-helix	trans	-66	-44.1	-175.5	-176.1	179.8	176.3	-83.5	-1.4	111.8	L350 Y567 V570 E572	R346-L350 HydrophobicContact CG-CD1 4.11Å; R346-L350 VanDerWaalsContact O-CG 3.28Å; R346-L350 WeakPolarHBondContact O-CG 3.33Å; R346-L350 PolarHBondContact O-N 3.44Å; R346-L350 VanDerWaalsContact O-N 3.11Å; R346-Y567 PolarHBondContact NH2-O 3.3Å; R346-V570 WeakPolarHBondContact CD-O 3.49Å; R346-V570 PolarHBondContact NE-O 3.25Å; R346-E572 HydrophobicContact CB-CB 4.43Å; R346-E572 WeakPolarHBondContact CB-OE2 3.47Å; R346-E572 PolarHBondContact N-OE2 3.33Å
347	L	94.5	Very high	92.5	Very high	109 Å²	109	41.1 Å²	41.1	57%	0.571	21%	0.209	S	C	*	.	H	α-helix	trans	-66.9	-41.7	-178.1	-173.7	60.6	0	0	0	111.3	A343 L350 G351	A343-L347 HydrophobicContact CB-CD2 4.2Å; L347-L350 PolarHBondContact O-N 3.45Å; L347-G351 PolarHBondContact O-N 3.42Å
348	V	94.5	Very high	93.1	Very high	10 Å²	10	45.8 Å²	45.8	6%	0.061	23%	0.233	C	C	.	.	H	α-helix	trans	-66.3	-41.5	178.3	175.2	0	0	0	0	111.7	L339 V340 A343 G344 R345 L350 S352 V498 V503	L339-V348 HydrophobicContact CB-CG2 3.77Å; L339-V348 WeakPolarHBondContact O-CG2 3.48Å; V340-V348 HydrophobicContact CG2-CB 4.35Å; V340-V348 HydrophobicContact CG2-CG1 3.87Å; A343-V348 HydrophobicContact CB-CG2 3.96Å; G344-V348 VanDerWaalsContact O-CG2 3.25Å; G344-V348 WeakPolarHBondContact O-CG2 3.41Å; G344-V348 PolarHBondContact O-N 2.98Å; R345-V348 PolarHBondContact O-N 3.21Å; V348-L350 PolarHBondContact O-N 3.2Å; V348-S352 VanDerWaalsContact O-CB 3.31Å; V348-S352 WeakPolarHBondContact O-CB 3.24Å; V348-S352 PolarHBondContact O-N 3.04Å; V348-S352 PolarHBondContact O-OG 3.12Å; V348-V498 HydrophobicContact CG1-CG1 4.49Å; V348-V498 WeakPolarHBondContact CG1-O 3.45Å; V348-V503 HydrophobicContact CG1-CG2 4.15Å
349	L	96.7	Very high	93.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-58.6	-48.5	174	178.9	66.6	0	0	0	111.8	L287 R345 S352 T353 L500 V503 P504 I507 F566 V570	L287-L349 HydrophobicContact CD2-CD1 4.47Å; L287-L349 HydrophobicContact CD2-CD2 3.57Å; R345-L349 WeakPolarHBondContact O-CB 3.24Å; R345-L349 PolarHBondContact O-N 3.05Å; L349-S352 PolarHBondContact O-OG 3.08Å; L349-T353 WeakPolarHBondContact O-CB 3.41Å; L349-T353 PolarHBondContact O-N 2.76Å; L349-T353 PolarHBondContact O-OG1 3.48Å; L349-L500 HydrophobicContact CD1-CD1 3.77Å; L349-V503 HydrophobicContact CB-CG1 3.99Å; L349-P504 HydrophobicContact CD1-CG 4.04Å; L349-I507 HydrophobicContact CD2-CD1 4.41Å; L349-F566 HydrophobicContact CD1-CD2 4.26Å; L349-F566 HydrophobicContact CD1-CE2 4.25Å; L349-F566 HydrophobicContact CD2-CB 4.24Å; L349-F566 HydrophobicContact CD2-CD2 4.08Å; L349-F566 HydrophobicContact CD2-CG 4.12Å; L349-F566 HydrophobicContact CG-CD2 4.09Å; L349-V570 HydrophobicContact CD2-CB 4.42Å; L349-V570 HydrophobicContact CD2-CG1 3.92Å; L349-V570 HydrophobicContact CD2-CG2 4.27Å
350	L	98	Very high	94	Very high	16 Å²	16	36.9 Å²	36.9	8%	0.084	20%	0.195	C	C	.	.	H	α-helix	trans	-67	-44.6	-178.6	-65.5	173.1	0	0	0	111.9	R346 L347 V348 T353 I354 L563 F566 Y567	R346-L350 HydrophobicContact CG-CD1 4.11Å; R346-L350 VanDerWaalsContact O-CG 3.28Å; R346-L350 WeakPolarHBondContact O-CG 3.33Å; R346-L350 PolarHBondContact O-N 3.44Å; R346-L350 VanDerWaalsContact O-N 3.11Å; L347-L350 PolarHBondContact O-N 3.45Å; V348-L350 PolarHBondContact O-N 3.2Å; L350-T353 PolarHBondContact O-N 3.19Å; L350-I354 WeakPolarHBondContact O-CG1 3.38Å; L350-I354 PolarHBondContact O-N 3.02Å; L350-I354 VanDerWaalsContact O-N 3.14Å; L350-L563 HydrophobicContact CB-CD1 4.38Å; L350-L563 HydrophobicContact CD2-CD1 3.75Å; L350-F566 HydrophobicContact CD2-CB 3.9Å; L350-Y567 HydrophobicContact CD1-CD2 4.05Å
351	G	97.5	Very high	94.7	Very high	42 Å²	42	39.1 Å²	39.1	43%	0.433	21%	0.209	S	C	.	.	H	α-helix	trans	-63.1	-44.9	178.5	0	0	0	0	0	112.9	L347 I354 G355	L347-G351 PolarHBondContact O-N 3.42Å; G351-I354 PolarHBondContact O-N 3.19Å; G351-G355 PolarHBondContact O-N 3.22Å; G351-G355 VanDerWaalsContact O-N 3.15Å
352	S	97.1	Very high	95.5	Very high	6 Å²	6	38.7 Å²	38.7	4%	0.042	21%	0.208	C	C	.	.	H	α-helix	trans	-63.8	-40.1	176.3	52.9	0	0	0	0	112.7	V348 L349 I354 G355 V356 C495 G499 L500	V348-S352 VanDerWaalsContact O-CB 3.31Å; V348-S352 WeakPolarHBondContact O-CB 3.24Å; V348-S352 PolarHBondContact O-N 3.04Å; V348-S352 PolarHBondContact O-OG 3.12Å; L349-S352 PolarHBondContact O-OG 3.08Å; S352-I354 VanDerWaalsContact C-N 3.33Å; S352-I354 PolarHBondContact O-N 3.33Å; S352-G355 PolarHBondContact O-N 2.9Å; S352-G355 VanDerWaalsContact O-N 3.16Å; S352-V356 WeakPolarHBondContact O-CG2 3.39Å; S352-V356 PolarHBondContact O-N 3.34Å; S352-C495 WeakPolarHBondContact CB-O 3.43Å; S352-G499 VanDerWaalsContact OG-CA 3.32Å; S352-G499 WeakPolarHBondContact OG-CA 3.38Å; S352-L500 PolarHBondContact OG-N 3.35Å
353	T	98.2	Very high	96.1	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.012	18%	0.177	C	C	.	.	H	α-helix	trans	-63.8	-37.9	177.7	-52.1	0	0	0	0	111.6	L349 L350 V356 I357 L563	L349-T353 WeakPolarHBondContact O-CB 3.41Å; L349-T353 PolarHBondContact O-N 2.76Å; L349-T353 PolarHBondContact O-OG1 3.48Å; L350-T353 PolarHBondContact O-N 3.19Å; T353-V356 PolarHBondContact O-N 2.82Å; T353-I357 HydrophobicContact CG2-CD1 4.28Å; T353-I357 WeakPolarHBondContact O-CD1 3.49Å; T353-I357 VanDerWaalsContact O-CG1 3.29Å; T353-I357 WeakPolarHBondContact O-CG1 3.25Å; T353-I357 PolarHBondContact O-N 3.42Å; T353-L563 HydrophobicContact CG2-CB 3.79Å; T353-L563 HydrophobicContact CG2-CD1 4.16Å; T353-L563 HydrophobicContact CG2-CG 4.49Å
354	I	98.5	Very high	96.6	Very high	85 Å²	85	28.3 Å²	28.3	44%	0.436	16%	0.16	S	C	.	.	H	α-helix	trans	-61.2	-46.7	172.4	-67.2	164.8	0	0	0	110.7	L350 G351 S352 V356 I357 L358 L563	L350-I354 WeakPolarHBondContact O-CG1 3.38Å; L350-I354 PolarHBondContact O-N 3.02Å; L350-I354 VanDerWaalsContact O-N 3.14Å; G351-I354 PolarHBondContact O-N 3.19Å; S352-I354 VanDerWaalsContact C-N 3.33Å; S352-I354 PolarHBondContact O-N 3.33Å; I354-V356 VanDerWaalsContact C-N 3.31Å; I354-V356 PolarHBondContact O-N 3.41Å; I354-I357 PolarHBondContact O-N 3.22Å; I354-L358 HydrophobicContact CG2-CD1 4.21Å; I354-L358 WeakPolarHBondContact O-CG 3.4Å; I354-L358 PolarHBondContact O-N 3.4Å; I354-L563 HydrophobicContact CD1-CD2 4.5Å; I354-L563 HydrophobicContact CG1-CD1 4.14Å; I354-L563 HydrophobicContact CG1-CD2 3.64Å
355	G	98.1	Very high	97.1	Very high	12 Å²	12	31.9 Å²	31.9	12%	0.124	18%	0.178	C	C	.	.	H	α-helix	trans	-61.1	-39.1	177.4	0	0	0	0	0	113	G351 S352 L358 S359	G351-G355 PolarHBondContact O-N 3.22Å; G351-G355 VanDerWaalsContact O-N 3.15Å; S352-G355 PolarHBondContact O-N 2.9Å; S352-G355 VanDerWaalsContact O-N 3.16Å; G355-L358 PolarHBondContact O-N 2.78Å; G355-S359 WeakPolarHBondContact O-CB 3.17Å; G355-S359 PolarHBondContact O-N 3.17Å; G355-S359 PolarHBondContact O-OG 3.48Å
356	V	98.4	Very high	97.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-60.5	-47	174.1	161.5	0	0	0	0	111.3	S352 T353 I354 L358 S359 L360 Y492 C495 F496 L500	S352-V356 WeakPolarHBondContact O-CG2 3.39Å; S352-V356 PolarHBondContact O-N 3.34Å; T353-V356 PolarHBondContact O-N 2.82Å; I354-V356 VanDerWaalsContact C-N 3.31Å; I354-V356 PolarHBondContact O-N 3.41Å; V356-L358 PolarHBondContact O-N 3.07Å; V356-S359 PolarHBondContact O-N 3.01Å; V356-L360 HydrophobicContact CG1-CD1 3.96Å; V356-L360 WeakPolarHBondContact O-CG 3.43Å; V356-L360 PolarHBondContact O-N 3.3Å; V356-Y492 HydrophobicContact CG1-CD2 4.01Å; V356-Y492 HydrophobicContact CG1-CE2 3.65Å; V356-Y492 HydrophobicContact CG2-CD2 4.5Å; V356-C495 HydrophobicContact CG2-CB 4.12Å; V356-F496 HydrophobicContact CG2-CB 4.01Å; V356-F496 HydrophobicContact CG2-CD2 4.31Å; V356-L500 HydrophobicContact CB-CD2 4.47Å; V356-L500 HydrophobicContact CG1-CD2 4.3Å; V356-L500 HydrophobicContact CG2-CD2 4.14Å
357	I	98.6	Very high	97.6	Very high	26 Å²	26	29.1 Å²	29.1	13%	0.133	17%	0.168	C	C	.	.	H	α-helix	trans	-60.3	-47.8	178.2	-66.9	159	0	0	0	111	T353 I354 S359 L360 V361 A560 L563	T353-I357 HydrophobicContact CG2-CD1 4.28Å; T353-I357 WeakPolarHBondContact O-CD1 3.49Å; T353-I357 VanDerWaalsContact O-CG1 3.29Å; T353-I357 WeakPolarHBondContact O-CG1 3.25Å; T353-I357 PolarHBondContact O-N 3.42Å; I354-I357 PolarHBondContact O-N 3.22Å; I357-S359 VanDerWaalsContact C-N 3.28Å; I357-S359 PolarHBondContact O-N 3.37Å; I357-L360 PolarHBondContact O-N 2.95Å; I357-V361 WeakPolarHBondContact O-CG2 3.38Å; I357-V361 PolarHBondContact O-N 2.9Å; I357-A560 HydrophobicContact CD1-CB 4.07Å; I357-L563 HydrophobicContact CD1-CB 4.1Å; I357-L563 HydrophobicContact CD1-CD2 3.83Å
358	L	98.6	Very high	97.7	Very high	117 Å²	117	25.5 Å²	25.5	61%	0.613	15%	0.154	S	C	*	.	H	α-helix	trans	-61.4	-38.1	178.9	-66.8	175.9	0	0	0	111.9	I354 G355 V356 V361 L362	I354-L358 HydrophobicContact CG2-CD1 4.21Å; I354-L358 WeakPolarHBondContact O-CG 3.4Å; I354-L358 PolarHBondContact O-N 3.4Å; G355-L358 PolarHBondContact O-N 2.78Å; V356-L358 PolarHBondContact O-N 3.07Å; L358-V361 PolarHBondContact O-N 2.92Å; L358-L362 PolarHBondContact O-N 3.02Å
359	S	98.3	Very high	97.9	Very high	5 Å²	5	27.9 Å²	27.9	4%	0.035	17%	0.166	C	C	.	.	H	α-helix	trans	-71.5	-37.4	179.3	-53.8	0	0	0	0	112.5	G355 V356 I357 L362 L363 L491 Y492	G355-S359 WeakPolarHBondContact O-CB 3.17Å; G355-S359 PolarHBondContact O-N 3.17Å; G355-S359 PolarHBondContact O-OG 3.48Å; V356-S359 PolarHBondContact O-N 3.01Å; I357-S359 VanDerWaalsContact C-N 3.28Å; I357-S359 PolarHBondContact O-N 3.37Å; S359-L362 PolarHBondContact O-N 3.48Å; S359-L363 PolarHBondContact O-N 3.39Å; S359-L491 WeakPolarHBondContact OG-CB 3.46Å; S359-Y492 VanDerWaalsContact CB-CA 3.41Å; S359-Y492 PolarHBondContact OG-N 3.34Å
360	L	98.1	Very high	97.8	Very high	0 Å²	0	28 Å²	28	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-65.5	-38.9	173	-73.6	170.1	0	0	0	111.9	V356 I357 L362 L363 G364 Y492 F552 A556	V356-L360 HydrophobicContact CG1-CD1 3.96Å; V356-L360 WeakPolarHBondContact O-CG 3.43Å; V356-L360 PolarHBondContact O-N 3.3Å; I357-L360 PolarHBondContact O-N 2.95Å; L360-L362 VanDerWaalsContact C-N 3.34Å; L360-L363 HydrophobicContact CD2-CD1 4.33Å; L360-L363 WeakPolarHBondContact O-CB 3.42Å; L360-L363 PolarHBondContact O-N 3.1Å; L360-G364 PolarHBondContact O-N 3.16Å; L360-Y492 HydrophobicContact CD1-CE2 4.03Å; L360-Y492 HydrophobicContact CD2-CD2 3.88Å; L360-Y492 HydrophobicContact CD2-CE2 3.66Å; L360-Y492 HydrophobicContact CG-CD2 3.79Å; L360-Y492 HydrophobicContact CG-CE2 3.73Å; L360-F552 HydrophobicContact CD2-CD1 4.07Å; L360-A556 HydrophobicContact CB-CB 3.82Å; L360-A556 HydrophobicContact CD1-CB 4.49Å
361	V	98.4	Very high	97.7	Very high	52 Å²	52	28 Å²	28	32%	0.315	17%	0.168	S	C	.	.	H	α-helix	trans	-62.9	-42.2	172.6	170.5	0	0	0	0	110.7	I357 L358 G364 I365 F553 A556	I357-V361 WeakPolarHBondContact O-CG2 3.38Å; I357-V361 PolarHBondContact O-N 2.9Å; L358-V361 PolarHBondContact O-N 2.92Å; V361-G364 PolarHBondContact O-N 3.36Å; V361-I365 HydrophobicContact CG1-CD1 3.83Å; V361-I365 HydrophobicContact CG1-CG1 4.42Å; V361-I365 VanDerWaalsContact O-CG1 3.3Å; V361-I365 WeakPolarHBondContact O-CG1 3.35Å; V361-I365 PolarHBondContact O-N 3.25Å; V361-F553 HydrophobicContact CG1-CE1 4.33Å; V361-A556 HydrophobicContact CG2-CB 3.97Å
362	L	98.3	Very high	97.5	Very high	48 Å²	48	30 Å²	30	25%	0.251	18%	0.176	S	C	.	.	H	α-helix	trans	-63.1	-42.1	175.9	-179.4	60.2	0	0	0	112.4	L358 S359 L360 I365 G366 I484 L487 L491	L358-L362 PolarHBondContact O-N 3.02Å; S359-L362 PolarHBondContact O-N 3.48Å; L360-L362 VanDerWaalsContact C-N 3.34Å; L362-I365 PolarHBondContact O-N 3.32Å; L362-G366 PolarHBondContact O-N 2.97Å; L362-I484 HydrophobicContact CD1-CG2 3.91Å; L362-I484 HydrophobicContact CG-CG2 4.42Å; L362-L487 HydrophobicContact CD2-CD2 4.46Å; L362-L487 HydrophobicContact CD2-CG 4.35Å; L362-L491 HydrophobicContact CD2-CD1 3.92Å
363	L	96.9	Very high	97.4	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-57.1	-48.5	171.4	-85.7	160.8	0	0	0	111.4	S359 L360 I365 G366 F367 P485 M489 F552	S359-L363 PolarHBondContact O-N 3.39Å; L360-L363 HydrophobicContact CD2-CD1 4.33Å; L360-L363 WeakPolarHBondContact O-CB 3.42Å; L360-L363 PolarHBondContact O-N 3.1Å; L363-I365 PolarHBondContact O-N 3.18Å; L363-G366 PolarHBondContact O-N 3.25Å; L363-F367 HydrophobicContact CD2-CE2 4.26Å; L363-F367 WeakPolarHBondContact O-CD2 3.45Å; L363-F367 PolarHBondContact O-N 2.88Å; L363-P485 HydrophobicContact CD2-CB 4.19Å; L363-P485 VanDerWaalsContact CD2-O 3.28Å; L363-P485 WeakPolarHBondContact CD2-O 3.26Å; L363-M489 HydrophobicContact CD2-CB 4.2Å; L363-F552 HydrophobicContact CB-CB 4.2Å; L363-F552 HydrophobicContact CB-CD1 4.04Å; L363-F552 HydrophobicContact CB-CD2 4.32Å; L363-F552 HydrophobicContact CB-CG 3.93Å; L363-F552 HydrophobicContact CD1-CD1 4.06Å; L363-F552 HydrophobicContact CD1-CE1 4.1Å
364	G	97.4	Very high	97.1	Very high	0 Å²	0	35 Å²	35	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-58.6	-45.5	176.6	0	0	0	0	0	112.6	L360 V361 G366 F367 A368 H549 F553	L360-G364 PolarHBondContact O-N 3.16Å; V361-G364 PolarHBondContact O-N 3.36Å; G364-G366 PolarHBondContact O-N 2.94Å; G364-F367 PolarHBondContact O-N 3.29Å; G364-A368 WeakPolarHBondContact O-CB 3.33Å; G364-A368 PolarHBondContact O-N 3.3Å; G364-H549 WeakPolarHBondContact O-CB 3.23Å; G364-F553 VanDerWaalsContact C-CZ 3.44Å
365	I	98.1	Very high	96.9	Very high	77 Å²	77	31.3 Å²	31.3	40%	0.395	19%	0.186	S	C	.	.	H	α-helix	trans	-62.2	-43.6	175.6	-68.1	166.2	0	0	0	110.9	V361 L362 L363 F367 A368 L369 F553	V361-I365 HydrophobicContact CG1-CD1 3.83Å; V361-I365 HydrophobicContact CG1-CG1 4.42Å; V361-I365 VanDerWaalsContact O-CG1 3.3Å; V361-I365 WeakPolarHBondContact O-CG1 3.35Å; V361-I365 PolarHBondContact O-N 3.25Å; L362-I365 PolarHBondContact O-N 3.32Å; L363-I365 PolarHBondContact O-N 3.18Å; I365-F367 PolarHBondContact O-N 3.31Å; I365-A368 PolarHBondContact O-N 3.46Å; I365-L369 HydrophobicContact CG2-CD1 4.06Å; I365-L369 HydrophobicContact CG2-CG 4.4Å; I365-L369 WeakPolarHBondContact O-CG 3.36Å; I365-L369 PolarHBondContact O-N 3.39Å; I365-F553 HydrophobicContact CG1-CE1 4.36Å; I365-F553 HydrophobicContact CG1-CZ 4.2Å
366	G	97.6	Very high	96.6	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-57.2	-50	177.7	0	0	0	0	0	112.2	L362 L363 G364 A368 L369 I370 I484	L362-G366 PolarHBondContact O-N 2.97Å; L363-G366 PolarHBondContact O-N 3.25Å; G364-G366 PolarHBondContact O-N 2.94Å; G366-A368 VanDerWaalsContact C-N 3.33Å; G366-A368 PolarHBondContact O-N 2.98Å; G366-L369 PolarHBondContact O-N 2.93Å; G366-I370 VanDerWaalsContact O-CG1 3.29Å; G366-I370 WeakPolarHBondContact O-CG1 3.44Å; G366-I370 PolarHBondContact O-N 3.26Å; G366-I484 VanDerWaalsContact CA-CG2 3.43Å
367	F	97.2	Very high	96.2	Very high	3 Å²	3	33.7 Å²	33.7	1%	0.013	21%	0.207	C	C	.	.	H	α-helix	trans	-69.2	-28.3	176.9	-78.3	-67.7	0	0	0	113.6	I306 L309 L363 G364 I365 I370 A371 P485 R548 H549 F552	I306-F367 HydrophobicContact CG2-CE2 4.26Å; I306-F367 HydrophobicContact CG2-CZ 4.09Å; L309-F367 HydrophobicContact CB-CE1 3.95Å; L309-F367 HydrophobicContact CB-CZ 4.25Å; L363-F367 HydrophobicContact CD2-CE2 4.26Å; L363-F367 WeakPolarHBondContact O-CD2 3.45Å; L363-F367 PolarHBondContact O-N 2.88Å; G364-F367 PolarHBondContact O-N 3.29Å; I365-F367 PolarHBondContact O-N 3.31Å; F367-I370 HydrophobicContact CD1-CD1 4.29Å; F367-A371 WeakPolarHBondContact O-CB 3.21Å; F367-A371 PolarHBondContact O-N 3.06Å; F367-P485 HydrophobicContact CD2-CB 4.42Å; F367-P485 HydrophobicContact CD2-CG 4.35Å; F367-P485 HydrophobicContact CE1-CG 4.33Å; F367-P485 HydrophobicContact CE2-CB 3.84Å; F367-P485 HydrophobicContact CE2-CG 4.16Å; F367-P485 HydrophobicContact CZ-CB 3.93Å; F367-P485 HydrophobicContact CZ-CG 4.16Å; F367-R548 HydrophobicContact CB-CB 4Å; F367-R548 HydrophobicContact CD1-CB 3.86Å; F367-R548 HydrophobicContact CD1-CG 4.36Å; F367-R548 HydrophobicContact CD2-CB 4.5Å; F367-R548 HydrophobicContact CE1-CB 4.48Å; F367-R548 HydrophobicContact CG-CB 3.87Å; F367-H549 HydrophobicContact CB-CB 3.85Å; F367-F552 AromaticContact CD2-CD2 3.63Å; F367-F552 HydrophobicContact CD2-CD2 3.63Å; F367-F552 AromaticContact CD2-CE2 3.44Å; F367-F552 HydrophobicContact CD2-CE2 3.44Å; F367-F552 VanDerWaalsContact CD2-CE2 3.44Å; F367-F552 HydrophobicContact CD2-CZ 4.49Å; F367-F552 AromaticContact CE2-CD2 3.97Å; F367-F552 HydrophobicContact CE2-CD2 3.97Å; F367-F552 AromaticContact CE2-CE2 3.29Å; F367-F552 HydrophobicContact CE2-CE2 3.29Å; F367-F552 AromaticContact CE2-CZ 3.98Å; F367-F552 HydrophobicContact CE2-CZ 3.98Å; F367-F552 HydrophobicContact CZ-CE2 4.28Å
368	A	97.4	Very high	95.8	Very high	33 Å²	33	38.8 Å²	38.8	27%	0.273	23%	0.23	S	C	.	.	H	α-helix	trans	-68.3	-41.3	174.5	0	0	0	0	0	111.5	G364 I365 G366 A371 S372 H549	G364-A368 WeakPolarHBondContact O-CB 3.33Å; G364-A368 PolarHBondContact O-N 3.3Å; I365-A368 PolarHBondContact O-N 3.46Å; G366-A368 VanDerWaalsContact C-N 3.33Å; G366-A368 PolarHBondContact O-N 2.98Å; A368-A371 PolarHBondContact O-N 3.37Å; A368-S372 PolarHBondContact O-N 2.93Å; A368-S372 PolarHBondContact O-OG 3.24Å; A368-H549 HydrophobicContact CB-CB 4.03Å
369	L	97.5	Very high	95.5	Very high	60 Å²	60	36.5 Å²	36.5	31%	0.314	21%	0.214	S	C	.	.	H	α-helix	trans	-67.1	-38.3	175.1	-69.7	173.2	0	0	0	112.3	I365 G366 A371 S372 N373 Y481 I484	I365-L369 HydrophobicContact CG2-CD1 4.06Å; I365-L369 HydrophobicContact CG2-CG 4.4Å; I365-L369 WeakPolarHBondContact O-CG 3.36Å; I365-L369 PolarHBondContact O-N 3.39Å; G366-L369 PolarHBondContact O-N 2.93Å; L369-A371 VanDerWaalsContact C-N 3.34Å; L369-S372 WeakPolarHBondContact CA-OG 3.39Å; L369-S372 PolarHBondContact O-OG 3.21Å; L369-S372 VanDerWaalsContact O-OG 3.14Å; L369-N373 WeakPolarHBondContact O-CB 3.41Å; L369-N373 PolarHBondContact O-N 2.89Å; L369-N373 VanDerWaalsContact O-N 3.14Å; L369-N373 PolarHBondContact O-OD1 2.73Å; L369-Y481 HydrophobicContact CB-CD2 4.46Å; L369-Y481 HydrophobicContact CB-CG 4.33Å; L369-I484 HydrophobicContact CD1-CD1 3.75Å
370	I	96	Very high	95.2	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-61.8	-44.9	173.9	-68.7	169.5	0	0	0	110.3	G366 F367 S374 T479 P485	G366-I370 VanDerWaalsContact O-CG1 3.29Å; G366-I370 WeakPolarHBondContact O-CG1 3.44Å; G366-I370 PolarHBondContact O-N 3.26Å; F367-I370 HydrophobicContact CD1-CD1 4.29Å; I370-S374 PolarHBondContact O-N 2.73Å; I370-S374 VanDerWaalsContact O-N 3.16Å; I370-T479 HydrophobicContact CD1-CG2 4.18Å; I370-T479 HydrophobicContact CG1-CG2 3.96Å; I370-T479 HydrophobicContact CG2-CG2 4.15Å; I370-P485 HydrophobicContact CD1-CG 3.58Å
371	A	95.4	Very high	95	Very high	16 Å²	16	38.8 Å²	38.8	13%	0.132	23%	0.226	C	C	.	.	H	α-helix	trans	-64.4	-46.3	178.6	0	0	0	0	0	112.1	F367 A368 L369 N373 S374 D404	F367-A371 WeakPolarHBondContact O-CB 3.21Å; F367-A371 PolarHBondContact O-N 3.06Å; A368-A371 PolarHBondContact O-N 3.37Å; L369-A371 VanDerWaalsContact C-N 3.34Å; A371-N373 VanDerWaalsContact C-N 3.29Å; A371-N373 PolarHBondContact O-N 3.38Å; A371-S374 WeakPolarHBondContact O-CB 3.38Å; A371-S374 PolarHBondContact O-N 3Å; A371-S374 PolarHBondContact O-OG 3.18Å; A371-D404 HydrophobicContact CB-CB 4.48Å
372	S	94.2	Very high	94.6	Very high	84 Å²	84	36.7 Å²	36.7	59%	0.587	21%	0.214	S	C	*	.	H	α-helix	trans	-68	-26	-177.3	62	0	0	0	0	114.5	A368 L369	A368-S372 PolarHBondContact O-N 2.93Å; A368-S372 PolarHBondContact O-OG 3.24Å; L369-S372 WeakPolarHBondContact CA-OG 3.39Å; L369-S372 PolarHBondContact O-OG 3.21Å; L369-S372 VanDerWaalsContact O-OG 3.14Å
373	N	93.5	Very high	94.2	Very high	87 Å²	87	40.3 Å²	40.3	47%	0.465	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	10.8	-178.3	-68.3	58.7	0	0	0	112.4	L369 A371 Y481	L369-N373 WeakPolarHBondContact O-CB 3.41Å; L369-N373 PolarHBondContact O-N 2.89Å; L369-N373 VanDerWaalsContact O-N 3.14Å; L369-N373 PolarHBondContact O-OD1 2.73Å; A371-N373 VanDerWaalsContact C-N 3.29Å; A371-N373 PolarHBondContact O-N 3.38Å; N373-Y481 HydrophobicContact CB-CD2 4.28Å; N373-Y481 HydrophobicContact CB-CE2 3.74Å; N373-Y481 PolarHBondContact ND2-OH 3.1Å
374	S	93.7	Very high	94	Very high	28 Å²	28	41.6 Å²	41.6	20%	0.196	24%	0.238	C	C	.	.	S	Bend	trans	-69.1	145.9	176.4	66.9	0	0	0	0	110.9	I370 A371 D404	I370-S374 PolarHBondContact O-N 2.73Å; I370-S374 VanDerWaalsContact O-N 3.16Å; A371-S374 WeakPolarHBondContact O-CB 3.38Å; A371-S374 PolarHBondContact O-N 3Å; A371-S374 PolarHBondContact O-OG 3.18Å; S374-D404 VanDerWaalsContact OG-CB 3.26Å; S374-D404 WeakPolarHBondContact OG-CB 3.26Å
375	P	93.6	Very high	93.6	Very high	6 Å²	6	45.6 Å²	45.6	4%	0.039	26%	0.258	C	S	.	.			trans	-63	143.3	178.8	-23.4	33.8	0	0	0	113.5	C403 F414 P422 T423 I478	P375-C403 WeakPolarHBondContact O-CB 3.46Å; P375-C403 PolarHBondContact O-N 3.12Å; P375-F414 HydrophobicContact CB-CE1 3.86Å; P375-F414 HydrophobicContact CB-CZ 3.8Å; P375-F414 HydrophobicContact CG-CE1 4.26Å; P375-P422 HydrophobicContact CB-CB 4.12Å; P375-P422 WeakPolarHBondContact CB-O 3.47Å; P375-P422 HydrophobicContact CG-CB 3.75Å; P375-T423 HydrophobicContact CB-CG2 4.47Å; P375-I478 HydrophobicContact CG-CG2 3.73Å
376	G	91.4	Very high	93.2	Very high	30 Å²	30	50.2 Å²	50.2	31%	0.309	28%	0.284	S	S	.	.			trans	-74.4	176.1	169.9	0	0	0	0	0	112.8	F414	G376-F414 WeakPolarHBondContact O-CZ 3.33Å
377	A	90.4	Very high	92.7	Very high	32 Å²	32	51.3 Å²	51.3	26%	0.264	30%	0.295	S	S	.	.			trans	-106.9	85	172.9	0	0	0	0	0	110.4	L401 G426	A377-L401 VanDerWaalsContact CB-O 3.23Å; A377-L401 WeakPolarHBondContact CB-O 3.41Å; A377-G426 CarbonylContact C-O 3.54Å; A377-G426 WeakPolarHBondContact CA-O 3.21Å
378	E	90.3	Very high	92.4	Very high	133 Å²	133	57.2 Å²	57.2	62%	0.621	32%	0.322	S	S	*	.			trans	-98.6	-25.6	179.6	-64.4	-170.5	177.7	0	0	113.1	T423 G426	E378-T423 WeakPolarHBondContact CB-O 3.18Å; E378-T423 WeakPolarHBondContact CG-O 3.14Å; E378-G426 PolarHBondContact N-O 2.73Å; E378-G426 VanDerWaalsContact N-O 3.16Å
379	Y	92.6	Very high	92.1	Very high	70 Å²	70	56.9 Å²	56.9	28%	0.275	32%	0.315	S	S	.	.			trans	-83.2	133.1	178.5	-171.4	-90.6	0	0	0	111.6	E381 G426 S427 R448	Y379-E381 HydrophobicContact CD1-CG 4.16Å; Y379-E381 WeakPolarHBondContact CD1-OE1 3.36Å; Y379-E381 HydrophobicContact CE1-CG 4.31Å; Y379-E381 WeakPolarHBondContact CE1-OE1 3.29Å; Y379-G426 PolarHBondContact N-O 3.08Å; Y379-S427 VanDerWaalsContact O-CB 3.27Å; Y379-S427 WeakPolarHBondContact O-CB 3.49Å; Y379-R448 VanDerWaalsContact CD1-CZ 3.41Å; Y379-R448 VanDerWaalsContact CE1-CZ 3.43Å
380	D	91.5	Very high	91.8	Very high	48 Å²	48	55.9 Å²	55.9	26%	0.257	31%	0.313	S	S	.	.			trans	-100.5	105.4	176.3	-168	-0	0	0	0	111.2	A382 L383 R399	D380-A382 PolarHBondContact O-N 3.29Å; D380-A382 VanDerWaalsContact O-N 3.08Å; D380-A382 WeakPolarHBondContact OD1-CB 3.23Å; D380-A382 PolarHBondContact OD1-N 3.31Å; D380-A382 VanDerWaalsContact OD1-N 3.09Å; D380-L383 HydrophobicContact CB-CD1 4.14Å; D380-L383 HydrophobicContact CB-CG 4.21Å; D380-L383 WeakPolarHBondContact O-CB 3.42Å; D380-L383 PolarHBondContact O-N 3.39Å; D380-R399 IonicContact OD1-CZ 2.81Å; D380-R399 IonicContact OD1-NE 2.67Å; D380-R399 PolarHBondContact OD1-NE 2.83Å; D380-R399 IonicContact OD1-NH2 2.87Å; D380-R399 PolarHBondContact OD1-NH2 3.45Å; D380-R399 VanDerWaalsContact OD1-NH2 3.1Å; D380-R399 IonicContact OD2-CZ 3.85Å; D380-R399 IonicContact OD2-NH2 2.94Å; D380-R399 PolarHBondContact OD2-NH2 2.97Å
381	E	92.5	Very high	91.6	Very high	5 Å²	5	63.7 Å²	63.7	2%	0.023	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-61.9	-15.3	177.1	-68.3	-68.9	157.1	0	0	113	Y379 L383 F384 S427 V429 Y446 G447 R448	Y379-E381 HydrophobicContact CD1-CG 4.16Å; Y379-E381 WeakPolarHBondContact CD1-OE1 3.36Å; Y379-E381 HydrophobicContact CE1-CG 4.31Å; Y379-E381 WeakPolarHBondContact CE1-OE1 3.29Å; E381-L383 PolarHBondContact O-N 3.41Å; E381-F384 PolarHBondContact O-N 3.27Å; E381-S427 VanDerWaalsContact CG-OG 3.29Å; E381-S427 WeakPolarHBondContact CG-OG 3.47Å; E381-S427 PolarHBondContact OE1-OG 3.36Å; E381-V429 HydrophobicContact CB-CG1 4.28Å; E381-V429 HydrophobicContact CG-CG1 3.71Å; E381-Y446 HydrophobicContact CB-CD2 4.4Å; E381-Y446 HydrophobicContact CB-CE2 3.74Å; E381-G447 WeakPolarHBondContact OE2-CA 3.48Å; E381-R448 IonicContact OE1-CZ 3.86Å; E381-R448 VanDerWaalsContact OE1-CZ 3.26Å; E381-R448 IonicContact OE1-NE 3.04Å; E381-R448 PolarHBondContact OE1-NE 3.43Å; E381-R448 IonicContact OE1-NH2 3.77Å; E381-R448 PolarHBondContact OE1-NH2 3.42Å; E381-R448 PolarHBondContact OE2-N 2.82Å; E381-R448 IonicContact OE2-NE 2.71Å
382	A	90.8	Very high	91.3	Very high	8 Å²	8	66.7 Å²	66.7	7%	0.066	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-64.5	-17.2	170.2	0	0	0	0	0	113.4	D380 G387 A393	D380-A382 PolarHBondContact O-N 3.29Å; D380-A382 VanDerWaalsContact O-N 3.08Å; D380-A382 WeakPolarHBondContact OD1-CB 3.23Å; D380-A382 PolarHBondContact OD1-N 3.31Å; D380-A382 VanDerWaalsContact OD1-N 3.09Å; A382-G387 VanDerWaalsContact O-CA 3.28Å; A382-G387 WeakPolarHBondContact O-CA 3.3Å; A382-A393 HydrophobicContact CB-CB 3.75Å
383	L	90.8	Very high	91.2	Very high	123 Å²	123	62.7 Å²	62.7	64%	0.644	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-91.6	-14.5	179.9	-61.4	175.7	0	0	0	113.2	D380 E381	D380-L383 HydrophobicContact CB-CD1 4.14Å; D380-L383 HydrophobicContact CB-CG 4.21Å; D380-L383 WeakPolarHBondContact O-CB 3.42Å; D380-L383 PolarHBondContact O-N 3.39Å; E381-L383 PolarHBondContact O-N 3.41Å
384	F	91.5	Very high	91.1	Very high	28 Å²	28	65 Å²	65	12%	0.123	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-64.5	144	-176.7	-175.5	-119.2	0	0	0	111.7	E381 N386 G387 Q388 F389 R448 L466 D467	E381-F384 PolarHBondContact O-N 3.27Å; F384-N386 VanDerWaalsContact C-N 3.34Å; F384-N386 PolarHBondContact O-N 3.04Å; F384-G387 PolarHBondContact O-N 2.96Å; F384-Q388 PolarHBondContact O-N 2.92Å; F384-F389 AromaticContact CD1-CD2 3.98Å; F384-F389 HydrophobicContact CD1-CD2 3.98Å; F384-F389 AromaticContact CD1-CE2 3.81Å; F384-F389 HydrophobicContact CD1-CE2 3.81Å; F384-F389 HydrophobicContact CE1-CE2 4.17Å; F384-R448 HydrophobicContact CB-CG 4.39Å; F384-R448 HydrophobicContact CD1-CG 4.1Å; F384-R448 HydrophobicContact CD2-CG 3.34Å; F384-R448 HydrophobicContact CE1-CG 4.19Å; F384-R448 HydrophobicContact CE2-CG 3.47Å; F384-R448 VanDerWaalsContact CE2-CG 3.47Å; F384-R448 HydrophobicContact CG-CG 3.68Å; F384-R448 HydrophobicContact CZ-CG 3.89Å; F384-L466 HydrophobicContact CE1-CD2 3.82Å; F384-L466 HydrophobicContact CE1-CG 4.3Å; F384-L466 HydrophobicContact CZ-CD2 4.47Å; F384-L466 HydrophobicContact CZ-CG 4.48Å; F384-D467 HydrophobicContact CZ-CB 4.38Å
385	M	89.6	Confident	91	Very high	85 Å²	85	72.6 Å²	72.6	42%	0.419	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	45.7	50.9	-175.3	-70.3	-171.6	170.9	0	0	113.9	G387 Q388 L466	M385-G387 PolarHBondContact O-N 3.23Å; M385-Q388 HydrophobicContact CB-CB 4Å; M385-Q388 PolarHBondContact O-N 3.26Å; M385-Q388 PolarHBondContact SD-OE1 3.49Å; M385-L466 HydrophobicContact CE-CD1 3.93Å; M385-L466 HydrophobicContact CE-CD2 3.79Å; M385-L466 HydrophobicContact CE-CG 3.82Å; M385-L466 HydrophobicContact SD-CD2 4.18Å
386	N	90.1	Very high	91	Very high	174 Å²	174	73.1 Å²	73.1	93%	0.93	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	54.9	32.6	-178.9	-64.7	-26.3	0	0	0	114.1	F384	F384-N386 VanDerWaalsContact C-N 3.34Å; F384-N386 PolarHBondContact O-N 3.04Å
387	G	87.5	Confident	91	Very high	22 Å²	22	75.5 Å²	75.5	23%	0.227	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	88.9	16	175.1	0	0	0	0	0	116	A382 F384 M385 F389 S390	A382-G387 VanDerWaalsContact O-CA 3.28Å; A382-G387 WeakPolarHBondContact O-CA 3.3Å; F384-G387 PolarHBondContact O-N 2.96Å; M385-G387 PolarHBondContact O-N 3.23Å; G387-F389 PolarHBondContact O-N 2.88Å; G387-F389 VanDerWaalsContact O-N 3.14Å; G387-S390 VanDerWaalsContact O-CB 3.3Å; G387-S390 WeakPolarHBondContact O-CB 3.48Å; G387-S390 PolarHBondContact O-N 2.74Å; G387-S390 VanDerWaalsContact O-N 3.09Å; G387-S390 PolarHBondContact O-OG 3.24Å
388	Q	91.2	Very high	91.1	Very high	127 Å²	127	74 Å²	74	59%	0.593	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-34.5	179	-178.9	175.1	-26.7	0	0	113.4	F384 M385	F384-Q388 PolarHBondContact O-N 2.92Å; M385-Q388 HydrophobicContact CB-CB 4Å; M385-Q388 PolarHBondContact O-N 3.26Å; M385-Q388 PolarHBondContact SD-OE1 3.49Å
389	F	90.4	Very high	91.3	Very high	27 Å²	27	72.1 Å²	72.1	12%	0.118	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	12.2	-177.8	-55.4	-70	0	0	0	114	F384 G387 E391 L392 A393 Y446 L450 L466	F384-F389 AromaticContact CD1-CD2 3.98Å; F384-F389 HydrophobicContact CD1-CD2 3.98Å; F384-F389 AromaticContact CD1-CE2 3.81Å; F384-F389 HydrophobicContact CD1-CE2 3.81Å; F384-F389 HydrophobicContact CE1-CE2 4.17Å; G387-F389 PolarHBondContact O-N 2.88Å; G387-F389 VanDerWaalsContact O-N 3.14Å; F389-E391 PolarHBondContact O-N 3.41Å; F389-L392 PolarHBondContact O-N 3.16Å; F389-A393 WeakPolarHBondContact O-CB 3.19Å; F389-A393 PolarHBondContact O-N 3.05Å; F389-Y446 HydrophobicContact CB-CD2 3.71Å; F389-Y446 HydrophobicContact CB-CG 4.28Å; F389-Y446 HydrophobicContact CG-CD2 4.29Å; F389-L450 HydrophobicContact CE1-CD2 3.94Å; F389-L450 HydrophobicContact CZ-CD2 3.7Å; F389-L466 HydrophobicContact CE2-CD2 4.4Å; F389-L466 HydrophobicContact CZ-CD2 4.35Å
390	S	90.7	Very high	91.2	Very high	39 Å²	39	71.6 Å²	71.6	27%	0.273	38%	0.379	S	S	.	.	H	α-helix	trans	-56.3	-45	-172.5	54.2	0	0	0	0	114	G387 L392 A393 M394	G387-S390 VanDerWaalsContact O-CB 3.3Å; G387-S390 WeakPolarHBondContact O-CB 3.48Å; G387-S390 PolarHBondContact O-N 2.74Å; G387-S390 VanDerWaalsContact O-N 3.09Å; G387-S390 PolarHBondContact O-OG 3.24Å; S390-L392 PolarHBondContact O-N 3.15Å; S390-A393 PolarHBondContact O-N 2.99Å; S390-M394 WeakPolarHBondContact O-CB 3.3Å; S390-M394 VanDerWaalsContact O-CG 3.25Å; S390-M394 WeakPolarHBondContact O-CG 3.28Å; S390-M394 PolarHBondContact O-N 3.29Å
391	E	91.2	Very high	91.4	Very high	166 Å²	166	71.8 Å²	71.8	78%	0.776	38%	0.38	S	S	*	.	H	α-helix	trans	-62.9	-42.8	178.4	-67	-173.6	173.6	0	0	112.4	F389 M394 K395	F389-E391 PolarHBondContact O-N 3.41Å; E391-M394 PolarHBondContact O-N 2.98Å; E391-K395 PolarHBondContact O-N 3.43Å
392	L	90.6	Very high	91.4	Very high	78 Å²	78	72.6 Å²	72.6	41%	0.408	39%	0.39	S	S	.	.	H	α-helix	trans	-69.6	-42.3	-179.7	-148.7	69.4	0	0	0	110.6	F389 S390 M394 K395 D396 L445 Y446	F389-L392 PolarHBondContact O-N 3.16Å; S390-L392 PolarHBondContact O-N 3.15Å; L392-M394 VanDerWaalsContact C-N 3.33Å; L392-M394 PolarHBondContact O-N 2.88Å; L392-K395 PolarHBondContact O-N 3.39Å; L392-D396 PolarHBondContact O-N 3Å; L392-D396 VanDerWaalsContact O-N 3.14Å; L392-L445 HydrophobicContact CD2-CD2 3.99Å; L392-L445 HydrophobicContact CD2-CG 3.92Å; L392-Y446 HydrophobicContact CB-CD1 4.3Å; L392-Y446 HydrophobicContact CB-CG 4.4Å; L392-Y446 HydrophobicContact CD2-CD1 3.71Å; L392-Y446 HydrophobicContact CD2-CG 3.98Å; L392-Y446 HydrophobicContact CG-CD1 4.06Å
393	A	91.2	Very high	91.6	Very high	0 Å²	0	72.2 Å²	72.2	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-62.8	-35.8	175.3	0	0	0	0	0	113.2	A382 F389 S390 K395 D396 R399 Y446	A382-A393 HydrophobicContact CB-CB 3.75Å; F389-A393 WeakPolarHBondContact O-CB 3.19Å; F389-A393 PolarHBondContact O-N 3.05Å; S390-A393 PolarHBondContact O-N 2.99Å; A393-K395 VanDerWaalsContact C-N 3.29Å; A393-K395 PolarHBondContact O-N 3.42Å; A393-D396 PolarHBondContact O-N 3.29Å; A393-R399 WeakPolarHBondContact O-CD 3.34Å; A393-Y446 WeakPolarHBondContact CA-OH 3.36Å; A393-Y446 HydrophobicContact CB-CD2 4.35Å; A393-Y446 HydrophobicContact CB-CE2 3.49Å; A393-Y446 VanDerWaalsContact CB-CE2 3.49Å
394	M	91	Very high	91.8	Very high	137 Å²	137	67.8 Å²	67.8	68%	0.675	36%	0.363	S	S	*	.	H	α-helix	trans	-69.7	-25.7	176	-75.3	-177.7	-170.9	0	0	113.7	S390 E391 L392	S390-M394 WeakPolarHBondContact O-CB 3.3Å; S390-M394 VanDerWaalsContact O-CG 3.25Å; S390-M394 WeakPolarHBondContact O-CG 3.28Å; S390-M394 PolarHBondContact O-N 3.29Å; E391-M394 PolarHBondContact O-N 2.98Å; L392-M394 VanDerWaalsContact C-N 3.33Å; L392-M394 PolarHBondContact O-N 2.88Å
395	K	92.9	Very high	91.9	Very high	186 Å²	186	68.6 Å²	68.6	81%	0.809	38%	0.376	S	S	*	.	H	α-helix	trans	-93.5	-8.3	179.2	-160.7	177.9	176.1	-175.5	0	113	E391 L392 A393 S397	E391-K395 PolarHBondContact O-N 3.43Å; L392-K395 PolarHBondContact O-N 3.39Å; A393-K395 VanDerWaalsContact C-N 3.29Å; A393-K395 PolarHBondContact O-N 3.42Å; K395-S397 PolarHBondContact O-N 2.98Å
396	D	92.1	Very high	92.2	Very high	17 Å²	17	64.6 Å²	64.6	9%	0.091	36%	0.356	C	S	.	.			trans	-71.8	122.7	-175.1	-167.4	-7.5	0	0	0	112.2	L392 A393 C398 R399 V429 S430 Y446	L392-D396 PolarHBondContact O-N 3Å; L392-D396 VanDerWaalsContact O-N 3.14Å; A393-D396 PolarHBondContact O-N 3.29Å; D396-C398 PolarHBondContact O-N 2.99Å; D396-C398 WeakPolarHBondContact OD1-CB 3.33Å; D396-C398 PolarHBondContact OD1-N 3.37Å; D396-C398 PolarHBondContact OD1-SG 3.49Å; D396-R399 HydrophobicContact CB-CB 4.47Å; D396-R399 WeakPolarHBondContact O-CB 3.39Å; D396-R399 PolarHBondContact O-N 3.03Å; D396-V429 WeakPolarHBondContact OD2-CA 3.47Å; D396-S430 VanDerWaalsContact CG-OG 3.3Å; D396-S430 PolarHBondContact OD1-OG 2.74Å; D396-S430 PolarHBondContact OD2-N 3.28Å; D396-S430 PolarHBondContact OD2-OG 3.22Å; D396-Y446 HydrophobicContact CB-CE1 4.07Å; D396-Y446 WeakPolarHBondContact CB-OH 3.37Å; D396-Y446 VanDerWaalsContact OD2-CE1 3.3Å; D396-Y446 WeakPolarHBondContact OD2-CE1 3.09Å; D396-Y446 PolarHBondContact OD2-OH 3.38Å
397	S	91.9	Very high	92.3	Very high	80 Å²	80	56.9 Å²	56.9	56%	0.559	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-20.2	174.4	66.3	0	0	0	0	114.1	K395 H411	K395-S397 PolarHBondContact O-N 2.98Å; S397-H411 PolarHBondContact OG-NE2 3.27Å
398	C	93.7	Very high	92.5	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-16.2	179.9	-57.2	0	0	0	0	112.7	D396 G400 L401 C412 C428 S430	D396-C398 PolarHBondContact O-N 2.99Å; D396-C398 WeakPolarHBondContact OD1-CB 3.33Å; D396-C398 PolarHBondContact OD1-N 3.37Å; D396-C398 PolarHBondContact OD1-SG 3.49Å; C398-G400 PolarHBondContact O-N 2.81Å; C398-L401 WeakPolarHBondContact O-CB 3.12Å; C398-L401 WeakPolarHBondContact O-CG 3.3Å; C398-L401 PolarHBondContact O-N 2.72Å; C398-C412 HydrophobicContact CB-CB 3.85Å; C398-C412 WeakPolarHBondContact CB-SG 3.43Å; C398-C412 VanDerWaalsContact SG-CA 3.58Å; C398-C412 WeakPolarHBondContact SG-CB 3.22Å; C398-C412 CovalentContact SG-SG 2.03Å; C398-C412 PolarHBondContact SG-SG 3.41Å; C398-C428 VanDerWaalsContact O-CB 3.32Å; C398-C428 WeakPolarHBondContact O-CB 3.31Å; C398-C428 PolarHBondContact O-SG 3.37Å; C398-C428 VanDerWaalsContact O-SG 3.4Å; C398-S430 PolarHBondContact SG-OG 3.13Å
399	R	93.6	Very high	92.4	Very high	94 Å²	94	54.6 Å²	54.6	36%	0.355	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	134.8	-171.7	-178	169.3	178.4	-166	1.8	112.4	D380 A393 D396 L401	D380-R399 IonicContact OD1-CZ 2.81Å; D380-R399 IonicContact OD1-NE 2.67Å; D380-R399 PolarHBondContact OD1-NE 2.83Å; D380-R399 IonicContact OD1-NH2 2.87Å; D380-R399 PolarHBondContact OD1-NH2 3.45Å; D380-R399 VanDerWaalsContact OD1-NH2 3.1Å; D380-R399 IonicContact OD2-CZ 3.85Å; D380-R399 IonicContact OD2-NH2 2.94Å; D380-R399 PolarHBondContact OD2-NH2 2.97Å; A393-R399 WeakPolarHBondContact O-CD 3.34Å; D396-R399 HydrophobicContact CB-CB 4.47Å; D396-R399 WeakPolarHBondContact O-CB 3.39Å; D396-R399 PolarHBondContact O-N 3.03Å; R399-L401 VanDerWaalsContact C-N 3.28Å; R399-L401 PolarHBondContact O-N 3.08Å
400	G	91.1	Very high	92.1	Very high	59 Å²	59	54.7 Å²	54.7	61%	0.608	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	82	-1.6	176.3	0	0	0	0	0	114.9	C398	C398-G400 PolarHBondContact O-N 2.81Å
401	L	94.3	Very high	92	Very high	52 Å²	52	56.4 Å²	56.4	27%	0.272	31%	0.308	S	S	.	.			trans	-78.6	128.8	173.4	-61.4	175.3	0	0	0	110.4	A377 C398 R399 A405 C406 L409 C428	A377-L401 VanDerWaalsContact CB-O 3.23Å; A377-L401 WeakPolarHBondContact CB-O 3.41Å; C398-L401 WeakPolarHBondContact O-CB 3.12Å; C398-L401 WeakPolarHBondContact O-CG 3.3Å; C398-L401 PolarHBondContact O-N 2.72Å; R399-L401 VanDerWaalsContact C-N 3.28Å; R399-L401 PolarHBondContact O-N 3.08Å; L401-A405 HydrophobicContact CB-CB 4.41Å; L401-A405 HydrophobicContact CD2-CB 4.39Å; L401-C406 HydrophobicContact CB-CB 4.46Å; L401-L409 HydrophobicContact CD1-CD1 3.37Å; L401-C428 HydrophobicContact CB-CB 4.03Å; L401-C428 WeakPolarHBondContact O-CB 3.47Å
402	G	94.3	Very high	92.1	Very high	23 Å²	23	48.5 Å²	48.5	24%	0.237	27%	0.272	C	S	.	.			trans	-63.3	165.5	168	0	0	0	0	0	111.8	D404 A405 C406	G402-D404 PolarHBondContact O-N 3.05Å; G402-A405 PolarHBondContact O-N 3.02Å; G402-C406 VanDerWaalsContact O-CB 3.28Å; G402-C406 WeakPolarHBondContact O-CB 3.47Å; G402-C406 PolarHBondContact O-N 3.08Å
403	C	95.1	Very high	92.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-56.8	-45.6	-171.8	-175.1	0	0	0	0	113.2	P375 A405 C406 S407 F414 C477	P375-C403 WeakPolarHBondContact O-CB 3.46Å; P375-C403 PolarHBondContact O-N 3.12Å; C403-A405 PolarHBondContact O-N 3.41Å; C403-C406 VanDerWaalsContact O-CB 3.32Å; C403-C406 WeakPolarHBondContact O-CB 3.21Å; C403-C406 PolarHBondContact O-N 3.36Å; C403-S407 VanDerWaalsContact O-CB 3.32Å; C403-S407 WeakPolarHBondContact O-CB 3.45Å; C403-S407 PolarHBondContact O-N 3.49Å; C403-S407 PolarHBondContact O-OG 2.84Å; C403-F414 HydrophobicContact CB-CB 4.45Å; C403-F414 HydrophobicContact CB-CD1 3.81Å; C403-F414 HydrophobicContact CB-CD2 3.67Å; C403-F414 HydrophobicContact CB-CE1 3.87Å; C403-F414 HydrophobicContact CB-CE2 3.73Å; C403-F414 HydrophobicContact CB-CG 3.71Å; C403-F414 HydrophobicContact CB-CZ 3.82Å; C403-C477 HydrophobicContact CB-CB 4.1Å; C403-C477 WeakPolarHBondContact CB-SG 3.38Å; C403-C477 PolarHBondContact O-SG 2.91Å; C403-C477 WeakPolarHBondContact SG-CA 3.38Å; C403-C477 WeakPolarHBondContact SG-CB 3.39Å; C403-C477 CovalentContact SG-SG 2.04Å; C403-C477 PolarHBondContact SG-SG 2.94Å
404	D	94.7	Very high	92.5	Very high	29 Å²	29	44.9 Å²	44.9	16%	0.155	25%	0.253	C	S	.	.	H	α-helix	trans	-59.3	-51.6	-178.7	-178.9	70.5	0	0	0	111.2	A371 S374 G402 C406 S407 Y408 C477	A371-D404 HydrophobicContact CB-CB 4.48Å; S374-D404 VanDerWaalsContact OG-CB 3.26Å; S374-D404 WeakPolarHBondContact OG-CB 3.26Å; G402-D404 PolarHBondContact O-N 3.05Å; D404-C406 VanDerWaalsContact C-N 3.34Å; D404-C406 PolarHBondContact O-N 3.01Å; D404-S407 PolarHBondContact O-N 3.03Å; D404-S407 VanDerWaalsContact O-N 3.14Å; D404-S407 PolarHBondContact O-OG 3.13Å; D404-Y408 WeakPolarHBondContact O-CD2 3.41Å; D404-Y408 WeakPolarHBondContact O-CE2 3.21Å; D404-C477 PolarHBondContact N-SG 3.32Å
405	A	94	Very high	92.7	Very high	46 Å²	46	38.4 Å²	38.4	38%	0.38	22%	0.221	S	C	.	.	H	α-helix	trans	-61.2	-41	176.6	0	0	0	0	0	112.6	L401 G402 C403 S407 Y408	L401-A405 HydrophobicContact CB-CB 4.41Å; L401-A405 HydrophobicContact CD2-CB 4.39Å; G402-A405 PolarHBondContact O-N 3.02Å; C403-A405 PolarHBondContact O-N 3.41Å; A405-S407 VanDerWaalsContact C-N 3.28Å; A405-S407 PolarHBondContact O-N 3.46Å; A405-Y408 PolarHBondContact O-N 2.92Å
406	C	94.8	Very high	92.8	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.007	18%	0.183	C	C	.	.	H	α-helix	trans	-56.6	-43.5	174.8	-168.1	0	0	0	0	111.4	L401 G402 C403 D404 Y408 L409 G413 F414 C428	L401-C406 HydrophobicContact CB-CB 4.46Å; G402-C406 VanDerWaalsContact O-CB 3.28Å; G402-C406 WeakPolarHBondContact O-CB 3.47Å; G402-C406 PolarHBondContact O-N 3.08Å; C403-C406 VanDerWaalsContact O-CB 3.32Å; C403-C406 WeakPolarHBondContact O-CB 3.21Å; C403-C406 PolarHBondContact O-N 3.36Å; D404-C406 VanDerWaalsContact C-N 3.34Å; D404-C406 PolarHBondContact O-N 3.01Å; C406-Y408 PolarHBondContact O-N 2.85Å; C406-Y408 VanDerWaalsContact O-N 3.16Å; C406-L409 PolarHBondContact O-N 3.44Å; C406-L409 VanDerWaalsContact O-N 3.11Å; C406-G413 PolarHBondContact SG-O 2.92Å; C406-F414 HydrophobicContact CB-CD2 4.42Å; C406-C428 HydrophobicContact CB-CB 3.63Å; C406-C428 WeakPolarHBondContact CB-SG 3.39Å; C406-C428 WeakPolarHBondContact SG-CB 3.48Å; C406-C428 CovalentContact SG-SG 2.02Å; C406-C428 PolarHBondContact SG-SG 2.67Å
407	S	92.6	Very high	92.8	Very high	12 Å²	12	31.7 Å²	31.7	8%	0.084	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-6.9	-173.2	75.8	0	0	0	0	115.3	C403 D404 A405 R548	C403-S407 VanDerWaalsContact O-CB 3.32Å; C403-S407 WeakPolarHBondContact O-CB 3.45Å; C403-S407 PolarHBondContact O-N 3.49Å; C403-S407 PolarHBondContact O-OG 2.84Å; D404-S407 PolarHBondContact O-N 3.03Å; D404-S407 VanDerWaalsContact O-N 3.14Å; D404-S407 PolarHBondContact O-OG 3.13Å; A405-S407 VanDerWaalsContact C-N 3.28Å; A405-S407 PolarHBondContact O-N 3.46Å; S407-R548 PolarHBondContact O-NH2 3.28Å; S407-R548 PolarHBondContact OG-NH2 2.96Å
408	Y	91	Very high	92.4	Very high	38 Å²	38	32.3 Å²	32.3	15%	0.149	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-17	171.5	-69.5	-82.6	0	0	0	113.3	D404 A405 C406 V543 R548	D404-Y408 WeakPolarHBondContact O-CD2 3.41Å; D404-Y408 WeakPolarHBondContact O-CE2 3.21Å; A405-Y408 PolarHBondContact O-N 2.92Å; C406-Y408 PolarHBondContact O-N 2.85Å; C406-Y408 VanDerWaalsContact O-N 3.16Å; Y408-V543 HydrophobicContact CD1-CG1 4.44Å; Y408-V543 HydrophobicContact CE1-CG1 3.91Å; Y408-V543 WeakPolarHBondContact CE1-O 3.49Å; Y408-R548 HydrophobicContact CE1-CG 3.91Å; Y408-R548 WeakPolarHBondContact OH-CG 3.29Å; Y408-R548 PolarHBondContact OH-N 3.27Å
409	L	90.1	Very high	92	Very high	63 Å²	63	39.5 Å²	39.5	33%	0.33	23%	0.227	S	C	.	.			trans	-89.6	122.7	-177.6	-63.2	177.1	0	0	0	109.8	L401 C406 H411 C412	L401-L409 HydrophobicContact CD1-CD1 3.37Å; C406-L409 PolarHBondContact O-N 3.44Å; C406-L409 VanDerWaalsContact O-N 3.11Å; L409-H411 PolarHBondContact O-N 3.28Å; L409-C412 HydrophobicContact CB-CB 3.88Å; L409-C412 VanDerWaalsContact CB-SG 3.56Å; L409-C412 WeakPolarHBondContact CD1-SG 3.23Å; L409-C412 PolarHBondContact O-N 3.14Å
410	A	84.3	Confident	91.5	Very high	29 Å²	29	36.2 Å²	36.2	24%	0.24	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-31	-176.7	0	0	0	0	0	113	I431 Y474	A410-I431 WeakPolarHBondContact O-CD1 3.43Å; A410-Y474 VanDerWaalsContact O-CE2 3.24Å; A410-Y474 WeakPolarHBondContact O-CE2 3.49Å; A410-Y474 PolarHBondContact O-OH 3.03Å
411	H	88.8	Confident	91.2	Very high	74 Å²	74	36.8 Å²	36.8	34%	0.343	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	6.9	-177.7	64.6	-78	0	0	0	114	S397 L409 S430 I431	S397-H411 PolarHBondContact OG-NE2 3.27Å; L409-H411 PolarHBondContact O-N 3.28Å; H411-S430 CarbonylContact O-C 3.52Å; H411-S430 VanDerWaalsContact O-CA 3.29Å; H411-S430 WeakPolarHBondContact O-CA 3.43Å; H411-I431 PolarHBondContact O-N 2.9Å
412	C	92.8	Very high	90.7	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	153.5	-179.3	-55.2	0	0	0	0	112.2	C398 L409 V429 Y474	C398-C412 HydrophobicContact CB-CB 3.85Å; C398-C412 WeakPolarHBondContact CB-SG 3.43Å; C398-C412 VanDerWaalsContact SG-CA 3.58Å; C398-C412 WeakPolarHBondContact SG-CB 3.22Å; C398-C412 CovalentContact SG-SG 2.03Å; C398-C412 PolarHBondContact SG-SG 3.41Å; L409-C412 HydrophobicContact CB-CB 3.88Å; L409-C412 VanDerWaalsContact CB-SG 3.56Å; L409-C412 WeakPolarHBondContact CD1-SG 3.23Å; L409-C412 PolarHBondContact O-N 3.14Å; C412-V429 CarbonylContact C-O 3.52Å; C412-V429 WeakPolarHBondContact CA-O 3.16Å; C412-Y474 WeakPolarHBondContact O-CD2 3.24Å; C412-Y474 WeakPolarHBondContact O-CE2 3.42Å
413	G	93.7	Very high	90.2	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	165.7	168.1	0	0	0	0	0	111.5	C406 C428 V429 D473	C406-G413 PolarHBondContact SG-O 2.92Å; G413-C428 WeakPolarHBondContact O-CA 2.92Å; G413-V429 PolarHBondContact N-O 3.27Å; G413-V429 PolarHBondContact O-N 3.44Å; G413-V429 VanDerWaalsContact O-O 3.07Å; G413-D473 CarbonylContact C-O 3.51Å; G413-D473 WeakPolarHBondContact CA-O 3.37Å
414	F	95.4	Very high	89.8	Confident	2 Å²	2	43.1 Å²	43.1	1%	0.009	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	120.2	-171.4	-165.5	-102.2	0	0	0	111.1	P375 G376 C403 C406 Y416 G426 S427 C428 F472 D473	P375-F414 HydrophobicContact CB-CE1 3.86Å; P375-F414 HydrophobicContact CB-CZ 3.8Å; P375-F414 HydrophobicContact CG-CE1 4.26Å; G376-F414 WeakPolarHBondContact O-CZ 3.33Å; C403-F414 HydrophobicContact CB-CB 4.45Å; C403-F414 HydrophobicContact CB-CD1 3.81Å; C403-F414 HydrophobicContact CB-CD2 3.67Å; C403-F414 HydrophobicContact CB-CE1 3.87Å; C403-F414 HydrophobicContact CB-CE2 3.73Å; C403-F414 HydrophobicContact CB-CG 3.71Å; C403-F414 HydrophobicContact CB-CZ 3.82Å; C406-F414 HydrophobicContact CB-CD2 4.42Å; F414-Y416 AromaticContact CD1-CD1 3.74Å; F414-Y416 HydrophobicContact CD1-CD1 3.74Å; F414-Y416 HydrophobicContact CD1-CG 4.35Å; F414-Y416 HydrophobicContact CE1-CD1 4.07Å; F414-Y416 HydrophobicContact CE1-CG 4.23Å; F414-G426 VanDerWaalsContact CZ-CA 3.48Å; F414-S427 WeakPolarHBondContact CD2-O 3.1Å; F414-C428 HydrophobicContact CD2-CB 4.22Å; F414-F472 WeakPolarHBondContact O-CA 3.44Å; F414-D473 PolarHBondContact N-O 2.94Å; F414-D473 PolarHBondContact O-N 2.9Å
415	C	95.5	Very high	89.7	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.007	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	126.2	-179.9	-171.9	0	0	0	0	110.7	G426 S427 V429 C449 V471 F472	C415-G426 CarbonylContact O-C 3.53Å; C415-G426 WeakPolarHBondContact O-CA 3.44Å; C415-S427 PolarHBondContact N-O 3.05Å; C415-S427 PolarHBondContact O-N 3.44Å; C415-S427 PolarHBondContact O-OG 3.24Å; C415-V429 HydrophobicContact CB-CG2 4.2Å; C415-C449 VanDerWaalsContact CA-SG 3.51Å; C415-C449 HydrophobicContact CB-CB 3.73Å; C415-C449 WeakPolarHBondContact CB-SG 3.32Å; C415-C449 WeakPolarHBondContact SG-CB 3.43Å; C415-C449 PolarHBondContact SG-N 2.97Å; C415-C449 VanDerWaalsContact SG-N 3.44Å; C415-C449 CovalentContact SG-SG 2.03Å; C415-C449 PolarHBondContact SG-SG 3.38Å; C415-V471 WeakPolarHBondContact CA-O 3.44Å; C415-F472 HydrophobicContact CB-CD2 4.4Å
416	Y	94.7	Very high	89.7	Confident	1 Å²	1	40.4 Å²	40.4	0%	0.004	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	165.3	-179.1	70.3	-79.9	0	0	0	111.9	R313 F414 L418 P422 V470 V471 D473 I478	R313-Y416 PolarHBondContact NH1-OH 3Å; F414-Y416 AromaticContact CD1-CD1 3.74Å; F414-Y416 HydrophobicContact CD1-CD1 3.74Å; F414-Y416 HydrophobicContact CD1-CG 4.35Å; F414-Y416 HydrophobicContact CE1-CD1 4.07Å; F414-Y416 HydrophobicContact CE1-CG 4.23Å; Y416-L418 HydrophobicContact CE2-CD2 4.37Å; Y416-P422 HydrophobicContact CD2-CB 3.78Å; Y416-P422 HydrophobicContact CD2-CG 4.04Å; Y416-P422 HydrophobicContact CE2-CB 4.39Å; Y416-P422 HydrophobicContact CE2-CG 4.32Å; Y416-P422 HydrophobicContact CG-CB 4.37Å; Y416-V470 CarbonylContact O-C 3.56Å; Y416-V470 VanDerWaalsContact O-CA 3.24Å; Y416-V470 WeakPolarHBondContact O-CA 3.19Å; Y416-V470 WeakPolarHBondContact O-CB 3.38Å; Y416-V471 HydrophobicContact CE1-CG1 4.43Å; Y416-V471 PolarHBondContact N-O 3.08Å; Y416-V471 PolarHBondContact O-N 3.35Å; Y416-D473 HydrophobicContact CE1-CB 4.42Å; Y416-D473 WeakPolarHBondContact CE1-OD2 3.35Å; Y416-I478 HydrophobicContact CE1-CB 4.49Å; Y416-I478 HydrophobicContact CE1-CG2 4.32Å; Y416-I478 HydrophobicContact CE2-CB 4.38Å; Y416-I478 HydrophobicContact CE2-CD1 3.71Å; Y416-I478 HydrophobicContact CE2-CG2 4.12Å; Y416-I478 WeakPolarHBondContact OH-CD1 3.05Å
417	E	92.9	Very high	89.7	Confident	60 Å²	60	40.6 Å²	40.6	28%	0.28	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	130.6	178.1	-164.7	176.7	177.4	0	0	111.2	T425 N469	E417-T425 HydrophobicContact CB-CG2 3.91Å; E417-T425 PolarHBondContact N-OG1 3.4Å; E417-T425 VanDerWaalsContact N-OG1 3.11Å; E417-N469 HydrophobicContact CG-CB 4.17Å; E417-N469 WeakPolarHBondContact CG-O 3.42Å
418	L	82.8	Confident	89.9	Confident	94 Å²	94	40.2 Å²	40.2	49%	0.492	22%	0.218	S	C	.	.	S	Bend	trans	-67.6	-40.9	-179	-90.9	173.1	0	0	0	113.3	Y416 N469 V471	Y416-L418 HydrophobicContact CE2-CD2 4.37Å; L418-N469 PolarHBondContact N-O 2.95Å; L418-V471 HydrophobicContact CB-CG2 4.49Å; L418-V471 HydrophobicContact CD1-CB 4.38Å; L418-V471 HydrophobicContact CD1-CG2 3.27Å; L418-V471 HydrophobicContact CD2-CG2 4.33Å; L418-V471 HydrophobicContact CG-CB 4.05Å; L418-V471 HydrophobicContact CG-CG2 3.4Å; L418-V471 VanDerWaalsContact CG-CG2 3.4Å
419	N	86.1	Confident	90.1	Very high	150 Å²	150	38.4 Å²	38.4	80%	0.802	21%	0.211	S	C	*	.	S	Bend	trans	-90.2	-9.9	-177.8	-67.9	-30.9	0	0	0	112.5
420	G	82	Confident	90.3	Very high	25 Å²	25	36.3 Å²	36.3	26%	0.258	20%	0.202	S	C	.	.	S	Bend	trans	-89.6	179.6	176	0	0	0	0	0	112.2	P422	G420-P422 VanDerWaalsContact O-CD 3.24Å; G420-P422 WeakPolarHBondContact O-CD 3.46Å
421	D	85.3	Confident	90.6	Very high	72 Å²	72	35.2 Å²	35.2	39%	0.385	19%	0.192	S	C	.	.			trans	-74.5	115	166	-174.3	-14.2	0	0	0	108.5	T423 Q424 T425	D421-T423 PolarHBondContact O-N 2.94Å; D421-T423 VanDerWaalsContact O-N 3.15Å; D421-T423 WeakPolarHBondContact OD1-CB 3.35Å; D421-T423 PolarHBondContact OD1-N 3.38Å; D421-T423 PolarHBondContact OD1-OG1 3.4Å; D421-T423 PolarHBondContact OD2-OG1 3.36Å; D421-Q424 HydrophobicContact CB-CB 4.29Å; D421-Q424 HydrophobicContact CB-CG 4.2Å; D421-Q424 PolarHBondContact O-N 3.34Å; D421-Q424 VanDerWaalsContact O-N 3.17Å; D421-T425 WeakPolarHBondContact O-CB 3.42Å; D421-T425 WeakPolarHBondContact O-CG2 3.18Å; D421-T425 PolarHBondContact O-N 3.17Å; D421-T425 PolarHBondContact O-OG1 3.42Å
422	P	83.2	Confident	90.4	Very high	29 Å²	29	33.6 Å²	33.6	19%	0.188	18%	0.183	C	C	.	.	H	α-helix	trans	-60.6	-24.9	179.7	-24.2	36.3	0	0	0	112.8	P375 Y416 G420 G426 I478	P375-P422 HydrophobicContact CB-CB 4.12Å; P375-P422 WeakPolarHBondContact CB-O 3.47Å; P375-P422 HydrophobicContact CG-CB 3.75Å; Y416-P422 HydrophobicContact CD2-CB 3.78Å; Y416-P422 HydrophobicContact CD2-CG 4.04Å; Y416-P422 HydrophobicContact CE2-CB 4.39Å; Y416-P422 HydrophobicContact CE2-CG 4.32Å; Y416-P422 HydrophobicContact CG-CB 4.37Å; G420-P422 VanDerWaalsContact O-CD 3.24Å; G420-P422 WeakPolarHBondContact O-CD 3.46Å; P422-G426 VanDerWaalsContact O-CA 3.29Å; P422-G426 WeakPolarHBondContact O-CA 3.35Å; P422-G426 PolarHBondContact O-N 2.91Å; P422-I478 HydrophobicContact CB-CG2 4.35Å
423	T	84.5	Confident	89.6	Confident	56 Å²	56	36.3 Å²	36.3	34%	0.344	20%	0.202	S	C	.	.	H	α-helix	trans	-69.5	-39.4	178.6	64.4	0	0	0	0	111.9	P375 E378 D421	P375-T423 HydrophobicContact CB-CG2 4.47Å; E378-T423 WeakPolarHBondContact CB-O 3.18Å; E378-T423 WeakPolarHBondContact CG-O 3.14Å; D421-T423 PolarHBondContact O-N 2.94Å; D421-T423 VanDerWaalsContact O-N 3.15Å; D421-T423 WeakPolarHBondContact OD1-CB 3.35Å; D421-T423 PolarHBondContact OD1-N 3.38Å; D421-T423 PolarHBondContact OD1-OG1 3.4Å; D421-T423 PolarHBondContact OD2-OG1 3.36Å
424	Q	86.8	Confident	88.2	Confident	122 Å²	122	39.4 Å²	39.4	57%	0.57	22%	0.219	S	C	*	.	H	α-helix	trans	-84.1	-34.5	180	-62.9	-176.7	1	0	0	112.7	D421	D421-Q424 HydrophobicContact CB-CB 4.29Å; D421-Q424 HydrophobicContact CB-CG 4.2Å; D421-Q424 PolarHBondContact O-N 3.34Å; D421-Q424 VanDerWaalsContact O-N 3.17Å
425	T	92.1	Very high	86.1	Confident	19 Å²	19	48.5 Å²	48.5	12%	0.117	26%	0.26	C	S	.	.	H	α-helix	trans	-93.6	-5.1	-175.2	62.8	0	0	0	0	113.2	E417 D421 R448	E417-T425 HydrophobicContact CB-CG2 3.91Å; E417-T425 PolarHBondContact N-OG1 3.4Å; E417-T425 VanDerWaalsContact N-OG1 3.11Å; D421-T425 WeakPolarHBondContact O-CB 3.42Å; D421-T425 WeakPolarHBondContact O-CG2 3.18Å; D421-T425 PolarHBondContact O-N 3.17Å; D421-T425 PolarHBondContact O-OG1 3.42Å; T425-R448 PolarHBondContact O-NH1 3Å; T425-R448 PolarHBondContact O-NH2 3.27Å
426	G	94.6	Very high	84	Confident	0 Å²	0	52 Å²	52	0%	0	29%	0.285	C	S	.	.			trans	-79.2	141.7	-174.6	0	0	0	0	0	114.1	A377 E378 Y379 F414 C415 P422	A377-G426 CarbonylContact C-O 3.54Å; A377-G426 WeakPolarHBondContact CA-O 3.21Å; E378-G426 PolarHBondContact N-O 2.73Å; E378-G426 VanDerWaalsContact N-O 3.16Å; Y379-G426 PolarHBondContact N-O 3.08Å; F414-G426 VanDerWaalsContact CZ-CA 3.48Å; C415-G426 CarbonylContact O-C 3.53Å; C415-G426 WeakPolarHBondContact O-CA 3.44Å; P422-G426 VanDerWaalsContact O-CA 3.29Å; P422-G426 WeakPolarHBondContact O-CA 3.35Å; P422-G426 PolarHBondContact O-N 2.91Å
427	S	95.3	Very high	81.7	Confident	5 Å²	5	58.3 Å²	58.3	4%	0.035	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	138.1	175.6	61.5	0	0	0	0	110.4	Y379 E381 F414 C415	Y379-S427 VanDerWaalsContact O-CB 3.27Å; Y379-S427 WeakPolarHBondContact O-CB 3.49Å; E381-S427 VanDerWaalsContact CG-OG 3.29Å; E381-S427 WeakPolarHBondContact CG-OG 3.47Å; E381-S427 PolarHBondContact OE1-OG 3.36Å; F414-S427 WeakPolarHBondContact CD2-O 3.1Å; C415-S427 PolarHBondContact N-O 3.05Å; C415-S427 PolarHBondContact O-N 3.44Å; C415-S427 PolarHBondContact O-OG 3.24Å
428	C	96.3	Very high	79.8	Confident	3 Å²	3	61.4 Å²	61.4	2%	0.02	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	129.9	171.3	-177.4	0	0	0	0	109.7	C398 L401 C406 G413 F414	C398-C428 VanDerWaalsContact O-CB 3.32Å; C398-C428 WeakPolarHBondContact O-CB 3.31Å; C398-C428 PolarHBondContact O-SG 3.37Å; C398-C428 VanDerWaalsContact O-SG 3.4Å; L401-C428 HydrophobicContact CB-CB 4.03Å; L401-C428 WeakPolarHBondContact O-CB 3.47Å; C406-C428 HydrophobicContact CB-CB 3.63Å; C406-C428 WeakPolarHBondContact CB-SG 3.39Å; C406-C428 WeakPolarHBondContact SG-CB 3.48Å; C406-C428 CovalentContact SG-SG 2.02Å; C406-C428 PolarHBondContact SG-SG 2.67Å; G413-C428 WeakPolarHBondContact O-CA 2.92Å; F414-C428 HydrophobicContact CD2-CB 4.22Å
429	V	95.4	Very high	78.6	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.006	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	148.3	-174.3	-70.5	0	0	0	0	110.7	E381 D396 C412 G413 C415 Y446 F472	E381-V429 HydrophobicContact CB-CG1 4.28Å; E381-V429 HydrophobicContact CG-CG1 3.71Å; D396-V429 WeakPolarHBondContact OD2-CA 3.47Å; C412-V429 CarbonylContact C-O 3.52Å; C412-V429 WeakPolarHBondContact CA-O 3.16Å; G413-V429 PolarHBondContact N-O 3.27Å; G413-V429 PolarHBondContact O-N 3.44Å; G413-V429 VanDerWaalsContact O-O 3.07Å; C415-V429 HydrophobicContact CB-CG2 4.2Å; V429-Y446 HydrophobicContact CG1-CE2 4.25Å; V429-F472 HydrophobicContact CG2-CE2 3.84Å
430	S	94	Very high	78	Confident	19 Å²	19	53.6 Å²	53.6	13%	0.133	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	139.2	173.8	-78.4	0	0	0	0	111.1	D396 C398 H411 L445	D396-S430 VanDerWaalsContact CG-OG 3.3Å; D396-S430 PolarHBondContact OD1-OG 2.74Å; D396-S430 PolarHBondContact OD2-N 3.28Å; D396-S430 PolarHBondContact OD2-OG 3.22Å; C398-S430 PolarHBondContact SG-OG 3.13Å; H411-S430 CarbonylContact O-C 3.52Å; H411-S430 VanDerWaalsContact O-CA 3.29Å; H411-S430 WeakPolarHBondContact O-CA 3.43Å; S430-L445 WeakPolarHBondContact O-CB 3.12Å; S430-L445 PolarHBondContact O-N 2.77Å
431	I	89.9	Confident	77.7	Confident	6 Å²	6	54.5 Å²	54.5	3%	0.031	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	155.2	172.4	73	179.2	0	0	0	110.2	A410 H411 S433 E439 S440 F472 Y474	A410-I431 WeakPolarHBondContact O-CD1 3.43Å; H411-I431 PolarHBondContact O-N 2.9Å; I431-S433 PolarHBondContact O-N 2.94Å; I431-E439 HydrophobicContact CD1-CB 3.69Å; I431-E439 HydrophobicContact CD1-CG 3.88Å; I431-S440 WeakPolarHBondContact CB-O 3.25Å; I431-F472 HydrophobicContact CG2-CE1 4.28Å; I431-F472 HydrophobicContact CG2-CZ 3.88Å; I431-Y474 HydrophobicContact CD1-CE2 3.97Å; I431-Y474 HydrophobicContact CG2-CD2 3.77Å; I431-Y474 HydrophobicContact CG2-CE2 3.78Å
432	Y	85.2	Confident	77.5	Confident	40 Å²	40	53.8 Å²	53.8	16%	0.157	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	126.9	170.4	178.7	-96.7	0	0	0	109.8	N434 E439 S440 Y443 L445 F454	Y432-N434 HydrophobicContact CE1-CB 4.11Å; Y432-E439 CarbonylContact O-C 3.58Å; Y432-E439 WeakPolarHBondContact O-CA 2.94Å; Y432-S440 PolarHBondContact O-N 3.14Å; Y432-Y443 VanDerWaalsContact CB-CE2 3.45Å; Y432-Y443 AromaticContact CD1-CE2 3.9Å; Y432-Y443 HydrophobicContact CD1-CE2 3.9Å; Y432-Y443 AromaticContact CG-CE2 3.71Å; Y432-Y443 HydrophobicContact CG-CE2 3.71Å; Y432-L445 HydrophobicContact CD2-CD1 3.77Å; Y432-L445 HydrophobicContact CE2-CD1 4.38Å; Y432-F454 AromaticContact CD2-CE2 3.97Å; Y432-F454 HydrophobicContact CD2-CE2 3.97Å; Y432-F454 HydrophobicContact CD2-CZ 4.11Å; Y432-F454 HydrophobicContact CE1-CZ 4.23Å; Y432-F454 AromaticContact CE2-CE2 3.78Å; Y432-F454 HydrophobicContact CE2-CE2 3.78Å; Y432-F454 AromaticContact CE2-CZ 3.43Å; Y432-F454 HydrophobicContact CE2-CZ 3.43Å; Y432-F454 VanDerWaalsContact CE2-CZ 3.43Å; Y432-F454 HydrophobicContact CG-CE2 4.5Å; Y432-F454 AromaticContact CZ-CZ 3.5Å; Y432-F454 VanDerWaalsContact CZ-CZ 3.5Å
433	S	76.1	Confident	77.7	Confident	57 Å²	57	53.3 Å²	53.3	40%	0.399	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	129.2	175.3	-178.9	0	0	0	0	109.3	I431 E438	I431-S433 PolarHBondContact O-N 2.94Å; S433-E438 WeakPolarHBondContact CA-O 3.3Å
434	N	64.9	Low	78.1	Confident	66 Å²	66	50.6 Å²	50.6	35%	0.353	26%	0.261	S	S	.	.			trans	-97.7	164.2	178.6	-151.8	-1.1	0	0	0	112	Y432 S436 H437 E438	Y432-N434 HydrophobicContact CE1-CB 4.11Å; N434-S436 PolarHBondContact O-N 2.85Å; N434-S436 VanDerWaalsContact O-N 3.1Å; N434-H437 WeakPolarHBondContact O-CA 3.35Å; N434-H437 PolarHBondContact O-N 3.3Å; N434-E438 PolarHBondContact N-O 3.26Å; N434-E438 VanDerWaalsContact N-O 3.14Å
435	H	51.4	Low	78.2	Confident	192 Å²	192	47.6 Å²	47.6	89%	0.889	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-19.3	177.7	-76.9	-62	0	0	0	114.2	H437	H435-H437 PolarHBondContact O-N 3.12Å
436	S	50.4	Low	78.2	Confident	75 Å²	75	46.9 Å²	46.9	52%	0.524	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	5.5	169.4	47.1	0	0	0	0	113.7	N434 E438	N434-S436 PolarHBondContact O-N 2.85Å; N434-S436 VanDerWaalsContact O-N 3.1Å; S436-E438 PolarHBondContact O-N 2.06Å
437	H	47.2	Very low	78.2	Confident	133 Å²	133	46.9 Å²	46.9	62%	0.616	24%	0.244	S	C	*	.			trans	68.1	1.8	-172	-72.4	-83.2	0	0	0	116.4	N434 H435 E439	N434-H437 WeakPolarHBondContact O-CA 3.35Å; N434-H437 PolarHBondContact O-N 3.3Å; H435-H437 PolarHBondContact O-N 3.12Å; H437-E439 PolarHBondContact O-N 3.34Å
438	E	51.8	Low	78.1	Confident	126 Å²	126	47.1 Å²	47.1	59%	0.589	24%	0.244	S	C	*	.			trans	-59	104.4	175.7	-70.9	175.4	172.1	0	0	111.5	S433 N434 S436	S433-E438 WeakPolarHBondContact CA-O 3.3Å; N434-E438 PolarHBondContact N-O 3.26Å; N434-E438 VanDerWaalsContact N-O 3.14Å; S436-E438 PolarHBondContact O-N 2.06Å
439	E	58.5	Low	78	Confident	67 Å²	67	47 Å²	47	31%	0.313	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	129.4	176.3	-76.5	-178.2	-176.4	0	0	110.7	I431 Y432 H437	I431-E439 HydrophobicContact CD1-CB 3.69Å; I431-E439 HydrophobicContact CD1-CG 3.88Å; Y432-E439 CarbonylContact O-C 3.58Å; Y432-E439 WeakPolarHBondContact O-CA 2.94Å; H437-E439 PolarHBondContact O-N 3.34Å
440	S	72.5	Confident	77.9	Confident	12 Å²	12	48.3 Å²	48.3	8%	0.084	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	120.2	175.5	179.2	0	0	0	0	111.9	I431 Y432 Q442 Y443	I431-S440 WeakPolarHBondContact CB-O 3.25Å; Y432-S440 PolarHBondContact O-N 3.14Å; S440-Q442 VanDerWaalsContact C-N 3.28Å; S440-Q442 PolarHBondContact OG-N 2.84Å; S440-Y443 WeakPolarHBondContact OG-CD1 3.35Å; S440-Y443 WeakPolarHBondContact OG-CE1 3.34Å; S440-Y443 PolarHBondContact OG-N 2.94Å
441	S	76.1	Confident	77.7	Confident	44 Å²	44	48.9 Å²	48.9	31%	0.308	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	2.7	169.6	67.3	0	0	0	0	114	Y474	S441-Y474 VanDerWaalsContact CB-CD1 3.45Å; S441-Y474 WeakPolarHBondContact O-CB 3.1Å
442	Q	81.6	Confident	77.5	Confident	57 Å²	57	53.7 Å²	53.7	27%	0.266	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	-18.7	-169.5	-64.9	-176.8	-47.2	0	0	113.9	S440 E461 V463	S440-Q442 VanDerWaalsContact C-N 3.28Å; S440-Q442 PolarHBondContact OG-N 2.84Å; Q442-E461 PolarHBondContact NE2-O 2.93Å; Q442-V463 HydrophobicContact CB-CB 4.41Å; Q442-V463 HydrophobicContact CB-CG2 3.87Å; Q442-V463 HydrophobicContact CG-CG2 4.46Å
443	Y	87.5	Confident	77.4	Confident	19 Å²	19	54.6 Å²	54.6	8%	0.075	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	156.4	-179.1	57.7	-90.5	0	0	0	111.5	Y432 S440 C449 R451 F454 I458 V463	Y432-Y443 VanDerWaalsContact CB-CE2 3.45Å; Y432-Y443 AromaticContact CD1-CE2 3.9Å; Y432-Y443 HydrophobicContact CD1-CE2 3.9Å; Y432-Y443 AromaticContact CG-CE2 3.71Å; Y432-Y443 HydrophobicContact CG-CE2 3.71Å; S440-Y443 WeakPolarHBondContact OG-CD1 3.35Å; S440-Y443 WeakPolarHBondContact OG-CE1 3.34Å; S440-Y443 PolarHBondContact OG-N 2.94Å; Y443-C449 WeakPolarHBondContact CA-O 3.15Å; Y443-C449 WeakPolarHBondContact CB-O 3.27Å; Y443-R451 HydrophobicContact CD1-CB 4.22Å; Y443-R451 HydrophobicContact CD2-CB 3.78Å; Y443-R451 HydrophobicContact CE2-CB 4.15Å; Y443-R451 HydrophobicContact CG-CB 3.82Å; Y443-F454 HydrophobicContact CE2-CE2 4.47Å; Y443-I458 HydrophobicContact CE1-CD1 4.01Å; Y443-V463 HydrophobicContact CD1-CB 4.49Å; Y443-V463 HydrophobicContact CD1-CG1 3.8Å; Y443-V463 HydrophobicContact CD1-CG2 4.24Å; Y443-V463 HydrophobicContact CG-CG1 4.38Å
444	S	91.9	Very high	77.4	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	164.9	179.8	60.9	0	0	0	0	112.8	Y446 C449 L450	S444-Y446 VanDerWaalsContact C-N 3.26Å; S444-Y446 PolarHBondContact O-N 3.35Å; S444-Y446 PolarHBondContact OG-O 3.29Å; S444-C449 PolarHBondContact N-O 3.41Å; S444-C449 WeakPolarHBondContact OG-CB 3.45Å; S444-C449 PolarHBondContact OG-O 2.88Å; S444-C449 VanDerWaalsContact OG-O 3.09Å; S444-L450 WeakPolarHBondContact O-CD1 3.3Å; S444-L450 PolarHBondContact OG-N 3.49Å
445	L	90.6	Very high	77.8	Confident	59 Å²	59	60.8 Å²	60.8	31%	0.309	30%	0.302	S	S	.	.	S	Bend	trans	-65.4	-29.5	174	179	62	0	0	0	112.6	L392 S430 Y432 L450	L392-L445 HydrophobicContact CD2-CD2 3.99Å; L392-L445 HydrophobicContact CD2-CG 3.92Å; S430-L445 WeakPolarHBondContact O-CB 3.12Å; S430-L445 PolarHBondContact O-N 2.77Å; Y432-L445 HydrophobicContact CD2-CD1 3.77Å; Y432-L445 HydrophobicContact CE2-CD1 4.38Å; L445-L450 WeakPolarHBondContact O-CD1 3.39Å
446	Y	92.1	Very high	78.8	Confident	4 Å²	4	57.5 Å²	57.5	2%	0.016	29%	0.285	C	S	.	.	S	Bend	trans	-158.7	175.4	-179.2	69.1	-86.7	0	0	0	112.2	E381 F389 L392 A393 D396 V429 S444	E381-Y446 HydrophobicContact CB-CD2 4.4Å; E381-Y446 HydrophobicContact CB-CE2 3.74Å; F389-Y446 HydrophobicContact CB-CD2 3.71Å; F389-Y446 HydrophobicContact CB-CG 4.28Å; F389-Y446 HydrophobicContact CG-CD2 4.29Å; L392-Y446 HydrophobicContact CB-CD1 4.3Å; L392-Y446 HydrophobicContact CB-CG 4.4Å; L392-Y446 HydrophobicContact CD2-CD1 3.71Å; L392-Y446 HydrophobicContact CD2-CG 3.98Å; L392-Y446 HydrophobicContact CG-CD1 4.06Å; A393-Y446 WeakPolarHBondContact CA-OH 3.36Å; A393-Y446 HydrophobicContact CB-CD2 4.35Å; A393-Y446 HydrophobicContact CB-CE2 3.49Å; A393-Y446 VanDerWaalsContact CB-CE2 3.49Å; D396-Y446 HydrophobicContact CB-CE1 4.07Å; D396-Y446 WeakPolarHBondContact CB-OH 3.37Å; D396-Y446 VanDerWaalsContact OD2-CE1 3.3Å; D396-Y446 WeakPolarHBondContact OD2-CE1 3.09Å; D396-Y446 PolarHBondContact OD2-OH 3.38Å; V429-Y446 HydrophobicContact CG1-CE2 4.25Å; S444-Y446 VanDerWaalsContact C-N 3.26Å; S444-Y446 PolarHBondContact O-N 3.35Å; S444-Y446 PolarHBondContact OG-O 3.29Å
447	G	93.2	Very high	79.5	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.294	C	S	.	.	S	Bend	trans	86.4	-160.4	174.6	0	0	0	0	0	112.8	E381 C449 L450	E381-G447 WeakPolarHBondContact OE2-CA 3.48Å; G447-C449 VanDerWaalsContact C-N 3.31Å; G447-C449 PolarHBondContact O-N 3.41Å; G447-L450 WeakPolarHBondContact O-CB 3.42Å; G447-L450 PolarHBondContact O-N 3.04Å; G447-L450 VanDerWaalsContact O-N 3.14Å
448	R	94.1	Very high	80.4	Confident	10 Å²	10	56.3 Å²	56.3	4%	0.038	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-37.3	-177.5	-70.5	178.2	-61.8	159	5.5	113.2	Y379 E381 F384 T425 L450 D467 V470	Y379-R448 VanDerWaalsContact CD1-CZ 3.41Å; Y379-R448 VanDerWaalsContact CE1-CZ 3.43Å; E381-R448 IonicContact OE1-CZ 3.86Å; E381-R448 VanDerWaalsContact OE1-CZ 3.26Å; E381-R448 IonicContact OE1-NE 3.04Å; E381-R448 PolarHBondContact OE1-NE 3.43Å; E381-R448 IonicContact OE1-NH2 3.77Å; E381-R448 PolarHBondContact OE1-NH2 3.42Å; E381-R448 PolarHBondContact OE2-N 2.82Å; E381-R448 IonicContact OE2-NE 2.71Å; F384-R448 HydrophobicContact CB-CG 4.39Å; F384-R448 HydrophobicContact CD1-CG 4.1Å; F384-R448 HydrophobicContact CD2-CG 3.34Å; F384-R448 HydrophobicContact CE1-CG 4.19Å; F384-R448 HydrophobicContact CE2-CG 3.47Å; F384-R448 VanDerWaalsContact CE2-CG 3.47Å; F384-R448 HydrophobicContact CG-CG 3.68Å; F384-R448 HydrophobicContact CZ-CG 3.89Å; T425-R448 PolarHBondContact O-NH1 3Å; T425-R448 PolarHBondContact O-NH2 3.27Å; R448-L450 PolarHBondContact O-N 3.32Å; R448-D467 HydrophobicContact CB-CB 4.01Å; R448-D467 HydrophobicContact CG-CB 4.27Å; R448-D467 PolarHBondContact O-N 3.35Å; R448-V470 HydrophobicContact CB-CB 4.42Å; R448-V470 HydrophobicContact CB-CG1 3.9Å; R448-V470 HydrophobicContact CB-CG2 3.86Å; R448-V470 HydrophobicContact CG-CG1 4.46Å
449	C	94	Very high	80.6	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	14.5	178	-70	0	0	0	0	114.1	C415 Y443 S444 G447 L465 V470 V471 F472	C415-C449 VanDerWaalsContact CA-SG 3.51Å; C415-C449 HydrophobicContact CB-CB 3.73Å; C415-C449 WeakPolarHBondContact CB-SG 3.32Å; C415-C449 WeakPolarHBondContact SG-CB 3.43Å; C415-C449 PolarHBondContact SG-N 2.97Å; C415-C449 VanDerWaalsContact SG-N 3.44Å; C415-C449 CovalentContact SG-SG 2.03Å; C415-C449 PolarHBondContact SG-SG 3.38Å; Y443-C449 WeakPolarHBondContact CA-O 3.15Å; Y443-C449 WeakPolarHBondContact CB-O 3.27Å; S444-C449 PolarHBondContact N-O 3.41Å; S444-C449 WeakPolarHBondContact OG-CB 3.45Å; S444-C449 PolarHBondContact OG-O 2.88Å; S444-C449 VanDerWaalsContact OG-O 3.09Å; G447-C449 VanDerWaalsContact C-N 3.31Å; G447-C449 PolarHBondContact O-N 3.41Å; C449-L465 HydrophobicContact CB-CD1 4.3Å; C449-L465 WeakPolarHBondContact O-CD2 3.32Å; C449-V470 VanDerWaalsContact SG-CG2 3.57Å; C449-V471 PolarHBondContact SG-O 3.19Å; C449-F472 HydrophobicContact CB-CB 4.19Å; C449-F472 HydrophobicContact CB-CD2 3.79Å; C449-F472 HydrophobicContact CB-CG 4.31Å
450	L	92.5	Very high	80.5	Confident	28 Å²	28	55.9 Å²	55.9	15%	0.147	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-67	146.1	169.5	-179.8	60	0	0	0	109.8	F389 S444 L445 G447 R448 L465 L466	F389-L450 HydrophobicContact CE1-CD2 3.94Å; F389-L450 HydrophobicContact CZ-CD2 3.7Å; S444-L450 WeakPolarHBondContact O-CD1 3.3Å; S444-L450 PolarHBondContact OG-N 3.49Å; L445-L450 WeakPolarHBondContact O-CD1 3.39Å; G447-L450 WeakPolarHBondContact O-CB 3.42Å; G447-L450 PolarHBondContact O-N 3.04Å; G447-L450 VanDerWaalsContact O-N 3.14Å; R448-L450 PolarHBondContact O-N 3.32Å; L450-L465 CarbonylContact O-C 3.28Å; L450-L465 WeakPolarHBondContact O-CA 3.19Å; L450-L466 HydrophobicContact CB-CB 4.34Å; L450-L466 HydrophobicContact CB-CD2 4.29Å; L450-L466 HydrophobicContact CD2-CD2 4.19Å; L450-L466 VanDerWaalsContact O-CB 3.25Å; L450-L466 WeakPolarHBondContact O-CB 3.19Å; L450-L466 PolarHBondContact O-N 3.46Å
451	R	90.3	Very high	79.9	Confident	31 Å²	31	59.7 Å²	59.7	12%	0.117	32%	0.32	C	S	.	.	B	Isolated β-bridge	trans	-66.2	132.8	173.2	-178.5	171.9	-175.5	-142	-5.1	111.6	Y443 D453 K456 P457 I458 V463	Y443-R451 HydrophobicContact CD1-CB 4.22Å; Y443-R451 HydrophobicContact CD2-CB 3.78Å; Y443-R451 HydrophobicContact CE2-CB 4.15Å; Y443-R451 HydrophobicContact CG-CB 3.82Å; R451-D453 PolarHBondContact NH2-O 3.38Å; R451-K456 PolarHBondContact NH1-O 2.92Å; R451-K456 PolarHBondContact NH2-O 3.16Å; R451-P457 PolarHBondContact NH2-O 3.16Å; R451-I458 VanDerWaalsContact CZ-CG1 3.46Å; R451-V463 HydrophobicContact CB-CG1 4.12Å; R451-V463 HydrophobicContact CG-CG1 3.68Å
452	K	85.7	Confident	79.4	Confident	107 Å²	107	64.7 Å²	64.7	47%	0.465	34%	0.344	S	S	.	.	S	Bend	trans	-69.8	-56.7	-178.1	-177.8	-179.9	165.8	-160.3	0	113.3	F454 E464	K452-F454 PolarHBondContact O-N 2.92Å; K452-E464 HydrophobicContact CB-CB 4.41Å; K452-E464 WeakPolarHBondContact CB-O 3.44Å; K452-E464 PolarHBondContact N-O 2.93Å; K452-E464 IonicContact NZ-OE2 3.36Å; K452-E464 PolarHBondContact NZ-OE2 3.26Å
453	D	82.6	Confident	79.2	Confident	59 Å²	59	63.2 Å²	63.2	32%	0.316	34%	0.338	S	S	.	.			trans	-96.5	69.4	-178.8	-78	-12.6	0	0	0	110.5	R451 D455 K456	R451-D453 PolarHBondContact NH2-O 3.38Å; D453-D455 VanDerWaalsContact C-N 3.25Å; D453-D455 PolarHBondContact O-N 3.31Å; D453-K456 HydrophobicContact CB-CB 4.36Å; D453-K456 HydrophobicContact CB-CD 3.98Å; D453-K456 HydrophobicContact CB-CG 4.26Å; D453-K456 PolarHBondContact O-N 3.28Å; D453-K456 WeakPolarHBondContact OD2-CE 3.41Å; D453-K456 IonicContact OD2-NZ 3.3Å; D453-K456 PolarHBondContact OD2-NZ 3.47Å
454	F	76.2	Confident	79.1	Confident	90 Å²	90	68 Å²	68	40%	0.395	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-33.4	-175.1	-162.9	-90.3	0	0	0	113.4	Y432 Y443 K452 K456	Y432-F454 AromaticContact CD2-CE2 3.97Å; Y432-F454 HydrophobicContact CD2-CE2 3.97Å; Y432-F454 HydrophobicContact CD2-CZ 4.11Å; Y432-F454 HydrophobicContact CE1-CZ 4.23Å; Y432-F454 AromaticContact CE2-CE2 3.78Å; Y432-F454 HydrophobicContact CE2-CE2 3.78Å; Y432-F454 AromaticContact CE2-CZ 3.43Å; Y432-F454 HydrophobicContact CE2-CZ 3.43Å; Y432-F454 VanDerWaalsContact CE2-CZ 3.43Å; Y432-F454 HydrophobicContact CG-CE2 4.5Å; Y432-F454 AromaticContact CZ-CZ 3.5Å; Y432-F454 VanDerWaalsContact CZ-CZ 3.5Å; Y443-F454 HydrophobicContact CE2-CE2 4.47Å; K452-F454 PolarHBondContact O-N 2.92Å; F454-K456 VanDerWaalsContact C-N 3.33Å; F454-K456 PolarHBondContact O-N 3.37Å
455	D	73.8	Confident	79	Confident	163 Å²	163	69 Å²	69	87%	0.872	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-12.2	-176.9	-60.8	-39.2	0	0	0	114.5	D453	D453-D455 VanDerWaalsContact C-N 3.25Å; D453-D455 PolarHBondContact O-N 3.31Å
456	K	71.8	Confident	79	Confident	123 Å²	123	68.5 Å²	68.5	54%	0.535	36%	0.364	S	S	.	.	S	Bend	trans	-92.8	146.3	-178.4	-65.1	-178.3	-170	160.7	0	110.6	R451 D453 F454	R451-K456 PolarHBondContact NH1-O 2.92Å; R451-K456 PolarHBondContact NH2-O 3.16Å; D453-K456 HydrophobicContact CB-CB 4.36Å; D453-K456 HydrophobicContact CB-CD 3.98Å; D453-K456 HydrophobicContact CB-CG 4.26Å; D453-K456 PolarHBondContact O-N 3.28Å; D453-K456 WeakPolarHBondContact OD2-CE 3.41Å; D453-K456 IonicContact OD2-NZ 3.3Å; D453-K456 PolarHBondContact OD2-NZ 3.47Å; F454-K456 VanDerWaalsContact C-N 3.33Å; F454-K456 PolarHBondContact O-N 3.37Å
457	P	66.7	Low	79	Confident	110 Å²	110	69.8 Å²	69.8	71%	0.714	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-60.5	147	168.1	25.5	-32	0	0	0	110.4	R451 V459	R451-P457 PolarHBondContact NH2-O 3.16Å; P457-V459 PolarHBondContact O-N 2.99Å
458	I	64.3	Low	78.8	Confident	74 Å²	74	75.1 Å²	75.1	38%	0.379	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-70.3	127.7	172.1	-59.4	171.7	0	0	0	107.3	Y443 R451 V463	Y443-I458 HydrophobicContact CE1-CD1 4.01Å; R451-I458 VanDerWaalsContact CZ-CG1 3.46Å; I458-V463 HydrophobicContact CG2-CG2 4.28Å
459	V	56.1	Low	78.6	Confident	129 Å²	129	78.5 Å²	78.5	78%	0.782	43%	0.425	S	S	*	.			trans	-122.4	107.7	177.2	-176.9	0	0	0	0	107.9	P457	P457-V459 PolarHBondContact O-N 2.99Å
460	G	56.6	Low	78.6	Confident	55 Å²	55	78.8 Å²	78.8	57%	0.567	43%	0.426	S	S	*	.	S	Bend	trans	85.8	-164.6	-177.7	0	0	0	0	0	113.9
461	E	60.5	Low	78.5	Confident	91 Å²	91	78.5 Å²	78.5	43%	0.425	43%	0.426	S	S	.	.	S	Bend	trans	-88.7	-18.8	-172.3	-151.5	167.1	-149.1	0	0	113	R315 Q442	R315-E461 IonicContact CZ-OE1 2.75Å; R315-E461 VanDerWaalsContact CZ-OE1 3.3Å; R315-E461 IonicContact NE-OE1 2.82Å; R315-E461 PolarHBondContact NE-OE1 3.04Å; R315-E461 IonicContact NH2-OE1 3.26Å; R315-E461 PolarHBondContact NH2-OE1 3.5Å; Q442-E461 PolarHBondContact NE2-O 2.93Å
462	D	65.9	Low	78.6	Confident	150 Å²	150	77.6 Å²	77.6	80%	0.802	42%	0.423	S	S	*	.			trans	-94.9	113.3	-173.4	-64.5	-44	0	0	0	111.8
463	V	77.6	Confident	78.9	Confident	25 Å²	25	72.5 Å²	72.5	15%	0.152	40%	0.401	C	S	.	.			trans	-94.1	118.7	170	179.1	0	0	0	0	108.9	Q442 Y443 R451 I458 L465	Q442-V463 HydrophobicContact CB-CB 4.41Å; Q442-V463 HydrophobicContact CB-CG2 3.87Å; Q442-V463 HydrophobicContact CG-CG2 4.46Å; Y443-V463 HydrophobicContact CD1-CB 4.49Å; Y443-V463 HydrophobicContact CD1-CG1 3.8Å; Y443-V463 HydrophobicContact CD1-CG2 4.24Å; Y443-V463 HydrophobicContact CG-CG1 4.38Å; R451-V463 HydrophobicContact CB-CG1 4.12Å; R451-V463 HydrophobicContact CG-CG1 3.68Å; I458-V463 HydrophobicContact CG2-CG2 4.28Å; V463-L465 HydrophobicContact CG1-CD2 4.28Å; V463-L465 PolarHBondContact O-N 2.88Å
464	E	84.7	Confident	79.2	Confident	119 Å²	119	71.3 Å²	71.3	56%	0.556	39%	0.392	S	S	*	.			trans	-67.8	115.6	168.2	-71.6	-169.4	-164.3	0	0	110.2	K452	K452-E464 HydrophobicContact CB-CB 4.41Å; K452-E464 WeakPolarHBondContact CB-O 3.44Å; K452-E464 PolarHBondContact N-O 2.93Å; K452-E464 IonicContact NZ-OE2 3.36Å; K452-E464 PolarHBondContact NZ-OE2 3.26Å
465	L	89.9	Confident	79.8	Confident	23 Å²	23	67.9 Å²	67.9	12%	0.12	38%	0.382	C	S	.	.	B	Isolated β-bridge	trans	-81.2	157.8	173.2	-56.2	-177.9	0	0	0	111	C449 L450 V463 V470 F472	C449-L465 HydrophobicContact CB-CD1 4.3Å; C449-L465 WeakPolarHBondContact O-CD2 3.32Å; L450-L465 CarbonylContact O-C 3.28Å; L450-L465 WeakPolarHBondContact O-CA 3.19Å; V463-L465 HydrophobicContact CG1-CD2 4.28Å; V463-L465 PolarHBondContact O-N 2.88Å; L465-V470 HydrophobicContact CD1-CG2 4.16Å; L465-F472 HydrophobicContact CD1-CB 4.41Å
466	L	90.7	Very high	80.6	Confident	48 Å²	48	61 Å²	61	25%	0.251	34%	0.344	S	S	.	.	S	Bend	trans	-64.6	-40.5	-176.9	-176.1	59.7	0	0	0	111.5	F384 M385 F389 L450	F384-L466 HydrophobicContact CE1-CD2 3.82Å; F384-L466 HydrophobicContact CE1-CG 4.3Å; F384-L466 HydrophobicContact CZ-CD2 4.47Å; F384-L466 HydrophobicContact CZ-CG 4.48Å; M385-L466 HydrophobicContact CE-CD1 3.93Å; M385-L466 HydrophobicContact CE-CD2 3.79Å; M385-L466 HydrophobicContact CE-CG 3.82Å; M385-L466 HydrophobicContact SD-CD2 4.18Å; F389-L466 HydrophobicContact CE2-CD2 4.4Å; F389-L466 HydrophobicContact CZ-CD2 4.35Å; L450-L466 HydrophobicContact CB-CB 4.34Å; L450-L466 HydrophobicContact CB-CD2 4.29Å; L450-L466 HydrophobicContact CD2-CD2 4.19Å; L450-L466 VanDerWaalsContact O-CB 3.25Å; L450-L466 WeakPolarHBondContact O-CB 3.19Å; L450-L466 PolarHBondContact O-N 3.46Å
467	D	91.5	Very high	81.6	Confident	31 Å²	31	55.2 Å²	55.2	17%	0.166	32%	0.319	C	S	.	.	S	Bend	trans	-99.5	118.8	163.5	-176.6	-11.3	0	0	0	109.5	F384 R448 N469 V470	F384-D467 HydrophobicContact CZ-CB 4.38Å; R448-D467 HydrophobicContact CB-CB 4.01Å; R448-D467 HydrophobicContact CG-CB 4.27Å; R448-D467 PolarHBondContact O-N 3.35Å; D467-N469 PolarHBondContact O-N 3.01Å; D467-N469 PolarHBondContact OD1-N 3.45Å; D467-N469 PolarHBondContact OD1-ND2 3.06Å; D467-N469 VanDerWaalsContact OD1-ND2 3.11Å; D467-V470 HydrophobicContact CB-CG1 4.32Å; D467-V470 HydrophobicContact CB-CG2 3.98Å; D467-V470 VanDerWaalsContact O-CG2 3.29Å; D467-V470 WeakPolarHBondContact O-CG2 3.48Å
468	P	88.9	Confident	82.8	Confident	112 Å²	112	52.6 Å²	52.6	73%	0.727	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-9.8	-177.7	31	-36.4	0	0	0	114.1
469	N	91	Very high	84.2	Confident	80 Å²	80	50.2 Å²	50.2	43%	0.428	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-12.8	-179	-55.2	-65.5	0	0	0	113	E417 L418 D467	E417-N469 HydrophobicContact CG-CB 4.17Å; E417-N469 WeakPolarHBondContact CG-O 3.42Å; L418-N469 PolarHBondContact N-O 2.95Å; D467-N469 PolarHBondContact O-N 3.01Å; D467-N469 PolarHBondContact OD1-N 3.45Å; D467-N469 PolarHBondContact OD1-ND2 3.06Å; D467-N469 VanDerWaalsContact OD1-ND2 3.11Å
470	V	92.6	Very high	85.9	Confident	6 Å²	6	49 Å²	49	4%	0.036	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	163	-179.9	-57.2	0	0	0	0	112	Y416 R448 C449 L465 D467	Y416-V470 CarbonylContact O-C 3.56Å; Y416-V470 VanDerWaalsContact O-CA 3.24Å; Y416-V470 WeakPolarHBondContact O-CA 3.19Å; Y416-V470 WeakPolarHBondContact O-CB 3.38Å; R448-V470 HydrophobicContact CB-CB 4.42Å; R448-V470 HydrophobicContact CB-CG1 3.9Å; R448-V470 HydrophobicContact CB-CG2 3.86Å; R448-V470 HydrophobicContact CG-CG1 4.46Å; C449-V470 VanDerWaalsContact SG-CG2 3.57Å; L465-V470 HydrophobicContact CD1-CG2 4.16Å; D467-V470 HydrophobicContact CB-CG1 4.32Å; D467-V470 HydrophobicContact CB-CG2 3.98Å; D467-V470 VanDerWaalsContact O-CG2 3.29Å; D467-V470 WeakPolarHBondContact O-CG2 3.48Å
471	V	91.4	Very high	87.7	Confident	22 Å²	22	50 Å²	50	13%	0.133	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	146.4	179.2	171.9	0	0	0	0	110.2	C415 Y416 L418 C449	C415-V471 WeakPolarHBondContact CA-O 3.44Å; Y416-V471 HydrophobicContact CE1-CG1 4.43Å; Y416-V471 PolarHBondContact N-O 3.08Å; Y416-V471 PolarHBondContact O-N 3.35Å; L418-V471 HydrophobicContact CB-CG2 4.49Å; L418-V471 HydrophobicContact CD1-CB 4.38Å; L418-V471 HydrophobicContact CD1-CG2 3.27Å; L418-V471 HydrophobicContact CD2-CG2 4.33Å; L418-V471 HydrophobicContact CG-CB 4.05Å; L418-V471 HydrophobicContact CG-CG2 3.4Å; L418-V471 VanDerWaalsContact CG-CG2 3.4Å; C449-V471 PolarHBondContact SG-O 3.19Å
472	F	92.2	Very high	89.3	Confident	12 Å²	12	47.3 Å²	47.3	5%	0.053	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	124.8	-178.7	-167.1	-114.7	0	0	0	110.7	R313 F414 C415 V429 I431 C449 L465	R313-F472 PolarHBondContact NH2-O 3.38Å; F414-F472 WeakPolarHBondContact O-CA 3.44Å; C415-F472 HydrophobicContact CB-CD2 4.4Å; V429-F472 HydrophobicContact CG2-CE2 3.84Å; I431-F472 HydrophobicContact CG2-CE1 4.28Å; I431-F472 HydrophobicContact CG2-CZ 3.88Å; C449-F472 HydrophobicContact CB-CB 4.19Å; C449-F472 HydrophobicContact CB-CD2 3.79Å; C449-F472 HydrophobicContact CB-CG 4.31Å; L465-F472 HydrophobicContact CD1-CB 4.41Å
473	D	91.5	Very high	90.7	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	131.7	173	-81.1	-7.3	0	0	0	110.3	R313 G413 F414 Y416 Y476 I478	R313-D473 IonicContact CZ-OD1 2.77Å; R313-D473 IonicContact NH1-OD1 2.81Å; R313-D473 PolarHBondContact NH1-OD1 3.35Å; R313-D473 IonicContact NH1-OD2 2.8Å; R313-D473 IonicContact NH2-OD1 3.27Å; R313-D473 PolarHBondContact NH2-OD1 3.41Å; G413-D473 CarbonylContact C-O 3.51Å; G413-D473 WeakPolarHBondContact CA-O 3.37Å; F414-D473 PolarHBondContact N-O 2.94Å; F414-D473 PolarHBondContact O-N 2.9Å; Y416-D473 HydrophobicContact CE1-CB 4.42Å; Y416-D473 WeakPolarHBondContact CE1-OD2 3.35Å; D473-Y476 HydrophobicContact CB-CD2 4.33Å; D473-Y476 HydrophobicContact CB-CE2 3.93Å; D473-Y476 VanDerWaalsContact CG-CE2 3.41Å; D473-Y476 VanDerWaalsContact OD1-CE2 3.28Å; D473-Y476 WeakPolarHBondContact OD1-CE2 3.18Å; D473-Y476 PolarHBondContact OD1-OH 3.1Å; D473-I478 PolarHBondContact OD2-N 3.39Å
474	Y	89.2	Confident	91.6	Very high	33 Å²	33	46.7 Å²	46.7	13%	0.129	25%	0.248	C	C	.	.			trans	-125.2	119.7	-178	177.9	-104.7	0	0	0	111	A410 C412 I431 S441 Y476	A410-Y474 VanDerWaalsContact O-CE2 3.24Å; A410-Y474 WeakPolarHBondContact O-CE2 3.49Å; A410-Y474 PolarHBondContact O-OH 3.03Å; C412-Y474 WeakPolarHBondContact O-CD2 3.24Å; C412-Y474 WeakPolarHBondContact O-CE2 3.42Å; I431-Y474 HydrophobicContact CD1-CE2 3.97Å; I431-Y474 HydrophobicContact CG2-CD2 3.77Å; I431-Y474 HydrophobicContact CG2-CE2 3.78Å; S441-Y474 VanDerWaalsContact CB-CD1 3.45Å; S441-Y474 WeakPolarHBondContact O-CB 3.1Å; Y474-Y476 WeakPolarHBondContact O-CD1 3.48Å; Y474-Y476 VanDerWaalsContact O-CE1 3.3Å; Y474-Y476 WeakPolarHBondContact O-CE1 3.29Å; Y474-Y476 PolarHBondContact O-N 2.92Å
475	G	88.2	Confident	92.1	Very high	19 Å²	19	41.1 Å²	41.1	20%	0.196	22%	0.222	C	C	.	.	S	Bend	trans	74.3	0.4	178.6	0	0	0	0	0	115.7	L309 R548	L309-G475 VanDerWaalsContact CD2-O 3.23Å; L309-G475 WeakPolarHBondContact CD2-O 3.47Å; G475-R548 PolarHBondContact O-NH2 2.77Å
476	Y	91.8	Very high	92.4	Very high	18 Å²	18	41.3 Å²	41.3	7%	0.071	22%	0.223	C	C	.	.	S	Bend	trans	-147.9	175.3	174.6	60.8	-94.7	0	0	0	110.1	Q308 R313 D473 Y474	Q308-Y476 HydrophobicContact CG-CD1 3.47Å; Q308-Y476 VanDerWaalsContact CG-CD1 3.47Å; Q308-Y476 HydrophobicContact CG-CE1 3.81Å; Q308-Y476 HydrophobicContact CG-CG 4.28Å; Q308-Y476 WeakPolarHBondContact O-CB 3.28Å; R313-Y476 HydrophobicContact CB-CE2 4.35Å; R313-Y476 HydrophobicContact CG-CE2 3.86Å; D473-Y476 HydrophobicContact CB-CD2 4.33Å; D473-Y476 HydrophobicContact CB-CE2 3.93Å; D473-Y476 VanDerWaalsContact CG-CE2 3.41Å; D473-Y476 VanDerWaalsContact OD1-CE2 3.28Å; D473-Y476 WeakPolarHBondContact OD1-CE2 3.18Å; D473-Y476 PolarHBondContact OD1-OH 3.1Å; Y474-Y476 WeakPolarHBondContact O-CD1 3.48Å; Y474-Y476 VanDerWaalsContact O-CE1 3.3Å; Y474-Y476 WeakPolarHBondContact O-CE1 3.29Å; Y474-Y476 PolarHBondContact O-N 2.92Å
477	C	92.8	Very high	92.8	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.007	23%	0.23	C	C	.	.			trans	-129	146.4	179.3	-69.9	0	0	0	0	111.3	G311 C403 D404 T479	G311-C477 WeakPolarHBondContact CA-O 3.49Å; C403-C477 HydrophobicContact CB-CB 4.1Å; C403-C477 WeakPolarHBondContact CB-SG 3.38Å; C403-C477 PolarHBondContact O-SG 2.91Å; C403-C477 WeakPolarHBondContact SG-CA 3.38Å; C403-C477 WeakPolarHBondContact SG-CB 3.39Å; C403-C477 CovalentContact SG-SG 2.04Å; C403-C477 PolarHBondContact SG-SG 2.94Å; D404-C477 PolarHBondContact N-SG 3.32Å; C477-T479 PolarHBondContact O-N 3.41Å
478	I	91.5	Very high	93	Very high	56 Å²	56	41.1 Å²	41.1	29%	0.287	22%	0.222	S	C	.	.			trans	-52.2	130	164.6	-174.5	167.3	0	0	0	110.5	P375 Y416 P422 D473	P375-I478 HydrophobicContact CG-CG2 3.73Å; Y416-I478 HydrophobicContact CE1-CB 4.49Å; Y416-I478 HydrophobicContact CE1-CG2 4.32Å; Y416-I478 HydrophobicContact CE2-CB 4.38Å; Y416-I478 HydrophobicContact CE2-CD1 3.71Å; Y416-I478 HydrophobicContact CE2-CG2 4.12Å; Y416-I478 WeakPolarHBondContact OH-CD1 3.05Å; P422-I478 HydrophobicContact CB-CG2 4.35Å; D473-I478 PolarHBondContact OD2-N 3.39Å
479	T	92.9	Very high	93.4	Very high	24 Å²	24	35.8 Å²	35.8	15%	0.147	19%	0.187	C	C	.	.			trans	-160	146.2	-178.9	-173.3	0	0	0	0	111.9	G310 I370 C477 Y481	G310-T479 WeakPolarHBondContact O-CG2 3.32Å; I370-T479 HydrophobicContact CD1-CG2 4.18Å; I370-T479 HydrophobicContact CG1-CG2 3.96Å; I370-T479 HydrophobicContact CG2-CG2 4.15Å; C477-T479 PolarHBondContact O-N 3.41Å; T479-Y481 VanDerWaalsContact C-N 3.31Å; T479-Y481 PolarHBondContact OG1-N 2.81Å; T479-Y481 VanDerWaalsContact OG1-N 3.16Å
480	S	91.4	Very high	93.7	Very high	104 Å²	104	32.9 Å²	32.9	73%	0.727	17%	0.172	S	C	*	.	S	Bend	trans	-85.4	-4.2	171.2	-55.5	0	0	0	0	113
481	Y	94.9	Very high	94	Very high	75 Å²	75	36 Å²	36	29%	0.294	19%	0.188	S	C	.	.			trans	-99.8	9.3	-174.6	-59.6	-71.8	0	0	0	114	L369 N373 T479 W483 I484 P485	L369-Y481 HydrophobicContact CB-CD2 4.46Å; L369-Y481 HydrophobicContact CB-CG 4.33Å; N373-Y481 HydrophobicContact CB-CD2 4.28Å; N373-Y481 HydrophobicContact CB-CE2 3.74Å; N373-Y481 PolarHBondContact ND2-OH 3.1Å; T479-Y481 VanDerWaalsContact C-N 3.31Å; T479-Y481 PolarHBondContact OG1-N 2.81Å; T479-Y481 VanDerWaalsContact OG1-N 3.16Å; Y481-W483 PolarHBondContact O-N 2.87Å; Y481-W483 VanDerWaalsContact O-N 3.09Å; Y481-I484 HydrophobicContact CD1-CD1 3.85Å; Y481-I484 HydrophobicContact CG-CD1 4.47Å; Y481-I484 PolarHBondContact O-N 3.26Å; Y481-P485 WeakPolarHBondContact O-CD 3.09Å
482	S	93.7	Very high	94.3	Very high	34 Å²	34	35 Å²	35	24%	0.238	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-28.8	-177.6	58.8	0	0	0	0	114	G310 I484 P485 I486	G310-S482 WeakPolarHBondContact O-CA 3.26Å; G310-S482 WeakPolarHBondContact O-CB 3.22Å; S482-I484 VanDerWaalsContact C-N 3.29Å; S482-I484 PolarHBondContact O-N 3.39Å; S482-P485 WeakPolarHBondContact O-CD 3.25Å; S482-I486 WeakPolarHBondContact O-CD1 3.23Å; S482-I486 VanDerWaalsContact O-CG1 3.3Å; S482-I486 WeakPolarHBondContact O-CG1 3.47Å
483	W	95.5	Very high	94.6	Very high	149 Å²	149	34.5 Å²	34.5	56%	0.564	18%	0.18	S	C	*	.	H	α-helix	trans	-67.6	-24.7	176.7	68.7	-91	0	0	0	113.6	Y481 L487	Y481-W483 PolarHBondContact O-N 2.87Å; Y481-W483 VanDerWaalsContact O-N 3.09Å; W483-L487 HydrophobicContact CE3-CD2 4.29Å; W483-L487 HydrophobicContact CZ3-CD2 3.9Å; W483-L487 VanDerWaalsContact O-CB 3.29Å; W483-L487 WeakPolarHBondContact O-CB 3.28Å; W483-L487 PolarHBondContact O-N 3.21Å
484	I	97.2	Very high	94.8	Very high	13 Å²	13	35.1 Å²	35.1	7%	0.067	18%	0.184	C	C	.	.	H	α-helix	trans	-70.1	-52.7	-177	-56.6	176.9	0	0	0	111	L362 G366 L369 Y481 S482 I486 L487 G488	L362-I484 HydrophobicContact CD1-CG2 3.91Å; L362-I484 HydrophobicContact CG-CG2 4.42Å; G366-I484 VanDerWaalsContact CA-CG2 3.43Å; L369-I484 HydrophobicContact CD1-CD1 3.75Å; Y481-I484 HydrophobicContact CD1-CD1 3.85Å; Y481-I484 HydrophobicContact CG-CD1 4.47Å; Y481-I484 PolarHBondContact O-N 3.26Å; S482-I484 VanDerWaalsContact C-N 3.29Å; S482-I484 PolarHBondContact O-N 3.39Å; I484-I486 VanDerWaalsContact C-N 3.29Å; I484-I486 PolarHBondContact O-N 2.94Å; I484-L487 PolarHBondContact O-N 2.91Å; I484-G488 PolarHBondContact O-N 3.38Å
485	P	96	Very high	95.2	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.013	19%	0.189	C	C	.	.	H	α-helix	trans	-58.3	-38.8	173.3	-25.6	34.3	0	0	0	113.3	L363 F367 I370 Y481 S482 G488 M489	L363-P485 HydrophobicContact CD2-CB 4.19Å; L363-P485 VanDerWaalsContact CD2-O 3.28Å; L363-P485 WeakPolarHBondContact CD2-O 3.26Å; F367-P485 HydrophobicContact CD2-CB 4.42Å; F367-P485 HydrophobicContact CD2-CG 4.35Å; F367-P485 HydrophobicContact CE1-CG 4.33Å; F367-P485 HydrophobicContact CE2-CB 3.84Å; F367-P485 HydrophobicContact CE2-CG 4.16Å; F367-P485 HydrophobicContact CZ-CB 3.93Å; F367-P485 HydrophobicContact CZ-CG 4.16Å; I370-P485 HydrophobicContact CD1-CG 3.58Å; Y481-P485 WeakPolarHBondContact O-CD 3.09Å; S482-P485 WeakPolarHBondContact O-CD 3.25Å; P485-G488 PolarHBondContact O-N 3.01Å; P485-M489 VanDerWaalsContact O-CB 3.22Å; P485-M489 WeakPolarHBondContact O-CB 3.39Å; P485-M489 PolarHBondContact O-N 3.33Å
486	I	96.3	Very high	95.6	Very high	27 Å²	27	34.9 Å²	34.9	14%	0.138	18%	0.183	C	C	.	.	H	α-helix	trans	-63.5	-44.6	178.4	-62.5	168.9	0	0	0	110.8	V307 V312 M321 T325 S482 I484 M489 T490	V307-I486 HydrophobicContact CG1-CD1 4.12Å; V307-I486 HydrophobicContact CG1-CG1 4.26Å; V307-I486 HydrophobicContact CG2-CG1 4.29Å; V312-I486 HydrophobicContact CG2-CD1 4.17Å; M321-I486 HydrophobicContact CG-CD1 4.44Å; T325-I486 HydrophobicContact CG2-CG2 4.28Å; S482-I486 WeakPolarHBondContact O-CD1 3.23Å; S482-I486 VanDerWaalsContact O-CG1 3.3Å; S482-I486 WeakPolarHBondContact O-CG1 3.47Å; I484-I486 VanDerWaalsContact C-N 3.29Å; I484-I486 PolarHBondContact O-N 2.94Å; I486-M489 PolarHBondContact O-N 3.24Å; I486-T490 WeakPolarHBondContact O-CB 3.45Å; I486-T490 PolarHBondContact O-N 3.4Å; I486-T490 PolarHBondContact O-OG1 3.26Å
487	L	97.3	Very high	95.7	Very high	75 Å²	75	34.2 Å²	34.2	39%	0.393	18%	0.18	S	C	.	.	H	α-helix	trans	-63.8	-46.6	175.2	177.7	62.5	0	0	0	111.5	L362 W483 I484 M489 T490 L491	L362-L487 HydrophobicContact CD2-CD2 4.46Å; L362-L487 HydrophobicContact CD2-CG 4.35Å; W483-L487 HydrophobicContact CE3-CD2 4.29Å; W483-L487 HydrophobicContact CZ3-CD2 3.9Å; W483-L487 VanDerWaalsContact O-CB 3.29Å; W483-L487 WeakPolarHBondContact O-CB 3.28Å; W483-L487 PolarHBondContact O-N 3.21Å; I484-L487 PolarHBondContact O-N 2.91Å; L487-M489 VanDerWaalsContact C-N 3.33Å; L487-M489 PolarHBondContact O-N 3.19Å; L487-T490 PolarHBondContact O-N 3.27Å; L487-L491 HydrophobicContact CD1-CD1 4.2Å; L487-L491 HydrophobicContact CD1-CG 4.23Å; L487-L491 HydrophobicContact CG-CD1 4.17Å; L487-L491 WeakPolarHBondContact O-CG 3.22Å; L487-L491 PolarHBondContact O-N 2.85Å
488	G	97.7	Very high	95.7	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-59.7	-42.9	177.3	0	0	0	0	0	112.4	I484 P485 Y492	I484-G488 PolarHBondContact O-N 3.38Å; P485-G488 PolarHBondContact O-N 3.01Å; G488-Y492 WeakPolarHBondContact O-CB 3.41Å; G488-Y492 PolarHBondContact O-N 2.92Å
489	M	96.7	Very high	95.8	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-62.9	-44.9	174.3	-177.9	172.2	-179.6	0	0	111.9	V299 S303 I306 L363 P485 I486 L487 Y492 L493	V299-M489 HydrophobicContact CG1-CE 3.48Å; V299-M489 VanDerWaalsContact CG1-CE 3.48Å; V299-M489 HydrophobicContact CG1-CG 4.02Å; V299-M489 HydrophobicContact CG1-SD 4.24Å; V299-M489 WeakPolarHBondContact O-CE 3.4Å; S303-M489 WeakPolarHBondContact OG-CE 3.4Å; I306-M489 HydrophobicContact CG2-SD 4.31Å; L363-M489 HydrophobicContact CD2-CB 4.2Å; P485-M489 VanDerWaalsContact O-CB 3.22Å; P485-M489 WeakPolarHBondContact O-CB 3.39Å; P485-M489 PolarHBondContact O-N 3.33Å; I486-M489 PolarHBondContact O-N 3.24Å; L487-M489 VanDerWaalsContact C-N 3.33Å; L487-M489 PolarHBondContact O-N 3.19Å; M489-Y492 WeakPolarHBondContact O-CB 3.06Å; M489-Y492 PolarHBondContact O-N 3.2Å; M489-L493 HydrophobicContact CE-CD1 3.92Å; M489-L493 HydrophobicContact CG-CD1 4.43Å; M489-L493 WeakPolarHBondContact O-CG 3.34Å; M489-L493 PolarHBondContact O-N 3.44Å
490	T	97.7	Very high	95.9	Very high	18 Å²	18	31.6 Å²	31.6	11%	0.11	17%	0.167	C	C	.	.	H	α-helix	trans	-61.1	-48	178.6	-58.2	0	0	0	0	111.3	T325 F328 I486 L487 Y492 L493 C494	T325-T490 VanDerWaalsContact CG2-OG1 3.26Å; T325-T490 WeakPolarHBondContact CG2-OG1 3.34Å; F328-T490 HydrophobicContact CB-CG2 3.64Å; F328-T490 HydrophobicContact CD1-CG2 4.17Å; F328-T490 HydrophobicContact CD2-CG2 3.74Å; F328-T490 HydrophobicContact CE2-CG2 4.44Å; F328-T490 HydrophobicContact CG-CG2 3.58Å; I486-T490 WeakPolarHBondContact O-CB 3.45Å; I486-T490 PolarHBondContact O-N 3.4Å; I486-T490 PolarHBondContact O-OG1 3.26Å; L487-T490 PolarHBondContact O-N 3.27Å; T490-Y492 VanDerWaalsContact C-N 3.34Å; T490-Y492 PolarHBondContact O-N 3.01Å; T490-L493 PolarHBondContact O-N 3.43Å; T490-C494 WeakPolarHBondContact O-CB 3.42Å; T490-C494 PolarHBondContact O-N 3.47Å
491	L	98	Very high	95.9	Very high	72 Å²	72	26.7 Å²	26.7	38%	0.377	13%	0.133	S	C	.	.	H	α-helix	trans	-63.4	-40.9	176.7	-70.2	175.3	0	0	0	111.6	S359 L362 L487 C494 C495	S359-L491 WeakPolarHBondContact OG-CB 3.46Å; L362-L491 HydrophobicContact CD2-CD1 3.92Å; L487-L491 HydrophobicContact CD1-CD1 4.2Å; L487-L491 HydrophobicContact CD1-CG 4.23Å; L487-L491 HydrophobicContact CG-CD1 4.17Å; L487-L491 WeakPolarHBondContact O-CG 3.22Å; L487-L491 PolarHBondContact O-N 2.85Å; L491-C494 PolarHBondContact O-N 3.08Å; L491-C495 WeakPolarHBondContact O-CB 3.41Å; L491-C495 PolarHBondContact O-N 2.97Å; L491-C495 PolarHBondContact O-SG 3.03Å; L491-C495 VanDerWaalsContact O-SG 3.38Å
492	Y	98.3	Very high	95.6	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-57.3	-51.8	176.2	171.7	-101	0	0	0	111.4	S294 G295 I296 V299 V356 S359 L360 G488 M489 T490 C494 C495 F496	S294-Y492 PolarHBondContact O-OH 2.72Å; G295-Y492 VanDerWaalsContact C-OH 3.28Å; I296-Y492 WeakPolarHBondContact CA-OH 3.44Å; I296-Y492 HydrophobicContact CB-CE1 4.43Å; I296-Y492 WeakPolarHBondContact CB-OH 3.29Å; I296-Y492 HydrophobicContact CD1-CD1 4.24Å; I296-Y492 HydrophobicContact CD1-CE1 3.42Å; I296-Y492 VanDerWaalsContact CD1-CE1 3.42Å; I296-Y492 HydrophobicContact CG1-CE1 4.49Å; I296-Y492 PolarHBondContact N-OH 3.47Å; V299-Y492 HydrophobicContact CB-CD1 4.41Å; V299-Y492 HydrophobicContact CB-CE1 3.87Å; V299-Y492 HydrophobicContact CG1-CD1 3.9Å; V299-Y492 HydrophobicContact CG1-CE1 3.85Å; V299-Y492 HydrophobicContact CG2-CD1 4.45Å; V299-Y492 HydrophobicContact CG2-CE1 3.9Å; V356-Y492 HydrophobicContact CG1-CD2 4.01Å; V356-Y492 HydrophobicContact CG1-CE2 3.65Å; V356-Y492 HydrophobicContact CG2-CD2 4.5Å; S359-Y492 VanDerWaalsContact CB-CA 3.41Å; S359-Y492 PolarHBondContact OG-N 3.34Å; L360-Y492 HydrophobicContact CD1-CE2 4.03Å; L360-Y492 HydrophobicContact CD2-CD2 3.88Å; L360-Y492 HydrophobicContact CD2-CE2 3.66Å; L360-Y492 HydrophobicContact CG-CD2 3.79Å; L360-Y492 HydrophobicContact CG-CE2 3.73Å; G488-Y492 WeakPolarHBondContact O-CB 3.41Å; G488-Y492 PolarHBondContact O-N 2.92Å; M489-Y492 WeakPolarHBondContact O-CB 3.06Å; M489-Y492 PolarHBondContact O-N 3.2Å; T490-Y492 VanDerWaalsContact C-N 3.34Å; T490-Y492 PolarHBondContact O-N 3.01Å; Y492-C494 VanDerWaalsContact C-N 3.33Å; Y492-C494 PolarHBondContact O-N 3.34Å; Y492-C495 PolarHBondContact O-N 3.34Å; Y492-F496 VanDerWaalsContact O-CB 3.24Å; Y492-F496 WeakPolarHBondContact O-CB 3.32Å; Y492-F496 PolarHBondContact O-N 2.87Å
493	L	97.1	Very high	95.5	Very high	3 Å²	3	22 Å²	22	2%	0.016	11%	0.112	C	C	.	.	H	α-helix	trans	-64.5	-36.3	178.5	-67.2	-177.5	0	0	0	112.4	I296 V299 M300 N329 M489 T490 S497	I296-L493 HydrophobicContact CD1-CD2 3.57Å; V299-L493 HydrophobicContact CG1-CD2 4.26Å; M300-L493 HydrophobicContact CG-CD2 4.14Å; N329-L493 HydrophobicContact CB-CB 3.94Å; N329-L493 HydrophobicContact CB-CD1 4.44Å; N329-L493 PolarHBondContact ND2-O 2.87Å; M489-L493 HydrophobicContact CE-CD1 3.92Å; M489-L493 HydrophobicContact CG-CD1 4.43Å; M489-L493 WeakPolarHBondContact O-CG 3.34Å; M489-L493 PolarHBondContact O-N 3.44Å; T490-L493 PolarHBondContact O-N 3.43Å; L493-S497 WeakPolarHBondContact O-CB 3.5Å; L493-S497 PolarHBondContact O-N 2.97Å; L493-S497 PolarHBondContact O-OG 2.78Å
494	C	96.7	Very high	95.4	Very high	14 Å²	14	14.9 Å²	14.9	10%	0.095	9%	0.086	C	C	.	.	H	α-helix	trans	-65.7	-51.4	174.6	-92.2	0	0	0	0	112.4	F328 C332 T490 L491 Y492 F496 S497 V498	F328-C494 PolarHBondContact O-SG 3.44Å; F328-C494 VanDerWaalsContact O-SG 3.38Å; C332-C494 HydrophobicContact CB-CB 3.7Å; C332-C494 WeakPolarHBondContact CB-SG 3.48Å; C332-C494 WeakPolarHBondContact SG-CB 3.22Å; C332-C494 CovalentContact SG-SG 2.06Å; C332-C494 PolarHBondContact SG-SG 3.43Å; T490-C494 WeakPolarHBondContact O-CB 3.42Å; T490-C494 PolarHBondContact O-N 3.47Å; L491-C494 PolarHBondContact O-N 3.08Å; Y492-C494 VanDerWaalsContact C-N 3.33Å; Y492-C494 PolarHBondContact O-N 3.34Å; C494-F496 VanDerWaalsContact C-N 3.28Å; C494-F496 PolarHBondContact O-N 3.46Å; C494-S497 PolarHBondContact O-N 3.06Å; C494-S497 PolarHBondContact O-OG 3.26Å; C494-V498 VanDerWaalsContact O-CG2 3.25Å; C494-V498 WeakPolarHBondContact O-CG2 3.42Å; C494-V498 PolarHBondContact O-N 3.38Å; C494-V498 VanDerWaalsContact O-N 3.16Å
495	C	97	Very high	95	Very high	33 Å²	33	16 Å²	16	22%	0.223	9%	0.089	C	C	.	.	H	α-helix	trans	-62.1	-38.8	178.3	-69.2	0	0	0	0	111.6	S352 V356 L491 Y492	S352-C495 WeakPolarHBondContact CB-O 3.43Å; V356-C495 HydrophobicContact CG2-CB 4.12Å; L491-C495 WeakPolarHBondContact O-CB 3.41Å; L491-C495 PolarHBondContact O-N 2.97Å; L491-C495 PolarHBondContact O-SG 3.03Å; L491-C495 VanDerWaalsContact O-SG 3.38Å; Y492-C495 PolarHBondContact O-N 3.34Å
496	F	97.1	Very high	94.6	Very high	14 Å²	14	16 Å²	16	6%	0.061	9%	0.089	C	C	.	.	I	π-helix	trans	-62.3	-53	176.7	-172.2	-85.3	0	0	0	111.6	Q291 I296 V356 Y492 C494 V498 G499 L500 G501	Q291-F496 HydrophobicContact CG-CE2 3.92Å; Q291-F496 HydrophobicContact CG-CZ 3.67Å; I296-F496 HydrophobicContact CB-CD2 3.92Å; I296-F496 HydrophobicContact CB-CE1 4.28Å; I296-F496 HydrophobicContact CB-CE2 3.57Å; I296-F496 HydrophobicContact CB-CG 4.43Å; I296-F496 HydrophobicContact CB-CZ 3.8Å; I296-F496 HydrophobicContact CD1-CB 4.05Å; I296-F496 HydrophobicContact CD1-CD1 3.71Å; I296-F496 HydrophobicContact CD1-CD2 3.91Å; I296-F496 HydrophobicContact CD1-CE1 4.13Å; I296-F496 HydrophobicContact CD1-CE2 4.33Å; I296-F496 HydrophobicContact CD1-CG 3.6Å; I296-F496 HydrophobicContact CD1-CZ 4.45Å; I296-F496 HydrophobicContact CG1-CD1 3.67Å; I296-F496 HydrophobicContact CG1-CD2 3.83Å; I296-F496 HydrophobicContact CG1-CE1 3.55Å; I296-F496 HydrophobicContact CG1-CE2 3.73Å; I296-F496 HydrophobicContact CG1-CG 3.83Å; I296-F496 HydrophobicContact CG1-CZ 3.6Å; I296-F496 HydrophobicContact CG2-CD2 4.46Å; I296-F496 HydrophobicContact CG2-CE1 4.29Å; I296-F496 HydrophobicContact CG2-CE2 3.63Å; I296-F496 HydrophobicContact CG2-CZ 3.54Å; V356-F496 HydrophobicContact CG2-CB 4.01Å; V356-F496 HydrophobicContact CG2-CD2 4.31Å; Y492-F496 VanDerWaalsContact O-CB 3.24Å; Y492-F496 WeakPolarHBondContact O-CB 3.32Å; Y492-F496 PolarHBondContact O-N 2.87Å; C494-F496 VanDerWaalsContact C-N 3.28Å; C494-F496 PolarHBondContact O-N 3.46Å; F496-V498 VanDerWaalsContact C-N 3.26Å; F496-V498 PolarHBondContact O-N 2.76Å; F496-G499 CarbonylContact O-C 3.07Å; F496-G499 PolarHBondContact O-N 3.27Å; F496-L500 HydrophobicContact CD2-CB 3.95Å; F496-L500 HydrophobicContact CD2-CD2 3.85Å; F496-L500 HydrophobicContact CD2-CG 3.93Å; F496-L500 HydrophobicContact CE2-CB 4.08Å; F496-L500 HydrophobicContact CE2-CD2 3.85Å; F496-L500 HydrophobicContact CE2-CG 3.68Å; F496-L500 HydrophobicContact CG-CB 4.49Å; F496-L500 HydrophobicContact CZ-CG 4.46Å; F496-L500 PolarHBondContact O-N 3.44Å; F496-L500 VanDerWaalsContact O-N 3.1Å; F496-G501 PolarHBondContact O-N 3.22Å
497	S	94.1	Very high	94.4	Very high	4 Å²	4	14.7 Å²	14.7	3%	0.028	8%	0.082	C	C	.	.	I	π-helix	trans	-61.6	-30.2	-178.6	51.9	0	0	0	0	114	N329 T333 L493 C494 G499	N329-S497 WeakPolarHBondContact ND2-CB 3.35Å; N329-S497 PolarHBondContact O-OG 3.32Å; T333-S497 WeakPolarHBondContact OG1-CB 3.46Å; L493-S497 WeakPolarHBondContact O-CB 3.5Å; L493-S497 PolarHBondContact O-N 2.97Å; L493-S497 PolarHBondContact O-OG 2.78Å; C494-S497 PolarHBondContact O-N 3.06Å; C494-S497 PolarHBondContact O-OG 3.26Å; S497-G499 VanDerWaalsContact C-N 3.28Å; S497-G499 PolarHBondContact O-N 3.28Å
498	V	93.5	Very high	94	Very high	24 Å²	24	11.2 Å²	11.2	15%	0.145	6%	0.064	C	C	.	.	I	π-helix	trans	-63.1	-31.9	177.8	167.5	0	0	0	0	112.7	C332 I335 G336 L339 V348 C494 F496	C332-V498 HydrophobicContact CB-CG2 4.43Å; C332-V498 WeakPolarHBondContact O-CG2 3.23Å; I335-V498 HydrophobicContact CB-CG2 4.2Å; I335-V498 HydrophobicContact CG2-CG2 4.25Å; G336-V498 WeakPolarHBondContact CA-O 3.39Å; L339-V498 HydrophobicContact CD1-CG1 3.97Å; V348-V498 HydrophobicContact CG1-CG1 4.49Å; V348-V498 WeakPolarHBondContact CG1-O 3.45Å; C494-V498 VanDerWaalsContact O-CG2 3.25Å; C494-V498 WeakPolarHBondContact O-CG2 3.42Å; C494-V498 PolarHBondContact O-N 3.38Å; C494-V498 VanDerWaalsContact O-N 3.16Å; F496-V498 VanDerWaalsContact C-N 3.26Å; F496-V498 PolarHBondContact O-N 2.76Å
499	G	92.8	Very high	93.4	Very high	1 Å²	1	11.5 Å²	11.5	1%	0.01	7%	0.066	C	C	.	.	I	π-helix	trans	-153.2	-59	-176	0	0	0	0	0	115.2	S352 F496 S497 G501 G502 V503	S352-G499 VanDerWaalsContact OG-CA 3.32Å; S352-G499 WeakPolarHBondContact OG-CA 3.38Å; F496-G499 CarbonylContact O-C 3.07Å; F496-G499 PolarHBondContact O-N 3.27Å; S497-G499 VanDerWaalsContact C-N 3.28Å; S497-G499 PolarHBondContact O-N 3.28Å; G499-G501 PolarHBondContact O-N 3.09Å; G499-G502 PolarHBondContact O-N 3.45Å; G499-V503 WeakPolarHBondContact O-CB 3.17Å; G499-V503 VanDerWaalsContact O-CG2 3.31Å; G499-V503 WeakPolarHBondContact O-CG2 3.29Å; G499-V503 PolarHBondContact O-N 2.94Å
500	L	94.7	Very high	92.9	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.005	7%	0.071	C	C	.	.	I	π-helix	trans	-59.9	-22.2	-174.8	-171.8	59.3	0	0	0	112.6	Q291 L349 S352 V356 F496 P504 F566	Q291-L500 HydrophobicContact CB-CD1 4.4Å; Q291-L500 HydrophobicContact CG-CG 4.43Å; Q291-L500 PolarHBondContact NE2-O 3.02Å; L349-L500 HydrophobicContact CD1-CD1 3.77Å; S352-L500 PolarHBondContact OG-N 3.35Å; V356-L500 HydrophobicContact CB-CD2 4.47Å; V356-L500 HydrophobicContact CG1-CD2 4.3Å; V356-L500 HydrophobicContact CG2-CD2 4.14Å; F496-L500 HydrophobicContact CD2-CB 3.95Å; F496-L500 HydrophobicContact CD2-CD2 3.85Å; F496-L500 HydrophobicContact CD2-CG 3.93Å; F496-L500 HydrophobicContact CE2-CB 4.08Å; F496-L500 HydrophobicContact CE2-CD2 3.85Å; F496-L500 HydrophobicContact CE2-CG 3.68Å; F496-L500 HydrophobicContact CG-CB 4.49Å; F496-L500 HydrophobicContact CZ-CG 4.46Å; F496-L500 PolarHBondContact O-N 3.44Å; F496-L500 VanDerWaalsContact O-N 3.1Å; L500-P504 HydrophobicContact CD1-CG 4.26Å; L500-P504 VanDerWaalsContact O-CD 3.23Å; L500-P504 WeakPolarHBondContact O-CD 3.35Å; L500-P504 VanDerWaalsContact O-CG 3.27Å; L500-P504 WeakPolarHBondContact O-CG 3.14Å; L500-F566 HydrophobicContact CD1-CE2 3.85Å; L500-F566 HydrophobicContact CD1-CZ 4.48Å
501	G	91.3	Very high	92.6	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-72.5	170.7	0	0	0	0	0	113.6	Q291 F496 G499 W505	Q291-G501 PolarHBondContact NE2-O 2.78Å; F496-G501 PolarHBondContact O-N 3.22Å; G499-G501 PolarHBondContact O-N 3.09Å; G501-W505 VanDerWaalsContact O-CD1 3.29Å
502	G	88.8	Confident	92.2	Very high	10 Å²	10	8.3 Å²	8.3	10%	0.103	5%	0.048	C	C	.	.	H	α-helix	trans	-81.1	-27.7	-170.9	0	0	0	0	0	115.6	G499 W505 T506	G499-G502 PolarHBondContact O-N 3.45Å; G502-W505 PolarHBondContact O-N 2.93Å; G502-T506 PolarHBondContact O-N 3.03Å; G502-T506 VanDerWaalsContact O-N 3.07Å; G502-T506 PolarHBondContact O-OG1 2.03Å
503	V	91.6	Very high	91.5	Very high	1 Å²	1	8.7 Å²	8.7	1%	0.006	5%	0.051	C	C	.	.	H	α-helix	trans	-67.8	-45	-171.8	176.5	0	0	0	0	112.8	V340 R345 V348 L349 G499 W505 T506 I507	V340-V503 HydrophobicContact CG2-CG2 3.63Å; R345-V503 HydrophobicContact CB-CG1 3.9Å; R345-V503 HydrophobicContact CG-CG1 4.36Å; V348-V503 HydrophobicContact CG1-CG2 4.15Å; L349-V503 HydrophobicContact CB-CG1 3.99Å; G499-V503 WeakPolarHBondContact O-CB 3.17Å; G499-V503 VanDerWaalsContact O-CG2 3.31Å; G499-V503 WeakPolarHBondContact O-CG2 3.29Å; G499-V503 PolarHBondContact O-N 2.94Å; V503-W505 VanDerWaalsContact C-N 3.29Å; V503-W505 PolarHBondContact O-N 3.06Å; V503-T506 PolarHBondContact O-N 3.38Å; V503-T506 VanDerWaalsContact O-N 3.14Å; V503-I507 HydrophobicContact CG1-CD1 3.57Å; V503-I507 HydrophobicContact CG1-CG1 3.95Å; V503-I507 WeakPolarHBondContact O-CG1 3.31Å; V503-I507 PolarHBondContact O-N 3.23Å
504	P	93.3	Very high	90.5	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-54.4	-40.6	175	-32.9	41.3	0	0	0	114.4	L287 M288 L349 L500 N508	L287-P504 HydrophobicContact CB-CB 4.18Å; L287-P504 HydrophobicContact CD2-CG 4.43Å; M288-P504 HydrophobicContact SD-CB 4.5Å; L349-P504 HydrophobicContact CD1-CG 4.04Å; L500-P504 HydrophobicContact CD1-CG 4.26Å; L500-P504 VanDerWaalsContact O-CD 3.23Å; L500-P504 WeakPolarHBondContact O-CD 3.35Å; L500-P504 VanDerWaalsContact O-CG 3.27Å; L500-P504 WeakPolarHBondContact O-CG 3.14Å; P504-N508 WeakPolarHBondContact O-CB 3.25Å; P504-N508 PolarHBondContact O-N 3.11Å; P504-N508 PolarHBondContact O-ND2 3.16Å
505	W	89.9	Confident	89.6	Confident	37 Å²	37	11.9 Å²	11.9	14%	0.14	6%	0.064	C	C	.	.	H	α-helix	trans	-67.9	-42.1	176.3	-68.6	90.8	0	0	0	111.9	M288 G501 G502 V503 N508 A509 T525 N528	M288-W505 HydrophobicContact CE-CD2 3.65Å; M288-W505 HydrophobicContact CE-CE3 3.83Å; M288-W505 HydrophobicContact CE-CG 4.04Å; M288-W505 HydrophobicContact CE-CH2 4.47Å; M288-W505 HydrophobicContact CE-CZ2 4.29Å; M288-W505 HydrophobicContact CE-CZ3 4.25Å; M288-W505 HydrophobicContact SD-CZ2 4.39Å; G501-W505 VanDerWaalsContact O-CD1 3.29Å; G502-W505 PolarHBondContact O-N 2.93Å; V503-W505 VanDerWaalsContact C-N 3.29Å; V503-W505 PolarHBondContact O-N 3.06Å; W505-N508 PolarHBondContact O-N 3.35Å; W505-A509 PolarHBondContact O-N 3.41Å; W505-T525 HydrophobicContact CH2-CG2 3.99Å; W505-T525 HydrophobicContact CZ3-CG2 4.05Å; W505-N528 HydrophobicContact CH2-CB 4.46Å; W505-N528 HydrophobicContact CZ2-CB 4.35Å
506	T	86.8	Confident	88.9	Confident	1 Å²	1	10.3 Å²	10.3	1%	0.006	5%	0.053	C	C	.	.	H	α-helix	trans	-62.4	-48.5	177.1	-54.7	0	0	0	0	111.1	G502 V503 N508 A509 E510	G502-T506 PolarHBondContact O-N 3.03Å; G502-T506 VanDerWaalsContact O-N 3.07Å; G502-T506 PolarHBondContact O-OG1 2.03Å; V503-T506 PolarHBondContact O-N 3.38Å; V503-T506 VanDerWaalsContact O-N 3.14Å; T506-N508 VanDerWaalsContact C-N 3.33Å; T506-N508 PolarHBondContact O-N 2.97Å; T506-A509 PolarHBondContact O-N 3.37Å; T506-E510 WeakPolarHBondContact O-CG 3.35Å; T506-E510 PolarHBondContact O-N 2.76Å
507	I	91.3	Very high	88.3	Confident	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-60.3	-44.8	177.5	-67.2	175.5	0	0	0	109.9	L287 R345 L349 V503 A509 E510 I511 V570 T573	L287-I507 HydrophobicContact CD1-CB 4.05Å; L287-I507 HydrophobicContact CD1-CD1 4.33Å; L287-I507 HydrophobicContact CD1-CG2 3.65Å; R345-I507 HydrophobicContact CB-CD1 4.33Å; R345-I507 HydrophobicContact CB-CG1 4.3Å; L349-I507 HydrophobicContact CD2-CD1 4.41Å; V503-I507 HydrophobicContact CG1-CD1 3.57Å; V503-I507 HydrophobicContact CG1-CG1 3.95Å; V503-I507 WeakPolarHBondContact O-CG1 3.31Å; V503-I507 PolarHBondContact O-N 3.23Å; I507-A509 VanDerWaalsContact C-N 3.29Å; I507-A509 PolarHBondContact O-N 3.06Å; I507-E510 PolarHBondContact O-N 3.45Å; I507-I511 HydrophobicContact CG2-CD1 4.31Å; I507-I511 HydrophobicContact CG2-CG2 3.51Å; I507-I511 WeakPolarHBondContact O-CG1 3.32Å; I507-I511 VanDerWaalsContact O-CG2 3.31Å; I507-I511 WeakPolarHBondContact O-CG2 3.46Å; I507-I511 PolarHBondContact O-N 3.35Å; I507-V570 HydrophobicContact CD1-CG1 3.7Å; I507-T573 HydrophobicContact CG2-CG2 4.37Å
508	N	90.4	Very high	87.7	Confident	2 Å²	2	10.8 Å²	10.8	1%	0.011	6%	0.057	C	C	.	.	H	α-helix	trans	-60.7	-34.8	177.9	-88.5	-57.8	0	0	0	113.5	G284 M288 P504 W505 T506 E510 F512 T524	G284-N508 WeakPolarHBondContact CA-OD1 3.49Å; G284-N508 PolarHBondContact O-ND2 3.33Å; M288-N508 HydrophobicContact CE-CB 4.19Å; M288-N508 WeakPolarHBondContact CE-ND2 3.32Å; P504-N508 WeakPolarHBondContact O-CB 3.25Å; P504-N508 PolarHBondContact O-N 3.11Å; P504-N508 PolarHBondContact O-ND2 3.16Å; W505-N508 PolarHBondContact O-N 3.35Å; T506-N508 VanDerWaalsContact C-N 3.33Å; T506-N508 PolarHBondContact O-N 2.97Å; N508-E510 VanDerWaalsContact C-N 3.29Å; N508-E510 PolarHBondContact O-N 3.07Å; N508-F512 WeakPolarHBondContact O-CD2 3.42Å; N508-F512 WeakPolarHBondContact O-CE2 3.41Å; N508-T524 VanDerWaalsContact OD1-CG2 3.31Å; N508-T524 WeakPolarHBondContact OD1-CG2 3.43Å
509	A	85.1	Confident	87.3	Confident	6 Å²	6	12 Å²	12	5%	0.05	6%	0.06	C	C	.	.	H	α-helix	trans	-69.8	-26.7	174.2	0	0	0	0	0	113.1	I155 W505 T506 I507 R517	I155-A509 HydrophobicContact CD1-CB 3.96Å; W505-A509 PolarHBondContact O-N 3.41Å; T506-A509 PolarHBondContact O-N 3.37Å; I507-A509 VanDerWaalsContact C-N 3.29Å; I507-A509 PolarHBondContact O-N 3.06Å; A509-R517 WeakPolarHBondContact O-CD 3.24Å; A509-R517 PolarHBondContact O-NE 3.41Å; A509-R517 VanDerWaalsContact O-NE 3.15Å
510	E	86.1	Confident	87.2	Confident	22 Å²	22	11.9 Å²	11.9	10%	0.103	6%	0.06	C	C	.	.	H	α-helix	trans	-96.8	-29.6	-172.6	-68.8	173.6	172.8	0	0	113.8	T506 I507 N508 T573	T506-E510 WeakPolarHBondContact O-CG 3.35Å; T506-E510 PolarHBondContact O-N 2.76Å; I507-E510 PolarHBondContact O-N 3.45Å; N508-E510 VanDerWaalsContact C-N 3.29Å; N508-E510 PolarHBondContact O-N 3.07Å; E510-T573 WeakPolarHBondContact OE2-CB 3.25Å; E510-T573 PolarHBondContact OE2-OG1 3.45Å
511	I	90.8	Very high	86.9	Confident	1 Å²	1	12.3 Å²	12.3	1%	0.005	6%	0.062	C	C	.	.	H	α-helix	trans	-77.9	-19.5	-171.5	61.9	180	0	0	0	115.8	A280 I283 I507 T573 M585	A280-I511 HydrophobicContact CB-CB 4.28Å; A280-I511 HydrophobicContact CB-CD1 4.3Å; A280-I511 HydrophobicContact CB-CG1 4.21Å; A280-I511 VanDerWaalsContact O-CD1 3.22Å; A280-I511 WeakPolarHBondContact O-CD1 3.47Å; I283-I511 HydrophobicContact CG2-CD1 4.49Å; I507-I511 HydrophobicContact CG2-CD1 4.31Å; I507-I511 HydrophobicContact CG2-CG2 3.51Å; I507-I511 WeakPolarHBondContact O-CG1 3.32Å; I507-I511 VanDerWaalsContact O-CG2 3.31Å; I507-I511 WeakPolarHBondContact O-CG2 3.46Å; I507-I511 PolarHBondContact O-N 3.35Å; I511-T573 HydrophobicContact CG2-CG2 3.97Å; I511-M585 HydrophobicContact CB-CE 3.68Å; I511-M585 HydrophobicContact CG2-CE 3.52Å
512	F	89.1	Confident	86.9	Confident	0 Å²	0	12.5 Å²	12.5	0%	0	6%	0.063	C	C	.	.	S	Bend	trans	-91.9	139.6	-179	-62.9	-70.7	0	0	0	111.5	M271 A280 L281 N508 R517 G520 V521 T524	M271-F512 HydrophobicContact CE-CD1 4.34Å; M271-F512 HydrophobicContact CE-CE1 4.21Å; A280-F512 HydrophobicContact CB-CD1 3.94Å; A280-F512 HydrophobicContact CB-CE1 3.93Å; L281-F512 HydrophobicContact CB-CE1 4.15Å; L281-F512 HydrophobicContact CD1-CE1 4.29Å; L281-F512 HydrophobicContact CD1-CZ 4.23Å; N508-F512 WeakPolarHBondContact O-CD2 3.42Å; N508-F512 WeakPolarHBondContact O-CE2 3.41Å; F512-R517 HydrophobicContact CB-CB 4.02Å; F512-R517 HydrophobicContact CB-CG 4.26Å; F512-R517 PolarHBondContact O-NH2 3.4Å; F512-G520 VanDerWaalsContact CE2-C 3.45Å; F512-V521 HydrophobicContact CD2-CG2 4.23Å; F512-T524 HydrophobicContact CE2-CG2 4.1Å; F512-T524 HydrophobicContact CZ-CG2 3.85Å
513	P	83.6	Confident	87	Confident	9 Å²	9	13.3 Å²	13.3	6%	0.058	7%	0.065	C	C	.	.			trans	-65.5	154.2	170.7	29.9	-34.6	0	0	0	110.7	T277 W515 A516 R517 E582	T277-P513 HydrophobicContact CG2-CG 3.56Å; P513-W515 HydrophobicContact CB-CG 4.38Å; P513-W515 HydrophobicContact CG-CD2 4.4Å; P513-W515 HydrophobicContact CG-CG 4.28Å; P513-W515 HydrophobicContact CG-CZ2 4.34Å; P513-W515 VanDerWaalsContact CG-NE1 3.32Å; P513-W515 PolarHBondContact O-N 3.45Å; P513-A516 HydrophobicContact CG-CB 3.99Å; P513-A516 PolarHBondContact O-N 3.48Å; P513-R517 PolarHBondContact O-N 2.88Å; P513-E582 HydrophobicContact CB-CG 4.19Å; P513-E582 WeakPolarHBondContact CB-OE1 3.42Å
514	N	75.7	Confident	87.2	Confident	46 Å²	46	13.2 Å²	13.2	25%	0.246	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.5	-38.5	-174.8	-75.4	-37.6	0	0	0	113	R212 R517 I578 E579	R212-N514 PolarHBondContact NH1-OD1 2.76Å; N514-R517 VanDerWaalsContact OD1-CZ 3.29Å; N514-R517 PolarHBondContact OD1-NH1 3.23Å; N514-R517 PolarHBondContact OD1-NH2 2.92Å; N514-I578 VanDerWaalsContact OD1-CG2 3.3Å; N514-I578 WeakPolarHBondContact OD1-CG2 3.44Å; N514-E579 PolarHBondContact ND2-OE1 2.8Å
515	W	78	Confident	87.2	Confident	38 Å²	38	13.2 Å²	13.2	14%	0.144	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-28.8	-171.6	87.1	-121.7	0	0	0	113.1	R255 I267 E270 M271 Q274 T277 P513	R255-W515 PolarHBondContact NH2-O 3.5Å; I267-W515 HydrophobicContact CG2-CE3 4.21Å; I267-W515 HydrophobicContact CG2-CZ3 3.95Å; E270-W515 HydrophobicContact CB-CH2 4.01Å; E270-W515 HydrophobicContact CB-CZ3 4.11Å; M271-W515 HydrophobicContact CG-CH2 3.81Å; M271-W515 HydrophobicContact CG-CZ3 3.85Å; Q274-W515 VanDerWaalsContact OE1-CZ2 3.24Å; T277-W515 HydrophobicContact CG2-CH2 4Å; T277-W515 HydrophobicContact CG2-CZ2 3.46Å; T277-W515 VanDerWaalsContact CG2-CZ2 3.46Å; P513-W515 HydrophobicContact CB-CG 4.38Å; P513-W515 HydrophobicContact CG-CD2 4.4Å; P513-W515 HydrophobicContact CG-CG 4.28Å; P513-W515 HydrophobicContact CG-CZ2 4.34Å; P513-W515 VanDerWaalsContact CG-NE1 3.32Å; P513-W515 PolarHBondContact O-N 3.45Å
516	A	83.5	Confident	87.4	Confident	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-12	-178.3	0	0	0	0	0	113	M271 T277 P513 S518 H519 G520	M271-A516 HydrophobicContact CE-CB 4.18Å; M271-A516 HydrophobicContact CG-CB 3.82Å; M271-A516 HydrophobicContact SD-CB 3.86Å; T277-A516 HydrophobicContact CG2-CB 4.13Å; P513-A516 HydrophobicContact CG-CB 3.99Å; P513-A516 PolarHBondContact O-N 3.48Å; A516-S518 PolarHBondContact O-N 2.92Å; A516-H519 PolarHBondContact O-N 2.69Å; A516-G520 PolarHBondContact O-N 3.4Å
517	R	83.8	Confident	87.9	Confident	13 Å²	13	15.1 Å²	15.1	5%	0.049	8%	0.076	C	C	.	.	H	α-helix	trans	-58.3	-49.3	-166	-176.3	179.2	-58.6	105.7	21.5	113.7	A509 F512 P513 N514 H519 G520 V521	A509-R517 WeakPolarHBondContact O-CD 3.24Å; A509-R517 PolarHBondContact O-NE 3.41Å; A509-R517 VanDerWaalsContact O-NE 3.15Å; F512-R517 HydrophobicContact CB-CB 4.02Å; F512-R517 HydrophobicContact CB-CG 4.26Å; F512-R517 PolarHBondContact O-NH2 3.4Å; P513-R517 PolarHBondContact O-N 2.88Å; N514-R517 VanDerWaalsContact OD1-CZ 3.29Å; N514-R517 PolarHBondContact OD1-NH1 3.23Å; N514-R517 PolarHBondContact OD1-NH2 2.92Å; R517-H519 VanDerWaalsContact C-N 3.3Å; R517-H519 PolarHBondContact O-N 3.42Å; R517-G520 PolarHBondContact O-N 2.86Å; R517-V521 HydrophobicContact CG-CG2 3.87Å; R517-V521 WeakPolarHBondContact O-CB 3.43Å; R517-V521 WeakPolarHBondContact O-CG2 3.42Å; R517-V521 PolarHBondContact O-N 3.25Å
518	S	81.6	Confident	88.1	Confident	15 Å²	15	15.2 Å²	15.2	11%	0.105	8%	0.076	C	C	.	.	H	α-helix	trans	-54.3	-48.3	-178.6	-178.6	0	0	0	0	111.3	G85 D89 A516 S522	G85-S518 VanDerWaalsContact CA-OG 3.24Å; G85-S518 WeakPolarHBondContact CA-OG 3.5Å; G85-S518 PolarHBondContact O-OG 2.91Å; D89-S518 PolarHBondContact OD1-OG 2.73Å; D89-S518 WeakPolarHBondContact OD2-CB 3.37Å; D89-S518 PolarHBondContact OD2-OG 3.49Å; A516-S518 PolarHBondContact O-N 2.92Å; S518-S522 WeakPolarHBondContact O-CB 3.29Å; S518-S522 PolarHBondContact O-N 3.44Å; S518-S522 PolarHBondContact O-OG 3.47Å
519	H	85.4	Confident	88.3	Confident	48 Å²	48	15.2 Å²	15.2	22%	0.222	8%	0.076	C	C	.	.	H	α-helix	trans	-69	-43.9	176.7	-71.1	-77.6	0	0	0	112.9	D89 I267 M271 A516 R517 S522 I523	D89-H519 IonicContact OD2-NE2 4Å; I267-H519 WeakPolarHBondContact CD1-NE2 3.49Å; I267-H519 HydrophobicContact CG2-CB 4.46Å; M271-H519 HydrophobicContact SD-CB 3.85Å; A516-H519 PolarHBondContact O-N 2.69Å; R517-H519 VanDerWaalsContact C-N 3.3Å; R517-H519 PolarHBondContact O-N 3.42Å; H519-S522 PolarHBondContact O-N 3.48Å; H519-I523 WeakPolarHBondContact O-CD1 3.49Å; H519-I523 VanDerWaalsContact O-CG1 3.24Å; H519-I523 WeakPolarHBondContact O-CG1 3.47Å; H519-I523 PolarHBondContact O-N 3.14Å
520	G	89.9	Confident	88.9	Confident	0 Å²	0	19 Å²	19	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-60	-50.1	178.9	0	0	0	0	0	112.4	F512 A516 R517 S522 I523 T524	F512-G520 VanDerWaalsContact CE2-C 3.45Å; A516-G520 PolarHBondContact O-N 3.4Å; R517-G520 PolarHBondContact O-N 2.86Å; G520-S522 PolarHBondContact O-N 3.01Å; G520-I523 PolarHBondContact O-N 3.37Å; G520-T524 VanDerWaalsContact O-CG2 3.29Å; G520-T524 WeakPolarHBondContact O-CG2 3.3Å; G520-T524 PolarHBondContact O-N 3.36Å; G520-T524 PolarHBondContact O-OG1 3.47Å
521	V	89.3	Confident	89.4	Confident	10 Å²	10	20.4 Å²	20.4	6%	0.061	10%	0.097	C	C	.	.	H	α-helix	trans	-58	-49.6	174.6	173.3	0	0	0	0	109.6	F512 R517 I523 T524 T525	F512-V521 HydrophobicContact CD2-CG2 4.23Å; R517-V521 HydrophobicContact CG-CG2 3.87Å; R517-V521 WeakPolarHBondContact O-CB 3.43Å; R517-V521 WeakPolarHBondContact O-CG2 3.42Å; R517-V521 PolarHBondContact O-N 3.25Å; V521-I523 VanDerWaalsContact C-N 3.35Å; V521-I523 PolarHBondContact O-N 2.95Å; V521-T524 WeakPolarHBondContact CA-OG1 3.38Å; V521-T524 PolarHBondContact O-N 3.46Å; V521-T524 VanDerWaalsContact O-N 3.11Å; V521-T524 PolarHBondContact O-OG1 3.3Å; V521-T525 WeakPolarHBondContact O-CB 3.49Å; V521-T525 PolarHBondContact O-N 3.19Å; V521-T525 PolarHBondContact O-OG1 3.03Å
522	S	90	Very high	89.5	Confident	3 Å²	3	20.3 Å²	20.3	2%	0.021	10%	0.097	C	C	.	.	H	α-helix	trans	-57.7	-42.7	179.4	-58	0	0	0	0	113.4	G85 S518 H519 G520 T525 F526	G85-S522 WeakPolarHBondContact CA-OG 3.35Å; G85-S522 PolarHBondContact N-OG 3.23Å; S518-S522 WeakPolarHBondContact O-CB 3.29Å; S518-S522 PolarHBondContact O-N 3.44Å; S518-S522 PolarHBondContact O-OG 3.47Å; H519-S522 PolarHBondContact O-N 3.48Å; G520-S522 PolarHBondContact O-N 3.01Å; S522-T525 PolarHBondContact O-N 2.87Å; S522-F526 WeakPolarHBondContact O-CB 3.47Å; S522-F526 PolarHBondContact O-N 3.22Å
523	I	92.7	Very high	89.8	Confident	27 Å²	27	22.2 Å²	22.2	14%	0.138	11%	0.106	C	C	.	.	H	α-helix	trans	-66.1	-43.4	176.9	-65.3	158.3	0	0	0	110.5	F268 L281 H519 G520 V521 T525 F526 V527	F268-I523 HydrophobicContact CD2-CD1 3.71Å; F268-I523 HydrophobicContact CE2-CD1 3.77Å; L281-I523 HydrophobicContact CD1-CB 4.06Å; L281-I523 HydrophobicContact CD1-CD1 4.28Å; L281-I523 HydrophobicContact CD1-CG2 3.79Å; H519-I523 WeakPolarHBondContact O-CD1 3.49Å; H519-I523 VanDerWaalsContact O-CG1 3.24Å; H519-I523 WeakPolarHBondContact O-CG1 3.47Å; H519-I523 PolarHBondContact O-N 3.14Å; G520-I523 PolarHBondContact O-N 3.37Å; V521-I523 VanDerWaalsContact C-N 3.35Å; V521-I523 PolarHBondContact O-N 2.95Å; I523-T525 VanDerWaalsContact C-N 3.34Å; I523-F526 WeakPolarHBondContact O-CB 3.34Å; I523-F526 PolarHBondContact O-N 3.25Å; I523-V527 WeakPolarHBondContact O-CG2 3.3Å; I523-V527 PolarHBondContact O-N 2.95Å
524	T	94.6	Very high	90.2	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-67.5	-36.4	178.5	60.6	0	0	0	0	111.9	L281 M288 N508 F512 G520 V521 V527 N528	L281-T524 HydrophobicContact CD1-CG2 4.32Å; M288-T524 WeakPolarHBondContact CG-O 3.09Å; N508-T524 VanDerWaalsContact OD1-CG2 3.31Å; N508-T524 WeakPolarHBondContact OD1-CG2 3.43Å; F512-T524 HydrophobicContact CE2-CG2 4.1Å; F512-T524 HydrophobicContact CZ-CG2 3.85Å; G520-T524 VanDerWaalsContact O-CG2 3.29Å; G520-T524 WeakPolarHBondContact O-CG2 3.3Å; G520-T524 PolarHBondContact O-N 3.36Å; G520-T524 PolarHBondContact O-OG1 3.47Å; V521-T524 WeakPolarHBondContact CA-OG1 3.38Å; V521-T524 PolarHBondContact O-N 3.46Å; V521-T524 VanDerWaalsContact O-N 3.11Å; V521-T524 PolarHBondContact O-OG1 3.3Å; T524-V527 PolarHBondContact O-N 3.13Å; T524-N528 PolarHBondContact O-N 3.09Å
525	T	93.3	Very high	91	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-66.3	-40.5	172.4	-56.7	0	0	0	0	111.3	A81 W505 V521 S522 I523 N528 W529	A81-T525 HydrophobicContact CB-CG2 3.67Å; W505-T525 HydrophobicContact CH2-CG2 3.99Å; W505-T525 HydrophobicContact CZ3-CG2 4.05Å; V521-T525 WeakPolarHBondContact O-CB 3.49Å; V521-T525 PolarHBondContact O-N 3.19Å; V521-T525 PolarHBondContact O-OG1 3.03Å; S522-T525 PolarHBondContact O-N 2.87Å; I523-T525 VanDerWaalsContact C-N 3.34Å; T525-N528 WeakPolarHBondContact O-CB 3.32Å; T525-N528 PolarHBondContact O-N 3.09Å; T525-W529 PolarHBondContact O-N 3.02Å
526	F	95.1	Very high	91.4	Very high	59 Å²	59	21 Å²	21	26%	0.259	10%	0.102	S	C	.	.	H	α-helix	trans	-58.6	-48.2	170.3	163.8	-98	0	0	0	111	A78 L82 S522 I523 N528 W529 F530	A78-F526 HydrophobicContact CB-CD2 4.19Å; A78-F526 HydrophobicContact CB-CE2 4.33Å; A78-F526 WeakPolarHBondContact O-CD2 3.46Å; L82-F526 HydrophobicContact CB-CB 4.42Å; L82-F526 HydrophobicContact CB-CD2 4.2Å; L82-F526 HydrophobicContact CB-CG 4.49Å; L82-F526 HydrophobicContact CD1-CB 4.26Å; L82-F526 HydrophobicContact CD1-CG 4.19Å; S522-F526 WeakPolarHBondContact O-CB 3.47Å; S522-F526 PolarHBondContact O-N 3.22Å; I523-F526 WeakPolarHBondContact O-CB 3.34Å; I523-F526 PolarHBondContact O-N 3.25Å; F526-N528 VanDerWaalsContact C-N 3.29Å; F526-N528 PolarHBondContact O-N 2.81Å; F526-W529 PolarHBondContact O-N 2.87Å; F526-F530 HydrophobicContact CE1-CB 4.38Å; F526-F530 HydrophobicContact CE2-CB 4.37Å; F526-F530 HydrophobicContact CZ-CB 4.16Å; F526-F530 HydrophobicContact CZ-CD2 4.1Å; F526-F530 HydrophobicContact CZ-CG 4.21Å; F526-F530 VanDerWaalsContact O-CB 3.22Å; F526-F530 WeakPolarHBondContact O-CB 3.32Å; F526-F530 PolarHBondContact O-N 2.91Å
527	V	96.7	Very high	91.7	Very high	19 Å²	19	24.4 Å²	24.4	12%	0.115	12%	0.12	C	C	.	.	H	α-helix	trans	-59.5	-41.7	177.7	168.8	0	0	0	0	111	C285 M288 V289 I523 T524 F530 F531	C285-V527 HydrophobicContact CB-CG1 4.19Å; C285-V527 HydrophobicContact CB-CG2 4.33Å; M288-V527 HydrophobicContact CB-CG1 4.22Å; V289-V527 HydrophobicContact CG2-CG1 3.6Å; I523-V527 WeakPolarHBondContact O-CG2 3.3Å; I523-V527 PolarHBondContact O-N 2.95Å; T524-V527 PolarHBondContact O-N 3.13Å; V527-F530 PolarHBondContact O-N 3.16Å; V527-F531 HydrophobicContact CG1-CD2 3.91Å; V527-F531 HydrophobicContact CG1-CE2 4.17Å; V527-F531 WeakPolarHBondContact O-CD2 3.47Å; V527-F531 PolarHBondContact O-N 2.85Å
528	N	95.3	Very high	91.9	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-54.9	-56.4	172.7	176.7	83.4	0	0	0	111.4	M288 Q291 Q292 W505 T524 T525 F526 F530 F531 N532	M288-N528 HydrophobicContact CB-CB 3.93Å; M288-N528 HydrophobicContact CG-CB 4.06Å; M288-N528 HydrophobicContact SD-CB 3.85Å; Q291-N528 PolarHBondContact OE1-OD1 3.39Å; Q292-N528 WeakPolarHBondContact CG-O 3.38Å; Q292-N528 WeakPolarHBondContact CG-OD1 3.06Å; Q292-N528 PolarHBondContact NE2-OD1 2.86Å; W505-N528 HydrophobicContact CH2-CB 4.46Å; W505-N528 HydrophobicContact CZ2-CB 4.35Å; T524-N528 PolarHBondContact O-N 3.09Å; T525-N528 WeakPolarHBondContact O-CB 3.32Å; T525-N528 PolarHBondContact O-N 3.09Å; F526-N528 VanDerWaalsContact C-N 3.29Å; F526-N528 PolarHBondContact O-N 2.81Å; N528-F530 VanDerWaalsContact C-N 3.33Å; N528-F530 PolarHBondContact O-N 2.79Å; N528-F531 PolarHBondContact O-N 3.26Å; N528-N532 WeakPolarHBondContact O-CB 3.48Å; N528-N532 PolarHBondContact O-N 3.49Å
529	W	95.3	Very high	92.2	Very high	3 Å²	3	26 Å²	26	1%	0.011	13%	0.13	C	C	.	.	H	α-helix	trans	-68.5	-32.7	-177.5	-65.9	125	0	0	0	113.3	F41 V74 A77 A78 I131 S135 T525 F526 N532 L533	F41-W529 HydrophobicContact CD2-CH2 4.21Å; F41-W529 HydrophobicContact CE1-CH2 4.28Å; F41-W529 AromaticContact CE2-CH2 3.42Å; F41-W529 HydrophobicContact CE2-CH2 3.42Å; F41-W529 VanDerWaalsContact CE2-CH2 3.42Å; F41-W529 HydrophobicContact CE2-CZ2 4.37Å; F41-W529 HydrophobicContact CE2-CZ3 4.15Å; F41-W529 AromaticContact CZ-CH2 3.47Å; F41-W529 HydrophobicContact CZ-CH2 3.47Å; F41-W529 VanDerWaalsContact CZ-CH2 3.47Å; F41-W529 HydrophobicContact CZ-CZ2 4.41Å; F41-W529 HydrophobicContact CZ-CZ3 4.23Å; V74-W529 HydrophobicContact CG1-CE3 4.14Å; V74-W529 VanDerWaalsContact CG1-O 3.27Å; V74-W529 WeakPolarHBondContact CG1-O 3.48Å; A77-W529 HydrophobicContact CB-CB 4.45Å; A77-W529 HydrophobicContact CB-CD2 3.76Å; A77-W529 HydrophobicContact CB-CE3 4.1Å; A77-W529 HydrophobicContact CB-CG 3.9Å; A78-W529 VanDerWaalsContact CA-CB 3.4Å; A78-W529 HydrophobicContact CB-CB 3.53Å; I131-W529 HydrophobicContact CG2-CH2 3.57Å; I131-W529 HydrophobicContact CG2-CZ2 3.4Å; I131-W529 VanDerWaalsContact CG2-CZ2 3.4Å; I131-W529 HydrophobicContact CG2-CZ3 4.35Å; S135-W529 WeakPolarHBondContact OG-CZ2 3.42Å; T525-W529 PolarHBondContact O-N 3.02Å; F526-W529 PolarHBondContact O-N 2.87Å; W529-N532 HydrophobicContact CE3-CB 4.35Å; W529-N532 WeakPolarHBondContact CZ3-ND2 3.08Å; W529-N532 PolarHBondContact O-N 2.99Å; W529-L533 WeakPolarHBondContact O-CB 3.13Å; W529-L533 PolarHBondContact O-N 2.9Å
530	F	96.2	Very high	92.1	Very high	85 Å²	85	24.1 Å²	24.1	37%	0.373	12%	0.122	S	C	.	.	H	α-helix	trans	-65.8	-43.8	176.2	-179	-100.4	0	0	0	112	F526 V527 N528 L533 I534	F526-F530 HydrophobicContact CE1-CB 4.38Å; F526-F530 HydrophobicContact CE2-CB 4.37Å; F526-F530 HydrophobicContact CZ-CB 4.16Å; F526-F530 HydrophobicContact CZ-CD2 4.1Å; F526-F530 HydrophobicContact CZ-CG 4.21Å; F526-F530 VanDerWaalsContact O-CB 3.22Å; F526-F530 WeakPolarHBondContact O-CB 3.32Å; F526-F530 PolarHBondContact O-N 2.91Å; V527-F530 PolarHBondContact O-N 3.16Å; N528-F530 VanDerWaalsContact C-N 3.33Å; N528-F530 PolarHBondContact O-N 2.79Å; F530-L533 WeakPolarHBondContact O-CB 3.19Å; F530-L533 PolarHBondContact O-N 2.81Å; F530-I534 HydrophobicContact CD1-CD1 4.01Å; F530-I534 HydrophobicContact CE1-CD1 3.54Å; F530-I534 HydrophobicContact CE1-CG1 4.46Å; F530-I534 HydrophobicContact CZ-CD1 4.05Å; F530-I534 WeakPolarHBondContact O-CG1 3.43Å; F530-I534 PolarHBondContact O-N 3.36Å; F530-I534 VanDerWaalsContact O-N 3.12Å
531	F	96.6	Very high	91.9	Very high	51 Å²	51	27 Å²	27	22%	0.224	14%	0.142	C	C	.	.	H	α-helix	trans	-74	-31.7	175.6	-83.7	-94	0	0	0	112.4	V289 Q292 L293 V527 N528 L533 I534 V535	V289-F531 HydrophobicContact CG1-CD1 3.96Å; V289-F531 HydrophobicContact CG1-CE1 3.75Å; V289-F531 HydrophobicContact CG1-CG 4.42Å; V289-F531 HydrophobicContact CG1-CZ 4.06Å; V289-F531 HydrophobicContact CG2-CD1 4.4Å; V289-F531 HydrophobicContact CG2-CD2 3.73Å; V289-F531 HydrophobicContact CG2-CE1 4.22Å; V289-F531 HydrophobicContact CG2-CE2 3.52Å; V289-F531 HydrophobicContact CG2-CG 4.16Å; V289-F531 HydrophobicContact CG2-CZ 3.78Å; Q292-F531 HydrophobicContact CB-CB 3.91Å; L293-F531 HydrophobicContact CD1-CD1 4.15Å; L293-F531 HydrophobicContact CD1-CE1 4.24Å; L293-F531 HydrophobicContact CD2-CD1 3.96Å; L293-F531 HydrophobicContact CG-CD1 3.95Å; V527-F531 HydrophobicContact CG1-CD2 3.91Å; V527-F531 HydrophobicContact CG1-CE2 4.17Å; V527-F531 WeakPolarHBondContact O-CD2 3.47Å; V527-F531 PolarHBondContact O-N 2.85Å; N528-F531 PolarHBondContact O-N 3.26Å; F531-L533 VanDerWaalsContact C-N 3.31Å; F531-I534 HydrophobicContact CD1-CD1 4.36Å; F531-I534 HydrophobicContact CE1-CD1 4.47Å; F531-I534 PolarHBondContact O-N 2.93Å; F531-V535 WeakPolarHBondContact O-CG2 3.08Å; F531-V535 PolarHBondContact O-N 3.49Å
532	N	94.6	Very high	91.9	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-58.4	-45.8	167.5	-177.7	-16.3	0	0	0	110.4	V74 Q292 N297 Y301 N528 W529 I534 V535 S536	V74-N532 HydrophobicContact CG1-CB 3.59Å; V74-N532 WeakPolarHBondContact CG1-OD1 3.48Å; Q292-N532 HydrophobicContact CG-CB 4.37Å; N297-N532 WeakPolarHBondContact CB-ND2 3.34Å; N297-N532 PolarHBondContact ND2-ND2 3.28Å; Y301-N532 PolarHBondContact OH-ND2 3.47Å; N528-N532 WeakPolarHBondContact O-CB 3.48Å; N528-N532 PolarHBondContact O-N 3.49Å; W529-N532 HydrophobicContact CE3-CB 4.35Å; W529-N532 WeakPolarHBondContact CZ3-ND2 3.08Å; W529-N532 PolarHBondContact O-N 2.99Å; N532-I534 VanDerWaalsContact C-N 3.32Å; N532-I534 PolarHBondContact O-N 3.19Å; N532-V535 PolarHBondContact O-N 2.97Å; N532-V535 VanDerWaalsContact O-N 3.16Å; N532-S536 WeakPolarHBondContact O-CB 3.47Å; N532-S536 PolarHBondContact O-N 3.36Å; N532-S536 PolarHBondContact O-OG 3.13Å; N532-S536 PolarHBondContact OD1-OG 2.91Å; N532-S536 VanDerWaalsContact OD1-OG 3.14Å
533	L	94.4	Very high	91.9	Very high	39 Å²	39	28.5 Å²	28.5	20%	0.204	15%	0.15	C	C	.	.	H	α-helix	trans	-56.8	-46.1	177.8	174.8	65.5	0	0	0	111.6	S71 V74 W529 F530 F531 S536 L537	S71-L533 VanDerWaalsContact O-CD1 3.28Å; S71-L533 WeakPolarHBondContact O-CD1 3.32Å; V74-L533 HydrophobicContact CG1-CB 3.94Å; V74-L533 VanDerWaalsContact CG1-N 3.3Å; W529-L533 WeakPolarHBondContact O-CB 3.13Å; W529-L533 PolarHBondContact O-N 2.9Å; F530-L533 WeakPolarHBondContact O-CB 3.19Å; F530-L533 PolarHBondContact O-N 2.81Å; F531-L533 VanDerWaalsContact C-N 3.31Å; L533-S536 PolarHBondContact O-N 3.47Å; L533-L537 HydrophobicContact CD1-CD1 3.71Å; L533-L537 HydrophobicContact CD1-CG 4.05Å; L533-L537 HydrophobicContact CG-CD1 3.96Å; L533-L537 WeakPolarHBondContact O-CB 3.4Å; L533-L537 WeakPolarHBondContact O-CG 3.03Å; L533-L537 PolarHBondContact O-N 3.16Å
534	I	93.1	Very high	91.5	Very high	64 Å²	64	32.2 Å²	32.2	33%	0.328	16%	0.162	S	C	.	.	H	α-helix	trans	-58.5	-50.1	177.1	-68.6	169.8	0	0	0	110.5	F530 F531 N532 L537 T538	F530-I534 HydrophobicContact CD1-CD1 4.01Å; F530-I534 HydrophobicContact CE1-CD1 3.54Å; F530-I534 HydrophobicContact CE1-CG1 4.46Å; F530-I534 HydrophobicContact CZ-CD1 4.05Å; F530-I534 WeakPolarHBondContact O-CG1 3.43Å; F530-I534 PolarHBondContact O-N 3.36Å; F530-I534 VanDerWaalsContact O-N 3.12Å; F531-I534 HydrophobicContact CD1-CD1 4.36Å; F531-I534 HydrophobicContact CE1-CD1 4.47Å; F531-I534 PolarHBondContact O-N 2.93Å; N532-I534 VanDerWaalsContact C-N 3.32Å; N532-I534 PolarHBondContact O-N 3.19Å; I534-L537 PolarHBondContact O-N 3.34Å; I534-T538 WeakPolarHBondContact O-CB 3.36Å; I534-T538 VanDerWaalsContact O-CG2 3.27Å; I534-T538 WeakPolarHBondContact O-CG2 3.3Å; I534-T538 PolarHBondContact O-N 3.46Å; I534-T538 PolarHBondContact O-OG1 3.47Å
535	V	91.8	Very high	91.3	Very high	4 Å²	4	36 Å²	36	2%	0.024	19%	0.193	C	C	.	.	H	α-helix	trans	-66.7	-42.9	-177.4	-177.4	0	0	0	0	110.8	L293 T298 F531 N532 L537 T538 F539 Y555	L293-V535 HydrophobicContact CD2-CG2 3.81Å; T298-V535 WeakPolarHBondContact OG1-CG1 3.47Å; F531-V535 WeakPolarHBondContact O-CG2 3.08Å; F531-V535 PolarHBondContact O-N 3.49Å; N532-V535 PolarHBondContact O-N 2.97Å; N532-V535 VanDerWaalsContact O-N 3.16Å; V535-L537 PolarHBondContact O-N 2.91Å; V535-T538 PolarHBondContact O-N 3.39Å; V535-T538 VanDerWaalsContact O-N 3.17Å; V535-T538 PolarHBondContact O-OG1 3.14Å; V535-F539 PolarHBondContact O-N 2.86Å; V535-Y555 HydrophobicContact CG1-CE1 4.19Å; V535-Y555 WeakPolarHBondContact CG1-OH 3.32Å
536	S	87.2	Confident	91.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.7	-34.2	178.8	-74.6	0	0	0	0	114	Y301 N532 L533 T538	Y301-S536 WeakPolarHBondContact CE2-OG 2.93Å; N532-S536 WeakPolarHBondContact O-CB 3.47Å; N532-S536 PolarHBondContact O-N 3.36Å; N532-S536 PolarHBondContact O-OG 3.13Å; N532-S536 PolarHBondContact OD1-OG 2.91Å; N532-S536 VanDerWaalsContact OD1-OG 3.14Å; L533-S536 PolarHBondContact O-N 3.47Å; S536-T538 VanDerWaalsContact C-N 3.34Å
537	L	88.3	Confident	91.2	Very high	71 Å²	71	39 Å²	39	37%	0.372	21%	0.212	S	C	.	.	H	α-helix	trans	-78.7	-15.5	175	-78.6	174.5	0	0	0	114	S71 L533 I534 V535	S71-L537 WeakPolarHBondContact OG-CD2 3.09Å; L533-L537 HydrophobicContact CD1-CD1 3.71Å; L533-L537 HydrophobicContact CD1-CG 4.05Å; L533-L537 HydrophobicContact CG-CD1 3.96Å; L533-L537 WeakPolarHBondContact O-CB 3.4Å; L533-L537 WeakPolarHBondContact O-CG 3.03Å; L533-L537 PolarHBondContact O-N 3.16Å; I534-L537 PolarHBondContact O-N 3.34Å; V535-L537 PolarHBondContact O-N 2.91Å
538	T	88	Confident	91.1	Very high	61 Å²	61	38.3 Å²	38.3	37%	0.374	21%	0.207	S	C	.	.	H	α-helix	trans	-113.7	-9.6	-172.9	56.2	0	0	0	0	113.2	I534 V535 S536 L542	I534-T538 WeakPolarHBondContact O-CB 3.36Å; I534-T538 VanDerWaalsContact O-CG2 3.27Å; I534-T538 WeakPolarHBondContact O-CG2 3.3Å; I534-T538 PolarHBondContact O-N 3.46Å; I534-T538 PolarHBondContact O-OG1 3.47Å; V535-T538 PolarHBondContact O-N 3.39Å; V535-T538 VanDerWaalsContact O-N 3.17Å; V535-T538 PolarHBondContact O-OG1 3.14Å; S536-T538 VanDerWaalsContact C-N 3.34Å; T538-L542 WeakPolarHBondContact O-CA 3.28Å; T538-L542 WeakPolarHBondContact O-CB 3.32Å; T538-L542 PolarHBondContact O-N 2.9Å
539	F	87.7	Confident	91.1	Very high	1 Å²	1	40.4 Å²	40.4	0%	0.004	22%	0.217	C	C	.	.	H	α-helix	trans	-66	-55.9	-171.9	175	-115	0	0	0	114.7	T298 Y302 I306 V535 S541 L542 V543 F552 Y555	T298-F539 HydrophobicContact CG2-CB 3.3Å; T298-F539 HydrophobicContact CG2-CD1 3.28Å; T298-F539 HydrophobicContact CG2-CD2 3.4Å; T298-F539 VanDerWaalsContact CG2-CD2 3.4Å; T298-F539 HydrophobicContact CG2-CE1 3.84Å; T298-F539 HydrophobicContact CG2-CE2 3.94Å; T298-F539 HydrophobicContact CG2-CG 3.01Å; T298-F539 HydrophobicContact CG2-CZ 4.13Å; Y302-F539 AromaticContact CD2-CD1 3.63Å; Y302-F539 HydrophobicContact CD2-CD1 3.63Å; Y302-F539 HydrophobicContact CD2-CE1 4.03Å; Y302-F539 AromaticContact CE2-CD1 3.99Å; Y302-F539 HydrophobicContact CE2-CD1 3.99Å; Y302-F539 HydrophobicContact CG-CD1 4.31Å; Y302-F539 HydrophobicContact CG-CE1 4.35Å; I306-F539 HydrophobicContact CD1-CZ 4.19Å; I306-F539 HydrophobicContact CG1-CE1 4.48Å; I306-F539 HydrophobicContact CG1-CZ 4.28Å; V535-F539 PolarHBondContact O-N 2.86Å; F539-S541 VanDerWaalsContact C-N 3.3Å; F539-L542 PolarHBondContact O-N 2.93Å; F539-V543 HydrophobicContact CD2-CG2 4.22Å; F539-V543 HydrophobicContact CE2-CG2 3.87Å; F539-V543 HydrophobicContact CZ-CG2 4.04Å; F539-V543 WeakPolarHBondContact O-CG2 3.06Å; F539-V543 PolarHBondContact O-N 2.91Å; F539-F552 HydrophobicContact CE2-CZ 4.42Å; F539-F552 HydrophobicContact CZ-CZ 4.29Å; F539-Y555 AromaticContact CD2-CE2 3.88Å; F539-Y555 HydrophobicContact CD2-CE2 3.88Å; F539-Y555 HydrophobicContact CE2-CE2 4.13Å
540	L	83.7	Confident	91.1	Very high	9 Å²	9	41 Å²	41	5%	0.047	23%	0.225	C	C	.	.	H	α-helix	trans	-68.2	-39.7	-177.5	-57.7	176.7	0	0	0	109.3	D63 Q66 E67 Y302 L542 V543 R544	D63-L540 HydrophobicContact CB-CB 4.26Å; D63-L540 HydrophobicContact CB-CD1 3.93Å; Q66-L540 HydrophobicContact CB-CD1 4.44Å; E67-L540 HydrophobicContact CG-CB 4.38Å; E67-L540 HydrophobicContact CG-CD1 4.12Å; E67-L540 HydrophobicContact CG-CG 4.33Å; E67-L540 WeakPolarHBondContact OE1-CA 3.19Å; E67-L540 VanDerWaalsContact OE1-CB 3.25Å; E67-L540 WeakPolarHBondContact OE1-CB 2.96Å; E67-L540 PolarHBondContact OE1-N 3.27Å; Y302-L540 HydrophobicContact CE1-CD1 3.98Å; Y302-L540 HydrophobicContact CE1-CG 4.43Å; L540-L542 VanDerWaalsContact C-N 3.33Å; L540-L542 PolarHBondContact O-N 2.92Å; L540-V543 PolarHBondContact O-N 3.28Å; L540-R544 PolarHBondContact O-N 3.22Å
541	S	86.5	Confident	91.1	Very high	59 Å²	59	37 Å²	37	41%	0.413	21%	0.207	S	C	.	.	H	α-helix	trans	-54.5	-43.6	170.1	-68.2	0	0	0	0	113.4	E67 F539 R544 A545	E67-S541 PolarHBondContact OE1-N 3.1Å; E67-S541 PolarHBondContact OE1-OG 3.46Å; E67-S541 PolarHBondContact OE2-OG 3.37Å; F539-S541 VanDerWaalsContact C-N 3.3Å; S541-R544 PolarHBondContact O-N 3.23Å; S541-A545 VanDerWaalsContact O-CB 3.24Å; S541-A545 WeakPolarHBondContact O-CB 3.44Å; S541-A545 PolarHBondContact O-N 2.87Å
542	L	89.3	Confident	91	Very high	38 Å²	38	34.7 Å²	34.7	20%	0.199	20%	0.197	C	C	.	.	H	α-helix	trans	-67.7	-44.1	177.4	179.4	67.1	0	0	0	111	T538 F539 L540 R544 A545 I546 A551 F554 Y555	T538-L542 WeakPolarHBondContact O-CA 3.28Å; T538-L542 WeakPolarHBondContact O-CB 3.32Å; T538-L542 PolarHBondContact O-N 2.9Å; F539-L542 PolarHBondContact O-N 2.93Å; L540-L542 VanDerWaalsContact C-N 3.33Å; L540-L542 PolarHBondContact O-N 2.92Å; L542-R544 VanDerWaalsContact C-N 3.27Å; L542-R544 PolarHBondContact O-N 3.45Å; L542-A545 PolarHBondContact O-N 3.25Å; L542-I546 HydrophobicContact CD1-CD1 3.71Å; L542-I546 HydrophobicContact CD1-CG1 3.89Å; L542-I546 HydrophobicContact CG-CD1 4.07Å; L542-I546 HydrophobicContact CG-CG1 4.15Å; L542-I546 WeakPolarHBondContact O-CG1 3.18Å; L542-I546 PolarHBondContact O-N 3.42Å; L542-A551 HydrophobicContact CD2-CB 3.96Å; L542-A551 HydrophobicContact CG-CB 4.06Å; L542-F554 HydrophobicContact CD2-CD1 3.94Å; L542-F554 HydrophobicContact CD2-CE1 4.42Å; L542-Y555 HydrophobicContact CD2-CE1 4.47Å
543	V	89.2	Confident	91.2	Very high	8 Å²	8	38.2 Å²	38.2	5%	0.048	21%	0.212	C	C	.	.	H	α-helix	trans	-57.7	-41.9	176.8	166	0	0	0	0	111.1	Y408 F539 L540 T547 R548 A551	Y408-V543 HydrophobicContact CD1-CG1 4.44Å; Y408-V543 HydrophobicContact CE1-CG1 3.91Å; Y408-V543 WeakPolarHBondContact CE1-O 3.49Å; F539-V543 HydrophobicContact CD2-CG2 4.22Å; F539-V543 HydrophobicContact CE2-CG2 3.87Å; F539-V543 HydrophobicContact CZ-CG2 4.04Å; F539-V543 WeakPolarHBondContact O-CG2 3.06Å; F539-V543 PolarHBondContact O-N 2.91Å; L540-V543 PolarHBondContact O-N 3.28Å; V543-T547 CarbonylContact O-C 3.58Å; V543-T547 VanDerWaalsContact O-C 3.28Å; V543-T547 WeakPolarHBondContact O-CA 3.29Å; V543-T547 PolarHBondContact O-N 3.17Å; V543-R548 HydrophobicContact CG1-CB 4.3Å; V543-R548 HydrophobicContact CG1-CG 3.48Å; V543-R548 VanDerWaalsContact CG1-CG 3.48Å; V543-A551 HydrophobicContact CG2-CB 3.84Å
544	R	85.6	Confident	91.3	Very high	105 Å²	105	41.2 Å²	41.2	40%	0.396	22%	0.224	S	C	.	.	H	α-helix	trans	-71.2	-37.3	175.3	-69.8	-179	-178.5	-160.8	-7.9	113.1	D63 L540 S541 L542	D63-R544 VanDerWaalsContact CG-CZ 3.48Å; D63-R544 IonicContact OD1-NH2 3.41Å; D63-R544 PolarHBondContact OD1-NH2 2.9Å; D63-R544 IonicContact OD2-CZ 2.7Å; D63-R544 IonicContact OD2-NE 3Å; D63-R544 PolarHBondContact OD2-NE 2.9Å; D63-R544 IonicContact OD2-NH2 3.46Å; D63-R544 PolarHBondContact OD2-NH2 2.88Å; L540-R544 PolarHBondContact O-N 3.22Å; S541-R544 PolarHBondContact O-N 3.23Å; L542-R544 VanDerWaalsContact C-N 3.27Å; L542-R544 PolarHBondContact O-N 3.45Å
545	A	88.8	Confident	91.4	Very high	80 Å²	80	38.4 Å²	38.4	66%	0.661	21%	0.209	S	C	*	.	H	α-helix	trans	-74.7	-33.9	-175	0	0	0	0	0	114	S541 L542	S541-A545 VanDerWaalsContact O-CB 3.24Å; S541-A545 WeakPolarHBondContact O-CB 3.44Å; S541-A545 PolarHBondContact O-N 2.87Å; L542-A545 PolarHBondContact O-N 3.25Å
546	I	92.6	Very high	91.7	Very high	87 Å²	87	38.5 Å²	38.5	45%	0.446	21%	0.21	S	C	.	.	S	Bend	trans	-111.3	-75.9	177.4	53.7	171.1	0	0	0	111.5	L542	L542-I546 HydrophobicContact CD1-CD1 3.71Å; L542-I546 HydrophobicContact CD1-CG1 3.89Å; L542-I546 HydrophobicContact CG-CD1 4.07Å; L542-I546 HydrophobicContact CG-CG1 4.15Å; L542-I546 WeakPolarHBondContact O-CG1 3.18Å; L542-I546 PolarHBondContact O-N 3.42Å
547	T	94.5	Very high	92.3	Very high	33 Å²	33	42.8 Å²	42.8	20%	0.202	24%	0.237	C	C	.	.			trans	179.1	166.3	171.4	52.5	0	0	0	0	107.6	V543 H549 G550 A551	V543-T547 CarbonylContact O-C 3.58Å; V543-T547 VanDerWaalsContact O-C 3.28Å; V543-T547 WeakPolarHBondContact O-CA 3.29Å; V543-T547 PolarHBondContact O-N 3.17Å; T547-H549 WeakPolarHBondContact CB-CE1 3.26Å; T547-H549 VanDerWaalsContact CG2-CE1 3.48Å; T547-H549 WeakPolarHBondContact CG2-CE1 3.48Å; T547-H549 PolarHBondContact O-N 3.14Å; T547-H549 PolarHBondContact OG1-CD2 2.86Å; T547-H549 PolarHBondContact OG1-CE1 2.82Å; T547-H549 PolarHBondContact OG1-ND1 3.46Å; T547-H549 PolarHBondContact OG1-NE2 3.29Å; T547-G550 PolarHBondContact O-N 3.44Å; T547-G550 PolarHBondContact OG1-N 2.61Å; T547-A551 PolarHBondContact O-N 2.86Å
548	R	93.7	Very high	92.7	Very high	6 Å²	6	40.4 Å²	40.4	2%	0.023	23%	0.225	C	C	.	.	H	α-helix	trans	-54.2	-51.5	172.1	-67	169.3	-166.8	153.6	13	112.2	L309 F367 S407 Y408 G475 V543 A551 F552	L309-R548 PolarHBondContact O-NH1 3.5Å; F367-R548 HydrophobicContact CB-CB 4Å; F367-R548 HydrophobicContact CD1-CB 3.86Å; F367-R548 HydrophobicContact CD1-CG 4.36Å; F367-R548 HydrophobicContact CD2-CB 4.5Å; F367-R548 HydrophobicContact CE1-CB 4.48Å; F367-R548 HydrophobicContact CG-CB 3.87Å; S407-R548 PolarHBondContact O-NH2 3.28Å; S407-R548 PolarHBondContact OG-NH2 2.96Å; Y408-R548 HydrophobicContact CE1-CG 3.91Å; Y408-R548 WeakPolarHBondContact OH-CG 3.29Å; Y408-R548 PolarHBondContact OH-N 3.27Å; G475-R548 PolarHBondContact O-NH2 2.77Å; V543-R548 HydrophobicContact CG1-CB 4.3Å; V543-R548 HydrophobicContact CG1-CG 3.48Å; V543-R548 VanDerWaalsContact CG1-CG 3.48Å; R548-A551 PolarHBondContact O-N 3.43Å; R548-F552 WeakPolarHBondContact O-CD2 3.38Å; R548-F552 PolarHBondContact O-N 2.82Å
549	H	96.2	Very high	93.2	Very high	44 Å²	44	37.6 Å²	37.6	20%	0.204	21%	0.208	C	C	.	.	H	α-helix	trans	-67.4	-38.2	-179.7	53.6	-93.1	0	0	0	112.4	G364 F367 A368 T547 A551 F552 F553	G364-H549 WeakPolarHBondContact O-CB 3.23Å; F367-H549 HydrophobicContact CB-CB 3.85Å; A368-H549 HydrophobicContact CB-CB 4.03Å; T547-H549 WeakPolarHBondContact CB-CE1 3.26Å; T547-H549 VanDerWaalsContact CG2-CE1 3.48Å; T547-H549 WeakPolarHBondContact CG2-CE1 3.48Å; T547-H549 PolarHBondContact O-N 3.14Å; T547-H549 PolarHBondContact OG1-CD2 2.86Å; T547-H549 PolarHBondContact OG1-CE1 2.82Å; T547-H549 PolarHBondContact OG1-ND1 3.46Å; T547-H549 PolarHBondContact OG1-NE2 3.29Å; H549-A551 VanDerWaalsContact C-N 3.31Å; H549-A551 PolarHBondContact O-N 3.39Å; H549-F552 PolarHBondContact O-N 3.12Å; H549-F553 HydrophobicContact CB-CE2 4.17Å; H549-F553 WeakPolarHBondContact O-CD2 3.34Å; H549-F553 WeakPolarHBondContact O-CG 3.44Å; H549-F553 PolarHBondContact O-N 3.11Å
550	G	95.9	Very high	93.7	Very high	17 Å²	17	39.6 Å²	39.6	18%	0.175	22%	0.224	C	C	.	.	H	α-helix	trans	-58.5	-41.8	175.7	0	0	0	0	0	112.3	T547 F553 F554	T547-G550 PolarHBondContact O-N 3.44Å; T547-G550 PolarHBondContact OG1-N 2.61Å; G550-F553 PolarHBondContact O-N 3.37Å; G550-F554 WeakPolarHBondContact O-CB 3.36Å; G550-F554 PolarHBondContact O-N 3.39Å
551	A	94.9	Very high	94.4	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.4	-45	177.2	0	0	0	0	0	112.4	L542 V543 T547 R548 H549 F554 Y555	L542-A551 HydrophobicContact CD2-CB 3.96Å; L542-A551 HydrophobicContact CG-CB 4.06Å; V543-A551 HydrophobicContact CG2-CB 3.84Å; T547-A551 PolarHBondContact O-N 2.86Å; R548-A551 PolarHBondContact O-N 3.43Å; H549-A551 VanDerWaalsContact C-N 3.31Å; H549-A551 PolarHBondContact O-N 3.39Å; A551-F554 WeakPolarHBondContact O-CB 3.3Å; A551-F554 PolarHBondContact O-N 3.5Å; A551-Y555 WeakPolarHBondContact O-CD2 3.38Å; A551-Y555 PolarHBondContact O-N 3.35Å
552	F	96.2	Very high	95	Very high	3 Å²	3	40.6 Å²	40.6	1%	0.013	22%	0.224	C	C	.	.	H	α-helix	trans	-69.1	-37.2	177.8	-68.3	-69	0	0	0	112.9	V299 I306 L360 L363 F367 F539 R548 H549 F554 Y555 A556	V299-F552 HydrophobicContact CG2-CE1 4.29Å; I306-F552 HydrophobicContact CD1-CZ 4.37Å; I306-F552 HydrophobicContact CG2-CZ 4.45Å; L360-F552 HydrophobicContact CD2-CD1 4.07Å; L363-F552 HydrophobicContact CB-CB 4.2Å; L363-F552 HydrophobicContact CB-CD1 4.04Å; L363-F552 HydrophobicContact CB-CD2 4.32Å; L363-F552 HydrophobicContact CB-CG 3.93Å; L363-F552 HydrophobicContact CD1-CD1 4.06Å; L363-F552 HydrophobicContact CD1-CE1 4.1Å; F367-F552 AromaticContact CD2-CD2 3.63Å; F367-F552 HydrophobicContact CD2-CD2 3.63Å; F367-F552 AromaticContact CD2-CE2 3.44Å; F367-F552 HydrophobicContact CD2-CE2 3.44Å; F367-F552 VanDerWaalsContact CD2-CE2 3.44Å; F367-F552 HydrophobicContact CD2-CZ 4.49Å; F367-F552 AromaticContact CE2-CD2 3.97Å; F367-F552 HydrophobicContact CE2-CD2 3.97Å; F367-F552 AromaticContact CE2-CE2 3.29Å; F367-F552 HydrophobicContact CE2-CE2 3.29Å; F367-F552 AromaticContact CE2-CZ 3.98Å; F367-F552 HydrophobicContact CE2-CZ 3.98Å; F367-F552 HydrophobicContact CZ-CE2 4.28Å; F539-F552 HydrophobicContact CE2-CZ 4.42Å; F539-F552 HydrophobicContact CZ-CZ 4.29Å; R548-F552 WeakPolarHBondContact O-CD2 3.38Å; R548-F552 PolarHBondContact O-N 2.82Å; H549-F552 PolarHBondContact O-N 3.12Å; F552-F554 VanDerWaalsContact C-N 3.34Å; F552-Y555 PolarHBondContact O-N 3.34Å; F552-A556 PolarHBondContact O-N 3.36Å
553	F	97.8	Very high	95.4	Very high	73 Å²	73	40.5 Å²	40.5	32%	0.32	22%	0.224	S	C	.	.	H	α-helix	trans	-64.8	-38	172.2	-68.4	-45.1	0	0	0	112.2	V361 G364 I365 H549 G550 A556 V557	V361-F553 HydrophobicContact CG1-CE1 4.33Å; G364-F553 VanDerWaalsContact C-CZ 3.44Å; I365-F553 HydrophobicContact CG1-CE1 4.36Å; I365-F553 HydrophobicContact CG1-CZ 4.2Å; H549-F553 HydrophobicContact CB-CE2 4.17Å; H549-F553 WeakPolarHBondContact O-CD2 3.34Å; H549-F553 WeakPolarHBondContact O-CG 3.44Å; H549-F553 PolarHBondContact O-N 3.11Å; G550-F553 PolarHBondContact O-N 3.37Å; F553-A556 WeakPolarHBondContact O-CB 3.46Å; F553-A556 PolarHBondContact O-N 3.47Å; F553-V557 WeakPolarHBondContact O-CG2 3.47Å; F553-V557 PolarHBondContact O-N 3.4Å
554	F	96.4	Very high	95.8	Very high	102 Å²	102	42.6 Å²	42.6	45%	0.447	24%	0.242	S	C	.	.	H	α-helix	trans	-58.6	-49.8	173	172.3	-98.3	0	0	0	111.3	L542 G550 A551 F552 A556 V557 V558	L542-F554 HydrophobicContact CD2-CD1 3.94Å; L542-F554 HydrophobicContact CD2-CE1 4.42Å; G550-F554 WeakPolarHBondContact O-CB 3.36Å; G550-F554 PolarHBondContact O-N 3.39Å; A551-F554 WeakPolarHBondContact O-CB 3.3Å; A551-F554 PolarHBondContact O-N 3.5Å; F552-F554 VanDerWaalsContact C-N 3.34Å; F554-A556 VanDerWaalsContact C-N 3.28Å; F554-A556 PolarHBondContact O-N 2.91Å; F554-V557 PolarHBondContact O-N 3.28Å; F554-V558 HydrophobicContact CD1-CG2 4.46Å; F554-V558 HydrophobicContact CD2-CG2 4.49Å; F554-V558 HydrophobicContact CE1-CG2 4.05Å; F554-V558 HydrophobicContact CE2-CG2 4.08Å; F554-V558 HydrophobicContact CZ-CG2 3.84Å; F554-V558 WeakPolarHBondContact O-CG2 3.48Å; F554-V558 PolarHBondContact O-N 3.47Å
555	Y	96.3	Very high	96.4	Very high	5 Å²	5	39.7 Å²	39.7	2%	0.02	23%	0.234	C	C	.	.	H	α-helix	trans	-62.5	-33.3	176	-65.6	-41.3	0	0	0	113.1	L293 V535 F539 L542 A551 F552 S559	L293-Y555 WeakPolarHBondContact O-CD1 2.9Å; V535-Y555 HydrophobicContact CG1-CE1 4.19Å; V535-Y555 WeakPolarHBondContact CG1-OH 3.32Å; F539-Y555 AromaticContact CD2-CE2 3.88Å; F539-Y555 HydrophobicContact CD2-CE2 3.88Å; F539-Y555 HydrophobicContact CE2-CE2 4.13Å; L542-Y555 HydrophobicContact CD2-CE1 4.47Å; A551-Y555 WeakPolarHBondContact O-CD2 3.38Å; A551-Y555 PolarHBondContact O-N 3.35Å; F552-Y555 PolarHBondContact O-N 3.34Å; Y555-S559 VanDerWaalsContact O-CB 3.25Å; Y555-S559 WeakPolarHBondContact O-CB 2.87Å; Y555-S559 PolarHBondContact O-N 3.21Å; Y555-S559 PolarHBondContact O-OG 3.48Å
556	A	98.1	Very high	96.8	Very high	6 Å²	6	36 Å²	36	5%	0.05	20%	0.203	C	C	.	.	H	α-helix	trans	-64.1	-43.6	174.5	0	0	0	0	0	111.9	L360 V361 F552 F553 F554 S559 A560	L360-A556 HydrophobicContact CB-CB 3.82Å; L360-A556 HydrophobicContact CD1-CB 4.49Å; V361-A556 HydrophobicContact CG2-CB 3.97Å; F552-A556 PolarHBondContact O-N 3.36Å; F553-A556 WeakPolarHBondContact O-CB 3.46Å; F553-A556 PolarHBondContact O-N 3.47Å; F554-A556 VanDerWaalsContact C-N 3.28Å; F554-A556 PolarHBondContact O-N 2.91Å; A556-S559 PolarHBondContact O-N 2.95Å; A556-A560 PolarHBondContact O-N 3.46Å
557	V	98.2	Very high	97.1	Very high	91 Å²	91	38 Å²	38	55%	0.552	21%	0.206	S	C	*	.	H	α-helix	trans	-64.4	-46.4	177	171.5	0	0	0	0	111	F553 F554 S559 A560 I561	F553-V557 WeakPolarHBondContact O-CG2 3.47Å; F553-V557 PolarHBondContact O-N 3.4Å; F554-V557 PolarHBondContact O-N 3.28Å; V557-S559 VanDerWaalsContact C-N 3.29Å; V557-S559 PolarHBondContact O-N 3.09Å; V557-A560 WeakPolarHBondContact O-CB 3.27Å; V557-A560 PolarHBondContact O-N 2.02Å; V557-A560 VanDerWaalsContact O-N 3.13Å; V557-I561 HydrophobicContact CG1-CD1 4.49Å; V557-I561 WeakPolarHBondContact O-CG1 3.35Å; V557-I561 PolarHBondContact O-N 2.82Å
558	V	97.3	Very high	97.2	Very high	21 Å²	21	40 Å²	40	13%	0.127	22%	0.215	C	C	.	.	H	α-helix	trans	-62.8	-39.3	178	178.5	0	0	0	0	111.1	F290 L293 F554 A560 I561 G562	F290-V558 HydrophobicContact CD1-CG1 4.12Å; F290-V558 WeakPolarHBondContact CD1-O 3.39Å; F290-V558 HydrophobicContact CE1-CG1 4.06Å; F290-V558 WeakPolarHBondContact CE1-O 3.45Å; L293-V558 HydrophobicContact CB-CG1 3.63Å; L293-V558 HydrophobicContact CD1-CG1 3.89Å; L293-V558 HydrophobicContact CG-CG1 4.37Å; F554-V558 HydrophobicContact CD1-CG2 4.46Å; F554-V558 HydrophobicContact CD2-CG2 4.49Å; F554-V558 HydrophobicContact CE1-CG2 4.05Å; F554-V558 HydrophobicContact CE2-CG2 4.08Å; F554-V558 HydrophobicContact CZ-CG2 3.84Å; F554-V558 WeakPolarHBondContact O-CG2 3.48Å; F554-V558 PolarHBondContact O-N 3.47Å; V558-A560 VanDerWaalsContact C-N 3.34Å; V558-A560 PolarHBondContact O-N 3.3Å; V558-I561 WeakPolarHBondContact O-CB 3.45Å; V558-I561 PolarHBondContact O-N 3.46Å; V558-G562 PolarHBondContact O-N 2.04Å
559	S	98	Very high	97.3	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.014	22%	0.22	C	C	.	.	H	α-helix	trans	-64.5	-35.7	174.4	-60.8	0	0	0	0	112.5	S294 Y555 A556 V557 G562 L563	S294-S559 WeakPolarHBondContact CA-OG 3.48Å; S294-S559 WeakPolarHBondContact CB-OG 3.38Å; Y555-S559 VanDerWaalsContact O-CB 3.25Å; Y555-S559 WeakPolarHBondContact O-CB 2.87Å; Y555-S559 PolarHBondContact O-N 3.21Å; Y555-S559 PolarHBondContact O-OG 3.48Å; A556-S559 PolarHBondContact O-N 2.95Å; V557-S559 VanDerWaalsContact C-N 3.29Å; V557-S559 PolarHBondContact O-N 3.09Å; S559-G562 PolarHBondContact O-N 3.16Å; S559-L563 PolarHBondContact O-N 3.26Å
560	A	98.5	Very high	97.3	Very high	43 Å²	43	38.8 Å²	38.8	36%	0.355	21%	0.21	S	C	.	.	H	α-helix	trans	-66.5	-37.1	174.7	0	0	0	0	0	112.6	I357 A556 V557 V558 G562 L563 A564	I357-A560 HydrophobicContact CD1-CB 4.07Å; A556-A560 PolarHBondContact O-N 3.46Å; V557-A560 WeakPolarHBondContact O-CB 3.27Å; V557-A560 PolarHBondContact O-N 2.02Å; V557-A560 VanDerWaalsContact O-N 3.13Å; V558-A560 VanDerWaalsContact C-N 3.34Å; V558-A560 PolarHBondContact O-N 3.3Å; A560-G562 VanDerWaalsContact C-N 3.34Å; A560-L563 PolarHBondContact O-N 3.14Å; A560-A564 PolarHBondContact O-N 2.85Å; A560-A564 VanDerWaalsContact O-N 3.11Å
561	I	98.4	Very high	97.2	Very high	87 Å²	87	38.1 Å²	38.1	45%	0.446	20%	0.203	S	C	.	.	H	α-helix	trans	-62.8	-44.7	170.9	-63.1	168.3	0	0	0	110	F290 V557 V558 L563 A564 I565	F290-I561 HydrophobicContact CE1-CB 4.14Å; F290-I561 HydrophobicContact CE1-CG2 3.91Å; F290-I561 HydrophobicContact CZ-CG2 3.86Å; V557-I561 HydrophobicContact CG1-CD1 4.49Å; V557-I561 WeakPolarHBondContact O-CG1 3.35Å; V557-I561 PolarHBondContact O-N 2.82Å; V558-I561 WeakPolarHBondContact O-CB 3.45Å; V558-I561 PolarHBondContact O-N 3.46Å; I561-L563 PolarHBondContact O-N 3.2Å; I561-A564 PolarHBondContact O-N 3.34Å; I561-I565 HydrophobicContact CG2-CD1 4.03Å; I561-I565 WeakPolarHBondContact O-CG1 3.44Å; I561-I565 PolarHBondContact O-N 3.24Å
562	G	98.3	Very high	97.1	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-56.6	-46.4	174.3	0	0	0	0	0	112.8	V558 S559 A560 A564 I565 F566	V558-G562 PolarHBondContact O-N 2.04Å; S559-G562 PolarHBondContact O-N 3.16Å; A560-G562 VanDerWaalsContact C-N 3.34Å; G562-A564 VanDerWaalsContact C-N 3.35Å; G562-A564 PolarHBondContact O-N 3.34Å; G562-I565 PolarHBondContact O-N 3.14Å; G562-F566 WeakPolarHBondContact O-CB 3.28Å; G562-F566 WeakPolarHBondContact O-CD1 3.43Å; G562-F566 WeakPolarHBondContact O-CG 3.25Å; G562-F566 PolarHBondContact O-N 3.4Å
563	L	98.5	Very high	96.7	Very high	37 Å²	37	40 Å²	40	19%	0.194	21%	0.212	C	C	.	.	H	α-helix	trans	-56.9	-45.9	176	176.1	63.8	0	0	0	112.1	L350 T353 I354 I357 S559 A560 I561 I565 F566 Y567	L350-L563 HydrophobicContact CB-CD1 4.38Å; L350-L563 HydrophobicContact CD2-CD1 3.75Å; T353-L563 HydrophobicContact CG2-CB 3.79Å; T353-L563 HydrophobicContact CG2-CD1 4.16Å; T353-L563 HydrophobicContact CG2-CG 4.49Å; I354-L563 HydrophobicContact CD1-CD2 4.5Å; I354-L563 HydrophobicContact CG1-CD1 4.14Å; I354-L563 HydrophobicContact CG1-CD2 3.64Å; I357-L563 HydrophobicContact CD1-CB 4.1Å; I357-L563 HydrophobicContact CD1-CD2 3.83Å; S559-L563 PolarHBondContact O-N 3.26Å; A560-L563 PolarHBondContact O-N 3.14Å; I561-L563 PolarHBondContact O-N 3.2Å; L563-I565 VanDerWaalsContact C-N 3.34Å; L563-I565 PolarHBondContact O-N 3.44Å; L563-F566 PolarHBondContact O-N 2.68Å; L563-Y567 WeakPolarHBondContact O-CB 3.36Å; L563-Y567 PolarHBondContact O-N 3.27Å
564	A	98.3	Very high	96.1	Very high	52 Å²	52	40.7 Å²	40.7	43%	0.43	21%	0.214	S	C	.	.	H	α-helix	trans	-61.6	-43.7	178.4	0	0	0	0	0	111.3	A560 I561 G562 Y567 L568	A560-A564 PolarHBondContact O-N 2.85Å; A560-A564 VanDerWaalsContact O-N 3.11Å; I561-A564 PolarHBondContact O-N 3.34Å; G562-A564 VanDerWaalsContact C-N 3.35Å; G562-A564 PolarHBondContact O-N 3.34Å; A564-Y567 PolarHBondContact O-N 3.19Å; A564-L568 VanDerWaalsContact O-CG 3.26Å; A564-L568 WeakPolarHBondContact O-CG 3.1Å; A564-L568 PolarHBondContact O-N 3.25Å
565	I	97.9	Very high	95.1	Very high	43 Å²	43	39.4 Å²	39.4	22%	0.221	23%	0.23	C	C	.	.	H	α-helix	trans	-63.5	-49.2	176.3	-70.4	168.4	0	0	0	110.5	L286 F290 I561 G562 L563 Y567 L568 I569	L286-I565 HydrophobicContact CD1-CG2 4.09Å; F290-I565 HydrophobicContact CD2-CD1 4.33Å; F290-I565 HydrophobicContact CE2-CD1 3.36Å; F290-I565 HydrophobicContact CZ-CD1 3.54Å; I561-I565 HydrophobicContact CG2-CD1 4.03Å; I561-I565 WeakPolarHBondContact O-CG1 3.44Å; I561-I565 PolarHBondContact O-N 3.24Å; G562-I565 PolarHBondContact O-N 3.14Å; L563-I565 VanDerWaalsContact C-N 3.34Å; L563-I565 PolarHBondContact O-N 3.44Å; I565-Y567 VanDerWaalsContact C-N 3.28Å; I565-Y567 PolarHBondContact O-N 3.17Å; I565-L568 PolarHBondContact O-N 2.82Å; I565-I569 HydrophobicContact CG2-CD1 3.63Å; I565-I569 HydrophobicContact CG2-CG1 4.07Å; I565-I569 WeakPolarHBondContact O-CG1 3.29Å; I565-I569 PolarHBondContact O-N 3.41Å
566	F	98	Very high	94.3	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.009	24%	0.237	C	C	.	.	H	α-helix	trans	-57.3	-43	179.1	-64	-14.4	0	0	0	111.7	L287 F290 L349 L350 L500 G562 L563 L568 V570	L287-F566 HydrophobicContact CD2-CD1 3.96Å; L287-F566 HydrophobicContact CD2-CE1 3.75Å; L287-F566 HydrophobicContact CD2-CG 4.48Å; L287-F566 HydrophobicContact CD2-CZ 4.05Å; L287-F566 HydrophobicContact CG-CE1 4.31Å; F290-F566 HydrophobicContact CB-CE1 4Å; F290-F566 HydrophobicContact CB-CE2 4.34Å; F290-F566 HydrophobicContact CB-CZ 3.54Å; F290-F566 HydrophobicContact CD2-CE1 4.42Å; L349-F566 HydrophobicContact CD1-CD2 4.26Å; L349-F566 HydrophobicContact CD1-CE2 4.25Å; L349-F566 HydrophobicContact CD2-CB 4.24Å; L349-F566 HydrophobicContact CD2-CD2 4.08Å; L349-F566 HydrophobicContact CD2-CG 4.12Å; L349-F566 HydrophobicContact CG-CD2 4.09Å; L350-F566 HydrophobicContact CD2-CB 3.9Å; L500-F566 HydrophobicContact CD1-CE2 3.85Å; L500-F566 HydrophobicContact CD1-CZ 4.48Å; G562-F566 WeakPolarHBondContact O-CB 3.28Å; G562-F566 WeakPolarHBondContact O-CD1 3.43Å; G562-F566 WeakPolarHBondContact O-CG 3.25Å; G562-F566 PolarHBondContact O-N 3.4Å; L563-F566 PolarHBondContact O-N 2.68Å; F566-L568 VanDerWaalsContact C-N 3.26Å; F566-L568 PolarHBondContact O-N 3.03Å; F566-V570 HydrophobicContact CB-CG2 4.08Å; F566-V570 HydrophobicContact CD1-CG2 4Å; F566-V570 HydrophobicContact CG-CG2 4.32Å; F566-V570 WeakPolarHBondContact O-CB 3.27Å; F566-V570 PolarHBondContact O-N 3.45Å; F566-V570 VanDerWaalsContact O-N 3.15Å
567	Y	97.6	Very high	93.2	Very high	129 Å²	129	43.2 Å²	43.2	51%	0.506	25%	0.249	S	C	.	.	H	α-helix	trans	-59.4	-38.9	177.2	177.4	-97.4	0	0	0	112.2	R346 L350 L563 A564 I565	R346-Y567 PolarHBondContact NH2-O 3.3Å; L350-Y567 HydrophobicContact CD1-CD2 4.05Å; L563-Y567 WeakPolarHBondContact O-CB 3.36Å; L563-Y567 PolarHBondContact O-N 3.27Å; A564-Y567 PolarHBondContact O-N 3.19Å; I565-Y567 VanDerWaalsContact C-N 3.28Å; I565-Y567 PolarHBondContact O-N 3.17Å
568	L	96.9	Very high	91.9	Very high	76 Å²	76	39.2 Å²	39.2	40%	0.398	22%	0.224	S	C	.	.	H	α-helix	trans	-79.2	-41.8	-175.4	-69.1	172.7	0	0	0	113.8	A564 I565 F566 R590 Y591	A564-L568 VanDerWaalsContact O-CG 3.26Å; A564-L568 WeakPolarHBondContact O-CG 3.1Å; A564-L568 PolarHBondContact O-N 3.25Å; I565-L568 PolarHBondContact O-N 2.82Å; F566-L568 VanDerWaalsContact C-N 3.26Å; F566-L568 PolarHBondContact O-N 3.03Å; L568-R590 WeakPolarHBondContact O-CA 3.24Å; L568-Y591 PolarHBondContact O-N 3.27Å
569	I	96.2	Very high	90.9	Very high	24 Å²	24	40.6 Å²	40.6	12%	0.123	23%	0.229	C	C	.	.	H	α-helix	trans	-115.5	-23.7	-165.8	74.4	178.2	0	0	0	115.2	I283 L286 I565 P571	I283-I569 HydrophobicContact CG1-CB 4.41Å; I283-I569 HydrophobicContact CG1-CD1 3.98Å; I283-I569 HydrophobicContact CG1-CG1 4.11Å; L286-I569 HydrophobicContact CD1-CD1 3.53Å; I565-I569 HydrophobicContact CG2-CD1 3.63Å; I565-I569 HydrophobicContact CG2-CG1 4.07Å; I565-I569 WeakPolarHBondContact O-CG1 3.29Å; I565-I569 PolarHBondContact O-N 3.41Å; I569-P571 WeakPolarHBondContact O-CD 3.37Å
570	V	96.1	Very high	90	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.006	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-76.2	122.4	-172.5	176.3	0	0	0	0	110.1	I283 L287 R346 L349 I507 F566	I283-V570 HydrophobicContact CG2-CG2 4.26Å; L287-V570 HydrophobicContact CD1-CG2 4.49Å; L287-V570 HydrophobicContact CD2-CG2 3.85Å; L287-V570 HydrophobicContact CG-CG2 4.2Å; R346-V570 WeakPolarHBondContact CD-O 3.49Å; R346-V570 PolarHBondContact NE-O 3.25Å; L349-V570 HydrophobicContact CD2-CB 4.42Å; L349-V570 HydrophobicContact CD2-CG1 3.92Å; L349-V570 HydrophobicContact CD2-CG2 4.27Å; I507-V570 HydrophobicContact CD1-CG1 3.7Å; F566-V570 HydrophobicContact CB-CG2 4.08Å; F566-V570 HydrophobicContact CD1-CG2 4Å; F566-V570 HydrophobicContact CG-CG2 4.32Å; F566-V570 WeakPolarHBondContact O-CB 3.27Å; F566-V570 PolarHBondContact O-N 3.45Å; F566-V570 VanDerWaalsContact O-N 3.15Å
571	P	93.8	Very high	89.3	Confident	3 Å²	3	39.3 Å²	39.3	2%	0.019	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-80.4	162.9	178.8	33.3	-34.3	0	0	0	112	I569 T573 I584 M585 Y591	I569-P571 WeakPolarHBondContact O-CD 3.37Å; P571-T573 HydrophobicContact CG-CG2 4.44Å; P571-I584 HydrophobicContact CB-CG2 3.86Å; P571-M585 HydrophobicContact CG-CE 3.8Å; P571-Y591 HydrophobicContact CB-CD2 3.75Å; P571-Y591 HydrophobicContact CB-CE2 3.78Å; P571-Y591 HydrophobicContact CB-CG 4.45Å
572	E	92.4	Very high	88.6	Confident	41 Å²	41	37.6 Å²	37.6	19%	0.192	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-81.9	127.6	163.6	-177.4	56.5	-109.7	0	0	109	R345 R346 K574 Y591	R345-E572 PolarHBondContact N-OE1 2.65Å; R345-E572 PolarHBondContact N-OE2 2.89Å; R345-E572 VanDerWaalsContact N-OE2 3.15Å; R346-E572 HydrophobicContact CB-CB 4.43Å; R346-E572 WeakPolarHBondContact CB-OE2 3.47Å; R346-E572 PolarHBondContact N-OE2 3.33Å; E572-K574 HydrophobicContact CG-CB 4.32Å; E572-K574 WeakPolarHBondContact OE1-CB 3.43Å; E572-K574 PolarHBondContact OE1-N 3.37Å; E572-Y591 WeakPolarHBondContact CB-OH 3.4Å; E572-Y591 PolarHBondContact N-OH 3.09Å
573	T	88.8	Confident	87.9	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.012	22%	0.215	C	C	.	.			trans	-110.2	-10	-179.7	60.2	0	0	0	0	112.8	I507 E510 I511 P571 G575 V576 I581	I507-T573 HydrophobicContact CG2-CG2 4.37Å; E510-T573 WeakPolarHBondContact OE2-CB 3.25Å; E510-T573 PolarHBondContact OE2-OG1 3.45Å; I511-T573 HydrophobicContact CG2-CG2 3.97Å; P571-T573 HydrophobicContact CG-CG2 4.44Å; T573-G575 PolarHBondContact O-N 3.44Å; T573-V576 WeakPolarHBondContact O-CB 3.47Å; T573-V576 PolarHBondContact O-N 3.19Å; T573-V576 VanDerWaalsContact O-N 3.09Å; T573-I581 HydrophobicContact CG2-CD1 4.25Å
574	K	84.1	Confident	87.4	Confident	86 Å²	86	38 Å²	38	37%	0.374	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	124	179.4	178.4	177.9	163.9	-171.6	0	111.1	E341 R342 E572 V576	E341-K574 WeakPolarHBondContact O-CE 3.21Å; E341-K574 PolarHBondContact O-NZ 3.41Å; R342-K574 PolarHBondContact O-NZ 2.89Å; E572-K574 HydrophobicContact CG-CB 4.32Å; E572-K574 WeakPolarHBondContact OE1-CB 3.43Å; E572-K574 PolarHBondContact OE1-N 3.37Å; K574-V576 PolarHBondContact O-N 3.49Å
575	G	75.3	Confident	87	Confident	76 Å²	76	35.7 Å²	35.7	78%	0.784	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.1	7.8	175.6	0	0	0	0	0	114.6	T573	T573-G575 PolarHBondContact O-N 3.44Å
576	V	80.1	Confident	86.5	Confident	27 Å²	27	39 Å²	39	16%	0.164	20%	0.201	C	C	.	.			trans	-87.6	126.5	176.7	-176.5	0	0	0	0	108.8	T573 K574 D580 I581 I584 L600	T573-V576 WeakPolarHBondContact O-CB 3.47Å; T573-V576 PolarHBondContact O-N 3.19Å; T573-V576 VanDerWaalsContact O-N 3.09Å; K574-V576 PolarHBondContact O-N 3.49Å; V576-D580 HydrophobicContact CG1-CB 4.16Å; V576-I581 HydrophobicContact CG1-CD1 4.09Å; V576-I584 HydrophobicContact CG1-CD1 4.01Å; V576-I584 HydrophobicContact CG2-CD1 3.94Å; V576-L600 HydrophobicContact CG1-CD2 4.04Å; V576-L600 HydrophobicContact CG2-CD1 3.89Å
577	H	74.3	Confident	85.9	Confident	64 Å²	64	39.7 Å²	39.7	30%	0.296	21%	0.209	S	C	.	.			trans	-63.6	146	172.4	-80.2	-100.1	0	0	0	110.5	E579 D580 I581	H577-E579 PolarHBondContact O-N 3.33Å; H577-D580 HydrophobicContact CB-CB 4.36Å; H577-D580 PolarHBondContact O-N 2.84Å; H577-I581 PolarHBondContact O-N 3.43Å
578	I	71.4	Confident	85.4	Confident	6 Å²	6	36.2 Å²	36.2	3%	0.031	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-35.7	-179.8	-84.7	174.9	0	0	0	111.1	N514 D580 I581	N514-I578 VanDerWaalsContact OD1-CG2 3.3Å; N514-I578 WeakPolarHBondContact OD1-CG2 3.44Å; I578-D580 VanDerWaalsContact C-N 3.25Å; I578-D580 PolarHBondContact O-N 3.31Å; I578-I581 WeakPolarHBondContact O-CG2 3.04Å
579	E	75.9	Confident	85.2	Confident	50 Å²	50	37.8 Å²	37.8	23%	0.234	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-14.7	-177.9	-62.6	69.1	-149.9	0	0	112.3	R212 N514 H577 R603	R212-E579 IonicContact NH1-OE1 2.82Å; N514-E579 PolarHBondContact ND2-OE1 2.8Å; H577-E579 PolarHBondContact O-N 3.33Å; E579-R603 PolarHBondContact O-NH1 2.8Å
580	D	80.2	Confident	85	Confident	16 Å²	16	44.7 Å²	44.7	9%	0.086	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-14	179.6	-70.3	-27.4	0	0	0	113.7	V576 H577 I578 E582 L583 L600 R603	V576-D580 HydrophobicContact CG1-CB 4.16Å; H577-D580 HydrophobicContact CB-CB 4.36Å; H577-D580 PolarHBondContact O-N 2.84Å; I578-D580 VanDerWaalsContact C-N 3.25Å; I578-D580 PolarHBondContact O-N 3.31Å; D580-E582 PolarHBondContact O-N 2.62Å; D580-E582 VanDerWaalsContact O-N 3.11Å; D580-L583 VanDerWaalsContact O-CB 3.27Å; D580-L583 WeakPolarHBondContact O-CB 3.3Å; D580-L583 PolarHBondContact O-N 2.84Å; D580-L600 HydrophobicContact CB-CD2 4.09Å; D580-R603 WeakPolarHBondContact OD1-CD 3.4Å; D580-R603 IonicContact OD1-CZ 2.99Å; D580-R603 IonicContact OD1-NE 2.94Å; D580-R603 PolarHBondContact OD1-NE 2.03Å; D580-R603 IonicContact OD1-NH1 3.17Å; D580-R603 PolarHBondContact OD1-NH1 2.86Å; D580-R603 VanDerWaalsContact OD1-NH1 3.17Å; D580-R603 IonicContact OD1-NH2 3.63Å
581	I	83.1	Confident	84.8	Confident	3 Å²	3	46.5 Å²	46.5	2%	0.015	24%	0.236	C	C	.	.	H	α-helix	trans	-59.8	-29.9	-176.2	-158.1	48.2	0	0	0	112.1	T573 V576 H577 I578 L583 I584 M585	T573-I581 HydrophobicContact CG2-CD1 4.25Å; V576-I581 HydrophobicContact CG1-CD1 4.09Å; H577-I581 PolarHBondContact O-N 3.43Å; I578-I581 WeakPolarHBondContact O-CG2 3.04Å; I581-L583 PolarHBondContact O-N 3.34Å; I581-I584 HydrophobicContact CD1-CB 4.48Å; I581-I584 HydrophobicContact CD1-CD1 4.1Å; I581-I584 PolarHBondContact O-N 2.79Å; I581-I584 VanDerWaalsContact O-N 3.08Å; I581-M585 HydrophobicContact CD1-CE 4.16Å; I581-M585 HydrophobicContact CG1-CE 4.08Å; I581-M585 WeakPolarHBondContact O-CG 3.43Å; I581-M585 PolarHBondContact O-N 3.22Å
582	E	84.5	Confident	84.6	Confident	51 Å²	51	50 Å²	50	24%	0.238	26%	0.255	C	S	.	.	H	α-helix	trans	-58.4	-31.7	175.2	-64.1	-169.3	157.8	0	0	112.5	P513 D580 I584 M585 K586	P513-E582 HydrophobicContact CB-CG 4.19Å; P513-E582 WeakPolarHBondContact CB-OE1 3.42Å; D580-E582 PolarHBondContact O-N 2.62Å; D580-E582 VanDerWaalsContact O-N 3.11Å; E582-I584 VanDerWaalsContact C-N 3.33Å; E582-I584 PolarHBondContact O-N 2.92Å; E582-M585 PolarHBondContact O-N 3.03Å; E582-K586 VanDerWaalsContact O-CG 3.28Å; E582-K586 WeakPolarHBondContact O-CG 3.18Å; E582-K586 PolarHBondContact O-N 3.31Å
583	L	83.3	Confident	84.5	Confident	36 Å²	36	50.2 Å²	50.2	19%	0.188	26%	0.264	C	S	.	.	H	α-helix	trans	-64.2	-39.7	176.7	-64.2	178.3	0	0	0	112	D580 I581 R603	D580-L583 VanDerWaalsContact O-CB 3.27Å; D580-L583 WeakPolarHBondContact O-CB 3.3Å; D580-L583 PolarHBondContact O-N 2.84Å; I581-L583 PolarHBondContact O-N 3.34Å; L583-R603 HydrophobicContact CD1-CB 3.86Å; L583-R603 VanDerWaalsContact CD1-CD 3.41Å; L583-R603 HydrophobicContact CD1-CG 4.28Å
584	I	86.2	Confident	84.4	Confident	10 Å²	10	60.6 Å²	60.6	5%	0.051	30%	0.303	C	S	.	.	H	α-helix	trans	-72.2	-37.3	177.2	-55.3	-178.6	0	0	0	109.6	K279 P571 V576 I581 E582 G587 Y591 L600	K279-I584 PolarHBondContact NZ-O 3.16Å; P571-I584 HydrophobicContact CB-CG2 3.86Å; V576-I584 HydrophobicContact CG1-CD1 4.01Å; V576-I584 HydrophobicContact CG2-CD1 3.94Å; I581-I584 HydrophobicContact CD1-CB 4.48Å; I581-I584 HydrophobicContact CD1-CD1 4.1Å; I581-I584 PolarHBondContact O-N 2.79Å; I581-I584 VanDerWaalsContact O-N 3.08Å; E582-I584 VanDerWaalsContact C-N 3.33Å; E582-I584 PolarHBondContact O-N 2.92Å; I584-G587 PolarHBondContact O-N 2.68Å; I584-Y591 HydrophobicContact CG2-CE2 4.36Å; I584-L600 HydrophobicContact CD1-CD1 4.18Å; I584-L600 HydrophobicContact CD1-CD2 4.42Å
585	M	91.1	Very high	84.6	Confident	3 Å²	3	60.8 Å²	60.8	2%	0.015	31%	0.305	C	S	.	.	H	α-helix	trans	-70.6	-33.6	-179.7	-64.1	-57.8	163.2	0	0	113.1	E276 K279 A280 I283 I511 P571 I581 E582 G587	E276-M585 HydrophobicContact CB-CB 4.03Å; E276-M585 HydrophobicContact CG-CB 4.24Å; K279-M585 WeakPolarHBondContact CD-O 2.97Å; K279-M585 HydrophobicContact CD-SD 4.17Å; K279-M585 HydrophobicContact CG-SD 4.43Å; K279-M585 PolarHBondContact NZ-O 3.1Å; A280-M585 HydrophobicContact CB-CG 4.48Å; A280-M585 HydrophobicContact CB-SD 4.27Å; I283-M585 HydrophobicContact CD1-SD 4.32Å; I511-M585 HydrophobicContact CB-CE 3.68Å; I511-M585 HydrophobicContact CG2-CE 3.52Å; P571-M585 HydrophobicContact CG-CE 3.8Å; I581-M585 HydrophobicContact CD1-CE 4.16Å; I581-M585 HydrophobicContact CG1-CE 4.08Å; I581-M585 WeakPolarHBondContact O-CG 3.43Å; I581-M585 PolarHBondContact O-N 3.22Å; E582-M585 PolarHBondContact O-N 3.03Å; M585-G587 PolarHBondContact O-N 3.4Å; M585-G587 VanDerWaalsContact O-N 3.14Å
586	K	87	Confident	85.2	Confident	112 Å²	112	57.5 Å²	57.5	49%	0.487	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-23.3	174.2	-78.2	173.5	-175.6	173.3	0	113.8	E276 E582	E276-K586 VanDerWaalsContact CD-CG 3.4Å; E276-K586 HydrophobicContact CG-CB 4.22Å; E276-K586 HydrophobicContact CG-CD 4.39Å; E276-K586 HydrophobicContact CG-CG 3.32Å; E582-K586 VanDerWaalsContact O-CG 3.28Å; E582-K586 WeakPolarHBondContact O-CG 3.18Å; E582-K586 PolarHBondContact O-N 3.31Å
587	G	84.9	Confident	85.5	Confident	17 Å²	17	63.2 Å²	63.2	18%	0.175	29%	0.293	C	S	.	.	S	Bend	trans	-66.5	-173.8	-178.4	0	0	0	0	0	115.2	R275 K279 I584 M585	R275-G587 PolarHBondContact NH2-O 3.16Å; R275-G587 VanDerWaalsContact NH2-O 3.1Å; K279-G587 PolarHBondContact NZ-O 3.03Å; I584-G587 PolarHBondContact O-N 2.68Å; M585-G587 PolarHBondContact O-N 3.4Å; M585-G587 VanDerWaalsContact O-N 3.14Å
588	S	88.4	Confident	86	Confident	57 Å²	57	68 Å²	68	40%	0.399	31%	0.313	S	S	.	.			trans	-60.5	155.5	172.3	51.2	0	0	0	0	112.2	K279 R590	K279-S588 PolarHBondContact NZ-O 3.36Å; S588-R590 VanDerWaalsContact C-N 3.33Å; S588-R590 PolarHBondContact O-N 2.71Å; S588-R590 PolarHBondContact OG-O 2.91Å
589	W	91.2	Very high	86.6	Confident	108 Å²	108	70.3 Å²	70.3	41%	0.409	33%	0.325	S	S	.	.	S	Bend	trans	-59	-44.1	173.6	-83.1	96.9	0	0	0	112.5	K279 V282 Y591	K279-W589 HydrophobicContact CB-CH2 4.23Å; K279-W589 HydrophobicContact CB-CZ2 4.43Å; K279-W589 HydrophobicContact CB-CZ3 4.47Å; K279-W589 HydrophobicContact CG-CD2 4.37Å; K279-W589 HydrophobicContact CG-CE3 4.02Å; K279-W589 HydrophobicContact CG-CH2 4.17Å; K279-W589 HydrophobicContact CG-CZ2 4.5Å; K279-W589 HydrophobicContact CG-CZ3 3.91Å; V282-W589 HydrophobicContact CB-CH2 3.77Å; V282-W589 HydrophobicContact CB-CZ3 3.98Å; V282-W589 HydrophobicContact CG1-CH2 3.83Å; V282-W589 HydrophobicContact CG1-CZ3 3.72Å; V282-W589 HydrophobicContact CG2-CH2 4.02Å; W589-Y591 PolarHBondContact O-N 3.42Å
590	R	92.6	Very high	86.9	Confident	169 Å²	169	70 Å²	70	64%	0.638	33%	0.325	S	S	*	.	S	Bend	trans	-67.7	122.4	171.6	-171.7	176.6	-178.9	175.7	1.6	109	L568 S588	L568-R590 WeakPolarHBondContact O-CA 3.24Å; S588-R590 VanDerWaalsContact C-N 3.33Å; S588-R590 PolarHBondContact O-N 2.71Å; S588-R590 PolarHBondContact OG-O 2.91Å
591	Y	91.9	Very high	86.9	Confident	39 Å²	39	75.2 Å²	75.2	15%	0.153	35%	0.347	C	S	.	.			trans	-69.6	132.9	177.9	177.2	-114.7	0	0	0	110.8	L568 P571 E572 I584 W589 A593 A596	L568-Y591 PolarHBondContact O-N 3.27Å; P571-Y591 HydrophobicContact CB-CD2 3.75Å; P571-Y591 HydrophobicContact CB-CE2 3.78Å; P571-Y591 HydrophobicContact CB-CG 4.45Å; E572-Y591 WeakPolarHBondContact CB-OH 3.4Å; E572-Y591 PolarHBondContact N-OH 3.09Å; I584-Y591 HydrophobicContact CG2-CE2 4.36Å; W589-Y591 PolarHBondContact O-N 3.42Å; Y591-A593 HydrophobicContact CE1-CB 3.95Å; Y591-A596 HydrophobicContact CE2-CB 3.84Å
592	N	90.7	Very high	86.7	Confident	76 Å²	76	78 Å²	78	41%	0.406	37%	0.367	S	S	.	.			trans	-127.8	106.4	174.6	-175.7	-24.9	0	0	0	109.7	R594 Q595 A596	N592-R594 VanDerWaalsContact C-N 3.27Å; N592-R594 PolarHBondContact O-N 3.49Å; N592-R594 PolarHBondContact OD1-N 3.27Å; N592-Q595 HydrophobicContact CB-CB 4.03Å; N592-Q595 PolarHBondContact O-N 3.38Å; N592-Q595 PolarHBondContact OD1-N 3.33Å; N592-A596 PolarHBondContact O-N 3.23Å
593	A	88.6	Confident	85.9	Confident	47 Å²	47	79.3 Å²	79.3	39%	0.388	37%	0.369	S	S	.	.	H	α-helix	trans	-60	-34	-177	0	0	0	0	0	113.4	Y591 K597	Y591-A593 HydrophobicContact CE1-CB 3.95Å; A593-K597 WeakPolarHBondContact O-CB 3.42Å; A593-K597 WeakPolarHBondContact O-CG 3.28Å; A593-K597 PolarHBondContact O-N 3.37Å; A593-K597 VanDerWaalsContact O-N 3.1Å
594	R	88.2	Confident	84.9	Confident	220 Å²	220	78 Å²	78	83%	0.83	36%	0.364	S	S	*	.	H	α-helix	trans	-69.1	-41.9	178.9	-66	-177	-180	175.1	0.1	111	N592 K598	N592-R594 VanDerWaalsContact C-N 3.27Å; N592-R594 PolarHBondContact O-N 3.49Å; N592-R594 PolarHBondContact OD1-N 3.27Å; R594-K598 PolarHBondContact O-N 3.39Å; R594-K598 VanDerWaalsContact O-N 3.12Å
595	Q	87.7	Confident	83.4	Confident	89 Å²	89	85.2 Å²	85.2	42%	0.416	40%	0.397	S	S	.	.	H	α-helix	trans	-68.3	-43.1	178.4	-172.8	173.9	-0.2	0	0	111.7	N592 K598 L599	N592-Q595 HydrophobicContact CB-CB 4.03Å; N592-Q595 PolarHBondContact O-N 3.38Å; N592-Q595 PolarHBondContact OD1-N 3.33Å; Q595-K598 PolarHBondContact O-N 3.47Å; Q595-L599 HydrophobicContact CG-CD1 4.29Å; Q595-L599 WeakPolarHBondContact O-CG 3.21Å; Q595-L599 PolarHBondContact O-N 2.87Å
596	A	86.9	Confident	81.6	Confident	7 Å²	7	90.8 Å²	90.8	6%	0.058	43%	0.431	C	S	.	.	H	α-helix	trans	-59.2	-48.1	176.4	0	0	0	0	0	111.8	Y591 N592 K598 L599 L600	Y591-A596 HydrophobicContact CE2-CB 3.84Å; N592-A596 PolarHBondContact O-N 3.23Å; A596-K598 VanDerWaalsContact C-N 3.31Å; A596-K598 PolarHBondContact O-N 2.73Å; A596-L599 PolarHBondContact O-N 3.14Å; A596-L600 WeakPolarHBondContact O-CG 3.4Å; A596-L600 PolarHBondContact O-N 3Å; A596-L600 VanDerWaalsContact O-N 3.07Å
597	K	86.5	Confident	79.7	Confident	147 Å²	147	90.1 Å²	90.1	64%	0.639	43%	0.43	S	S	*	.	H	α-helix	trans	-59.1	-39.6	175.7	-75	-176	178.9	-169.3	0	112.7	A593 K601	A593-K597 WeakPolarHBondContact O-CB 3.42Å; A593-K597 WeakPolarHBondContact O-CG 3.28Å; A593-K597 PolarHBondContact O-N 3.37Å; A593-K597 VanDerWaalsContact O-N 3.1Å; K597-K601 WeakPolarHBondContact O-CB 3.46Å; K597-K601 WeakPolarHBondContact O-CG 3.4Å; K597-K601 PolarHBondContact O-N 3.09Å; K597-K601 VanDerWaalsContact O-N 3.1Å
598	K	85.6	Confident	77.7	Confident	164 Å²	164	92.1 Å²	92.1	71%	0.713	44%	0.44	S	S	*	.	H	α-helix	trans	-64.5	-43	177.7	-172.7	178.1	178.6	-179.4	0	112	R594 Q595 A596 S602	R594-K598 PolarHBondContact O-N 3.39Å; R594-K598 VanDerWaalsContact O-N 3.12Å; Q595-K598 PolarHBondContact O-N 3.47Å; A596-K598 VanDerWaalsContact C-N 3.31Å; A596-K598 PolarHBondContact O-N 2.73Å; K598-S602 PolarHBondContact O-N 3.14Å; K598-S602 VanDerWaalsContact O-N 3.1Å
599	L	84.4	Confident	75.6	Confident	56 Å²	56	93.1 Å²	93.1	29%	0.293	44%	0.443	S	S	.	.	H	α-helix	trans	-64.6	-46.2	179.1	-71.2	168.6	0	0	0	111.9	Q595 A596 S602 R603	Q595-L599 HydrophobicContact CG-CD1 4.29Å; Q595-L599 WeakPolarHBondContact O-CG 3.21Å; Q595-L599 PolarHBondContact O-N 2.87Å; A596-L599 PolarHBondContact O-N 3.14Å; L599-S602 PolarHBondContact O-N 2.82Å; L599-S602 PolarHBondContact O-OG 2.82Å; L599-R603 PolarHBondContact O-N 3.5Å
600	L	81.4	Confident	73.3	Confident	42 Å²	42	89 Å²	89	22%	0.22	43%	0.429	C	S	.	.	H	α-helix	trans	-62	-45.2	178	-67	171.2	0	0	0	111.7	V576 D580 I584 A596 S602 R603 A604	V576-L600 HydrophobicContact CG1-CD2 4.04Å; V576-L600 HydrophobicContact CG2-CD1 3.89Å; D580-L600 HydrophobicContact CB-CD2 4.09Å; I584-L600 HydrophobicContact CD1-CD1 4.18Å; I584-L600 HydrophobicContact CD1-CD2 4.42Å; A596-L600 WeakPolarHBondContact O-CG 3.4Å; A596-L600 PolarHBondContact O-N 3Å; A596-L600 VanDerWaalsContact O-N 3.07Å; L600-S602 VanDerWaalsContact C-N 3.27Å; L600-S602 PolarHBondContact O-N 3.44Å; L600-R603 PolarHBondContact O-N 3.05Å; L600-A604 PolarHBondContact O-N 3.24Å; L600-A604 VanDerWaalsContact O-N 3.09Å
601	K	81.1	Confident	71	Confident	127 Å²	127	85 Å²	85	55%	0.552	42%	0.423	S	S	*	.	H	α-helix	trans	-60.2	-35.5	175.5	-74.6	-169.8	177	-150.1	0	112.9	K597	K597-K601 WeakPolarHBondContact O-CB 3.46Å; K597-K601 WeakPolarHBondContact O-CG 3.4Å; K597-K601 PolarHBondContact O-N 3.09Å; K597-K601 VanDerWaalsContact O-N 3.1Å
602	S	77.9	Confident	68.6	Low	62 Å²	62	84 Å²	84	43%	0.434	42%	0.421	S	S	.	.	H	α-helix	trans	-70.9	-34.1	178.8	66.3	0	0	0	0	113.7	K598 L599 L600	K598-S602 PolarHBondContact O-N 3.14Å; K598-S602 VanDerWaalsContact O-N 3.1Å; L599-S602 PolarHBondContact O-N 2.82Å; L599-S602 PolarHBondContact O-OG 2.82Å; L600-S602 VanDerWaalsContact C-N 3.27Å; L600-S602 PolarHBondContact O-N 3.44Å
603	R	68.2	Low	66.3	Low	77 Å²	77	82.9 Å²	82.9	29%	0.291	42%	0.415	S	S	.	.	H	α-helix	trans	-71.6	-37.2	174.4	-176.9	152.5	179.7	-178	-1.5	111.6	E579 D580 L583 L599 L600 Q605 V606 H607	E579-R603 PolarHBondContact O-NH1 2.8Å; D580-R603 WeakPolarHBondContact OD1-CD 3.4Å; D580-R603 IonicContact OD1-CZ 2.99Å; D580-R603 IonicContact OD1-NE 2.94Å; D580-R603 PolarHBondContact OD1-NE 2.03Å; D580-R603 IonicContact OD1-NH1 3.17Å; D580-R603 PolarHBondContact OD1-NH1 2.86Å; D580-R603 VanDerWaalsContact OD1-NH1 3.17Å; D580-R603 IonicContact OD1-NH2 3.63Å; L583-R603 HydrophobicContact CD1-CB 3.86Å; L583-R603 VanDerWaalsContact CD1-CD 3.41Å; L583-R603 HydrophobicContact CD1-CG 4.28Å; L599-R603 PolarHBondContact O-N 3.5Å; L600-R603 PolarHBondContact O-N 3.05Å; R603-Q605 PolarHBondContact O-N 2.8Å; R603-Q605 VanDerWaalsContact O-N 3.12Å; R603-V606 PolarHBondContact O-N 2.96Å; R603-H607 PolarHBondContact O-N 3.08Å
604	A	61.9	Low	64	Low	9 Å²	9	84.3 Å²	84.3	7%	0.074	42%	0.416	C	S	.	.	H	α-helix	trans	-60.7	-23.8	178.3	0	0	0	0	0	114.7	L600 V606 D610 V611 N614	L600-A604 PolarHBondContact O-N 3.24Å; L600-A604 VanDerWaalsContact O-N 3.09Å; A604-V606 VanDerWaalsContact C-N 3.34Å; A604-D610 HydrophobicContact CB-CB 3.59Å; A604-D610 WeakPolarHBondContact O-CB 3.4Å; A604-V611 WeakPolarHBondContact O-CG2 3.34Å; A604-V611 PolarHBondContact O-N 2.75Å; A604-N614 WeakPolarHBondContact CB-ND2 3.29Å
605	Q	55.8	Low	61.8	Low	161 Å²	161	76.9 Å²	76.9	75%	0.752	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-13.8	176.1	-69.9	-178.6	-23.4	0	0	113.5	R603	R603-Q605 PolarHBondContact O-N 2.8Å; R603-Q605 VanDerWaalsContact O-N 3.12Å
606	V	53.3	Low	59.6	Low	120 Å²	120	74.4 Å²	74.4	73%	0.727	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-27.3	-176.6	-177.9	0	0	0	0	111.7	R603 A604	R603-V606 PolarHBondContact O-N 2.96Å; A604-V606 VanDerWaalsContact C-N 3.34Å
607	H	46.2	Very low	57.6	Low	98 Å²	98	75.9 Å²	75.9	45%	0.454	40%	0.404	S	S	.	.	S	Bend	trans	-102.8	127.6	177.7	-108.3	-76.7	0	0	0	112.1	R603 V609 D610 V611	R603-H607 PolarHBondContact O-N 3.08Å; H607-V609 PolarHBondContact O-N 3.32Å; H607-D610 HydrophobicContact CB-CB 4.44Å; H607-D610 WeakPolarHBondContact CB-OD2 3.43Å; H607-D610 PolarHBondContact O-N 2.8Å; H607-D610 VanDerWaalsContact O-N 3.13Å; H607-V611 PolarHBondContact O-N 3.09Å
608	P	42.1	Very low	55.5	Low	59 Å²	59	73.9 Å²	73.9	38%	0.383	40%	0.397	S	S	.	.	H	α-helix	trans	-63.5	-23.9	-179.1	21.4	-30.5	0	0	0	114	V10	V10-P608 HydrophobicContact CG1-CG 4.22Å
609	V	46.1	Very low	53.3	Low	79 Å²	79	72.4 Å²	72.4	48%	0.479	39%	0.393	S	S	.	.	H	α-helix	trans	-70	-35	176.3	-178.8	0	0	0	0	111.7	H607 I613	H607-V609 PolarHBondContact O-N 3.32Å; V609-I613 HydrophobicContact CG1-CD1 4.03Å; V609-I613 WeakPolarHBondContact O-CG1 3.42Å; V609-I613 PolarHBondContact O-N 3.46Å
610	D	42.5	Very low	51.1	Low	20 Å²	20	75.3 Å²	75.3	11%	0.107	41%	0.407	C	S	.	.	H	α-helix	trans	-82.6	-24.6	-175.6	-64.3	-30.3	0	0	0	113.6	A604 H607 V612 N614	A604-D610 HydrophobicContact CB-CB 3.59Å; A604-D610 WeakPolarHBondContact O-CB 3.4Å; H607-D610 HydrophobicContact CB-CB 4.44Å; H607-D610 WeakPolarHBondContact CB-OD2 3.43Å; H607-D610 PolarHBondContact O-N 2.8Å; H607-D610 VanDerWaalsContact O-N 3.13Å; D610-V612 VanDerWaalsContact C-N 3.25Å; D610-V612 PolarHBondContact O-N 2.81Å; D610-N614 PolarHBondContact O-N 2.95Å; D610-N614 PolarHBondContact O-ND2 3.17Å
611	V	43.2	Very low	49.3	Very low	86 Å²	86	80.1 Å²	80.1	52%	0.521	43%	0.428	S	S	.	.	H	α-helix	trans	-61	-39.3	171.6	177.8	0	0	0	0	110.1	A604 H607 S615	A604-V611 WeakPolarHBondContact O-CG2 3.34Å; A604-V611 PolarHBondContact O-N 2.75Å; H607-V611 PolarHBondContact O-N 3.09Å; V611-S615 PolarHBondContact O-N 2.94Å; V611-S615 PolarHBondContact O-OG 2.65Å
612	V	42.1	Very low	47.4	Very low	18 Å²	18	81.2 Å²	81.2	11%	0.109	43%	0.433	C	S	.	.	H	α-helix	trans	-74.8	-39.9	-179.8	-178.6	0	0	0	0	111.8	L16 D610 S615 V616	L16-V612 WeakPolarHBondContact O-CG1 3.48Å; D610-V612 VanDerWaalsContact C-N 3.25Å; D610-V612 PolarHBondContact O-N 2.81Å; V612-S615 PolarHBondContact O-OG 3.11Å; V612-V616 WeakPolarHBondContact O-CG2 3.44Å; V612-V616 PolarHBondContact O-N 2.81Å
613	I	42.9	Very low	45.6	Very low	52 Å²	52	83 Å²	83	27%	0.267	44%	0.441	S	S	.	.	H	α-helix	trans	-65.1	-42	-179.4	-67.2	166	0	0	0	111.7	L18 V609 G617	L18-I613 HydrophobicContact CD1-CD1 4.43Å; L18-I613 HydrophobicContact CD1-CG1 3.61Å; V609-I613 HydrophobicContact CG1-CD1 4.03Å; V609-I613 WeakPolarHBondContact O-CG1 3.42Å; V609-I613 PolarHBondContact O-N 3.46Å; I613-G617 PolarHBondContact O-N 3.01Å
614	N	40.4	Very low	44.1	Very low	78 Å²	78	84.1 Å²	84.1	42%	0.417	46%	0.456	S	S	.	.	H	α-helix	trans	-74.8	-31.5	-177.6	-74.3	-61.7	0	0	0	113.2	A604 D610 E618	A604-N614 WeakPolarHBondContact CB-ND2 3.29Å; D610-N614 PolarHBondContact O-N 2.95Å; D610-N614 PolarHBondContact O-ND2 3.17Å; N614-E618 PolarHBondContact O-N 3.44Å
615	S	40.6	Very low	42.7	Very low	63 Å²	63	94.5 Å²	94.5	44%	0.441	49%	0.494	S	S	.	.	H	α-helix	trans	-66.6	-41.5	173.8	56.7	0	0	0	0	111.6	V611 V612 E619	V611-S615 PolarHBondContact O-N 2.94Å; V611-S615 PolarHBondContact O-OG 2.65Å; V612-S615 PolarHBondContact O-OG 3.11Å; S615-E619 PolarHBondContact O-N 3.15Å; S615-E619 VanDerWaalsContact O-N 3.12Å
616	V	43.1	Very low	41.6	Very low	37 Å²	37	98.5 Å²	98.5	22%	0.224	51%	0.509	C	S	.	.	H	α-helix	trans	-69.9	-38.9	177.4	177.8	0	0	0	0	111.4	V612 E619 M620	V612-V616 WeakPolarHBondContact O-CG2 3.44Å; V612-V616 PolarHBondContact O-N 2.81Å; V616-E619 PolarHBondContact O-N 3.18Å; V616-M620 WeakPolarHBondContact O-CB 3.48Å; V616-M620 PolarHBondContact O-N 3.19Å
617	G	43.3	Very low	41	Very low	38 Å²	38	97.5 Å²	97.5	39%	0.392	50%	0.498	S	S	.	.	H	α-helix	trans	-63.1	-43	175.6	0	0	0	0	0	113.3	I613 M620 E621	I613-G617 PolarHBondContact O-N 3.01Å; G617-M620 PolarHBondContact O-N 3.01Å; G617-E621 WeakPolarHBondContact O-CB 3.29Å; G617-E621 PolarHBondContact O-N 2.92Å
618	E	43.5	Very low	40.7	Very low	105 Å²	105	97.4 Å²	97.4	49%	0.491	50%	0.501	S	S	.	.	H	α-helix	trans	-69.2	-31.7	175.8	-76.4	-172.9	173.7	0	0	112.6	N614 K622	N614-E618 PolarHBondContact O-N 3.44Å; E618-K622 VanDerWaalsContact O-CG 3.3Å; E618-K622 WeakPolarHBondContact O-CG 3.24Å; E618-K622 PolarHBondContact O-N 3.33Å
619	E	38.9	Very low	40.7	Very low	133 Å²	133	99.6 Å²	99.6	62%	0.621	51%	0.507	S	S	*	.	H	α-helix	trans	-71.2	-38.4	171.7	-80.2	-174.8	158.5	0	0	112.6	S615 V616 K622 T623	S615-E619 PolarHBondContact O-N 3.15Å; S615-E619 VanDerWaalsContact O-N 3.12Å; V616-E619 PolarHBondContact O-N 3.18Å; E619-K622 PolarHBondContact O-N 3.32Å; E619-T623 PolarHBondContact O-N 3.34Å; E619-T623 PolarHBondContact O-OG1 3.44Å
620	M	39.4	Very low	40.3	Very low	118 Å²	118	100.8 Å²	100.8	58%	0.581	51%	0.509	S	S	*	.	H	α-helix	trans	-66.4	-39.3	173.7	-87.5	-169.7	67.1	0	0	112.6	V616 G617 K622 T623 T624	V616-M620 WeakPolarHBondContact O-CB 3.48Å; V616-M620 PolarHBondContact O-N 3.19Å; G617-M620 PolarHBondContact O-N 3.01Å; M620-K622 VanDerWaalsContact C-N 3.26Å; M620-K622 PolarHBondContact O-N 3.04Å; M620-T623 VanDerWaalsContact CA-OG1 3.29Å; M620-T623 WeakPolarHBondContact CA-OG1 3.42Å; M620-T623 PolarHBondContact O-N 3.31Å; M620-T623 PolarHBondContact O-OG1 3.04Å; M620-T624 WeakPolarHBondContact O-CB 3.46Å; M620-T624 PolarHBondContact O-N 3.11Å; M620-T624 PolarHBondContact O-OG1 2.97Å
621	E	43.2	Very low	40.2	Very low	143 Å²	143	105.8 Å²	105.8	67%	0.668	53%	0.534	S	S	*	.	H	α-helix	trans	-68.5	-27.5	176	-132.6	178.8	-171.1	0	0	111.9	G617	G617-E621 WeakPolarHBondContact O-CB 3.29Å; G617-E621 PolarHBondContact O-N 2.92Å
622	K	40.4	Very low	40	Very low	150 Å²	150	107.1 Å²	107.1	65%	0.652	54%	0.535	S	S	*	.	H	α-helix	trans	-76.1	-35.3	171	-76.2	173	-176.7	170	0	112.9	E618 E619 M620	E618-K622 VanDerWaalsContact O-CG 3.3Å; E618-K622 WeakPolarHBondContact O-CG 3.24Å; E618-K622 PolarHBondContact O-N 3.33Å; E619-K622 PolarHBondContact O-N 3.32Å; M620-K622 VanDerWaalsContact C-N 3.26Å; M620-K622 PolarHBondContact O-N 3.04Å
623	T	39.7	Very low	39.9	Very low	99 Å²	99	113.5 Å²	113.5	61%	0.607	57%	0.565	S	S	*	*	H	α-helix	trans	-82.3	-27.6	-179.9	32.4	0	0	0	0	113.8	E619 M620 R625	E619-T623 PolarHBondContact O-N 3.34Å; E619-T623 PolarHBondContact O-OG1 3.44Å; M620-T623 VanDerWaalsContact CA-OG1 3.29Å; M620-T623 WeakPolarHBondContact CA-OG1 3.42Å; M620-T623 PolarHBondContact O-N 3.31Å; M620-T623 PolarHBondContact O-OG1 3.04Å; T623-R625 VanDerWaalsContact C-N 3.29Å; T623-R625 PolarHBondContact O-N 2.71Å
624	T	38.3	Very low	39.6	Very low	100 Å²	100	118.2 Å²	118.2	61%	0.613	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	8.1	175.6	48	0	0	0	0	114.5	M620 F626	M620-T624 WeakPolarHBondContact O-CB 3.46Å; M620-T624 PolarHBondContact O-N 3.11Å; M620-T624 PolarHBondContact O-OG1 2.97Å; T624-F626 VanDerWaalsContact C-N 3.33Å
625	R	32.4	Very low	39.6	Very low	227 Å²	227	121.6 Å²	121.6	86%	0.857	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	3.1	167.3	-92.1	-168.6	-178.1	-165.2	2	114.1	T623	T623-R625 VanDerWaalsContact C-N 3.29Å; T623-R625 PolarHBondContact O-N 2.71Å
626	F	31.9	Very low	39.5	Very low	246 Å²	246	126.9 Å²	126.9	100%	1.079	62%	0.617	S	S	*	*			trans	-102	0	159.4	-73	-84.7	0	0	0	108.9	T624	T624-F626 VanDerWaalsContact C-N 3.33Å

Retrieved 626 of 626 residues in 657.4 ms (Link to these results)

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