A2AQE4_MOUSE Loading...

COP9 signalosome complex subunit 2

AlphaFold DB , UniProt , Accession A2AQE4, Species MOUSE (Mus musculus, Mouse), Gene Cops2, Length 402 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	33.3	Very low	35.8	Very low	244 Å²	244	167 Å²	167	100%	1.202	87%	0.871	S	S	*	*				0	111.9	0	-82.6	174.1	160.1	0	0	105
2	S	34.2	Very low	35.5	Very low	108 Å²	108	168.3 Å²	168.3	76%	0.755	88%	0.88	S	S	*	*			cis	-173.3	88.4	-10.1	35.3	0	0	0	0	102.6
3	D	34.4	Very low	35.5	Very low	172 Å²	172	167.1 Å²	167.1	92%	0.92	87%	0.867	S	S	*	*			trans	-94.5	91.2	171.8	-71.2	-27.7	0	0	0	106.3
4	M	37.6	Very low	35.7	Very low	182 Å²	182	167.6 Å²	167.6	90%	0.897	86%	0.863	S	S	*	*			trans	-159.3	53.6	174.1	-163.2	146.5	-167.2	0	0	112.5
5	E	36.8	Very low	35.6	Very low	198 Å²	198	166.1 Å²	166.1	93%	0.925	86%	0.857	S	S	*	*			trans	-147.8	68.9	167.3	-72.6	-170.6	170.4	0	0	110
6	D	35.5	Very low	35.7	Very low	160 Å²	160	169.4 Å²	169.4	86%	0.856	86%	0.857	S	S	*	*	S	Bend	trans	-166.1	67.2	156.9	-148.3	12.4	0	0	0	111.5
7	D	35.4	Very low	35.9	Very low	158 Å²	158	164.9 Å²	164.9	85%	0.845	84%	0.836	S	S	*	*			trans	-160.5	51.9	167.3	-139.2	5.7	0	0	0	113.6
8	F	37.1	Very low	35.9	Very low	193 Å²	193	162.7 Å²	162.7	85%	0.846	83%	0.826	S	S	*	*			trans	-136.4	51.3	172	-137.2	-95.1	0	0	0	112.6
9	M	40.8	Very low	35.8	Very low	184 Å²	184	160.8 Å²	160.8	91%	0.906	81%	0.814	S	S	*	*			trans	-105	83.3	156.7	-69.3	-69.6	-173.7	0	0	107.1
10	C	36.9	Very low	35.9	Very low	110 Å²	110	162.6 Å²	162.6	74%	0.743	81%	0.811	S	S	*	*			trans	-109.8	91.9	164.9	-93.5	0	0	0	0	107.6
11	D	31.8	Very low	35.8	Very low	128 Å²	128	159.8 Å²	159.8	68%	0.684	81%	0.807	S	S	*	*			trans	33.1	89.6	146.5	-64	-23.6	0	0	0	117.1	E13	D11-E13 HydrophobicContact CB-CB 4.37Å; D11-E13 PolarHBondContact O-N 3.38Å
12	D	31.8	Very low	36.2	Very low	183 Å²	183	156.9 Å²	156.9	98%	0.979	79%	0.791	S	S	*	*			trans	-76.4	53.5	143.7	-83.3	-37.7	0	0	0	109.2
13	E	36.4	Very low	36.5	Very low	152 Å²	152	159.4 Å²	159.4	71%	0.71	80%	0.796	S	S	*	*			trans	-88	120.4	167	-84.8	-168.8	163.6	0	0	109.6	D11	D11-E13 HydrophobicContact CB-CB 4.37Å; D11-E13 PolarHBondContact O-N 3.38Å
14	E	38.1	Very low	36.4	Very low	175 Å²	175	155 Å²	155	82%	0.818	78%	0.779	S	S	*	*			trans	76.3	97.7	158.3	-59.1	-174.6	166.2	0	0	118.8
15	D	33.9	Very low	36.5	Very low	144 Å²	144	155.1 Å²	155.1	77%	0.77	78%	0.783	S	S	*	*			trans	-160.9	62.6	130.4	-114.1	-7.7	0	0	0	108.8	D17	D15-D17 PolarHBondContact O-N 3.47Å; D15-D17 VanDerWaalsContact O-N 3.16Å
16	Y	38	Very low	36.8	Very low	220 Å²	220	149.5 Å²	149.5	86%	0.863	77%	0.765	S	S	*	*			trans	-79.4	68.7	152.8	-103	-84	0	0	0	107	L18	Y16-L18 PolarHBondContact O-N 3.15Å
17	D	38.8	Very low	37.1	Very low	92 Å²	92	150.9 Å²	150.9	49%	0.492	77%	0.767	S	S	.	*			trans	-76.7	79.9	170.5	-151.7	12.1	0	0	0	107.3	D15 E19	D15-D17 PolarHBondContact O-N 3.47Å; D15-D17 VanDerWaalsContact O-N 3.16Å; D17-E19 PolarHBondContact O-N 3.2Å
18	L	35	Very low	37.7	Very low	125 Å²	125	147.7 Å²	147.7	65%	0.654	76%	0.755	S	S	*	*			trans	-71.1	69.1	162.9	-84.3	163.2	0	0	0	107.6	Y16 Y20	Y16-L18 PolarHBondContact O-N 3.15Å; L18-Y20 VanDerWaalsContact C-N 3.3Å; L18-Y20 PolarHBondContact O-N 3.25Å
19	E	35.3	Very low	38.7	Very low	128 Å²	128	142.7 Å²	142.7	60%	0.598	74%	0.737	S	S	*	*			trans	-69.1	95	161.8	-81.3	-168.6	164.5	0	0	107	D17 S21	D17-E19 PolarHBondContact O-N 3.2Å; E19-S21 VanDerWaalsContact C-N 3.32Å; E19-S21 PolarHBondContact O-N 3.41Å
20	Y	36.5	Very low	39.7	Very low	195 Å²	195	137.8 Å²	137.8	77%	0.765	72%	0.717	S	S	*	*			trans	-62.1	103.3	155.9	-75.8	-88.5	0	0	0	106.3	L18 E22	L18-Y20 VanDerWaalsContact C-N 3.3Å; L18-Y20 PolarHBondContact O-N 3.25Å; Y20-E22 PolarHBondContact O-N 3.05Å
21	S	34.5	Very low	41	Very low	104 Å²	104	138.2 Å²	138.2	73%	0.727	71%	0.712	S	S	*	*			trans	-67	83.7	168.6	47.6	0	0	0	0	109	E19 D23	E19-S21 VanDerWaalsContact C-N 3.32Å; E19-S21 PolarHBondContact O-N 3.41Å; S21-D23 PolarHBondContact O-N 2.98Å
22	E	41.3	Very low	42.8	Very low	183 Å²	183	132.9 Å²	132.9	86%	0.855	68%	0.683	S	S	*	*			trans	-67.4	110.4	157.3	-73.1	-171.3	168.6	0	0	106.9	Y20	Y20-E22 PolarHBondContact O-N 3.05Å
23	D	39.9	Very low	44.6	Very low	162 Å²	162	127 Å²	127	87%	0.866	65%	0.65	S	S	*	*	S	Bend	trans	81.1	74.8	175.2	-66.5	-29.3	0	0	0	118.9	S21	S21-D23 PolarHBondContact O-N 2.98Å
24	S	33.1	Very low	46.5	Very low	80 Å²	80	123.9 Å²	123.9	56%	0.559	64%	0.638	S	S	*	*			trans	-148.4	109.3	136.7	178.1	0	0	0	0	110.2	S26	S24-S26 PolarHBondContact O-N 3.2Å; S24-S26 PolarHBondContact OG-OG 3.29Å
25	N	40.4	Very low	48.2	Very low	184 Å²	184	117.9 Å²	117.9	98%	0.984	61%	0.61	S	S	*	*			trans	-70.2	63.6	171.7	-93.9	-41.4	0	0	0	111.6
26	S	42.3	Very low	50.3	Low	79 Å²	79	111.9 Å²	111.9	55%	0.552	58%	0.577	S	S	*	*	S	Bend	trans	-129.4	111.5	168.1	49.4	0	0	0	0	106.9	S24	S24-S26 PolarHBondContact O-N 3.2Å; S24-S26 PolarHBondContact OG-OG 3.29Å
27	E	42.3	Very low	52.1	Low	189 Å²	189	107.1 Å²	107.1	88%	0.883	56%	0.558	S	S	*	*			trans	-45.6	128.7	178.5	-70.1	179.2	158.8	0	0	110.2	N29	E27-N29 PolarHBondContact O-N 3.06Å; E27-N29 VanDerWaalsContact O-N 3.1Å
28	P	47.5	Very low	53.9	Low	92 Å²	92	107.9 Å²	107.9	60%	0.597	56%	0.562	S	S	*	*			trans	-61.7	119.5	174.5	24.5	-30.5	0	0	0	107.2	V30	P28-V30 WeakPolarHBondContact O-CG2 3.33Å; P28-V30 PolarHBondContact O-N 2.97Å
29	N	58.7	Low	55.8	Low	88 Å²	88	102 Å²	102	47%	0.471	53%	0.532	S	S	.	.			trans	-71.8	85	178.9	-164.6	-14.6	0	0	0	108.2	E27 D31 L32 E33	E27-N29 PolarHBondContact O-N 3.06Å; E27-N29 VanDerWaalsContact O-N 3.1Å; N29-D31 PolarHBondContact O-N 3.2Å; N29-L32 HydrophobicContact CB-CD1 3.98Å; N29-L32 HydrophobicContact CB-CG 4.24Å; N29-L32 WeakPolarHBondContact O-CB 3.47Å; N29-L32 PolarHBondContact O-N 3.05Å; N29-E33 PolarHBondContact O-N 3.36Å
30	V	61.9	Low	57.6	Low	81 Å²	81	100.8 Å²	100.8	49%	0.491	52%	0.524	S	S	.	.	H	α-helix	trans	-49.2	-29.8	-173.3	176.1	0	0	0	0	112.2	P28 N34	P28-V30 WeakPolarHBondContact O-CG2 3.33Å; P28-V30 PolarHBondContact O-N 2.97Å; V30-N34 WeakPolarHBondContact CG1-ND2 3.42Å; V30-N34 WeakPolarHBondContact O-CB 3.37Å; V30-N34 PolarHBondContact O-N 2.93Å; V30-N34 PolarHBondContact O-ND2 3.37Å; V30-N34 VanDerWaalsContact O-ND2 3.1Å
31	D	64.4	Low	59.5	Low	119 Å²	119	94.7 Å²	94.7	64%	0.636	52%	0.515	S	S	*	.	H	α-helix	trans	-69.4	-38.3	178.4	-65.9	-28.7	0	0	0	112.9	N29 Q35	N29-D31 PolarHBondContact O-N 3.2Å; D31-Q35 VanDerWaalsContact O-CB 3.31Å; D31-Q35 WeakPolarHBondContact O-CB 3.47Å; D31-Q35 PolarHBondContact O-N 3.47Å; D31-Q35 VanDerWaalsContact O-N 3.14Å
32	L	67.9	Low	61.5	Low	15 Å²	15	92.7 Å²	92.7	8%	0.079	50%	0.495	C	S	.	.	H	α-helix	trans	-69.8	-40.2	177.5	-68.6	176.8	0	0	0	111.6	N29 Q35 Y36 L60	N29-L32 HydrophobicContact CB-CD1 3.98Å; N29-L32 HydrophobicContact CB-CG 4.24Å; N29-L32 WeakPolarHBondContact O-CB 3.47Å; N29-L32 PolarHBondContact O-N 3.05Å; L32-Q35 PolarHBondContact O-N 3.43Å; L32-Y36 WeakPolarHBondContact O-CB 3.41Å; L32-Y36 PolarHBondContact O-N 3.05Å; L32-L60 HydrophobicContact CD2-CB 3.59Å
33	E	70.7	Confident	63	Low	60 Å²	60	86.1 Å²	86.1	28%	0.28	46%	0.464	S	S	.	.	H	α-helix	trans	-65.5	-50.5	178.5	-179.5	168.5	-164.9	0	0	111.3	N29 Q35 Y36 Y37 W67	N29-E33 PolarHBondContact O-N 3.36Å; E33-Q35 VanDerWaalsContact C-N 3.27Å; E33-Q35 PolarHBondContact O-N 3.43Å; E33-Y36 WeakPolarHBondContact O-CB 3.44Å; E33-Y36 PolarHBondContact O-N 2.95Å; E33-Y36 VanDerWaalsContact O-N 3.14Å; E33-Y37 HydrophobicContact CG-CD2 3.76Å; E33-Y37 HydrophobicContact CG-CE2 3.52Å; E33-Y37 WeakPolarHBondContact O-CD2 3.38Å; E33-Y37 PolarHBondContact O-N 3.05Å; E33-W67 HydrophobicContact CB-CH2 4.1Å; E33-W67 HydrophobicContact CB-CZ2 3.87Å; E33-W67 HydrophobicContact CG-CH2 3.58Å; E33-W67 HydrophobicContact CG-CZ2 3.72Å; E33-W67 HydrophobicContact CG-CZ3 4.32Å
34	N	75.3	Confident	64.4	Low	86 Å²	86	85.1 Å²	85.1	46%	0.46	45%	0.454	S	S	.	.	H	α-helix	trans	-58	-41.1	177.4	-75.7	-28.2	0	0	0	111.8	V30 N38	V30-N34 WeakPolarHBondContact CG1-ND2 3.42Å; V30-N34 WeakPolarHBondContact O-CB 3.37Å; V30-N34 PolarHBondContact O-N 2.93Å; V30-N34 PolarHBondContact O-ND2 3.37Å; V30-N34 VanDerWaalsContact O-ND2 3.1Å; N34-N38 WeakPolarHBondContact O-CB 3.36Å; N34-N38 PolarHBondContact O-N 2.73Å; N34-N38 PolarHBondContact O-ND2 3.09Å; N34-N38 VanDerWaalsContact O-ND2 3.12Å
35	Q	73.9	Confident	66.2	Low	50 Å²	50	87.4 Å²	87.4	23%	0.234	46%	0.46	C	S	.	.	H	α-helix	trans	-71.6	-32.8	179.3	-167.1	165.3	-14.8	0	0	113.1	D31 L32 E33 S39 V57	D31-Q35 VanDerWaalsContact O-CB 3.31Å; D31-Q35 WeakPolarHBondContact O-CB 3.47Å; D31-Q35 PolarHBondContact O-N 3.47Å; D31-Q35 VanDerWaalsContact O-N 3.14Å; L32-Q35 PolarHBondContact O-N 3.43Å; E33-Q35 VanDerWaalsContact C-N 3.27Å; E33-Q35 PolarHBondContact O-N 3.43Å; Q35-S39 WeakPolarHBondContact O-CB 3.44Å; Q35-S39 PolarHBondContact O-N 3.27Å; Q35-S39 PolarHBondContact O-OG 3.45Å; Q35-V57 HydrophobicContact CB-CG2 4.15Å; Q35-V57 HydrophobicContact CG-CG2 3.82Å
36	Y	79.1	Confident	68.1	Low	18 Å²	18	83.3 Å²	83.3	7%	0.071	44%	0.438	C	S	.	.	H	α-helix	trans	-65.2	-46.8	172.8	177	-95.3	0	0	0	111.8	L32 E33 N38 S39 K40 F54 W67 K70 A71 Q74	L32-Y36 WeakPolarHBondContact O-CB 3.41Å; L32-Y36 PolarHBondContact O-N 3.05Å; E33-Y36 WeakPolarHBondContact O-CB 3.44Å; E33-Y36 PolarHBondContact O-N 2.95Å; E33-Y36 VanDerWaalsContact O-N 3.14Å; Y36-N38 PolarHBondContact O-N 3.49Å; Y36-S39 WeakPolarHBondContact O-CB 3.3Å; Y36-S39 PolarHBondContact O-N 3.06Å; Y36-K40 PolarHBondContact O-N 3.49Å; Y36-F54 HydrophobicContact CD2-CD1 4.13Å; Y36-F54 AromaticContact CD2-CE1 3.74Å; Y36-F54 HydrophobicContact CD2-CE1 3.74Å; Y36-F54 HydrophobicContact CE2-CD1 4.29Å; Y36-F54 AromaticContact CE2-CE1 3.7Å; Y36-F54 HydrophobicContact CE2-CE1 3.7Å; Y36-W67 HydrophobicContact CD1-CE3 4.02Å; Y36-W67 AromaticContact CD1-CZ3 3.67Å; Y36-W67 HydrophobicContact CD1-CZ3 3.67Å; Y36-W67 HydrophobicContact CE1-CZ3 4.2Å; Y36-W67 AromaticContact CG-CE3 3.95Å; Y36-W67 HydrophobicContact CG-CE3 3.95Å; Y36-W67 HydrophobicContact CG-CZ3 4.07Å; Y36-K70 HydrophobicContact CE2-CB 3.84Å; Y36-A71 HydrophobicContact CD2-CB 4.25Å; Y36-A71 HydrophobicContact CE2-CB 4.36Å; Y36-Q74 HydrophobicContact CE2-CG 4.49Å
37	Y	75.7	Confident	69.8	Low	120 Å²	120	81.8 Å²	81.8	47%	0.471	43%	0.426	S	S	.	.	H	α-helix	trans	-65.8	-38.8	178.5	-76.8	-70.1	0	0	0	112.7	E33 S39 K40 A41 W67	E33-Y37 HydrophobicContact CG-CD2 3.76Å; E33-Y37 HydrophobicContact CG-CE2 3.52Å; E33-Y37 WeakPolarHBondContact O-CD2 3.38Å; E33-Y37 PolarHBondContact O-N 3.05Å; Y37-S39 VanDerWaalsContact C-N 3.3Å; Y37-S39 PolarHBondContact O-N 3.44Å; Y37-K40 PolarHBondContact O-N 3.43Å; Y37-K40 VanDerWaalsContact O-N 3.17Å; Y37-A41 PolarHBondContact O-N 2.96Å; Y37-W67 HydrophobicContact CE2-CH2 4.21Å; Y37-W67 HydrophobicContact CE2-CZ3 4.48Å
38	N	76.7	Confident	71.5	Confident	108 Å²	108	80.5 Å²	80.5	58%	0.578	42%	0.418	S	S	*	.	H	α-helix	trans	-59.7	-41.8	171.7	-73.6	-26.8	0	0	0	111.7	N34 Y36 K40 A41 L42	N34-N38 WeakPolarHBondContact O-CB 3.36Å; N34-N38 PolarHBondContact O-N 2.73Å; N34-N38 PolarHBondContact O-ND2 3.09Å; N34-N38 VanDerWaalsContact O-ND2 3.12Å; Y36-N38 PolarHBondContact O-N 3.49Å; N38-K40 VanDerWaalsContact C-N 3.32Å; N38-K40 PolarHBondContact O-N 3.36Å; N38-A41 PolarHBondContact O-N 3.48Å; N38-L42 WeakPolarHBondContact O-CD1 3.48Å; N38-L42 WeakPolarHBondContact O-CG 3.4Å; N38-L42 PolarHBondContact O-N 2.92Å
39	S	75.2	Confident	73.1	Confident	1 Å²	1	78 Å²	78	1%	0.007	40%	0.404	C	S	.	.	H	α-helix	trans	-67.8	-32.3	176.7	-56	0	0	0	0	112.6	Q35 Y36 Y37 S53 F54	Q35-S39 WeakPolarHBondContact O-CB 3.44Å; Q35-S39 PolarHBondContact O-N 3.27Å; Q35-S39 PolarHBondContact O-OG 3.45Å; Y36-S39 WeakPolarHBondContact O-CB 3.3Å; Y36-S39 PolarHBondContact O-N 3.06Å; Y37-S39 VanDerWaalsContact C-N 3.3Å; Y37-S39 PolarHBondContact O-N 3.44Å; S39-S53 WeakPolarHBondContact OG-CB 3.36Å; S39-F54 VanDerWaalsContact C-CZ 3.48Å; S39-F54 WeakPolarHBondContact O-CE2 3.49Å; S39-F54 WeakPolarHBondContact O-CZ 3.36Å
40	K	73.1	Confident	74.1	Confident	102 Å²	102	73.8 Å²	73.8	44%	0.443	38%	0.382	S	S	.	.	H	α-helix	trans	-70.8	-39.9	177	-169.3	-178.5	179	-171.6	0	111.9	Y36 Y37 N38 L42 K43 F54	Y36-K40 PolarHBondContact O-N 3.49Å; Y37-K40 PolarHBondContact O-N 3.43Å; Y37-K40 VanDerWaalsContact O-N 3.17Å; N38-K40 VanDerWaalsContact C-N 3.32Å; N38-K40 PolarHBondContact O-N 3.36Å; K40-L42 VanDerWaalsContact C-N 3.3Å; K40-L42 PolarHBondContact O-N 2.93Å; K40-K43 WeakPolarHBondContact O-CB 3.46Å; K40-K43 PolarHBondContact O-N 3.27Å; K40-F54 HydrophobicContact CB-CZ 4.42Å
41	A	76.8	Confident	75	Confident	68 Å²	68	71.3 Å²	71.3	56%	0.562	37%	0.366	S	S	*	.	H	α-helix	trans	-61.1	-40.9	175	0	0	0	0	0	111.5	Y37 N38 K43	Y37-A41 PolarHBondContact O-N 2.96Å; N38-A41 PolarHBondContact O-N 3.48Å; A41-K43 PolarHBondContact O-N 2.73Å; A41-K43 VanDerWaalsContact O-N 3.11Å
42	L	76.2	Confident	75.8	Confident	62 Å²	62	68.5 Å²	68.5	33%	0.325	36%	0.355	S	S	.	.	H	α-helix	trans	-66.2	-10.3	178.1	-74.7	160.2	0	0	0	114.6	N38 K40 D46 A50	N38-L42 WeakPolarHBondContact O-CD1 3.48Å; N38-L42 WeakPolarHBondContact O-CG 3.4Å; N38-L42 PolarHBondContact O-N 2.92Å; K40-L42 VanDerWaalsContact C-N 3.3Å; K40-L42 PolarHBondContact O-N 2.93Å; L42-D46 CarbonylContact O-C 3.49Å; L42-D46 PolarHBondContact O-N 2.88Å; L42-A50 HydrophobicContact CB-CB 4.17Å
43	K	72.1	Confident	76.4	Confident	44 Å²	44	68.8 Å²	68.8	19%	0.191	36%	0.359	C	S	.	.	H	α-helix	trans	-66.3	-36.4	-176.9	179.4	-179.7	167.8	-169.7	0	113	K40 A41 I78	K40-K43 WeakPolarHBondContact O-CB 3.46Å; K40-K43 PolarHBondContact O-N 3.27Å; A41-K43 PolarHBondContact O-N 2.73Å; A41-K43 VanDerWaalsContact O-N 3.11Å; K43-I78 HydrophobicContact CB-CD1 4.45Å; K43-I78 HydrophobicContact CD-CD1 4.27Å; K43-I78 HydrophobicContact CD-CG1 4.27Å; K43-I78 HydrophobicContact CG-CD1 3.91Å; K43-I78 HydrophobicContact CG-CG1 4Å
44	E	69.1	Low	76.9	Confident	142 Å²	142	65.9 Å²	65.9	66%	0.664	35%	0.345	S	S	*	.	H	α-helix	trans	-81	-32.3	-178.4	-62.1	-55.8	132.1	0	0	111.5
45	D	71.9	Confident	77.2	Confident	127 Å²	127	64.3 Å²	64.3	68%	0.679	34%	0.335	S	S	*	.	H	α-helix	trans	-84.4	-51.2	-178.3	-64.2	-33.3	0	0	0	112.9
46	D	80.3	Confident	77.5	Confident	99 Å²	99	67 Å²	67	53%	0.529	35%	0.346	S	S	.	.			trans	-143.8	92	-172.9	-90.6	-45.8	0	0	0	112.4	L42 K48 A49 A50	L42-D46 CarbonylContact O-C 3.49Å; L42-D46 PolarHBondContact O-N 2.88Å; D46-K48 VanDerWaalsContact C-N 3.27Å; D46-K48 PolarHBondContact O-N 3.28Å; D46-K48 VanDerWaalsContact O-N 3.16Å; D46-A49 HydrophobicContact CB-CB 3.81Å; D46-A49 PolarHBondContact O-N 3.32Å; D46-A49 VanDerWaalsContact O-N 3.1Å; D46-A50 PolarHBondContact O-N 3Å
47	P	76.6	Confident	77.6	Confident	46 Å²	46	66.2 Å²	66.2	30%	0.299	34%	0.343	S	S	.	.	H	α-helix	trans	-64.3	-28.5	-172.5	24	-34.1	0	0	0	113.4	L51 I78 L82	P47-L51 WeakPolarHBondContact O-CG 3.27Å; P47-L51 PolarHBondContact O-N 3.4Å; P47-I78 HydrophobicContact CB-CG2 3.72Å; P47-L82 HydrophobicContact CB-CD1 4.11Å; P47-L82 HydrophobicContact CB-CD2 4.15Å; P47-L82 HydrophobicContact CB-CG 4.3Å; P47-L82 HydrophobicContact CG-CD2 3.82Å
48	K	79.6	Confident	77.7	Confident	163 Å²	163	61.6 Å²	61.6	71%	0.709	33%	0.326	S	S	*	.	H	α-helix	trans	-74.7	-37.5	175.8	-68.3	-179.4	-178	174	0	112.7	D46 L51 S52 L82	D46-K48 VanDerWaalsContact C-N 3.27Å; D46-K48 PolarHBondContact O-N 3.28Å; D46-K48 VanDerWaalsContact O-N 3.16Å; K48-L51 PolarHBondContact O-N 3.09Å; K48-S52 PolarHBondContact O-N 3.4Å; K48-L82 HydrophobicContact CG-CD1 4.21Å
49	A	79.1	Confident	77.8	Confident	38 Å²	38	62.9 Å²	62.9	31%	0.314	33%	0.329	S	S	.	.	H	α-helix	trans	-70.4	-37.6	176.3	0	0	0	0	0	110.9	D46 L51 S52 S53	D46-A49 HydrophobicContact CB-CB 3.81Å; D46-A49 PolarHBondContact O-N 3.32Å; D46-A49 VanDerWaalsContact O-N 3.1Å; A49-L51 VanDerWaalsContact C-N 3.35Å; A49-L51 PolarHBondContact O-N 3.21Å; A49-S52 PolarHBondContact O-N 3.06Å; A49-S52 PolarHBondContact O-OG 3.39Å; A49-S53 PolarHBondContact O-N 3.4Å; A49-S53 PolarHBondContact O-OG 3.06Å
50	A	80.2	Confident	77.7	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-57.6	-44.1	172.9	0	0	0	0	0	111.9	L42 D46 S52 S53 F54 I78	L42-A50 HydrophobicContact CB-CB 4.17Å; D46-A50 PolarHBondContact O-N 3Å; A50-S52 VanDerWaalsContact C-N 3.33Å; A50-S52 PolarHBondContact O-N 2.91Å; A50-S53 PolarHBondContact O-N 3.1Å; A50-F54 HydrophobicContact CB-CD2 4.39Å; A50-F54 HydrophobicContact CB-CE2 4.19Å; A50-F54 WeakPolarHBondContact O-CD2 3.43Å; A50-F54 PolarHBondContact O-N 3.15Å; A50-I78 HydrophobicContact CB-CD1 4.13Å
51	L	80.9	Confident	77.6	Confident	29 Å²	29	63.7 Å²	63.7	15%	0.152	34%	0.337	C	S	.	.	H	α-helix	trans	-58	-42.9	176	-72.6	170.3	0	0	0	112.7	P47 K48 A49 S53 Q55 M75 I78 N79 L82	P47-L51 WeakPolarHBondContact O-CG 3.27Å; P47-L51 PolarHBondContact O-N 3.4Å; K48-L51 PolarHBondContact O-N 3.09Å; A49-L51 VanDerWaalsContact C-N 3.35Å; A49-L51 PolarHBondContact O-N 3.21Å; L51-S53 VanDerWaalsContact C-N 3.27Å; L51-S53 PolarHBondContact O-N 2.84Å; L51-Q55 WeakPolarHBondContact O-CB 3.11Å; L51-Q55 PolarHBondContact O-N 2.88Å; L51-M75 HydrophobicContact CD2-CB 3.91Å; L51-M75 HydrophobicContact CD2-CE 4.28Å; L51-M75 HydrophobicContact CD2-CG 4Å; L51-I78 HydrophobicContact CD1-CG2 4.18Å; L51-I78 HydrophobicContact CD2-CB 4.16Å; L51-I78 HydrophobicContact CD2-CG2 4.05Å; L51-I78 HydrophobicContact CG-CG2 3.91Å; L51-N79 VanDerWaalsContact CD1-OD1 3.23Å; L51-N79 WeakPolarHBondContact CD1-OD1 3.3Å; L51-L82 HydrophobicContact CD1-CD1 4Å
52	S	81	Confident	76.9	Confident	60 Å²	60	64.2 Å²	64.2	42%	0.42	35%	0.349	S	S	.	.	H	α-helix	trans	-67.5	-29.4	177.1	75.1	0	0	0	0	112.8	K48 A49 A50 K56	K48-S52 PolarHBondContact O-N 3.4Å; A49-S52 PolarHBondContact O-N 3.06Å; A49-S52 PolarHBondContact O-OG 3.39Å; A50-S52 VanDerWaalsContact C-N 3.33Å; A50-S52 PolarHBondContact O-N 2.91Å; S52-K56 WeakPolarHBondContact O-CG 3.48Å; S52-K56 PolarHBondContact O-N 2.66Å
53	S	80.6	Confident	76.5	Confident	21 Å²	21	69.5 Å²	69.5	15%	0.147	37%	0.372	C	S	.	.	H	α-helix	trans	-78.3	-41.2	179.2	-55	0	0	0	0	111.4	S39 A49 A50 L51 Q55 K56 V57	S39-S53 WeakPolarHBondContact OG-CB 3.36Å; A49-S53 PolarHBondContact O-N 3.4Å; A49-S53 PolarHBondContact O-OG 3.06Å; A50-S53 PolarHBondContact O-N 3.1Å; L51-S53 VanDerWaalsContact C-N 3.27Å; L51-S53 PolarHBondContact O-N 2.84Å; S53-Q55 VanDerWaalsContact C-N 3.32Å; S53-Q55 PolarHBondContact O-N 3.2Å; S53-K56 WeakPolarHBondContact O-CB 3.43Å; S53-K56 PolarHBondContact O-N 3.41Å; S53-V57 PolarHBondContact O-N 2.88Å
54	F	82.4	Confident	76.6	Confident	0 Å²	0	72 Å²	72	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-64.4	-34.3	170.4	-72.8	-59.9	0	0	0	112.7	Y36 S39 K40 A50 K56 V57 L58 A71 Q74 M75 I78	Y36-F54 HydrophobicContact CD2-CD1 4.13Å; Y36-F54 AromaticContact CD2-CE1 3.74Å; Y36-F54 HydrophobicContact CD2-CE1 3.74Å; Y36-F54 HydrophobicContact CE2-CD1 4.29Å; Y36-F54 AromaticContact CE2-CE1 3.7Å; Y36-F54 HydrophobicContact CE2-CE1 3.7Å; S39-F54 VanDerWaalsContact C-CZ 3.48Å; S39-F54 WeakPolarHBondContact O-CE2 3.49Å; S39-F54 WeakPolarHBondContact O-CZ 3.36Å; K40-F54 HydrophobicContact CB-CZ 4.42Å; A50-F54 HydrophobicContact CB-CD2 4.39Å; A50-F54 HydrophobicContact CB-CE2 4.19Å; A50-F54 WeakPolarHBondContact O-CD2 3.43Å; A50-F54 PolarHBondContact O-N 3.15Å; F54-K56 VanDerWaalsContact C-N 3.3Å; F54-K56 PolarHBondContact O-N 3.01Å; F54-V57 WeakPolarHBondContact O-CB 3.33Å; F54-V57 PolarHBondContact O-N 3.38Å; F54-L58 PolarHBondContact O-N 2.8Å; F54-A71 HydrophobicContact CB-CB 4.44Å; F54-A71 HydrophobicContact CD1-CB 3.95Å; F54-Q74 HydrophobicContact CE1-CB 4.31Å; F54-Q74 HydrophobicContact CE2-CB 4.15Å; F54-Q74 HydrophobicContact CZ-CB 3.95Å; F54-Q74 HydrophobicContact CZ-CG 4.38Å; F54-M75 HydrophobicContact CB-CG 3.52Å; F54-M75 HydrophobicContact CB-SD 3.7Å; F54-M75 HydrophobicContact CD2-CG 4.22Å; F54-M75 HydrophobicContact CG-CG 4.07Å; F54-I78 HydrophobicContact CD2-CD1 4.13Å; F54-I78 HydrophobicContact CE2-CD1 3.76Å
55	Q	81.6	Confident	76.8	Confident	52 Å²	52	66.1 Å²	66.1	24%	0.243	36%	0.36	C	S	.	.	H	α-helix	trans	-61.8	-37.8	172.8	179.8	60.4	33.1	0	0	112.1	L51 S53 V57 L58 E59 M75	L51-Q55 WeakPolarHBondContact O-CB 3.11Å; L51-Q55 PolarHBondContact O-N 2.88Å; S53-Q55 VanDerWaalsContact C-N 3.32Å; S53-Q55 PolarHBondContact O-N 3.2Å; Q55-V57 VanDerWaalsContact C-N 3.32Å; Q55-V57 PolarHBondContact O-N 3.16Å; Q55-L58 WeakPolarHBondContact O-CB 3.46Å; Q55-L58 PolarHBondContact O-N 2.76Å; Q55-E59 WeakPolarHBondContact CG-OE1 3.22Å; Q55-E59 PolarHBondContact NE2-OE1 2.88Å; Q55-E59 VanDerWaalsContact NE2-OE1 3.1Å; Q55-E59 PolarHBondContact O-N 3.14Å; Q55-E59 VanDerWaalsContact O-N 3.08Å; Q55-M75 HydrophobicContact CB-CE 4.42Å
56	K	80.4	Confident	76.9	Confident	108 Å²	108	63.8 Å²	63.8	47%	0.47	35%	0.345	S	S	.	.	H	α-helix	trans	-66.8	-33.2	175.1	-67.8	168.7	-176.1	175	0	112.4	S52 S53 F54 L58 E59 L60	S52-K56 WeakPolarHBondContact O-CG 3.48Å; S52-K56 PolarHBondContact O-N 2.66Å; S53-K56 WeakPolarHBondContact O-CB 3.43Å; S53-K56 PolarHBondContact O-N 3.41Å; F54-K56 VanDerWaalsContact C-N 3.3Å; F54-K56 PolarHBondContact O-N 3.01Å; K56-L58 VanDerWaalsContact C-N 3.29Å; K56-L58 PolarHBondContact O-N 3.03Å; K56-E59 PolarHBondContact O-N 2.83Å; K56-L60 WeakPolarHBondContact O-CB 3.42Å; K56-L60 WeakPolarHBondContact O-CD1 3.45Å; K56-L60 VanDerWaalsContact O-CG 3.24Å; K56-L60 WeakPolarHBondContact O-CG 3.37Å; K56-L60 PolarHBondContact O-N 3.49Å
57	V	80.4	Confident	76.8	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-61.7	-40.8	173.4	178.7	0	0	0	0	110.4	Q35 S53 F54 Q55 L60 E61 A71	Q35-V57 HydrophobicContact CB-CG2 4.15Å; Q35-V57 HydrophobicContact CG-CG2 3.82Å; S53-V57 PolarHBondContact O-N 2.88Å; F54-V57 WeakPolarHBondContact O-CB 3.33Å; F54-V57 PolarHBondContact O-N 3.38Å; Q55-V57 VanDerWaalsContact C-N 3.32Å; Q55-V57 PolarHBondContact O-N 3.16Å; V57-L60 PolarHBondContact O-N 3.39Å; V57-E61 WeakPolarHBondContact O-CB 3.48Å; V57-E61 PolarHBondContact O-N 2.86Å; V57-A71 HydrophobicContact CB-CB 4.47Å; V57-A71 HydrophobicContact CG1-CB 4.29Å
58	L	77.6	Confident	77	Confident	24 Å²	24	59 Å²	59	13%	0.126	31%	0.314	C	S	.	.	H	α-helix	trans	-67.1	-32.7	175.8	-78	148.7	0	0	0	113.6	F54 Q55 K56 L72 M75 Y98	F54-L58 PolarHBondContact O-N 2.8Å; Q55-L58 WeakPolarHBondContact O-CB 3.46Å; Q55-L58 PolarHBondContact O-N 2.76Å; K56-L58 VanDerWaalsContact C-N 3.29Å; K56-L58 PolarHBondContact O-N 3.03Å; L58-L72 HydrophobicContact CD1-CD2 3.74Å; L58-L72 HydrophobicContact CD1-CG 4.03Å; L58-L72 HydrophobicContact CD2-CD1 3.85Å; L58-L72 HydrophobicContact CD2-CD2 4.09Å; L58-L72 HydrophobicContact CD2-CG 3.77Å; L58-L72 HydrophobicContact CG-CG 4.45Å; L58-M75 HydrophobicContact CD1-CE 4.46Å; L58-M75 HydrophobicContact CD1-SD 3.53Å; L58-M75 VanDerWaalsContact CD1-SD 3.53Å; L58-Y98 WeakPolarHBondContact CD2-OH 3.21Å
59	E	78.4	Confident	77.1	Confident	135 Å²	135	51.2 Å²	51.2	63%	0.631	28%	0.28	S	S	*	.	H	α-helix	trans	-77.8	-30.7	178.2	-73.7	168.4	-165	0	0	112.8	Q55 K56	Q55-E59 WeakPolarHBondContact CG-OE1 3.22Å; Q55-E59 PolarHBondContact NE2-OE1 2.88Å; Q55-E59 VanDerWaalsContact NE2-OE1 3.1Å; Q55-E59 PolarHBondContact O-N 3.14Å; Q55-E59 VanDerWaalsContact O-N 3.08Å; K56-E59 PolarHBondContact O-N 2.83Å
60	L	74.1	Confident	77.2	Confident	99 Å²	99	51.6 Å²	51.6	52%	0.518	28%	0.275	S	S	.	.	H	α-helix	trans	-78.9	-25.3	175.5	-70.4	165.9	0	0	0	112.3	L32 K56 V57 G62	L32-L60 HydrophobicContact CD2-CB 3.59Å; K56-L60 WeakPolarHBondContact O-CB 3.42Å; K56-L60 WeakPolarHBondContact O-CD1 3.45Å; K56-L60 VanDerWaalsContact O-CG 3.24Å; K56-L60 WeakPolarHBondContact O-CG 3.37Å; K56-L60 PolarHBondContact O-N 3.49Å; V57-L60 PolarHBondContact O-N 3.39Å; L60-G62 PolarHBondContact O-N 3.2Å; L60-G62 VanDerWaalsContact O-N 3.08Å
61	E	70.8	Confident	77.3	Confident	20 Å²	20	51.6 Å²	51.6	9%	0.093	28%	0.275	C	S	.	.			trans	-76.9	90.8	173.7	-167.3	-179	-118.3	0	0	110	V57 E63 G65 W67 G68	V57-E61 WeakPolarHBondContact O-CB 3.48Å; V57-E61 PolarHBondContact O-N 2.86Å; E61-E63 WeakPolarHBondContact CG-O 3.33Å; E61-G65 VanDerWaalsContact CD-N 3.26Å; E61-G65 VanDerWaalsContact OE1-C 3.24Å; E61-G65 WeakPolarHBondContact OE1-CA 3.34Å; E61-G65 PolarHBondContact OE1-N 2.89Å; E61-G65 PolarHBondContact OE2-N 3.15Å; E61-W67 PolarHBondContact OE1-N 3.09Å; E61-G68 VanDerWaalsContact CD-N 3.29Å; E61-G68 PolarHBondContact OE1-N 3.35Å; E61-G68 WeakPolarHBondContact OE2-CA 3.28Å; E61-G68 PolarHBondContact OE2-N 2.94Å
62	G	62.1	Low	77.4	Confident	79 Å²	79	50.2 Å²	50.2	81%	0.814	27%	0.267	S	S	*	.			trans	-70	-31.7	-178.5	0	0	0	0	0	114.6	L60	L60-G62 PolarHBondContact O-N 3.2Å; L60-G62 VanDerWaalsContact O-N 3.08Å
63	E	66.7	Low	77.6	Confident	173 Å²	173	48.7 Å²	48.7	81%	0.808	25%	0.253	S	S	*	.	S	Bend	trans	-116.4	133.9	172.1	-68.8	-170.3	165.2	0	0	109.3	E61 G65	E61-E63 WeakPolarHBondContact CG-O 3.33Å; E63-G65 PolarHBondContact O-N 3.05Å
64	K	73.8	Confident	77.6	Confident	97 Å²	97	48.7 Å²	48.7	42%	0.422	25%	0.251	S	S	.	.			trans	-54.5	113.3	-177.4	-64	-172.9	-175.1	-173.6	0	110.4	T97 Y98 A102	K64-T97 VanDerWaalsContact NZ-CB 3.33Å; K64-T97 PolarHBondContact NZ-O 2.71Å; K64-T97 PolarHBondContact NZ-OG1 3.18Å; K64-Y98 HydrophobicContact CB-CD1 3.79Å; K64-Y98 HydrophobicContact CB-CE1 3.58Å; K64-Y98 HydrophobicContact CD-CD1 4.36Å; K64-Y98 HydrophobicContact CD-CD2 4.31Å; K64-Y98 HydrophobicContact CD-CE1 4.34Å; K64-Y98 HydrophobicContact CD-CE2 4.27Å; K64-Y98 HydrophobicContact CD-CG 4.34Å; K64-Y98 HydrophobicContact CG-CD1 4.29Å; K64-Y98 HydrophobicContact CG-CE1 3.88Å; K64-Y98 HydrophobicContact CG-CE2 4.41Å; K64-A102 HydrophobicContact CB-CB 3.83Å; K64-A102 WeakPolarHBondContact O-CB 3.34Å
65	G	74.4	Confident	77.6	Confident	19 Å²	19	48.9 Å²	48.9	20%	0.196	25%	0.252	C	S	.	.			trans	-125.5	-173.6	-176.8	0	0	0	0	0	112.7	E61 E63	E61-G65 VanDerWaalsContact CD-N 3.26Å; E61-G65 VanDerWaalsContact OE1-C 3.24Å; E61-G65 WeakPolarHBondContact OE1-CA 3.34Å; E61-G65 PolarHBondContact OE1-N 2.89Å; E61-G65 PolarHBondContact OE2-N 3.15Å; E63-G65 PolarHBondContact O-N 3.05Å
66	E	73.9	Confident	77.6	Confident	77 Å²	77	46.5 Å²	46.5	36%	0.36	24%	0.241	S	C	.	.	H	α-helix	trans	-70	-32.8	-178.7	-164.1	-171.3	151.7	0	0	112.3	F69 K70	E66-F69 WeakPolarHBondContact O-CB 3.4Å; E66-F69 PolarHBondContact O-N 3.32Å; E66-K70 WeakPolarHBondContact O-CG 3.04Å; E66-K70 PolarHBondContact O-N 2.9Å; E66-K70 WeakPolarHBondContact OE1-CE 3.44Å; E66-K70 IonicContact OE1-NZ 2.86Å; E66-K70 PolarHBondContact OE1-NZ 2.79Å
67	W	79	Confident	77.7	Confident	45 Å²	45	43.4 Å²	43.4	17%	0.17	23%	0.227	C	C	.	.	H	α-helix	trans	-73.2	-39.7	-175.8	-71	109	0	0	0	112.7	E33 Y36 Y37 E61 F69 K70 A71	E33-W67 HydrophobicContact CB-CH2 4.1Å; E33-W67 HydrophobicContact CB-CZ2 3.87Å; E33-W67 HydrophobicContact CG-CH2 3.58Å; E33-W67 HydrophobicContact CG-CZ2 3.72Å; E33-W67 HydrophobicContact CG-CZ3 4.32Å; Y36-W67 HydrophobicContact CD1-CE3 4.02Å; Y36-W67 AromaticContact CD1-CZ3 3.67Å; Y36-W67 HydrophobicContact CD1-CZ3 3.67Å; Y36-W67 HydrophobicContact CE1-CZ3 4.2Å; Y36-W67 AromaticContact CG-CE3 3.95Å; Y36-W67 HydrophobicContact CG-CE3 3.95Å; Y36-W67 HydrophobicContact CG-CZ3 4.07Å; Y37-W67 HydrophobicContact CE2-CH2 4.21Å; Y37-W67 HydrophobicContact CE2-CZ3 4.48Å; E61-W67 PolarHBondContact OE1-N 3.09Å; W67-F69 VanDerWaalsContact C-N 3.3Å; W67-F69 PolarHBondContact O-N 2.96Å; W67-K70 HydrophobicContact CE3-CD 4.11Å; W67-K70 HydrophobicContact CZ3-CD 4.21Å; W67-K70 PolarHBondContact O-N 2.88Å; W67-A71 WeakPolarHBondContact O-CB 3.33Å; W67-A71 PolarHBondContact O-N 3.2Å
68	G	79.9	Confident	77.7	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-66.6	-32.5	171.4	0	0	0	0	0	112.5	E61 A71 L72	E61-G68 VanDerWaalsContact CD-N 3.29Å; E61-G68 PolarHBondContact OE1-N 3.35Å; E61-G68 WeakPolarHBondContact OE2-CA 3.28Å; E61-G68 PolarHBondContact OE2-N 2.94Å; G68-A71 PolarHBondContact O-N 3.32Å; G68-L72 WeakPolarHBondContact O-CB 3.42Å; G68-L72 VanDerWaalsContact O-CG 3.29Å; G68-L72 WeakPolarHBondContact O-CG 3.4Å; G68-L72 PolarHBondContact O-N 3.03Å
69	F	80.8	Confident	77.9	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.8	-45.7	172.5	-171.4	-88.7	0	0	0	111.9	E66 W67 A71 L72 K73 L95 Y98 V103 Y107	E66-F69 WeakPolarHBondContact O-CB 3.4Å; E66-F69 PolarHBondContact O-N 3.32Å; W67-F69 VanDerWaalsContact C-N 3.3Å; W67-F69 PolarHBondContact O-N 2.96Å; F69-A71 VanDerWaalsContact C-N 3.34Å; F69-A71 PolarHBondContact O-N 3.46Å; F69-L72 PolarHBondContact O-N 3.35Å; F69-K73 PolarHBondContact O-N 2.92Å; F69-L95 HydrophobicContact CD2-CD2 4.34Å; F69-L95 HydrophobicContact CD2-CG 4.02Å; F69-L95 HydrophobicContact CE2-CD1 4.33Å; F69-L95 HydrophobicContact CE2-CD2 3.46Å; F69-L95 VanDerWaalsContact CE2-CD2 3.46Å; F69-L95 HydrophobicContact CE2-CG 3.62Å; F69-L95 HydrophobicContact CZ-CD1 4.39Å; F69-L95 HydrophobicContact CZ-CD2 3.78Å; F69-L95 HydrophobicContact CZ-CG 4.12Å; F69-Y98 HydrophobicContact CB-CD1 4.32Å; F69-Y98 HydrophobicContact CD2-CG 4.3Å; F69-V103 HydrophobicContact CB-CG2 3.75Å; F69-V103 HydrophobicContact CD1-CG2 4.31Å; F69-V103 HydrophobicContact CD2-CG2 3.86Å; F69-V103 HydrophobicContact CG-CG2 3.72Å; F69-Y107 HydrophobicContact CD1-CD1 4.14Å; F69-Y107 AromaticContact CD1-CE1 3.71Å; F69-Y107 HydrophobicContact CD1-CE1 3.71Å; F69-Y107 AromaticContact CE1-CD1 3.9Å; F69-Y107 HydrophobicContact CE1-CD1 3.9Å; F69-Y107 AromaticContact CE1-CE1 3.74Å; F69-Y107 HydrophobicContact CE1-CE1 3.74Å
70	K	81.2	Confident	77.9	Confident	45 Å²	45	37.2 Å²	37.2	20%	0.196	20%	0.197	C	C	.	.	H	α-helix	trans	-60.7	-41.9	174.3	-73.7	175.5	-178	170.7	0	111.6	Y36 E66 W67 K73 Q74 Y107	Y36-K70 HydrophobicContact CE2-CB 3.84Å; E66-K70 WeakPolarHBondContact O-CG 3.04Å; E66-K70 PolarHBondContact O-N 2.9Å; E66-K70 WeakPolarHBondContact OE1-CE 3.44Å; E66-K70 IonicContact OE1-NZ 2.86Å; E66-K70 PolarHBondContact OE1-NZ 2.79Å; W67-K70 HydrophobicContact CE3-CD 4.11Å; W67-K70 HydrophobicContact CZ3-CD 4.21Å; W67-K70 PolarHBondContact O-N 2.88Å; K70-K73 PolarHBondContact O-N 3.4Å; K70-Q74 PolarHBondContact O-N 2.9Å; K70-Y107 VanDerWaalsContact CE-OH 3.3Å; K70-Y107 WeakPolarHBondContact CE-OH 3.49Å
71	A	83.2	Confident	78.1	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-61.8	-49.2	176.2	0	0	0	0	0	112	Y36 F54 V57 W67 G68 F69 K73 Q74 M75	Y36-A71 HydrophobicContact CD2-CB 4.25Å; Y36-A71 HydrophobicContact CE2-CB 4.36Å; F54-A71 HydrophobicContact CB-CB 4.44Å; F54-A71 HydrophobicContact CD1-CB 3.95Å; V57-A71 HydrophobicContact CB-CB 4.47Å; V57-A71 HydrophobicContact CG1-CB 4.29Å; W67-A71 WeakPolarHBondContact O-CB 3.33Å; W67-A71 PolarHBondContact O-N 3.2Å; G68-A71 PolarHBondContact O-N 3.32Å; F69-A71 VanDerWaalsContact C-N 3.34Å; F69-A71 PolarHBondContact O-N 3.46Å; A71-K73 VanDerWaalsContact C-N 3.32Å; A71-K73 PolarHBondContact O-N 2.88Å; A71-Q74 PolarHBondContact O-N 2.81Å; A71-Q74 VanDerWaalsContact O-N 3.12Å; A71-M75 WeakPolarHBondContact O-CG 3.44Å; A71-M75 PolarHBondContact O-N 3.22Å
72	L	83.2	Confident	78.4	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59.5	-41.1	178	-74.5	166.8	0	0	0	112.2	L58 G68 F69 Q74 M75 I76 R91 Q94 L95 Y98	L58-L72 HydrophobicContact CD1-CD2 3.74Å; L58-L72 HydrophobicContact CD1-CG 4.03Å; L58-L72 HydrophobicContact CD2-CD1 3.85Å; L58-L72 HydrophobicContact CD2-CD2 4.09Å; L58-L72 HydrophobicContact CD2-CG 3.77Å; L58-L72 HydrophobicContact CG-CG 4.45Å; G68-L72 WeakPolarHBondContact O-CB 3.42Å; G68-L72 VanDerWaalsContact O-CG 3.29Å; G68-L72 WeakPolarHBondContact O-CG 3.4Å; G68-L72 PolarHBondContact O-N 3.03Å; F69-L72 PolarHBondContact O-N 3.35Å; L72-Q74 VanDerWaalsContact C-N 3.32Å; L72-Q74 PolarHBondContact O-N 3.06Å; L72-M75 HydrophobicContact CD2-SD 4.4Å; L72-M75 PolarHBondContact O-N 2.85Å; L72-I76 WeakPolarHBondContact O-CD1 3.36Å; L72-I76 VanDerWaalsContact O-CG1 3.29Å; L72-I76 WeakPolarHBondContact O-CG1 3.45Å; L72-I76 PolarHBondContact O-N 3.39Å; L72-R91 HydrophobicContact CD2-CB 4.38Å; L72-Q94 HydrophobicContact CD1-CB 4.37Å; L72-Q94 HydrophobicContact CD2-CB 4.28Å; L72-L95 HydrophobicContact CB-CB 4.27Å; L72-L95 HydrophobicContact CB-CD1 4.16Å; L72-L95 HydrophobicContact CD1-CB 4.33Å; L72-Y98 HydrophobicContact CD1-CD2 4Å; L72-Y98 HydrophobicContact CD1-CE2 3.59Å
73	K	83.9	Confident	79	Confident	28 Å²	28	41 Å²	41	12%	0.122	20%	0.198	C	C	.	.	H	α-helix	trans	-57.9	-42.8	175.4	-177.9	178.7	179.8	179.6	0	111.9	F69 K70 A71 K77 L95 S111 I115	F69-K73 PolarHBondContact O-N 2.92Å; K70-K73 PolarHBondContact O-N 3.4Å; A71-K73 VanDerWaalsContact C-N 3.32Å; A71-K73 PolarHBondContact O-N 2.88Å; K73-K77 PolarHBondContact O-N 3.41Å; K73-L95 HydrophobicContact CB-CD1 4.43Å; K73-S111 PolarHBondContact NZ-OG 3.38Å; K73-I115 HydrophobicContact CG-CD1 4.35Å
74	Q	81.6	Confident	79.6	Confident	22 Å²	22	36.2 Å²	36.2	10%	0.103	18%	0.178	C	C	.	.	H	α-helix	trans	-71.3	-40.3	176.9	-67	-58.9	-38.9	0	0	112.2	Y36 F54 K70 A71 L72 I76 K77 I78	Y36-Q74 HydrophobicContact CE2-CG 4.49Å; F54-Q74 HydrophobicContact CE1-CB 4.31Å; F54-Q74 HydrophobicContact CE2-CB 4.15Å; F54-Q74 HydrophobicContact CZ-CB 3.95Å; F54-Q74 HydrophobicContact CZ-CG 4.38Å; K70-Q74 PolarHBondContact O-N 2.9Å; A71-Q74 PolarHBondContact O-N 2.81Å; A71-Q74 VanDerWaalsContact O-N 3.12Å; L72-Q74 VanDerWaalsContact C-N 3.32Å; L72-Q74 PolarHBondContact O-N 3.06Å; Q74-I76 VanDerWaalsContact C-N 3.27Å; Q74-I76 PolarHBondContact O-N 3.31Å; Q74-K77 PolarHBondContact O-N 3.03Å; Q74-K77 VanDerWaalsContact O-N 3.16Å; Q74-I78 WeakPolarHBondContact O-CG1 3.5Å; Q74-I78 PolarHBondContact O-N 2.93Å
75	M	81.6	Confident	79.8	Confident	3 Å²	3	34 Å²	34	2%	0.015	17%	0.169	C	C	.	.	H	α-helix	trans	-59.1	-39.5	175.9	-67.9	176	78.1	0	0	112	L51 F54 Q55 L58 A71 L72 I78 N79	L51-M75 HydrophobicContact CD2-CB 3.91Å; L51-M75 HydrophobicContact CD2-CE 4.28Å; L51-M75 HydrophobicContact CD2-CG 4Å; F54-M75 HydrophobicContact CB-CG 3.52Å; F54-M75 HydrophobicContact CB-SD 3.7Å; F54-M75 HydrophobicContact CD2-CG 4.22Å; F54-M75 HydrophobicContact CG-CG 4.07Å; Q55-M75 HydrophobicContact CB-CE 4.42Å; L58-M75 HydrophobicContact CD1-CE 4.46Å; L58-M75 HydrophobicContact CD1-SD 3.53Å; L58-M75 VanDerWaalsContact CD1-SD 3.53Å; A71-M75 WeakPolarHBondContact O-CG 3.44Å; A71-M75 PolarHBondContact O-N 3.22Å; L72-M75 HydrophobicContact CD2-SD 4.4Å; L72-M75 PolarHBondContact O-N 2.85Å; M75-I78 PolarHBondContact O-N 3.42Å; M75-N79 WeakPolarHBondContact O-CB 3.32Å; M75-N79 PolarHBondContact O-N 2.9Å; M75-N79 PolarHBondContact O-ND2 3.42Å
76	I	83.2	Confident	80	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-61.6	-47.3	175.1	-72.2	158.4	0	0	0	110.9	L72 Q74 I78 N79 F80 M88 R91 Y92 L95 I115	L72-I76 WeakPolarHBondContact O-CD1 3.36Å; L72-I76 VanDerWaalsContact O-CG1 3.29Å; L72-I76 WeakPolarHBondContact O-CG1 3.45Å; L72-I76 PolarHBondContact O-N 3.39Å; Q74-I76 VanDerWaalsContact C-N 3.27Å; Q74-I76 PolarHBondContact O-N 3.31Å; I76-I78 VanDerWaalsContact C-N 3.34Å; I76-I78 PolarHBondContact O-N 3.44Å; I76-N79 PolarHBondContact O-N 2.9Å; I76-F80 VanDerWaalsContact O-CB 3.31Å; I76-F80 WeakPolarHBondContact O-CB 3.32Å; I76-F80 PolarHBondContact O-N 3.43Å; I76-M88 HydrophobicContact CG2-CG 4.06Å; I76-M88 HydrophobicContact CG2-SD 3.73Å; I76-R91 HydrophobicContact CG1-CB 4Å; I76-Y92 HydrophobicContact CD1-CD2 4.02Å; I76-L95 HydrophobicContact CD1-CB 4.25Å; I76-L95 HydrophobicContact CD1-CD1 3.55Å; I76-I115 HydrophobicContact CD1-CD1 4.25Å; I76-I115 HydrophobicContact CG2-CD1 4.49Å; I76-I115 HydrophobicContact CG2-CG2 4.02Å
77	K	81.3	Confident	80.2	Confident	43 Å²	43	36.7 Å²	36.7	19%	0.187	18%	0.184	C	C	.	.	H	α-helix	trans	-61.6	-39.8	177.1	-70.7	-174.8	176.8	-167.5	0	112.3	K73 Q74 K81 Y118	K73-K77 PolarHBondContact O-N 3.41Å; Q74-K77 PolarHBondContact O-N 3.03Å; Q74-K77 VanDerWaalsContact O-N 3.16Å; K77-K81 PolarHBondContact O-N 2.85Å; K77-K81 VanDerWaalsContact O-N 3.12Å; K77-Y118 HydrophobicContact CG-CD1 4.43Å; K77-Y118 HydrophobicContact CG-CE1 4.44Å
78	I	81.8	Confident	80.3	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.01	18%	0.176	C	C	.	.	H	α-helix	trans	-70.1	-46.7	178.8	-65.2	166.7	0	0	0	111.1	K43 P47 A50 L51 F54 Q74 M75 I76 F80 K81 L82	K43-I78 HydrophobicContact CB-CD1 4.45Å; K43-I78 HydrophobicContact CD-CD1 4.27Å; K43-I78 HydrophobicContact CD-CG1 4.27Å; K43-I78 HydrophobicContact CG-CD1 3.91Å; K43-I78 HydrophobicContact CG-CG1 4Å; P47-I78 HydrophobicContact CB-CG2 3.72Å; A50-I78 HydrophobicContact CB-CD1 4.13Å; L51-I78 HydrophobicContact CD1-CG2 4.18Å; L51-I78 HydrophobicContact CD2-CB 4.16Å; L51-I78 HydrophobicContact CD2-CG2 4.05Å; L51-I78 HydrophobicContact CG-CG2 3.91Å; F54-I78 HydrophobicContact CD2-CD1 4.13Å; F54-I78 HydrophobicContact CE2-CD1 3.76Å; Q74-I78 WeakPolarHBondContact O-CG1 3.5Å; Q74-I78 PolarHBondContact O-N 2.93Å; M75-I78 PolarHBondContact O-N 3.42Å; I76-I78 VanDerWaalsContact C-N 3.34Å; I76-I78 PolarHBondContact O-N 3.44Å; I78-F80 PolarHBondContact O-N 2.98Å; I78-K81 PolarHBondContact O-N 2.95Å; I78-K81 VanDerWaalsContact O-N 3.14Å; I78-L82 HydrophobicContact CG2-CD1 3.94Å; I78-L82 HydrophobicContact CG2-CG 4.39Å; I78-L82 WeakPolarHBondContact O-CG 3.39Å; I78-L82 PolarHBondContact O-N 2.71Å
79	N	81	Confident	80.4	Confident	4 Å²	4	35 Å²	35	2%	0.021	18%	0.178	C	C	.	.	H	α-helix	trans	-62.3	-33.1	177.4	-78.6	-33.6	0	0	0	112.2	L51 M75 I76 L82 T83 N84 M88	L51-N79 VanDerWaalsContact CD1-OD1 3.23Å; L51-N79 WeakPolarHBondContact CD1-OD1 3.3Å; M75-N79 WeakPolarHBondContact O-CB 3.32Å; M75-N79 PolarHBondContact O-N 2.9Å; M75-N79 PolarHBondContact O-ND2 3.42Å; I76-N79 PolarHBondContact O-N 2.9Å; N79-L82 PolarHBondContact O-N 2.92Å; N79-T83 PolarHBondContact O-N 3Å; N79-N84 PolarHBondContact O-N 2.88Å; N79-N84 VanDerWaalsContact O-N 3.07Å; N79-M88 HydrophobicContact CB-CB 3.8Å; N79-M88 HydrophobicContact CB-CG 3.93Å
80	F	77.9	Confident	80.5	Confident	23 Å²	23	38.9 Å²	38.9	10%	0.101	20%	0.199	C	C	.	.	H	α-helix	trans	-65	-46.6	172.5	-172.5	-95.9	0	0	0	112.1	I76 I78 L82 T83 F85 M88 Y118 I119 S122	I76-F80 VanDerWaalsContact O-CB 3.31Å; I76-F80 WeakPolarHBondContact O-CB 3.32Å; I76-F80 PolarHBondContact O-N 3.43Å; I78-F80 PolarHBondContact O-N 2.98Å; F80-L82 VanDerWaalsContact C-N 3.27Å; F80-L82 PolarHBondContact O-N 3.27Å; F80-T83 PolarHBondContact O-N 3.27Å; F80-T83 VanDerWaalsContact O-N 3.16Å; F80-F85 HydrophobicContact CD2-CE1 4.3Å; F80-F85 HydrophobicContact CE2-CE1 4.13Å; F80-M88 HydrophobicContact CD2-CE 4.11Å; F80-Y118 HydrophobicContact CD1-CD1 4.24Å; F80-Y118 AromaticContact CD1-CE1 3.89Å; F80-Y118 HydrophobicContact CD1-CE1 3.89Å; F80-I119 HydrophobicContact CD2-CG1 4.06Å; F80-I119 HydrophobicContact CE2-CB 4.33Å; F80-I119 HydrophobicContact CE2-CG1 4.06Å; F80-I119 HydrophobicContact CE2-CG2 3.89Å; F80-I119 HydrophobicContact CZ-CG2 4.37Å; F80-S122 WeakPolarHBondContact CE1-OG 3.45Å; F80-S122 WeakPolarHBondContact CZ-OG 3.45Å
81	K	77.9	Confident	80.7	Confident	122 Å²	122	38.5 Å²	38.5	53%	0.53	20%	0.196	S	C	.	.	H	α-helix	trans	-60.4	-35.3	173.9	-75.6	-171.1	176.7	-169.9	0	112.7	K77 I78 T83 Y118	K77-K81 PolarHBondContact O-N 2.85Å; K77-K81 VanDerWaalsContact O-N 3.12Å; I78-K81 PolarHBondContact O-N 2.95Å; I78-K81 VanDerWaalsContact O-N 3.14Å; K81-T83 VanDerWaalsContact C-N 3.26Å; K81-T83 PolarHBondContact O-N 3.43Å; K81-Y118 WeakPolarHBondContact CE-OH 3.38Å
82	L	77.8	Confident	80.8	Confident	56 Å²	56	38.5 Å²	38.5	29%	0.293	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	7.8	179.3	-67.5	176.2	0	0	0	114.1	P47 K48 L51 I78 N79 F80 N84	P47-L82 HydrophobicContact CB-CD1 4.11Å; P47-L82 HydrophobicContact CB-CD2 4.15Å; P47-L82 HydrophobicContact CB-CG 4.3Å; P47-L82 HydrophobicContact CG-CD2 3.82Å; K48-L82 HydrophobicContact CG-CD1 4.21Å; L51-L82 HydrophobicContact CD1-CD1 4Å; I78-L82 HydrophobicContact CG2-CD1 3.94Å; I78-L82 HydrophobicContact CG2-CG 4.39Å; I78-L82 WeakPolarHBondContact O-CG 3.39Å; I78-L82 PolarHBondContact O-N 2.71Å; N79-L82 PolarHBondContact O-N 2.92Å; F80-L82 VanDerWaalsContact C-N 3.27Å; F80-L82 PolarHBondContact O-N 3.27Å; L82-N84 PolarHBondContact O-N 3.07Å
83	T	75.1	Confident	80.8	Confident	99 Å²	99	43 Å²	43	61%	0.607	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.6	19.4	-178	62.8	0	0	0	0	115.5	N79 F80 K81 F85	N79-T83 PolarHBondContact O-N 3Å; F80-T83 PolarHBondContact O-N 3.27Å; F80-T83 VanDerWaalsContact O-N 3.16Å; K81-T83 VanDerWaalsContact C-N 3.26Å; K81-T83 PolarHBondContact O-N 3.43Å; T83-F85 WeakPolarHBondContact O-CD2 3.25Å; T83-F85 PolarHBondContact O-N 3.06Å; T83-F85 VanDerWaalsContact O-N 3.16Å
84	N	79.7	Confident	80.7	Confident	73 Å²	73	45.5 Å²	45.5	39%	0.39	23%	0.228	S	C	.	.			trans	-90.6	76.9	178.2	-171.9	3.5	0	0	0	110.7	N79 L82 E87 M88	N79-N84 PolarHBondContact O-N 2.88Å; N79-N84 VanDerWaalsContact O-N 3.07Å; L82-N84 PolarHBondContact O-N 3.07Å; N84-E87 WeakPolarHBondContact ND2-CB 3.37Å; N84-M88 WeakPolarHBondContact O-CB 3.43Å; N84-M88 PolarHBondContact O-N 2.75Å
85	F	76.9	Confident	80.8	Confident	52 Å²	52	44.5 Å²	44.5	23%	0.228	22%	0.223	C	C	.	.	H	α-helix	trans	-66.2	-39.7	-174.2	-53.1	-65.2	0	0	0	115.8	F80 T83 E87 M88 M89 L134	F80-F85 HydrophobicContact CD2-CE1 4.3Å; F80-F85 HydrophobicContact CE2-CE1 4.13Å; T83-F85 WeakPolarHBondContact O-CD2 3.25Å; T83-F85 PolarHBondContact O-N 3.06Å; T83-F85 VanDerWaalsContact O-N 3.16Å; F85-E87 PolarHBondContact O-N 2.99Å; F85-M88 HydrophobicContact CD1-CE 4.49Å; F85-M88 WeakPolarHBondContact O-CB 3.43Å; F85-M88 PolarHBondContact O-N 2.99Å; F85-M89 PolarHBondContact O-N 2.8Å; F85-L134 HydrophobicContact CB-CD1 3.37Å; F85-L134 HydrophobicContact CB-CD2 3.79Å; F85-L134 HydrophobicContact CB-CG 4.12Å; F85-L134 HydrophobicContact CD1-CD1 3.99Å; F85-L134 HydrophobicContact CD1-CD2 3.35Å; F85-L134 HydrophobicContact CD1-CG 4.26Å; F85-L134 HydrophobicContact CD2-CD1 4.04Å; F85-L134 HydrophobicContact CE1-CD2 4.13Å; F85-L134 HydrophobicContact CG-CD1 3.54Å; F85-L134 HydrophobicContact CG-CD2 3.79Å; F85-L134 HydrophobicContact CG-CG 4.28Å
86	P	79.4	Confident	80.7	Confident	94 Å²	94	45.1 Å²	45.1	61%	0.61	23%	0.226	S	C	*	.	H	α-helix	trans	-62.9	-42.7	180	-23.9	34.7	0	0	0	112.7	M88 M89 N90	P86-M88 VanDerWaalsContact C-N 3.33Å; P86-M89 PolarHBondContact O-N 3.43Å; P86-N90 PolarHBondContact O-N 3.1Å
87	E	78.5	Confident	80.7	Confident	58 Å²	58	48.1 Å²	48.1	27%	0.271	25%	0.245	S	C	.	.	H	α-helix	trans	-69.5	-36	178.1	-171.2	59	-162	0	0	111	N84 F85 M89 N90 R91	N84-E87 WeakPolarHBondContact ND2-CB 3.37Å; F85-E87 PolarHBondContact O-N 2.99Å; E87-M89 VanDerWaalsContact C-N 3.33Å; E87-M89 PolarHBondContact O-N 3.29Å; E87-N90 WeakPolarHBondContact O-CB 3.35Å; E87-N90 PolarHBondContact O-N 3.26Å; E87-R91 WeakPolarHBondContact O-CG 3.45Å; E87-R91 PolarHBondContact O-N 3.1Å; E87-R91 IonicContact OE1-CZ 3.26Å; E87-R91 VanDerWaalsContact OE1-CZ 3.26Å; E87-R91 IonicContact OE1-NE 2.88Å; E87-R91 PolarHBondContact OE1-NE 2.56Å; E87-R91 IonicContact OE1-NH2 3.8Å; E87-R91 PolarHBondContact OE1-NH2 3Å
88	M	81.6	Confident	80.4	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-59.1	-43.5	174.5	-161.6	-94.4	-62.7	0	0	111.9	I76 N79 F80 N84 F85 P86 N90 R91 Y92 I119 L134 F138	I76-M88 HydrophobicContact CG2-CG 4.06Å; I76-M88 HydrophobicContact CG2-SD 3.73Å; N79-M88 HydrophobicContact CB-CB 3.8Å; N79-M88 HydrophobicContact CB-CG 3.93Å; F80-M88 HydrophobicContact CD2-CE 4.11Å; N84-M88 WeakPolarHBondContact O-CB 3.43Å; N84-M88 PolarHBondContact O-N 2.75Å; F85-M88 HydrophobicContact CD1-CE 4.49Å; F85-M88 WeakPolarHBondContact O-CB 3.43Å; F85-M88 PolarHBondContact O-N 2.99Å; P86-M88 VanDerWaalsContact C-N 3.33Å; M88-N90 PolarHBondContact O-N 3.05Å; M88-R91 PolarHBondContact O-N 3.36Å; M88-Y92 WeakPolarHBondContact O-CB 3.37Å; M88-Y92 PolarHBondContact O-N 3.28Å; M88-I119 HydrophobicContact CE-CD1 4.45Å; M88-L134 HydrophobicContact CE-CD2 3.68Å; M88-F138 HydrophobicContact CE-CD2 4.22Å; M88-F138 HydrophobicContact CE-CE1 4.02Å; M88-F138 HydrophobicContact CE-CE2 3.17Å; M88-F138 HydrophobicContact CE-CZ 3.08Å; M88-F138 HydrophobicContact SD-CE1 3.58Å; M88-F138 VanDerWaalsContact SD-CE1 3.58Å; M88-F138 HydrophobicContact SD-CE2 3.86Å; M88-F138 HydrophobicContact SD-CZ 3.06Å; M88-F138 WeakPolarHBondContact SD-CZ 3.02Å
89	M	80.1	Confident	80	Confident	9 Å²	9	48 Å²	48	4%	0.044	25%	0.245	C	C	.	.	H	α-helix	trans	-64	-39.2	175.6	-174.7	58.5	77.8	0	0	112.4	F85 P86 E87 R91 Y92 K93 E137 F138 T141	F85-M89 PolarHBondContact O-N 2.8Å; P86-M89 PolarHBondContact O-N 3.43Å; E87-M89 VanDerWaalsContact C-N 3.33Å; E87-M89 PolarHBondContact O-N 3.29Å; M89-R91 PolarHBondContact O-N 3Å; M89-Y92 WeakPolarHBondContact O-CB 3.32Å; M89-Y92 PolarHBondContact O-N 3.27Å; M89-Y92 HydrophobicContact SD-CD1 4.35Å; M89-K93 WeakPolarHBondContact O-CG 3.36Å; M89-K93 PolarHBondContact O-N 2.92Å; M89-E137 HydrophobicContact CE-CB 3.76Å; M89-E137 HydrophobicContact CE-CG 3.66Å; M89-F138 HydrophobicContact CB-CZ 4.39Å; M89-F138 HydrophobicContact CE-CD1 4.38Å; M89-F138 HydrophobicContact CE-CD2 3.53Å; M89-F138 HydrophobicContact CE-CE1 4.23Å; M89-F138 HydrophobicContact CE-CE2 3.27Å; M89-F138 HydrophobicContact CE-CG 4Å; M89-F138 HydrophobicContact CE-CZ 3.6Å; M89-F138 HydrophobicContact SD-CE1 4.3Å; M89-F138 HydrophobicContact SD-CE2 4.24Å; M89-F138 HydrophobicContact SD-CZ 3.94Å; M89-T141 HydrophobicContact SD-CG2 4.19Å
90	N	84.6	Confident	79.2	Confident	81 Å²	81	55.6 Å²	55.6	43%	0.433	27%	0.273	S	S	.	.	H	α-helix	trans	-61.6	-43.6	174.8	-72.6	-26.4	0	0	0	111.7	P86 E87 M88 Y92 K93 Q94	P86-N90 PolarHBondContact O-N 3.1Å; E87-N90 WeakPolarHBondContact O-CB 3.35Å; E87-N90 PolarHBondContact O-N 3.26Å; M88-N90 PolarHBondContact O-N 3.05Å; N90-Y92 VanDerWaalsContact C-N 3.34Å; N90-K93 PolarHBondContact O-N 3.22Å; N90-Q94 WeakPolarHBondContact O-CG 3.45Å; N90-Q94 PolarHBondContact O-N 2.77Å; N90-Q94 VanDerWaalsContact O-N 3.08Å
91	R	84.7	Confident	78.6	Confident	37 Å²	37	58.6 Å²	58.6	14%	0.14	30%	0.297	C	S	.	.	H	α-helix	trans	-67.5	-35.1	175.4	-58	-48.7	170.1	157.9	3.3	112.5	L72 I76 E87 M88 M89 Q94 L95	L72-R91 HydrophobicContact CD2-CB 4.38Å; I76-R91 HydrophobicContact CG1-CB 4Å; E87-R91 WeakPolarHBondContact O-CG 3.45Å; E87-R91 PolarHBondContact O-N 3.1Å; E87-R91 IonicContact OE1-CZ 3.26Å; E87-R91 VanDerWaalsContact OE1-CZ 3.26Å; E87-R91 IonicContact OE1-NE 2.88Å; E87-R91 PolarHBondContact OE1-NE 2.56Å; E87-R91 IonicContact OE1-NH2 3.8Å; E87-R91 PolarHBondContact OE1-NH2 3Å; M88-R91 PolarHBondContact O-N 3.36Å; M89-R91 PolarHBondContact O-N 3Å; R91-Q94 WeakPolarHBondContact O-CB 3.32Å; R91-Q94 PolarHBondContact O-N 2.91Å; R91-L95 PolarHBondContact O-N 3.24Å
92	Y	84.3	Confident	77.7	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-63.5	-47.1	173.9	-168.9	-112.6	0	0	0	112	I76 M88 M89 N90 Q94 L95 L96 I115 F138 T142	I76-Y92 HydrophobicContact CD1-CD2 4.02Å; M88-Y92 WeakPolarHBondContact O-CB 3.37Å; M88-Y92 PolarHBondContact O-N 3.28Å; M89-Y92 WeakPolarHBondContact O-CB 3.32Å; M89-Y92 PolarHBondContact O-N 3.27Å; M89-Y92 HydrophobicContact SD-CD1 4.35Å; N90-Y92 VanDerWaalsContact C-N 3.34Å; Y92-Q94 VanDerWaalsContact C-N 3.27Å; Y92-Q94 PolarHBondContact O-N 3.31Å; Y92-L95 WeakPolarHBondContact O-CB 3.43Å; Y92-L95 PolarHBondContact O-N 3.18Å; Y92-L95 VanDerWaalsContact O-N 3.07Å; Y92-L96 HydrophobicContact CD1-CD1 3.92Å; Y92-L96 HydrophobicContact CD1-CG 4.29Å; Y92-L96 HydrophobicContact CE1-CD1 3.71Å; Y92-L96 HydrophobicContact CE1-CD2 4.07Å; Y92-L96 HydrophobicContact CE1-CG 4.05Å; Y92-L96 WeakPolarHBondContact O-CG 3.48Å; Y92-L96 PolarHBondContact O-N 3.3Å; Y92-I115 HydrophobicContact CE2-CD1 4.49Å; Y92-I115 HydrophobicContact CE2-CG2 4.43Å; Y92-F138 AromaticContact CD1-CD1 3.67Å; Y92-F138 HydrophobicContact CD1-CD1 3.67Å; Y92-F138 AromaticContact CD1-CE1 3.56Å; Y92-F138 HydrophobicContact CD1-CE1 3.56Å; Y92-F138 HydrophobicContact CD2-CD1 4.2Å; Y92-F138 AromaticContact CD2-CE1 3.8Å; Y92-F138 HydrophobicContact CD2-CE1 3.8Å; Y92-F138 AromaticContact CE1-CD1 3.79Å; Y92-F138 HydrophobicContact CE1-CD1 3.79Å; Y92-F138 HydrophobicContact CE1-CE1 4.15Å; Y92-F138 HydrophobicContact CE2-CD1 4.32Å; Y92-F138 HydrophobicContact CE2-CE1 4.37Å; Y92-F138 AromaticContact CG-CD1 3.9Å; Y92-F138 HydrophobicContact CG-CD1 3.9Å; Y92-F138 AromaticContact CG-CE1 3.38Å; Y92-F138 HydrophobicContact CG-CE1 3.38Å; Y92-F138 HydrophobicContact CG-CZ 4.38Å; Y92-T142 WeakPolarHBondContact CE1-OG1 3.43Å; Y92-T142 WeakPolarHBondContact OH-CG2 3.46Å; Y92-T142 PolarHBondContact OH-OG1 3.24Å
93	K	83.8	Confident	77.1	Confident	95 Å²	95	52.4 Å²	52.4	41%	0.413	27%	0.274	S	S	.	.	H	α-helix	trans	-58.5	-39.5	174.3	-72.6	175.4	-177.9	172.3	0	111.9	M89 N90 L96 T97	M89-K93 WeakPolarHBondContact O-CG 3.36Å; M89-K93 PolarHBondContact O-N 2.92Å; N90-K93 PolarHBondContact O-N 3.22Å; K93-L96 PolarHBondContact O-N 3.19Å; K93-T97 WeakPolarHBondContact O-CG2 3.38Å
94	Q	82.2	Confident	76.8	Confident	81 Å²	81	52.5 Å²	52.5	38%	0.379	28%	0.275	S	S	.	.	H	α-helix	trans	-61.7	-46.7	173.3	-72.7	174.5	-6.3	0	0	111.5	L72 N90 R91 Y92 L96 T97 Y98	L72-Q94 HydrophobicContact CD1-CB 4.37Å; L72-Q94 HydrophobicContact CD2-CB 4.28Å; N90-Q94 WeakPolarHBondContact O-CG 3.45Å; N90-Q94 PolarHBondContact O-N 2.77Å; N90-Q94 VanDerWaalsContact O-N 3.08Å; R91-Q94 WeakPolarHBondContact O-CB 3.32Å; R91-Q94 PolarHBondContact O-N 2.91Å; Y92-Q94 VanDerWaalsContact C-N 3.27Å; Y92-Q94 PolarHBondContact O-N 3.31Å; Q94-L96 VanDerWaalsContact C-N 3.32Å; Q94-L96 PolarHBondContact O-N 3.14Å; Q94-T97 WeakPolarHBondContact O-CB 3.13Å; Q94-T97 PolarHBondContact O-N 2.83Å; Q94-T97 PolarHBondContact O-OG1 3Å; Q94-Y98 VanDerWaalsContact O-CD2 3.31Å; Q94-Y98 WeakPolarHBondContact O-CD2 3.26Å
95	L	84.1	Confident	76.3	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-58.1	-41.9	177.3	-174	155.9	0	0	0	112	F69 L72 K73 I76 R91 Y92 T97 Y98 I115	F69-L95 HydrophobicContact CD2-CD2 4.34Å; F69-L95 HydrophobicContact CD2-CG 4.02Å; F69-L95 HydrophobicContact CE2-CD1 4.33Å; F69-L95 HydrophobicContact CE2-CD2 3.46Å; F69-L95 VanDerWaalsContact CE2-CD2 3.46Å; F69-L95 HydrophobicContact CE2-CG 3.62Å; F69-L95 HydrophobicContact CZ-CD1 4.39Å; F69-L95 HydrophobicContact CZ-CD2 3.78Å; F69-L95 HydrophobicContact CZ-CG 4.12Å; L72-L95 HydrophobicContact CB-CB 4.27Å; L72-L95 HydrophobicContact CB-CD1 4.16Å; L72-L95 HydrophobicContact CD1-CB 4.33Å; K73-L95 HydrophobicContact CB-CD1 4.43Å; I76-L95 HydrophobicContact CD1-CB 4.25Å; I76-L95 HydrophobicContact CD1-CD1 3.55Å; R91-L95 PolarHBondContact O-N 3.24Å; Y92-L95 WeakPolarHBondContact O-CB 3.43Å; Y92-L95 PolarHBondContact O-N 3.18Å; Y92-L95 VanDerWaalsContact O-N 3.07Å; L95-T97 PolarHBondContact O-N 3.11Å; L95-T97 VanDerWaalsContact O-N 3.14Å; L95-Y98 WeakPolarHBondContact O-CB 3.3Å; L95-Y98 PolarHBondContact O-N 3.37Å; L95-I115 HydrophobicContact CD1-CD1 4.14Å
96	L	79.5	Confident	76	Confident	16 Å²	16	57.9 Å²	57.9	8%	0.084	30%	0.297	C	S	.	.	H	α-helix	trans	-59.9	-25.9	177.9	-65.8	174	0	0	0	112.7	Y92 K93 Q94 Y98 I99 A145	Y92-L96 HydrophobicContact CD1-CD1 3.92Å; Y92-L96 HydrophobicContact CD1-CG 4.29Å; Y92-L96 HydrophobicContact CE1-CD1 3.71Å; Y92-L96 HydrophobicContact CE1-CD2 4.07Å; Y92-L96 HydrophobicContact CE1-CG 4.05Å; Y92-L96 WeakPolarHBondContact O-CG 3.48Å; Y92-L96 PolarHBondContact O-N 3.3Å; K93-L96 PolarHBondContact O-N 3.19Å; Q94-L96 VanDerWaalsContact C-N 3.32Å; Q94-L96 PolarHBondContact O-N 3.14Å; L96-Y98 VanDerWaalsContact C-N 3.28Å; L96-Y98 PolarHBondContact O-N 2.97Å; L96-I99 HydrophobicContact CB-CD1 4.23Å; L96-I99 HydrophobicContact CD2-CD1 3.51Å; L96-I99 HydrophobicContact CG-CD1 4.46Å; L96-I99 WeakPolarHBondContact O-CB 3.49Å; L96-I99 WeakPolarHBondContact O-CG1 3.43Å; L96-I99 PolarHBondContact O-N 3Å; L96-A145 HydrophobicContact CB-CB 3.89Å; L96-A145 HydrophobicContact CD1-CB 3.73Å; L96-A145 HydrophobicContact CD2-CB 4.07Å; L96-A145 HydrophobicContact CG-CB 4.1Å
97	T	81.8	Confident	75.8	Confident	66 Å²	66	55.5 Å²	55.5	41%	0.405	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-16.7	176.7	76.8	0	0	0	0	114.3	K64 K93 Q94 L95	K64-T97 VanDerWaalsContact NZ-CB 3.33Å; K64-T97 PolarHBondContact NZ-O 2.71Å; K64-T97 PolarHBondContact NZ-OG1 3.18Å; K93-T97 WeakPolarHBondContact O-CG2 3.38Å; Q94-T97 WeakPolarHBondContact O-CB 3.13Å; Q94-T97 PolarHBondContact O-N 2.83Å; Q94-T97 PolarHBondContact O-OG1 3Å; L95-T97 PolarHBondContact O-N 3.11Å; L95-T97 VanDerWaalsContact O-N 3.14Å
98	Y	76.6	Confident	75.6	Confident	20 Å²	20	52.8 Å²	52.8	8%	0.078	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-17	178.6	-76.3	-111.7	0	0	0	112.3	L58 K64 F69 L72 Q94 L95 L96 R100 S101 A102	L58-Y98 WeakPolarHBondContact CD2-OH 3.21Å; K64-Y98 HydrophobicContact CB-CD1 3.79Å; K64-Y98 HydrophobicContact CB-CE1 3.58Å; K64-Y98 HydrophobicContact CD-CD1 4.36Å; K64-Y98 HydrophobicContact CD-CD2 4.31Å; K64-Y98 HydrophobicContact CD-CE1 4.34Å; K64-Y98 HydrophobicContact CD-CE2 4.27Å; K64-Y98 HydrophobicContact CD-CG 4.34Å; K64-Y98 HydrophobicContact CG-CD1 4.29Å; K64-Y98 HydrophobicContact CG-CE1 3.88Å; K64-Y98 HydrophobicContact CG-CE2 4.41Å; F69-Y98 HydrophobicContact CB-CD1 4.32Å; F69-Y98 HydrophobicContact CD2-CG 4.3Å; L72-Y98 HydrophobicContact CD1-CD2 4Å; L72-Y98 HydrophobicContact CD1-CE2 3.59Å; Q94-Y98 VanDerWaalsContact O-CD2 3.31Å; Q94-Y98 WeakPolarHBondContact O-CD2 3.26Å; L95-Y98 WeakPolarHBondContact O-CB 3.3Å; L95-Y98 PolarHBondContact O-N 3.37Å; L96-Y98 VanDerWaalsContact C-N 3.28Å; L96-Y98 PolarHBondContact O-N 2.97Å; Y98-R100 PolarHBondContact O-N 2.93Å; Y98-S101 PolarHBondContact O-N 3.04Å; Y98-A102 HydrophobicContact CD1-CB 3.76Å; Y98-A102 HydrophobicContact CG-CB 4.42Å; Y98-A102 PolarHBondContact O-N 3.41Å
99	I	71.9	Confident	75.2	Confident	21 Å²	21	54 Å²	54	11%	0.108	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-29.6	-176.7	-61.5	174.4	0	0	0	112.4	L96 I112 A149	L96-I99 HydrophobicContact CB-CD1 4.23Å; L96-I99 HydrophobicContact CD2-CD1 3.51Å; L96-I99 HydrophobicContact CG-CD1 4.46Å; L96-I99 WeakPolarHBondContact O-CB 3.49Å; L96-I99 WeakPolarHBondContact O-CG1 3.43Å; L96-I99 PolarHBondContact O-N 3Å; I99-I112 HydrophobicContact CD1-CD1 3.77Å; I99-A149 HydrophobicContact CG2-CB 4.25Å
100	R	65.5	Low	75.1	Confident	165 Å²	165	60.8 Å²	60.8	62%	0.623	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-29.7	-176.1	-62.7	-170.1	-164.4	176.1	12.7	114.6	Y98 D148	Y98-R100 PolarHBondContact O-N 2.93Å; R100-D148 IonicContact CZ-OD2 2.97Å; R100-D148 IonicContact NH1-OD2 2.66Å; R100-D148 VanDerWaalsContact NH2-CG 3.27Å; R100-D148 IonicContact NH2-OD2 2.81Å; R100-D148 PolarHBondContact NH2-OD2 3.09Å
101	S	64.1	Low	74.7	Confident	85 Å²	85	57 Å²	57	59%	0.594	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.8	-26.6	-160.1	61.5	0	0	0	0	115	Y98	Y98-S101 PolarHBondContact O-N 3.04Å
102	A	59	Low	74.6	Confident	27 Å²	27	55.2 Å²	55.2	22%	0.223	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.6	-24.4	-164.1	0	0	0	0	0	114.2	K64 Y98	K64-A102 HydrophobicContact CB-CB 3.83Å; K64-A102 WeakPolarHBondContact O-CB 3.34Å; Y98-A102 HydrophobicContact CD1-CB 3.76Å; Y98-A102 HydrophobicContact CG-CB 4.42Å; Y98-A102 PolarHBondContact O-N 3.41Å
103	V	65.1	Low	74.2	Confident	22 Å²	22	56 Å²	56	13%	0.133	28%	0.276	C	S	.	.	S	Bend	trans	-136.3	144.5	-165.4	178.4	0	0	0	0	110.1	F69 Y107	F69-V103 HydrophobicContact CB-CG2 3.75Å; F69-V103 HydrophobicContact CD1-CG2 4.31Å; F69-V103 HydrophobicContact CD2-CG2 3.86Å; F69-V103 HydrophobicContact CG-CG2 3.72Å; V103-Y107 HydrophobicContact CG1-CD1 3.42Å; V103-Y107 VanDerWaalsContact CG1-CD1 3.42Å; V103-Y107 HydrophobicContact CG1-CE1 4.36Å; V103-Y107 HydrophobicContact CG1-CG 4.03Å
104	T	69.8	Low	74.1	Confident	100 Å²	100	53.7 Å²	53.7	61%	0.613	27%	0.272	S	S	*	.			trans	-62.5	145.6	177.5	69.1	0	0	0	0	111.3	N106 Y107 S108	T104-N106 VanDerWaalsContact C-N 3.27Å; T104-N106 PolarHBondContact O-N 3.29Å; T104-Y107 PolarHBondContact O-N 3.1Å; T104-Y107 VanDerWaalsContact O-N 3.15Å; T104-Y107 VanDerWaalsContact OG1-CB 3.29Å; T104-Y107 WeakPolarHBondContact OG1-CB 3.37Å; T104-Y107 PolarHBondContact OG1-N 3.45Å; T104-S108 PolarHBondContact O-N 2.86Å
105	R	69.6	Low	74	Confident	119 Å²	119	49.9 Å²	49.9	45%	0.449	25%	0.254	S	S	.	.	H	α-helix	trans	-55.3	-42.3	-178.6	-175.9	167.8	164.6	164	-15.3	112.2	S108 E109 K150 N151	R105-S108 PolarHBondContact O-N 3.06Å; R105-S108 PolarHBondContact O-OG 2.74Å; R105-E109 WeakPolarHBondContact O-CB 3.28Å; R105-E109 PolarHBondContact O-N 3.34Å; R105-K150 PolarHBondContact NH1-O 2.99Å; R105-K150 PolarHBondContact NH2-O 3.5Å; R105-N151 VanDerWaalsContact NE-CG 3.34Å; R105-N151 PolarHBondContact NE-OD1 3.3Å; R105-N151 VanDerWaalsContact NH2-CA 3.32Å; R105-N151 PolarHBondContact NH2-OD1 2.79Å
106	N	70.9	Confident	73.6	Confident	119 Å²	119	50 Å²	50	64%	0.636	25%	0.254	S	S	*	.	H	α-helix	trans	-65.3	-41.9	178.7	-69	-14	0	0	0	112.7	T104 E109 K110	T104-N106 VanDerWaalsContact C-N 3.27Å; T104-N106 PolarHBondContact O-N 3.29Å; N106-E109 PolarHBondContact O-N 3.12Å; N106-K110 PolarHBondContact O-N 2.61Å
107	Y	73.4	Confident	73.5	Confident	44 Å²	44	52.3 Å²	52.3	17%	0.173	27%	0.267	C	S	.	.	H	α-helix	trans	-68.5	-39.1	179.4	-171.3	-90.1	0	0	0	112	F69 K70 V103 T104 E109 S111	F69-Y107 HydrophobicContact CD1-CD1 4.14Å; F69-Y107 AromaticContact CD1-CE1 3.71Å; F69-Y107 HydrophobicContact CD1-CE1 3.71Å; F69-Y107 AromaticContact CE1-CD1 3.9Å; F69-Y107 HydrophobicContact CE1-CD1 3.9Å; F69-Y107 AromaticContact CE1-CE1 3.74Å; F69-Y107 HydrophobicContact CE1-CE1 3.74Å; K70-Y107 VanDerWaalsContact CE-OH 3.3Å; K70-Y107 WeakPolarHBondContact CE-OH 3.49Å; V103-Y107 HydrophobicContact CG1-CD1 3.42Å; V103-Y107 VanDerWaalsContact CG1-CD1 3.42Å; V103-Y107 HydrophobicContact CG1-CE1 4.36Å; V103-Y107 HydrophobicContact CG1-CG 4.03Å; T104-Y107 PolarHBondContact O-N 3.1Å; T104-Y107 VanDerWaalsContact O-N 3.15Å; T104-Y107 VanDerWaalsContact OG1-CB 3.29Å; T104-Y107 WeakPolarHBondContact OG1-CB 3.37Å; T104-Y107 PolarHBondContact OG1-N 3.45Å; Y107-E109 VanDerWaalsContact C-N 3.33Å; Y107-E109 PolarHBondContact O-N 3.36Å; Y107-S111 WeakPolarHBondContact O-CB 3.5Å; Y107-S111 PolarHBondContact O-N 3.47Å; Y107-S111 PolarHBondContact O-OG 3.4Å; Y107-S111 VanDerWaalsContact O-OG 3.07Å
108	S	75.8	Confident	73.2	Confident	2 Å²	2	53.2 Å²	53.2	1%	0.014	26%	0.263	C	S	.	.	H	α-helix	trans	-62.6	-40.1	174	74.2	0	0	0	0	112	T104 R105 S111 I112	T104-S108 PolarHBondContact O-N 2.86Å; R105-S108 PolarHBondContact O-N 3.06Å; R105-S108 PolarHBondContact O-OG 2.74Å; S108-S111 PolarHBondContact O-N 2.96Å; S108-I112 VanDerWaalsContact O-CG1 3.26Å; S108-I112 WeakPolarHBondContact O-CG1 3.37Å; S108-I112 PolarHBondContact O-N 3.4Å
109	E	72.5	Confident	73.1	Confident	24 Å²	24	52.4 Å²	52.4	11%	0.112	26%	0.261	C	S	.	.	H	α-helix	trans	-67	-46.1	178.8	177.3	167.1	167	0	0	112.8	R105 N106 Y107 S111 I112 N113 N151 L154	R105-E109 WeakPolarHBondContact O-CB 3.28Å; R105-E109 PolarHBondContact O-N 3.34Å; N106-E109 PolarHBondContact O-N 3.12Å; Y107-E109 VanDerWaalsContact C-N 3.33Å; Y107-E109 PolarHBondContact O-N 3.36Å; E109-S111 VanDerWaalsContact C-N 3.29Å; E109-S111 PolarHBondContact O-N 3.25Å; E109-I112 PolarHBondContact O-N 2.84Å; E109-N113 WeakPolarHBondContact O-CB 3.49Å; E109-N113 PolarHBondContact O-N 3.21Å; E109-N113 PolarHBondContact O-ND2 3.37Å; E109-N151 PolarHBondContact OE2-ND2 3.49Å; E109-L154 HydrophobicContact CB-CD2 4.21Å; E109-L154 HydrophobicContact CG-CB 4.25Å; E109-L154 HydrophobicContact CG-CD1 4.08Å; E109-L154 HydrophobicContact CG-CD2 4.09Å; E109-L154 HydrophobicContact CG-CG 4.36Å
110	K	78.5	Confident	72.9	Confident	153 Å²	153	53.8 Å²	53.8	67%	0.665	27%	0.272	S	S	*	.	H	α-helix	trans	-58.5	-43.4	173.4	-74	-176.4	179.7	-177.9	0	111.1	N106 N113 S114	N106-K110 PolarHBondContact O-N 2.61Å; K110-N113 PolarHBondContact O-N 3.01Å; K110-S114 WeakPolarHBondContact O-CB 3.45Å; K110-S114 PolarHBondContact O-N 3.01Å
111	S	76.7	Confident	73.1	Confident	1 Å²	1	51 Å²	51	1%	0.007	27%	0.274	C	S	.	.	H	α-helix	trans	-68.2	-41.3	-178.1	-69	0	0	0	0	113	K73 Y107 S108 E109 S114 I115	K73-S111 PolarHBondContact NZ-OG 3.38Å; Y107-S111 WeakPolarHBondContact O-CB 3.5Å; Y107-S111 PolarHBondContact O-N 3.47Å; Y107-S111 PolarHBondContact O-OG 3.4Å; Y107-S111 VanDerWaalsContact O-OG 3.07Å; S108-S111 PolarHBondContact O-N 2.96Å; E109-S111 VanDerWaalsContact C-N 3.29Å; E109-S111 PolarHBondContact O-N 3.25Å; S111-S114 PolarHBondContact O-N 2.81Å; S111-I115 VanDerWaalsContact O-CG1 3.31Å; S111-I115 WeakPolarHBondContact O-CG1 3.47Å; S111-I115 PolarHBondContact O-N 3.12Å
112	I	80.7	Confident	72.9	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-63.9	-46	174.8	-69.2	164.1	0	0	0	110.5	I99 S108 E109 S114 I115 L116 T142 L154	I99-I112 HydrophobicContact CD1-CD1 3.77Å; S108-I112 VanDerWaalsContact O-CG1 3.26Å; S108-I112 WeakPolarHBondContact O-CG1 3.37Å; S108-I112 PolarHBondContact O-N 3.4Å; E109-I112 PolarHBondContact O-N 2.84Å; I112-S114 PolarHBondContact O-N 3.35Å; I112-I115 PolarHBondContact O-N 2.97Å; I112-L116 HydrophobicContact CG2-CD1 3.73Å; I112-L116 HydrophobicContact CG2-CG 4.29Å; I112-L116 WeakPolarHBondContact O-CB 3.47Å; I112-L116 VanDerWaalsContact O-CG 3.31Å; I112-L116 WeakPolarHBondContact O-CG 3.34Å; I112-L116 PolarHBondContact O-N 3.48Å; I112-T142 HydrophobicContact CG2-CG2 3.93Å; I112-L154 HydrophobicContact CB-CD2 4.41Å; I112-L154 HydrophobicContact CD1-CD2 3.93Å; I112-L154 HydrophobicContact CG2-CD2 4.34Å
113	N	77.6	Confident	72.6	Confident	17 Å²	17	55.4 Å²	55.4	9%	0.091	28%	0.28	C	S	.	.	H	α-helix	trans	-60.2	-45.8	176.7	-77.9	-59.4	0	0	0	111.5	E109 K110 I115 L116 D117	E109-N113 WeakPolarHBondContact O-CB 3.49Å; E109-N113 PolarHBondContact O-N 3.21Å; E109-N113 PolarHBondContact O-ND2 3.37Å; K110-N113 PolarHBondContact O-N 3.01Å; N113-I115 VanDerWaalsContact C-N 3.31Å; N113-I115 PolarHBondContact O-N 3.13Å; N113-L116 PolarHBondContact O-N 3.48Å; N113-D117 VanDerWaalsContact O-CB 3.31Å; N113-D117 WeakPolarHBondContact O-CB 3.48Å; N113-D117 PolarHBondContact O-N 3.39Å
114	S	80.9	Confident	71.8	Confident	45 Å²	45	62.6 Å²	62.6	32%	0.315	31%	0.312	S	S	.	.	H	α-helix	trans	-58.6	-40.2	176.9	179.3	0	0	0	0	112.6	K110 S111 I112 Y118	K110-S114 WeakPolarHBondContact O-CB 3.45Å; K110-S114 PolarHBondContact O-N 3.01Å; S111-S114 PolarHBondContact O-N 2.81Å; I112-S114 PolarHBondContact O-N 3.35Å; S114-Y118 VanDerWaalsContact O-CB 3.24Å; S114-Y118 WeakPolarHBondContact O-CB 3.5Å; S114-Y118 PolarHBondContact O-N 3.35Å
115	I	80.1	Confident	70.7	Confident	2 Å²	2	65.3 Å²	65.3	1%	0.01	32%	0.323	C	S	.	.	H	α-helix	trans	-67.8	-47.1	176.5	-68.6	165.8	0	0	0	110.6	K73 I76 Y92 L95 S111 I112 N113 D117 Y118 I119	K73-I115 HydrophobicContact CG-CD1 4.35Å; I76-I115 HydrophobicContact CD1-CD1 4.25Å; I76-I115 HydrophobicContact CG2-CD1 4.49Å; I76-I115 HydrophobicContact CG2-CG2 4.02Å; Y92-I115 HydrophobicContact CE2-CD1 4.49Å; Y92-I115 HydrophobicContact CE2-CG2 4.43Å; L95-I115 HydrophobicContact CD1-CD1 4.14Å; S111-I115 VanDerWaalsContact O-CG1 3.31Å; S111-I115 WeakPolarHBondContact O-CG1 3.47Å; S111-I115 PolarHBondContact O-N 3.12Å; I112-I115 PolarHBondContact O-N 2.97Å; N113-I115 VanDerWaalsContact C-N 3.31Å; N113-I115 PolarHBondContact O-N 3.13Å; I115-D117 PolarHBondContact O-N 2.89Å; I115-Y118 PolarHBondContact O-N 3.34Å; I115-I119 HydrophobicContact CG2-CD1 3.63Å; I115-I119 HydrophobicContact CG2-CG1 4.4Å; I115-I119 VanDerWaalsContact O-CG1 3.27Å; I115-I119 WeakPolarHBondContact O-CG1 3.4Å; I115-I119 PolarHBondContact O-N 2.96Å
116	L	75.4	Confident	69.5	Low	1 Å²	1	64.9 Å²	64.9	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-63.1	-42.3	179.7	-70	171.1	0	0	0	111.8	I112 N113 I119 S120 Y139	I112-L116 HydrophobicContact CG2-CD1 3.73Å; I112-L116 HydrophobicContact CG2-CG 4.29Å; I112-L116 WeakPolarHBondContact O-CB 3.47Å; I112-L116 VanDerWaalsContact O-CG 3.31Å; I112-L116 WeakPolarHBondContact O-CG 3.34Å; I112-L116 PolarHBondContact O-N 3.48Å; N113-L116 PolarHBondContact O-N 3.48Å; L116-I119 PolarHBondContact O-N 3Å; L116-S120 VanDerWaalsContact O-CB 3.23Å; L116-S120 WeakPolarHBondContact O-CB 3.2Å; L116-S120 PolarHBondContact O-N 3.41Å; L116-S120 PolarHBondContact O-OG 3.48Å; L116-Y139 HydrophobicContact CD1-CD1 4.44Å; L116-Y139 HydrophobicContact CD1-CE1 3.84Å; L116-Y139 HydrophobicContact CD2-CD1 4.17Å; L116-Y139 HydrophobicContact CD2-CE1 3.81Å; L116-Y139 HydrophobicContact CG-CE1 4.34Å
117	D	77.3	Confident	68.7	Low	66 Å²	66	64.8 Å²	64.8	35%	0.353	34%	0.338	S	S	.	.	H	α-helix	trans	-66.2	-40.1	177.9	-66.4	-24.3	0	0	0	110.3	N113 I115 S120 T121 K161	N113-D117 VanDerWaalsContact O-CB 3.31Å; N113-D117 WeakPolarHBondContact O-CB 3.48Å; N113-D117 PolarHBondContact O-N 3.39Å; I115-D117 PolarHBondContact O-N 2.89Å; D117-S120 WeakPolarHBondContact CA-OG 3.44Å; D117-S120 PolarHBondContact O-N 3.09Å; D117-S120 PolarHBondContact O-OG 3.13Å; D117-T121 VanDerWaalsContact O-CB 3.31Å; D117-T121 WeakPolarHBondContact O-CB 3.48Å; D117-T121 PolarHBondContact O-N 3.43Å; D117-T121 PolarHBondContact O-OG1 2.96Å; D117-K161 IonicContact OD1-NZ 3.85Å; D117-K161 PolarHBondContact OD1-NZ 3.37Å
118	Y	76.1	Confident	67.8	Low	84 Å²	84	69.7 Å²	69.7	33%	0.329	36%	0.361	S	S	.	.	H	α-helix	trans	-61.9	-47.2	174.7	-168.7	-109.5	0	0	0	112.7	K77 F80 K81 S114 I115 S120 T121 S122	K77-Y118 HydrophobicContact CG-CD1 4.43Å; K77-Y118 HydrophobicContact CG-CE1 4.44Å; F80-Y118 HydrophobicContact CD1-CD1 4.24Å; F80-Y118 AromaticContact CD1-CE1 3.89Å; F80-Y118 HydrophobicContact CD1-CE1 3.89Å; K81-Y118 WeakPolarHBondContact CE-OH 3.38Å; S114-Y118 VanDerWaalsContact O-CB 3.24Å; S114-Y118 WeakPolarHBondContact O-CB 3.5Å; S114-Y118 PolarHBondContact O-N 3.35Å; I115-Y118 PolarHBondContact O-N 3.34Å; Y118-S120 VanDerWaalsContact C-N 3.32Å; Y118-S120 PolarHBondContact O-N 3.13Å; Y118-T121 PolarHBondContact O-N 3.47Å; Y118-S122 PolarHBondContact O-N 2.87Å; Y118-S122 PolarHBondContact O-OG 3.45Å
119	I	74.1	Confident	66.7	Low	4 Å²	4	76 Å²	76	2%	0.021	39%	0.393	C	S	.	.	H	α-helix	trans	-67.5	-34.1	178.3	-62.8	166.4	0	0	0	111.3	F80 M88 I115 L116 S122 L135 F138	F80-I119 HydrophobicContact CD2-CG1 4.06Å; F80-I119 HydrophobicContact CE2-CB 4.33Å; F80-I119 HydrophobicContact CE2-CG1 4.06Å; F80-I119 HydrophobicContact CE2-CG2 3.89Å; F80-I119 HydrophobicContact CZ-CG2 4.37Å; M88-I119 HydrophobicContact CE-CD1 4.45Å; I115-I119 HydrophobicContact CG2-CD1 3.63Å; I115-I119 HydrophobicContact CG2-CG1 4.4Å; I115-I119 VanDerWaalsContact O-CG1 3.27Å; I115-I119 WeakPolarHBondContact O-CG1 3.4Å; I115-I119 PolarHBondContact O-N 2.96Å; L116-I119 PolarHBondContact O-N 3Å; I119-S122 PolarHBondContact O-OG 3.19Å; I119-S122 VanDerWaalsContact O-OG 3.1Å; I119-L135 HydrophobicContact CG2-CD1 3.94Å; I119-F138 HydrophobicContact CD1-CD1 4.25Å; I119-F138 HydrophobicContact CD1-CE1 4.38Å; I119-F138 HydrophobicContact CD1-CG 4.46Å
120	S	68.6	Low	66.1	Low	50 Å²	50	77.9 Å²	77.9	35%	0.35	41%	0.408	S	S	.	.	H	α-helix	trans	-74.7	-29.3	178.7	76.3	0	0	0	0	113.7	L116 D117 Y118	L116-S120 VanDerWaalsContact O-CB 3.23Å; L116-S120 WeakPolarHBondContact O-CB 3.2Å; L116-S120 PolarHBondContact O-N 3.41Å; L116-S120 PolarHBondContact O-OG 3.48Å; D117-S120 WeakPolarHBondContact CA-OG 3.44Å; D117-S120 PolarHBondContact O-N 3.09Å; D117-S120 PolarHBondContact O-OG 3.13Å; Y118-S120 VanDerWaalsContact C-N 3.32Å; Y118-S120 PolarHBondContact O-N 3.13Å
121	T	68.2	Low	65.3	Low	106 Å²	106	72.6 Å²	72.6	65%	0.65	39%	0.386	S	S	*	.	H	α-helix	trans	-86.2	-29.3	-175.8	-55.8	0	0	0	0	112.1	D117 Y118 K123	D117-T121 VanDerWaalsContact O-CB 3.31Å; D117-T121 WeakPolarHBondContact O-CB 3.48Å; D117-T121 PolarHBondContact O-N 3.43Å; D117-T121 PolarHBondContact O-OG1 2.96Å; Y118-T121 PolarHBondContact O-N 3.47Å; T121-K123 VanDerWaalsContact C-N 3.25Å; T121-K123 PolarHBondContact O-N 3.3Å
122	S	61.7	Low	64.7	Low	26 Å²	26	73.5 Å²	73.5	18%	0.182	39%	0.39	C	S	.	.			trans	-71.9	75	-179	56.5	0	0	0	0	112.2	F80 Y118 I119 Q124 Q131	F80-S122 WeakPolarHBondContact CE1-OG 3.45Å; F80-S122 WeakPolarHBondContact CZ-OG 3.45Å; Y118-S122 PolarHBondContact O-N 2.87Å; Y118-S122 PolarHBondContact O-OG 3.45Å; I119-S122 PolarHBondContact O-OG 3.19Å; I119-S122 VanDerWaalsContact O-OG 3.1Å; S122-Q124 VanDerWaalsContact C-N 3.3Å; S122-Q124 PolarHBondContact O-N 3.3Å; S122-Q124 VanDerWaalsContact O-N 3.08Å; S122-Q131 PolarHBondContact O-NE2 3.22Å
123	K	51.8	Low	64.2	Low	179 Å²	179	77.6 Å²	77.6	78%	0.778	41%	0.412	S	S	*	.			trans	-80.1	74	172.7	-63.2	-174.7	-179.2	-176.2	0	109.7	T121	T121-K123 VanDerWaalsContact C-N 3.25Å; T121-K123 PolarHBondContact O-N 3.3Å
124	Q	47.4	Very low	63.9	Low	173 Å²	173	77.7 Å²	77.7	81%	0.808	41%	0.413	S	S	*	.			trans	-93.6	126.1	171.2	-74	-122.7	-22.9	0	0	110.6	S122 S126	S122-Q124 VanDerWaalsContact C-N 3.3Å; S122-Q124 PolarHBondContact O-N 3.3Å; S122-Q124 VanDerWaalsContact O-N 3.08Å; Q124-S126 PolarHBondContact O-N 3.42Å
125	N	47.3	Very low	63.6	Low	156 Å²	156	76.4 Å²	76.4	83%	0.834	40%	0.402	S	S	*	.	S	Bend	trans	-62.6	118.2	-170.2	-68.7	-46.8	0	0	0	113.1
126	S	44.1	Very low	63.4	Low	111 Å²	111	77.4 Å²	77.4	78%	0.776	41%	0.407	S	S	*	.	S	Bend	trans	165.9	-24.9	131.3	44.7	0	0	0	0	113	Q124	Q124-S126 PolarHBondContact O-N 3.42Å
127	D	53.8	Low	63.6	Low	116 Å²	116	81.3 Å²	81.3	62%	0.62	43%	0.425	S	S	*	.			trans	-125	63.8	-177.7	-75.7	-26.7	0	0	0	112.8	L129 C130 Q131	D127-L129 PolarHBondContact O-N 3.39Å; D127-C130 HydrophobicContact CB-CB 4.18Å; D127-C130 PolarHBondContact O-N 3.04Å; D127-Q131 PolarHBondContact O-N 3.23Å
128	F	54.9	Low	63.7	Low	148 Å²	148	78.2 Å²	78.2	65%	0.649	41%	0.408	S	S	*	.	H	α-helix	trans	-55.5	-35.7	-178.9	-175.8	-104.8	0	0	0	113.5	M132	F128-M132 HydrophobicContact CD1-SD 4.01Å; F128-M132 HydrophobicContact CE1-CG 4.35Å; F128-M132 HydrophobicContact CE1-SD 3.32Å; F128-M132 WeakPolarHBondContact CE1-SD 3.42Å; F128-M132 HydrophobicContact CE2-SD 4.21Å; F128-M132 HydrophobicContact CZ-CE 4.45Å; F128-M132 HydrophobicContact CZ-CG 4.28Å; F128-M132 HydrophobicContact CZ-SD 3.44Å; F128-M132 WeakPolarHBondContact CZ-SD 3.45Å; F128-M132 WeakPolarHBondContact O-CG 3.4Å; F128-M132 PolarHBondContact O-N 3.39Å
129	L	53.8	Low	63.8	Low	135 Å²	135	74.5 Å²	74.5	71%	0.707	39%	0.394	S	S	*	.	H	α-helix	trans	-66.3	-47.2	179.4	-82.3	151.1	0	0	0	112.4	D127 Q131 M132 D133 R169	D127-L129 PolarHBondContact O-N 3.39Å; L129-Q131 PolarHBondContact O-N 3.06Å; L129-M132 PolarHBondContact O-N 3.45Å; L129-D133 PolarHBondContact O-N 2.81Å; L129-R169 PolarHBondContact O-NH2 3.06Å
130	C	58.3	Low	64.2	Low	62 Å²	62	78 Å²	78	42%	0.419	41%	0.41	S	S	.	.	H	α-helix	trans	-66.3	-38.3	-178.9	-173.3	0	0	0	0	111.8	D127 D133 L134	D127-C130 HydrophobicContact CB-CB 4.18Å; D127-C130 PolarHBondContact O-N 3.04Å; C130-D133 PolarHBondContact O-N 2.61Å; C130-L134 WeakPolarHBondContact O-CB 3.42Å; C130-L134 PolarHBondContact O-N 2.99Å
131	Q	61.7	Low	64.8	Low	43 Å²	43	76.4 Å²	76.4	20%	0.201	40%	0.398	C	S	.	.	H	α-helix	trans	-68.2	-38.4	178.6	-171.2	172.5	14.4	0	0	112.6	S122 D127 L129 L134 L135	S122-Q131 PolarHBondContact O-NE2 3.22Å; D127-Q131 PolarHBondContact O-N 3.23Å; L129-Q131 PolarHBondContact O-N 3.06Å; Q131-L134 WeakPolarHBondContact O-CB 3.27Å; Q131-L134 PolarHBondContact O-N 3.32Å; Q131-L135 WeakPolarHBondContact O-CB 3.45Å; Q131-L135 PolarHBondContact O-N 3.27Å
132	M	65.4	Low	65.4	Low	20 Å²	20	71.4 Å²	71.4	10%	0.099	37%	0.367	C	S	.	.	H	α-helix	trans	-70.3	-35.6	175	-70.7	-168.5	90.7	0	0	112.5	F128 L129 L134 L135 Q136 L165 E168 R169	F128-M132 HydrophobicContact CD1-SD 4.01Å; F128-M132 HydrophobicContact CE1-CG 4.35Å; F128-M132 HydrophobicContact CE1-SD 3.32Å; F128-M132 WeakPolarHBondContact CE1-SD 3.42Å; F128-M132 HydrophobicContact CE2-SD 4.21Å; F128-M132 HydrophobicContact CZ-CE 4.45Å; F128-M132 HydrophobicContact CZ-CG 4.28Å; F128-M132 HydrophobicContact CZ-SD 3.44Å; F128-M132 WeakPolarHBondContact CZ-SD 3.45Å; F128-M132 WeakPolarHBondContact O-CG 3.4Å; F128-M132 PolarHBondContact O-N 3.39Å; L129-M132 PolarHBondContact O-N 3.45Å; M132-L134 VanDerWaalsContact C-N 3.32Å; M132-L135 PolarHBondContact O-N 2.66Å; M132-Q136 PolarHBondContact O-N 2.8Å; M132-L165 HydrophobicContact CE-CD2 3.81Å; M132-E168 HydrophobicContact CE-CB 4.44Å; M132-R169 VanDerWaalsContact CB-NH2 3.27Å; M132-R169 HydrophobicContact CE-CG 4.07Å
133	D	69.4	Low	66.1	Low	85 Å²	85	70.7 Å²	70.7	46%	0.455	36%	0.362	S	S	.	.	H	α-helix	trans	-63.3	-41.8	173.1	-74.1	-31.9	0	0	0	111	L129 C130 Q136 E137 R169	L129-D133 PolarHBondContact O-N 2.81Å; C130-D133 PolarHBondContact O-N 2.61Å; D133-Q136 WeakPolarHBondContact O-CB 3.46Å; D133-Q136 PolarHBondContact O-N 3.13Å; D133-E137 PolarHBondContact O-N 3.37Å; D133-E137 VanDerWaalsContact O-N 3.1Å; D133-R169 VanDerWaalsContact CG-NH2 3.3Å; D133-R169 VanDerWaalsContact N-NH2 3.15Å; D133-R169 IonicContact OD1-CZ 2.69Å; D133-R169 IonicContact OD1-NH1 2.65Å; D133-R169 PolarHBondContact OD1-NH1 3.19Å; D133-R169 IonicContact OD1-NH2 2.73Å; D133-R169 PolarHBondContact OD1-NH2 3.44Å; D133-R169 IonicContact OD2-NH2 3.17Å
134	L	72.5	Confident	67.4	Low	20 Å²	20	68.7 Å²	68.7	11%	0.105	36%	0.355	C	S	.	.	H	α-helix	trans	-60.4	-50.4	174.9	-133.7	101.7	0	0	0	111.2	F85 M88 C130 Q131 M132 Q136 E137 F138	F85-L134 HydrophobicContact CB-CD1 3.37Å; F85-L134 HydrophobicContact CB-CD2 3.79Å; F85-L134 HydrophobicContact CB-CG 4.12Å; F85-L134 HydrophobicContact CD1-CD1 3.99Å; F85-L134 HydrophobicContact CD1-CD2 3.35Å; F85-L134 HydrophobicContact CD1-CG 4.26Å; F85-L134 HydrophobicContact CD2-CD1 4.04Å; F85-L134 HydrophobicContact CE1-CD2 4.13Å; F85-L134 HydrophobicContact CG-CD1 3.54Å; F85-L134 HydrophobicContact CG-CD2 3.79Å; F85-L134 HydrophobicContact CG-CG 4.28Å; M88-L134 HydrophobicContact CE-CD2 3.68Å; C130-L134 WeakPolarHBondContact O-CB 3.42Å; C130-L134 PolarHBondContact O-N 2.99Å; Q131-L134 WeakPolarHBondContact O-CB 3.27Å; Q131-L134 PolarHBondContact O-N 3.32Å; M132-L134 VanDerWaalsContact C-N 3.32Å; L134-Q136 PolarHBondContact O-N 3.24Å; L134-E137 WeakPolarHBondContact O-CB 3.27Å; L134-E137 PolarHBondContact O-N 2.88Å; L134-F138 HydrophobicContact CD2-CD2 4.07Å; L134-F138 HydrophobicContact CD2-CE2 3.65Å; L134-F138 HydrophobicContact CG-CD2 4.49Å; L134-F138 HydrophobicContact CG-CE2 4.28Å; L134-F138 VanDerWaalsContact O-CD2 3.25Å; L134-F138 WeakPolarHBondContact O-CD2 3.28Å; L134-F138 PolarHBondContact O-N 3.22Å
135	L	74.5	Confident	68.6	Low	17 Å²	17	61.5 Å²	61.5	9%	0.089	33%	0.325	C	S	.	.	H	α-helix	trans	-60.7	-36.3	-177.4	-173.8	59.6	0	0	0	111.3	I119 Q131 M132 F138 Y139 L165	I119-L135 HydrophobicContact CG2-CD1 3.94Å; Q131-L135 WeakPolarHBondContact O-CB 3.45Å; Q131-L135 PolarHBondContact O-N 3.27Å; M132-L135 PolarHBondContact O-N 2.66Å; L135-F138 WeakPolarHBondContact O-CB 3.43Å; L135-F138 PolarHBondContact O-N 3.12Å; L135-Y139 HydrophobicContact CD1-CD2 4.01Å; L135-Y139 HydrophobicContact CD1-CE2 3.48Å; L135-Y139 VanDerWaalsContact CD1-CE2 3.48Å; L135-Y139 HydrophobicContact CD2-CE2 4.01Å; L135-Y139 HydrophobicContact CG-CD2 3.83Å; L135-Y139 HydrophobicContact CG-CE2 3.48Å; L135-Y139 VanDerWaalsContact CG-CE2 3.48Å; L135-Y139 WeakPolarHBondContact O-CD2 3.45Å; L135-Y139 PolarHBondContact O-N 3.42Å; L135-L165 HydrophobicContact CD2-CD1 3.71Å; L135-L165 HydrophobicContact CD2-CD2 4.04Å; L135-L165 HydrophobicContact CG-CD1 3.84Å
136	Q	74.9	Confident	69.8	Low	23 Å²	23	54.1 Å²	54.1	11%	0.107	29%	0.286	C	S	.	.	H	α-helix	trans	-61.1	-48.6	171.5	-170.7	-167	-43.5	0	0	111.6	M132 D133 L134 F138 Y139 E140 L162 Y166	M132-Q136 PolarHBondContact O-N 2.8Å; D133-Q136 WeakPolarHBondContact O-CB 3.46Å; D133-Q136 PolarHBondContact O-N 3.13Å; L134-Q136 PolarHBondContact O-N 3.24Å; Q136-F138 VanDerWaalsContact C-N 3.26Å; Q136-F138 PolarHBondContact O-N 3.35Å; Q136-Y139 PolarHBondContact O-N 3.21Å; Q136-E140 WeakPolarHBondContact CG-OE1 3.1Å; Q136-E140 PolarHBondContact NE2-OE1 3.24Å; Q136-E140 WeakPolarHBondContact O-CG 3.41Å; Q136-E140 PolarHBondContact O-N 2.96Å; Q136-L162 HydrophobicContact CG-CD1 4.21Å; Q136-Y166 VanDerWaalsContact CD-OH 3.25Å; Q136-Y166 HydrophobicContact CG-CE1 4.16Å; Q136-Y166 WeakPolarHBondContact CG-OH 3.36Å; Q136-Y166 PolarHBondContact NE2-OH 3.03Å
137	E	79.1	Confident	70.9	Confident	84 Å²	84	54.4 Å²	54.4	39%	0.393	27%	0.273	S	S	.	.	H	α-helix	trans	-61.1	-36.4	177.8	-158.8	-169.8	161.4	0	0	111.6	M89 D133 L134 T141	M89-E137 HydrophobicContact CE-CB 3.76Å; M89-E137 HydrophobicContact CE-CG 3.66Å; D133-E137 PolarHBondContact O-N 3.37Å; D133-E137 VanDerWaalsContact O-N 3.1Å; L134-E137 WeakPolarHBondContact O-CB 3.27Å; L134-E137 PolarHBondContact O-N 2.88Å; E137-T141 WeakPolarHBondContact O-CB 3.34Å; E137-T141 VanDerWaalsContact O-CG2 3.3Å; E137-T141 WeakPolarHBondContact O-CG2 3.08Å; E137-T141 PolarHBondContact O-N 3.21Å; E137-T141 PolarHBondContact O-OG1 3.31Å
138	F	79.7	Confident	71.4	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.2	-52.9	172.2	-90.3	-85.3	0	0	0	111.4	M88 M89 Y92 I119 L134 L135 Q136 E140 T141 T142	M88-F138 HydrophobicContact CE-CD2 4.22Å; M88-F138 HydrophobicContact CE-CE1 4.02Å; M88-F138 HydrophobicContact CE-CE2 3.17Å; M88-F138 HydrophobicContact CE-CZ 3.08Å; M88-F138 HydrophobicContact SD-CE1 3.58Å; M88-F138 VanDerWaalsContact SD-CE1 3.58Å; M88-F138 HydrophobicContact SD-CE2 3.86Å; M88-F138 HydrophobicContact SD-CZ 3.06Å; M88-F138 WeakPolarHBondContact SD-CZ 3.02Å; M89-F138 HydrophobicContact CB-CZ 4.39Å; M89-F138 HydrophobicContact CE-CD1 4.38Å; M89-F138 HydrophobicContact CE-CD2 3.53Å; M89-F138 HydrophobicContact CE-CE1 4.23Å; M89-F138 HydrophobicContact CE-CE2 3.27Å; M89-F138 HydrophobicContact CE-CG 4Å; M89-F138 HydrophobicContact CE-CZ 3.6Å; M89-F138 HydrophobicContact SD-CE1 4.3Å; M89-F138 HydrophobicContact SD-CE2 4.24Å; M89-F138 HydrophobicContact SD-CZ 3.94Å; Y92-F138 AromaticContact CD1-CD1 3.67Å; Y92-F138 HydrophobicContact CD1-CD1 3.67Å; Y92-F138 AromaticContact CD1-CE1 3.56Å; Y92-F138 HydrophobicContact CD1-CE1 3.56Å; Y92-F138 HydrophobicContact CD2-CD1 4.2Å; Y92-F138 AromaticContact CD2-CE1 3.8Å; Y92-F138 HydrophobicContact CD2-CE1 3.8Å; Y92-F138 AromaticContact CE1-CD1 3.79Å; Y92-F138 HydrophobicContact CE1-CD1 3.79Å; Y92-F138 HydrophobicContact CE1-CE1 4.15Å; Y92-F138 HydrophobicContact CE2-CD1 4.32Å; Y92-F138 HydrophobicContact CE2-CE1 4.37Å; Y92-F138 AromaticContact CG-CD1 3.9Å; Y92-F138 HydrophobicContact CG-CD1 3.9Å; Y92-F138 AromaticContact CG-CE1 3.38Å; Y92-F138 HydrophobicContact CG-CE1 3.38Å; Y92-F138 HydrophobicContact CG-CZ 4.38Å; I119-F138 HydrophobicContact CD1-CD1 4.25Å; I119-F138 HydrophobicContact CD1-CE1 4.38Å; I119-F138 HydrophobicContact CD1-CG 4.46Å; L134-F138 HydrophobicContact CD2-CD2 4.07Å; L134-F138 HydrophobicContact CD2-CE2 3.65Å; L134-F138 HydrophobicContact CG-CD2 4.49Å; L134-F138 HydrophobicContact CG-CE2 4.28Å; L134-F138 VanDerWaalsContact O-CD2 3.25Å; L134-F138 WeakPolarHBondContact O-CD2 3.28Å; L134-F138 PolarHBondContact O-N 3.22Å; L135-F138 WeakPolarHBondContact O-CB 3.43Å; L135-F138 PolarHBondContact O-N 3.12Å; Q136-F138 VanDerWaalsContact C-N 3.26Å; Q136-F138 PolarHBondContact O-N 3.35Å; F138-E140 VanDerWaalsContact C-N 3.34Å; F138-E140 PolarHBondContact O-N 2.97Å; F138-T141 PolarHBondContact O-N 3.48Å; F138-T141 PolarHBondContact O-OG1 2.94Å; F138-T141 VanDerWaalsContact O-OG1 3.06Å; F138-T142 VanDerWaalsContact O-CB 3.31Å; F138-T142 WeakPolarHBondContact O-CB 3.28Å; F138-T142 PolarHBondContact O-N 3.49Å; F138-T142 PolarHBondContact O-OG1 2.95Å
139	Y	79.1	Confident	71.7	Confident	7 Å²	7	48.1 Å²	48.1	3%	0.027	25%	0.25	C	C	.	.	H	α-helix	trans	-60.8	-42	179.8	-79	-61.8	0	0	0	112.2	L116 L135 Q136 L143 T158 K161 L162 L165	L116-Y139 HydrophobicContact CD1-CD1 4.44Å; L116-Y139 HydrophobicContact CD1-CE1 3.84Å; L116-Y139 HydrophobicContact CD2-CD1 4.17Å; L116-Y139 HydrophobicContact CD2-CE1 3.81Å; L116-Y139 HydrophobicContact CG-CE1 4.34Å; L135-Y139 HydrophobicContact CD1-CD2 4.01Å; L135-Y139 HydrophobicContact CD1-CE2 3.48Å; L135-Y139 VanDerWaalsContact CD1-CE2 3.48Å; L135-Y139 HydrophobicContact CD2-CE2 4.01Å; L135-Y139 HydrophobicContact CG-CD2 3.83Å; L135-Y139 HydrophobicContact CG-CE2 3.48Å; L135-Y139 VanDerWaalsContact CG-CE2 3.48Å; L135-Y139 WeakPolarHBondContact O-CD2 3.45Å; L135-Y139 PolarHBondContact O-N 3.42Å; Q136-Y139 PolarHBondContact O-N 3.21Å; Y139-L143 WeakPolarHBondContact O-CB 3.44Å; Y139-L143 WeakPolarHBondContact O-CD1 3.42Å; Y139-L143 WeakPolarHBondContact O-CG 3.08Å; Y139-L143 PolarHBondContact O-N 2.95Å; Y139-T158 HydrophobicContact CD1-CG2 3.54Å; Y139-T158 HydrophobicContact CE1-CG2 4.13Å; Y139-K161 HydrophobicContact CE1-CB 3.91Å; Y139-K161 HydrophobicContact CE1-CD 4.3Å; Y139-K161 WeakPolarHBondContact OH-CD 3.36Å; Y139-L162 HydrophobicContact CD2-CD1 4.3Å; Y139-L162 HydrophobicContact CG-CB 4.25Å; Y139-L162 HydrophobicContact CG-CD1 4.28Å; Y139-L165 HydrophobicContact CD2-CD1 3.52Å; Y139-L165 HydrophobicContact CE2-CD1 3.41Å; Y139-L165 VanDerWaalsContact CE2-CD1 3.41Å
140	E	81.7	Confident	72.1	Confident	76 Å²	76	49.3 Å²	49.3	36%	0.355	25%	0.249	S	C	.	.	H	α-helix	trans	-64.3	-50.1	178.4	-73.4	175.9	-175.6	0	0	112.3	Q136 F138 T142 L143 E144 L162 Y166	Q136-E140 WeakPolarHBondContact CG-OE1 3.1Å; Q136-E140 PolarHBondContact NE2-OE1 3.24Å; Q136-E140 WeakPolarHBondContact O-CG 3.41Å; Q136-E140 PolarHBondContact O-N 2.96Å; F138-E140 VanDerWaalsContact C-N 3.34Å; F138-E140 PolarHBondContact O-N 2.97Å; E140-T142 VanDerWaalsContact C-N 3.32Å; E140-T142 PolarHBondContact O-N 3.45Å; E140-L143 PolarHBondContact O-N 2.95Å; E140-E144 PolarHBondContact O-N 3.38Å; E140-L162 HydrophobicContact CG-CD2 4.46Å; E140-Y166 PolarHBondContact OE1-OH 2.89Å
141	T	81.9	Confident	72.4	Confident	18 Å²	18	46.7 Å²	46.7	11%	0.11	23%	0.231	C	C	.	.	H	α-helix	trans	-64.4	-36.3	178.5	52.2	0	0	0	0	112.4	M89 E137 F138 A145	M89-T141 HydrophobicContact SD-CG2 4.19Å; E137-T141 WeakPolarHBondContact O-CB 3.34Å; E137-T141 VanDerWaalsContact O-CG2 3.3Å; E137-T141 WeakPolarHBondContact O-CG2 3.08Å; E137-T141 PolarHBondContact O-N 3.21Å; E137-T141 PolarHBondContact O-OG1 3.31Å; F138-T141 PolarHBondContact O-N 3.48Å; F138-T141 PolarHBondContact O-OG1 2.94Å; F138-T141 VanDerWaalsContact O-OG1 3.06Å; T141-A145 PolarHBondContact O-N 2.92Å; T141-A145 VanDerWaalsContact O-N 3.15Å
142	T	80.8	Confident	72.4	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.1	-47	172.9	-49.4	0	0	0	0	110.6	Y92 I112 F138 E140 E144 A145 L146 T158	Y92-T142 WeakPolarHBondContact CE1-OG1 3.43Å; Y92-T142 WeakPolarHBondContact OH-CG2 3.46Å; Y92-T142 PolarHBondContact OH-OG1 3.24Å; I112-T142 HydrophobicContact CG2-CG2 3.93Å; F138-T142 VanDerWaalsContact O-CB 3.31Å; F138-T142 WeakPolarHBondContact O-CB 3.28Å; F138-T142 PolarHBondContact O-N 3.49Å; F138-T142 PolarHBondContact O-OG1 2.95Å; E140-T142 VanDerWaalsContact C-N 3.32Å; E140-T142 PolarHBondContact O-N 3.45Å; T142-E144 PolarHBondContact O-N 2.99Å; T142-A145 PolarHBondContact O-N 3.32Å; T142-L146 HydrophobicContact CG2-CD1 3.68Å; T142-L146 HydrophobicContact CG2-CG 4.14Å; T142-L146 WeakPolarHBondContact O-CB 3.27Å; T142-L146 WeakPolarHBondContact O-CG 3.41Å; T142-L146 PolarHBondContact O-N 3.11Å; T142-T158 HydrophobicContact CG2-CG2 4.42Å
143	L	75.3	Confident	72.4	Confident	12 Å²	12	56.6 Å²	56.6	6%	0.063	27%	0.274	C	S	.	.	H	α-helix	trans	-66	-37.1	-178.5	-73.6	168.2	0	0	0	112.6	Y139 E140 L146 K147 W155 T158 N159 L162	Y139-L143 WeakPolarHBondContact O-CB 3.44Å; Y139-L143 WeakPolarHBondContact O-CD1 3.42Å; Y139-L143 WeakPolarHBondContact O-CG 3.08Å; Y139-L143 PolarHBondContact O-N 2.95Å; E140-L143 PolarHBondContact O-N 2.95Å; L143-L146 PolarHBondContact O-N 3.4Å; L143-K147 WeakPolarHBondContact O-CG 3.44Å; L143-K147 PolarHBondContact O-N 3.03Å; L143-W155 HydrophobicContact CD2-CG 4.13Å; L143-T158 HydrophobicContact CD1-CG2 4.36Å; L143-T158 HydrophobicContact CD2-CG2 3.7Å; L143-T158 HydrophobicContact CG-CG2 3.75Å; L143-N159 WeakPolarHBondContact CD1-OD1 3.39Å; L143-N159 WeakPolarHBondContact CD2-ND2 3.24Å; L143-L162 HydrophobicContact CD1-CD2 3.61Å
144	E	78.9	Confident	72.4	Confident	136 Å²	136	52.5 Å²	52.5	64%	0.636	25%	0.253	S	S	*	.	H	α-helix	trans	-61.6	-45.8	172.7	-74.2	-177.9	173.2	0	0	111.6	E140 T142 L146	E140-E144 PolarHBondContact O-N 3.38Å; T142-E144 PolarHBondContact O-N 2.99Å; E144-L146 VanDerWaalsContact C-N 3.35Å; E144-L146 PolarHBondContact O-N 3.42Å
145	A	74.1	Confident	72.6	Confident	22 Å²	22	53 Å²	53	18%	0.182	25%	0.253	C	S	.	.	H	α-helix	trans	-68.6	-32.6	177.5	0	0	0	0	0	113.2	L96 T141 T142	L96-A145 HydrophobicContact CB-CB 3.89Å; L96-A145 HydrophobicContact CD1-CB 3.73Å; L96-A145 HydrophobicContact CD2-CB 4.07Å; L96-A145 HydrophobicContact CG-CB 4.1Å; T141-A145 PolarHBondContact O-N 2.92Å; T141-A145 VanDerWaalsContact O-N 3.15Å; T142-A145 PolarHBondContact O-N 3.32Å
146	L	70.9	Confident	72.4	Confident	2 Å²	2	56 Å²	56	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-78.5	-27.8	-179.6	-72.2	177.1	0	0	0	113.9	T142 L143 E144 D148 A149 K150 N151 L154	T142-L146 HydrophobicContact CG2-CD1 3.68Å; T142-L146 HydrophobicContact CG2-CG 4.14Å; T142-L146 WeakPolarHBondContact O-CB 3.27Å; T142-L146 WeakPolarHBondContact O-CG 3.41Å; T142-L146 PolarHBondContact O-N 3.11Å; L143-L146 PolarHBondContact O-N 3.4Å; E144-L146 VanDerWaalsContact C-N 3.35Å; E144-L146 PolarHBondContact O-N 3.42Å; L146-D148 PolarHBondContact O-N 2.85Å; L146-A149 PolarHBondContact O-N 3.26Å; L146-K150 PolarHBondContact O-N 2.92Å; L146-N151 HydrophobicContact CD2-CB 4.44Å; L146-L154 HydrophobicContact CD1-CB 4.32Å; L146-L154 HydrophobicContact CD1-CD2 3.69Å; L146-L154 HydrophobicContact CD1-CG 3.65Å; L146-L154 HydrophobicContact CD2-CD2 3.77Å; L146-L154 HydrophobicContact CD2-CG 4.48Å; L146-L154 HydrophobicContact CG-CD2 4.39Å
147	K	68.4	Low	72.1	Confident	116 Å²	116	59.6 Å²	59.6	50%	0.504	28%	0.281	S	S	.	.	H	α-helix	trans	-55.6	-38.8	172.7	-84.1	175.6	-178.1	177.4	0	111.6	L143	L143-K147 WeakPolarHBondContact O-CG 3.44Å; L143-K147 PolarHBondContact O-N 3.03Å
148	D	63.4	Low	71.9	Confident	105 Å²	105	55.6 Å²	55.6	56%	0.561	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-18.8	179	-70.5	-7.9	0	0	0	113.6	R100 L146	R100-D148 IonicContact CZ-OD2 2.97Å; R100-D148 IonicContact NH1-OD2 2.66Å; R100-D148 VanDerWaalsContact NH2-CG 3.27Å; R100-D148 IonicContact NH2-OD2 2.81Å; R100-D148 PolarHBondContact NH2-OD2 3.09Å; L146-D148 PolarHBondContact O-N 2.85Å
149	A	61.4	Low	71.6	Confident	27 Å²	27	55.7 Å²	55.7	22%	0.223	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-2	-177.1	0	0	0	0	0	113.9	I99 L146 N151	I99-A149 HydrophobicContact CG2-CB 4.25Å; L146-A149 PolarHBondContact O-N 3.26Å; A149-N151 PolarHBondContact O-N 3.29Å
150	K	62	Low	71.3	Confident	161 Å²	161	57.9 Å²	57.9	70%	0.7	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.7	39.6	-175.6	-63.4	-171.3	175.7	-172.4	0	113.2	R105 L146 D152	R105-K150 PolarHBondContact NH1-O 2.99Å; R105-K150 PolarHBondContact NH2-O 3.5Å; L146-K150 PolarHBondContact O-N 2.92Å; K150-D152 PolarHBondContact O-N 3.15Å
151	N	64.3	Low	70.8	Confident	7 Å²	7	56.6 Å²	56.6	4%	0.037	27%	0.27	C	S	.	.			trans	-97.1	74.9	175.1	-159.8	5.3	0	0	0	112.7	R105 E109 L146 A149 R153 L154 W155	R105-N151 VanDerWaalsContact NE-CG 3.34Å; R105-N151 PolarHBondContact NE-OD1 3.3Å; R105-N151 VanDerWaalsContact NH2-CA 3.32Å; R105-N151 PolarHBondContact NH2-OD1 2.79Å; E109-N151 PolarHBondContact OE2-ND2 3.49Å; L146-N151 HydrophobicContact CD2-CB 4.44Å; A149-N151 PolarHBondContact O-N 3.29Å; N151-R153 VanDerWaalsContact C-N 3.25Å; N151-R153 PolarHBondContact O-N 3.02Å; N151-L154 HydrophobicContact CB-CB 4.46Å; N151-L154 PolarHBondContact O-N 2.82Å; N151-W155 WeakPolarHBondContact O-CB 3.29Å; N151-W155 PolarHBondContact O-N 2.89Å
152	D	63.2	Low	70.5	Confident	117 Å²	117	56 Å²	56	63%	0.626	27%	0.266	S	S	*	.	H	α-helix	trans	-56.8	-38.2	-173.2	-52.2	-38.8	0	0	0	112.3	K150 F156	K150-D152 PolarHBondContact O-N 3.15Å; D152-F156 VanDerWaalsContact O-CB 3.3Å; D152-F156 WeakPolarHBondContact O-CB 3.47Å; D152-F156 PolarHBondContact O-N 2.93Å
153	R	65.3	Low	70.2	Confident	153 Å²	153	56.3 Å²	56.3	58%	0.577	27%	0.27	S	S	*	.	H	α-helix	trans	-64.1	-55.6	178.9	-168.6	-175.1	-166.9	-162.4	5	112.9	N151 W155 F156 K157 E226	N151-R153 VanDerWaalsContact C-N 3.25Å; N151-R153 PolarHBondContact O-N 3.02Å; R153-W155 VanDerWaalsContact C-N 3.31Å; R153-W155 PolarHBondContact O-N 3.28Å; R153-F156 PolarHBondContact O-N 3.22Å; R153-K157 PolarHBondContact O-N 2.97Å; R153-K157 VanDerWaalsContact O-N 3.1Å; R153-E226 IonicContact CZ-OE1 2.68Å; R153-E226 IonicContact NE-OE1 3.15Å; R153-E226 PolarHBondContact NE-OE1 2.83Å; R153-E226 IonicContact NH2-OE1 3.87Å; R153-E226 PolarHBondContact NH2-OE1 2.98Å
154	L	69.3	Low	70.1	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-66.5	-37	179.4	-178.5	59.2	0	0	0	111.2	E109 I112 L146 N151 F156 K157 T158	E109-L154 HydrophobicContact CB-CD2 4.21Å; E109-L154 HydrophobicContact CG-CB 4.25Å; E109-L154 HydrophobicContact CG-CD1 4.08Å; E109-L154 HydrophobicContact CG-CD2 4.09Å; E109-L154 HydrophobicContact CG-CG 4.36Å; I112-L154 HydrophobicContact CB-CD2 4.41Å; I112-L154 HydrophobicContact CD1-CD2 3.93Å; I112-L154 HydrophobicContact CG2-CD2 4.34Å; L146-L154 HydrophobicContact CD1-CB 4.32Å; L146-L154 HydrophobicContact CD1-CD2 3.69Å; L146-L154 HydrophobicContact CD1-CG 3.65Å; L146-L154 HydrophobicContact CD2-CD2 3.77Å; L146-L154 HydrophobicContact CD2-CG 4.48Å; L146-L154 HydrophobicContact CG-CD2 4.39Å; N151-L154 HydrophobicContact CB-CB 4.46Å; N151-L154 PolarHBondContact O-N 2.82Å; L154-F156 VanDerWaalsContact C-N 3.34Å; L154-F156 PolarHBondContact O-N 2.71Å; L154-K157 PolarHBondContact O-N 3.14Å; L154-T158 WeakPolarHBondContact O-CB 3.46Å; L154-T158 PolarHBondContact O-N 3.18Å; L154-T158 PolarHBondContact O-OG1 3.31Å
155	W	75.8	Confident	69.9	Low	30 Å²	30	56.9 Å²	56.9	11%	0.114	27%	0.271	C	S	.	.	H	α-helix	trans	-60	-44.2	175.2	-178.7	93.7	0	0	0	111.2	L143 N151 R153 N159 Q181 L182 S185	L143-W155 HydrophobicContact CD2-CG 4.13Å; N151-W155 WeakPolarHBondContact O-CB 3.29Å; N151-W155 PolarHBondContact O-N 2.89Å; R153-W155 VanDerWaalsContact C-N 3.31Å; R153-W155 PolarHBondContact O-N 3.28Å; W155-N159 WeakPolarHBondContact CH2-ND2 3.25Å; W155-N159 WeakPolarHBondContact CZ2-ND2 3.35Å; W155-N159 WeakPolarHBondContact CZ3-ND2 3.12Å; W155-N159 WeakPolarHBondContact O-CB 3.43Å; W155-N159 PolarHBondContact O-N 3.46Å; W155-N159 PolarHBondContact O-ND2 2.91Å; W155-N159 VanDerWaalsContact O-ND2 3.1Å; W155-Q181 HydrophobicContact CH2-CB 4.32Å; W155-L182 HydrophobicContact CZ3-CD2 4.2Å; W155-S185 VanDerWaalsContact CZ3-CB 3.44Å; W155-S185 VanDerWaalsContact CZ3-OG 3.25Å; W155-S185 WeakPolarHBondContact CZ3-OG 3.48Å
156	F	69.9	Low	69.9	Low	79 Å²	79	56 Å²	56	35%	0.346	26%	0.263	S	S	.	.	H	α-helix	trans	-66.2	-45.6	178.9	-166	-91.6	0	0	0	112.6	D152 R153 L154 T158 N159 T160 L182 C186	D152-F156 VanDerWaalsContact O-CB 3.3Å; D152-F156 WeakPolarHBondContact O-CB 3.47Å; D152-F156 PolarHBondContact O-N 2.93Å; R153-F156 PolarHBondContact O-N 3.22Å; L154-F156 VanDerWaalsContact C-N 3.34Å; L154-F156 PolarHBondContact O-N 2.71Å; F156-T158 PolarHBondContact O-N 2.82Å; F156-N159 PolarHBondContact O-N 3.32Å; F156-T160 WeakPolarHBondContact O-CB 3.43Å; F156-T160 PolarHBondContact O-N 2.66Å; F156-T160 PolarHBondContact O-OG1 3.2Å; F156-L182 HydrophobicContact CD2-CD2 3.51Å; F156-L182 HydrophobicContact CE2-CB 4.34Å; F156-L182 HydrophobicContact CE2-CD2 3.55Å; F156-L182 HydrophobicContact CG-CD2 4.08Å; F156-L182 HydrophobicContact CZ-CD2 4.16Å; F156-C186 WeakPolarHBondContact CE2-SG 3.42Å
157	K	70.4	Confident	70	Confident	99 Å²	99	60.7 Å²	60.7	43%	0.43	29%	0.287	S	S	.	.	H	α-helix	trans	-62	-44.4	177.3	-169.8	178.1	-176.9	-177.2	0	111.8	R153 L154 T160 K161	R153-K157 PolarHBondContact O-N 2.97Å; R153-K157 VanDerWaalsContact O-N 3.1Å; L154-K157 PolarHBondContact O-N 3.14Å; K157-T160 PolarHBondContact O-N 3.44Å; K157-K161 PolarHBondContact O-N 3.36Å
158	T	73.6	Confident	70.1	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.006	29%	0.294	C	S	.	.	H	α-helix	trans	-63.6	-45.5	178.2	-58.1	0	0	0	0	111.2	Y139 T142 L143 L154 F156 T160 K161 L162	Y139-T158 HydrophobicContact CD1-CG2 3.54Å; Y139-T158 HydrophobicContact CE1-CG2 4.13Å; T142-T158 HydrophobicContact CG2-CG2 4.42Å; L143-T158 HydrophobicContact CD1-CG2 4.36Å; L143-T158 HydrophobicContact CD2-CG2 3.7Å; L143-T158 HydrophobicContact CG-CG2 3.75Å; L154-T158 WeakPolarHBondContact O-CB 3.46Å; L154-T158 PolarHBondContact O-N 3.18Å; L154-T158 PolarHBondContact O-OG1 3.31Å; F156-T158 PolarHBondContact O-N 2.82Å; T158-T160 VanDerWaalsContact C-N 3.34Å; T158-T160 PolarHBondContact O-N 2.8Å; T158-K161 PolarHBondContact O-N 3.33Å; T158-L162 WeakPolarHBondContact O-CB 3.42Å; T158-L162 PolarHBondContact O-N 3.15Å
159	N	73.6	Confident	70.4	Confident	2 Å²	2	59.3 Å²	59.3	1%	0.011	28%	0.277	C	S	.	.	H	α-helix	trans	-63.7	-37	174.6	-88.4	-53.8	0	0	0	113	L143 W155 F156 L162 G163 I178 L182	L143-N159 WeakPolarHBondContact CD1-OD1 3.39Å; L143-N159 WeakPolarHBondContact CD2-ND2 3.24Å; W155-N159 WeakPolarHBondContact CH2-ND2 3.25Å; W155-N159 WeakPolarHBondContact CZ2-ND2 3.35Å; W155-N159 WeakPolarHBondContact CZ3-ND2 3.12Å; W155-N159 WeakPolarHBondContact O-CB 3.43Å; W155-N159 PolarHBondContact O-N 3.46Å; W155-N159 PolarHBondContact O-ND2 2.91Å; W155-N159 VanDerWaalsContact O-ND2 3.1Å; F156-N159 PolarHBondContact O-N 3.32Å; N159-L162 PolarHBondContact O-N 3.12Å; N159-G163 PolarHBondContact O-N 2.66Å; N159-I178 HydrophobicContact CB-CG2 4.26Å; N159-L182 HydrophobicContact CB-CD1 4.16Å; N159-L182 HydrophobicContact CB-CD2 3.41Å; N159-L182 VanDerWaalsContact CB-CD2 3.41Å; N159-L182 HydrophobicContact CB-CG 3.87Å
160	T	73.1	Confident	71	Confident	52 Å²	52	64.6 Å²	64.6	32%	0.319	30%	0.297	S	S	.	.	H	α-helix	trans	-65.4	-43.4	176.5	-58.5	0	0	0	0	111	F156 K157 T158 G163 K164	F156-T160 WeakPolarHBondContact O-CB 3.43Å; F156-T160 PolarHBondContact O-N 2.66Å; F156-T160 PolarHBondContact O-OG1 3.2Å; K157-T160 PolarHBondContact O-N 3.44Å; T158-T160 VanDerWaalsContact C-N 3.34Å; T158-T160 PolarHBondContact O-N 2.8Å; T160-G163 PolarHBondContact O-N 2.67Å; T160-K164 WeakPolarHBondContact O-CG 3.46Å; T160-K164 PolarHBondContact O-N 3.29Å
161	K	71.5	Confident	71.7	Confident	50 Å²	50	60.2 Å²	60.2	22%	0.217	28%	0.279	C	S	.	.	H	α-helix	trans	-63.1	-43.2	174.3	-74	-173.2	175.8	-174.7	0	111.6	D117 Y139 K157 T158 G163 K164 L165	D117-K161 IonicContact OD1-NZ 3.85Å; D117-K161 PolarHBondContact OD1-NZ 3.37Å; Y139-K161 HydrophobicContact CE1-CB 3.91Å; Y139-K161 HydrophobicContact CE1-CD 4.3Å; Y139-K161 WeakPolarHBondContact OH-CD 3.36Å; K157-K161 PolarHBondContact O-N 3.36Å; T158-K161 PolarHBondContact O-N 3.33Å; K161-G163 PolarHBondContact O-N 3.42Å; K161-K164 WeakPolarHBondContact O-CB 3.25Å; K161-K164 PolarHBondContact O-N 3.08Å; K161-L165 PolarHBondContact O-N 3.2Å; K161-L165 VanDerWaalsContact O-N 3.15Å
162	L	76.2	Confident	72	Confident	4 Å²	4	66.6 Å²	66.6	2%	0.021	30%	0.304	C	S	.	.	H	α-helix	trans	-63.5	-39.5	175.2	-177.5	57.7	0	0	0	112.3	Q136 Y139 E140 L143 T158 N159 K164 L165 Y166 I178	Q136-L162 HydrophobicContact CG-CD1 4.21Å; Y139-L162 HydrophobicContact CD2-CD1 4.3Å; Y139-L162 HydrophobicContact CG-CB 4.25Å; Y139-L162 HydrophobicContact CG-CD1 4.28Å; E140-L162 HydrophobicContact CG-CD2 4.46Å; L143-L162 HydrophobicContact CD1-CD2 3.61Å; T158-L162 WeakPolarHBondContact O-CB 3.42Å; T158-L162 PolarHBondContact O-N 3.15Å; N159-L162 PolarHBondContact O-N 3.12Å; L162-K164 VanDerWaalsContact C-N 3.35Å; L162-K164 PolarHBondContact O-N 2.79Å; L162-L165 WeakPolarHBondContact O-CB 3.3Å; L162-L165 PolarHBondContact O-N 3.45Å; L162-Y166 HydrophobicContact CD1-CD2 4.06Å; L162-Y166 HydrophobicContact CD1-CE2 3.54Å; L162-Y166 HydrophobicContact CD2-CE2 3.96Å; L162-Y166 HydrophobicContact CG-CD2 3.91Å; L162-Y166 HydrophobicContact CG-CE2 3.51Å; L162-Y166 VanDerWaalsContact O-CD2 3.28Å; L162-Y166 WeakPolarHBondContact O-CD2 3.23Å; L162-Y166 PolarHBondContact O-N 3.3Å; L162-I178 HydrophobicContact CB-CD1 4.47Å; L162-I178 HydrophobicContact CD2-CD1 3.55Å; L162-I178 HydrophobicContact CG-CD1 3.69Å
163	G	74.5	Confident	72.7	Confident	8 Å²	8	63.4 Å²	63.4	8%	0.082	30%	0.298	C	S	.	.	H	α-helix	trans	-61.1	-41	173.6	0	0	0	0	0	112.6	N159 T160 K161 L165 Y166 L167 L175	N159-G163 PolarHBondContact O-N 2.66Å; T160-G163 PolarHBondContact O-N 2.67Å; K161-G163 PolarHBondContact O-N 3.42Å; G163-L165 VanDerWaalsContact C-N 3.34Å; G163-L165 PolarHBondContact O-N 3.34Å; G163-Y166 PolarHBondContact O-N 2.87Å; G163-L167 PolarHBondContact O-N 3.49Å; G163-L175 WeakPolarHBondContact O-CD1 3.49Å
164	K	71.9	Confident	73.1	Confident	135 Å²	135	60 Å²	60	59%	0.587	29%	0.287	S	S	*	.	H	α-helix	trans	-60.6	-42.2	173.3	-71.6	179.3	179.8	-176.9	0	112	T160 K161 L162 Y166 L167 E168	T160-K164 WeakPolarHBondContact O-CG 3.46Å; T160-K164 PolarHBondContact O-N 3.29Å; K161-K164 WeakPolarHBondContact O-CB 3.25Å; K161-K164 PolarHBondContact O-N 3.08Å; L162-K164 VanDerWaalsContact C-N 3.35Å; L162-K164 PolarHBondContact O-N 2.79Å; K164-Y166 PolarHBondContact O-N 3.27Å; K164-L167 WeakPolarHBondContact O-CB 3.46Å; K164-L167 PolarHBondContact O-N 3.35Å; K164-E168 WeakPolarHBondContact O-CG 3.35Å; K164-E168 PolarHBondContact O-N 3.49Å
165	L	74.4	Confident	73.3	Confident	24 Å²	24	60.9 Å²	60.9	13%	0.126	29%	0.292	C	S	.	.	H	α-helix	trans	-63.2	-41	176	-71.6	172.3	0	0	0	112.9	M132 L135 Y139 K161 L162 G163 L167 E168 R169	M132-L165 HydrophobicContact CE-CD2 3.81Å; L135-L165 HydrophobicContact CD2-CD1 3.71Å; L135-L165 HydrophobicContact CD2-CD2 4.04Å; L135-L165 HydrophobicContact CG-CD1 3.84Å; Y139-L165 HydrophobicContact CD2-CD1 3.52Å; Y139-L165 HydrophobicContact CE2-CD1 3.41Å; Y139-L165 VanDerWaalsContact CE2-CD1 3.41Å; K161-L165 PolarHBondContact O-N 3.2Å; K161-L165 VanDerWaalsContact O-N 3.15Å; L162-L165 WeakPolarHBondContact O-CB 3.3Å; L162-L165 PolarHBondContact O-N 3.45Å; G163-L165 VanDerWaalsContact C-N 3.34Å; G163-L165 PolarHBondContact O-N 3.34Å; L165-L167 VanDerWaalsContact C-N 3.29Å; L165-L167 PolarHBondContact O-N 2.89Å; L165-E168 PolarHBondContact O-N 3.48Å; L165-R169 WeakPolarHBondContact O-CG 3.5Å; L165-R169 PolarHBondContact O-N 3.26Å
166	Y	74.4	Confident	73.2	Confident	4 Å²	4	64.5 Å²	64.5	2%	0.016	31%	0.31	C	S	.	.	H	α-helix	trans	-68	-30.6	176	-74.9	-52.2	0	0	0	113.3	Q136 E140 L162 G163 K164 R169 E170 E171 K174 I178	Q136-Y166 VanDerWaalsContact CD-OH 3.25Å; Q136-Y166 HydrophobicContact CG-CE1 4.16Å; Q136-Y166 WeakPolarHBondContact CG-OH 3.36Å; Q136-Y166 PolarHBondContact NE2-OH 3.03Å; E140-Y166 PolarHBondContact OE1-OH 2.89Å; L162-Y166 HydrophobicContact CD1-CD2 4.06Å; L162-Y166 HydrophobicContact CD1-CE2 3.54Å; L162-Y166 HydrophobicContact CD2-CE2 3.96Å; L162-Y166 HydrophobicContact CG-CD2 3.91Å; L162-Y166 HydrophobicContact CG-CE2 3.51Å; L162-Y166 VanDerWaalsContact O-CD2 3.28Å; L162-Y166 WeakPolarHBondContact O-CD2 3.23Å; L162-Y166 PolarHBondContact O-N 3.3Å; G163-Y166 PolarHBondContact O-N 2.87Å; K164-Y166 PolarHBondContact O-N 3.27Å; Y166-R169 PolarHBondContact O-N 3.46Å; Y166-E170 PolarHBondContact O-N 3.06Å; Y166-E171 HydrophobicContact CD1-CB 4.07Å; Y166-E171 WeakPolarHBondContact CE1-OE2 3.42Å; Y166-E171 PolarHBondContact O-N 3.4Å; Y166-K174 HydrophobicContact CD1-CB 4.13Å; Y166-K174 HydrophobicContact CD1-CD 4.33Å; Y166-K174 HydrophobicContact CD2-CB 4.38Å; Y166-K174 HydrophobicContact CE1-CB 4.01Å; Y166-K174 HydrophobicContact CE1-CD 3.55Å; Y166-K174 HydrophobicContact CE1-CG 4.45Å; Y166-K174 HydrophobicContact CE2-CB 4.24Å; Y166-K174 HydrophobicContact CG-CB 4.31Å; Y166-I178 HydrophobicContact CD2-CD1 3.47Å; Y166-I178 VanDerWaalsContact CD2-CD1 3.47Å; Y166-I178 HydrophobicContact CE2-CD1 3.27Å
167	L	72.9	Confident	73.5	Confident	101 Å²	101	67.5 Å²	67.5	53%	0.529	32%	0.323	S	S	.	.	H	α-helix	trans	-66.6	-43.5	172.1	-175.4	68.8	0	0	0	111.2	G163 K164 L165 R169 E170 Y172 L175	G163-L167 PolarHBondContact O-N 3.49Å; K164-L167 WeakPolarHBondContact O-CB 3.46Å; K164-L167 PolarHBondContact O-N 3.35Å; L165-L167 VanDerWaalsContact C-N 3.29Å; L165-L167 PolarHBondContact O-N 2.89Å; L167-R169 VanDerWaalsContact C-N 3.26Å; L167-R169 PolarHBondContact O-N 3.39Å; L167-E170 PolarHBondContact O-N 3.08Å; L167-Y172 HydrophobicContact CD1-CE1 4.5Å; L167-L175 HydrophobicContact CB-CD2 4.16Å; L167-L175 HydrophobicContact CD1-CD2 3.89Å
168	E	70.6	Confident	73.7	Confident	138 Å²	138	63.4 Å²	63.4	65%	0.645	31%	0.306	S	S	*	.	H	α-helix	trans	-65	-28.9	176.2	-71.8	175.5	-176.2	0	0	112.9	M132 K164 L165	M132-E168 HydrophobicContact CE-CB 4.44Å; K164-E168 WeakPolarHBondContact O-CG 3.35Å; K164-E168 PolarHBondContact O-N 3.49Å; L165-E168 PolarHBondContact O-N 3.48Å
169	R	70.4	Confident	73.5	Confident	53 Å²	53	68 Å²	68	20%	0.2	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-0.7	175.9	-74.2	-177.8	154.4	-151.8	-17.8	114.6	L129 M132 D133 L165 Y166 L167 E171	L129-R169 PolarHBondContact O-NH2 3.06Å; M132-R169 VanDerWaalsContact CB-NH2 3.27Å; M132-R169 HydrophobicContact CE-CG 4.07Å; D133-R169 VanDerWaalsContact CG-NH2 3.3Å; D133-R169 VanDerWaalsContact N-NH2 3.15Å; D133-R169 IonicContact OD1-CZ 2.69Å; D133-R169 IonicContact OD1-NH1 2.65Å; D133-R169 PolarHBondContact OD1-NH1 3.19Å; D133-R169 IonicContact OD1-NH2 2.73Å; D133-R169 PolarHBondContact OD1-NH2 3.44Å; D133-R169 IonicContact OD2-NH2 3.17Å; L165-R169 WeakPolarHBondContact O-CG 3.5Å; L165-R169 PolarHBondContact O-N 3.26Å; Y166-R169 PolarHBondContact O-N 3.46Å; L167-R169 VanDerWaalsContact C-N 3.26Å; L167-R169 PolarHBondContact O-N 3.39Å; R169-E171 HydrophobicContact CB-CG 4.19Å; R169-E171 PolarHBondContact O-N 3.07Å; R169-E171 VanDerWaalsContact O-N 3.09Å
170	E	72.9	Confident	73.5	Confident	139 Å²	139	75 Å²	75	65%	0.65	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	22	-174.1	-56.9	-175.2	165.9	0	0	113.9	Y166 L167 Y172	Y166-E170 PolarHBondContact O-N 3.06Å; L167-E170 PolarHBondContact O-N 3.08Å; E170-Y172 VanDerWaalsContact C-N 3.27Å; E170-Y172 HydrophobicContact CB-CE2 3.89Å; E170-Y172 WeakPolarHBondContact O-CD2 3.47Å; E170-Y172 VanDerWaalsContact O-CE2 3.3Å; E170-Y172 WeakPolarHBondContact O-CE2 3.4Å; E170-Y172 PolarHBondContact O-N 3.41Å
171	E	76.6	Confident	73.4	Confident	68 Å²	68	76.1 Å²	76.1	32%	0.318	36%	0.358	S	S	.	.			trans	-84.5	67.9	178.1	-71.4	-164	173.8	0	0	111.1	Y166 R169 G173 K174 L175	Y166-E171 HydrophobicContact CD1-CB 4.07Å; Y166-E171 WeakPolarHBondContact CE1-OE2 3.42Å; Y166-E171 PolarHBondContact O-N 3.4Å; R169-E171 HydrophobicContact CB-CG 4.19Å; R169-E171 PolarHBondContact O-N 3.07Å; R169-E171 VanDerWaalsContact O-N 3.09Å; E171-G173 PolarHBondContact O-N 3.13Å; E171-G173 VanDerWaalsContact O-N 3.09Å; E171-K174 PolarHBondContact O-N 3.22Å; E171-K174 IonicContact OE1-NZ 3.3Å; E171-K174 VanDerWaalsContact OE2-CD 3.22Å; E171-K174 WeakPolarHBondContact OE2-CD 3.39Å; E171-K174 WeakPolarHBondContact OE2-CE 3.46Å; E171-K174 IonicContact OE2-NZ 2.79Å; E171-K174 PolarHBondContact OE2-NZ 3.36Å; E171-L175 PolarHBondContact O-N 3.4Å; E171-L175 VanDerWaalsContact O-N 3.12Å
172	Y	71.6	Confident	73.3	Confident	142 Å²	142	74.6 Å²	74.6	56%	0.557	35%	0.352	S	S	*	.	H	α-helix	trans	-59.2	-26.8	-174.4	-55.5	-68.8	0	0	0	114.1	L167 E170 Q176	L167-Y172 HydrophobicContact CD1-CE1 4.5Å; E170-Y172 VanDerWaalsContact C-N 3.27Å; E170-Y172 HydrophobicContact CB-CE2 3.89Å; E170-Y172 WeakPolarHBondContact O-CD2 3.47Å; E170-Y172 VanDerWaalsContact O-CE2 3.3Å; E170-Y172 WeakPolarHBondContact O-CE2 3.4Å; E170-Y172 PolarHBondContact O-N 3.41Å; Y172-Q176 WeakPolarHBondContact O-CB 3.37Å; Y172-Q176 PolarHBondContact O-N 3.1Å
173	G	77.8	Confident	72.7	Confident	49 Å²	49	78.6 Å²	78.6	51%	0.505	37%	0.37	S	S	.	.	H	α-helix	trans	-69.3	-42	179.1	0	0	0	0	0	113.9	E171	E171-G173 PolarHBondContact O-N 3.13Å; E171-G173 VanDerWaalsContact O-N 3.09Å
174	K	74.5	Confident	72.3	Confident	81 Å²	81	84.7 Å²	84.7	35%	0.352	40%	0.397	S	S	.	.	H	α-helix	trans	-77.2	-38.1	176.2	-65.8	-172.4	-162.2	149.9	0	111	Y166 E171 Q176 K177 I178	Y166-K174 HydrophobicContact CD1-CB 4.13Å; Y166-K174 HydrophobicContact CD1-CD 4.33Å; Y166-K174 HydrophobicContact CD2-CB 4.38Å; Y166-K174 HydrophobicContact CE1-CB 4.01Å; Y166-K174 HydrophobicContact CE1-CD 3.55Å; Y166-K174 HydrophobicContact CE1-CG 4.45Å; Y166-K174 HydrophobicContact CE2-CB 4.24Å; Y166-K174 HydrophobicContact CG-CB 4.31Å; E171-K174 PolarHBondContact O-N 3.22Å; E171-K174 IonicContact OE1-NZ 3.3Å; E171-K174 VanDerWaalsContact OE2-CD 3.22Å; E171-K174 WeakPolarHBondContact OE2-CD 3.39Å; E171-K174 WeakPolarHBondContact OE2-CE 3.46Å; E171-K174 IonicContact OE2-NZ 2.79Å; E171-K174 PolarHBondContact OE2-NZ 3.36Å; K174-Q176 VanDerWaalsContact C-N 3.31Å; K174-Q176 PolarHBondContact O-N 3.02Å; K174-K177 WeakPolarHBondContact O-CB 3.18Å; K174-K177 PolarHBondContact O-N 3.01Å; K174-K177 VanDerWaalsContact O-N 3.1Å; K174-I178 PolarHBondContact O-N 2.85Å; K174-I178 VanDerWaalsContact O-N 3.13Å
175	L	73.1	Confident	71.8	Confident	20 Å²	20	81 Å²	81	11%	0.105	39%	0.388	C	S	.	.	H	α-helix	trans	-54.9	-46	172.4	180	58.4	0	0	0	111.7	G163 L167 E171 K177 I178 L179	G163-L175 WeakPolarHBondContact O-CD1 3.49Å; L167-L175 HydrophobicContact CB-CD2 4.16Å; L167-L175 HydrophobicContact CD1-CD2 3.89Å; E171-L175 PolarHBondContact O-N 3.4Å; E171-L175 VanDerWaalsContact O-N 3.12Å; L175-K177 VanDerWaalsContact C-N 3.27Å; L175-K177 PolarHBondContact O-N 3.37Å; L175-I178 PolarHBondContact O-N 2.85Å; L175-L179 HydrophobicContact CD1-CD1 4.1Å; L175-L179 HydrophobicContact CD1-CG 4.08Å; L175-L179 HydrophobicContact CG-CD1 3.87Å; L175-L179 HydrophobicContact CG-CG 4.3Å; L175-L179 WeakPolarHBondContact O-CB 3.48Å; L175-L179 WeakPolarHBondContact O-CG 3.13Å; L175-L179 PolarHBondContact O-N 2.96Å
176	Q	72.3	Confident	70.8	Confident	106 Å²	106	81.2 Å²	81.2	50%	0.495	39%	0.391	S	S	.	.	H	α-helix	trans	-61.1	-35.2	178.8	-166	-175.7	21.7	0	0	112.5	Y172 K174 R180	Y172-Q176 WeakPolarHBondContact O-CB 3.37Å; Y172-Q176 PolarHBondContact O-N 3.1Å; K174-Q176 VanDerWaalsContact C-N 3.31Å; K174-Q176 PolarHBondContact O-N 3.02Å; Q176-R180 VanDerWaalsContact CD-NH2 3.26Å; Q176-R180 VanDerWaalsContact NE2-NH2 3.1Å; Q176-R180 WeakPolarHBondContact O-CG 3.37Å; Q176-R180 PolarHBondContact O-N 3.3Å
177	K	76.9	Confident	69.7	Low	142 Å²	142	83.8 Å²	83.8	62%	0.617	40%	0.403	S	S	*	.	H	α-helix	trans	-68.4	-43	176.7	-69.5	179.6	-178.9	178.9	0	111.8	K174 L175 R180 Q181	K174-K177 WeakPolarHBondContact O-CB 3.18Å; K174-K177 PolarHBondContact O-N 3.01Å; K174-K177 VanDerWaalsContact O-N 3.1Å; L175-K177 VanDerWaalsContact C-N 3.27Å; L175-K177 PolarHBondContact O-N 3.37Å; K177-R180 PolarHBondContact O-N 3.1Å; K177-Q181 WeakPolarHBondContact O-CG 3.49Å; K177-Q181 PolarHBondContact O-N 3.39Å
178	I	74.8	Confident	68.7	Low	13 Å²	13	83.6 Å²	83.6	7%	0.067	41%	0.406	C	S	.	.	H	α-helix	trans	-67.3	-42.3	177.1	-73.8	167.8	0	0	0	110.9	N159 L162 Y166 K174 L175 R180 Q181 L182	N159-I178 HydrophobicContact CB-CG2 4.26Å; L162-I178 HydrophobicContact CB-CD1 4.47Å; L162-I178 HydrophobicContact CD2-CD1 3.55Å; L162-I178 HydrophobicContact CG-CD1 3.69Å; Y166-I178 HydrophobicContact CD2-CD1 3.47Å; Y166-I178 VanDerWaalsContact CD2-CD1 3.47Å; Y166-I178 HydrophobicContact CE2-CD1 3.27Å; K174-I178 PolarHBondContact O-N 2.85Å; K174-I178 VanDerWaalsContact O-N 3.13Å; L175-I178 PolarHBondContact O-N 2.85Å; I178-R180 VanDerWaalsContact C-N 3.3Å; I178-R180 PolarHBondContact O-N 3.34Å; I178-Q181 PolarHBondContact O-N 2.89Å; I178-Q181 VanDerWaalsContact O-N 3.1Å; I178-L182 HydrophobicContact CG2-CD1 3.76Å; I178-L182 HydrophobicContact CG2-CG 4.15Å; I178-L182 WeakPolarHBondContact O-CB 3.3Å; I178-L182 WeakPolarHBondContact O-CG 3.32Å; I178-L182 PolarHBondContact O-N 3.46Å
179	L	69.1	Low	67.4	Low	96 Å²	96	85.5 Å²	85.5	50%	0.503	42%	0.421	S	S	.	.	H	α-helix	trans	-59.8	-40.6	174.9	-73.7	173.5	0	0	0	111.6	L175 H183	L175-L179 HydrophobicContact CD1-CD1 4.1Å; L175-L179 HydrophobicContact CD1-CG 4.08Å; L175-L179 HydrophobicContact CG-CD1 3.87Å; L175-L179 HydrophobicContact CG-CG 4.3Å; L175-L179 WeakPolarHBondContact O-CB 3.48Å; L175-L179 WeakPolarHBondContact O-CG 3.13Å; L175-L179 PolarHBondContact O-N 2.96Å; L179-H183 WeakPolarHBondContact O-CB 3.35Å; L179-H183 PolarHBondContact O-N 2.88Å
180	R	73.2	Confident	66.1	Low	149 Å²	149	90.3 Å²	90.3	56%	0.562	45%	0.45	S	S	*	.	H	α-helix	trans	-63.2	-40.7	172.9	-74.9	-178.5	-152.2	173.3	6.6	112.6	Q176 K177 I178 H183 Q184	Q176-R180 VanDerWaalsContact CD-NH2 3.26Å; Q176-R180 VanDerWaalsContact NE2-NH2 3.1Å; Q176-R180 WeakPolarHBondContact O-CG 3.37Å; Q176-R180 PolarHBondContact O-N 3.3Å; K177-R180 PolarHBondContact O-N 3.1Å; I178-R180 VanDerWaalsContact C-N 3.3Å; I178-R180 PolarHBondContact O-N 3.34Å; R180-H183 PolarHBondContact O-N 3.41Å; R180-Q184 VanDerWaalsContact O-CB 3.27Å; R180-Q184 WeakPolarHBondContact O-CB 3.44Å; R180-Q184 PolarHBondContact O-N 3.44Å
181	Q	71.7	Confident	65	Low	77 Å²	77	85.6 Å²	85.6	36%	0.36	44%	0.439	S	S	.	.	H	α-helix	trans	-68.5	-42.6	178.3	-73.3	176.5	-0.7	0	0	112.1	W155 K177 I178 H183 Q184 S185	W155-Q181 HydrophobicContact CH2-CB 4.32Å; K177-Q181 WeakPolarHBondContact O-CG 3.49Å; K177-Q181 PolarHBondContact O-N 3.39Å; I178-Q181 PolarHBondContact O-N 2.89Å; I178-Q181 VanDerWaalsContact O-N 3.1Å; Q181-H183 VanDerWaalsContact C-N 3.34Å; Q181-Q184 PolarHBondContact O-N 2.99Å; Q181-S185 PolarHBondContact O-N 3.38Å; Q181-S185 PolarHBondContact O-OG 3.16Å
182	L	68.6	Low	63.4	Low	18 Å²	18	87.4 Å²	87.4	9%	0.094	45%	0.448	C	S	.	.	H	α-helix	trans	-61.1	-44.9	173.3	-77.4	172.4	0	0	0	111	W155 F156 N159 I178 S185 C186	W155-L182 HydrophobicContact CZ3-CD2 4.2Å; F156-L182 HydrophobicContact CD2-CD2 3.51Å; F156-L182 HydrophobicContact CE2-CB 4.34Å; F156-L182 HydrophobicContact CE2-CD2 3.55Å; F156-L182 HydrophobicContact CG-CD2 4.08Å; F156-L182 HydrophobicContact CZ-CD2 4.16Å; N159-L182 HydrophobicContact CB-CD1 4.16Å; N159-L182 HydrophobicContact CB-CD2 3.41Å; N159-L182 VanDerWaalsContact CB-CD2 3.41Å; N159-L182 HydrophobicContact CB-CG 3.87Å; I178-L182 HydrophobicContact CG2-CD1 3.76Å; I178-L182 HydrophobicContact CG2-CG 4.15Å; I178-L182 WeakPolarHBondContact O-CB 3.3Å; I178-L182 WeakPolarHBondContact O-CG 3.32Å; I178-L182 PolarHBondContact O-N 3.46Å; L182-S185 WeakPolarHBondContact CA-OG 3.38Å; L182-S185 PolarHBondContact O-N 3.45Å; L182-S185 PolarHBondContact O-OG 3.09Å; L182-C186 PolarHBondContact O-N 3.15Å
183	H	64.8	Low	62.2	Low	87 Å²	87	83.3 Å²	83.3	40%	0.403	44%	0.435	S	S	.	.	H	α-helix	trans	-62.2	-44.6	176.6	-172.9	81.4	0	0	0	111.4	L179 R180 Q181 S185 C186 Q187 D193	L179-H183 WeakPolarHBondContact O-CB 3.35Å; L179-H183 PolarHBondContact O-N 2.88Å; R180-H183 PolarHBondContact O-N 3.41Å; Q181-H183 VanDerWaalsContact C-N 3.34Å; H183-S185 VanDerWaalsContact C-N 3.32Å; H183-S185 PolarHBondContact O-N 3.21Å; H183-C186 CarbonylContact O-C 3.59Å; H183-C186 WeakPolarHBondContact O-CB 3.4Å; H183-C186 PolarHBondContact O-N 3.43Å; H183-C186 VanDerWaalsContact O-N 3.12Å; H183-Q187 PolarHBondContact CD2-NE2 3.06Å; H183-Q187 PolarHBondContact NE2-NE2 2.7Å; H183-Q187 WeakPolarHBondContact O-CG 3.4Å; H183-Q187 PolarHBondContact O-N 3.17Å; H183-D193 IonicContact CD2-OD1 2.82Å; H183-D193 IonicContact CE1-OD1 3.68Å; H183-D193 PolarHBondContact CE1-OD1 2.92Å; H183-D193 IonicContact CE1-OD2 3.22Å; H183-D193 PolarHBondContact CE1-OD2 3.01Å; H183-D193 IonicContact CG-OD1 3.63Å; H183-D193 IonicContact ND1-OD1 2.68Å; H183-D193 PolarHBondContact ND1-OD1 3.49Å; H183-D193 VanDerWaalsContact ND1-OD1 3.15Å; H183-D193 IonicContact ND1-OD2 2.77Å; H183-D193 IonicContact NE2-OD1 3.99Å; H183-D193 PolarHBondContact NE2-OD1 3.37Å; H183-D193 IonicContact NE2-OD2 3.89Å
184	Q	65.7	Low	61	Low	137 Å²	137	83.8 Å²	83.8	64%	0.64	43%	0.426	S	S	*	.	H	α-helix	trans	-66.7	-30.6	176.1	-168	169.3	18.2	0	0	113	R180 Q181 C186 Q187	R180-Q184 VanDerWaalsContact O-CB 3.27Å; R180-Q184 WeakPolarHBondContact O-CB 3.44Å; R180-Q184 PolarHBondContact O-N 3.44Å; Q181-Q184 PolarHBondContact O-N 2.99Å; Q184-C186 VanDerWaalsContact C-N 3.33Å; Q184-Q187 PolarHBondContact O-N 3.02Å
185	S	61.3	Low	59.8	Low	58 Å²	58	84.8 Å²	84.8	41%	0.406	44%	0.435	S	S	.	.	H	α-helix	trans	-74.6	-23.9	172.2	68.3	0	0	0	0	113.7	W155 Q181 L182 H183	W155-S185 VanDerWaalsContact CZ3-CB 3.44Å; W155-S185 VanDerWaalsContact CZ3-OG 3.25Å; W155-S185 WeakPolarHBondContact CZ3-OG 3.48Å; Q181-S185 PolarHBondContact O-N 3.38Å; Q181-S185 PolarHBondContact O-OG 3.16Å; L182-S185 WeakPolarHBondContact CA-OG 3.38Å; L182-S185 PolarHBondContact O-N 3.45Å; L182-S185 PolarHBondContact O-OG 3.09Å; H183-S185 VanDerWaalsContact C-N 3.32Å; H183-S185 PolarHBondContact O-N 3.21Å
186	C	54.4	Low	59	Low	27 Å²	27	88.8 Å²	88.8	18%	0.182	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	2.6	171.3	-78.5	0	0	0	0	112.5	F156 L182 H183 Q184 D194	F156-C186 WeakPolarHBondContact CE2-SG 3.42Å; L182-C186 PolarHBondContact O-N 3.15Å; H183-C186 CarbonylContact O-C 3.59Å; H183-C186 WeakPolarHBondContact O-CB 3.4Å; H183-C186 PolarHBondContact O-N 3.43Å; H183-C186 VanDerWaalsContact O-N 3.12Å; Q184-C186 VanDerWaalsContact C-N 3.33Å; C186-D194 HydrophobicContact CB-CB 4.28Å; C186-D194 PolarHBondContact O-N 3.29Å; C186-D194 PolarHBondContact SG-OD2 2.86Å
187	Q	50.3	Low	58.7	Low	58 Å²	58	86.2 Å²	86.2	27%	0.271	44%	0.439	S	S	.	.	B	Isolated β-bridge	trans	-101.5	129.6	174.9	-74.1	172	-4.3	0	0	108.9	H183 Q184 D193	H183-Q187 PolarHBondContact CD2-NE2 3.06Å; H183-Q187 PolarHBondContact NE2-NE2 2.7Å; H183-Q187 WeakPolarHBondContact O-CG 3.4Å; H183-Q187 PolarHBondContact O-N 3.17Å; Q184-Q187 PolarHBondContact O-N 3.02Å; Q187-D193 PolarHBondContact NE2-OD1 2.95Å
188	T	51.2	Low	58.3	Low	97 Å²	97	79.7 Å²	79.7	60%	0.595	41%	0.41	S	S	*	.			trans	-71.7	174.4	167.3	45.5	0	0	0	0	110.7	D190 G191	T188-D190 PolarHBondContact O-N 3.09Å; T188-G191 PolarHBondContact O-N 2.96Å
189	D	44.7	Very low	58.1	Low	178 Å²	178	82.4 Å²	82.4	95%	0.952	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-13.1	-179.5	-81.2	-28.5	0	0	0	114.7
190	D	42.3	Very low	58.5	Low	154 Å²	154	78.5 Å²	78.5	82%	0.824	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	1.9	175.7	-69.3	-41.5	0	0	0	114.8	T188	T188-D190 PolarHBondContact O-N 3.09Å
191	G	49.4	Very low	58.9	Low	40 Å²	40	71.4 Å²	71.4	41%	0.412	39%	0.386	S	S	.	.			trans	80.1	30.6	165.5	0	0	0	0	0	117.3	T188	T188-G191 PolarHBondContact O-N 2.96Å
192	E	44.2	Very low	59.4	Low	107 Å²	107	70.1 Å²	70.1	50%	0.5	38%	0.379	S	S	.	.			trans	-133.5	147	177.2	-69.1	-170.6	130.6	0	0	114.8	K196	E192-K196 HydrophobicContact CB-CD 4.19Å; E192-K196 IonicContact OE1-NZ 3.68Å; E192-K196 PolarHBondContact OE1-NZ 2.79Å; E192-K196 WeakPolarHBondContact OE2-CD 3.44Å; E192-K196 WeakPolarHBondContact OE2-CE 3.25Å; E192-K196 IonicContact OE2-NZ 3.02Å; E192-K196 PolarHBondContact OE2-NZ 3.49Å
193	D	46.6	Very low	60	Low	56 Å²	56	73.8 Å²	73.8	30%	0.299	40%	0.397	S	S	.	.	B	Isolated β-bridge	trans	-64.6	148.7	-167.1	-68.9	-14.2	0	0	0	117	H183 Q187 L195 K196	H183-D193 IonicContact CD2-OD1 2.82Å; H183-D193 IonicContact CE1-OD1 3.68Å; H183-D193 PolarHBondContact CE1-OD1 2.92Å; H183-D193 IonicContact CE1-OD2 3.22Å; H183-D193 PolarHBondContact CE1-OD2 3.01Å; H183-D193 IonicContact CG-OD1 3.63Å; H183-D193 IonicContact ND1-OD1 2.68Å; H183-D193 PolarHBondContact ND1-OD1 3.49Å; H183-D193 VanDerWaalsContact ND1-OD1 3.15Å; H183-D193 IonicContact ND1-OD2 2.77Å; H183-D193 IonicContact NE2-OD1 3.99Å; H183-D193 PolarHBondContact NE2-OD1 3.37Å; H183-D193 IonicContact NE2-OD2 3.89Å; Q187-D193 PolarHBondContact NE2-OD1 2.95Å; D193-L195 PolarHBondContact O-N 3.13Å; D193-K196 WeakPolarHBondContact O-CB 3.38Å; D193-K196 PolarHBondContact O-N 2.93Å
194	D	52.3	Low	60.9	Low	58 Å²	58	71 Å²	71	31%	0.31	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.6	-23.9	171.1	-106	-38.1	0	0	0	116.3	C186 K196 K197 N223	C186-D194 HydrophobicContact CB-CB 4.28Å; C186-D194 PolarHBondContact O-N 3.29Å; C186-D194 PolarHBondContact SG-OD2 2.86Å; D194-K196 PolarHBondContact O-N 3.37Å; D194-K197 PolarHBondContact O-N 2.84Å; D194-K197 VanDerWaalsContact O-N 3.14Å; D194-N223 PolarHBondContact OD1-ND2 3.47Å
195	L	49.5	Very low	61.7	Low	102 Å²	102	64.7 Å²	64.7	53%	0.534	35%	0.354	S	S	.	.	H	α-helix	trans	-62.6	-17.8	171.3	-85.8	155.9	0	0	0	112.6	D193	D193-L195 PolarHBondContact O-N 3.13Å
196	K	56.2	Low	62.7	Low	104 Å²	104	69.4 Å²	69.4	45%	0.452	36%	0.363	S	S	.	.	H	α-helix	trans	-81.6	-7.4	173.5	-93.3	-176.2	164.7	-177.7	0	114.7	E192 D193 D194 C199 G200	E192-K196 HydrophobicContact CB-CD 4.19Å; E192-K196 IonicContact OE1-NZ 3.68Å; E192-K196 PolarHBondContact OE1-NZ 2.79Å; E192-K196 WeakPolarHBondContact OE2-CD 3.44Å; E192-K196 WeakPolarHBondContact OE2-CE 3.25Å; E192-K196 IonicContact OE2-NZ 3.02Å; E192-K196 PolarHBondContact OE2-NZ 3.49Å; D193-K196 WeakPolarHBondContact O-CB 3.38Å; D193-K196 PolarHBondContact O-N 2.93Å; D194-K196 PolarHBondContact O-N 3.37Å; K196-C199 HydrophobicContact CG-CB 4.42Å; K196-C199 CarbonylContact O-C 3.44Å; K196-C199 PolarHBondContact O-N 3Å; K196-G200 VanDerWaalsContact O-CA 3.28Å; K196-G200 WeakPolarHBondContact O-CA 3.44Å; K196-G200 PolarHBondContact O-N 3.27Å
197	K	65.8	Low	64	Low	53 Å²	53	74.1 Å²	74.1	23%	0.23	38%	0.382	C	S	.	.	H	α-helix	trans	-70	-40.4	173.4	-71.8	-170.5	-176.5	-179.2	0	112.4	D194 C199 G200 G201 E219 A220	D194-K197 PolarHBondContact O-N 2.84Å; D194-K197 VanDerWaalsContact O-N 3.14Å; K197-C199 VanDerWaalsContact C-N 3.35Å; K197-G200 PolarHBondContact O-N 3.44Å; K197-G201 PolarHBondContact O-N 3.19Å; K197-E219 HydrophobicContact CD-CB 4.11Å; K197-E219 WeakPolarHBondContact CE-OE2 3.38Å; K197-E219 IonicContact NZ-OE2 3.49Å; K197-E219 PolarHBondContact NZ-OE2 3.42Å; K197-A220 HydrophobicContact CB-CB 4.06Å
198	E	67.8	Low	65.5	Low	5 Å²	5	73.1 Å²	73.1	2%	0.023	39%	0.388	C	S	.	.	H	α-helix	trans	-65.3	-39.8	171.2	-168.5	-164.7	135.1	0	0	111.2	K202 F217 Y224 R231 Y238	E198-K202 VanDerWaalsContact O-CG 3.28Å; E198-K202 WeakPolarHBondContact O-CG 3.21Å; E198-K202 PolarHBondContact O-N 3.49Å; E198-K202 IonicContact OE1-NZ 2.72Å; E198-K202 PolarHBondContact OE1-NZ 3.37Å; E198-F217 HydrophobicContact CG-CE1 4.17Å; E198-F217 WeakPolarHBondContact O-CE1 3.34Å; E198-Y224 WeakPolarHBondContact OE2-CE2 3.19Å; E198-Y224 PolarHBondContact OE2-OH 3.43Å; E198-R231 VanDerWaalsContact CD-NH2 3.28Å; E198-R231 IonicContact OE1-NH2 3.11Å; E198-R231 PolarHBondContact OE1-NH2 3.47Å; E198-R231 IonicContact OE2-CZ 3.92Å; E198-R231 VanDerWaalsContact OE2-CZ 3.31Å; E198-R231 IonicContact OE2-NE 2.81Å; E198-R231 PolarHBondContact OE2-NE 2.94Å; E198-R231 IonicContact OE2-NH2 2.71Å; E198-R231 PolarHBondContact OE2-NH2 3.23Å; E198-Y238 HydrophobicContact CG-CD2 4.35Å; E198-Y238 HydrophobicContact CG-CE2 4.49Å
199	C	70.9	Confident	67.1	Low	70 Å²	70	72 Å²	72	47%	0.473	38%	0.376	S	S	.	.	H	α-helix	trans	-71.2	-32.9	176.4	-64.7	0	0	0	0	113.2	K196 K197 K202 M203	K196-C199 HydrophobicContact CG-CB 4.42Å; K196-C199 CarbonylContact O-C 3.44Å; K196-C199 PolarHBondContact O-N 3Å; K197-C199 VanDerWaalsContact C-N 3.35Å; C199-K202 WeakPolarHBondContact O-CB 3.15Å; C199-K202 PolarHBondContact O-N 3.49Å; C199-M203 WeakPolarHBondContact O-CB 3.3Å; C199-M203 PolarHBondContact O-N 3.3Å
200	G	77	Confident	69.2	Low	13 Å²	13	65.4 Å²	65.4	13%	0.134	34%	0.339	C	S	.	.	H	α-helix	trans	-70.6	-44.2	176.6	0	0	0	0	0	109.9	K196 K197 K202 M203 H204	K196-G200 VanDerWaalsContact O-CA 3.28Å; K196-G200 WeakPolarHBondContact O-CA 3.44Å; K196-G200 PolarHBondContact O-N 3.27Å; K197-G200 PolarHBondContact O-N 3.44Å; G200-K202 VanDerWaalsContact C-N 3.31Å; G200-K202 PolarHBondContact O-N 3.44Å; G200-M203 WeakPolarHBondContact O-CB 2.81Å; G200-M203 PolarHBondContact O-N 3.03Å; G200-M203 VanDerWaalsContact O-N 3.12Å; G200-H204 WeakPolarHBondContact O-CB 3.44Å; G200-H204 PolarHBondContact O-N 3.21Å; G200-H204 PolarHBondContact O-ND1 3.43Å
201	G	82.3	Confident	71.4	Confident	0 Å²	0	65 Å²	65	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-56	-45.2	167.8	0	0	0	0	0	112	K197 M203 L205 A213 F217	K197-G201 PolarHBondContact O-N 3.19Å; G201-M203 PolarHBondContact O-N 3.37Å; G201-L205 WeakPolarHBondContact O-CB 3.39Å; G201-L205 PolarHBondContact O-N 3.3Å; G201-A213 WeakPolarHBondContact O-CB 3.2Å; G201-F217 VanDerWaalsContact C-CE2 3.47Å; G201-F217 WeakPolarHBondContact O-CE2 3.15Å
202	K	82.8	Confident	73.1	Confident	50 Å²	50	67.9 Å²	67.9	22%	0.217	33%	0.333	C	S	.	.	H	α-helix	trans	-63.9	-38.1	175.5	-74.5	172.1	170.6	167.8	0	112.9	E198 C199 G200 R206 F217 Y238 F301	E198-K202 VanDerWaalsContact O-CG 3.28Å; E198-K202 WeakPolarHBondContact O-CG 3.21Å; E198-K202 PolarHBondContact O-N 3.49Å; E198-K202 IonicContact OE1-NZ 2.72Å; E198-K202 PolarHBondContact OE1-NZ 3.37Å; C199-K202 WeakPolarHBondContact O-CB 3.15Å; C199-K202 PolarHBondContact O-N 3.49Å; G200-K202 VanDerWaalsContact C-N 3.31Å; G200-K202 PolarHBondContact O-N 3.44Å; K202-R206 WeakPolarHBondContact O-CG 3.43Å; K202-R206 PolarHBondContact O-N 2.98Å; K202-F217 HydrophobicContact CB-CZ 4.46Å; K202-F217 HydrophobicContact CG-CE1 4.09Å; K202-F217 HydrophobicContact CG-CZ 3.83Å; K202-F217 VanDerWaalsContact N-CZ 3.29Å; K202-Y238 PolarHBondContact NZ-OH 3.27Å; K202-F301 HydrophobicContact CB-CE2 3.77Å; K202-F301 HydrophobicContact CB-CZ 3.89Å; K202-F301 HydrophobicContact CG-CD1 4.39Å; K202-F301 HydrophobicContact CG-CD2 4.19Å; K202-F301 HydrophobicContact CG-CE1 3.95Å; K202-F301 HydrophobicContact CG-CE2 3.73Å; K202-F301 HydrophobicContact CG-CG 4.5Å; K202-F301 HydrophobicContact CG-CZ 3.59Å
203	M	80.2	Confident	75.2	Confident	95 Å²	95	62.8 Å²	62.8	47%	0.468	31%	0.309	S	S	.	.	H	α-helix	trans	-67.6	-52.3	177.5	-176.6	-172.6	79.1	0	0	111	C199 G200 G201 L205 R206 E207	C199-M203 WeakPolarHBondContact O-CB 3.3Å; C199-M203 PolarHBondContact O-N 3.3Å; G200-M203 WeakPolarHBondContact O-CB 2.81Å; G200-M203 PolarHBondContact O-N 3.03Å; G200-M203 VanDerWaalsContact O-N 3.12Å; G201-M203 PolarHBondContact O-N 3.37Å; M203-L205 VanDerWaalsContact C-N 3.25Å; M203-L205 PolarHBondContact O-N 2.68Å; M203-R206 WeakPolarHBondContact O-CA 3.18Å; M203-R206 WeakPolarHBondContact O-CB 3.38Å; M203-R206 PolarHBondContact O-N 3.06Å; M203-E207 PolarHBondContact O-N 3.4Å
204	H	83.2	Confident	77.2	Confident	30 Å²	30	61.9 Å²	61.9	14%	0.139	30%	0.304	C	S	.	.	H	α-helix	trans	-58.5	-37.1	177	-68.9	139.1	0	0	0	111.8	G200 R206 E207 G208 E209 K212 A213 D216	G200-H204 WeakPolarHBondContact O-CB 3.44Å; G200-H204 PolarHBondContact O-N 3.21Å; G200-H204 PolarHBondContact O-ND1 3.43Å; H204-R206 VanDerWaalsContact C-N 3.31Å; H204-R206 PolarHBondContact O-N 2.88Å; H204-E207 PolarHBondContact O-N 3.28Å; H204-G208 PolarHBondContact O-N 3.15Å; H204-G208 VanDerWaalsContact O-N 3.07Å; H204-E209 HydrophobicContact CB-CB 4.19Å; H204-E209 IonicContact CD2-OE2 3.97Å; H204-E209 PolarHBondContact CD2-OE2 3.27Å; H204-E209 VanDerWaalsContact CD2-OE2 3.27Å; H204-E209 IonicContact NE2-OE2 3.84Å; H204-E209 PolarHBondContact O-N 3.48Å; H204-K212 HydrophobicContact CB-CB 4.41Å; H204-A213 HydrophobicContact CB-CB 3.79Å; H204-D216 IonicContact CE1-OD2 2.82Å; H204-D216 PolarHBondContact CE1-OD2 3.42Å; H204-D216 IonicContact ND1-OD2 3.31Å; H204-D216 PolarHBondContact ND1-OD2 2.85Å
205	L	84.3	Confident	78.8	Confident	3 Å²	3	62.2 Å²	62.2	2%	0.016	31%	0.308	C	S	.	.	H	α-helix	trans	-63.9	-36.4	175.5	-148.9	84.3	0	0	0	112.4	G201 M203 G208 F210 A213 F217 L241 A242 L245 F301 H305	G201-L205 WeakPolarHBondContact O-CB 3.39Å; G201-L205 PolarHBondContact O-N 3.3Å; M203-L205 VanDerWaalsContact C-N 3.25Å; M203-L205 PolarHBondContact O-N 2.68Å; L205-G208 PolarHBondContact O-N 3.48Å; L205-F210 HydrophobicContact CD1-CD1 3.98Å; L205-F210 HydrophobicContact CG-CD1 4.4Å; L205-A213 HydrophobicContact CB-CB 4.23Å; L205-A213 HydrophobicContact CD1-CB 3.72Å; L205-F217 HydrophobicContact CD1-CE2 4.39Å; L205-L241 HydrophobicContact CD2-CD2 3.99Å; L205-L241 HydrophobicContact CD2-CG 4.5Å; L205-A242 HydrophobicContact CD1-CB 3.73Å; L205-L245 HydrophobicContact CD1-CD1 3.86Å; L205-L245 HydrophobicContact CD2-CD1 3.91Å; L205-L245 HydrophobicContact CG-CD1 3.96Å; L205-F301 HydrophobicContact CB-CZ 3.88Å; L205-F301 HydrophobicContact CD2-CE1 3.6Å; L205-F301 HydrophobicContact CD2-CE2 4.37Å; L205-F301 HydrophobicContact CD2-CZ 3.35Å; L205-F301 HydrophobicContact CG-CZ 4.23Å; L205-H305 VanDerWaalsContact CD2-CD2 3.45Å; L205-H305 WeakPolarHBondContact CD2-CD2 3.5Å; L205-H305 WeakPolarHBondContact CD2-NE2 3.21Å
206	R	82.1	Confident	80.6	Confident	158 Å²	158	58.8 Å²	58.8	60%	0.596	29%	0.29	S	S	*	.	H	α-helix	trans	-73.7	-30.9	175.8	-75.8	-178.8	165.7	-148.6	-10.5	113.1	K202 M203 H204 G208 F301 E304	K202-R206 WeakPolarHBondContact O-CG 3.43Å; K202-R206 PolarHBondContact O-N 2.98Å; M203-R206 WeakPolarHBondContact O-CA 3.18Å; M203-R206 WeakPolarHBondContact O-CB 3.38Å; M203-R206 PolarHBondContact O-N 3.06Å; H204-R206 VanDerWaalsContact C-N 3.31Å; H204-R206 PolarHBondContact O-N 2.88Å; R206-G208 VanDerWaalsContact C-N 3.25Å; R206-F301 HydrophobicContact CG-CE2 4.49Å; R206-E304 IonicContact CZ-OE2 3.27Å; R206-E304 IonicContact NE-OE2 2.56Å; R206-E304 IonicContact NH2-OE1 2.71Å; R206-E304 IonicContact NH2-OE2 3.55Å; R206-E304 PolarHBondContact NH2-OE2 2.88Å
207	E	80.5	Confident	82.2	Confident	125 Å²	125	53.9 Å²	53.9	58%	0.584	27%	0.268	S	S	*	.	H	α-helix	trans	-79.6	-8.1	175	-67.7	-175.6	167.7	0	0	112.9	M203 H204 E209	M203-E207 PolarHBondContact O-N 3.4Å; H204-E207 PolarHBondContact O-N 3.28Å; E207-E209 VanDerWaalsContact C-N 3.34Å
208	G	82.4	Confident	83.2	Confident	38 Å²	38	54 Å²	54	39%	0.392	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	8.9	-178.4	0	0	0	0	0	114.1	H204 L205 R206 F210	H204-G208 PolarHBondContact O-N 3.15Å; H204-G208 VanDerWaalsContact O-N 3.07Å; L205-G208 PolarHBondContact O-N 3.48Å; R206-G208 VanDerWaalsContact C-N 3.25Å; G208-F210 VanDerWaalsContact C-N 3.28Å; G208-F210 WeakPolarHBondContact O-CD2 3.46Å; G208-F210 PolarHBondContact O-N 3Å
209	E	85.7	Confident	84	Confident	72 Å²	72	57.9 Å²	57.9	34%	0.336	29%	0.287	S	S	.	.			trans	-84.1	67.1	176.1	-62.4	-166	146.9	0	0	110.9	H204 E207 E211 K212 A213	H204-E209 HydrophobicContact CB-CB 4.19Å; H204-E209 IonicContact CD2-OE2 3.97Å; H204-E209 PolarHBondContact CD2-OE2 3.27Å; H204-E209 VanDerWaalsContact CD2-OE2 3.27Å; H204-E209 IonicContact NE2-OE2 3.84Å; H204-E209 PolarHBondContact O-N 3.48Å; E207-E209 VanDerWaalsContact C-N 3.34Å; E209-E211 VanDerWaalsContact C-N 3.29Å; E209-E211 PolarHBondContact O-N 2.97Å; E209-K212 HydrophobicContact CB-CB 4.49Å; E209-K212 PolarHBondContact O-N 2.91Å; E209-K212 IonicContact OE1-NZ 2.95Å; E209-K212 PolarHBondContact OE1-NZ 2.91Å; E209-K212 VanDerWaalsContact OE2-CD 3.28Å; E209-K212 WeakPolarHBondContact OE2-CD 3.47Å; E209-K212 WeakPolarHBondContact OE2-CE 3.44Å; E209-K212 IonicContact OE2-NZ 2.71Å; E209-K212 PolarHBondContact OE2-NZ 3.1Å; E209-A213 PolarHBondContact O-N 3.23Å
210	F	88.6	Confident	84.6	Confident	40 Å²	40	54.8 Å²	54.8	18%	0.175	27%	0.267	C	S	.	.	H	α-helix	trans	-61.9	-31.9	-171.4	-53.5	-57.5	0	0	0	114.6	L205 G208 H214 L245 M246	L205-F210 HydrophobicContact CD1-CD1 3.98Å; L205-F210 HydrophobicContact CG-CD1 4.4Å; G208-F210 VanDerWaalsContact C-N 3.28Å; G208-F210 WeakPolarHBondContact O-CD2 3.46Å; G208-F210 PolarHBondContact O-N 3Å; F210-H214 WeakPolarHBondContact O-CB 3.44Å; F210-H214 PolarHBondContact O-N 2.85Å; F210-L245 HydrophobicContact CB-CB 4.46Å; F210-L245 HydrophobicContact CD1-CB 3.62Å; F210-L245 HydrophobicContact CD1-CD1 4.04Å; F210-L245 HydrophobicContact CD1-CG 4.34Å; F210-L245 HydrophobicContact CD2-CB 4.43Å; F210-L245 HydrophobicContact CE1-CB 3.88Å; F210-L245 HydrophobicContact CE1-CD1 3.89Å; F210-L245 HydrophobicContact CE1-CD2 4.19Å; F210-L245 HydrophobicContact CE1-CG 4.2Å; F210-L245 HydrophobicContact CG-CB 3.92Å; F210-L245 HydrophobicContact CZ-CB 4.38Å; F210-L245 HydrophobicContact CZ-CD2 4.35Å; F210-M246 HydrophobicContact CB-CB 4.18Å
211	E	87.2	Confident	85.1	Confident	146 Å²	146	54.2 Å²	54.2	68%	0.682	26%	0.26	S	S	*	.	H	α-helix	trans	-69.8	-43.5	-179.9	-170.4	170.6	-167.7	0	0	111.8	E209 H214 T215 M246	E209-E211 VanDerWaalsContact C-N 3.29Å; E209-E211 PolarHBondContact O-N 2.97Å; E211-H214 WeakPolarHBondContact O-CB 3.46Å; E211-H214 PolarHBondContact O-N 3.31Å; E211-T215 PolarHBondContact O-N 2.82Å; E211-T215 VanDerWaalsContact O-N 3.13Å; E211-M246 HydrophobicContact CB-SD 4.13Å; E211-M246 HydrophobicContact CG-SD 4.13Å
212	K	85.1	Confident	85.2	Confident	100 Å²	100	57.8 Å²	57.8	44%	0.435	28%	0.276	S	S	.	.	H	α-helix	trans	-68.7	-38.9	174	-61.2	-168.2	-157.2	152.3	0	111.7	H204 E209 H214 T215 D216	H204-K212 HydrophobicContact CB-CB 4.41Å; E209-K212 HydrophobicContact CB-CB 4.49Å; E209-K212 PolarHBondContact O-N 2.91Å; E209-K212 IonicContact OE1-NZ 2.95Å; E209-K212 PolarHBondContact OE1-NZ 2.91Å; E209-K212 VanDerWaalsContact OE2-CD 3.28Å; E209-K212 WeakPolarHBondContact OE2-CD 3.47Å; E209-K212 WeakPolarHBondContact OE2-CE 3.44Å; E209-K212 IonicContact OE2-NZ 2.71Å; E209-K212 PolarHBondContact OE2-NZ 3.1Å; K212-H214 VanDerWaalsContact C-N 3.26Å; K212-H214 PolarHBondContact O-N 3.49Å; K212-T215 WeakPolarHBondContact CA-OG1 3.34Å; K212-T215 PolarHBondContact O-N 3.32Å; K212-T215 PolarHBondContact O-OG1 3.13Å; K212-D216 PolarHBondContact O-N 3.48Å
213	A	88.4	Confident	85.2	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-59	-42.1	174.4	0	0	0	0	0	111.4	G201 H204 L205 E209 D216 F217	G201-A213 WeakPolarHBondContact O-CB 3.2Å; H204-A213 HydrophobicContact CB-CB 3.79Å; L205-A213 HydrophobicContact CB-CB 4.23Å; L205-A213 HydrophobicContact CD1-CB 3.72Å; E209-A213 PolarHBondContact O-N 3.23Å; A213-D216 PolarHBondContact O-N 3.1Å; A213-F217 HydrophobicContact CB-CD2 4.42Å; A213-F217 HydrophobicContact CB-CE2 4.3Å; A213-F217 WeakPolarHBondContact O-CB 3.42Å; A213-F217 WeakPolarHBondContact O-CD2 3.28Å; A213-F217 WeakPolarHBondContact O-CG 3.22Å; A213-F217 PolarHBondContact O-N 2.94Å
214	H	89	Confident	85.3	Confident	38 Å²	38	55.2 Å²	55.2	18%	0.176	27%	0.265	C	S	.	.	H	α-helix	trans	-61.6	-46.2	176.2	176.6	-83	0	0	0	112.1	F210 E211 K212 F218 A242 M246	F210-H214 WeakPolarHBondContact O-CB 3.44Å; F210-H214 PolarHBondContact O-N 2.85Å; E211-H214 WeakPolarHBondContact O-CB 3.46Å; E211-H214 PolarHBondContact O-N 3.31Å; K212-H214 VanDerWaalsContact C-N 3.26Å; K212-H214 PolarHBondContact O-N 3.49Å; H214-F218 VanDerWaalsContact O-CB 3.28Å; H214-F218 WeakPolarHBondContact O-CB 3.35Å; H214-F218 PolarHBondContact O-N 3.34Å; H214-A242 HydrophobicContact CB-CB 4.34Å; H214-M246 HydrophobicContact CB-SD 4.43Å
215	T	86.8	Confident	85.3	Confident	65 Å²	65	56.1 Å²	56.1	40%	0.399	27%	0.271	S	S	.	.	H	α-helix	trans	-62.2	-44.9	177.7	51.8	0	0	0	0	111.7	E211 K212 F218 E219	E211-T215 PolarHBondContact O-N 2.82Å; E211-T215 VanDerWaalsContact O-N 3.13Å; K212-T215 WeakPolarHBondContact CA-OG1 3.34Å; K212-T215 PolarHBondContact O-N 3.32Å; K212-T215 PolarHBondContact O-OG1 3.13Å; T215-F218 PolarHBondContact O-N 2.78Å; T215-E219 WeakPolarHBondContact O-CG 3.41Å; T215-E219 PolarHBondContact O-N 3.08Å
216	D	86.3	Confident	85	Confident	30 Å²	30	61.8 Å²	61.8	16%	0.16	30%	0.297	C	S	.	.	H	α-helix	trans	-64.3	-44.2	-179.5	-70.9	-13.2	0	0	0	112.1	H204 K212 A213 F218 A220	H204-D216 IonicContact CE1-OD2 2.82Å; H204-D216 PolarHBondContact CE1-OD2 3.42Å; H204-D216 IonicContact ND1-OD2 3.31Å; H204-D216 PolarHBondContact ND1-OD2 2.85Å; K212-D216 PolarHBondContact O-N 3.48Å; A213-D216 PolarHBondContact O-N 3.1Å; D216-F218 VanDerWaalsContact C-N 3.32Å; D216-F218 PolarHBondContact O-N 2.94Å; D216-A220 VanDerWaalsContact O-CB 3.27Å; D216-A220 WeakPolarHBondContact O-CB 3.4Å; D216-A220 PolarHBondContact O-N 3.49Å
217	F	89.1	Confident	84.7	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-67.2	-33.5	176.2	-74	-51.2	0	0	0	112.6	E198 G201 K202 L205 A213 F221 Y238 L239 A242 F301	E198-F217 HydrophobicContact CG-CE1 4.17Å; E198-F217 WeakPolarHBondContact O-CE1 3.34Å; G201-F217 VanDerWaalsContact C-CE2 3.47Å; G201-F217 WeakPolarHBondContact O-CE2 3.15Å; K202-F217 HydrophobicContact CB-CZ 4.46Å; K202-F217 HydrophobicContact CG-CE1 4.09Å; K202-F217 HydrophobicContact CG-CZ 3.83Å; K202-F217 VanDerWaalsContact N-CZ 3.29Å; L205-F217 HydrophobicContact CD1-CE2 4.39Å; A213-F217 HydrophobicContact CB-CD2 4.42Å; A213-F217 HydrophobicContact CB-CE2 4.3Å; A213-F217 WeakPolarHBondContact O-CB 3.42Å; A213-F217 WeakPolarHBondContact O-CD2 3.28Å; A213-F217 WeakPolarHBondContact O-CG 3.22Å; A213-F217 PolarHBondContact O-N 2.94Å; F217-F221 VanDerWaalsContact O-CB 3.23Å; F217-F221 WeakPolarHBondContact O-CB 3.28Å; F217-F221 PolarHBondContact O-N 3.06Å; F217-Y238 HydrophobicContact CD1-CD2 4.46Å; F217-Y238 AromaticContact CE1-CD2 3.91Å; F217-Y238 HydrophobicContact CE1-CD2 3.91Å; F217-Y238 HydrophobicContact CE1-CG 4.1Å; F217-Y238 HydrophobicContact CZ-CD2 4.46Å; F217-Y238 HydrophobicContact CZ-CG 4.28Å; F217-L239 HydrophobicContact CB-CB 4.07Å; F217-L239 HydrophobicContact CB-CD1 4.15Å; F217-A242 HydrophobicContact CD2-CB 3.98Å; F217-A242 HydrophobicContact CE2-CB 4.4Å; F217-F301 HydrophobicContact CZ-CE1 4.3Å; F217-F301 HydrophobicContact CZ-CZ 4.4Å
218	F	87.2	Confident	84.5	Confident	55 Å²	55	54.3 Å²	54.3	24%	0.241	29%	0.29	C	S	.	.	H	α-helix	trans	-68.7	-45	178.5	-172.2	-104.5	0	0	0	111.3	H214 T215 D216 F221 K222 L239	H214-F218 VanDerWaalsContact O-CB 3.28Å; H214-F218 WeakPolarHBondContact O-CB 3.35Å; H214-F218 PolarHBondContact O-N 3.34Å; T215-F218 PolarHBondContact O-N 2.78Å; D216-F218 VanDerWaalsContact C-N 3.32Å; D216-F218 PolarHBondContact O-N 2.94Å; F218-F221 PolarHBondContact O-N 3.16Å; F218-K222 HydrophobicContact CD1-CD 4.42Å; F218-K222 HydrophobicContact CE1-CD 3.98Å; F218-K222 HydrophobicContact CE1-CG 4.46Å; F218-K222 PolarHBondContact O-N 3.43Å; F218-L239 HydrophobicContact CB-CD1 3.87Å; F218-L239 HydrophobicContact CD2-CD1 4.24Å; F218-L239 HydrophobicContact CD2-CD2 3.77Å
219	E	84.3	Confident	84.3	Confident	87 Å²	87	53.9 Å²	53.9	41%	0.407	28%	0.281	S	S	.	.	H	α-helix	trans	-65.1	-42.8	174.9	-69.8	-175	-179.5	0	0	111.9	K197 T215 F221 K222 N223	K197-E219 HydrophobicContact CD-CB 4.11Å; K197-E219 WeakPolarHBondContact CE-OE2 3.38Å; K197-E219 IonicContact NZ-OE2 3.49Å; K197-E219 PolarHBondContact NZ-OE2 3.42Å; T215-E219 WeakPolarHBondContact O-CG 3.41Å; T215-E219 PolarHBondContact O-N 3.08Å; E219-F221 VanDerWaalsContact C-N 3.31Å; E219-F221 PolarHBondContact O-N 2.72Å; E219-K222 WeakPolarHBondContact O-CB 3.33Å; E219-K222 PolarHBondContact O-N 3.32Å; E219-N223 PolarHBondContact O-N 2.98Å
220	A	85.1	Confident	84	Confident	5 Å²	5	55.6 Å²	55.6	4%	0.041	30%	0.298	C	S	.	.	H	α-helix	trans	-60.6	-41.5	174.7	0	0	0	0	0	111.8	K197 D216 N223 Y224	K197-A220 HydrophobicContact CB-CB 4.06Å; D216-A220 VanDerWaalsContact O-CB 3.27Å; D216-A220 WeakPolarHBondContact O-CB 3.4Å; D216-A220 PolarHBondContact O-N 3.49Å; A220-N223 PolarHBondContact O-N 2.76Å; A220-Y224 HydrophobicContact CB-CE2 4.38Å; A220-Y224 WeakPolarHBondContact O-CD2 3.36Å; A220-Y224 PolarHBondContact O-N 3.27Å
221	F	87.5	Confident	83.7	Confident	1 Å²	1	58.4 Å²	58.4	0%	0.004	31%	0.308	C	S	.	.	H	α-helix	trans	-61.2	-44.9	176.1	172.6	-106.8	0	0	0	111.7	F217 F218 E219 N223 Y224 D225 R232 L236 L239 E257 A258 Y261	F217-F221 VanDerWaalsContact O-CB 3.23Å; F217-F221 WeakPolarHBondContact O-CB 3.28Å; F217-F221 PolarHBondContact O-N 3.06Å; F218-F221 PolarHBondContact O-N 3.16Å; E219-F221 VanDerWaalsContact C-N 3.31Å; E219-F221 PolarHBondContact O-N 2.72Å; F221-N223 VanDerWaalsContact C-N 3.34Å; F221-N223 PolarHBondContact O-N 3.11Å; F221-Y224 PolarHBondContact O-N 3.21Å; F221-D225 WeakPolarHBondContact O-CB 3.41Å; F221-D225 PolarHBondContact O-N 3.32Å; F221-R232 HydrophobicContact CD2-CB 4.44Å; F221-R232 HydrophobicContact CE2-CB 4.32Å; F221-L236 HydrophobicContact CD2-CB 3.92Å; F221-L236 HydrophobicContact CD2-CD1 4.23Å; F221-L236 HydrophobicContact CE1-CD1 4.4Å; F221-L236 HydrophobicContact CE2-CB 3.82Å; F221-L236 HydrophobicContact CE2-CD1 3.97Å; F221-L236 HydrophobicContact CE2-CD2 4.01Å; F221-L236 HydrophobicContact CE2-CG 4.16Å; F221-L236 HydrophobicContact CZ-CD1 4.07Å; F221-L236 HydrophobicContact CZ-CD2 4.24Å; F221-L239 HydrophobicContact CD1-CD2 4.5Å; F221-E257 HydrophobicContact CE1-CB 3.83Å; F221-A258 HydrophobicContact CE1-CB 4.39Å; F221-Y261 HydrophobicContact CE2-CE2 4.49Å; F221-Y261 AromaticContact CZ-CD2 3.93Å; F221-Y261 HydrophobicContact CZ-CD2 3.93Å; F221-Y261 AromaticContact CZ-CE2 3.92Å; F221-Y261 HydrophobicContact CZ-CE2 3.92Å
222	K	83.9	Confident	83.6	Confident	76 Å²	76	54.9 Å²	54.9	33%	0.33	29%	0.288	S	S	.	.	H	α-helix	trans	-56.7	-47.2	174.7	-75.6	-170.5	148.5	-168.3	0	112.2	F218 E219 Y224 D225 E226 E257	F218-K222 HydrophobicContact CD1-CD 4.42Å; F218-K222 HydrophobicContact CE1-CD 3.98Å; F218-K222 HydrophobicContact CE1-CG 4.46Å; F218-K222 PolarHBondContact O-N 3.43Å; E219-K222 WeakPolarHBondContact O-CB 3.33Å; E219-K222 PolarHBondContact O-N 3.32Å; K222-Y224 VanDerWaalsContact C-N 3.32Å; K222-Y224 PolarHBondContact O-N 2.81Å; K222-D225 PolarHBondContact O-N 3.4Å; K222-E226 WeakPolarHBondContact O-CG 3.48Å; K222-E226 PolarHBondContact O-N 3.2Å; K222-E257 VanDerWaalsContact CE-CD 3.49Å; K222-E257 WeakPolarHBondContact CE-OE1 3.44Å; K222-E257 IonicContact NZ-OE1 2.78Å; K222-E257 PolarHBondContact NZ-OE1 2.82Å
223	N	82	Confident	83.7	Confident	62 Å²	62	50.9 Å²	50.9	33%	0.332	27%	0.272	S	S	.	.	H	α-helix	trans	-63.4	-38.3	179	-69.3	-7.4	0	0	0	112	D194 E219 A220 F221 S227	D194-N223 PolarHBondContact OD1-ND2 3.47Å; E219-N223 PolarHBondContact O-N 2.98Å; A220-N223 PolarHBondContact O-N 2.76Å; F221-N223 VanDerWaalsContact C-N 3.34Å; F221-N223 PolarHBondContact O-N 3.11Å; N223-S227 WeakPolarHBondContact O-CB 3.09Å; N223-S227 PolarHBondContact O-N 3.04Å; N223-S227 VanDerWaalsContact O-N 3.11Å; N223-S227 PolarHBondContact O-OG 3.23Å
224	Y	83.3	Confident	83.7	Confident	28 Å²	28	53 Å²	53	11%	0.11	29%	0.285	C	S	.	.	H	α-helix	trans	-71.7	-33.2	176.6	-70	-44.3	0	0	0	113.5	E198 A220 F221 K222 S227 G228 S229 R231 C235	E198-Y224 WeakPolarHBondContact OE2-CE2 3.19Å; E198-Y224 PolarHBondContact OE2-OH 3.43Å; A220-Y224 HydrophobicContact CB-CE2 4.38Å; A220-Y224 WeakPolarHBondContact O-CD2 3.36Å; A220-Y224 PolarHBondContact O-N 3.27Å; F221-Y224 PolarHBondContact O-N 3.21Å; K222-Y224 VanDerWaalsContact C-N 3.32Å; K222-Y224 PolarHBondContact O-N 2.81Å; Y224-S227 WeakPolarHBondContact CA-OG 3.49Å; Y224-S227 PolarHBondContact O-OG 3.42Å; Y224-G228 PolarHBondContact O-N 3.11Å; Y224-G228 VanDerWaalsContact O-N 3.11Å; Y224-S229 PolarHBondContact O-N 2.87Å; Y224-R231 HydrophobicContact CD1-CB 4.34Å; Y224-R231 HydrophobicContact CD2-CB 4.47Å; Y224-R231 HydrophobicContact CE1-CB 4.25Å; Y224-R231 HydrophobicContact CE2-CB 4.35Å; Y224-R231 HydrophobicContact CG-CB 4.45Å; Y224-C235 HydrophobicContact CD2-CB 3.73Å; Y224-C235 HydrophobicContact CE2-CB 4.01Å
225	D	83.3	Confident	83.6	Confident	50 Å²	50	51.1 Å²	51.1	27%	0.267	28%	0.277	S	S	.	.	H	α-helix	trans	-66.9	-48.8	174.8	-168.7	59.2	0	0	0	111	F221 K222 S227 G228 Y261	F221-D225 WeakPolarHBondContact O-CB 3.41Å; F221-D225 PolarHBondContact O-N 3.32Å; K222-D225 PolarHBondContact O-N 3.4Å; D225-S227 VanDerWaalsContact C-N 3.28Å; D225-S227 PolarHBondContact O-N 2.96Å; D225-G228 PolarHBondContact O-N 2.69Å; D225-Y261 WeakPolarHBondContact OD1-CE2 3.3Å; D225-Y261 PolarHBondContact OD1-OH 3.33Å
226	E	78.1	Confident	83.8	Confident	121 Å²	121	48 Å²	48	57%	0.565	26%	0.258	S	S	*	.	H	α-helix	trans	-63.4	-32.9	177.8	-70.3	-165.3	158.3	0	0	113.1	R153 K222 G228	R153-E226 IonicContact CZ-OE1 2.68Å; R153-E226 IonicContact NE-OE1 3.15Å; R153-E226 PolarHBondContact NE-OE1 2.83Å; R153-E226 IonicContact NH2-OE1 3.87Å; R153-E226 PolarHBondContact NH2-OE1 2.98Å; K222-E226 WeakPolarHBondContact O-CG 3.48Å; K222-E226 PolarHBondContact O-N 3.2Å; E226-G228 VanDerWaalsContact C-N 3.35Å
227	S	75.6	Confident	83.9	Confident	81 Å²	81	47.4 Å²	47.4	57%	0.566	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-9.4	176.4	55.9	0	0	0	0	113.9	N223 Y224 D225 S229	N223-S227 WeakPolarHBondContact O-CB 3.09Å; N223-S227 PolarHBondContact O-N 3.04Å; N223-S227 VanDerWaalsContact O-N 3.11Å; N223-S227 PolarHBondContact O-OG 3.23Å; Y224-S227 WeakPolarHBondContact CA-OG 3.49Å; Y224-S227 PolarHBondContact O-OG 3.42Å; D225-S227 VanDerWaalsContact C-N 3.28Å; D225-S227 PolarHBondContact O-N 2.96Å; S227-S229 PolarHBondContact O-N 3.21Å
228	G	76	Confident	84	Confident	46 Å²	46	48 Å²	48	47%	0.474	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.3	22.4	-176.8	0	0	0	0	0	113.9	Y224 D225 E226	Y224-G228 PolarHBondContact O-N 3.11Å; Y224-G228 VanDerWaalsContact O-N 3.11Å; D225-G228 PolarHBondContact O-N 2.69Å; E226-G228 VanDerWaalsContact C-N 3.35Å
229	S	77.8	Confident	84.1	Confident	28 Å²	28	45.4 Å²	45.4	20%	0.196	24%	0.244	C	C	.	.			trans	-70.2	140.6	-176.1	177.7	0	0	0	0	111.7	Y224 S227 R231 R232	Y224-S229 PolarHBondContact O-N 2.87Å; S227-S229 PolarHBondContact O-N 3.21Å; S229-R231 PolarHBondContact O-N 3.4Å; S229-R231 VanDerWaalsContact O-N 3.13Å; S229-R231 PolarHBondContact OG-N 3.08Å; S229-R232 WeakPolarHBondContact O-CG 3.43Å; S229-R232 PolarHBondContact O-N 2.98Å; S229-R232 VanDerWaalsContact O-N 3.17Å
230	P	79.7	Confident	84.4	Confident	108 Å²	108	41.2 Å²	41.2	70%	0.701	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-18.5	173.5	27.4	-35	0	0	0	112.5	R232 T233	P230-R232 PolarHBondContact O-N 3.12Å; P230-T233 PolarHBondContact O-OG1 3.47Å
231	R	82.1	Confident	84.6	Confident	100 Å²	100	41 Å²	41	38%	0.377	22%	0.223	S	C	.	.	H	α-helix	trans	-68.2	-12.5	176.9	-64.4	-176.3	71.4	173.1	2	113.8	E198 Y224 S229 T233 T234 C235	E198-R231 VanDerWaalsContact CD-NH2 3.28Å; E198-R231 IonicContact OE1-NH2 3.11Å; E198-R231 PolarHBondContact OE1-NH2 3.47Å; E198-R231 IonicContact OE2-CZ 3.92Å; E198-R231 VanDerWaalsContact OE2-CZ 3.31Å; E198-R231 IonicContact OE2-NE 2.81Å; E198-R231 PolarHBondContact OE2-NE 2.94Å; E198-R231 IonicContact OE2-NH2 2.71Å; E198-R231 PolarHBondContact OE2-NH2 3.23Å; Y224-R231 HydrophobicContact CD1-CB 4.34Å; Y224-R231 HydrophobicContact CD2-CB 4.47Å; Y224-R231 HydrophobicContact CE1-CB 4.25Å; Y224-R231 HydrophobicContact CE2-CB 4.35Å; Y224-R231 HydrophobicContact CG-CB 4.45Å; S229-R231 PolarHBondContact O-N 3.4Å; S229-R231 VanDerWaalsContact O-N 3.13Å; S229-R231 PolarHBondContact OG-N 3.08Å; R231-T233 PolarHBondContact O-N 3.02Å; R231-T234 PolarHBondContact O-N 2.95Å; R231-C235 WeakPolarHBondContact O-CB 3.47Å; R231-C235 PolarHBondContact O-N 3.05Å
232	R	85.8	Confident	84.7	Confident	71 Å²	71	41 Å²	41	27%	0.268	22%	0.223	S	C	.	.	H	α-helix	trans	-58.4	-37.3	178.3	76.6	-177	178.4	-129.7	-3.1	112.1	F221 S229 P230 C235 L236 Y261	F221-R232 HydrophobicContact CD2-CB 4.44Å; F221-R232 HydrophobicContact CE2-CB 4.32Å; S229-R232 WeakPolarHBondContact O-CG 3.43Å; S229-R232 PolarHBondContact O-N 2.98Å; S229-R232 VanDerWaalsContact O-N 3.17Å; P230-R232 PolarHBondContact O-N 3.12Å; R232-C235 PolarHBondContact O-N 3.09Å; R232-L236 VanDerWaalsContact O-CB 3.28Å; R232-L236 WeakPolarHBondContact O-CB 3.46Å; R232-L236 PolarHBondContact O-N 3.29Å; R232-Y261 WeakPolarHBondContact CD-OH 3.33Å; R232-Y261 VanDerWaalsContact NE-CE1 3.31Å; R232-Y261 PolarHBondContact NE-OH 3.45Å
233	T	86.3	Confident	84.9	Confident	16 Å²	16	37.7 Å²	37.7	10%	0.098	21%	0.209	C	C	.	.	H	α-helix	trans	-68.2	-44.3	-178.7	56.3	0	0	0	0	110.4	P230 R231 L236 K237	P230-T233 PolarHBondContact O-OG1 3.47Å; R231-T233 PolarHBondContact O-N 3.02Å; T233-L236 PolarHBondContact O-N 3.31Å; T233-K237 WeakPolarHBondContact O-CG 3.39Å; T233-K237 PolarHBondContact O-N 3.19Å; T233-K237 VanDerWaalsContact O-N 3.09Å
234	T	87.6	Confident	85.1	Confident	44 Å²	44	34.8 Å²	34.8	27%	0.27	19%	0.193	S	C	.	.	H	α-helix	trans	-62.4	-45.2	174.7	-39.5	0	0	0	0	111.8	R231 L236 K237 Y238	R231-T234 PolarHBondContact O-N 2.95Å; T234-L236 VanDerWaalsContact C-N 3.3Å; T234-L236 PolarHBondContact O-N 3.13Å; T234-K237 WeakPolarHBondContact O-CB 3.42Å; T234-K237 PolarHBondContact O-N 2.84Å; T234-K237 VanDerWaalsContact O-N 3.15Å; T234-Y238 HydrophobicContact CG2-CE1 4.46Å; T234-Y238 HydrophobicContact CG2-CE2 3.79Å; T234-Y238 PolarHBondContact O-N 3.48Å
235	C	88.6	Confident	85.3	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.1	-38.3	177.9	-163.9	0	0	0	0	111.9	Y224 R231 R232 K237 Y238 L239	Y224-C235 HydrophobicContact CD2-CB 3.73Å; Y224-C235 HydrophobicContact CE2-CB 4.01Å; R231-C235 WeakPolarHBondContact O-CB 3.47Å; R231-C235 PolarHBondContact O-N 3.05Å; R232-C235 PolarHBondContact O-N 3.09Å; C235-K237 VanDerWaalsContact C-N 3.32Å; C235-K237 PolarHBondContact O-N 3.27Å; C235-Y238 PolarHBondContact O-N 3.22Å; C235-Y238 VanDerWaalsContact O-N 3.16Å; C235-L239 PolarHBondContact O-N 3.17Å
236	L	89.4	Confident	85.4	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-63	-38.2	175.2	-172.7	56.2	0	0	0	111.6	F221 R232 T233 T234 Y238 L239 V240 F253 A258 Y261 I267	F221-L236 HydrophobicContact CD2-CB 3.92Å; F221-L236 HydrophobicContact CD2-CD1 4.23Å; F221-L236 HydrophobicContact CE1-CD1 4.4Å; F221-L236 HydrophobicContact CE2-CB 3.82Å; F221-L236 HydrophobicContact CE2-CD1 3.97Å; F221-L236 HydrophobicContact CE2-CD2 4.01Å; F221-L236 HydrophobicContact CE2-CG 4.16Å; F221-L236 HydrophobicContact CZ-CD1 4.07Å; F221-L236 HydrophobicContact CZ-CD2 4.24Å; R232-L236 VanDerWaalsContact O-CB 3.28Å; R232-L236 WeakPolarHBondContact O-CB 3.46Å; R232-L236 PolarHBondContact O-N 3.29Å; T233-L236 PolarHBondContact O-N 3.31Å; T234-L236 VanDerWaalsContact C-N 3.3Å; T234-L236 PolarHBondContact O-N 3.13Å; L236-Y238 VanDerWaalsContact C-N 3.33Å; L236-Y238 PolarHBondContact O-N 3.11Å; L236-L239 HydrophobicContact CD1-CD2 4.06Å; L236-L239 PolarHBondContact O-N 2.78Å; L236-V240 HydrophobicContact CD1-CG2 4.44Å; L236-V240 WeakPolarHBondContact O-CB 3.44Å; L236-V240 WeakPolarHBondContact O-CG2 3.19Å; L236-V240 PolarHBondContact O-N 3.25Å; L236-F253 HydrophobicContact CD1-CE1 4.44Å; L236-F253 HydrophobicContact CD2-CE1 4.06Å; L236-F253 HydrophobicContact CG-CE1 4.32Å; L236-A258 HydrophobicContact CD1-CB 4Å; L236-Y261 HydrophobicContact CD2-CD2 4.42Å; L236-Y261 HydrophobicContact CD2-CG 4.13Å; L236-I267 HydrophobicContact CB-CD1 4.32Å; L236-I267 HydrophobicContact CD2-CD1 4.1Å; L236-I267 HydrophobicContact CD2-CG1 4.21Å; L236-I267 HydrophobicContact CD2-CG2 4.01Å; L236-I267 HydrophobicContact CG-CD1 4.39Å
237	K	90.1	Very high	85.4	Confident	17 Å²	17	34.4 Å²	34.4	7%	0.074	19%	0.19	C	C	.	.	H	α-helix	trans	-59.5	-43.5	172.5	-62.8	178	-172.6	175.5	0	111.3	T233 T234 C235 V240 L241 E266 I267 M270 N295 I302	T233-K237 WeakPolarHBondContact O-CG 3.39Å; T233-K237 PolarHBondContact O-N 3.19Å; T233-K237 VanDerWaalsContact O-N 3.09Å; T234-K237 WeakPolarHBondContact O-CB 3.42Å; T234-K237 PolarHBondContact O-N 2.84Å; T234-K237 VanDerWaalsContact O-N 3.15Å; C235-K237 VanDerWaalsContact C-N 3.32Å; C235-K237 PolarHBondContact O-N 3.27Å; K237-V240 PolarHBondContact O-N 2.95Å; K237-L241 WeakPolarHBondContact O-CB 3.44Å; K237-L241 PolarHBondContact O-N 3.42Å; K237-E266 IonicContact NZ-OE1 2.73Å; K237-E266 PolarHBondContact NZ-OE1 3.02Å; K237-I267 HydrophobicContact CG-CD1 4.15Å; K237-M270 HydrophobicContact CB-CE 4.41Å; K237-M270 HydrophobicContact CB-CG 4.28Å; K237-M270 HydrophobicContact CB-SD 4.48Å; K237-M270 HydrophobicContact CG-CG 3.87Å; K237-M270 HydrophobicContact CG-SD 4.5Å; K237-M270 WeakPolarHBondContact O-CE 3.3Å; K237-N295 PolarHBondContact NZ-O 3.07Å; K237-I302 HydrophobicContact CB-CD1 3.97Å; K237-I302 HydrophobicContact CD-CD1 4.3Å
238	Y	90.3	Very high	85.1	Confident	11 Å²	11	31.6 Å²	31.6	4%	0.043	17%	0.17	C	C	.	.	H	α-helix	trans	-68.4	-39.5	178.1	-56.7	-34.2	0	0	0	113.1	E198 K202 F217 T234 C235 L236 V240 L241 A242 D299 F301 I302	E198-Y238 HydrophobicContact CG-CD2 4.35Å; E198-Y238 HydrophobicContact CG-CE2 4.49Å; K202-Y238 PolarHBondContact NZ-OH 3.27Å; F217-Y238 HydrophobicContact CD1-CD2 4.46Å; F217-Y238 AromaticContact CE1-CD2 3.91Å; F217-Y238 HydrophobicContact CE1-CD2 3.91Å; F217-Y238 HydrophobicContact CE1-CG 4.1Å; F217-Y238 HydrophobicContact CZ-CD2 4.46Å; F217-Y238 HydrophobicContact CZ-CG 4.28Å; T234-Y238 HydrophobicContact CG2-CE1 4.46Å; T234-Y238 HydrophobicContact CG2-CE2 3.79Å; T234-Y238 PolarHBondContact O-N 3.48Å; C235-Y238 PolarHBondContact O-N 3.22Å; C235-Y238 VanDerWaalsContact O-N 3.16Å; L236-Y238 VanDerWaalsContact C-N 3.33Å; L236-Y238 PolarHBondContact O-N 3.11Å; Y238-V240 VanDerWaalsContact C-N 3.33Å; Y238-V240 PolarHBondContact O-N 2.97Å; Y238-L241 WeakPolarHBondContact O-CB 3.14Å; Y238-L241 PolarHBondContact O-N 2.87Å; Y238-A242 WeakPolarHBondContact O-CB 3.33Å; Y238-A242 PolarHBondContact O-N 2.9Å; Y238-D299 VanDerWaalsContact CE1-OD2 3.27Å; Y238-D299 WeakPolarHBondContact CE1-OD2 3.31Å; Y238-D299 PolarHBondContact OH-OD2 2.81Å; Y238-F301 AromaticContact CD1-CD1 3.66Å; Y238-F301 HydrophobicContact CD1-CD1 3.66Å; Y238-F301 AromaticContact CD1-CE1 3.97Å; Y238-F301 HydrophobicContact CD1-CE1 3.97Å; Y238-F301 HydrophobicContact CE1-CB 4.49Å; Y238-F301 AromaticContact CE1-CD1 3.6Å; Y238-F301 HydrophobicContact CE1-CD1 3.6Å; Y238-F301 HydrophobicContact CE1-CE1 4.33Å; Y238-F301 HydrophobicContact CE1-CG 4.45Å; Y238-F301 HydrophobicContact CG-CD1 4.42Å; Y238-F301 HydrophobicContact CG-CE1 4.37Å; Y238-I302 HydrophobicContact CD1-CD1 4.34Å; Y238-I302 HydrophobicContact CD1-CG1 4.02Å; Y238-I302 HydrophobicContact CE1-CD1 4.12Å; Y238-I302 HydrophobicContact CE1-CG1 3.81Å
239	L	89.8	Confident	84.6	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-58.5	-46.8	174.1	175	63	0	0	0	111.2	F217 F218 F221 C235 L236 L241 A242 N243	F217-L239 HydrophobicContact CB-CB 4.07Å; F217-L239 HydrophobicContact CB-CD1 4.15Å; F218-L239 HydrophobicContact CB-CD1 3.87Å; F218-L239 HydrophobicContact CD2-CD1 4.24Å; F218-L239 HydrophobicContact CD2-CD2 3.77Å; F221-L239 HydrophobicContact CD1-CD2 4.5Å; C235-L239 PolarHBondContact O-N 3.17Å; L236-L239 HydrophobicContact CD1-CD2 4.06Å; L236-L239 PolarHBondContact O-N 2.78Å; L239-L241 VanDerWaalsContact C-N 3.34Å; L239-L241 PolarHBondContact O-N 3.1Å; L239-A242 PolarHBondContact O-N 3.27Å; L239-N243 WeakPolarHBondContact O-CB 3.5Å; L239-N243 PolarHBondContact O-N 3.37Å
240	V	89.6	Confident	84.4	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-63.8	-41.3	178.7	174.6	0	0	0	0	111.2	L236 K237 Y238 N243 M244 P252 F253 M270 V274	L236-V240 HydrophobicContact CD1-CG2 4.44Å; L236-V240 WeakPolarHBondContact O-CB 3.44Å; L236-V240 WeakPolarHBondContact O-CG2 3.19Å; L236-V240 PolarHBondContact O-N 3.25Å; K237-V240 PolarHBondContact O-N 2.95Å; Y238-V240 VanDerWaalsContact C-N 3.33Å; Y238-V240 PolarHBondContact O-N 2.97Å; V240-N243 PolarHBondContact O-N 3.18Å; V240-M244 HydrophobicContact CG1-CE 3.9Å; V240-M244 WeakPolarHBondContact O-CG 3.41Å; V240-M244 PolarHBondContact O-N 3.47Å; V240-M244 VanDerWaalsContact O-N 3.09Å; V240-P252 HydrophobicContact CB-CG 4.32Å; V240-P252 HydrophobicContact CG1-CG 4.26Å; V240-P252 HydrophobicContact CG2-CB 4.26Å; V240-P252 HydrophobicContact CG2-CG 3.79Å; V240-F253 HydrophobicContact CG1-CE2 4.44Å; V240-F253 HydrophobicContact CG2-CE1 4.43Å; V240-F253 HydrophobicContact CG2-CE2 3.75Å; V240-F253 HydrophobicContact CG2-CZ 3.61Å; V240-M270 HydrophobicContact CB-CE 3.89Å; V240-M270 HydrophobicContact CG1-CB 4.18Å; V240-M270 HydrophobicContact CG1-CE 3.74Å; V240-V274 HydrophobicContact CG1-CG2 3.15Å
241	L	89.6	Confident	84.1	Confident	1 Å²	1	33 Å²	33	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-60.5	-48.3	174.8	-178.4	69.4	0	0	0	111.9	L205 K237 Y238 L239 N243 M244 L245 F301 I302 H305 L309	L205-L241 HydrophobicContact CD2-CD2 3.99Å; L205-L241 HydrophobicContact CD2-CG 4.5Å; K237-L241 WeakPolarHBondContact O-CB 3.44Å; K237-L241 PolarHBondContact O-N 3.42Å; Y238-L241 WeakPolarHBondContact O-CB 3.14Å; Y238-L241 PolarHBondContact O-N 2.87Å; L239-L241 VanDerWaalsContact C-N 3.34Å; L239-L241 PolarHBondContact O-N 3.1Å; L241-N243 VanDerWaalsContact C-N 3.31Å; L241-N243 PolarHBondContact O-N 3.45Å; L241-M244 PolarHBondContact O-N 3.06Å; L241-L245 HydrophobicContact CG-CD1 4.16Å; L241-L245 WeakPolarHBondContact O-CG 3.43Å; L241-L245 PolarHBondContact O-N 3.03Å; L241-F301 HydrophobicContact CD2-CE1 4.34Å; L241-I302 HydrophobicContact CD1-CG2 4.48Å; L241-I302 HydrophobicContact CD2-CB 4.48Å; L241-I302 HydrophobicContact CD2-CG1 4.34Å; L241-I302 HydrophobicContact CD2-CG2 4.4Å; L241-H305 HydrophobicContact CD1-CB 4.28Å; L241-H305 HydrophobicContact CD2-CB 4.1Å; L241-H305 HydrophobicContact CG-CB 4.47Å; L241-L309 HydrophobicContact CD1-CD1 3.56Å; L241-L309 HydrophobicContact CD1-CD2 4.01Å; L241-L309 HydrophobicContact CD1-CG 4.48Å
242	A	90.3	Very high	83.9	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.9	-40	177.7	0	0	0	0	0	111.9	L205 H214 F217 Y238 L239 L245 M246	L205-A242 HydrophobicContact CD1-CB 3.73Å; H214-A242 HydrophobicContact CB-CB 4.34Å; F217-A242 HydrophobicContact CD2-CB 3.98Å; F217-A242 HydrophobicContact CE2-CB 4.4Å; Y238-A242 WeakPolarHBondContact O-CB 3.33Å; Y238-A242 PolarHBondContact O-N 2.9Å; L239-A242 PolarHBondContact O-N 3.27Å; A242-L245 PolarHBondContact O-N 3.12Å; A242-M246 WeakPolarHBondContact O-CB 3.3Å; A242-M246 PolarHBondContact O-N 3.41Å
243	N	88.4	Confident	83.6	Confident	6 Å²	6	25.5 Å²	25.5	3%	0.032	15%	0.147	C	C	.	.	H	α-helix	trans	-61.8	-44.1	176.4	-174.4	-76	0	0	0	112.3	L239 V240 L241 M246 I250 P252	L239-N243 WeakPolarHBondContact O-CB 3.5Å; L239-N243 PolarHBondContact O-N 3.37Å; V240-N243 PolarHBondContact O-N 3.18Å; L241-N243 VanDerWaalsContact C-N 3.31Å; L241-N243 PolarHBondContact O-N 3.45Å; N243-M246 PolarHBondContact O-N 3.48Å; N243-I250 PolarHBondContact ND2-O 2.75Å; N243-I250 PolarHBondContact OD1-O 2.93Å; N243-I250 VanDerWaalsContact OD1-O 3.08Å; N243-P252 HydrophobicContact CB-CB 4.5Å; N243-P252 HydrophobicContact CB-CG 4.35Å
244	M	86.6	Confident	83.3	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-64.1	-41.1	175.9	-71.2	-174.5	-71.4	0	0	112	V240 L241 K247 M270 V274 Y277 L309	V240-M244 HydrophobicContact CG1-CE 3.9Å; V240-M244 WeakPolarHBondContact O-CG 3.41Å; V240-M244 PolarHBondContact O-N 3.47Å; V240-M244 VanDerWaalsContact O-N 3.09Å; L241-M244 PolarHBondContact O-N 3.06Å; M244-K247 PolarHBondContact O-N 2.73Å; M244-K247 VanDerWaalsContact O-N 3.11Å; M244-M270 HydrophobicContact CE-CE 4.09Å; M244-V274 HydrophobicContact CE-CG2 4.47Å; M244-V274 HydrophobicContact CG-CG2 4.22Å; M244-V274 HydrophobicContact SD-CG2 3.97Å; M244-Y277 HydrophobicContact CB-CD1 4.39Å; M244-Y277 HydrophobicContact CB-CE1 4.37Å; M244-Y277 HydrophobicContact CB-CG 4.48Å; M244-Y277 HydrophobicContact CG-CD1 4.19Å; M244-Y277 HydrophobicContact CG-CG 4.19Å; M244-Y277 VanDerWaalsContact O-CZ 3.27Å; M244-Y277 PolarHBondContact O-OH 3.48Å; M244-Y277 HydrophobicContact SD-CG 4.29Å; M244-L309 HydrophobicContact CB-CD2 3.63Å; M244-L309 HydrophobicContact CB-CG 4.36Å; M244-L309 HydrophobicContact CE-CD2 3.61Å; M244-L309 HydrophobicContact CG-CD2 4.3Å; M244-L309 HydrophobicContact SD-CD2 3.78Å
245	L	86.9	Confident	82.9	Confident	3 Å²	3	29.4 Å²	29.4	2%	0.016	17%	0.168	C	C	.	.	H	α-helix	trans	-66.3	-35.7	177.3	-76.1	165.1	0	0	0	113.3	L205 F210 L241 A242 K247 H305 E308 L309	L205-L245 HydrophobicContact CD1-CD1 3.86Å; L205-L245 HydrophobicContact CD2-CD1 3.91Å; L205-L245 HydrophobicContact CG-CD1 3.96Å; F210-L245 HydrophobicContact CB-CB 4.46Å; F210-L245 HydrophobicContact CD1-CB 3.62Å; F210-L245 HydrophobicContact CD1-CD1 4.04Å; F210-L245 HydrophobicContact CD1-CG 4.34Å; F210-L245 HydrophobicContact CD2-CB 4.43Å; F210-L245 HydrophobicContact CE1-CB 3.88Å; F210-L245 HydrophobicContact CE1-CD1 3.89Å; F210-L245 HydrophobicContact CE1-CD2 4.19Å; F210-L245 HydrophobicContact CE1-CG 4.2Å; F210-L245 HydrophobicContact CG-CB 3.92Å; F210-L245 HydrophobicContact CZ-CB 4.38Å; F210-L245 HydrophobicContact CZ-CD2 4.35Å; L241-L245 HydrophobicContact CG-CD1 4.16Å; L241-L245 WeakPolarHBondContact O-CG 3.43Å; L241-L245 PolarHBondContact O-N 3.03Å; A242-L245 PolarHBondContact O-N 3.12Å; L245-K247 PolarHBondContact O-N 2.98Å; L245-H305 HydrophobicContact CD1-CB 4.13Å; L245-E308 HydrophobicContact CD2-CB 4.29Å; L245-E308 HydrophobicContact CD2-CG 4.12Å; L245-L309 HydrophobicContact CD1-CD1 4.24Å; L245-L309 HydrophobicContact CD2-CD1 3.47Å; L245-L309 VanDerWaalsContact CD2-CD1 3.47Å; L245-L309 HydrophobicContact CD2-CG 4.28Å; L245-L309 HydrophobicContact CG-CD1 3.64Å; L245-L309 HydrophobicContact CG-CG 4.45Å
246	M	84.1	Confident	82.4	Confident	60 Å²	60	37.6 Å²	37.6	30%	0.296	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-7.3	173.1	-171.4	171.4	72	0	0	112.8	F210 E211 H214 A242 N243 S248	F210-M246 HydrophobicContact CB-CB 4.18Å; E211-M246 HydrophobicContact CB-SD 4.13Å; E211-M246 HydrophobicContact CG-SD 4.13Å; H214-M246 HydrophobicContact CB-SD 4.43Å; A242-M246 WeakPolarHBondContact O-CB 3.3Å; A242-M246 PolarHBondContact O-N 3.41Å; N243-M246 PolarHBondContact O-N 3.48Å; M246-S248 PolarHBondContact O-N 3.17Å
247	K	79.1	Confident	81.9	Confident	128 Å²	128	40 Å²	40	56%	0.557	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.1	28.3	-175.2	-57.2	176.1	-179.1	176.6	0	112.1	M244 L245 N312	M244-K247 PolarHBondContact O-N 2.73Å; M244-K247 VanDerWaalsContact O-N 3.11Å; L245-K247 PolarHBondContact O-N 2.98Å; K247-N312 VanDerWaalsContact CE-OD1 3.32Å; K247-N312 WeakPolarHBondContact CE-OD1 3.31Å; K247-N312 PolarHBondContact NZ-OD1 3.2Å
248	S	70.2	Confident	81.5	Confident	22 Å²	22	39.1 Å²	39.1	15%	0.154	21%	0.213	C	C	.	.			trans	-72.9	139	176.5	-173.3	0	0	0	0	110.5	M246 I250	M246-S248 PolarHBondContact O-N 3.17Å; S248-I250 PolarHBondContact OG-N 3.41Å
249	G	64.4	Low	81.1	Confident	69 Å²	69	45.5 Å²	45.5	71%	0.711	24%	0.241	S	C	*	.			trans	-81.6	-3.8	170	0	0	0	0	0	113.4	Q278	G249-Q278 PolarHBondContact O-NE2 2.96Å
250	I	73.8	Confident	81	Confident	120 Å²	120	49.8 Å²	49.8	62%	0.615	27%	0.269	S	S	*	.	S	Bend	trans	-86.3	124.7	-173.9	-55.5	172.5	0	0	0	109.4	N243 S248 P252	N243-I250 PolarHBondContact ND2-O 2.75Å; N243-I250 PolarHBondContact OD1-O 2.93Å; N243-I250 VanDerWaalsContact OD1-O 3.08Å; S248-I250 PolarHBondContact OG-N 3.41Å; I250-P252 WeakPolarHBondContact O-CD 3.26Å
251	N	74.1	Confident	80.7	Confident	24 Å²	24	51.3 Å²	51.3	13%	0.128	28%	0.275	C	S	.	.			trans	-73	121.8	179.1	-165.7	-26.8	0	0	0	110.3	F253 D254	N251-F253 PolarHBondContact O-N 2.63Å; N251-F253 VanDerWaalsContact O-N 3.13Å; N251-F253 WeakPolarHBondContact OD1-CB 3.44Å; N251-F253 WeakPolarHBondContact OD1-CD2 3.48Å; N251-F253 PolarHBondContact OD1-N 3.49Å; N251-D254 WeakPolarHBondContact CB-OD2 3.39Å; N251-D254 WeakPolarHBondContact O-CB 3.48Å; N251-D254 PolarHBondContact O-N 2.95Å; N251-D254 VanDerWaalsContact O-N 3.08Å
252	P	76.3	Confident	80.3	Confident	10 Å²	10	55.5 Å²	55.5	7%	0.065	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-59.9	-24.7	178	23.1	-33.4	0	0	0	112.9	V240 N243 I250 D254 S255 A258 V274	V240-P252 HydrophobicContact CB-CG 4.32Å; V240-P252 HydrophobicContact CG1-CG 4.26Å; V240-P252 HydrophobicContact CG2-CB 4.26Å; V240-P252 HydrophobicContact CG2-CG 3.79Å; N243-P252 HydrophobicContact CB-CB 4.5Å; N243-P252 HydrophobicContact CB-CG 4.35Å; I250-P252 WeakPolarHBondContact O-CD 3.26Å; P252-D254 VanDerWaalsContact C-N 3.31Å; P252-D254 PolarHBondContact O-N 3.35Å; P252-S255 PolarHBondContact O-OG 3.02Å; P252-A258 WeakPolarHBondContact O-CB 3.33Å; P252-V274 HydrophobicContact CG-CG2 4.4Å
253	F	79.6	Confident	79.9	Confident	3 Å²	3	62 Å²	62	1%	0.013	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-80.3	-4	178.5	-62.8	-73.4	0	0	0	114.9	L236 V240 N251 S255 A258 K259 I267 T271 V274	L236-F253 HydrophobicContact CD1-CE1 4.44Å; L236-F253 HydrophobicContact CD2-CE1 4.06Å; L236-F253 HydrophobicContact CG-CE1 4.32Å; V240-F253 HydrophobicContact CG1-CE2 4.44Å; V240-F253 HydrophobicContact CG2-CE1 4.43Å; V240-F253 HydrophobicContact CG2-CE2 3.75Å; V240-F253 HydrophobicContact CG2-CZ 3.61Å; N251-F253 PolarHBondContact O-N 2.63Å; N251-F253 VanDerWaalsContact O-N 3.13Å; N251-F253 WeakPolarHBondContact OD1-CB 3.44Å; N251-F253 WeakPolarHBondContact OD1-CD2 3.48Å; N251-F253 PolarHBondContact OD1-N 3.49Å; F253-S255 VanDerWaalsContact C-N 3.26Å; F253-A258 HydrophobicContact CD1-CB 4.07Å; F253-K259 WeakPolarHBondContact O-CA 3.49Å; F253-I267 HydrophobicContact CE1-CG2 3.4Å; F253-I267 VanDerWaalsContact CE1-CG2 3.4Å; F253-I267 HydrophobicContact CZ-CG2 3.49Å; F253-I267 VanDerWaalsContact CZ-CG2 3.49Å; F253-T271 HydrophobicContact CD2-CG2 4.42Å; F253-V274 HydrophobicContact CE2-CG2 4.43Å
254	D	79.9	Confident	79.8	Confident	116 Å²	116	64 Å²	64	62%	0.62	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-78.9	-13.6	172.3	-68.5	-21	0	0	0	112.1	N251 P252	N251-D254 WeakPolarHBondContact CB-OD2 3.39Å; N251-D254 WeakPolarHBondContact O-CB 3.48Å; N251-D254 PolarHBondContact O-N 2.95Å; N251-D254 VanDerWaalsContact O-N 3.08Å; P252-D254 VanDerWaalsContact C-N 3.31Å; P252-D254 PolarHBondContact O-N 3.35Å
255	S	79.9	Confident	79.5	Confident	26 Å²	26	68.9 Å²	68.9	18%	0.182	37%	0.371	C	S	.	.	S	Bend	trans	-64	145	172.4	62.7	0	0	0	0	111.4	P252 F253 E257 A258 K259	P252-S255 PolarHBondContact O-OG 3.02Å; F253-S255 VanDerWaalsContact C-N 3.26Å; S255-E257 PolarHBondContact O-N 3.46Å; S255-A258 PolarHBondContact O-N 2.73Å; S255-A258 WeakPolarHBondContact OG-CB 3.48Å; S255-A258 PolarHBondContact OG-N 3.3Å; S255-K259 WeakPolarHBondContact O-CB 3.49Å; S255-K259 PolarHBondContact O-N 3.21Å
256	Q	78.8	Confident	79.2	Confident	172 Å²	172	72.3 Å²	72.3	80%	0.804	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-33.2	-178.4	-69.2	-176.9	-7.4	0	0	111.4	P260	Q256-P260 WeakPolarHBondContact O-CD 3.49Å
257	E	78.5	Confident	79.4	Confident	49 Å²	49	69.5 Å²	69.5	23%	0.229	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-37	-177.2	-56.6	87.4	161.9	0	0	112.5	F221 K222 S255 Y261	F221-E257 HydrophobicContact CE1-CB 3.83Å; K222-E257 VanDerWaalsContact CE-CD 3.49Å; K222-E257 WeakPolarHBondContact CE-OE1 3.44Å; K222-E257 IonicContact NZ-OE1 2.78Å; K222-E257 PolarHBondContact NZ-OE1 2.82Å; S255-E257 PolarHBondContact O-N 3.46Å; E257-Y261 VanDerWaalsContact O-CD2 3.26Å; E257-Y261 WeakPolarHBondContact O-CD2 3.5Å; E257-Y261 VanDerWaalsContact O-CE2 3.3Å; E257-Y261 WeakPolarHBondContact O-CE2 3.38Å
258	A	80.6	Confident	79.8	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-21.2	-178.2	0	0	0	0	0	114.1	F221 L236 P252 F253 S255 P260 Y261	F221-A258 HydrophobicContact CE1-CB 4.39Å; L236-A258 HydrophobicContact CD1-CB 4Å; P252-A258 WeakPolarHBondContact O-CB 3.33Å; F253-A258 HydrophobicContact CD1-CB 4.07Å; S255-A258 PolarHBondContact O-N 2.73Å; S255-A258 WeakPolarHBondContact OG-CB 3.48Å; S255-A258 PolarHBondContact OG-N 3.3Å; A258-P260 VanDerWaalsContact C-CD 3.44Å; A258-Y261 WeakPolarHBondContact O-CB 3.48Å; A258-Y261 PolarHBondContact O-N 2.87Å
259	K	83.6	Confident	80.6	Confident	144 Å²	144	66 Å²	66	63%	0.626	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-51.1	-43.9	179.3	-167.8	171.3	-175	175.7	0	115.3	F253 S255 Y261 K262	F253-K259 WeakPolarHBondContact O-CA 3.49Å; S255-K259 WeakPolarHBondContact O-CB 3.49Å; S255-K259 PolarHBondContact O-N 3.21Å; K259-Y261 PolarHBondContact O-N 3.35Å; K259-K262 WeakPolarHBondContact O-CB 3.4Å; K259-K262 PolarHBondContact O-N 3.18Å
260	P	85.9	Confident	81.8	Confident	91 Å²	91	62.8 Å²	62.8	59%	0.591	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-66.2	-25.2	179	25.1	-34	0	0	0	113.1	Q256 A258 K262	Q256-P260 WeakPolarHBondContact O-CD 3.49Å; A258-P260 VanDerWaalsContact C-CD 3.44Å; P260-K262 VanDerWaalsContact C-N 3.32Å; P260-K262 PolarHBondContact O-N 3.01Å
261	Y	83.4	Confident	82.5	Confident	32 Å²	32	57.6 Å²	57.6	13%	0.125	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-82.8	-6.9	-176.6	-63.1	-72.3	0	0	0	114.1	F221 D225 R232 L236 E257 A258 K259 N263 D264	F221-Y261 HydrophobicContact CE2-CE2 4.49Å; F221-Y261 AromaticContact CZ-CD2 3.93Å; F221-Y261 HydrophobicContact CZ-CD2 3.93Å; F221-Y261 AromaticContact CZ-CE2 3.92Å; F221-Y261 HydrophobicContact CZ-CE2 3.92Å; D225-Y261 WeakPolarHBondContact OD1-CE2 3.3Å; D225-Y261 PolarHBondContact OD1-OH 3.33Å; R232-Y261 WeakPolarHBondContact CD-OH 3.33Å; R232-Y261 VanDerWaalsContact NE-CE1 3.31Å; R232-Y261 PolarHBondContact NE-OH 3.45Å; L236-Y261 HydrophobicContact CD2-CD2 4.42Å; L236-Y261 HydrophobicContact CD2-CG 4.13Å; E257-Y261 VanDerWaalsContact O-CD2 3.26Å; E257-Y261 WeakPolarHBondContact O-CD2 3.5Å; E257-Y261 VanDerWaalsContact O-CE2 3.3Å; E257-Y261 WeakPolarHBondContact O-CE2 3.38Å; A258-Y261 WeakPolarHBondContact O-CB 3.48Å; A258-Y261 PolarHBondContact O-N 2.87Å; K259-Y261 PolarHBondContact O-N 3.35Å; Y261-N263 PolarHBondContact O-N 2.9Å; Y261-D264 WeakPolarHBondContact O-CB 3.46Å; Y261-D264 PolarHBondContact O-N 2.92Å; Y261-D264 VanDerWaalsContact O-N 3.12Å
262	K	81.6	Confident	83.2	Confident	89 Å²	89	59.3 Å²	59.3	39%	0.387	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-58.3	-33.2	-175.4	-171.9	177.9	179.3	175.7	0	113.9	K259 P260 T271	K259-K262 WeakPolarHBondContact O-CB 3.4Å; K259-K262 PolarHBondContact O-N 3.18Å; P260-K262 VanDerWaalsContact C-N 3.32Å; P260-K262 PolarHBondContact O-N 3.01Å; K262-T271 HydrophobicContact CD-CG2 4.29Å; K262-T271 HydrophobicContact CG-CG2 3.7Å
263	N	83.1	Confident	83.8	Confident	137 Å²	137	58.9 Å²	58.9	73%	0.733	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-95.3	-0.4	-176.5	-62.1	-29.8	0	0	0	113.3	Y261	Y261-N263 PolarHBondContact O-N 2.9Å
264	D	85.1	Confident	84.2	Confident	49 Å²	49	58.8 Å²	58.8	26%	0.262	31%	0.305	S	S	.	.			trans	-66.3	127.5	176.8	-172.3	-42	0	0	0	109.2	Y261 E266 I267 L268	Y261-D264 WeakPolarHBondContact O-CB 3.46Å; Y261-D264 PolarHBondContact O-N 2.92Å; Y261-D264 VanDerWaalsContact O-N 3.12Å; D264-E266 PolarHBondContact O-N 3.33Å; D264-E266 VanDerWaalsContact O-N 3.11Å; D264-E266 PolarHBondContact OD1-N 3.04Å; D264-I267 HydrophobicContact CB-CB 4.17Å; D264-I267 HydrophobicContact CB-CG1 4.18Å; D264-I267 CarbonylContact O-C 3.54Å; D264-I267 PolarHBondContact O-N 3.22Å; D264-L268 WeakPolarHBondContact O-CB 3.1Å; D264-L268 PolarHBondContact O-N 3.04Å
265	P	81.4	Confident	84.6	Confident	103 Å²	103	55.6 Å²	55.6	67%	0.669	29%	0.291	S	S	*	.	H	α-helix	trans	-56.7	-27.4	-178.5	23.2	-34.7	0	0	0	113.6
266	E	80.8	Confident	85	Confident	75 Å²	75	54.5 Å²	54.5	35%	0.35	28%	0.284	S	S	.	.	H	α-helix	trans	-77.1	-28.5	178.3	-153.1	-171.5	156.2	0	0	112.6	K237 D264	K237-E266 IonicContact NZ-OE1 2.73Å; K237-E266 PolarHBondContact NZ-OE1 3.02Å; D264-E266 PolarHBondContact O-N 3.33Å; D264-E266 VanDerWaalsContact O-N 3.11Å; D264-E266 PolarHBondContact OD1-N 3.04Å
267	I	86.5	Confident	85.4	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-98.6	-23.2	-177.3	-59.2	-60.3	0	0	0	112	L236 K237 F253 D264 A269 M270 T271	L236-I267 HydrophobicContact CB-CD1 4.32Å; L236-I267 HydrophobicContact CD2-CD1 4.1Å; L236-I267 HydrophobicContact CD2-CG1 4.21Å; L236-I267 HydrophobicContact CD2-CG2 4.01Å; L236-I267 HydrophobicContact CG-CD1 4.39Å; K237-I267 HydrophobicContact CG-CD1 4.15Å; F253-I267 HydrophobicContact CE1-CG2 3.4Å; F253-I267 VanDerWaalsContact CE1-CG2 3.4Å; F253-I267 HydrophobicContact CZ-CG2 3.49Å; F253-I267 VanDerWaalsContact CZ-CG2 3.49Å; D264-I267 HydrophobicContact CB-CB 4.17Å; D264-I267 HydrophobicContact CB-CG1 4.18Å; D264-I267 CarbonylContact O-C 3.54Å; D264-I267 PolarHBondContact O-N 3.22Å; I267-A269 PolarHBondContact O-N 3.49Å; I267-A269 VanDerWaalsContact O-N 3.11Å; I267-M270 WeakPolarHBondContact O-CA 3.31Å; I267-M270 WeakPolarHBondContact O-CB 3.43Å; I267-M270 PolarHBondContact O-N 3.35Å; I267-T271 PolarHBondContact O-N 3.32Å; I267-T271 PolarHBondContact O-OG1 3.23Å
268	L	88	Confident	85.8	Confident	73 Å²	73	47.8 Å²	47.8	38%	0.382	25%	0.252	S	S	.	.	H	α-helix	trans	-54	-36	-179.7	-173.2	66.6	0	0	0	112.1	D264 M270 T271 N272	D264-L268 WeakPolarHBondContact O-CB 3.1Å; D264-L268 PolarHBondContact O-N 3.04Å; L268-M270 VanDerWaalsContact C-N 3.35Å; L268-M270 PolarHBondContact O-N 3.26Å; L268-T271 WeakPolarHBondContact O-CB 3.44Å; L268-T271 PolarHBondContact O-N 2.5Å; L268-N272 WeakPolarHBondContact O-CB 3.29Å; L268-N272 PolarHBondContact O-N 3.46Å; L268-N272 PolarHBondContact O-ND2 3.48Å
269	A	88.1	Confident	86.1	Confident	2 Å²	2	53.7 Å²	53.7	2%	0.017	28%	0.284	C	S	.	.	H	α-helix	trans	-60	-43.3	174.3	0	0	0	0	0	112.1	I267 N272 L273 N292 I296	I267-A269 PolarHBondContact O-N 3.49Å; I267-A269 VanDerWaalsContact O-N 3.11Å; A269-N272 PolarHBondContact O-N 3.17Å; A269-L273 WeakPolarHBondContact O-CG 3.43Å; A269-L273 PolarHBondContact O-N 3.37Å; A269-N292 HydrophobicContact CB-CB 3.75Å; A269-I296 HydrophobicContact CB-CD1 3.95Å; A269-I296 HydrophobicContact CB-CG1 4.37Å
270	M	88.6	Confident	86.2	Confident	3 Å²	3	49 Å²	49	2%	0.015	27%	0.265	C	S	.	.	H	α-helix	trans	-69.4	-39.7	175.9	-63.3	-59	-67.9	0	0	112	K237 V240 M244 I267 L268 N272 L273 V274 I296	K237-M270 HydrophobicContact CB-CE 4.41Å; K237-M270 HydrophobicContact CB-CG 4.28Å; K237-M270 HydrophobicContact CB-SD 4.48Å; K237-M270 HydrophobicContact CG-CG 3.87Å; K237-M270 HydrophobicContact CG-SD 4.5Å; K237-M270 WeakPolarHBondContact O-CE 3.3Å; V240-M270 HydrophobicContact CB-CE 3.89Å; V240-M270 HydrophobicContact CG1-CB 4.18Å; V240-M270 HydrophobicContact CG1-CE 3.74Å; M244-M270 HydrophobicContact CE-CE 4.09Å; I267-M270 WeakPolarHBondContact O-CA 3.31Å; I267-M270 WeakPolarHBondContact O-CB 3.43Å; I267-M270 PolarHBondContact O-N 3.35Å; L268-M270 VanDerWaalsContact C-N 3.35Å; L268-M270 PolarHBondContact O-N 3.26Å; M270-N272 VanDerWaalsContact C-N 3.3Å; M270-N272 PolarHBondContact O-N 3.15Å; M270-L273 PolarHBondContact O-N 3.04Å; M270-L273 HydrophobicContact SD-CD1 4.04Å; M270-V274 WeakPolarHBondContact O-CG2 3.39Å; M270-V274 PolarHBondContact O-N 3.06Å; M270-I296 HydrophobicContact SD-CG1 4.37Å
271	T	88.7	Confident	86.2	Confident	10 Å²	10	47.7 Å²	47.7	6%	0.061	25%	0.253	C	S	.	.	H	α-helix	trans	-56.7	-46.4	174	-55.6	0	0	0	0	111.2	F253 K262 I267 L268 V274 S275	F253-T271 HydrophobicContact CD2-CG2 4.42Å; K262-T271 HydrophobicContact CD-CG2 4.29Å; K262-T271 HydrophobicContact CG-CG2 3.7Å; I267-T271 PolarHBondContact O-N 3.32Å; I267-T271 PolarHBondContact O-OG1 3.23Å; L268-T271 WeakPolarHBondContact O-CB 3.44Å; L268-T271 PolarHBondContact O-N 2.5Å; T271-V274 PolarHBondContact O-N 3.3Å; T271-S275 PolarHBondContact O-N 2.99Å; T271-S275 VanDerWaalsContact O-N 3.08Å
272	N	88.7	Confident	86.4	Confident	60 Å²	60	46.7 Å²	46.7	32%	0.321	25%	0.25	S	S	.	.	H	α-helix	trans	-66.1	-41	178.7	-67.1	-20.5	0	0	0	111.1	L268 A269 M270 V274 S275 A276 I288	L268-N272 WeakPolarHBondContact O-CB 3.29Å; L268-N272 PolarHBondContact O-N 3.46Å; L268-N272 PolarHBondContact O-ND2 3.48Å; A269-N272 PolarHBondContact O-N 3.17Å; M270-N272 VanDerWaalsContact C-N 3.3Å; M270-N272 PolarHBondContact O-N 3.15Å; N272-V274 PolarHBondContact O-N 3Å; N272-S275 PolarHBondContact O-N 3.23Å; N272-S275 PolarHBondContact O-OG 3.49Å; N272-A276 PolarHBondContact O-N 3.12Å; N272-I288 HydrophobicContact CB-CD1 3.72Å; N272-I288 HydrophobicContact CB-CG1 4.21Å; N272-I288 HydrophobicContact CB-CG2 4.31Å
273	L	88.4	Confident	86.7	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-59	-45.2	174.9	-76.6	178	0	0	0	112.4	A269 M270 S275 A276 Y277 F285 I288 L289 I296	A269-L273 WeakPolarHBondContact O-CG 3.43Å; A269-L273 PolarHBondContact O-N 3.37Å; M270-L273 PolarHBondContact O-N 3.04Å; M270-L273 HydrophobicContact SD-CD1 4.04Å; L273-S275 VanDerWaalsContact C-N 3.31Å; L273-S275 PolarHBondContact O-N 3.46Å; L273-A276 PolarHBondContact O-N 3.02Å; L273-Y277 WeakPolarHBondContact O-CB 3.34Å; L273-Y277 PolarHBondContact O-N 3.4Å; L273-F285 HydrophobicContact CB-CE2 4.14Å; L273-F285 HydrophobicContact CD2-CD1 4.24Å; L273-F285 HydrophobicContact CD2-CD2 3.77Å; L273-F285 HydrophobicContact CD2-CE1 4.16Å; L273-F285 HydrophobicContact CD2-CE2 3.67Å; L273-F285 HydrophobicContact CD2-CG 4.07Å; L273-F285 HydrophobicContact CD2-CZ 3.87Å; L273-F285 HydrophobicContact CG-CE2 4.43Å; L273-I288 HydrophobicContact CD2-CB 3.97Å; L273-I288 HydrophobicContact CD2-CG2 3.68Å; L273-I288 HydrophobicContact CG-CG2 3.77Å; L273-L289 HydrophobicContact CD1-CD2 4.19Å; L273-L289 HydrophobicContact CD2-CD2 4.04Å; L273-L289 HydrophobicContact CD2-CG 4.1Å; L273-I296 HydrophobicContact CD1-CD1 3.66Å; L273-I296 HydrophobicContact CD1-CG1 4.44Å; L273-I296 HydrophobicContact CG-CD1 4.37Å
274	V	88.9	Confident	87	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.012	24%	0.237	C	C	.	.	H	α-helix	trans	-59.9	-43.9	176.3	173.1	0	0	0	0	110.7	V240 M244 P252 F253 M270 T271 N272 A276 Y277 Q278	V240-V274 HydrophobicContact CG1-CG2 3.15Å; M244-V274 HydrophobicContact CE-CG2 4.47Å; M244-V274 HydrophobicContact CG-CG2 4.22Å; M244-V274 HydrophobicContact SD-CG2 3.97Å; P252-V274 HydrophobicContact CG-CG2 4.4Å; F253-V274 HydrophobicContact CE2-CG2 4.43Å; M270-V274 WeakPolarHBondContact O-CG2 3.39Å; M270-V274 PolarHBondContact O-N 3.06Å; T271-V274 PolarHBondContact O-N 3.3Å; N272-V274 PolarHBondContact O-N 3Å; V274-A276 PolarHBondContact O-N 3.47Å; V274-Y277 WeakPolarHBondContact O-CB 3.49Å; V274-Y277 PolarHBondContact O-N 3.24Å; V274-Q278 HydrophobicContact CG1-CG 4.38Å; V274-Q278 WeakPolarHBondContact O-CG 3.26Å; V274-Q278 PolarHBondContact O-N 3.47Å
275	S	88	Confident	87.2	Confident	48 Å²	48	41 Å²	41	34%	0.336	23%	0.225	S	C	.	.	H	α-helix	trans	-64	-40.3	179.1	73.2	0	0	0	0	112.5	T271 N272 L273 Q278 N279	T271-S275 PolarHBondContact O-N 2.99Å; T271-S275 VanDerWaalsContact O-N 3.08Å; N272-S275 PolarHBondContact O-N 3.23Å; N272-S275 PolarHBondContact O-OG 3.49Å; L273-S275 VanDerWaalsContact C-N 3.31Å; L273-S275 PolarHBondContact O-N 3.46Å; S275-Q278 PolarHBondContact O-N 3.37Å; S275-N279 WeakPolarHBondContact O-CB 3.48Å; S275-N279 PolarHBondContact O-N 2.99Å; S275-N279 PolarHBondContact O-ND2 3.32Å; S275-N279 VanDerWaalsContact O-ND2 3.16Å
276	A	88.9	Confident	87.6	Confident	3 Å²	3	37.5 Å²	37.5	3%	0.025	20%	0.2	C	C	.	.	H	α-helix	trans	-66.9	-39	175	0	0	0	0	0	111.6	N272 L273 V274 N279 N280 D281 E284 F285 I288	N272-A276 PolarHBondContact O-N 3.12Å; L273-A276 PolarHBondContact O-N 3.02Å; V274-A276 PolarHBondContact O-N 3.47Å; A276-N279 PolarHBondContact O-N 2.93Å; A276-N280 PolarHBondContact O-N 3.2Å; A276-N280 VanDerWaalsContact O-N 3.08Å; A276-D281 PolarHBondContact O-N 3.31Å; A276-E284 HydrophobicContact CB-CB 4.38Å; A276-E284 HydrophobicContact CB-CG 4.5Å; A276-F285 HydrophobicContact CB-CB 4.08Å; A276-F285 HydrophobicContact CB-CD2 4.09Å; A276-I288 HydrophobicContact CB-CD1 4Å
277	Y	87.1	Confident	88.1	Confident	10 Å²	10	39.1 Å²	39.1	4%	0.039	21%	0.205	C	C	.	.	H	α-helix	trans	-61.3	-48.4	174.8	-172.2	-96.6	0	0	0	111.7	M244 L273 V274 N279 N280 I313	M244-Y277 HydrophobicContact CB-CD1 4.39Å; M244-Y277 HydrophobicContact CB-CE1 4.37Å; M244-Y277 HydrophobicContact CB-CG 4.48Å; M244-Y277 HydrophobicContact CG-CD1 4.19Å; M244-Y277 HydrophobicContact CG-CG 4.19Å; M244-Y277 VanDerWaalsContact O-CZ 3.27Å; M244-Y277 PolarHBondContact O-OH 3.48Å; M244-Y277 HydrophobicContact SD-CG 4.29Å; L273-Y277 WeakPolarHBondContact O-CB 3.34Å; L273-Y277 PolarHBondContact O-N 3.4Å; V274-Y277 WeakPolarHBondContact O-CB 3.49Å; V274-Y277 PolarHBondContact O-N 3.24Å; Y277-N279 VanDerWaalsContact C-N 3.32Å; Y277-N279 PolarHBondContact O-N 3.11Å; Y277-N280 PolarHBondContact O-N 2.99Å; Y277-I313 HydrophobicContact CD2-CD1 3.57Å; Y277-I313 HydrophobicContact CD2-CG1 3.28Å; Y277-I313 HydrophobicContact CE2-CD1 4.19Å; Y277-I313 HydrophobicContact CE2-CG1 3.45Å; Y277-I313 VanDerWaalsContact CE2-CG1 3.45Å; Y277-I313 HydrophobicContact CG-CG1 4.36Å
278	Q	85.9	Confident	88.3	Confident	71 Å²	71	39.4 Å²	39.4	33%	0.332	21%	0.207	S	C	.	.	H	α-helix	trans	-62.6	-38.1	178.3	-73.2	-180	-14	0	0	112.5	G249 V274 S275 N280	G249-Q278 PolarHBondContact O-NE2 2.96Å; V274-Q278 HydrophobicContact CG1-CG 4.38Å; V274-Q278 WeakPolarHBondContact O-CG 3.26Å; V274-Q278 PolarHBondContact O-N 3.47Å; S275-Q278 PolarHBondContact O-N 3.37Å; Q278-N280 PolarHBondContact O-N 3.01Å; Q278-N280 PolarHBondContact O-ND2 3.4Å
279	N	86.9	Confident	88.3	Confident	124 Å²	124	36.7 Å²	36.7	66%	0.663	19%	0.193	S	C	*	.	H	α-helix	trans	-77.4	-6.8	176.9	-69.5	-30.2	0	0	0	113.5	S275 A276 Y277 D281	S275-N279 WeakPolarHBondContact O-CB 3.48Å; S275-N279 PolarHBondContact O-N 2.99Å; S275-N279 PolarHBondContact O-ND2 3.32Å; S275-N279 VanDerWaalsContact O-ND2 3.16Å; A276-N279 PolarHBondContact O-N 2.93Å; Y277-N279 VanDerWaalsContact C-N 3.32Å; Y277-N279 PolarHBondContact O-N 3.11Å; N279-D281 PolarHBondContact O-N 2.77Å
280	N	86.2	Confident	88.2	Confident	45 Å²	45	44.2 Å²	44.2	24%	0.241	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	37.9	-172.9	-63.9	-79.3	0	0	0	112.8	A276 Y277 Q278 Q316 V317	A276-N280 PolarHBondContact O-N 3.2Å; A276-N280 VanDerWaalsContact O-N 3.08Å; Y277-N280 PolarHBondContact O-N 2.99Å; Q278-N280 PolarHBondContact O-N 3.01Å; Q278-N280 PolarHBondContact O-ND2 3.4Å; N280-Q316 WeakPolarHBondContact OD1-CB 3.27Å; N280-Q316 PolarHBondContact OD1-OE1 3.06Å; N280-V317 HydrophobicContact CB-CG2 3.87Å; N280-V317 WeakPolarHBondContact O-CG2 3.24Å
281	D	87.1	Confident	88.3	Confident	64 Å²	64	49 Å²	49	34%	0.342	26%	0.255	S	S	.	.			trans	-98.8	103.5	179.5	-170.6	-21.7	0	0	0	110.7	A276 N279 T283 E284 F285	A276-D281 PolarHBondContact O-N 3.31Å; N279-D281 PolarHBondContact O-N 2.77Å; D281-T283 PolarHBondContact OD1-N 2.7Å; D281-T283 PolarHBondContact OD1-OG1 3.17Å; D281-E284 HydrophobicContact CB-CB 4.27Å; D281-E284 PolarHBondContact OD1-N 3.08Å; D281-F285 VanDerWaalsContact O-CB 3.3Å; D281-F285 WeakPolarHBondContact O-CB 3.36Å; D281-F285 PolarHBondContact O-N 2.91Å; D281-F285 VanDerWaalsContact O-N 3.17Å
282	I	86.2	Confident	88.2	Confident	11 Å²	11	50.4 Å²	50.4	6%	0.056	26%	0.262	C	S	.	.	H	α-helix	trans	-68.5	-37.4	-179.6	-57.6	159.6	0	0	0	110.8	F285 E286 I313 R314 V317 L337	I282-F285 PolarHBondContact O-N 3.38Å; I282-E286 HydrophobicContact CG2-CG 4.34Å; I282-E286 WeakPolarHBondContact O-CG 3.46Å; I282-E286 PolarHBondContact O-N 3.03Å; I282-I313 HydrophobicContact CG1-CG2 3.72Å; I282-R314 HydrophobicContact CD1-CG 3.93Å; I282-R314 HydrophobicContact CG1-CG 4.34Å; I282-V317 HydrophobicContact CD1-CB 3.92Å; I282-V317 HydrophobicContact CD1-CG1 4Å; I282-V317 HydrophobicContact CD1-CG2 3.83Å; I282-V317 HydrophobicContact CG1-CG2 4.03Å; I282-L337 HydrophobicContact CD1-CD2 3.52Å
283	T	87.9	Confident	87.9	Confident	86 Å²	86	52.3 Å²	52.3	53%	0.528	27%	0.268	S	S	.	.	H	α-helix	trans	-69.7	-43.3	-173.7	63.2	0	0	0	0	111.3	D281 K287	D281-T283 PolarHBondContact OD1-N 2.7Å; D281-T283 PolarHBondContact OD1-OG1 3.17Å; T283-K287 VanDerWaalsContact O-CB 3.25Å; T283-K287 WeakPolarHBondContact O-CB 3.47Å; T283-K287 PolarHBondContact O-N 3.33Å
284	E	90.5	Very high	87.6	Confident	69 Å²	69	55.4 Å²	55.4	32%	0.322	29%	0.29	S	S	.	.	H	α-helix	trans	-69.1	-38.7	175.4	-166.4	60.9	-153.8	0	0	110.6	A276 D281 E286 K287 I288	A276-E284 HydrophobicContact CB-CB 4.38Å; A276-E284 HydrophobicContact CB-CG 4.5Å; D281-E284 HydrophobicContact CB-CB 4.27Å; D281-E284 PolarHBondContact OD1-N 3.08Å; E284-E286 PolarHBondContact O-N 3.15Å; E284-K287 VanDerWaalsContact CD-NZ 3.33Å; E284-K287 PolarHBondContact O-N 3.33Å; E284-K287 IonicContact OE1-NZ 3.35Å; E284-K287 PolarHBondContact OE1-NZ 3.14Å; E284-K287 IonicContact OE2-NZ 3.41Å; E284-K287 PolarHBondContact OE2-NZ 3.05Å; E284-I288 HydrophobicContact CG-CD1 3.92Å; E284-I288 HydrophobicContact CG-CG1 4.39Å; E284-I288 WeakPolarHBondContact O-CD1 3.07Å; E284-I288 WeakPolarHBondContact O-CG1 3.47Å; E284-I288 PolarHBondContact O-N 3.42Å
285	F	89.3	Confident	87.1	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-59.7	-48.6	176.2	-164	-86.4	0	0	0	112	L273 A276 D281 I282 K287 I288 L289 L309 L310 I313	L273-F285 HydrophobicContact CB-CE2 4.14Å; L273-F285 HydrophobicContact CD2-CD1 4.24Å; L273-F285 HydrophobicContact CD2-CD2 3.77Å; L273-F285 HydrophobicContact CD2-CE1 4.16Å; L273-F285 HydrophobicContact CD2-CE2 3.67Å; L273-F285 HydrophobicContact CD2-CG 4.07Å; L273-F285 HydrophobicContact CD2-CZ 3.87Å; L273-F285 HydrophobicContact CG-CE2 4.43Å; A276-F285 HydrophobicContact CB-CB 4.08Å; A276-F285 HydrophobicContact CB-CD2 4.09Å; D281-F285 VanDerWaalsContact O-CB 3.3Å; D281-F285 WeakPolarHBondContact O-CB 3.36Å; D281-F285 PolarHBondContact O-N 2.91Å; D281-F285 VanDerWaalsContact O-N 3.17Å; I282-F285 PolarHBondContact O-N 3.38Å; F285-K287 VanDerWaalsContact C-N 3.35Å; F285-K287 PolarHBondContact O-N 2.95Å; F285-I288 PolarHBondContact O-N 2.94Å; F285-L289 HydrophobicContact CD1-CD1 3.88Å; F285-L289 HydrophobicContact CD1-CG 4.38Å; F285-L289 HydrophobicContact CE1-CD1 3.74Å; F285-L289 HydrophobicContact CE1-CG 4.32Å; F285-L289 WeakPolarHBondContact O-CG 3.31Å; F285-L289 PolarHBondContact O-N 3.07Å; F285-L289 VanDerWaalsContact O-N 3.13Å; F285-L309 HydrophobicContact CZ-CB 4.27Å; F285-L309 HydrophobicContact CZ-CD2 4.16Å; F285-L310 HydrophobicContact CD1-CD2 3.62Å; F285-L310 HydrophobicContact CD1-CG 4.35Å; F285-L310 HydrophobicContact CE1-CD2 3.9Å; F285-L310 HydrophobicContact CE1-CG 4.12Å; F285-I313 HydrophobicContact CB-CD1 4.28Å; F285-I313 HydrophobicContact CD1-CD1 3.95Å; F285-I313 HydrophobicContact CD2-CD1 3.48Å; F285-I313 VanDerWaalsContact CD2-CD1 3.48Å; F285-I313 HydrophobicContact CE1-CD1 4.09Å; F285-I313 HydrophobicContact CE2-CD1 3.65Å; F285-I313 HydrophobicContact CG-CD1 3.64Å; F285-I313 HydrophobicContact CZ-CD1 3.95Å
286	E	88.5	Confident	86.8	Confident	30 Å²	30	55.9 Å²	55.9	14%	0.14	29%	0.289	C	S	.	.	H	α-helix	trans	-64.9	-37.3	176.6	-73.3	-177.3	172	0	0	112.5	I282 E284 L289 K290 L310 R314 N338	I282-E286 HydrophobicContact CG2-CG 4.34Å; I282-E286 WeakPolarHBondContact O-CG 3.46Å; I282-E286 PolarHBondContact O-N 3.03Å; E284-E286 PolarHBondContact O-N 3.15Å; E286-L289 PolarHBondContact O-N 3.25Å; E286-K290 WeakPolarHBondContact O-CG 3.5Å; E286-K290 PolarHBondContact O-N 3.26Å; E286-L310 HydrophobicContact CG-CD2 4.19Å; E286-R314 IonicContact OE1-CZ 3.66Å; E286-R314 IonicContact OE1-NH2 3.96Å; E286-R314 PolarHBondContact OE1-NH2 3.34Å; E286-N338 PolarHBondContact OE2-ND2 3.48Å; E286-N338 VanDerWaalsContact OE2-ND2 3.12Å
287	K	91.3	Very high	86.4	Confident	108 Å²	108	57.6 Å²	57.6	47%	0.47	30%	0.297	S	S	.	.	H	α-helix	trans	-63.9	-44.8	175.8	177.4	178	152.1	-132.9	0	111.4	T283 E284 F285 L289 K290 T291	T283-K287 VanDerWaalsContact O-CB 3.25Å; T283-K287 WeakPolarHBondContact O-CB 3.47Å; T283-K287 PolarHBondContact O-N 3.33Å; E284-K287 VanDerWaalsContact CD-NZ 3.33Å; E284-K287 PolarHBondContact O-N 3.33Å; E284-K287 IonicContact OE1-NZ 3.35Å; E284-K287 PolarHBondContact OE1-NZ 3.14Å; E284-K287 IonicContact OE2-NZ 3.41Å; E284-K287 PolarHBondContact OE2-NZ 3.05Å; F285-K287 VanDerWaalsContact C-N 3.35Å; F285-K287 PolarHBondContact O-N 2.95Å; K287-L289 VanDerWaalsContact C-N 3.32Å; K287-L289 PolarHBondContact O-N 3.43Å; K287-K290 PolarHBondContact O-N 3.48Å; K287-T291 PolarHBondContact O-N 2.92Å; K287-T291 PolarHBondContact O-OG1 3.42Å; K287-T291 VanDerWaalsContact O-OG1 3.12Å
288	I	90.6	Very high	86.4	Confident	8 Å²	8	62 Å²	62	4%	0.041	32%	0.321	C	S	.	.	H	α-helix	trans	-61.2	-42.4	177.5	-66.9	158.4	0	0	0	110.8	N272 L273 A276 E284 F285 K290 T291 N292	N272-I288 HydrophobicContact CB-CD1 3.72Å; N272-I288 HydrophobicContact CB-CG1 4.21Å; N272-I288 HydrophobicContact CB-CG2 4.31Å; L273-I288 HydrophobicContact CD2-CB 3.97Å; L273-I288 HydrophobicContact CD2-CG2 3.68Å; L273-I288 HydrophobicContact CG-CG2 3.77Å; A276-I288 HydrophobicContact CB-CD1 4Å; E284-I288 HydrophobicContact CG-CD1 3.92Å; E284-I288 HydrophobicContact CG-CG1 4.39Å; E284-I288 WeakPolarHBondContact O-CD1 3.07Å; E284-I288 WeakPolarHBondContact O-CG1 3.47Å; E284-I288 PolarHBondContact O-N 3.42Å; F285-I288 PolarHBondContact O-N 2.94Å; I288-K290 VanDerWaalsContact C-N 3.35Å; I288-K290 PolarHBondContact O-N 3.46Å; I288-T291 PolarHBondContact O-N 3.04Å; I288-N292 WeakPolarHBondContact O-CB 3.43Å; I288-N292 PolarHBondContact O-N 2.93Å; I288-N292 PolarHBondContact O-ND2 3.35Å
289	L	87.8	Confident	86.4	Confident	15 Å²	15	60.1 Å²	60.1	8%	0.079	31%	0.313	C	S	.	.	H	α-helix	trans	-62.3	-39.5	175.6	-70.9	177.2	0	0	0	112.5	L273 F285 E286 K287 H293 I296 I306 L310	L273-L289 HydrophobicContact CD1-CD2 4.19Å; L273-L289 HydrophobicContact CD2-CD2 4.04Å; L273-L289 HydrophobicContact CD2-CG 4.1Å; F285-L289 HydrophobicContact CD1-CD1 3.88Å; F285-L289 HydrophobicContact CD1-CG 4.38Å; F285-L289 HydrophobicContact CE1-CD1 3.74Å; F285-L289 HydrophobicContact CE1-CG 4.32Å; F285-L289 WeakPolarHBondContact O-CG 3.31Å; F285-L289 PolarHBondContact O-N 3.07Å; F285-L289 VanDerWaalsContact O-N 3.13Å; E286-L289 PolarHBondContact O-N 3.25Å; K287-L289 VanDerWaalsContact C-N 3.32Å; K287-L289 PolarHBondContact O-N 3.43Å; L289-H293 WeakPolarHBondContact O-CA 3.39Å; L289-H293 PolarHBondContact O-N 2.9Å; L289-I296 HydrophobicContact CD2-CD1 4.19Å; L289-I296 HydrophobicContact CD2-CG2 3.92Å; L289-I306 HydrophobicContact CD1-CG1 4Å; L289-I306 HydrophobicContact CD2-CD1 3.97Å; L289-I306 HydrophobicContact CD2-CG1 3.95Å; L289-L310 HydrophobicContact CD1-CD1 4.42Å
290	K	87.9	Confident	86.2	Confident	161 Å²	161	58.8 Å²	58.8	70%	0.7	31%	0.312	S	S	*	.	H	α-helix	trans	-69.2	-42.6	176.5	-76.2	176.6	-179.8	170.4	0	112.5	E286 K287 I288	E286-K290 WeakPolarHBondContact O-CG 3.5Å; E286-K290 PolarHBondContact O-N 3.26Å; K287-K290 PolarHBondContact O-N 3.48Å; I288-K290 VanDerWaalsContact C-N 3.35Å; I288-K290 PolarHBondContact O-N 3.46Å
291	T	89.2	Confident	86.1	Confident	103 Å²	103	57.6 Å²	57.6	63%	0.632	30%	0.304	S	S	*	.	H	α-helix	trans	-70.8	-40.1	-178.6	-59.5	0	0	0	0	112.2	K287 I288	K287-T291 PolarHBondContact O-N 2.92Å; K287-T291 PolarHBondContact O-OG1 3.42Å; K287-T291 VanDerWaalsContact O-OG1 3.12Å; I288-T291 PolarHBondContact O-N 3.04Å
292	N	86.5	Confident	86.1	Confident	40 Å²	40	54.6 Å²	54.6	21%	0.214	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	34.3	-175.6	-59.4	-73.2	0	0	0	112.5	A269 I288 S294 N295 I296	A269-N292 HydrophobicContact CB-CB 3.75Å; I288-N292 WeakPolarHBondContact O-CB 3.43Å; I288-N292 PolarHBondContact O-N 2.93Å; I288-N292 PolarHBondContact O-ND2 3.35Å; N292-S294 VanDerWaalsContact C-N 3.32Å; N292-S294 PolarHBondContact O-N 3.02Å; N292-N295 PolarHBondContact O-N 3.48Å; N292-N295 VanDerWaalsContact O-N 3.1Å; N292-I296 HydrophobicContact CB-CD1 4.02Å; N292-I296 PolarHBondContact O-N 3.05Å
293	H	82.5	Confident	86.1	Confident	99 Å²	99	59.9 Å²	59.9	46%	0.458	31%	0.307	S	S	.	.	H	α-helix	trans	-54.8	-44.7	-173	-173.9	-73.8	0	0	0	112.6	L289 N295 I296 M297	L289-H293 WeakPolarHBondContact O-CA 3.39Å; L289-H293 PolarHBondContact O-N 2.9Å; H293-N295 VanDerWaalsContact C-N 3.32Å; H293-N295 PolarHBondContact O-N 3.35Å; H293-I296 PolarHBondContact O-N 3.06Å; H293-M297 WeakPolarHBondContact O-CA 3.47Å; H293-M297 VanDerWaalsContact O-CB 3.25Å; H293-M297 WeakPolarHBondContact O-CB 3.32Å; H293-M297 PolarHBondContact O-N 2.56Å
294	S	81.9	Confident	86	Confident	66 Å²	66	60.6 Å²	60.6	46%	0.462	31%	0.305	S	S	.	.	H	α-helix	trans	-62.2	-35.8	179.6	55.2	0	0	0	0	113.3	N292 D298	N292-S294 VanDerWaalsContact C-N 3.32Å; N292-S294 PolarHBondContact O-N 3.02Å; S294-D298 WeakPolarHBondContact O-CB 3.44Å
295	N	79.4	Confident	85.9	Confident	58 Å²	58	57.8 Å²	57.8	31%	0.31	29%	0.292	S	S	.	.	H	α-helix	trans	-81.7	-21.3	-172.9	-65.6	-13.4	0	0	0	113.4	K237 N292 H293	K237-N295 PolarHBondContact NZ-O 3.07Å; N292-N295 PolarHBondContact O-N 3.48Å; N292-N295 VanDerWaalsContact O-N 3.1Å; H293-N295 VanDerWaalsContact C-N 3.32Å; H293-N295 PolarHBondContact O-N 3.35Å
296	I	81.3	Confident	85.8	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-112.8	-50.2	-173.6	-62.7	161.7	0	0	0	110.9	A269 M270 L273 L289 N292 H293 I302 I306	A269-I296 HydrophobicContact CB-CD1 3.95Å; A269-I296 HydrophobicContact CB-CG1 4.37Å; M270-I296 HydrophobicContact SD-CG1 4.37Å; L273-I296 HydrophobicContact CD1-CD1 3.66Å; L273-I296 HydrophobicContact CD1-CG1 4.44Å; L273-I296 HydrophobicContact CG-CD1 4.37Å; L289-I296 HydrophobicContact CD2-CD1 4.19Å; L289-I296 HydrophobicContact CD2-CG2 3.92Å; N292-I296 HydrophobicContact CB-CD1 4.02Å; N292-I296 PolarHBondContact O-N 3.05Å; H293-I296 PolarHBondContact O-N 3.06Å; I296-I302 HydrophobicContact CG2-CG2 3.92Å; I296-I306 HydrophobicContact CG2-CD1 4.42Å
297	M	81.4	Confident	85.6	Confident	40 Å²	40	62.1 Å²	62.1	20%	0.197	31%	0.312	C	S	.	.	H	α-helix	trans	-81.1	-20.6	-171.6	-61.4	-65.6	-108.4	0	0	112.5	H293 D299 R303 I306	H293-M297 WeakPolarHBondContact O-CA 3.47Å; H293-M297 VanDerWaalsContact O-CB 3.25Å; H293-M297 WeakPolarHBondContact O-CB 3.32Å; H293-M297 PolarHBondContact O-N 2.56Å; M297-D299 PolarHBondContact O-N 2.79Å; M297-R303 PolarHBondContact O-NE 3.28Å; M297-R303 PolarHBondContact O-NH2 3.38Å; M297-R303 HydrophobicContact SD-CG 4.28Å; M297-I306 HydrophobicContact CE-CG2 4.46Å; M297-I306 HydrophobicContact SD-CG2 4.37Å
298	D	85.8	Confident	85.3	Confident	103 Å²	103	60 Å²	60	55%	0.551	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-24.1	177.4	-70.3	-6.6	0	0	0	112.1	S294 P300	S294-D298 WeakPolarHBondContact O-CB 3.44Å; D298-P300 VanDerWaalsContact O-CD 3.29Å; D298-P300 WeakPolarHBondContact O-CD 3.17Å
299	D	85.4	Confident	85.2	Confident	30 Å²	30	59.6 Å²	59.6	16%	0.16	30%	0.302	C	S	.	.	S	Bend	trans	-79	114.6	172.4	-170.3	-48.6	0	0	0	110.5	Y238 M297 F301 I302 R303	Y238-D299 VanDerWaalsContact CE1-OD2 3.27Å; Y238-D299 WeakPolarHBondContact CE1-OD2 3.31Å; Y238-D299 PolarHBondContact OH-OD2 2.81Å; M297-D299 PolarHBondContact O-N 2.79Å; D299-F301 VanDerWaalsContact C-N 3.27Å; D299-F301 PolarHBondContact O-N 3.25Å; D299-F301 WeakPolarHBondContact OD1-CA 3.35Å; D299-F301 VanDerWaalsContact OD1-CB 3.24Å; D299-F301 WeakPolarHBondContact OD1-CB 3.17Å; D299-F301 PolarHBondContact OD1-N 3.46Å; D299-I302 HydrophobicContact CB-CB 4.17Å; D299-I302 HydrophobicContact CB-CD1 3.85Å; D299-I302 HydrophobicContact CB-CG1 3.92Å; D299-I302 PolarHBondContact O-N 3.37Å; D299-I302 PolarHBondContact OD1-N 3.03Å; D299-R303 WeakPolarHBondContact O-CB 3.11Å; D299-R303 PolarHBondContact O-N 3.41Å; D299-R303 VanDerWaalsContact O-N 3.15Å
300	P	83.3	Confident	85.2	Confident	97 Å²	97	60 Å²	60	63%	0.63	30%	0.304	S	S	*	.	H	α-helix	trans	-63.5	-31.6	-179.1	-20.9	33.5	0	0	0	113.6	D298 E304	D298-P300 VanDerWaalsContact O-CD 3.29Å; D298-P300 WeakPolarHBondContact O-CD 3.17Å; P300-E304 PolarHBondContact O-N 2.93Å
301	F	84.2	Confident	85.2	Confident	20 Å²	20	57.4 Å²	57.4	9%	0.088	29%	0.29	C	S	.	.	H	α-helix	trans	-72	-44.5	-178.5	178.9	-99.2	0	0	0	110.7	K202 L205 R206 F217 Y238 L241 D299 R303 E304 H305	K202-F301 HydrophobicContact CB-CE2 3.77Å; K202-F301 HydrophobicContact CB-CZ 3.89Å; K202-F301 HydrophobicContact CG-CD1 4.39Å; K202-F301 HydrophobicContact CG-CD2 4.19Å; K202-F301 HydrophobicContact CG-CE1 3.95Å; K202-F301 HydrophobicContact CG-CE2 3.73Å; K202-F301 HydrophobicContact CG-CG 4.5Å; K202-F301 HydrophobicContact CG-CZ 3.59Å; L205-F301 HydrophobicContact CB-CZ 3.88Å; L205-F301 HydrophobicContact CD2-CE1 3.6Å; L205-F301 HydrophobicContact CD2-CE2 4.37Å; L205-F301 HydrophobicContact CD2-CZ 3.35Å; L205-F301 HydrophobicContact CG-CZ 4.23Å; R206-F301 HydrophobicContact CG-CE2 4.49Å; F217-F301 HydrophobicContact CZ-CE1 4.3Å; F217-F301 HydrophobicContact CZ-CZ 4.4Å; Y238-F301 AromaticContact CD1-CD1 3.66Å; Y238-F301 HydrophobicContact CD1-CD1 3.66Å; Y238-F301 AromaticContact CD1-CE1 3.97Å; Y238-F301 HydrophobicContact CD1-CE1 3.97Å; Y238-F301 HydrophobicContact CE1-CB 4.49Å; Y238-F301 AromaticContact CE1-CD1 3.6Å; Y238-F301 HydrophobicContact CE1-CD1 3.6Å; Y238-F301 HydrophobicContact CE1-CE1 4.33Å; Y238-F301 HydrophobicContact CE1-CG 4.45Å; Y238-F301 HydrophobicContact CG-CD1 4.42Å; Y238-F301 HydrophobicContact CG-CE1 4.37Å; L241-F301 HydrophobicContact CD2-CE1 4.34Å; D299-F301 VanDerWaalsContact C-N 3.27Å; D299-F301 PolarHBondContact O-N 3.25Å; D299-F301 WeakPolarHBondContact OD1-CA 3.35Å; D299-F301 VanDerWaalsContact OD1-CB 3.24Å; D299-F301 WeakPolarHBondContact OD1-CB 3.17Å; D299-F301 PolarHBondContact OD1-N 3.46Å; F301-R303 VanDerWaalsContact C-N 3.3Å; F301-R303 PolarHBondContact O-N 3.46Å; F301-E304 PolarHBondContact O-N 2.91Å; F301-H305 AromaticContact CE2-NE2 3.86Å; F301-H305 PolarHBondContact O-CD2 2.96Å; F301-H305 VanDerWaalsContact O-CD2 3.3Å
302	I	86.3	Confident	85	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-63.5	-40.7	176.4	-58	178.2	0	0	0	110.6	K237 Y238 L241 I296 D299 E304 H305 I306	K237-I302 HydrophobicContact CB-CD1 3.97Å; K237-I302 HydrophobicContact CD-CD1 4.3Å; Y238-I302 HydrophobicContact CD1-CD1 4.34Å; Y238-I302 HydrophobicContact CD1-CG1 4.02Å; Y238-I302 HydrophobicContact CE1-CD1 4.12Å; Y238-I302 HydrophobicContact CE1-CG1 3.81Å; L241-I302 HydrophobicContact CD1-CG2 4.48Å; L241-I302 HydrophobicContact CD2-CB 4.48Å; L241-I302 HydrophobicContact CD2-CG1 4.34Å; L241-I302 HydrophobicContact CD2-CG2 4.4Å; I296-I302 HydrophobicContact CG2-CG2 3.92Å; D299-I302 HydrophobicContact CB-CB 4.17Å; D299-I302 HydrophobicContact CB-CD1 3.85Å; D299-I302 HydrophobicContact CB-CG1 3.92Å; D299-I302 PolarHBondContact O-N 3.37Å; D299-I302 PolarHBondContact OD1-N 3.03Å; I302-E304 VanDerWaalsContact C-N 3.31Å; I302-E304 PolarHBondContact O-N 3.1Å; I302-H305 PolarHBondContact O-N 3.02Å; I302-I306 HydrophobicContact CG2-CD1 4.34Å; I302-I306 PolarHBondContact O-N 2.98Å
303	R	86.2	Confident	85.1	Confident	122 Å²	122	51.7 Å²	51.7	46%	0.46	26%	0.255	S	S	.	.	H	α-helix	trans	-59.5	-38.8	-179.7	-166.1	-170.3	-56.5	170.4	2.3	113	M297 D299 F301 H305 I306	M297-R303 PolarHBondContact O-NE 3.28Å; M297-R303 PolarHBondContact O-NH2 3.38Å; M297-R303 HydrophobicContact SD-CG 4.28Å; D299-R303 WeakPolarHBondContact O-CB 3.11Å; D299-R303 PolarHBondContact O-N 3.41Å; D299-R303 VanDerWaalsContact O-N 3.15Å; F301-R303 VanDerWaalsContact C-N 3.3Å; F301-R303 PolarHBondContact O-N 3.46Å; R303-H305 VanDerWaalsContact C-N 3.28Å; R303-H305 PolarHBondContact O-N 2.98Å; R303-I306 WeakPolarHBondContact O-CG2 3.5Å; R303-I306 PolarHBondContact O-N 2.68Å
304	E	86.8	Confident	85.4	Confident	101 Å²	101	49 Å²	49	47%	0.472	24%	0.241	S	C	.	.	H	α-helix	trans	-60.7	-38	179.1	-172.1	174.1	-179.4	0	0	112	R206 P300 F301 I302	R206-E304 IonicContact CZ-OE2 3.27Å; R206-E304 IonicContact NE-OE2 2.56Å; R206-E304 IonicContact NH2-OE1 2.71Å; R206-E304 IonicContact NH2-OE2 3.55Å; R206-E304 PolarHBondContact NH2-OE2 2.88Å; P300-E304 PolarHBondContact O-N 2.93Å; F301-E304 PolarHBondContact O-N 2.91Å; I302-E304 VanDerWaalsContact C-N 3.31Å; I302-E304 PolarHBondContact O-N 3.1Å
305	H	87.6	Confident	85.7	Confident	10 Å²	10	47.3 Å²	47.3	5%	0.046	23%	0.228	C	C	.	.	H	α-helix	trans	-92.6	-15.9	-176.7	-65.7	-73.3	0	0	0	114	L205 L241 L245 F301 I302 R303 E307 E308 L309	L205-H305 VanDerWaalsContact CD2-CD2 3.45Å; L205-H305 WeakPolarHBondContact CD2-CD2 3.5Å; L205-H305 WeakPolarHBondContact CD2-NE2 3.21Å; L241-H305 HydrophobicContact CD1-CB 4.28Å; L241-H305 HydrophobicContact CD2-CB 4.1Å; L241-H305 HydrophobicContact CG-CB 4.47Å; L245-H305 HydrophobicContact CD1-CB 4.13Å; F301-H305 AromaticContact CE2-NE2 3.86Å; F301-H305 PolarHBondContact O-CD2 2.96Å; F301-H305 VanDerWaalsContact O-CD2 3.3Å; I302-H305 PolarHBondContact O-N 3.02Å; R303-H305 VanDerWaalsContact C-N 3.28Å; R303-H305 PolarHBondContact O-N 2.98Å; H305-E307 PolarHBondContact O-N 3.39Å; H305-E308 IonicContact ND1-OE2 3.22Å; H305-E308 WeakPolarHBondContact O-CB 3.29Å; H305-E308 PolarHBondContact O-N 3.45Å; H305-L309 HydrophobicContact CB-CD1 4.43Å; H305-L309 WeakPolarHBondContact O-CD1 3.47Å; H305-L309 PolarHBondContact O-N 2.69Å; H305-L309 VanDerWaalsContact O-N 3.13Å
306	I	87.1	Confident	86.1	Confident	7 Å²	7	47.9 Å²	47.9	4%	0.036	23%	0.229	C	C	.	.	H	α-helix	trans	-61.5	-33.2	-176.8	-146.7	74.8	0	0	0	112.6	L289 I296 M297 I302 R303 E308 L309 L310	L289-I306 HydrophobicContact CD1-CG1 4Å; L289-I306 HydrophobicContact CD2-CD1 3.97Å; L289-I306 HydrophobicContact CD2-CG1 3.95Å; I296-I306 HydrophobicContact CG2-CD1 4.42Å; M297-I306 HydrophobicContact CE-CG2 4.46Å; M297-I306 HydrophobicContact SD-CG2 4.37Å; I302-I306 HydrophobicContact CG2-CD1 4.34Å; I302-I306 PolarHBondContact O-N 2.98Å; R303-I306 WeakPolarHBondContact O-CG2 3.5Å; R303-I306 PolarHBondContact O-N 2.68Å; I306-E308 VanDerWaalsContact C-N 3.32Å; I306-L309 PolarHBondContact O-N 2.73Å; I306-L310 PolarHBondContact O-N 3.39Å
307	E	84.3	Confident	86.4	Confident	114 Å²	114	49 Å²	49	53%	0.533	24%	0.236	S	C	.	.	H	α-helix	trans	-65.7	-37.9	176.3	-67.3	-170.4	-178.3	0	0	111.9	H305 L310 R311	H305-E307 PolarHBondContact O-N 3.39Å; E307-L310 PolarHBondContact O-N 3.05Å; E307-R311 WeakPolarHBondContact O-CG 3.48Å; E307-R311 PolarHBondContact O-N 2.83Å; E307-R311 IonicContact OE2-NH1 4Å; E307-R311 PolarHBondContact OE2-NH1 3.35Å; E307-R311 IonicContact OE2-NH2 2.75Å
308	E	86.6	Confident	86.9	Confident	62 Å²	62	47.1 Å²	47.1	29%	0.29	23%	0.226	S	C	.	.	H	α-helix	trans	-67.2	-39.9	176.7	-168.3	179	176	0	0	111.1	L245 H305 I306 R311 N312	L245-E308 HydrophobicContact CD2-CB 4.29Å; L245-E308 HydrophobicContact CD2-CG 4.12Å; H305-E308 IonicContact ND1-OE2 3.22Å; H305-E308 WeakPolarHBondContact O-CB 3.29Å; H305-E308 PolarHBondContact O-N 3.45Å; I306-E308 VanDerWaalsContact C-N 3.32Å; E308-R311 PolarHBondContact O-N 3.4Å; E308-N312 WeakPolarHBondContact O-CB 3.39Å; E308-N312 PolarHBondContact O-N 3.31Å; E308-N312 PolarHBondContact O-ND2 3.47Å
309	L	87.3	Confident	87	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.3	-47.2	172.4	-83.2	81.7	0	0	0	111.6	L241 M244 L245 F285 H305 I306 R311 N312 I313	L241-L309 HydrophobicContact CD1-CD1 3.56Å; L241-L309 HydrophobicContact CD1-CD2 4.01Å; L241-L309 HydrophobicContact CD1-CG 4.48Å; M244-L309 HydrophobicContact CB-CD2 3.63Å; M244-L309 HydrophobicContact CB-CG 4.36Å; M244-L309 HydrophobicContact CE-CD2 3.61Å; M244-L309 HydrophobicContact CG-CD2 4.3Å; M244-L309 HydrophobicContact SD-CD2 3.78Å; L245-L309 HydrophobicContact CD1-CD1 4.24Å; L245-L309 HydrophobicContact CD2-CD1 3.47Å; L245-L309 VanDerWaalsContact CD2-CD1 3.47Å; L245-L309 HydrophobicContact CD2-CG 4.28Å; L245-L309 HydrophobicContact CG-CD1 3.64Å; L245-L309 HydrophobicContact CG-CG 4.45Å; F285-L309 HydrophobicContact CZ-CB 4.27Å; F285-L309 HydrophobicContact CZ-CD2 4.16Å; H305-L309 HydrophobicContact CB-CD1 4.43Å; H305-L309 WeakPolarHBondContact O-CD1 3.47Å; H305-L309 PolarHBondContact O-N 2.69Å; H305-L309 VanDerWaalsContact O-N 3.13Å; I306-L309 PolarHBondContact O-N 2.73Å; L309-R311 VanDerWaalsContact C-N 3.33Å; L309-R311 PolarHBondContact O-N 3.22Å; L309-N312 WeakPolarHBondContact O-CB 3.49Å; L309-N312 PolarHBondContact O-N 2.99Å; L309-N312 VanDerWaalsContact O-N 3.13Å; L309-I313 WeakPolarHBondContact O-CG1 3.45Å; L309-I313 PolarHBondContact O-N 3.32Å
310	L	88	Confident	87.2	Confident	25 Å²	25	50.8 Å²	50.8	13%	0.131	24%	0.238	C	C	.	.	H	α-helix	trans	-59.8	-43.5	177.8	-80.2	169.8	0	0	0	111.6	F285 E286 L289 I306 E307 N312 I313 R314	F285-L310 HydrophobicContact CD1-CD2 3.62Å; F285-L310 HydrophobicContact CD1-CG 4.35Å; F285-L310 HydrophobicContact CE1-CD2 3.9Å; F285-L310 HydrophobicContact CE1-CG 4.12Å; E286-L310 HydrophobicContact CG-CD2 4.19Å; L289-L310 HydrophobicContact CD1-CD1 4.42Å; I306-L310 PolarHBondContact O-N 3.39Å; E307-L310 PolarHBondContact O-N 3.05Å; L310-N312 VanDerWaalsContact C-N 3.33Å; L310-N312 PolarHBondContact O-N 3.21Å; L310-I313 PolarHBondContact O-N 3.08Å; L310-R314 WeakPolarHBondContact O-CB 3.43Å; L310-R314 WeakPolarHBondContact O-CD 3.42Å; L310-R314 WeakPolarHBondContact O-CG 3.02Å; L310-R314 PolarHBondContact O-N 2.91Å
311	R	87.2	Confident	87.5	Confident	105 Å²	105	47.6 Å²	47.6	40%	0.396	22%	0.216	S	C	.	.	H	α-helix	trans	-60.1	-42.9	173.9	-74.9	-174.4	-73.4	-99.3	0.9	111.5	E307 E308 L309 R314 T315	E307-R311 WeakPolarHBondContact O-CG 3.48Å; E307-R311 PolarHBondContact O-N 2.83Å; E307-R311 IonicContact OE2-NH1 4Å; E307-R311 PolarHBondContact OE2-NH1 3.35Å; E307-R311 IonicContact OE2-NH2 2.75Å; E308-R311 PolarHBondContact O-N 3.4Å; L309-R311 VanDerWaalsContact C-N 3.33Å; L309-R311 PolarHBondContact O-N 3.22Å; R311-R314 PolarHBondContact O-N 3.4Å; R311-T315 WeakPolarHBondContact O-CB 3.06Å; R311-T315 PolarHBondContact O-N 3.48Å; R311-T315 PolarHBondContact O-OG1 2.98Å
312	N	86.9	Confident	87.8	Confident	22 Å²	22	47.1 Å²	47.1	12%	0.118	21%	0.214	C	C	.	.	H	α-helix	trans	-62.9	-47.8	178.1	-78.6	-34	0	0	0	112.6	K247 E308 L309 L310 T315 Q316	K247-N312 VanDerWaalsContact CE-OD1 3.32Å; K247-N312 WeakPolarHBondContact CE-OD1 3.31Å; K247-N312 PolarHBondContact NZ-OD1 3.2Å; E308-N312 WeakPolarHBondContact O-CB 3.39Å; E308-N312 PolarHBondContact O-N 3.31Å; E308-N312 PolarHBondContact O-ND2 3.47Å; L309-N312 WeakPolarHBondContact O-CB 3.49Å; L309-N312 PolarHBondContact O-N 2.99Å; L309-N312 VanDerWaalsContact O-N 3.13Å; L310-N312 VanDerWaalsContact C-N 3.33Å; L310-N312 PolarHBondContact O-N 3.21Å; N312-T315 WeakPolarHBondContact O-CB 3.25Å; N312-T315 PolarHBondContact O-N 2.85Å; N312-Q316 WeakPolarHBondContact O-CG 3.45Å; N312-Q316 PolarHBondContact O-N 2.65Å; N312-Q316 VanDerWaalsContact O-N 3.1Å
313	I	87.7	Confident	88	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-62	-48.1	177.3	-58.5	168.4	0	0	0	110.1	Y277 I282 F285 L309 L310 T315 Q316 V317	Y277-I313 HydrophobicContact CD2-CD1 3.57Å; Y277-I313 HydrophobicContact CD2-CG1 3.28Å; Y277-I313 HydrophobicContact CE2-CD1 4.19Å; Y277-I313 HydrophobicContact CE2-CG1 3.45Å; Y277-I313 VanDerWaalsContact CE2-CG1 3.45Å; Y277-I313 HydrophobicContact CG-CG1 4.36Å; I282-I313 HydrophobicContact CG1-CG2 3.72Å; F285-I313 HydrophobicContact CB-CD1 4.28Å; F285-I313 HydrophobicContact CD1-CD1 3.95Å; F285-I313 HydrophobicContact CD2-CD1 3.48Å; F285-I313 VanDerWaalsContact CD2-CD1 3.48Å; F285-I313 HydrophobicContact CE1-CD1 4.09Å; F285-I313 HydrophobicContact CE2-CD1 3.65Å; F285-I313 HydrophobicContact CG-CD1 3.64Å; F285-I313 HydrophobicContact CZ-CD1 3.95Å; L309-I313 WeakPolarHBondContact O-CG1 3.45Å; L309-I313 PolarHBondContact O-N 3.32Å; L310-I313 PolarHBondContact O-N 3.08Å; I313-T315 PolarHBondContact O-N 2.85Å; I313-Q316 PolarHBondContact O-N 3.43Å; I313-V317 HydrophobicContact CG2-CG2 4.2Å; I313-V317 WeakPolarHBondContact O-CG2 3.4Å; I313-V317 PolarHBondContact O-N 3.01Å
314	R	88.8	Confident	88.2	Confident	44 Å²	44	53.8 Å²	53.8	17%	0.166	26%	0.256	C	S	.	.	H	α-helix	trans	-58.2	-39.6	179.8	-73.5	169.8	-179	167.4	0.8	111.6	I282 E286 L310 R311 V317 L318 L347	I282-R314 HydrophobicContact CD1-CG 3.93Å; I282-R314 HydrophobicContact CG1-CG 4.34Å; E286-R314 IonicContact OE1-CZ 3.66Å; E286-R314 IonicContact OE1-NH2 3.96Å; E286-R314 PolarHBondContact OE1-NH2 3.34Å; L310-R314 WeakPolarHBondContact O-CB 3.43Å; L310-R314 WeakPolarHBondContact O-CD 3.42Å; L310-R314 WeakPolarHBondContact O-CG 3.02Å; L310-R314 PolarHBondContact O-N 2.91Å; R311-R314 PolarHBondContact O-N 3.4Å; R314-V317 PolarHBondContact O-N 3.48Å; R314-L318 WeakPolarHBondContact O-CB 3.35Å; R314-L318 PolarHBondContact O-N 3.4Å; R314-L347 HydrophobicContact CB-CD2 4.03Å
315	T	88.6	Confident	88.5	Confident	29 Å²	29	53.6 Å²	53.6	18%	0.178	25%	0.252	C	S	.	.	H	α-helix	trans	-62.2	-45.7	174.8	-56.2	0	0	0	0	111.6	R311 N312 I313 L318 I319	R311-T315 WeakPolarHBondContact O-CB 3.06Å; R311-T315 PolarHBondContact O-N 3.48Å; R311-T315 PolarHBondContact O-OG1 2.98Å; N312-T315 WeakPolarHBondContact O-CB 3.25Å; N312-T315 PolarHBondContact O-N 2.85Å; I313-T315 PolarHBondContact O-N 2.85Å; T315-L318 PolarHBondContact O-N 3.46Å; T315-I319 HydrophobicContact CG2-CD1 3.93Å; T315-I319 VanDerWaalsContact O-CG1 3.25Å; T315-I319 WeakPolarHBondContact O-CG1 3.31Å; T315-I319 PolarHBondContact O-N 3.38Å
316	Q	86.4	Confident	88.6	Confident	70 Å²	70	56.7 Å²	56.7	33%	0.327	27%	0.272	S	S	.	.	H	α-helix	trans	-64.1	-44.5	178.7	-68.7	-169.8	42.1	0	0	112.3	N280 N312 I313 I319 K320	N280-Q316 WeakPolarHBondContact OD1-CB 3.27Å; N280-Q316 PolarHBondContact OD1-OE1 3.06Å; N312-Q316 WeakPolarHBondContact O-CG 3.45Å; N312-Q316 PolarHBondContact O-N 2.65Å; N312-Q316 VanDerWaalsContact O-N 3.1Å; I313-Q316 PolarHBondContact O-N 3.43Å; Q316-I319 PolarHBondContact O-N 2.87Å; Q316-K320 PolarHBondContact O-N 3.03Å; Q316-K320 VanDerWaalsContact O-N 3.14Å
317	V	89.4	Confident	88.9	Confident	27 Å²	27	63.4 Å²	63.4	16%	0.164	30%	0.297	C	S	.	.	H	α-helix	trans	-63.1	-44.4	176.5	176.8	0	0	0	0	110.7	N280 I282 I313 R314 I319 K320 L321 L337	N280-V317 HydrophobicContact CB-CG2 3.87Å; N280-V317 WeakPolarHBondContact O-CG2 3.24Å; I282-V317 HydrophobicContact CD1-CB 3.92Å; I282-V317 HydrophobicContact CD1-CG1 4Å; I282-V317 HydrophobicContact CD1-CG2 3.83Å; I282-V317 HydrophobicContact CG1-CG2 4.03Å; I313-V317 HydrophobicContact CG2-CG2 4.2Å; I313-V317 WeakPolarHBondContact O-CG2 3.4Å; I313-V317 PolarHBondContact O-N 3.01Å; R314-V317 PolarHBondContact O-N 3.48Å; V317-I319 PolarHBondContact O-N 3.29Å; V317-K320 PolarHBondContact O-N 3.5Å; V317-L321 VanDerWaalsContact O-CB 3.3Å; V317-L321 WeakPolarHBondContact O-CB 3.47Å; V317-L321 PolarHBondContact O-N 3.43Å; V317-L337 HydrophobicContact CB-CD2 3.96Å; V317-L337 HydrophobicContact CG1-CD2 3.64Å
318	L	90.6	Very high	89.4	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-57.9	-49.3	177.4	177.5	62.5	0	0	0	111.7	R314 T315 K320 L321 I322 I333 L337 L347 L348 I357	R314-L318 WeakPolarHBondContact O-CB 3.35Å; R314-L318 PolarHBondContact O-N 3.4Å; T315-L318 PolarHBondContact O-N 3.46Å; L318-K320 PolarHBondContact O-N 3.21Å; L318-L321 PolarHBondContact O-N 3.17Å; L318-L321 VanDerWaalsContact O-N 3.12Å; L318-I322 HydrophobicContact CD1-CG2 3.76Å; L318-I322 HydrophobicContact CG-CG2 4.42Å; L318-I322 WeakPolarHBondContact O-CG1 3.5Å; L318-I322 WeakPolarHBondContact O-CG2 3.31Å; L318-I322 PolarHBondContact O-N 3.02Å; L318-I333 HydrophobicContact CD1-CD1 4.15Å; L318-I333 HydrophobicContact CD1-CG2 3.57Å; L318-L337 HydrophobicContact CB-CD1 4.25Å; L318-L337 HydrophobicContact CD1-CD1 4.26Å; L318-L347 HydrophobicContact CD2-CD2 4.05Å; L318-L347 HydrophobicContact CD2-CG 4.26Å; L318-L348 HydrophobicContact CD1-CD2 4.3Å; L318-L348 HydrophobicContact CD2-CD2 3.85Å; L318-L348 HydrophobicContact CD2-CG 4.43Å; L318-I357 HydrophobicContact CD2-CD1 3.72Å; L318-I357 HydrophobicContact CG-CD1 3.97Å
319	I	88.8	Confident	89.8	Confident	53 Å²	53	60.7 Å²	60.7	27%	0.272	28%	0.284	S	S	.	.	H	α-helix	trans	-59	-39.1	178.4	-68.5	165.3	0	0	0	110.9	T315 Q316 V317 K323 I357	T315-I319 HydrophobicContact CG2-CD1 3.93Å; T315-I319 VanDerWaalsContact O-CG1 3.25Å; T315-I319 WeakPolarHBondContact O-CG1 3.31Å; T315-I319 PolarHBondContact O-N 3.38Å; Q316-I319 PolarHBondContact O-N 2.87Å; V317-I319 PolarHBondContact O-N 3.29Å; I319-K323 WeakPolarHBondContact O-CG 3.41Å; I319-I357 HydrophobicContact CG1-CG1 4.21Å
320	K	88.5	Confident	90.1	Very high	156 Å²	156	60.7 Å²	60.7	68%	0.678	28%	0.284	S	S	*	.	H	α-helix	trans	-70.8	-38.6	177.2	-168	176.7	179.4	-177.3	0	112	Q316 V317 L318	Q316-K320 PolarHBondContact O-N 3.03Å; Q316-K320 VanDerWaalsContact O-N 3.14Å; V317-K320 PolarHBondContact O-N 3.5Å; L318-K320 PolarHBondContact O-N 3.21Å
321	L	90.6	Very high	90.4	Very high	31 Å²	31	62.1 Å²	62.1	16%	0.162	29%	0.294	C	S	.	.	H	α-helix	trans	-68.5	-40.3	-178.3	-176.9	66.1	0	0	0	112.5	V317 L318 P324 Y325 F332 I333 E336	V317-L321 VanDerWaalsContact O-CB 3.3Å; V317-L321 WeakPolarHBondContact O-CB 3.47Å; V317-L321 PolarHBondContact O-N 3.43Å; L318-L321 PolarHBondContact O-N 3.17Å; L318-L321 VanDerWaalsContact O-N 3.12Å; L321-P324 WeakPolarHBondContact O-CD 3.23Å; L321-Y325 WeakPolarHBondContact O-CD2 3.37Å; L321-Y325 VanDerWaalsContact O-CE2 3.26Å; L321-Y325 WeakPolarHBondContact O-CE2 3.44Å; L321-F332 HydrophobicContact CD1-CE1 4.44Å; L321-I333 HydrophobicContact CD2-CG1 4.48Å; L321-E336 HydrophobicContact CD1-CG 4Å; L321-E336 HydrophobicContact CD2-CB 3.85Å; L321-E336 HydrophobicContact CD2-CG 3.77Å
322	I	90.8	Very high	90.8	Very high	10 Å²	10	61.2 Å²	61.2	5%	0.051	29%	0.293	C	S	.	.	H	α-helix	trans	-79.2	-22.2	-174.9	67.5	-176.3	0	0	0	113.6	L318 P324 Y325 I328 I333 I357 L368 L370	L318-I322 HydrophobicContact CD1-CG2 3.76Å; L318-I322 HydrophobicContact CG-CG2 4.42Å; L318-I322 WeakPolarHBondContact O-CG1 3.5Å; L318-I322 WeakPolarHBondContact O-CG2 3.31Å; L318-I322 PolarHBondContact O-N 3.02Å; I322-P324 VanDerWaalsContact C-CD 3.45Å; I322-Y325 PolarHBondContact O-N 3.04Å; I322-I328 HydrophobicContact CG2-CD1 4.44Å; I322-I328 HydrophobicContact CG2-CG2 4.45Å; I322-I333 HydrophobicContact CG2-CD1 4.41Å; I322-I357 HydrophobicContact CD1-CB 4.36Å; I322-I357 HydrophobicContact CD1-CD1 3.67Å; I322-I357 HydrophobicContact CD1-CG1 3.74Å; I322-I357 HydrophobicContact CD1-CG2 3.76Å; I322-L368 HydrophobicContact CG2-CD2 4.11Å; I322-L370 HydrophobicContact CB-CD1 4.12Å; I322-L370 HydrophobicContact CD1-CD2 4.15Å; I322-L370 WeakPolarHBondContact O-CD1 3.21Å
323	K	89.1	Confident	91.1	Very high	160 Å²	160	60.1 Å²	60.1	70%	0.696	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.4	-45.2	-176.3	-91.4	175.6	-175.9	-176.9	0	116.1	I319 Y325	I319-K323 WeakPolarHBondContact O-CG 3.41Å; K323-Y325 VanDerWaalsContact C-N 3.3Å
324	P	91.7	Very high	91.3	Very high	102 Å²	102	61 Å²	61	66%	0.662	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-7.6	-178.5	30.6	-34	0	0	0	114	L321 I322	L321-P324 WeakPolarHBondContact O-CD 3.23Å; I322-P324 VanDerWaalsContact C-CD 3.45Å
325	Y	92.1	Very high	91.5	Very high	98 Å²	98	67.1 Å²	67.1	38%	0.384	32%	0.322	S	S	.	.			trans	-100.9	150.6	-176	-60.4	-83.1	0	0	0	111.3	L321 I322 K323 I328 L370	L321-Y325 WeakPolarHBondContact O-CD2 3.37Å; L321-Y325 VanDerWaalsContact O-CE2 3.26Å; L321-Y325 WeakPolarHBondContact O-CE2 3.44Å; I322-Y325 PolarHBondContact O-N 3.04Å; K323-Y325 VanDerWaalsContact C-N 3.3Å; Y325-I328 HydrophobicContact CD2-CD1 3.77Å; Y325-I328 HydrophobicContact CE2-CD1 4.09Å; Y325-I328 HydrophobicContact CG-CB 4.3Å; Y325-I328 HydrophobicContact CG-CD1 4.13Å; Y325-I328 HydrophobicContact CG-CG1 4.45Å; Y325-L370 WeakPolarHBondContact O-CD1 3.41Å
326	T	90.5	Very high	91.5	Very high	74 Å²	74	71 Å²	71	45%	0.454	34%	0.338	S	S	.	.	S	Bend	trans	-98.4	-32.7	165.8	-44.1	0	0	0	0	110.9	L370 H372	T326-L370 PolarHBondContact O-N 2.78Å; T326-H372 HydrophobicContact CG2-CB 4.23Å
327	R	92.6	Very high	91.5	Very high	149 Å²	149	67.7 Å²	67.7	56%	0.562	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.4	125	-177.6	-73.3	-179	76.3	-176.4	4.6	107.1	L367 L368 E369	R327-L367 HydrophobicContact CB-CD2 3.95Å; R327-L367 HydrophobicContact CG-CD2 4.08Å; R327-L368 WeakPolarHBondContact CA-O 3.49Å; R327-E369 HydrophobicContact CG-CG 4.18Å
328	I	94.6	Very high	91.4	Very high	6 Å²	6	71 Å²	71	3%	0.031	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	137.6	-176	-172.9	172.1	0	0	0	110.2	I322 Y325 F332 I333 L367 L368	I322-I328 HydrophobicContact CG2-CD1 4.44Å; I322-I328 HydrophobicContact CG2-CG2 4.45Å; Y325-I328 HydrophobicContact CD2-CD1 3.77Å; Y325-I328 HydrophobicContact CE2-CD1 4.09Å; Y325-I328 HydrophobicContact CG-CB 4.3Å; Y325-I328 HydrophobicContact CG-CD1 4.13Å; Y325-I328 HydrophobicContact CG-CG1 4.45Å; I328-F332 HydrophobicContact CD1-CD1 3.93Å; I328-F332 HydrophobicContact CD1-CE1 4.28Å; I328-F332 HydrophobicContact CG1-CD1 4.06Å; I328-I333 HydrophobicContact CD1-CD1 4.12Å; I328-I333 HydrophobicContact CD1-CG1 3.74Å; I328-I333 HydrophobicContact CG1-CD1 4.26Å; I328-I333 HydrophobicContact CG1-CG1 4.05Å; I328-I333 HydrophobicContact CG2-CD1 3.91Å; I328-L367 CarbonylContact O-C 3.41Å; I328-L367 WeakPolarHBondContact O-CA 3.31Å; I328-L368 HydrophobicContact CG2-CB 3.75Å; I328-L368 HydrophobicContact CG2-CD2 3.94Å; I328-L368 HydrophobicContact CG2-CG 4.28Å; I328-L368 PolarHBondContact N-O 3.41Å; I328-L368 PolarHBondContact O-N 3.23Å
329	H	95.2	Very high	91.4	Very high	113 Å²	113	71.9 Å²	71.9	52%	0.523	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	131.8	178.6	-78.8	-73.7	0	0	0	111	F332 I333	H329-F332 HydrophobicContact CB-CB 4.15Å; H329-F332 WeakPolarHBondContact O-CB 3.41Å; H329-F332 PolarHBondContact O-N 3.44Å; H329-I333 PolarHBondContact O-N 3.34Å
330	I	94.1	Very high	91.6	Very high	0 Å²	0	74.3 Å²	74.3	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-60.3	-40.9	176.3	-55.9	173.4	0	0	0	111.1	F332 I333 S334 V341 V344 L348 I361 Q366	I330-F332 PolarHBondContact O-N 3.21Å; I330-I333 WeakPolarHBondContact O-CB 3.49Å; I330-I333 PolarHBondContact O-N 3.01Å; I330-I333 VanDerWaalsContact O-N 3.09Å; I330-S334 PolarHBondContact O-N 2.95Å; I330-V341 HydrophobicContact CG2-CG1 3.83Å; I330-V344 HydrophobicContact CG2-CB 4.07Å; I330-V344 HydrophobicContact CG2-CG1 3.74Å; I330-L348 HydrophobicContact CG1-CD1 4.37Å; I330-I361 HydrophobicContact CD1-CG2 3.89Å; I330-Q366 PolarHBondContact N-O 3.42Å
331	P	94.9	Very high	91.8	Very high	54 Å²	54	69 Å²	69	35%	0.351	34%	0.337	S	S	.	.	H	α-helix	trans	-61.1	-25.5	174	-27.3	35.7	0	0	0	114.6	K335 Q366	P331-K335 WeakPolarHBondContact O-CG 3.39Å; P331-K335 PolarHBondContact O-N 2.9Å; P331-Q366 HydrophobicContact CG-CB 4.42Å
332	F	94.2	Very high	91.9	Very high	86 Å²	86	70 Å²	70	38%	0.377	35%	0.351	S	S	.	.	H	α-helix	trans	-72.5	-44.1	174.3	176.5	-95.4	0	0	0	110.5	L321 I328 H329 I330 S334 K335 E336	L321-F332 HydrophobicContact CD1-CE1 4.44Å; I328-F332 HydrophobicContact CD1-CD1 3.93Å; I328-F332 HydrophobicContact CD1-CE1 4.28Å; I328-F332 HydrophobicContact CG1-CD1 4.06Å; H329-F332 HydrophobicContact CB-CB 4.15Å; H329-F332 WeakPolarHBondContact O-CB 3.41Å; H329-F332 PolarHBondContact O-N 3.44Å; I330-F332 PolarHBondContact O-N 3.21Å; F332-S334 VanDerWaalsContact C-N 3.32Å; F332-S334 PolarHBondContact O-N 3.3Å; F332-K335 PolarHBondContact O-N 3.49Å; F332-E336 PolarHBondContact O-N 3.34Å; F332-E336 VanDerWaalsContact O-N 3.13Å
333	I	93.2	Very high	92	Very high	0 Å²	0	73.9 Å²	73.9	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-61	-42.1	174.8	-60	171.5	0	0	0	111	L318 L321 I322 I328 H329 I330 K335 E336 L337 V344 L348 L368	L318-I333 HydrophobicContact CD1-CD1 4.15Å; L318-I333 HydrophobicContact CD1-CG2 3.57Å; L321-I333 HydrophobicContact CD2-CG1 4.48Å; I322-I333 HydrophobicContact CG2-CD1 4.41Å; I328-I333 HydrophobicContact CD1-CD1 4.12Å; I328-I333 HydrophobicContact CD1-CG1 3.74Å; I328-I333 HydrophobicContact CG1-CD1 4.26Å; I328-I333 HydrophobicContact CG1-CG1 4.05Å; I328-I333 HydrophobicContact CG2-CD1 3.91Å; H329-I333 PolarHBondContact O-N 3.34Å; I330-I333 WeakPolarHBondContact O-CB 3.49Å; I330-I333 PolarHBondContact O-N 3.01Å; I330-I333 VanDerWaalsContact O-N 3.09Å; I333-K335 VanDerWaalsContact C-N 3.33Å; I333-K335 PolarHBondContact O-N 2.91Å; I333-E336 PolarHBondContact O-N 2.79Å; I333-L337 HydrophobicContact CG2-CD1 3.59Å; I333-L337 HydrophobicContact CG2-CG 4.05Å; I333-L337 WeakPolarHBondContact O-CB 3.41Å; I333-L337 PolarHBondContact O-N 3.1Å; I333-V344 HydrophobicContact CB-CG1 4.02Å; I333-V344 HydrophobicContact CG2-CG1 3.57Å; I333-V344 HydrophobicContact CG2-CG2 4.41Å; I333-L348 HydrophobicContact CD1-CD1 4.48Å; I333-L368 HydrophobicContact CD1-CD2 4.44Å
334	S	93.6	Very high	92.2	Very high	19 Å²	19	66.3 Å²	66.3	13%	0.133	34%	0.338	C	S	.	.	H	α-helix	trans	-56.8	-44.2	176.9	161.6	0	0	0	0	112.6	I330 F332 N338 I339	I330-S334 PolarHBondContact O-N 2.95Å; F332-S334 VanDerWaalsContact C-N 3.32Å; F332-S334 PolarHBondContact O-N 3.3Å; S334-N338 WeakPolarHBondContact O-CA 3.4Å; S334-N338 PolarHBondContact O-N 3.35Å; S334-I339 WeakPolarHBondContact CB-O 3.3Å; S334-I339 PolarHBondContact O-N 2.71Å; S334-I339 PolarHBondContact OG-O 2.88Å
335	K	91.3	Very high	92.2	Very high	173 Å²	173	63.2 Å²	63.2	75%	0.752	32%	0.315	S	S	*	.	H	α-helix	trans	-66.5	-38.8	176.6	-72.3	179.2	-179.6	-177.4	0	112.6	P331 F332 I333	P331-K335 WeakPolarHBondContact O-CG 3.39Å; P331-K335 PolarHBondContact O-N 2.9Å; F332-K335 PolarHBondContact O-N 3.49Å; I333-K335 VanDerWaalsContact C-N 3.33Å; I333-K335 PolarHBondContact O-N 2.91Å
336	E	88.7	Confident	92.2	Very high	110 Å²	110	62.1 Å²	62.1	51%	0.514	32%	0.322	S	S	.	.	H	α-helix	trans	-73.6	-38	-178.5	-160.4	67.7	-165.5	0	0	112.4	L321 F332 I333	L321-E336 HydrophobicContact CD1-CG 4Å; L321-E336 HydrophobicContact CD2-CB 3.85Å; L321-E336 HydrophobicContact CD2-CG 3.77Å; F332-E336 PolarHBondContact O-N 3.34Å; F332-E336 VanDerWaalsContact O-N 3.13Å; I333-E336 PolarHBondContact O-N 2.79Å
337	L	88	Confident	92.3	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-87	-5.5	178.5	-64.6	-178.1	0	0	0	113.7	I282 V317 L318 I333 I339 L347	I282-L337 HydrophobicContact CD1-CD2 3.52Å; V317-L337 HydrophobicContact CB-CD2 3.96Å; V317-L337 HydrophobicContact CG1-CD2 3.64Å; L318-L337 HydrophobicContact CB-CD1 4.25Å; L318-L337 HydrophobicContact CD1-CD1 4.26Å; I333-L337 HydrophobicContact CG2-CD1 3.59Å; I333-L337 HydrophobicContact CG2-CG 4.05Å; I333-L337 WeakPolarHBondContact O-CB 3.41Å; I333-L337 PolarHBondContact O-N 3.1Å; L337-I339 HydrophobicContact CB-CD1 4.2Å; L337-I339 HydrophobicContact CB-CG1 3.78Å; L337-I339 HydrophobicContact CD1-CD1 4.27Å; L337-I339 PolarHBondContact O-N 2.95Å; L337-L347 HydrophobicContact CD1-CD2 4.39Å
338	N	87.2	Confident	92.3	Very high	98 Å²	98	52.1 Å²	52.1	52%	0.524	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	43.6	-177.5	-167.2	44.2	0	0	0	113.9	E286 S334	E286-N338 PolarHBondContact OE2-ND2 3.48Å; E286-N338 VanDerWaalsContact OE2-ND2 3.12Å; S334-N338 WeakPolarHBondContact O-CA 3.4Å; S334-N338 PolarHBondContact O-N 3.35Å
339	I	89.5	Confident	92.3	Very high	18 Å²	18	55 Å²	55	9%	0.092	30%	0.295	C	S	.	.	S	Bend	trans	-134.8	161.3	179.3	51.8	165.2	0	0	0	111.7	S334 L337 D343 V344	S334-I339 WeakPolarHBondContact CB-O 3.3Å; S334-I339 PolarHBondContact O-N 2.71Å; S334-I339 PolarHBondContact OG-O 2.88Å; L337-I339 HydrophobicContact CB-CD1 4.2Å; L337-I339 HydrophobicContact CB-CG1 3.78Å; L337-I339 HydrophobicContact CD1-CD1 4.27Å; L337-I339 PolarHBondContact O-N 2.95Å; I339-D343 HydrophobicContact CB-CB 4.43Å; I339-D343 HydrophobicContact CD1-CB 4.26Å; I339-V344 HydrophobicContact CD1-CB 4.36Å; I339-V344 HydrophobicContact CD1-CG2 3.53Å; I339-V344 HydrophobicContact CG1-CG2 3.56Å
340	D	93.4	Very high	92	Very high	104 Å²	104	54.5 Å²	54.5	56%	0.556	29%	0.292	S	S	*	.			trans	-63.4	150.5	178.4	-165.2	-82.5	0	0	0	111.5	A342 D343 V344	D340-A342 PolarHBondContact O-N 3.45Å; D340-A342 WeakPolarHBondContact OD1-CB 3.37Å; D340-A342 PolarHBondContact OD1-N 3.26Å; D340-D343 PolarHBondContact O-N 3.39Å; D340-D343 VanDerWaalsContact O-N 3.1Å; D340-V344 WeakPolarHBondContact O-CG2 3.33Å; D340-V344 PolarHBondContact O-N 3.48Å
341	V	93.1	Very high	91.9	Very high	43 Å²	43	54.6 Å²	54.6	26%	0.261	29%	0.293	S	S	.	.	H	α-helix	trans	-57.9	-37.2	179.1	-177.1	0	0	0	0	111.2	I330 V344 E345 Q366	I330-V341 HydrophobicContact CG2-CG1 3.83Å; V341-V344 PolarHBondContact O-N 3.21Å; V341-E345 PolarHBondContact O-N 3.24Å; V341-Q366 VanDerWaalsContact CG1-OE1 3.29Å
342	A	92.8	Very high	91.7	Very high	53 Å²	53	54.1 Å²	54.1	44%	0.438	29%	0.287	S	S	.	.	H	α-helix	trans	-66	-36.8	177.4	0	0	0	0	0	112.7	D340 E345 S346	D340-A342 PolarHBondContact O-N 3.45Å; D340-A342 WeakPolarHBondContact OD1-CB 3.37Å; D340-A342 PolarHBondContact OD1-N 3.26Å; A342-E345 PolarHBondContact O-N 3.27Å; A342-S346 PolarHBondContact O-N 3.1Å; A342-S346 PolarHBondContact O-OG 3.1Å
343	D	91.4	Very high	91.6	Very high	92 Å²	92	56 Å²	56	49%	0.492	30%	0.301	S	S	.	.	H	α-helix	trans	-72	-37	176.7	-66.7	-31	0	0	0	111.2	I339 D340 E345 S346 L347	I339-D343 HydrophobicContact CB-CB 4.43Å; I339-D343 HydrophobicContact CD1-CB 4.26Å; D340-D343 PolarHBondContact O-N 3.39Å; D340-D343 VanDerWaalsContact O-N 3.1Å; D343-E345 VanDerWaalsContact C-N 3.34Å; D343-S346 PolarHBondContact O-N 2.78Å; D343-L347 WeakPolarHBondContact O-CB 3.29Å; D343-L347 PolarHBondContact O-N 3.26Å
344	V	93.5	Very high	91.5	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-61.2	-45.4	172.1	179.1	0	0	0	0	110.5	I330 I333 I339 D340 V341 L347 L348	I330-V344 HydrophobicContact CG2-CB 4.07Å; I330-V344 HydrophobicContact CG2-CG1 3.74Å; I333-V344 HydrophobicContact CB-CG1 4.02Å; I333-V344 HydrophobicContact CG2-CG1 3.57Å; I333-V344 HydrophobicContact CG2-CG2 4.41Å; I339-V344 HydrophobicContact CD1-CB 4.36Å; I339-V344 HydrophobicContact CD1-CG2 3.53Å; I339-V344 HydrophobicContact CG1-CG2 3.56Å; D340-V344 WeakPolarHBondContact O-CG2 3.33Å; D340-V344 PolarHBondContact O-N 3.48Å; V341-V344 PolarHBondContact O-N 3.21Å; V344-L347 PolarHBondContact O-N 3.08Å; V344-L348 HydrophobicContact CG1-CD1 3.86Å; V344-L348 HydrophobicContact CG1-CG 4.27Å; V344-L348 WeakPolarHBondContact O-CB 3.42Å; V344-L348 VanDerWaalsContact O-CG 3.3Å; V344-L348 WeakPolarHBondContact O-CG 3.4Å; V344-L348 PolarHBondContact O-N 3.47Å
345	E	92.9	Very high	91.1	Very high	37 Å²	37	65.3 Å²	65.3	17%	0.173	35%	0.349	C	S	.	.	H	α-helix	trans	-61.6	-45.9	178.9	-170.4	175.2	174.6	0	0	110.9	V341 A342 D343 L347 L348 V349 I361 Q363	V341-E345 PolarHBondContact O-N 3.24Å; A342-E345 PolarHBondContact O-N 3.27Å; D343-E345 VanDerWaalsContact C-N 3.34Å; E345-L347 VanDerWaalsContact C-N 3.34Å; E345-L347 PolarHBondContact O-N 3.05Å; E345-L348 PolarHBondContact O-N 2.99Å; E345-V349 WeakPolarHBondContact O-CG2 3.31Å; E345-V349 PolarHBondContact O-N 3.22Å; E345-I361 HydrophobicContact CG-CG2 4.47Å; E345-Q363 WeakPolarHBondContact OE1-CG 3.37Å; E345-Q363 PolarHBondContact OE1-NE2 3.32Å
346	S	92.3	Very high	91	Very high	75 Å²	75	60.2 Å²	60.2	52%	0.524	33%	0.332	S	S	.	.	H	α-helix	trans	-59.8	-42.9	176	-58.7	0	0	0	0	112.2	A342 D343 V349 Q350	A342-S346 PolarHBondContact O-N 3.1Å; A342-S346 PolarHBondContact O-OG 3.1Å; D343-S346 PolarHBondContact O-N 2.78Å; S346-V349 PolarHBondContact O-N 3.48Å; S346-Q350 PolarHBondContact O-N 3.22Å
347	L	91.9	Very high	91	Very high	14 Å²	14	55.2 Å²	55.2	7%	0.073	31%	0.309	C	S	.	.	H	α-helix	trans	-64	-42.7	176	-175	65.4	0	0	0	111.8	R314 L318 L337 D343 V344 E345 Q350 C351	R314-L347 HydrophobicContact CB-CD2 4.03Å; L318-L347 HydrophobicContact CD2-CD2 4.05Å; L318-L347 HydrophobicContact CD2-CG 4.26Å; L337-L347 HydrophobicContact CD1-CD2 4.39Å; D343-L347 WeakPolarHBondContact O-CB 3.29Å; D343-L347 PolarHBondContact O-N 3.26Å; V344-L347 PolarHBondContact O-N 3.08Å; E345-L347 VanDerWaalsContact C-N 3.34Å; E345-L347 PolarHBondContact O-N 3.05Å; L347-Q350 PolarHBondContact O-N 3.44Å; L347-C351 WeakPolarHBondContact O-CB 3.33Å; L347-C351 PolarHBondContact O-N 3Å; L347-C351 PolarHBondContact O-SG 2.93Å
348	L	92.5	Very high	91	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-63.4	-42.3	176.6	-76.3	169.6	0	0	0	111.7	L318 I330 I333 V344 E345 C351 I352 I357 I361 L368	L318-L348 HydrophobicContact CD1-CD2 4.3Å; L318-L348 HydrophobicContact CD2-CD2 3.85Å; L318-L348 HydrophobicContact CD2-CG 4.43Å; I330-L348 HydrophobicContact CG1-CD1 4.37Å; I333-L348 HydrophobicContact CD1-CD1 4.48Å; V344-L348 HydrophobicContact CG1-CD1 3.86Å; V344-L348 HydrophobicContact CG1-CG 4.27Å; V344-L348 WeakPolarHBondContact O-CB 3.42Å; V344-L348 VanDerWaalsContact O-CG 3.3Å; V344-L348 WeakPolarHBondContact O-CG 3.4Å; V344-L348 PolarHBondContact O-N 3.47Å; E345-L348 PolarHBondContact O-N 2.99Å; L348-C351 PolarHBondContact O-N 2.94Å; L348-I352 WeakPolarHBondContact O-CB 2.97Å; L348-I352 WeakPolarHBondContact O-CD1 3.35Å; L348-I352 VanDerWaalsContact O-CG1 3.22Å; L348-I352 WeakPolarHBondContact O-CG1 3.23Å; L348-I352 PolarHBondContact O-N 2.95Å; L348-I357 HydrophobicContact CD2-CD1 4.08Å; L348-I361 HydrophobicContact CB-CD1 3.67Å; L348-I361 HydrophobicContact CB-CG1 4.34Å; L348-L368 HydrophobicContact CD1-CD1 4.45Å; L348-L368 HydrophobicContact CD2-CD1 4.1Å; L348-L368 HydrophobicContact CD2-CD2 3.65Å; L348-L368 HydrophobicContact CD2-CG 4.45Å
349	V	93.6	Very high	91.1	Very high	67 Å²	67	57.1 Å²	57.1	41%	0.406	32%	0.317	S	S	.	.	H	α-helix	trans	-58.6	-50.2	175.4	169.9	0	0	0	0	110.3	E345 S346 C351 I352 L353 I361	E345-V349 WeakPolarHBondContact O-CG2 3.31Å; E345-V349 PolarHBondContact O-N 3.22Å; S346-V349 PolarHBondContact O-N 3.48Å; V349-C351 PolarHBondContact O-N 2.86Å; V349-I352 PolarHBondContact O-N 3.39Å; V349-L353 HydrophobicContact CG1-CD1 3.99Å; V349-L353 WeakPolarHBondContact O-CG 3.06Å; V349-L353 PolarHBondContact O-N 3.12Å; V349-I361 HydrophobicContact CG2-CD1 3.65Å
350	Q	90.7	Very high	91.2	Very high	101 Å²	101	64.3 Å²	64.3	47%	0.472	34%	0.343	S	S	.	.	H	α-helix	trans	-59.5	-47	177.9	-175.6	176.7	-4.4	0	0	111.4	S346 L347 I352 L353 D354	S346-Q350 PolarHBondContact O-N 3.22Å; L347-Q350 PolarHBondContact O-N 3.44Å; Q350-I352 VanDerWaalsContact C-N 3.31Å; Q350-I352 PolarHBondContact O-N 2.88Å; Q350-L353 PolarHBondContact O-N 3.34Å; Q350-D354 WeakPolarHBondContact O-CB 3.42Å; Q350-D354 PolarHBondContact O-N 3.23Å
351	C	90.6	Very high	91.3	Very high	3 Å²	3	61.6 Å²	61.6	2%	0.02	33%	0.327	C	S	.	.	H	α-helix	trans	-62.9	-34.9	-179.4	-68.6	0	0	0	0	113.4	L347 L348 V349 N355 T356 I357	L347-C351 WeakPolarHBondContact O-CB 3.33Å; L347-C351 PolarHBondContact O-N 3Å; L347-C351 PolarHBondContact O-SG 2.93Å; L348-C351 PolarHBondContact O-N 2.94Å; V349-C351 PolarHBondContact O-N 2.86Å; C351-N355 PolarHBondContact O-N 2.93Å; C351-T356 WeakPolarHBondContact CA-OG1 3.24Å; C351-T356 WeakPolarHBondContact CB-OG1 3.35Å; C351-T356 PolarHBondContact O-N 3.29Å; C351-T356 PolarHBondContact O-OG1 2.88Å; C351-I357 HydrophobicContact CB-CB 4.18Å; C351-I357 HydrophobicContact CB-CD1 3.53Å; C351-I357 HydrophobicContact CB-CG1 3.81Å; C351-I357 PolarHBondContact O-N 3.25Å
352	I	91.8	Very high	91.3	Very high	43 Å²	43	61.8 Å²	61.8	22%	0.221	33%	0.327	C	S	.	.	H	α-helix	trans	-70.7	-42.8	176.1	-68.7	165	0	0	0	110.5	L348 V349 Q350 D354 N355 I357 I361 L368	L348-I352 WeakPolarHBondContact O-CB 2.97Å; L348-I352 WeakPolarHBondContact O-CD1 3.35Å; L348-I352 VanDerWaalsContact O-CG1 3.22Å; L348-I352 WeakPolarHBondContact O-CG1 3.23Å; L348-I352 PolarHBondContact O-N 2.95Å; V349-I352 PolarHBondContact O-N 3.39Å; Q350-I352 VanDerWaalsContact C-N 3.31Å; Q350-I352 PolarHBondContact O-N 2.88Å; I352-D354 VanDerWaalsContact C-N 3.34Å; I352-N355 PolarHBondContact O-N 3.19Å; I352-N355 VanDerWaalsContact O-N 3.09Å; I352-I357 HydrophobicContact CG1-CB 4.34Å; I352-I357 HydrophobicContact CG1-CG2 4.33Å; I352-I361 HydrophobicContact CD1-CD1 3.96Å; I352-I361 HydrophobicContact CD1-CG1 3.73Å; I352-L368 HydrophobicContact CD1-CD1 4.35Å
353	L	92.3	Very high	91.2	Very high	126 Å²	126	65.1 Å²	65.1	66%	0.66	33%	0.334	S	S	*	.	H	α-helix	trans	-63	-40.6	176.3	-71	172.8	0	0	0	112	V349 Q350 N355	V349-L353 HydrophobicContact CG1-CD1 3.99Å; V349-L353 WeakPolarHBondContact O-CG 3.06Å; V349-L353 PolarHBondContact O-N 3.12Å; Q350-L353 PolarHBondContact O-N 3.34Å; L353-N355 PolarHBondContact O-N 3.36Å; L353-N355 VanDerWaalsContact O-N 3.16Å; L353-N355 PolarHBondContact O-ND2 3.26Å
354	D	89.6	Confident	91.2	Very high	98 Å²	98	67 Å²	67	52%	0.524	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	0.9	176.1	-67.4	-18	0	0	0	112.8	Q350 I352 T356	Q350-D354 WeakPolarHBondContact O-CB 3.42Å; Q350-D354 PolarHBondContact O-N 3.23Å; I352-D354 VanDerWaalsContact C-N 3.34Å; D354-T356 HydrophobicContact CB-CG2 4.08Å; D354-T356 PolarHBondContact O-N 3.43Å; D354-T356 VanDerWaalsContact O-N 3.15Å
355	N	86.6	Confident	91.1	Very high	116 Å²	116	71.9 Å²	71.9	62%	0.62	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	21.2	-176.3	-61	-76.2	0	0	0	114.4	C351 I352 L353 H358	C351-N355 PolarHBondContact O-N 2.93Å; I352-N355 PolarHBondContact O-N 3.19Å; I352-N355 VanDerWaalsContact O-N 3.09Å; L353-N355 PolarHBondContact O-N 3.36Å; L353-N355 VanDerWaalsContact O-N 3.16Å; L353-N355 PolarHBondContact O-ND2 3.26Å; N355-H358 PolarHBondContact O-CE1 3.3Å
356	T	87.8	Confident	91.2	Very high	67 Å²	67	72.7 Å²	72.7	41%	0.411	38%	0.378	S	S	.	.	S	Bend	trans	-80	-31.1	176.2	61.4	0	0	0	0	111.7	C351 D354	C351-T356 WeakPolarHBondContact CA-OG1 3.24Å; C351-T356 WeakPolarHBondContact CB-OG1 3.35Å; C351-T356 PolarHBondContact O-N 3.29Å; C351-T356 PolarHBondContact O-OG1 2.88Å; D354-T356 HydrophobicContact CB-CG2 4.08Å; D354-T356 PolarHBondContact O-N 3.43Å; D354-T356 VanDerWaalsContact O-N 3.15Å
357	I	89.2	Confident	91.3	Very high	4 Å²	4	69.6 Å²	69.6	2%	0.021	36%	0.356	C	S	.	.	S	Bend	trans	-117.2	129.6	174.6	-63.1	177.2	0	0	0	109.3	L318 I319 I322 L348 C351 I352 L370	L318-I357 HydrophobicContact CD2-CD1 3.72Å; L318-I357 HydrophobicContact CG-CD1 3.97Å; I319-I357 HydrophobicContact CG1-CG1 4.21Å; I322-I357 HydrophobicContact CD1-CB 4.36Å; I322-I357 HydrophobicContact CD1-CD1 3.67Å; I322-I357 HydrophobicContact CD1-CG1 3.74Å; I322-I357 HydrophobicContact CD1-CG2 3.76Å; L348-I357 HydrophobicContact CD2-CD1 4.08Å; C351-I357 HydrophobicContact CB-CB 4.18Å; C351-I357 HydrophobicContact CB-CD1 3.53Å; C351-I357 HydrophobicContact CB-CG1 3.81Å; C351-I357 PolarHBondContact O-N 3.25Å; I352-I357 HydrophobicContact CG1-CB 4.34Å; I352-I357 HydrophobicContact CG1-CG2 4.33Å; I357-L370 HydrophobicContact CG2-CD2 4.02Å
358	H	88.4	Confident	91.3	Very high	130 Å²	130	69 Å²	69	60%	0.602	35%	0.352	S	S	*	.			trans	-101.3	99.7	174.8	-58	-50.7	0	0	0	110.3	N355 D371	N355-H358 PolarHBondContact O-CE1 3.3Å; H358-D371 PolarHBondContact O-N 3.16Å
359	G	89.8	Confident	91.3	Very high	8 Å²	8	73.2 Å²	73.2	8%	0.082	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.5	-175	179.9	0	0	0	0	0	112.7	E369	G359-E369 CarbonylContact C-O 3.59Å; G359-E369 WeakPolarHBondContact CA-O 3.48Å
360	R	91.8	Very high	91.2	Very high	170 Å²	170	71.1 Å²	71.1	64%	0.642	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.1	144.7	-179.3	-57.5	178.6	-168.3	-171.5	-0.9	109.7	E369	R360-E369 PolarHBondContact N-O 2.77Å; R360-E369 PolarHBondContact O-N 3.22Å
361	I	94.3	Very high	90.7	Very high	46 Å²	46	70.7 Å²	70.7	24%	0.236	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	121.5	178	-54.8	173.8	0	0	0	108.1	I330 E345 L348 V349 I352 L368	I330-I361 HydrophobicContact CD1-CG2 3.89Å; E345-I361 HydrophobicContact CG-CG2 4.47Å; L348-I361 HydrophobicContact CB-CD1 3.67Å; L348-I361 HydrophobicContact CB-CG1 4.34Å; V349-I361 HydrophobicContact CG2-CD1 3.65Å; I352-I361 HydrophobicContact CD1-CD1 3.96Å; I352-I361 HydrophobicContact CD1-CG1 3.73Å; I361-L368 HydrophobicContact CG1-CD1 4.07Å
362	D	93.5	Very high	89.8	Confident	48 Å²	48	77.9 Å²	77.9	26%	0.257	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	94	166.8	-177.9	-14	0	0	0	108.3	V364 N365 Q366 L367	D362-V364 VanDerWaalsContact C-N 3.27Å; D362-V364 PolarHBondContact O-N 3.37Å; D362-V364 PolarHBondContact OD1-N 3.01Å; D362-V364 VanDerWaalsContact OD1-N 3.14Å; D362-N365 PolarHBondContact OD1-N 2.95Å; D362-N365 WeakPolarHBondContact OD2-CB 3.46Å; D362-N365 PolarHBondContact OD2-ND2 3.27Å; D362-Q366 WeakPolarHBondContact O-CA 3.4Å; D362-Q366 PolarHBondContact O-N 2.87Å; D362-L367 HydrophobicContact CB-CB 4.35Å; D362-L367 PolarHBondContact N-O 3.35Å; D362-L367 PolarHBondContact O-N 3.16Å
363	Q	90.9	Very high	88.2	Confident	122 Å²	122	83.1 Å²	83.1	57%	0.57	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-27.4	-177.5	-164.8	176.6	30.5	0	0	112.6	E345 Q366	E345-Q363 WeakPolarHBondContact OE1-CG 3.37Å; E345-Q363 PolarHBondContact OE1-NE2 3.32Å; Q363-Q366 PolarHBondContact O-NE2 3.07Å
364	V	92.3	Very high	86.6	Confident	131 Å²	131	86.9 Å²	86.9	79%	0.794	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-45.9	-178.8	-180	0	0	0	0	110.4	D362	D362-V364 VanDerWaalsContact C-N 3.27Å; D362-V364 PolarHBondContact O-N 3.37Å; D362-V364 PolarHBondContact OD1-N 3.01Å; D362-V364 VanDerWaalsContact OD1-N 3.14Å
365	N	91.4	Very high	85.3	Confident	104 Å²	104	92.2 Å²	92.2	56%	0.556	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	1.7	-179.8	-61.9	-57.9	0	0	0	113.5	D362 L367	D362-N365 PolarHBondContact OD1-N 2.95Å; D362-N365 WeakPolarHBondContact OD2-CB 3.46Å; D362-N365 PolarHBondContact OD2-ND2 3.27Å; N365-L367 PolarHBondContact O-N 3.19Å
366	Q	93.2	Very high	84.3	Confident	54 Å²	54	88.9 Å²	88.9	25%	0.252	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	51.4	-178.8	-69.2	-70.2	-53	0	0	112	I330 P331 V341 D362 Q363	I330-Q366 PolarHBondContact N-O 3.42Å; P331-Q366 HydrophobicContact CG-CB 4.42Å; V341-Q366 VanDerWaalsContact CG1-OE1 3.29Å; D362-Q366 WeakPolarHBondContact O-CA 3.4Å; D362-Q366 PolarHBondContact O-N 2.87Å; Q363-Q366 PolarHBondContact O-NE2 3.07Å
367	L	94.4	Very high	83.6	Confident	10 Å²	10	87.4 Å²	87.4	5%	0.052	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	138.5	-172.9	-163	92.8	0	0	0	110.9	R327 I328 D362 N365	R327-L367 HydrophobicContact CB-CD2 3.95Å; R327-L367 HydrophobicContact CG-CD2 4.08Å; I328-L367 CarbonylContact O-C 3.41Å; I328-L367 WeakPolarHBondContact O-CA 3.31Å; D362-L367 HydrophobicContact CB-CB 4.35Å; D362-L367 PolarHBondContact N-O 3.35Å; D362-L367 PolarHBondContact O-N 3.16Å; N365-L367 PolarHBondContact O-N 3.19Å
368	L	93.5	Very high	83.2	Confident	0 Å²	0	91.2 Å²	91.2	0%	0	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	122.4	166.2	178.7	73.4	0	0	0	108.7	I322 R327 I328 I333 L348 I352 I361 L370	I322-L368 HydrophobicContact CG2-CD2 4.11Å; R327-L368 WeakPolarHBondContact CA-O 3.49Å; I328-L368 HydrophobicContact CG2-CB 3.75Å; I328-L368 HydrophobicContact CG2-CD2 3.94Å; I328-L368 HydrophobicContact CG2-CG 4.28Å; I328-L368 PolarHBondContact N-O 3.41Å; I328-L368 PolarHBondContact O-N 3.23Å; I333-L368 HydrophobicContact CD1-CD2 4.44Å; L348-L368 HydrophobicContact CD1-CD1 4.45Å; L348-L368 HydrophobicContact CD2-CD1 4.1Å; L348-L368 HydrophobicContact CD2-CD2 3.65Å; L348-L368 HydrophobicContact CD2-CG 4.45Å; I352-L368 HydrophobicContact CD1-CD1 4.35Å; I361-L368 HydrophobicContact CG1-CD1 4.07Å; L368-L370 HydrophobicContact CD2-CD2 4.15Å; L368-L370 HydrophobicContact CG-CD2 4.43Å
369	E	92.7	Very high	83.1	Confident	90 Å²	90	94 Å²	94	42%	0.421	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	120.5	176.1	-170.6	165.9	-140.1	0	0	109.5	R327 G359 R360	R327-E369 HydrophobicContact CG-CG 4.18Å; G359-E369 CarbonylContact C-O 3.59Å; G359-E369 WeakPolarHBondContact CA-O 3.48Å; R360-E369 PolarHBondContact N-O 2.77Å; R360-E369 PolarHBondContact O-N 3.22Å
370	L	89.9	Confident	83	Confident	22 Å²	22	101.1 Å²	101.1	12%	0.115	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	136.6	-175.3	-66.9	159.5	0	0	0	110.5	I322 Y325 T326 I357 L368 H372	I322-L370 HydrophobicContact CB-CD1 4.12Å; I322-L370 HydrophobicContact CD1-CD2 4.15Å; I322-L370 WeakPolarHBondContact O-CD1 3.21Å; Y325-L370 WeakPolarHBondContact O-CD1 3.41Å; T326-L370 PolarHBondContact O-N 2.78Å; I357-L370 HydrophobicContact CG2-CD2 4.02Å; L368-L370 HydrophobicContact CD2-CD2 4.15Å; L368-L370 HydrophobicContact CG-CD2 4.43Å; L370-H372 VanDerWaalsContact C-N 3.34Å; L370-H372 PolarHBondContact O-N 3.08Å
371	D	81.8	Confident	82.9	Confident	92 Å²	92	96.9 Å²	96.9	49%	0.492	49%	0.487	S	S	.	.			trans	-74.3	85.9	-177.6	-85.6	-29.4	0	0	0	110.4	H358	H358-D371 PolarHBondContact O-N 3.16Å
372	H	69.7	Low	82.8	Confident	154 Å²	154	97.5 Å²	97.5	71%	0.713	50%	0.499	S	S	*	.			trans	-87.1	-15.5	178.4	-138.9	44.6	0	0	0	113.1	T326 L370 K374	T326-H372 HydrophobicContact CG2-CB 4.23Å; L370-H372 VanDerWaalsContact C-N 3.34Å; L370-H372 PolarHBondContact O-N 3.08Å; H372-K374 PolarHBondContact O-N 2.89Å
373	Q	58.6	Low	82.8	Confident	154 Å²	154	99.1 Å²	99.1	72%	0.72	51%	0.507	S	S	*	.			trans	-98.6	91.3	-179.2	-68.1	-142.5	-20.1	0	0	112.6	R375	Q373-R375 PolarHBondContact O-N 2.98Å
374	K	59.1	Low	82.9	Confident	204 Å²	204	98.3 Å²	98.3	89%	0.887	51%	0.507	S	S	*	.			trans	-69.8	78.2	160.6	-76.2	-176.2	178.4	177.6	0	110.1	H372 G376	H372-K374 PolarHBondContact O-N 2.89Å; K374-G376 PolarHBondContact O-N 3.1Å
375	R	63.1	Low	83.1	Confident	211 Å²	211	99.1 Å²	99.1	80%	0.796	50%	0.5	S	S	*	.			trans	-63.3	129.6	152.8	-70.1	-174.3	-177.7	-172.7	0.7	106.1	Q373 G377	Q373-R375 PolarHBondContact O-N 2.98Å; R375-G377 PolarHBondContact O-N 3.42Å
376	G	65.4	Low	83.3	Confident	45 Å²	45	102 Å²	102	46%	0.464	50%	0.502	S	S	.	.			trans	-63.3	68.5	-165.4	0	0	0	0	0	115.3	K374 A378 R379 Y380	K374-G376 PolarHBondContact O-N 3.1Å; G376-A378 PolarHBondContact O-N 3.05Å; G376-R379 PolarHBondContact O-N 3.18Å; G376-Y380 VanDerWaalsContact O-CD2 3.27Å; G376-Y380 WeakPolarHBondContact O-CD2 3.34Å
377	G	73.5	Confident	83.4	Confident	37 Å²	37	103.2 Å²	103.2	38%	0.381	51%	0.514	S	S	.	.	H	α-helix	trans	-53.6	-39.9	-177.3	0	0	0	0	0	111.9	R375 R379 Y380 T381	R375-G377 PolarHBondContact O-N 3.42Å; G377-R379 PolarHBondContact O-N 3.47Å; G377-R379 VanDerWaalsContact O-N 3.15Å; G377-Y380 PolarHBondContact O-N 3.02Å; G377-T381 PolarHBondContact O-N 3.49Å; G377-T381 PolarHBondContact O-OG1 3.28Å
378	A	79.1	Confident	83.5	Confident	84 Å²	84	107.6 Å²	107.6	69%	0.694	54%	0.538	S	S	*	.	H	α-helix	trans	-53.6	-38	177.3	0	0	0	0	0	113.7	G376 A382	G376-A378 PolarHBondContact O-N 3.05Å; A378-A382 WeakPolarHBondContact O-CB 3.45Å; A378-A382 PolarHBondContact O-N 2.98Å; A378-A382 VanDerWaalsContact O-N 3.1Å
379	R	87	Confident	83.7	Confident	189 Å²	189	114.2 Å²	114.2	71%	0.713	57%	0.568	S	S	*	*	H	α-helix	trans	-70	-44.4	178.2	-175.3	-178.9	-69.9	-179.9	-1.7	111.2	G376 G377 A382 L383	G376-R379 PolarHBondContact O-N 3.18Å; G377-R379 PolarHBondContact O-N 3.47Å; G377-R379 VanDerWaalsContact O-N 3.15Å; R379-A382 PolarHBondContact O-N 3.3Å; R379-L383 HydrophobicContact CG-CD1 4.36Å; R379-L383 WeakPolarHBondContact O-CG 3.38Å; R379-L383 PolarHBondContact O-N 3.29Å; R379-L383 VanDerWaalsContact O-N 3.09Å
380	Y	88.3	Confident	83.8	Confident	157 Å²	157	114 Å²	114	62%	0.616	57%	0.57	S	S	*	*	H	α-helix	trans	-67.1	-41.2	178.7	-63.2	-72.9	0	0	0	111.5	G376 G377 A382 L383 D384	G376-Y380 VanDerWaalsContact O-CD2 3.27Å; G376-Y380 WeakPolarHBondContact O-CD2 3.34Å; G377-Y380 PolarHBondContact O-N 3.02Å; Y380-A382 VanDerWaalsContact C-N 3.31Å; Y380-A382 PolarHBondContact O-N 3.14Å; Y380-L383 PolarHBondContact O-N 3.19Å; Y380-D384 PolarHBondContact O-N 2.95Å
381	T	89.5	Confident	84.1	Confident	80 Å²	80	117.1 Å²	117.1	49%	0.491	59%	0.587	S	S	.	*	H	α-helix	trans	-62.4	-37.5	175.7	-45.8	0	0	0	0	112.1	G377 K385	G377-T381 PolarHBondContact O-N 3.49Å; G377-T381 PolarHBondContact O-OG1 3.28Å; T381-K385 WeakPolarHBondContact O-CG 3.1Å; T381-K385 PolarHBondContact O-N 3.47Å
382	A	91.2	Very high	84.8	Confident	59 Å²	59	115.3 Å²	115.3	49%	0.488	58%	0.581	S	S	.	*	H	α-helix	trans	-66.8	-42.2	175.2	0	0	0	0	0	112.2	A378 R379 Y380 K385 W386	A378-A382 WeakPolarHBondContact O-CB 3.45Å; A378-A382 PolarHBondContact O-N 2.98Å; A378-A382 VanDerWaalsContact O-N 3.1Å; R379-A382 PolarHBondContact O-N 3.3Å; Y380-A382 VanDerWaalsContact C-N 3.31Å; Y380-A382 PolarHBondContact O-N 3.14Å; A382-K385 PolarHBondContact O-N 3.14Å; A382-W386 PolarHBondContact O-N 3.43Å
383	L	93.9	Very high	85.9	Confident	82 Å²	82	113.1 Å²	113.1	43%	0.429	57%	0.574	S	S	.	*	H	α-helix	trans	-63.7	-41.3	175.9	-74.5	167.9	0	0	0	112.1	R379 Y380 W386 T387	R379-L383 HydrophobicContact CG-CD1 4.36Å; R379-L383 WeakPolarHBondContact O-CG 3.38Å; R379-L383 PolarHBondContact O-N 3.29Å; R379-L383 VanDerWaalsContact O-N 3.09Å; Y380-L383 PolarHBondContact O-N 3.19Å; L383-W386 HydrophobicContact CD2-CE3 4.34Å; L383-W386 PolarHBondContact O-N 3.06Å; L383-T387 WeakPolarHBondContact O-CB 3.48Å; L383-T387 PolarHBondContact O-N 3.5Å; L383-T387 PolarHBondContact O-OG1 3.22Å
384	D	93.9	Very high	87.7	Confident	106 Å²	106	110.3 Å²	110.3	57%	0.567	56%	0.564	S	S	*	*	H	α-helix	trans	-62.9	-45.1	175.4	-96	-7.2	0	0	0	111.8	Y380 W386 T387 N388	Y380-D384 PolarHBondContact O-N 2.95Å; D384-W386 VanDerWaalsContact C-N 3.31Å; D384-W386 PolarHBondContact O-N 2.87Å; D384-T387 PolarHBondContact O-N 2.89Å; D384-N388 WeakPolarHBondContact O-CB 3.48Å; D384-N388 PolarHBondContact O-N 3.42Å; D384-N388 PolarHBondContact O-ND2 3.25Å
385	K	94.9	Very high	89.4	Confident	148 Å²	148	106.7 Å²	106.7	64%	0.643	55%	0.55	S	S	*	*	H	α-helix	trans	-58	-45.5	175.2	-79.4	-175	178.9	-176	0	111.3	T381 A382 N388 Q389	T381-K385 WeakPolarHBondContact O-CG 3.1Å; T381-K385 PolarHBondContact O-N 3.47Å; A382-K385 PolarHBondContact O-N 3.14Å; K385-N388 PolarHBondContact O-N 3.06Å; K385-Q389 VanDerWaalsContact O-CG 3.3Å; K385-Q389 WeakPolarHBondContact O-CG 3.33Å; K385-Q389 PolarHBondContact O-N 3.16Å; K385-Q389 VanDerWaalsContact O-N 3.09Å
386	W	96	Very high	90.8	Very high	163 Å²	163	99 Å²	99	62%	0.617	53%	0.532	S	S	*	.	H	α-helix	trans	-64.7	-42.6	179.2	-171.8	27.9	0	0	0	112	A382 L383 D384 N388 Q389 L390	A382-W386 PolarHBondContact O-N 3.43Å; L383-W386 HydrophobicContact CD2-CE3 4.34Å; L383-W386 PolarHBondContact O-N 3.06Å; D384-W386 VanDerWaalsContact C-N 3.31Å; D384-W386 PolarHBondContact O-N 2.87Å; W386-N388 PolarHBondContact O-N 3.44Å; W386-Q389 PolarHBondContact O-N 3.44Å; W386-L390 HydrophobicContact CD2-CD1 4.18Å; W386-L390 HydrophobicContact CG-CD1 4.28Å; W386-L390 HydrophobicContact CZ2-CD1 4.28Å; W386-L390 WeakPolarHBondContact O-CG 3.43Å; W386-L390 PolarHBondContact O-N 3.42Å
387	T	96.9	Very high	92.1	Very high	80 Å²	80	100.4 Å²	100.4	49%	0.491	53%	0.531	S	S	.	.	H	α-helix	trans	-60.7	-44.2	177.6	-55	0	0	0	0	111.4	L383 D384 Q389 L390 N391	L383-T387 WeakPolarHBondContact O-CB 3.48Å; L383-T387 PolarHBondContact O-N 3.5Å; L383-T387 PolarHBondContact O-OG1 3.22Å; D384-T387 PolarHBondContact O-N 2.89Å; T387-Q389 PolarHBondContact O-N 3.17Å; T387-L390 PolarHBondContact O-N 3.37Å; T387-N391 WeakPolarHBondContact O-CB 3.5Å; T387-N391 PolarHBondContact O-N 3.42Å
388	N	96	Very high	93.1	Very high	103 Å²	103	102.9 Å²	102.9	55%	0.551	54%	0.539	S	S	*	.	H	α-helix	trans	-64.5	-39.6	177.7	-73.7	-29.5	0	0	0	112.7	D384 K385 W386 N391 S392	D384-N388 WeakPolarHBondContact O-CB 3.48Å; D384-N388 PolarHBondContact O-N 3.42Å; D384-N388 PolarHBondContact O-ND2 3.25Å; K385-N388 PolarHBondContact O-N 3.06Å; W386-N388 PolarHBondContact O-N 3.44Å; N388-N391 PolarHBondContact O-N 3.46Å; N388-S392 PolarHBondContact O-N 3.16Å; N388-S392 PolarHBondContact O-OG 3.36Å
389	Q	96.3	Very high	93.7	Very high	138 Å²	138	102.8 Å²	102.8	65%	0.645	53%	0.533	S	S	*	.	H	α-helix	trans	-67.3	-41.1	176.1	-70.4	-66.6	-31.4	0	0	112.1	K385 W386 T387 N391 S392 L393	K385-Q389 VanDerWaalsContact O-CG 3.3Å; K385-Q389 WeakPolarHBondContact O-CG 3.33Å; K385-Q389 PolarHBondContact O-N 3.16Å; K385-Q389 VanDerWaalsContact O-N 3.09Å; W386-Q389 PolarHBondContact O-N 3.44Å; T387-Q389 PolarHBondContact O-N 3.17Å; Q389-N391 VanDerWaalsContact C-N 3.33Å; Q389-N391 PolarHBondContact O-N 2.94Å; Q389-S392 WeakPolarHBondContact CA-OG 3.42Å; Q389-S392 PolarHBondContact O-N 2.95Å; Q389-S392 PolarHBondContact O-OG 3.14Å; Q389-S392 VanDerWaalsContact O-OG 3.05Å; Q389-L393 WeakPolarHBondContact O-CB 3.43Å; Q389-L393 PolarHBondContact O-N 3.12Å
390	L	96.3	Very high	93.7	Very high	86 Å²	86	102.7 Å²	102.7	45%	0.45	54%	0.538	S	S	.	.	H	α-helix	trans	-64	-39.2	174.5	-77.1	170.2	0	0	0	112	W386 T387 L393 N394	W386-L390 HydrophobicContact CD2-CD1 4.18Å; W386-L390 HydrophobicContact CG-CD1 4.28Å; W386-L390 HydrophobicContact CZ2-CD1 4.28Å; W386-L390 WeakPolarHBondContact O-CG 3.43Å; W386-L390 PolarHBondContact O-N 3.42Å; T387-L390 PolarHBondContact O-N 3.37Å; L390-L393 PolarHBondContact O-N 3.45Å; L390-N394 WeakPolarHBondContact O-CB 3.15Å; L390-N394 PolarHBondContact O-N 2.99Å
391	N	96.1	Very high	93.1	Very high	88 Å²	88	102.2 Å²	102.2	47%	0.471	55%	0.545	S	S	.	.	H	α-helix	trans	-68	-41.3	-179.9	-155.4	11.9	0	0	0	111.9	T387 N388 Q389 N394 Q395	T387-N391 WeakPolarHBondContact O-CB 3.5Å; T387-N391 PolarHBondContact O-N 3.42Å; N388-N391 PolarHBondContact O-N 3.46Å; Q389-N391 VanDerWaalsContact C-N 3.33Å; Q389-N391 PolarHBondContact O-N 2.94Å; N391-N394 PolarHBondContact O-N 2.73Å; N391-Q395 WeakPolarHBondContact O-CG 3.41Å; N391-Q395 PolarHBondContact O-N 3.43Å
392	S	95	Very high	91.4	Very high	54 Å²	54	104.9 Å²	104.9	38%	0.378	58%	0.575	S	S	.	*	H	α-helix	trans	-67.6	-38.1	174.7	38.4	0	0	0	0	112.4	N388 Q389 Q395 A396	N388-S392 PolarHBondContact O-N 3.16Å; N388-S392 PolarHBondContact O-OG 3.36Å; Q389-S392 WeakPolarHBondContact CA-OG 3.42Å; Q389-S392 PolarHBondContact O-N 2.95Å; Q389-S392 PolarHBondContact O-OG 3.14Å; Q389-S392 VanDerWaalsContact O-OG 3.05Å; S392-Q395 PolarHBondContact O-N 3.03Å; S392-A396 PolarHBondContact O-N 3.31Å
393	L	94.8	Very high	91.4	Very high	108 Å²	108	107.2 Å²	107.2	57%	0.565	58%	0.58	S	S	*	*	H	α-helix	trans	-61.2	-45.5	171.9	-176.9	67.8	0	0	0	111.6	Q389 L390 Q395 A396 V397	Q389-L393 WeakPolarHBondContact O-CB 3.43Å; Q389-L393 PolarHBondContact O-N 3.12Å; L390-L393 PolarHBondContact O-N 3.45Å; L393-Q395 PolarHBondContact O-N 3.12Å; L393-A396 PolarHBondContact O-N 3.05Å; L393-V397 WeakPolarHBondContact O-CG2 3.42Å; L393-V397 PolarHBondContact O-N 3.48Å
394	N	94.9	Very high	91.3	Very high	94 Å²	94	108.5 Å²	108.5	50%	0.503	59%	0.588	S	S	.	*	H	α-helix	trans	-59.1	-47.1	177.9	-175.4	25.3	0	0	0	111.5	L390 N391 A396 V397 V398	L390-N394 WeakPolarHBondContact O-CB 3.15Å; L390-N394 PolarHBondContact O-N 2.99Å; N391-N394 PolarHBondContact O-N 2.73Å; N394-A396 VanDerWaalsContact C-N 3.31Å; N394-A396 PolarHBondContact O-N 2.73Å; N394-V397 PolarHBondContact O-N 3Å; N394-V398 WeakPolarHBondContact O-CG2 3.46Å; N394-V398 PolarHBondContact O-N 3.17Å
395	Q	94.3	Very high	91.2	Very high	129 Å²	129	108.7 Å²	108.7	60%	0.603	59%	0.589	S	S	*	*	H	α-helix	trans	-58.7	-40.6	175.6	-72.8	178.4	-3	0	0	112.6	N391 S392 L393 S399	N391-Q395 WeakPolarHBondContact O-CG 3.41Å; N391-Q395 PolarHBondContact O-N 3.43Å; S392-Q395 PolarHBondContact O-N 3.03Å; L393-Q395 PolarHBondContact O-N 3.12Å; Q395-S399 WeakPolarHBondContact O-CB 3.15Å; Q395-S399 PolarHBondContact O-N 2.96Å; Q395-S399 PolarHBondContact O-OG 3.16Å
396	A	93.6	Very high	90.9	Very high	49 Å²	49	106.4 Å²	106.4	41%	0.405	59%	0.586	S	S	.	*	H	α-helix	trans	-69.9	-29.8	178.2	0	0	0	0	0	113.7	S392 L393 N394 S399	S392-A396 PolarHBondContact O-N 3.31Å; L393-A396 PolarHBondContact O-N 3.05Å; N394-A396 VanDerWaalsContact C-N 3.31Å; N394-A396 PolarHBondContact O-N 2.73Å; A396-S399 PolarHBondContact O-OG 3.47Å; A396-S399 VanDerWaalsContact O-OG 3.06Å
397	V	93.3	Very high	90.6	Very high	75 Å²	75	102.8 Å²	102.8	46%	0.455	58%	0.584	S	S	.	*	H	α-helix	trans	-74.2	-44.9	174.5	172.1	0	0	0	0	110.4	L393 N394 S399 K400 L401	L393-V397 WeakPolarHBondContact O-CG2 3.42Å; L393-V397 PolarHBondContact O-N 3.48Å; N394-V397 PolarHBondContact O-N 3Å; V397-S399 VanDerWaalsContact C-N 3.31Å; V397-S399 PolarHBondContact O-N 3.1Å; V397-K400 PolarHBondContact O-N 3.11Å; V397-L401 HydrophobicContact CG1-CD1 4.22Å; V397-L401 PolarHBondContact O-N 3.46Å
398	V	94	Very high	90.2	Very high	89 Å²	89	104.3 Å²	104.3	54%	0.539	59%	0.59	S	S	.	*	H	α-helix	trans	-61.8	-39.7	178.7	173	0	0	0	0	111.3	N394 K400 L401 A402	N394-V398 WeakPolarHBondContact O-CG2 3.46Å; N394-V398 PolarHBondContact O-N 3.17Å; V398-K400 PolarHBondContact O-N 3.21Å; V398-L401 PolarHBondContact O-N 3.18Å; V398-L401 VanDerWaalsContact O-N 3.15Å; V398-A402 PolarHBondContact O-N 2.96Å
399	S	91.4	Very high	89.8	Confident	82 Å²	82	104.4 Å²	104.4	57%	0.573	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-13.8	179.1	66	0	0	0	0	115	Q395 A396 V397	Q395-S399 WeakPolarHBondContact O-CB 3.15Å; Q395-S399 PolarHBondContact O-N 2.96Å; Q395-S399 PolarHBondContact O-OG 3.16Å; A396-S399 PolarHBondContact O-OG 3.47Å; A396-S399 VanDerWaalsContact O-OG 3.06Å; V397-S399 VanDerWaalsContact C-N 3.31Å; V397-S399 PolarHBondContact O-N 3.1Å
400	K	87.8	Confident	89.3	Confident	186 Å²	186	101.8 Å²	101.8	81%	0.809	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	-12.4	172.8	-73.3	-161.6	177.1	-168.6	0	113.9	V397 V398	V397-K400 PolarHBondContact O-N 3.11Å; V398-K400 PolarHBondContact O-N 3.21Å
401	L	74.4	Confident	88.7	Confident	147 Å²	147	103.2 Å²	103.2	77%	0.77	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	-19.1	-178	-109.6	138.8	0	0	0	112.7	V397 V398	V397-L401 HydrophobicContact CG1-CD1 4.22Å; V397-L401 PolarHBondContact O-N 3.46Å; V398-L401 PolarHBondContact O-N 3.18Å; V398-L401 VanDerWaalsContact O-N 3.15Å
402	A	55	Low	88	Confident	137 Å²	137	104.5 Å²	104.5	100%	1.132	61%	0.612	S	S	*	*			trans	-88.6	0	161.3	0	0	0	0	0	109.5	V398	V398-A402 PolarHBondContact O-N 2.96Å

Retrieved 402 of 402 residues in 153.8 ms (Link to these results)

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