A0A077ZA98_TRITR Loading...

Ribosomal protein S5

AlphaFold DB , UniProt , Accession A0A077ZA98, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 231 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	41.1	Very low	41.1	Very low	244 Å²	244	143.5 Å²	143.5	100%	1.202	80%	0.8	S	S	*	*				0	117.5	0	-152	-179.8	-159.5	0	0	106.5
2	A	37.9	Very low	41.1	Very low	81 Å²	81	146.9 Å²	146.9	67%	0.669	81%	0.805	S	S	*	*			trans	57.8	111.4	176.2	0	0	0	0	0	117.5
3	F	40.4	Very low	41.1	Very low	182 Å²	182	149.5 Å²	149.5	80%	0.798	81%	0.808	S	S	*	*				63.5	154.8	69.1	-91.7	-93.5	0	0	0	114.6
4	Y	43.1	Very low	40.8	Very low	211 Å²	211	149.8 Å²	149.8	83%	0.827	80%	0.802	S	S	*	*			trans	94.1	86.5	-174.2	-52.4	-64.8	0	0	0	113
5	D	38.7	Very low	40.9	Very low	142 Å²	142	148.7 Å²	148.7	76%	0.759	80%	0.802	S	S	*	*			cis	65.5	127.1	39.9	-132.3	9.6	0	0	0	113.1
6	A	49.5	Very low	40.6	Very low	81 Å²	81	149.5 Å²	149.5	67%	0.669	80%	0.796	S	S	*	*			trans	139.7	89.2	161.9	0	0	0	0	0	111.1
7	T	45.2	Very low	40.4	Very low	118 Å²	118	146.1 Å²	146.1	72%	0.724	78%	0.784	S	S	*	*				77.7	120.5	95.4	54.8	0	0	0	0	115.7
8	M	38.6	Very low	40.6	Very low	156 Å²	156	143.5 Å²	143.5	77%	0.768	79%	0.786	S	S	*	*			trans	70.6	112.4	137	-57.1	-81.9	156	0	0	117.2
9	D	41.2	Very low	40.8	Very low	160 Å²	160	141.3 Å²	141.3	86%	0.856	78%	0.782	S	S	*	*				-166.8	103.1	113.7	-89	-19.8	0	0	0	108.9	G11	D9-G11 PolarHBondContact O-N 2.87Å
10	T	36	Very low	40.6	Very low	138 Å²	138	142.9 Å²	142.9	85%	0.847	78%	0.784	S	S	*	*			trans	-66.5	84.5	163.3	42.1	0	0	0	0	107.7	E12	T10-E12 PolarHBondContact O-N 2.78Å; T10-E12 VanDerWaalsContact O-N 3.14Å
11	G	40.9	Very low	41	Very low	66 Å²	66	142.6 Å²	142.6	68%	0.68	78%	0.78	S	S	*	*			trans	-61.5	112.4	173.8	0	0	0	0	0	109.9	D9 Q13	D9-G11 PolarHBondContact O-N 2.87Å; G11-Q13 PolarHBondContact O-N 2.86Å; G11-Q13 VanDerWaalsContact O-N 3.11Å
12	E	40.5	Very low	41.8	Very low	184 Å²	184	137.5 Å²	137.5	86%	0.86	76%	0.757	S	S	*	*			trans	-48.9	114.8	166.1	-70.4	178	147.2	0	0	109.1	T10 Q14	T10-E12 PolarHBondContact O-N 2.78Å; T10-E12 VanDerWaalsContact O-N 3.14Å; E12-Q14 PolarHBondContact O-N 3.17Å
13	Q	41.8	Very low	43.3	Very low	180 Å²	180	139.2 Å²	139.2	84%	0.841	76%	0.755	S	S	*	*			trans	-66.5	102.3	168.1	-75.3	179.9	-16.1	0	0	107.8	G11 V15	G11-Q13 PolarHBondContact O-N 2.86Å; G11-Q13 VanDerWaalsContact O-N 3.11Å; Q13-V15 PolarHBondContact O-N 3.31Å
14	Q	36.4	Very low	45.3	Very low	154 Å²	154	132.7 Å²	132.7	72%	0.72	73%	0.728	S	S	*	*			trans	-60.2	103.9	167.2	-72.1	-173.5	-9.2	0	0	109.1	E12 F16	E12-Q14 PolarHBondContact O-N 3.17Å; Q14-F16 HydrophobicContact CB-CE2 4.29Å; Q14-F16 PolarHBondContact O-N 3.16Å
15	V	41.8	Very low	47.3	Very low	133 Å²	133	126.9 Å²	126.9	81%	0.806	71%	0.707	S	S	*	*			trans	-78.7	98.8	170.2	-175.9	0	0	0	0	107.3	Q13	Q13-V15 PolarHBondContact O-N 3.31Å
16	F	37.2	Very low	49.6	Very low	162 Å²	162	120.4 Å²	120.4	71%	0.711	67%	0.673	S	S	*	*			trans	-63.7	128	171	-69.9	-87.1	0	0	0	109.5	Q14 A18	Q14-F16 HydrophobicContact CB-CE2 4.29Å; Q14-F16 PolarHBondContact O-N 3.16Å; F16-A18 PolarHBondContact O-N 3.37Å
17	P	36.2	Very low	51.4	Low	92 Å²	92	118 Å²	118	60%	0.597	65%	0.647	S	S	*	*			trans	-63.5	130	175.8	27.2	-32.8	0	0	0	109	S19	P17-S19 PolarHBondContact O-N 3.49Å
18	A	44.8	Very low	53.3	Low	99 Å²	99	114.8 Å²	114.8	82%	0.818	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	14.4	-179.2	0	0	0	0	0	114.7	F16	F16-A18 PolarHBondContact O-N 3.37Å
19	S	44.4	Very low	55.7	Low	101 Å²	101	113 Å²	113	71%	0.706	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	-1.3	-175.6	53	0	0	0	0	114.5	P17	P17-S19 PolarHBondContact O-N 3.49Å
20	E	36.2	Very low	58	Low	174 Å²	174	106.6 Å²	106.6	81%	0.813	59%	0.59	S	S	*	*			trans	-109.2	65.9	164.3	-72.2	-171.6	174.2	0	0	110.4	L22	E20-L22 PolarHBondContact O-N 2.86Å
21	L	49.5	Very low	60.6	Low	136 Å²	136	102.2 Å²	102.2	71%	0.712	56%	0.563	S	S	*	*			trans	-63.7	96.6	154.6	-77.4	170.4	0	0	0	106.2	N23	L21-N23 WeakPolarHBondContact O-CA 3.44Å; L21-N23 PolarHBondContact O-N 3.43Å
22	L	58.4	Low	62.7	Low	137 Å²	137	99.5 Å²	99.5	72%	0.717	53%	0.533	S	S	*	.			trans	-20.7	95.4	172.1	-72.9	165.2	0	0	0	111	E20 I24	E20-L22 PolarHBondContact O-N 2.86Å; L22-I24 WeakPolarHBondContact O-CA 3.37Å; L22-I24 WeakPolarHBondContact O-CG1 3.26Å; L22-I24 PolarHBondContact O-N 3.14Å
23	N	69.2	Low	64.7	Low	118 Å²	118	95.3 Å²	95.3	63%	0.631	52%	0.517	S	S	*	.			trans	-41.6	98.7	-165.5	-79.3	-39.8	0	0	0	111.5	L21 K25	L21-N23 WeakPolarHBondContact O-CA 3.44Å; L21-N23 PolarHBondContact O-N 3.43Å; N23-K25 PolarHBondContact O-N 3.19Å
24	I	81.3	Confident	66.7	Low	45 Å²	45	91.4 Å²	91.4	23%	0.231	51%	0.505	C	S	.	.			trans	-79.1	95.4	-169.2	-56.8	179.3	0	0	0	107.4	L22 A53 Y55	L22-I24 WeakPolarHBondContact O-CA 3.37Å; L22-I24 WeakPolarHBondContact O-CG1 3.26Å; L22-I24 PolarHBondContact O-N 3.14Å; I24-A53 HydrophobicContact CB-CB 3.97Å; I24-A53 HydrophobicContact CD1-CB 4.14Å; I24-A53 HydrophobicContact CG2-CB 3.98Å; I24-Y55 HydrophobicContact CG2-CD1 4.19Å; I24-Y55 HydrophobicContact CG2-CD2 4.3Å; I24-Y55 HydrophobicContact CG2-CE1 4.1Å; I24-Y55 HydrophobicContact CG2-CE2 4.21Å; I24-Y55 HydrophobicContact CG2-CG 4.29Å
25	K	85.5	Confident	69	Low	89 Å²	89	84.1 Å²	84.1	39%	0.387	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	126.4	176.1	-63.6	-179	-175.3	179.8	0	110.4	N23 F27 G28 W30 Y55	N23-K25 PolarHBondContact O-N 3.19Å; K25-F27 PolarHBondContact O-N 3.26Å; K25-G28 PolarHBondContact O-N 3.4Å; K25-W30 CarbonylContact C-O 3.5Å; K25-W30 WeakPolarHBondContact CA-O 3.45Å; K25-Y55 WeakPolarHBondContact O-CD1 3.44Å
26	L	87.4	Confident	71.2	Confident	6 Å²	6	82.1 Å²	82.1	3%	0.031	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	131.4	171.9	-177.6	72	0	0	0	109.8	G28 K29 W30 L32 K54 V76 F104 V116	L26-G28 PolarHBondContact O-N 3.16Å; L26-K29 PolarHBondContact O-N 3.14Å; L26-K29 VanDerWaalsContact O-N 3.11Å; L26-W30 HydrophobicContact CB-CB 4.33Å; L26-W30 PolarHBondContact N-O 3.24Å; L26-W30 PolarHBondContact O-N 3.44Å; L26-L32 HydrophobicContact CB-CD1 4.4Å; L26-L32 HydrophobicContact CB-CD2 4.17Å; L26-L32 HydrophobicContact CB-CG 4.32Å; L26-K54 WeakPolarHBondContact CD1-O 3.46Å; L26-V76 HydrophobicContact CD2-CB 4.49Å; L26-V76 HydrophobicContact CD2-CG1 4.33Å; L26-V76 HydrophobicContact CD2-CG2 3.82Å; L26-F104 HydrophobicContact CD2-CD2 4.24Å; L26-F104 HydrophobicContact CD2-CE2 3.75Å; L26-V116 HydrophobicContact CD2-CG2 3.75Å
27	F	88.1	Confident	73.6	Confident	29 Å²	29	75.8 Å²	75.8	13%	0.127	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	18.1	-171.6	-59.2	-64.7	0	0	0	114.4	K25 K29 Y55 L56 P57 V100 R101 F104	K25-F27 PolarHBondContact O-N 3.26Å; F27-K29 PolarHBondContact O-N 3.4Å; F27-Y55 WeakPolarHBondContact CA-O 3.2Å; F27-Y55 PolarHBondContact N-O 2.96Å; F27-L56 HydrophobicContact CD1-CD2 3.97Å; F27-L56 HydrophobicContact CE1-CD2 4.27Å; F27-P57 HydrophobicContact CE1-CG 4.01Å; F27-P57 HydrophobicContact CZ-CG 3.69Å; F27-V100 HydrophobicContact CE2-CG1 4.5Å; F27-V100 HydrophobicContact CZ-CG1 4.5Å; F27-R101 HydrophobicContact CD1-CG 4.26Å; F27-R101 HydrophobicContact CE1-CB 4.18Å; F27-R101 HydrophobicContact CE1-CG 4.41Å; F27-R101 HydrophobicContact CE2-CB 4.46Å; F27-R101 HydrophobicContact CG-CG 4.33Å; F27-R101 HydrophobicContact CZ-CB 4.14Å; F27-F104 HydrophobicContact CD2-CD2 4.25Å; F27-F104 AromaticContact CE2-CD2 3.87Å; F27-F104 HydrophobicContact CE2-CD2 3.87Å; F27-F104 HydrophobicContact CE2-CE2 4.23Å
28	G	84.8	Confident	75.9	Confident	52 Å²	52	77.3 Å²	77.3	54%	0.536	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	74	-5.8	-174.2	0	0	0	0	0	115	K25 L26	K25-G28 PolarHBondContact O-N 3.4Å; L26-G28 PolarHBondContact O-N 3.16Å
29	K	87.8	Confident	77.8	Confident	117 Å²	117	74.1 Å²	74.1	51%	0.509	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-43.1	-175	-63.2	-177.7	-178.8	-179.2	0	112.7	L26 F27 E105	L26-K29 PolarHBondContact O-N 3.14Å; L26-K29 VanDerWaalsContact O-N 3.11Å; F27-K29 PolarHBondContact O-N 3.4Å; K29-E105 IonicContact NZ-OE1 3.16Å; K29-E105 PolarHBondContact NZ-OE1 3.15Å
30	W	90.3	Very high	79.9	Confident	27 Å²	27	76.7 Å²	76.7	10%	0.102	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	117.4	-165.4	-48.7	113.2	0	0	0	112.2	K25 L26 H108 P115 V116	K25-W30 CarbonylContact C-O 3.5Å; K25-W30 WeakPolarHBondContact CA-O 3.45Å; L26-W30 HydrophobicContact CB-CB 4.33Å; L26-W30 PolarHBondContact N-O 3.24Å; L26-W30 PolarHBondContact O-N 3.44Å; W30-H108 HydrophobicContact CH2-CB 3.31Å; W30-H108 AromaticContact CH2-CD2 3.35Å; W30-H108 WeakPolarHBondContact CH2-CD2 3.42Å; W30-H108 AromaticContact CH2-CG 3.14Å; W30-H108 AromaticContact CH2-ND1 3.69Å; W30-H108 AromaticContact CH2-NE2 3.94Å; W30-H108 HydrophobicContact CZ2-CB 3.93Å; W30-H108 HydrophobicContact CZ3-CB 3.92Å; W30-H108 AromaticContact CZ3-CD2 3.78Å; W30-H108 AromaticContact CZ3-CE1 3.75Å; W30-H108 AromaticContact CZ3-CG 3.43Å; W30-H108 VanDerWaalsContact CZ3-CG 3.43Å; W30-H108 AromaticContact CZ3-ND1 3.43Å; W30-H108 WeakPolarHBondContact CZ3-ND1 3.19Å; W30-H108 AromaticContact CZ3-NE2 3.93Å; W30-P115 HydrophobicContact CD2-CG 3.56Å; W30-P115 VanDerWaalsContact CE3-CD 3.46Å; W30-P115 HydrophobicContact CE3-CG 3.96Å; W30-P115 HydrophobicContact CG-CG 3.93Å; W30-P115 HydrophobicContact CH2-CG 4.46Å; W30-P115 HydrophobicContact CZ2-CG 4.05Å; W30-P115 HydrophobicContact CZ3-CG 4.4Å; W30-V116 HydrophobicContact CB-CG2 4.48Å
31	P	89.2	Confident	82.4	Confident	45 Å²	45	70.8 Å²	70.8	29%	0.292	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	141	173.5	29.2	-33.2	0	0	0	110.6	N114	P31-N114 PolarHBondContact O-ND2 3.44Å
32	L	85.8	Confident	84.3	Confident	10 Å²	10	64.3 Å²	64.3	5%	0.052	35%	0.35	C	S	.	.	S	Bend	trans	-97	-17.3	178.7	-68.1	171.2	0	0	0	112.9	L26 T34 V35 V48 A53 V116	L26-L32 HydrophobicContact CB-CD1 4.4Å; L26-L32 HydrophobicContact CB-CD2 4.17Å; L26-L32 HydrophobicContact CB-CG 4.32Å; L32-T34 VanDerWaalsContact C-N 3.35Å; L32-T34 PolarHBondContact O-N 3.22Å; L32-V35 PolarHBondContact O-N 3.46Å; L32-V48 HydrophobicContact CB-CG1 4.48Å; L32-V48 HydrophobicContact CD2-CG1 4.04Å; L32-A53 HydrophobicContact CD1-CB 3.62Å; L32-V116 HydrophobicContact CD2-CB 4.45Å; L32-V116 HydrophobicContact CD2-CG1 3.96Å; L32-V116 HydrophobicContact CD2-CG2 4.03Å
33	D	82.2	Confident	85.8	Confident	95 Å²	95	61.9 Å²	61.9	51%	0.508	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-31.8	-174.1	-52.3	-45.4	0	0	0	112.6	V35	D33-V35 PolarHBondContact O-N 3.14Å
34	T	83.5	Confident	86.7	Confident	99 Å²	99	62.6 Å²	62.6	61%	0.607	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-2.9	179.5	-37.9	0	0	0	0	113.5	L32 D36	L32-T34 VanDerWaalsContact C-N 3.35Å; L32-T34 PolarHBondContact O-N 3.22Å; T34-D36 PolarHBondContact O-N 3.11Å
35	V	86.3	Confident	87.1	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	34%	0.342	C	S	.	.			trans	-84	116.7	-173.9	-178.9	0	0	0	0	110.3	L32 D33 V48 K49 V116 Q117 V120	L32-V35 PolarHBondContact O-N 3.46Å; D33-V35 PolarHBondContact O-N 3.14Å; V35-V48 HydrophobicContact CB-CG1 3.91Å; V35-V48 HydrophobicContact CG1-CG1 4Å; V35-V48 HydrophobicContact CG2-CG1 4.18Å; V35-K49 WeakPolarHBondContact O-CE 3.34Å; V35-K49 PolarHBondContact O-NZ 3.48Å; V35-K49 VanDerWaalsContact O-NZ 3.12Å; V35-V116 HydrophobicContact CG1-CG1 4.28Å; V35-V116 HydrophobicContact CG2-CB 3.94Å; V35-V116 HydrophobicContact CG2-CG1 3.81Å; V35-Q117 VanDerWaalsContact CA-OE1 3.3Å; V35-V120 HydrophobicContact CG1-CB 4.41Å; V35-V120 HydrophobicContact CG1-CG2 3.88Å
36	D	86.7	Confident	87.4	Confident	91 Å²	91	59.3 Å²	59.3	49%	0.487	32%	0.324	S	S	.	.			trans	-104.4	141.5	179.3	-69.8	-35.5	0	0	0	112.5	T34 K49 Q117	T34-D36 PolarHBondContact O-N 3.11Å; D36-K49 IonicContact OD1-NZ 2.7Å; D36-K49 PolarHBondContact OD1-NZ 3.2Å; D36-K49 VanDerWaalsContact OD1-NZ 3.16Å; D36-Q117 PolarHBondContact O-NE2 3.25Å; D36-Q117 PolarHBondContact O-OE1 3.05Å
37	I	87.2	Confident	87.3	Confident	30 Å²	30	59.4 Å²	59.4	15%	0.154	33%	0.326	C	S	.	.			trans	-109.2	107.7	-179	-59.8	164.4	0	0	0	107.4	D39 N43 I46 V120 I124	I37-D39 VanDerWaalsContact C-N 3.35Å; I37-D39 PolarHBondContact O-N 3.22Å; I37-N43 WeakPolarHBondContact CD1-OD1 3.45Å; I37-I46 HydrophobicContact CD1-CB 4.04Å; I37-I46 HydrophobicContact CD1-CG2 3.95Å; I37-I46 HydrophobicContact CG1-CG2 4.41Å; I37-I46 HydrophobicContact CG2-CD1 4.42Å; I37-V120 HydrophobicContact CG1-CG1 4.03Å; I37-I124 HydrophobicContact CG2-CD1 4.25Å
38	N	84.5	Confident	87	Confident	124 Å²	124	58.4 Å²	58.4	66%	0.663	32%	0.322	S	S	*	.			trans	-72.5	-24.6	-175.6	-63.3	-34.4	0	0	0	113.8
39	D	84.7	Confident	86.8	Confident	31 Å²	31	59.7 Å²	59.7	17%	0.166	31%	0.313	C	S	.	.			trans	-100.2	110.5	-177.6	-172.6	-14.6	0	0	0	111.2	I37 S41 L42 N43 I124 R153	I37-D39 VanDerWaalsContact C-N 3.35Å; I37-D39 PolarHBondContact O-N 3.22Å; D39-S41 PolarHBondContact O-N 3.26Å; D39-S41 WeakPolarHBondContact OD1-CB 3.36Å; D39-S41 PolarHBondContact OD1-N 2.95Å; D39-S41 PolarHBondContact OD1-OG 2.8Å; D39-S41 PolarHBondContact OD2-OG 3.46Å; D39-L42 HydrophobicContact CB-CB 4.47Å; D39-L42 HydrophobicContact CB-CD1 4.17Å; D39-L42 HydrophobicContact CB-CG 4.4Å; D39-L42 PolarHBondContact O-N 2.84Å; D39-L42 VanDerWaalsContact O-N 3.08Å; D39-N43 PolarHBondContact O-N 3.48Å; D39-I124 HydrophobicContact CB-CG1 4.49Å; D39-I124 HydrophobicContact CB-CG2 3.95Å; D39-R153 IonicContact OD2-NH1 2.86Å
40	I	89.3	Confident	86.4	Confident	156 Å²	156	61.2 Å²	61.2	80%	0.8	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-54.6	-35.6	179	-56.7	170.3	0	0	0	111.2	L42	I40-L42 PolarHBondContact O-N 3.4Å
41	S	88.3	Confident	86	Confident	50 Å²	50	68.6 Å²	68.6	35%	0.35	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-70.3	-18.5	-176.6	70.9	0	0	0	0	114	D39 P150 R153	D39-S41 PolarHBondContact O-N 3.26Å; D39-S41 WeakPolarHBondContact OD1-CB 3.36Å; D39-S41 PolarHBondContact OD1-N 2.95Å; D39-S41 PolarHBondContact OD1-OG 2.8Å; D39-S41 PolarHBondContact OD2-OG 3.46Å; S41-P150 WeakPolarHBondContact O-CB 3.32Å; S41-R153 PolarHBondContact OG-NH1 3Å
42	L	89.6	Confident	85.6	Confident	0 Å²	0	69 Å²	69	0%	0	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-107.2	-8.5	-175.5	-62	173.2	0	0	0	113.5	D39 I40 D44 Y45 I46 I124 P150 R153 V154	D39-L42 HydrophobicContact CB-CB 4.47Å; D39-L42 HydrophobicContact CB-CD1 4.17Å; D39-L42 HydrophobicContact CB-CG 4.4Å; D39-L42 PolarHBondContact O-N 2.84Å; D39-L42 VanDerWaalsContact O-N 3.08Å; I40-L42 PolarHBondContact O-N 3.4Å; L42-D44 VanDerWaalsContact C-N 3.33Å; L42-D44 PolarHBondContact O-N 3.45Å; L42-Y45 PolarHBondContact O-N 3.06Å; L42-I46 HydrophobicContact CB-CD1 3.77Å; L42-I46 HydrophobicContact CB-CG1 4.3Å; L42-I46 WeakPolarHBondContact O-CG1 3.5Å; L42-I46 PolarHBondContact O-N 2.79Å; L42-I124 HydrophobicContact CD1-CB 4.33Å; L42-I124 HydrophobicContact CD1-CG1 3.93Å; L42-I124 HydrophobicContact CD1-CG2 4.39Å; L42-P150 HydrophobicContact CD2-CB 4.04Å; L42-R153 HydrophobicContact CD2-CB 4.38Å; L42-R153 HydrophobicContact CD2-CG 4.42Å; L42-V154 HydrophobicContact CD2-CG2 3.73Å
43	N	89.8	Confident	85.5	Confident	86 Å²	86	69.1 Å²	69.1	46%	0.46	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-53	-48.2	-176.8	-165.9	23.5	0	0	0	112.2	I37 D39 Y45 I46	I37-N43 WeakPolarHBondContact CD1-OD1 3.45Å; D39-N43 PolarHBondContact O-N 3.48Å; N43-Y45 PolarHBondContact O-N 3.14Å; N43-I46 PolarHBondContact O-N 3.46Å
44	D	88.5	Confident	85.6	Confident	133 Å²	133	67.6 Å²	67.6	71%	0.711	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-69.1	-18.7	-179.3	-61.7	-23.9	0	0	0	114.2	L42	L42-D44 VanDerWaalsContact C-N 3.33Å; L42-D44 PolarHBondContact O-N 3.45Å
45	Y	90.7	Very high	85.9	Confident	59 Å²	59	68.6 Å²	68.6	23%	0.231	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-106	-6.3	-174.1	-62.8	-77.9	0	0	0	113.5	L42 N43 A71 R78 P150 L151	L42-Y45 PolarHBondContact O-N 3.06Å; N43-Y45 PolarHBondContact O-N 3.14Å; Y45-A71 HydrophobicContact CD1-CB 3.9Å; Y45-A71 HydrophobicContact CE1-CB 4.48Å; Y45-R78 PolarHBondContact O-NH1 2.97Å; Y45-P150 HydrophobicContact CD2-CB 3.51Å; Y45-P150 HydrophobicContact CD2-CG 4.45Å; Y45-P150 HydrophobicContact CE2-CB 3.54Å; Y45-P150 HydrophobicContact CE2-CG 4.04Å; Y45-P150 HydrophobicContact CG-CB 4.32Å; Y45-L151 HydrophobicContact CD1-CB 3.79Å; Y45-L151 HydrophobicContact CD1-CD1 3.92Å; Y45-L151 HydrophobicContact CD1-CG 4.39Å; Y45-L151 HydrophobicContact CE1-CB 3.76Å; Y45-L151 HydrophobicContact CE1-CD1 4.47Å
46	I	90.4	Very high	86	Confident	5 Å²	5	73 Å²	73	3%	0.026	36%	0.361	C	S	.	.			trans	-109.7	87.7	176	-62.9	176	0	0	0	108.1	I37 L42 N43 V48 I75 V120 I123 I124 V154	I37-I46 HydrophobicContact CD1-CB 4.04Å; I37-I46 HydrophobicContact CD1-CG2 3.95Å; I37-I46 HydrophobicContact CG1-CG2 4.41Å; I37-I46 HydrophobicContact CG2-CD1 4.42Å; L42-I46 HydrophobicContact CB-CD1 3.77Å; L42-I46 HydrophobicContact CB-CG1 4.3Å; L42-I46 WeakPolarHBondContact O-CG1 3.5Å; L42-I46 PolarHBondContact O-N 2.79Å; N43-I46 PolarHBondContact O-N 3.46Å; I46-V48 HydrophobicContact CG2-CG2 3.7Å; I46-V48 PolarHBondContact O-N 3.34Å; I46-V48 VanDerWaalsContact O-N 3.08Å; I46-I75 HydrophobicContact CG2-CG1 4.45Å; I46-V120 HydrophobicContact CD1-CG1 4.46Å; I46-V120 HydrophobicContact CG2-CG2 4.05Å; I46-I123 HydrophobicContact CD1-CG2 4.43Å; I46-I124 HydrophobicContact CD1-CG1 4.24Å; I46-V154 HydrophobicContact CG1-CG2 4.19Å
47	A	86.1	Confident	86.1	Confident	9 Å²	9	68.9 Å²	68.9	7%	0.074	34%	0.339	C	S	.	.			trans	-75	95.7	177.1	0	0	0	0	0	111.2	H52 A71 P74 I75	A47-H52 HydrophobicContact CB-CB 3.84Å; A47-H52 VanDerWaalsContact CB-CG 3.5Å; A47-A71 VanDerWaalsContact CB-O 3.3Å; A47-A71 WeakPolarHBondContact CB-O 3.1Å; A47-P74 WeakPolarHBondContact O-CA 3.43Å; A47-I75 PolarHBondContact O-N 3.24Å
48	V	82.3	Confident	86.2	Confident	7 Å²	7	72 Å²	72	4%	0.042	35%	0.353	C	S	.	.			trans	-121.8	-43.6	175.5	176.8	0	0	0	0	111.6	L32 V35 I46 I75 V116 V120	L32-V48 HydrophobicContact CB-CG1 4.48Å; L32-V48 HydrophobicContact CD2-CG1 4.04Å; V35-V48 HydrophobicContact CB-CG1 3.91Å; V35-V48 HydrophobicContact CG1-CG1 4Å; V35-V48 HydrophobicContact CG2-CG1 4.18Å; I46-V48 HydrophobicContact CG2-CG2 3.7Å; I46-V48 PolarHBondContact O-N 3.34Å; I46-V48 VanDerWaalsContact O-N 3.08Å; V48-I75 HydrophobicContact CG2-CB 4.36Å; V48-I75 HydrophobicContact CG2-CG2 3.62Å; V48-V116 HydrophobicContact CG1-CG1 4.16Å; V48-V120 HydrophobicContact CG2-CG2 4.06Å
49	K	80.4	Confident	86.3	Confident	79 Å²	79	66.8 Å²	66.8	34%	0.343	33%	0.326	S	S	.	.	S	Bend	trans	-84.4	157.9	-173	-60.6	-170.3	178.9	-170.2	0	113.1	V35 D36 K51 H52	V35-K49 WeakPolarHBondContact O-CE 3.34Å; V35-K49 PolarHBondContact O-NZ 3.48Å; V35-K49 VanDerWaalsContact O-NZ 3.12Å; D36-K49 IonicContact OD1-NZ 2.7Å; D36-K49 PolarHBondContact OD1-NZ 3.2Å; D36-K49 VanDerWaalsContact OD1-NZ 3.16Å; K49-K51 PolarHBondContact O-N 3.36Å; K49-H52 PolarHBondContact O-N 2.94Å
50	E	79.6	Confident	86.5	Confident	149 Å²	149	70.3 Å²	70.3	70%	0.696	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	56.1	-112.7	170	-55.2	174.4	-168.9	0	0	114.9	H52 A53	E50-H52 PolarHBondContact O-N 3.03Å; E50-A53 WeakPolarHBondContact O-CB 3.49Å; E50-A53 PolarHBondContact O-N 3.3Å; E50-A53 VanDerWaalsContact O-N 3.07Å
51	K	81.2	Confident	86.3	Confident	183 Å²	183	64.6 Å²	64.6	80%	0.796	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-62.5	-16.1	-172.8	-62.4	177.1	-177.2	172.4	0	113.5	K49	K49-K51 PolarHBondContact O-N 3.36Å
52	H	81.2	Confident	86.4	Confident	52 Å²	52	71.9 Å²	71.9	24%	0.241	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-99.1	-6.4	-176.9	-55.4	-61.5	0	0	0	113	A47 K49 E50 K54 Q72 P74	A47-H52 HydrophobicContact CB-CB 3.84Å; A47-H52 VanDerWaalsContact CB-CG 3.5Å; K49-H52 PolarHBondContact O-N 2.94Å; E50-H52 PolarHBondContact O-N 3.03Å; H52-K54 PolarHBondContact O-N 3.48Å; H52-Q72 PolarHBondContact CE1-O 2.83Å; H52-Q72 VanDerWaalsContact CE1-O 3.24Å; H52-Q72 PolarHBondContact ND1-O 3.21Å; H52-P74 WeakPolarHBondContact O-CG 3.07Å
53	A	82.8	Confident	86.5	Confident	14 Å²	14	73.7 Å²	73.7	12%	0.116	37%	0.366	C	S	.	.			trans	-66.7	122.8	175.5	0	0	0	0	0	110.4	I24 L32 E50	I24-A53 HydrophobicContact CB-CB 3.97Å; I24-A53 HydrophobicContact CD1-CB 4.14Å; I24-A53 HydrophobicContact CG2-CB 3.98Å; L32-A53 HydrophobicContact CD1-CB 3.62Å; E50-A53 WeakPolarHBondContact O-CB 3.49Å; E50-A53 PolarHBondContact O-N 3.3Å; E50-A53 VanDerWaalsContact O-N 3.07Å
54	K	85.2	Confident	86.5	Confident	63 Å²	63	77.3 Å²	77.3	27%	0.274	38%	0.38	S	S	.	.			trans	-137.8	142	179.4	-65.1	-174.4	-178.9	174.2	0	109.9	L26 H52 L56 S59 Y63 P74	L26-K54 WeakPolarHBondContact CD1-O 3.46Å; H52-K54 PolarHBondContact O-N 3.48Å; K54-L56 VanDerWaalsContact C-N 3.32Å; K54-L56 PolarHBondContact O-N 3.45Å; K54-S59 VanDerWaalsContact CD-OG 3.29Å; K54-S59 WeakPolarHBondContact CD-OG 3.46Å; K54-S59 PolarHBondContact NZ-OG 3.37Å; K54-Y63 PolarHBondContact NZ-OH 3.27Å; K54-Y63 VanDerWaalsContact NZ-OH 3.09Å; K54-P74 HydrophobicContact CD-CG 4.03Å
55	Y	88.3	Confident	86.7	Confident	119 Å²	119	75.7 Å²	75.7	47%	0.467	38%	0.375	S	S	.	.	S	Bend	trans	-62.6	-39	174.8	-63.7	-74.9	0	0	0	112.5	I24 K25 F27	I24-Y55 HydrophobicContact CG2-CD1 4.19Å; I24-Y55 HydrophobicContact CG2-CD2 4.3Å; I24-Y55 HydrophobicContact CG2-CE1 4.1Å; I24-Y55 HydrophobicContact CG2-CE2 4.21Å; I24-Y55 HydrophobicContact CG2-CG 4.29Å; K25-Y55 WeakPolarHBondContact O-CD1 3.44Å; F27-Y55 WeakPolarHBondContact CA-O 3.2Å; F27-Y55 PolarHBondContact N-O 2.96Å
56	L	89.7	Confident	86.8	Confident	94 Å²	94	79.5 Å²	79.5	49%	0.492	39%	0.393	S	S	.	.	S	Bend	trans	-124.4	139.1	178.5	-65.4	174.3	0	0	0	109.8	F27 K54 H58	F27-L56 HydrophobicContact CD1-CD2 3.97Å; F27-L56 HydrophobicContact CE1-CD2 4.27Å; K54-L56 VanDerWaalsContact C-N 3.32Å; K54-L56 PolarHBondContact O-N 3.45Å; L56-H58 PolarHBondContact O-N 3.46Å
57	P	88.4	Confident	86.7	Confident	3 Å²	3	89.3 Å²	89.3	2%	0.019	43%	0.43	C	S	.	.	S	Bend	trans	-76.9	46.7	173.7	33.7	-35.4	0	0	0	111.5	F27 V76 E77 V80 M97	F27-P57 HydrophobicContact CE1-CG 4.01Å; F27-P57 HydrophobicContact CZ-CG 3.69Å; P57-V76 HydrophobicContact CB-CB 4.19Å; P57-V76 HydrophobicContact CB-CG1 3.78Å; P57-V76 HydrophobicContact CG-CG1 3.99Å; P57-E77 HydrophobicContact CB-CB 4.23Å; P57-V80 HydrophobicContact CB-CG2 4.27Å; P57-V80 HydrophobicContact CG-CG2 4.15Å; P57-M97 HydrophobicContact CG-CG 4.23Å; P57-M97 HydrophobicContact CG-SD 4.28Å
58	H	89.6	Confident	86.9	Confident	95 Å²	95	94.6 Å²	94.6	44%	0.44	45%	0.451	S	S	.	.			trans	-126.7	88.6	177.6	-164.4	-88.5	0	0	0	110.7	L56 K93 M97	L56-H58 PolarHBondContact O-N 3.46Å; H58-K93 VanDerWaalsContact CD2-CD 3.45Å; H58-K93 WeakPolarHBondContact CD2-CD 3.41Å; H58-M97 HydrophobicContact CB-CE 4.05Å; H58-M97 HydrophobicContact CB-SD 3.59Å; H58-M97 VanDerWaalsContact CB-SD 3.59Å
59	S	86.7	Confident	87.3	Confident	15 Å²	15	98.1 Å²	98.1	11%	0.105	46%	0.464	C	S	.	.			trans	-105.7	142.4	173.1	-43.7	0	0	0	0	110.2	K54 G61 E77 K93	K54-S59 VanDerWaalsContact CD-OG 3.29Å; K54-S59 WeakPolarHBondContact CD-OG 3.46Å; K54-S59 PolarHBondContact NZ-OG 3.37Å; S59-G61 PolarHBondContact O-N 2.88Å; S59-E77 WeakPolarHBondContact CA-OE1 3.16Å; S59-E77 VanDerWaalsContact CB-OE1 3.23Å; S59-E77 WeakPolarHBondContact CB-OE1 3.33Å; S59-E77 WeakPolarHBondContact CB-OE2 3.29Å; S59-E77 PolarHBondContact N-OE1 3.44Å; S59-E77 VanDerWaalsContact O-OE1 3.12Å; S59-E77 PolarHBondContact OG-OE1 2.65Å; S59-E77 PolarHBondContact OG-OE2 3.09Å; S59-K93 PolarHBondContact O-NZ 3.21Å; S59-K93 VanDerWaalsContact O-NZ 3.13Å
60	A	87.8	Confident	87.8	Confident	106 Å²	106	98.7 Å²	98.7	88%	0.876	47%	0.466	S	S	*	.			trans	-82.1	31.5	162	0	0	0	0	0	111.2
61	G	85.6	Confident	88.3	Confident	35 Å²	35	92.1 Å²	92.1	36%	0.361	44%	0.438	S	S	.	.			trans	-72.4	129.1	-170.9	0	0	0	0	0	112.3	S59 Y63	S59-G61 PolarHBondContact O-N 2.88Å; G61-Y63 VanDerWaalsContact O-CD2 3.32Å; G61-Y63 WeakPolarHBondContact O-CD2 3.36Å; G61-Y63 PolarHBondContact O-N 3.04Å
62	R	90.3	Very high	88.8	Confident	203 Å²	203	88.4 Å²	88.4	77%	0.766	42%	0.423	S	S	*	.			trans	-81.2	64.4	175.6	-62.2	-176.5	-178.5	-176.5	0.8	111.3	Q64 R69	R62-Q64 VanDerWaalsContact C-N 3.27Å; R62-Q64 PolarHBondContact O-N 3.35Å; R62-R69 WeakPolarHBondContact O-CD 3.47Å; R62-R69 PolarHBondContact O-NH1 3.03Å
63	Y	91.6	Very high	89.2	Confident	38 Å²	38	86.3 Å²	86.3	15%	0.149	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-13.7	-174.8	-62.6	-66	0	0	0	114.3	K54 G61 R69 K70 C73 P74	K54-Y63 PolarHBondContact NZ-OH 3.27Å; K54-Y63 VanDerWaalsContact NZ-OH 3.09Å; G61-Y63 VanDerWaalsContact O-CD2 3.32Å; G61-Y63 WeakPolarHBondContact O-CD2 3.36Å; G61-Y63 PolarHBondContact O-N 3.04Å; Y63-R69 HydrophobicContact CD1-CG 4.37Å; Y63-R69 WeakPolarHBondContact CD1-O 3.46Å; Y63-R69 CarbonylContact O-C 3.26Å; Y63-K70 WeakPolarHBondContact O-CG 3.3Å; Y63-K70 PolarHBondContact O-N 3.14Å; Y63-C73 HydrophobicContact CD1-CB 3.73Å; Y63-C73 HydrophobicContact CD2-CB 3.83Å; Y63-C73 HydrophobicContact CE1-CB 3.85Å; Y63-C73 HydrophobicContact CE2-CB 3.93Å; Y63-C73 VanDerWaalsContact CE2-SG 3.53Å; Y63-C73 HydrophobicContact CG-CB 3.73Å; Y63-P74 WeakPolarHBondContact OH-CD 3.29Å
64	Q	90.1	Very high	89.7	Confident	162 Å²	162	86.1 Å²	86.1	76%	0.757	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-12.7	-175.6	-61.3	-170.8	-8.1	0	0	114.4	R62 K66	R62-Q64 VanDerWaalsContact C-N 3.27Å; R62-Q64 PolarHBondContact O-N 3.35Å; Q64-K66 VanDerWaalsContact C-N 3.29Å; Q64-K66 PolarHBondContact O-N 3.11Å
65	T	92.7	Very high	90.1	Very high	100 Å²	100	83.2 Å²	83.2	61%	0.613	40%	0.4	S	S	*	.	S	Bend	trans	-63.9	-30.2	-175.4	-49.1	0	0	0	0	113.6
66	K	92.2	Very high	90.3	Very high	138 Å²	138	78 Å²	78	60%	0.6	38%	0.38	S	S	*	.	S	Bend	trans	-125.7	146.1	176.1	-65.9	-169.4	177.4	-171.5	0	109.9	Q64 F68 R69	Q64-K66 VanDerWaalsContact C-N 3.29Å; Q64-K66 PolarHBondContact O-N 3.11Å; K66-F68 PolarHBondContact O-N 2.86Å; K66-R69 HydrophobicContact CB-CB 4.19Å; K66-R69 PolarHBondContact O-N 2.75Å; K66-R69 VanDerWaalsContact O-N 3.16Å
67	R	88.4	Confident	90.5	Very high	211 Å²	211	73.6 Å²	73.6	80%	0.796	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.8	-46.4	-172.4	-171.1	176.7	-179.1	-178.7	-0.3	114.3
68	F	90.2	Very high	90.7	Very high	121 Å²	121	74.3 Å²	74.3	53%	0.531	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-1.7	-175.3	-60.8	-69.8	0	0	0	114.7	K66 K70 A71 L151	K66-F68 PolarHBondContact O-N 2.86Å; F68-K70 PolarHBondContact O-N 2.95Å; F68-K70 VanDerWaalsContact O-N 3.13Å; F68-A71 WeakPolarHBondContact O-CB 3.32Å; F68-A71 PolarHBondContact O-N 2.55Å; F68-L151 HydrophobicContact CD1-CD2 4.12Å
69	R	90.6	Very high	91	Very high	81 Å²	81	69.8 Å²	69.8	31%	0.306	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-65.8	-18.6	179.9	-168.8	-178.9	-80.1	175.9	-6.5	112.4	R62 Y63 K66 A71 Q72	R62-R69 WeakPolarHBondContact O-CD 3.47Å; R62-R69 PolarHBondContact O-NH1 3.03Å; Y63-R69 HydrophobicContact CD1-CG 4.37Å; Y63-R69 WeakPolarHBondContact CD1-O 3.46Å; Y63-R69 CarbonylContact O-C 3.26Å; K66-R69 HydrophobicContact CB-CB 4.19Å; K66-R69 PolarHBondContact O-N 2.75Å; K66-R69 VanDerWaalsContact O-N 3.16Å; R69-A71 PolarHBondContact O-N 2.86Å; R69-Q72 WeakPolarHBondContact O-CB 3.38Å; R69-Q72 PolarHBondContact O-N 3.49Å
70	K	91.3	Very high	91.4	Very high	90 Å²	90	69 Å²	69	39%	0.391	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-60.1	-27.8	170.4	-68	-175	177.3	-179.7	0	113.6	Y63 F68 Q72 C73	Y63-K70 WeakPolarHBondContact O-CG 3.3Å; Y63-K70 PolarHBondContact O-N 3.14Å; F68-K70 PolarHBondContact O-N 2.95Å; F68-K70 VanDerWaalsContact O-N 3.13Å; K70-Q72 VanDerWaalsContact C-N 3.25Å; K70-Q72 PolarHBondContact O-N 2.7Å; K70-C73 WeakPolarHBondContact O-CB 3.23Å; K70-C73 PolarHBondContact O-N 3.13Å
71	A	90.8	Very high	91.7	Very high	12 Å²	12	66.3 Å²	66.3	10%	0.099	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-65.1	-31.4	177.5	0	0	0	0	0	112.1	Y45 A47 F68 R69 C73	Y45-A71 HydrophobicContact CD1-CB 3.9Å; Y45-A71 HydrophobicContact CE1-CB 4.48Å; A47-A71 VanDerWaalsContact CB-O 3.3Å; A47-A71 WeakPolarHBondContact CB-O 3.1Å; F68-A71 WeakPolarHBondContact O-CB 3.32Å; F68-A71 PolarHBondContact O-N 2.55Å; R69-A71 PolarHBondContact O-N 2.86Å; A71-C73 VanDerWaalsContact C-N 3.26Å; A71-C73 PolarHBondContact O-N 2.79Å
72	Q	90.4	Very high	92	Very high	104 Å²	104	66 Å²	66	49%	0.486	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-79.6	-2.2	178.9	-63.6	176.2	-17.5	0	0	113.8	H52 R69 K70	H52-Q72 PolarHBondContact CE1-O 2.83Å; H52-Q72 VanDerWaalsContact CE1-O 3.24Å; H52-Q72 PolarHBondContact ND1-O 3.21Å; R69-Q72 WeakPolarHBondContact O-CB 3.38Å; R69-Q72 PolarHBondContact O-N 3.49Å; K70-Q72 VanDerWaalsContact C-N 3.25Å; K70-Q72 PolarHBondContact O-N 2.7Å
73	C	90.8	Very high	92.1	Very high	8 Å²	8	56.9 Å²	56.9	5%	0.054	27%	0.266	C	S	.	.	S	Bend	trans	-79.8	128.8	177.4	-176.8	0	0	0	0	109.2	Y63 K70 A71 I75 R78	Y63-C73 HydrophobicContact CD1-CB 3.73Å; Y63-C73 HydrophobicContact CD2-CB 3.83Å; Y63-C73 HydrophobicContact CE1-CB 3.85Å; Y63-C73 HydrophobicContact CE2-CB 3.93Å; Y63-C73 VanDerWaalsContact CE2-SG 3.53Å; Y63-C73 HydrophobicContact CG-CB 3.73Å; K70-C73 WeakPolarHBondContact O-CB 3.23Å; K70-C73 PolarHBondContact O-N 3.13Å; A71-C73 VanDerWaalsContact C-N 3.26Å; A71-C73 PolarHBondContact O-N 2.79Å; C73-I75 PolarHBondContact O-N 3.11Å; C73-R78 HydrophobicContact CB-CG 3.91Å
74	P	92.8	Very high	92.2	Very high	11 Å²	11	56.4 Å²	56.4	7%	0.071	27%	0.265	C	S	.	.			trans	-51.1	136.4	178.6	-25.5	32.8	0	0	0	111.6	A47 H52 K54 Y63 V76 E77 R78	A47-P74 WeakPolarHBondContact O-CA 3.43Å; H52-P74 WeakPolarHBondContact O-CG 3.07Å; K54-P74 HydrophobicContact CD-CG 4.03Å; Y63-P74 WeakPolarHBondContact OH-CD 3.29Å; P74-V76 PolarHBondContact O-N 3.41Å; P74-E77 HydrophobicContact CB-CB 4.24Å; P74-E77 WeakPolarHBondContact O-CA 3.4Å; P74-E77 WeakPolarHBondContact O-CB 3.41Å; P74-E77 PolarHBondContact O-N 3.05Å; P74-R78 PolarHBondContact O-N 3.46Å
75	I	93	Very high	92.1	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.01	25%	0.249	C	C	.	.	H	α-helix	trans	-60	-37.2	-171.1	-162.3	63.6	0	0	0	112.8	I46 A47 V48 C73 E77 R78 L79 L119 I123 V154 I158	I46-I75 HydrophobicContact CG2-CG1 4.45Å; A47-I75 PolarHBondContact O-N 3.24Å; V48-I75 HydrophobicContact CG2-CB 4.36Å; V48-I75 HydrophobicContact CG2-CG2 3.62Å; C73-I75 PolarHBondContact O-N 3.11Å; I75-E77 VanDerWaalsContact C-N 3.32Å; I75-E77 PolarHBondContact O-N 3.05Å; I75-R78 WeakPolarHBondContact O-CB 3.28Å; I75-R78 PolarHBondContact O-N 2.98Å; I75-L79 PolarHBondContact O-N 3.24Å; I75-L119 HydrophobicContact CG2-CD2 4.18Å; I75-I123 HydrophobicContact CD1-CD1 3.8Å; I75-I123 HydrophobicContact CG1-CD1 3.47Å; I75-I123 VanDerWaalsContact CG1-CD1 3.47Å; I75-V154 HydrophobicContact CD1-CG1 3.81Å; I75-I158 HydrophobicContact CD1-CD1 3.72Å
76	V	93.3	Very high	91.7	Very high	8 Å²	8	54.1 Å²	54.1	5%	0.048	25%	0.248	C	C	.	.	H	α-helix	trans	-66.3	-36.3	177.1	-175.6	0	0	0	0	111.1	L26 P57 P74 R78 L79 V80 V100 F104 L119	L26-V76 HydrophobicContact CD2-CB 4.49Å; L26-V76 HydrophobicContact CD2-CG1 4.33Å; L26-V76 HydrophobicContact CD2-CG2 3.82Å; P57-V76 HydrophobicContact CB-CB 4.19Å; P57-V76 HydrophobicContact CB-CG1 3.78Å; P57-V76 HydrophobicContact CG-CG1 3.99Å; P74-V76 PolarHBondContact O-N 3.41Å; V76-R78 VanDerWaalsContact C-N 3.34Å; V76-L79 WeakPolarHBondContact O-CB 3.42Å; V76-L79 PolarHBondContact O-N 3.32Å; V76-V80 VanDerWaalsContact O-CG2 3.3Å; V76-V80 WeakPolarHBondContact O-CG2 3.46Å; V76-V80 PolarHBondContact O-N 3.03Å; V76-V100 HydrophobicContact CG1-CG1 3.9Å; V76-F104 HydrophobicContact CG1-CE2 3.95Å; V76-F104 HydrophobicContact CG1-CZ 4.06Å; V76-F104 HydrophobicContact CG2-CE2 4.05Å; V76-F104 HydrophobicContact CG2-CZ 4.08Å; V76-L119 HydrophobicContact CG2-CD2 4.01Å
77	E	93.5	Very high	91.5	Very high	3 Å²	3	50.3 Å²	50.3	1%	0.014	25%	0.248	C	C	.	.	H	α-helix	trans	-68.6	-34.8	175.1	-179.1	166	-160.1	0	0	111.6	P57 S59 P74 I75 L79 V80 C81 K93	P57-E77 HydrophobicContact CB-CB 4.23Å; S59-E77 WeakPolarHBondContact CA-OE1 3.16Å; S59-E77 VanDerWaalsContact CB-OE1 3.23Å; S59-E77 WeakPolarHBondContact CB-OE1 3.33Å; S59-E77 WeakPolarHBondContact CB-OE2 3.29Å; S59-E77 PolarHBondContact N-OE1 3.44Å; S59-E77 VanDerWaalsContact O-OE1 3.12Å; S59-E77 PolarHBondContact OG-OE1 2.65Å; S59-E77 PolarHBondContact OG-OE2 3.09Å; P74-E77 HydrophobicContact CB-CB 4.24Å; P74-E77 WeakPolarHBondContact O-CA 3.4Å; P74-E77 WeakPolarHBondContact O-CB 3.41Å; P74-E77 PolarHBondContact O-N 3.05Å; I75-E77 VanDerWaalsContact C-N 3.32Å; I75-E77 PolarHBondContact O-N 3.05Å; E77-L79 VanDerWaalsContact C-N 3.34Å; E77-V80 PolarHBondContact O-N 3.45Å; E77-C81 WeakPolarHBondContact O-CB 3.43Å; E77-C81 PolarHBondContact O-N 3.41Å; E77-C81 PolarHBondContact O-SG 3.36Å; E77-K93 IonicContact OE1-NZ 3.58Å; E77-K93 PolarHBondContact OE1-NZ 3.38Å
78	R	93.9	Very high	91.6	Very high	17 Å²	17	50.9 Å²	50.9	6%	0.064	25%	0.25	C	S	.	.	H	α-helix	trans	-64.5	-39	172.6	-66	174.9	62.4	-173.2	-2.2	111.8	Y45 C73 P74 I75 V76 S82 V154 N155 I158	Y45-R78 PolarHBondContact O-NH1 2.97Å; C73-R78 HydrophobicContact CB-CG 3.91Å; P74-R78 PolarHBondContact O-N 3.46Å; I75-R78 WeakPolarHBondContact O-CB 3.28Å; I75-R78 PolarHBondContact O-N 2.98Å; V76-R78 VanDerWaalsContact C-N 3.34Å; R78-S82 WeakPolarHBondContact O-CB 3.24Å; R78-S82 PolarHBondContact O-N 3.14Å; R78-S82 PolarHBondContact O-OG 3.02Å; R78-V154 VanDerWaalsContact NH2-CG1 3.32Å; R78-N155 PolarHBondContact NH2-OD1 3.11Å; R78-I158 HydrophobicContact CB-CD1 3.86Å
79	L	94.3	Very high	91.6	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.1	-50.1	173.1	-174.6	72.7	0	0	0	111.2	I75 V76 E77 C81 S82 L83 V100 L119 I158 C162	I75-L79 PolarHBondContact O-N 3.24Å; V76-L79 WeakPolarHBondContact O-CB 3.42Å; V76-L79 PolarHBondContact O-N 3.32Å; E77-L79 VanDerWaalsContact C-N 3.34Å; L79-C81 PolarHBondContact O-N 2.93Å; L79-S82 WeakPolarHBondContact O-CB 3.48Å; L79-S82 PolarHBondContact O-N 3.21Å; L79-S82 VanDerWaalsContact O-N 3.07Å; L79-L83 PolarHBondContact O-N 3.14Å; L79-V100 HydrophobicContact CD2-CG1 4.41Å; L79-V100 HydrophobicContact CD2-CG2 4.23Å; L79-L119 HydrophobicContact CD1-CD1 4.44Å; L79-L119 HydrophobicContact CD2-CD1 3.98Å; L79-L119 HydrophobicContact CD2-CD2 4.2Å; L79-I158 HydrophobicContact CD1-CG2 4.05Å; L79-C162 VanDerWaalsContact CD1-SG 3.57Å
80	V	95.1	Very high	91.8	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-56.8	-47.8	176.4	171.4	0	0	0	0	111.1	P57 V76 E77 S82 L83 M84 K93 A96 M97 V100	P57-V80 HydrophobicContact CB-CG2 4.27Å; P57-V80 HydrophobicContact CG-CG2 4.15Å; V76-V80 VanDerWaalsContact O-CG2 3.3Å; V76-V80 WeakPolarHBondContact O-CG2 3.46Å; V76-V80 PolarHBondContact O-N 3.03Å; E77-V80 PolarHBondContact O-N 3.45Å; V80-S82 VanDerWaalsContact C-N 3.26Å; V80-S82 PolarHBondContact O-N 3.42Å; V80-L83 PolarHBondContact O-N 2.94Å; V80-M84 WeakPolarHBondContact O-CG 3.34Å; V80-M84 PolarHBondContact O-N 2.63Å; V80-K93 HydrophobicContact CG1-CG 3.9Å; V80-A96 HydrophobicContact CG1-CB 3.79Å; V80-M97 HydrophobicContact CG1-CG 3.83Å; V80-M97 HydrophobicContact CG2-CG 4.24Å; V80-V100 HydrophobicContact CG2-CB 4.18Å; V80-V100 HydrophobicContact CG2-CG1 4.47Å; V80-V100 HydrophobicContact CG2-CG2 3.74Å
81	C	93.9	Very high	91.6	Very high	48 Å²	48	47.9 Å²	47.9	32%	0.324	27%	0.265	S	S	.	.	H	α-helix	trans	-59.6	-39.7	176.8	-68.3	0	0	0	0	111.6	E77 L79 L83 M84 M85	E77-C81 WeakPolarHBondContact O-CB 3.43Å; E77-C81 PolarHBondContact O-N 3.41Å; E77-C81 PolarHBondContact O-SG 3.36Å; L79-C81 PolarHBondContact O-N 2.93Å; C81-L83 VanDerWaalsContact C-N 3.32Å; C81-L83 PolarHBondContact O-N 3.3Å; C81-M84 PolarHBondContact O-N 3.14Å; C81-M85 WeakPolarHBondContact O-CE 3.49Å
82	S	93	Very high	91.8	Very high	28 Å²	28	52.5 Å²	52.5	20%	0.196	28%	0.283	C	S	.	.	H	α-helix	trans	-70.6	-26.7	-179.5	-59.1	0	0	0	0	112.7	R78 L79 V80 M84 M85 I158 R166	R78-S82 WeakPolarHBondContact O-CB 3.24Å; R78-S82 PolarHBondContact O-N 3.14Å; R78-S82 PolarHBondContact O-OG 3.02Å; L79-S82 WeakPolarHBondContact O-CB 3.48Å; L79-S82 PolarHBondContact O-N 3.21Å; L79-S82 VanDerWaalsContact O-N 3.07Å; V80-S82 VanDerWaalsContact C-N 3.26Å; V80-S82 PolarHBondContact O-N 3.42Å; S82-M84 VanDerWaalsContact C-N 3.35Å; S82-M85 WeakPolarHBondContact O-CG 3.32Å; S82-I158 VanDerWaalsContact OG-CG2 3.32Å; S82-I158 WeakPolarHBondContact OG-CG2 3.46Å; S82-R166 PolarHBondContact O-NH2 2.89Å
83	L	93.2	Very high	91.9	Very high	13 Å²	13	49 Å²	49	7%	0.068	27%	0.267	C	S	.	.	H	α-helix	trans	-72.2	-23.9	175	-75.8	169.3	0	0	0	113.6	L79 V80 C81 M85 A96 I99 V100 C162 R166 L180	L79-L83 PolarHBondContact O-N 3.14Å; V80-L83 PolarHBondContact O-N 2.94Å; C81-L83 VanDerWaalsContact C-N 3.32Å; C81-L83 PolarHBondContact O-N 3.3Å; L83-M85 PolarHBondContact O-N 3.09Å; L83-M85 VanDerWaalsContact O-N 3.14Å; L83-A96 HydrophobicContact CB-CB 4.21Å; L83-I99 HydrophobicContact CD1-CG2 4.49Å; L83-V100 HydrophobicContact CD1-CG2 3.47Å; L83-V100 VanDerWaalsContact CD1-CG2 3.47Å; L83-C162 HydrophobicContact CD2-CB 4.21Å; L83-R166 PolarHBondContact O-NH2 3.16Å; L83-L180 HydrophobicContact CD1-CD2 3.9Å; L83-L180 HydrophobicContact CD2-CD2 4.46Å
84	M	92.6	Very high	92.1	Very high	27 Å²	27	54.6 Å²	54.6	13%	0.133	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	3.5	-177	-64.1	167	57.8	0	0	114.9	V80 C81 S82 N89 N90 G91 K93 A96	V80-M84 WeakPolarHBondContact O-CG 3.34Å; V80-M84 PolarHBondContact O-N 2.63Å; C81-M84 PolarHBondContact O-N 3.14Å; S82-M84 VanDerWaalsContact C-N 3.35Å; M84-N89 CarbonylContact O-C 3.56Å; M84-N89 VanDerWaalsContact O-C 3.26Å; M84-N90 VanDerWaalsContact O-CA 3.26Å; M84-N90 WeakPolarHBondContact O-CA 3.36Å; M84-N90 PolarHBondContact O-N 2.76Å; M84-N90 PolarHBondContact O-OD1 3.07Å; M84-N90 VanDerWaalsContact O-OD1 3.06Å; M84-G91 VanDerWaalsContact CE-C 3.41Å; M84-G91 VanDerWaalsContact CE-CA 3.45Å; M84-K93 HydrophobicContact CE-CB 3.85Å; M84-K93 VanDerWaalsContact SD-CA 3.57Å; M84-K93 HydrophobicContact SD-CB 3.64Å; M84-K93 HydrophobicContact SD-CD 4.4Å; M84-K93 HydrophobicContact SD-CG 3.81Å; M84-A96 HydrophobicContact CG-CB 3.84Å
85	M	88	Confident	92.2	Very high	87 Å²	87	57 Å²	57	43%	0.429	31%	0.308	S	S	.	.			trans	-75.9	164.9	-177.2	-57.3	-63.5	118	0	0	113.1	C81 S82 L83	C81-M85 WeakPolarHBondContact O-CE 3.49Å; S82-M85 WeakPolarHBondContact O-CG 3.32Å; L83-M85 PolarHBondContact O-N 3.09Å; L83-M85 VanDerWaalsContact O-N 3.14Å
86	H	85.4	Confident	92.3	Very high	127 Å²	127	57.2 Å²	57.2	59%	0.588	31%	0.309	S	S	*	.	S	Bend	trans	73.8	96.6	-175	-52	-74.9	0	0	0	113.9	R88 N89 N90	H86-R88 PolarHBondContact O-N 3Å; H86-N89 PolarHBondContact O-N 3.34Å; H86-N90 PolarHBondContact N-OD1 2.97Å
87	G	87	Confident	92.3	Very high	58 Å²	58	57.4 Å²	57.4	60%	0.598	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	31.6	-82.5	165.1	0	0	0	0	0	116.7	N89 N90	G87-N89 PolarHBondContact O-N 2.86Å; G87-N89 VanDerWaalsContact O-N 3.16Å; G87-N90 PolarHBondContact N-OD1 3.49Å; G87-N90 WeakPolarHBondContact O-CB 3.43Å; G87-N90 PolarHBondContact O-N 3.4Å; G87-N90 VanDerWaalsContact O-N 3.17Å
88	R	90.4	Very high	92.4	Very high	224 Å²	224	63.9 Å²	63.9	85%	0.845	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-58.8	-24.1	-177.4	-62.3	179.7	-179.8	153.4	-0.4	114.5	H86 K92	H86-R88 PolarHBondContact O-N 3Å; R88-K92 WeakPolarHBondContact O-CE 3.22Å; R88-K92 PolarHBondContact O-NZ 3Å
89	N	91.3	Very high	92.5	Very high	69 Å²	69	64.5 Å²	64.5	37%	0.369	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-102.4	-5.6	-177.1	-64.1	-9.8	0	0	0	113.3	M84 H86 G87 G91 K92	M84-N89 CarbonylContact O-C 3.56Å; M84-N89 VanDerWaalsContact O-C 3.26Å; H86-N89 PolarHBondContact O-N 3.34Å; G87-N89 PolarHBondContact O-N 2.86Å; G87-N89 VanDerWaalsContact O-N 3.16Å; N89-G91 PolarHBondContact O-N 3.16Å; N89-K92 PolarHBondContact O-N 3.02Å
90	N	92.9	Very high	92.5	Very high	93 Å²	93	64.5 Å²	64.5	50%	0.497	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	137.6	-178.6	-70.3	-8.8	0	0	0	110.7	M84 H86 G87 K92	M84-N90 VanDerWaalsContact O-CA 3.26Å; M84-N90 WeakPolarHBondContact O-CA 3.36Å; M84-N90 PolarHBondContact O-N 2.76Å; M84-N90 PolarHBondContact O-OD1 3.07Å; M84-N90 VanDerWaalsContact O-OD1 3.06Å; H86-N90 PolarHBondContact N-OD1 2.97Å; G87-N90 PolarHBondContact N-OD1 3.49Å; G87-N90 WeakPolarHBondContact O-CB 3.43Å; G87-N90 PolarHBondContact O-N 3.4Å; G87-N90 VanDerWaalsContact O-N 3.17Å; N90-K92 PolarHBondContact O-N 3Å; N90-K92 VanDerWaalsContact O-N 3.14Å
91	G	88.7	Confident	92.5	Very high	66 Å²	66	68 Å²	68	68%	0.68	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	-13.6	176.7	0	0	0	0	0	116	M84 N89 K93	M84-G91 VanDerWaalsContact CE-C 3.41Å; M84-G91 VanDerWaalsContact CE-CA 3.45Å; N89-G91 PolarHBondContact O-N 3.16Å; G91-K93 PolarHBondContact O-N 3.42Å
92	K	93.5	Very high	92.7	Very high	109 Å²	109	70 Å²	70	47%	0.474	36%	0.356	S	S	.	.			trans	-79.9	61.8	-178.6	-62.9	178	179.6	164.8	0	113.1	R88 N89 N90 L94 L95 A96	R88-K92 WeakPolarHBondContact O-CE 3.22Å; R88-K92 PolarHBondContact O-NZ 3Å; N89-K92 PolarHBondContact O-N 3.02Å; N90-K92 PolarHBondContact O-N 3Å; N90-K92 VanDerWaalsContact O-N 3.14Å; K92-L94 PolarHBondContact O-N 3.37Å; K92-L95 HydrophobicContact CB-CB 4.02Å; K92-L95 HydrophobicContact CB-CD2 4.42Å; K92-L95 HydrophobicContact CD-CD2 4.27Å; K92-L95 WeakPolarHBondContact O-CB 3.48Å; K92-L95 PolarHBondContact O-N 2.94Å; K92-A96 PolarHBondContact O-N 3.32Å
93	K	93.9	Very high	92.8	Very high	31 Å²	31	68.6 Å²	68.6	14%	0.135	35%	0.346	C	S	.	.	H	α-helix	trans	-63.5	-38.4	-178.2	-165.5	168	176.9	-179.2	0	112.8	H58 S59 E77 V80 M84 G91 L95 A96 M97	H58-K93 VanDerWaalsContact CD2-CD 3.45Å; H58-K93 WeakPolarHBondContact CD2-CD 3.41Å; S59-K93 PolarHBondContact O-NZ 3.21Å; S59-K93 VanDerWaalsContact O-NZ 3.13Å; E77-K93 IonicContact OE1-NZ 3.58Å; E77-K93 PolarHBondContact OE1-NZ 3.38Å; V80-K93 HydrophobicContact CG1-CG 3.9Å; M84-K93 HydrophobicContact CE-CB 3.85Å; M84-K93 VanDerWaalsContact SD-CA 3.57Å; M84-K93 HydrophobicContact SD-CB 3.64Å; M84-K93 HydrophobicContact SD-CD 4.4Å; M84-K93 HydrophobicContact SD-CG 3.81Å; G91-K93 PolarHBondContact O-N 3.42Å; K93-L95 VanDerWaalsContact C-N 3.31Å; K93-L95 PolarHBondContact O-N 3.36Å; K93-A96 PolarHBondContact O-N 3.03Å; K93-M97 WeakPolarHBondContact O-CG 3.3Å; K93-M97 PolarHBondContact O-N 3.06Å
94	L	94.4	Very high	92.9	Very high	126 Å²	126	68 Å²	68	66%	0.66	34%	0.343	S	S	*	.	H	α-helix	trans	-58	-43.4	175.4	-64.8	179.7	0	0	0	111.8	K92 M97 R98	K92-L94 PolarHBondContact O-N 3.37Å; L94-M97 HydrophobicContact CD2-CE 3.48Å; L94-M97 VanDerWaalsContact CD2-CE 3.48Å; L94-M97 HydrophobicContact CG-CE 4.49Å; L94-M97 PolarHBondContact O-N 2.91Å; L94-R98 WeakPolarHBondContact O-CG 3.42Å; L94-R98 PolarHBondContact O-N 3.03Å
95	L	94.6	Very high	93.1	Very high	62 Å²	62	69.4 Å²	69.4	33%	0.325	35%	0.349	S	S	.	.	H	α-helix	trans	-62.3	-48.7	176.8	179	64	0	0	0	111.2	K92 K93 M97 R98 I99	K92-L95 HydrophobicContact CB-CB 4.02Å; K92-L95 HydrophobicContact CB-CD2 4.42Å; K92-L95 HydrophobicContact CD-CD2 4.27Å; K92-L95 WeakPolarHBondContact O-CB 3.48Å; K92-L95 PolarHBondContact O-N 2.94Å; K93-L95 VanDerWaalsContact C-N 3.31Å; K93-L95 PolarHBondContact O-N 3.36Å; L95-M97 VanDerWaalsContact C-N 3.32Å; L95-M97 PolarHBondContact O-N 3.49Å; L95-R98 PolarHBondContact O-N 3.38Å; L95-R98 VanDerWaalsContact O-N 3.14Å; L95-I99 HydrophobicContact CG-CD1 4.23Å; L95-I99 WeakPolarHBondContact O-CG1 3.45Å; L95-I99 PolarHBondContact O-N 2.94Å; L95-I99 VanDerWaalsContact O-N 3.16Å
96	A	94.9	Very high	93.5	Very high	5 Å²	5	67.7 Å²	67.7	4%	0.041	34%	0.341	C	S	.	.	H	α-helix	trans	-61.1	-38.6	179.6	0	0	0	0	0	112.5	V80 L83 M84 K92 K93 R98 I99 V100	V80-A96 HydrophobicContact CG1-CB 3.79Å; L83-A96 HydrophobicContact CB-CB 4.21Å; M84-A96 HydrophobicContact CG-CB 3.84Å; K92-A96 PolarHBondContact O-N 3.32Å; K93-A96 PolarHBondContact O-N 3.03Å; A96-R98 VanDerWaalsContact C-N 3.35Å; A96-R98 PolarHBondContact O-N 3.28Å; A96-I99 PolarHBondContact O-N 3.29Å; A96-V100 WeakPolarHBondContact O-CG2 3.43Å; A96-V100 PolarHBondContact O-N 3.19Å
97	M	94.3	Very high	93.9	Very high	13 Å²	13	61.7 Å²	61.7	6%	0.064	31%	0.313	C	S	.	.	H	α-helix	trans	-63.8	-37.3	174.7	-72.2	-167.4	-65.3	0	0	113.3	P57 H58 V80 K93 L94 L95 V100 R101	P57-M97 HydrophobicContact CG-CG 4.23Å; P57-M97 HydrophobicContact CG-SD 4.28Å; H58-M97 HydrophobicContact CB-CE 4.05Å; H58-M97 HydrophobicContact CB-SD 3.59Å; H58-M97 VanDerWaalsContact CB-SD 3.59Å; V80-M97 HydrophobicContact CG1-CG 3.83Å; V80-M97 HydrophobicContact CG2-CG 4.24Å; K93-M97 WeakPolarHBondContact O-CG 3.3Å; K93-M97 PolarHBondContact O-N 3.06Å; L94-M97 HydrophobicContact CD2-CE 3.48Å; L94-M97 VanDerWaalsContact CD2-CE 3.48Å; L94-M97 HydrophobicContact CG-CE 4.49Å; L94-M97 PolarHBondContact O-N 2.91Å; L95-M97 VanDerWaalsContact C-N 3.32Å; L95-M97 PolarHBondContact O-N 3.49Å; M97-V100 PolarHBondContact O-N 3Å; M97-R101 WeakPolarHBondContact O-CB 3.47Å; M97-R101 PolarHBondContact O-N 3.35Å
98	R	95.1	Very high	94.3	Very high	139 Å²	139	62.1 Å²	62.1	53%	0.525	30%	0.3	S	S	.	.	H	α-helix	trans	-63.8	-44	175	-62.9	-175.3	-48.8	176	9.7	111.4	L94 L95 A96 V100 R101 H102	L94-R98 WeakPolarHBondContact O-CG 3.42Å; L94-R98 PolarHBondContact O-N 3.03Å; L95-R98 PolarHBondContact O-N 3.38Å; L95-R98 VanDerWaalsContact O-N 3.14Å; A96-R98 VanDerWaalsContact C-N 3.35Å; A96-R98 PolarHBondContact O-N 3.28Å; R98-V100 VanDerWaalsContact C-N 3.34Å; R98-V100 PolarHBondContact O-N 2.87Å; R98-R101 PolarHBondContact O-N 3.07Å; R98-H102 PolarHBondContact O-CD2 3.27Å; R98-H102 PolarHBondContact O-N 3.38Å
99	I	95.8	Very high	94.5	Very high	30 Å²	30	58.6 Å²	58.6	15%	0.154	30%	0.297	C	S	.	.	H	α-helix	trans	-58.1	-48.2	177.1	-65.5	164.6	0	0	0	110.5	L83 L95 A96 R101 H102 A103 I176 A177 L180	L83-I99 HydrophobicContact CD1-CG2 4.49Å; L95-I99 HydrophobicContact CG-CD1 4.23Å; L95-I99 WeakPolarHBondContact O-CG1 3.45Å; L95-I99 PolarHBondContact O-N 2.94Å; L95-I99 VanDerWaalsContact O-N 3.16Å; A96-I99 PolarHBondContact O-N 3.29Å; I99-R101 PolarHBondContact O-N 2.79Å; I99-H102 PolarHBondContact O-N 2.95Å; I99-A103 WeakPolarHBondContact O-CB 3.35Å; I99-A103 PolarHBondContact O-N 3.2Å; I99-I176 HydrophobicContact CB-CG2 4.45Å; I99-I176 HydrophobicContact CD1-CG2 3.64Å; I99-I176 HydrophobicContact CG1-CG2 3.77Å; I99-I176 HydrophobicContact CG2-CG1 4.22Å; I99-I176 HydrophobicContact CG2-CG2 3.81Å; I99-A177 HydrophobicContact CG2-CB 4.39Å; I99-L180 HydrophobicContact CG2-CD2 4.46Å
100	V	95.5	Very high	94.5	Very high	0 Å²	0	61 Å²	61	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-65.3	-38.9	179.6	174	0	0	0	0	112	F27 V76 L79 V80 L83 A96 M97 R98 A103 F104 L180	F27-V100 HydrophobicContact CE2-CG1 4.5Å; F27-V100 HydrophobicContact CZ-CG1 4.5Å; V76-V100 HydrophobicContact CG1-CG1 3.9Å; L79-V100 HydrophobicContact CD2-CG1 4.41Å; L79-V100 HydrophobicContact CD2-CG2 4.23Å; V80-V100 HydrophobicContact CG2-CB 4.18Å; V80-V100 HydrophobicContact CG2-CG1 4.47Å; V80-V100 HydrophobicContact CG2-CG2 3.74Å; L83-V100 HydrophobicContact CD1-CG2 3.47Å; L83-V100 VanDerWaalsContact CD1-CG2 3.47Å; A96-V100 WeakPolarHBondContact O-CG2 3.43Å; A96-V100 PolarHBondContact O-N 3.19Å; M97-V100 PolarHBondContact O-N 3Å; R98-V100 VanDerWaalsContact C-N 3.34Å; R98-V100 PolarHBondContact O-N 2.87Å; V100-A103 PolarHBondContact O-N 3.41Å; V100-F104 HydrophobicContact CG1-CD1 4.25Å; V100-F104 HydrophobicContact CG1-CD2 4.34Å; V100-F104 HydrophobicContact CG1-CE1 3.98Å; V100-F104 HydrophobicContact CG1-CE2 4.06Å; V100-F104 HydrophobicContact CG1-CG 4.43Å; V100-F104 HydrophobicContact CG1-CZ 3.87Å; V100-F104 WeakPolarHBondContact O-CB 3.39Å; V100-F104 WeakPolarHBondContact O-CG 3.4Å; V100-F104 PolarHBondContact O-N 3.24Å; V100-L180 HydrophobicContact CG2-CD2 4.4Å
101	R	94.9	Very high	94.4	Very high	73 Å²	73	58.7 Å²	58.7	28%	0.275	30%	0.295	S	S	.	.	H	α-helix	trans	-59.4	-49	175.8	-171.4	-173.4	-53.5	98.2	3.3	111.4	F27 M97 R98 I99 F104 E105	F27-R101 HydrophobicContact CD1-CG 4.26Å; F27-R101 HydrophobicContact CE1-CB 4.18Å; F27-R101 HydrophobicContact CE1-CG 4.41Å; F27-R101 HydrophobicContact CE2-CB 4.46Å; F27-R101 HydrophobicContact CG-CG 4.33Å; F27-R101 HydrophobicContact CZ-CB 4.14Å; M97-R101 WeakPolarHBondContact O-CB 3.47Å; M97-R101 PolarHBondContact O-N 3.35Å; R98-R101 PolarHBondContact O-N 3.07Å; I99-R101 PolarHBondContact O-N 2.79Å; R101-F104 PolarHBondContact O-N 2.93Å; R101-E105 WeakPolarHBondContact O-CG 3.42Å; R101-E105 PolarHBondContact O-N 3.02Å; R101-E105 VanDerWaalsContact O-N 3.14Å
102	H	96.3	Very high	94.5	Very high	89 Å²	89	58.3 Å²	58.3	41%	0.412	29%	0.291	S	S	.	.	H	α-helix	trans	-66	-40.6	178.2	-63.7	-46.5	0	0	0	112	R98 I99 F104 E105 I106 A177	R98-H102 PolarHBondContact O-CD2 3.27Å; R98-H102 PolarHBondContact O-N 3.38Å; I99-H102 PolarHBondContact O-N 2.95Å; H102-F104 VanDerWaalsContact C-N 3.31Å; H102-F104 PolarHBondContact O-N 2.8Å; H102-E105 IonicContact ND1-OE2 2.76Å; H102-E105 PolarHBondContact O-N 2.87Å; H102-I106 WeakPolarHBondContact O-CG1 3.48Å; H102-I106 PolarHBondContact O-N 2.89Å; H102-A177 HydrophobicContact CB-CB 3.88Å
103	A	96.2	Very high	94.2	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-60.1	-40.8	175.7	0	0	0	0	0	111.8	I99 V100 I106 I107 A177 L180	I99-A103 WeakPolarHBondContact O-CB 3.35Å; I99-A103 PolarHBondContact O-N 3.2Å; V100-A103 PolarHBondContact O-N 3.41Å; A103-I106 PolarHBondContact O-N 3.47Å; A103-I107 VanDerWaalsContact O-CG1 3.22Å; A103-I107 WeakPolarHBondContact O-CG1 3.33Å; A103-I107 PolarHBondContact O-N 2.75Å; A103-A177 WeakPolarHBondContact CB-O 3.31Å; A103-L180 HydrophobicContact CB-CB 4.33Å; A103-L180 HydrophobicContact CB-CD2 4.03Å; A103-L180 HydrophobicContact CB-CG 4.35Å
104	F	96.2	Very high	94.1	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-67.9	-34.3	177.1	-77.2	6.4	0	0	0	113.1	L26 F27 V76 V100 R101 H102 I107 H108 P115 V116 L119	L26-F104 HydrophobicContact CD2-CD2 4.24Å; L26-F104 HydrophobicContact CD2-CE2 3.75Å; F27-F104 HydrophobicContact CD2-CD2 4.25Å; F27-F104 AromaticContact CE2-CD2 3.87Å; F27-F104 HydrophobicContact CE2-CD2 3.87Å; F27-F104 HydrophobicContact CE2-CE2 4.23Å; V76-F104 HydrophobicContact CG1-CE2 3.95Å; V76-F104 HydrophobicContact CG1-CZ 4.06Å; V76-F104 HydrophobicContact CG2-CE2 4.05Å; V76-F104 HydrophobicContact CG2-CZ 4.08Å; V100-F104 HydrophobicContact CG1-CD1 4.25Å; V100-F104 HydrophobicContact CG1-CD2 4.34Å; V100-F104 HydrophobicContact CG1-CE1 3.98Å; V100-F104 HydrophobicContact CG1-CE2 4.06Å; V100-F104 HydrophobicContact CG1-CG 4.43Å; V100-F104 HydrophobicContact CG1-CZ 3.87Å; V100-F104 WeakPolarHBondContact O-CB 3.39Å; V100-F104 WeakPolarHBondContact O-CG 3.4Å; V100-F104 PolarHBondContact O-N 3.24Å; R101-F104 PolarHBondContact O-N 2.93Å; H102-F104 VanDerWaalsContact C-N 3.31Å; H102-F104 PolarHBondContact O-N 2.8Å; F104-I107 HydrophobicContact CD1-CD1 4.12Å; F104-H108 PolarHBondContact O-N 2.97Å; F104-P115 HydrophobicContact CB-CB 3.82Å; F104-P115 HydrophobicContact CB-CG 3.88Å; F104-P115 HydrophobicContact CD1-CB 4.04Å; F104-P115 HydrophobicContact CD2-CB 4.31Å; F104-P115 HydrophobicContact CD2-CG 4.26Å; F104-P115 HydrophobicContact CG-CB 3.82Å; F104-P115 HydrophobicContact CG-CG 4.11Å; F104-V116 HydrophobicContact CE2-CG2 4.38Å; F104-L119 HydrophobicContact CE1-CD2 4.43Å; F104-L119 HydrophobicContact CZ-CD2 3.91Å
105	E	95.7	Very high	94.1	Very high	56 Å²	56	51.9 Å²	51.9	26%	0.262	26%	0.261	S	S	.	.	H	α-helix	trans	-64.3	-44.6	172	-70.6	173.4	162.4	0	0	111.1	K29 R101 H102 I107 H108 L109	K29-E105 IonicContact NZ-OE1 3.16Å; K29-E105 PolarHBondContact NZ-OE1 3.15Å; R101-E105 WeakPolarHBondContact O-CG 3.42Å; R101-E105 PolarHBondContact O-N 3.02Å; R101-E105 VanDerWaalsContact O-N 3.14Å; H102-E105 IonicContact ND1-OE2 2.76Å; H102-E105 PolarHBondContact O-N 2.87Å; E105-I107 PolarHBondContact O-N 3.32Å; E105-H108 PolarHBondContact O-N 3.22Å; E105-L109 VanDerWaalsContact O-CG 3.3Å; E105-L109 WeakPolarHBondContact O-CG 3.32Å; E105-L109 PolarHBondContact O-N 2.98Å
106	I	95.7	Very high	94	Very high	52 Å²	52	49 Å²	49	27%	0.267	25%	0.245	S	C	.	.	H	α-helix	trans	-62.4	-43.8	176.5	-64.1	164.2	0	0	0	111.1	H102 A103 H108 L109 H110 A177 E178 A181	H102-I106 WeakPolarHBondContact O-CG1 3.48Å; H102-I106 PolarHBondContact O-N 2.89Å; A103-I106 PolarHBondContact O-N 3.47Å; I106-H108 PolarHBondContact O-N 2.86Å; I106-L109 PolarHBondContact O-N 3.25Å; I106-H110 WeakPolarHBondContact O-CB 3.09Å; I106-H110 PolarHBondContact O-N 3.43Å; I106-A177 HydrophobicContact CD1-CB 4.29Å; I106-E178 HydrophobicContact CD1-CB 4.46Å; I106-E178 HydrophobicContact CD1-CG 3.73Å; I106-A181 HydrophobicContact CB-CB 3.94Å; I106-A181 HydrophobicContact CG2-CB 3.63Å
107	I	94.7	Very high	93.8	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-59.7	-48.2	178.3	-70.5	165.7	0	0	0	110.6	A103 F104 E105 L109 H110 T111 P115 V118 A181 L184 I185	A103-I107 VanDerWaalsContact O-CG1 3.22Å; A103-I107 WeakPolarHBondContact O-CG1 3.33Å; A103-I107 PolarHBondContact O-N 2.75Å; F104-I107 HydrophobicContact CD1-CD1 4.12Å; E105-I107 PolarHBondContact O-N 3.32Å; I107-L109 VanDerWaalsContact C-N 3.33Å; I107-L109 PolarHBondContact O-N 2.89Å; I107-H110 PolarHBondContact O-N 3.42Å; I107-H110 VanDerWaalsContact O-N 3.12Å; I107-T111 PolarHBondContact O-N 3.4Å; I107-T111 PolarHBondContact O-OG1 3.08Å; I107-T111 VanDerWaalsContact O-OG1 3.08Å; I107-P115 HydrophobicContact CB-CB 4.1Å; I107-P115 HydrophobicContact CG2-CB 3.88Å; I107-V118 HydrophobicContact CG2-CB 3.9Å; I107-V118 HydrophobicContact CG2-CG1 3.96Å; I107-V118 HydrophobicContact CG2-CG2 3.8Å; I107-A181 HydrophobicContact CD1-CB 4.45Å; I107-A181 HydrophobicContact CG1-CB 3.79Å; I107-L184 HydrophobicContact CD1-CB 4Å; I107-L184 HydrophobicContact CD1-CD1 3.64Å; I107-L184 HydrophobicContact CD1-CG 4.47Å; I107-I185 HydrophobicContact CG1-CD1 4.22Å; I107-I185 HydrophobicContact CG1-CG1 4.19Å; I107-I185 HydrophobicContact CG2-CG1 4.47Å
108	H	94.6	Very high	93.8	Very high	68 Å²	68	49.6 Å²	49.6	32%	0.315	25%	0.247	S	C	.	.	H	α-helix	trans	-62.2	-41.7	179.9	-179	64.9	0	0	0	112.3	W30 F104 E105 I106 H110 G112 E113	W30-H108 HydrophobicContact CH2-CB 3.31Å; W30-H108 AromaticContact CH2-CD2 3.35Å; W30-H108 WeakPolarHBondContact CH2-CD2 3.42Å; W30-H108 AromaticContact CH2-CG 3.14Å; W30-H108 AromaticContact CH2-ND1 3.69Å; W30-H108 AromaticContact CH2-NE2 3.94Å; W30-H108 HydrophobicContact CZ2-CB 3.93Å; W30-H108 HydrophobicContact CZ3-CB 3.92Å; W30-H108 AromaticContact CZ3-CD2 3.78Å; W30-H108 AromaticContact CZ3-CE1 3.75Å; W30-H108 AromaticContact CZ3-CG 3.43Å; W30-H108 VanDerWaalsContact CZ3-CG 3.43Å; W30-H108 AromaticContact CZ3-ND1 3.43Å; W30-H108 WeakPolarHBondContact CZ3-ND1 3.19Å; W30-H108 AromaticContact CZ3-NE2 3.93Å; F104-H108 PolarHBondContact O-N 2.97Å; E105-H108 PolarHBondContact O-N 3.22Å; I106-H108 PolarHBondContact O-N 2.86Å; H108-H110 PolarHBondContact O-N 3.08Å; H108-G112 VanDerWaalsContact O-CA 3.3Å; H108-G112 WeakPolarHBondContact O-CA 3.45Å; H108-G112 PolarHBondContact O-N 2.74Å; H108-E113 PolarHBondContact ND1-O 2.87Å
109	L	95.3	Very high	93.7	Very high	149 Å²	149	43 Å²	43	78%	0.78	22%	0.223	S	C	*	.	H	α-helix	trans	-63.1	-31.8	176	-70	172.6	0	0	0	112.4	E105 I106 I107	E105-L109 VanDerWaalsContact O-CG 3.3Å; E105-L109 WeakPolarHBondContact O-CG 3.32Å; E105-L109 PolarHBondContact O-N 2.98Å; I106-L109 PolarHBondContact O-N 3.25Å; I107-L109 VanDerWaalsContact C-N 3.33Å; I107-L109 PolarHBondContact O-N 2.89Å
110	H	92.4	Very high	93.6	Very high	121 Å²	121	41.5 Å²	41.5	56%	0.56	22%	0.215	S	C	*	.	H	α-helix	trans	-86.2	-39.1	-177.8	-166.7	78.3	0	0	0	114	I106 I107 H108 I185	I106-H110 WeakPolarHBondContact O-CB 3.09Å; I106-H110 PolarHBondContact O-N 3.43Å; I107-H110 PolarHBondContact O-N 3.42Å; I107-H110 VanDerWaalsContact O-N 3.12Å; H108-H110 PolarHBondContact O-N 3.08Å; H110-I185 HydrophobicContact CB-CD1 3.94Å
111	T	90.7	Very high	93.4	Very high	44 Å²	44	43 Å²	43	27%	0.27	22%	0.223	S	C	.	.	H	α-helix	trans	-101	-22.4	-175.8	64.7	0	0	0	0	113.8	I107 E113 V118 I185	I107-T111 PolarHBondContact O-N 3.4Å; I107-T111 PolarHBondContact O-OG1 3.08Å; I107-T111 VanDerWaalsContact O-OG1 3.08Å; T111-E113 PolarHBondContact O-N 3.36Å; T111-E113 PolarHBondContact OG1-N 3.02Å; T111-V118 HydrophobicContact CG2-CG2 4.47Å; T111-I185 HydrophobicContact CG2-CD1 4.45Å; T111-I185 HydrophobicContact CG2-CG1 4.08Å; T111-I185 HydrophobicContact CG2-CG2 4.39Å
112	G	89.3	Confident	93.3	Very high	58 Å²	58	39.5 Å²	39.5	60%	0.598	21%	0.21	S	C	*	.	S	Bend	trans	70.6	-4.3	-169.4	0	0	0	0	0	114.1	H108	H108-G112 VanDerWaalsContact O-CA 3.3Å; H108-G112 WeakPolarHBondContact O-CA 3.45Å; H108-G112 PolarHBondContact O-N 2.74Å
113	E	88.7	Confident	93.1	Very high	101 Å²	101	35.3 Å²	35.3	47%	0.472	19%	0.191	S	C	.	.	S	Bend	trans	-89.8	171.7	-179.5	-63.6	178.3	-174.3	0	0	111.6	H108 T111 P115 V118	H108-E113 PolarHBondContact ND1-O 2.87Å; T111-E113 PolarHBondContact O-N 3.36Å; T111-E113 PolarHBondContact OG1-N 3.02Å; E113-P115 WeakPolarHBondContact O-CD 3.38Å; E113-V118 HydrophobicContact CB-CG2 4.29Å
114	N	91.2	Very high	92.9	Very high	30 Å²	30	36.5 Å²	36.5	16%	0.16	20%	0.197	C	C	.	.			trans	-67.7	122.4	169.7	-174.4	-14.2	0	0	0	109.7	P31 V116 Q117 V118	P31-N114 PolarHBondContact O-ND2 3.44Å; N114-V116 PolarHBondContact O-N 3.07Å; N114-V116 VanDerWaalsContact O-N 3.11Å; N114-V116 PolarHBondContact OD1-N 3.38Å; N114-V116 VanDerWaalsContact OD1-N 3.12Å; N114-Q117 HydrophobicContact CB-CB 4.33Å; N114-Q117 WeakPolarHBondContact O-CB 3.45Å; N114-Q117 PolarHBondContact O-N 3.26Å; N114-V118 PolarHBondContact O-N 3.02Å
115	P	93.7	Very high	92.7	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62	-24.4	-178	24.8	-35.2	0	0	0	113.2	W30 F104 I107 E113 V118 L119	W30-P115 HydrophobicContact CD2-CG 3.56Å; W30-P115 VanDerWaalsContact CE3-CD 3.46Å; W30-P115 HydrophobicContact CE3-CG 3.96Å; W30-P115 HydrophobicContact CG-CG 3.93Å; W30-P115 HydrophobicContact CH2-CG 4.46Å; W30-P115 HydrophobicContact CZ2-CG 4.05Å; W30-P115 HydrophobicContact CZ3-CG 4.4Å; F104-P115 HydrophobicContact CB-CB 3.82Å; F104-P115 HydrophobicContact CB-CG 3.88Å; F104-P115 HydrophobicContact CD1-CB 4.04Å; F104-P115 HydrophobicContact CD2-CB 4.31Å; F104-P115 HydrophobicContact CD2-CG 4.26Å; F104-P115 HydrophobicContact CG-CB 3.82Å; F104-P115 HydrophobicContact CG-CG 4.11Å; I107-P115 HydrophobicContact CB-CB 4.1Å; I107-P115 HydrophobicContact CG2-CB 3.88Å; E113-P115 WeakPolarHBondContact O-CD 3.38Å; P115-V118 PolarHBondContact O-N 3.05Å; P115-L119 PolarHBondContact O-N 2.94Å
116	V	92.4	Very high	92.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-68.4	-37.9	175	-174.3	0	0	0	0	110.9	L26 W30 L32 V35 V48 F104 N114 L119 V120	L26-V116 HydrophobicContact CD2-CG2 3.75Å; W30-V116 HydrophobicContact CB-CG2 4.48Å; L32-V116 HydrophobicContact CD2-CB 4.45Å; L32-V116 HydrophobicContact CD2-CG1 3.96Å; L32-V116 HydrophobicContact CD2-CG2 4.03Å; V35-V116 HydrophobicContact CG1-CG1 4.28Å; V35-V116 HydrophobicContact CG2-CB 3.94Å; V35-V116 HydrophobicContact CG2-CG1 3.81Å; V48-V116 HydrophobicContact CG1-CG1 4.16Å; F104-V116 HydrophobicContact CE2-CG2 4.38Å; N114-V116 PolarHBondContact O-N 3.07Å; N114-V116 VanDerWaalsContact O-N 3.11Å; N114-V116 PolarHBondContact OD1-N 3.38Å; N114-V116 VanDerWaalsContact OD1-N 3.12Å; V116-L119 WeakPolarHBondContact O-CB 3.33Å; V116-L119 PolarHBondContact O-N 3.47Å; V116-V120 WeakPolarHBondContact O-CG2 3.03Å; V116-V120 PolarHBondContact O-N 3.12Å
117	Q	92	Very high	92.2	Very high	29 Å²	29	32.9 Å²	32.9	14%	0.136	18%	0.18	C	C	.	.	H	α-helix	trans	-63.5	-45.3	174.8	-174.6	62.6	46.7	0	0	110.9	V35 D36 N114 L119 V120 N121	V35-Q117 VanDerWaalsContact CA-OE1 3.3Å; D36-Q117 PolarHBondContact O-NE2 3.25Å; D36-Q117 PolarHBondContact O-OE1 3.05Å; N114-Q117 HydrophobicContact CB-CB 4.33Å; N114-Q117 WeakPolarHBondContact O-CB 3.45Å; N114-Q117 PolarHBondContact O-N 3.26Å; Q117-L119 VanDerWaalsContact C-N 3.29Å; Q117-L119 PolarHBondContact O-N 3.35Å; Q117-V120 PolarHBondContact O-N 3Å; Q117-N121 PolarHBondContact NE2-OD1 3.08Å; Q117-N121 WeakPolarHBondContact O-CB 3.37Å; Q117-N121 VanDerWaalsContact O-CG 3.29Å; Q117-N121 PolarHBondContact O-N 3.32Å
118	V	93.2	Very high	92.1	Very high	2 Å²	2	33 Å²	33	1%	0.012	18%	0.18	C	C	.	.	H	α-helix	trans	-58.9	-42.9	176.4	-178.9	0	0	0	0	110.6	I107 T111 E113 N114 P115 N121 A122 A188	I107-V118 HydrophobicContact CG2-CB 3.9Å; I107-V118 HydrophobicContact CG2-CG1 3.96Å; I107-V118 HydrophobicContact CG2-CG2 3.8Å; T111-V118 HydrophobicContact CG2-CG2 4.47Å; E113-V118 HydrophobicContact CB-CG2 4.29Å; N114-V118 PolarHBondContact O-N 3.02Å; P115-V118 PolarHBondContact O-N 3.05Å; V118-N121 PolarHBondContact O-N 2.88Å; V118-A122 VanDerWaalsContact O-CB 3.25Å; V118-A122 WeakPolarHBondContact O-CB 3.48Å; V118-A122 PolarHBondContact O-N 2.88Å; V118-A188 HydrophobicContact CG1-CB 3.74Å
119	L	93.5	Very high	91.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.4	-45.6	175.6	175.8	64.1	0	0	0	112.3	I75 V76 L79 F104 P115 V116 Q117 A122 I123 L184	I75-L119 HydrophobicContact CG2-CD2 4.18Å; V76-L119 HydrophobicContact CG2-CD2 4.01Å; L79-L119 HydrophobicContact CD1-CD1 4.44Å; L79-L119 HydrophobicContact CD2-CD1 3.98Å; L79-L119 HydrophobicContact CD2-CD2 4.2Å; F104-L119 HydrophobicContact CE1-CD2 4.43Å; F104-L119 HydrophobicContact CZ-CD2 3.91Å; P115-L119 PolarHBondContact O-N 2.94Å; V116-L119 WeakPolarHBondContact O-CB 3.33Å; V116-L119 PolarHBondContact O-N 3.47Å; Q117-L119 VanDerWaalsContact C-N 3.29Å; Q117-L119 PolarHBondContact O-N 3.35Å; L119-A122 PolarHBondContact O-N 2.93Å; L119-I123 HydrophobicContact CD1-CD1 3.89Å; L119-I123 HydrophobicContact CD1-CG1 4.26Å; L119-I123 HydrophobicContact CG-CD1 3.97Å; L119-I123 VanDerWaalsContact O-CG1 3.28Å; L119-I123 WeakPolarHBondContact O-CG1 3.5Å; L119-I123 PolarHBondContact O-N 3.12Å; L119-L184 HydrophobicContact CD1-CD1 4.33Å; L119-L184 HydrophobicContact CD1-CD2 3.53Å
120	V	92.5	Very high	91.7	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62.4	-48	178.6	169.2	0	0	0	0	110.5	V35 I37 I46 V48 V116 Q117 A122 I123 I124	V35-V120 HydrophobicContact CG1-CB 4.41Å; V35-V120 HydrophobicContact CG1-CG2 3.88Å; I37-V120 HydrophobicContact CG1-CG1 4.03Å; I46-V120 HydrophobicContact CD1-CG1 4.46Å; I46-V120 HydrophobicContact CG2-CG2 4.05Å; V48-V120 HydrophobicContact CG2-CG2 4.06Å; V116-V120 WeakPolarHBondContact O-CG2 3.03Å; V116-V120 PolarHBondContact O-N 3.12Å; Q117-V120 PolarHBondContact O-N 3Å; V120-A122 VanDerWaalsContact C-N 3.33Å; V120-A122 PolarHBondContact O-N 2.67Å; V120-I123 PolarHBondContact O-N 3.11Å; V120-I124 HydrophobicContact CG1-CD1 3.77Å; V120-I124 HydrophobicContact CG1-CG1 4.46Å; V120-I124 VanDerWaalsContact O-CG1 3.31Å; V120-I124 WeakPolarHBondContact O-CG1 3.5Å; V120-I124 PolarHBondContact O-N 3.43Å
121	N	91.6	Very high	91.7	Very high	31 Å²	31	27.6 Å²	27.6	17%	0.166	15%	0.146	C	C	.	.	H	α-helix	trans	-58.8	-44.2	176.5	-69.9	-14.4	0	0	0	111.6	Q117 V118 I123 I124 N125 A188	Q117-N121 PolarHBondContact NE2-OD1 3.08Å; Q117-N121 WeakPolarHBondContact O-CB 3.37Å; Q117-N121 VanDerWaalsContact O-CG 3.29Å; Q117-N121 PolarHBondContact O-N 3.32Å; V118-N121 PolarHBondContact O-N 2.88Å; N121-I123 VanDerWaalsContact C-N 3.33Å; N121-I123 PolarHBondContact O-N 2.98Å; N121-I124 PolarHBondContact O-N 3.45Å; N121-N125 WeakPolarHBondContact O-CB 3.5Å; N121-N125 PolarHBondContact O-N 3.27Å; N121-N125 PolarHBondContact O-ND2 3.13Å; N121-A188 HydrophobicContact CB-CB 4.12Å
122	A	93.1	Very high	91.7	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-59.9	-41.4	176.6	0	0	0	0	0	112.5	V118 L119 V120 S126 L161 L184 A187 A188	V118-A122 VanDerWaalsContact O-CB 3.25Å; V118-A122 WeakPolarHBondContact O-CB 3.48Å; V118-A122 PolarHBondContact O-N 2.88Å; L119-A122 PolarHBondContact O-N 2.93Å; V120-A122 VanDerWaalsContact C-N 3.33Å; V120-A122 PolarHBondContact O-N 2.67Å; A122-S126 WeakPolarHBondContact O-CB 3.41Å; A122-S126 PolarHBondContact O-N 3.46Å; A122-S126 PolarHBondContact O-OG 3.01Å; A122-L161 HydrophobicContact CB-CD1 4.35Å; A122-L184 HydrophobicContact CB-CD2 3.87Å; A122-A187 HydrophobicContact CB-CB 3.76Å; A122-A188 HydrophobicContact CB-CB 4.42Å
123	I	93.5	Very high	91.8	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-67.9	-43.9	178.8	-71.4	169.7	0	0	0	111.3	I46 I75 L119 V120 N121 N125 S126 G127 V154 A157 I158 L161	I46-I123 HydrophobicContact CD1-CG2 4.43Å; I75-I123 HydrophobicContact CD1-CD1 3.8Å; I75-I123 HydrophobicContact CG1-CD1 3.47Å; I75-I123 VanDerWaalsContact CG1-CD1 3.47Å; L119-I123 HydrophobicContact CD1-CD1 3.89Å; L119-I123 HydrophobicContact CD1-CG1 4.26Å; L119-I123 HydrophobicContact CG-CD1 3.97Å; L119-I123 VanDerWaalsContact O-CG1 3.28Å; L119-I123 WeakPolarHBondContact O-CG1 3.5Å; L119-I123 PolarHBondContact O-N 3.12Å; V120-I123 PolarHBondContact O-N 3.11Å; N121-I123 VanDerWaalsContact C-N 3.33Å; N121-I123 PolarHBondContact O-N 2.98Å; I123-N125 VanDerWaalsContact C-N 3.31Å; I123-N125 PolarHBondContact O-N 2.97Å; I123-S126 PolarHBondContact O-N 3.31Å; I123-G127 PolarHBondContact O-N 3.26Å; I123-V154 HydrophobicContact CG2-CB 4.46Å; I123-V154 HydrophobicContact CG2-CG1 3.94Å; I123-V154 HydrophobicContact CG2-CG2 4.43Å; I123-A157 HydrophobicContact CG2-CB 4.08Å; I123-A157 WeakPolarHBondContact O-CB 3.3Å; I123-I158 HydrophobicContact CD1-CD1 4.27Å; I123-I158 HydrophobicContact CD1-CG1 3.84Å; I123-I158 HydrophobicContact CG1-CG1 4.12Å; I123-L161 HydrophobicContact CG1-CD1 4.25Å
124	I	91.9	Very high	91.9	Very high	25 Å²	25	30.3 Å²	30.3	13%	0.128	14%	0.14	C	C	.	.	H	α-helix	trans	-58.7	-46.2	177.5	-67	166.4	0	0	0	109.9	I37 D39 L42 I46 V120 N121	I37-I124 HydrophobicContact CG2-CD1 4.25Å; D39-I124 HydrophobicContact CB-CG1 4.49Å; D39-I124 HydrophobicContact CB-CG2 3.95Å; L42-I124 HydrophobicContact CD1-CB 4.33Å; L42-I124 HydrophobicContact CD1-CG1 3.93Å; L42-I124 HydrophobicContact CD1-CG2 4.39Å; I46-I124 HydrophobicContact CD1-CG1 4.24Å; V120-I124 HydrophobicContact CG1-CD1 3.77Å; V120-I124 HydrophobicContact CG1-CG1 4.46Å; V120-I124 VanDerWaalsContact O-CG1 3.31Å; V120-I124 WeakPolarHBondContact O-CG1 3.5Å; V120-I124 PolarHBondContact O-N 3.43Å; N121-I124 PolarHBondContact O-N 3.45Å
125	N	90.6	Very high	91.9	Very high	31 Å²	31	31.7 Å²	31.7	17%	0.166	15%	0.146	C	C	.	.	H	α-helix	trans	-72	-36.1	-177.6	-65.4	-19.4	0	0	0	113.1	N121 I123 G127 A187 A188 G191 K220	N121-N125 WeakPolarHBondContact O-CB 3.5Å; N121-N125 PolarHBondContact O-N 3.27Å; N121-N125 PolarHBondContact O-ND2 3.13Å; I123-N125 VanDerWaalsContact C-N 3.31Å; I123-N125 PolarHBondContact O-N 2.97Å; N125-G127 VanDerWaalsContact C-N 3.34Å; N125-G127 PolarHBondContact O-N 3.42Å; N125-A187 WeakPolarHBondContact CB-O 3.26Å; N125-A187 PolarHBondContact ND2-O 3.3Å; N125-A188 PolarHBondContact ND2-O 2.99Å; N125-G191 PolarHBondContact ND2-N 3.07Å; N125-K220 VanDerWaalsContact O-CD 3.32Å; N125-K220 WeakPolarHBondContact O-CD 3.29Å; N125-K220 PolarHBondContact O-NZ 2.96Å
126	S	90.6	Very high	91.5	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-80.4	-12.8	-175.6	-59	0	0	0	0	114.3	A122 I123	A122-S126 WeakPolarHBondContact O-CB 3.41Å; A122-S126 PolarHBondContact O-N 3.46Å; A122-S126 PolarHBondContact O-OG 3.01Å; I123-S126 PolarHBondContact O-N 3.31Å
127	G	89.8	Confident	91.1	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.01	21%	0.207	C	C	.	.			trans	-74.1	123.2	-177.6	0	0	0	0	0	113.2	I123 N125 K220	I123-G127 PolarHBondContact O-N 3.26Å; N125-G127 VanDerWaalsContact C-N 3.34Å; N125-G127 PolarHBondContact O-N 3.42Å; G127-K220 WeakPolarHBondContact O-CD 3.42Å; G127-K220 VanDerWaalsContact O-CE 3.23Å; G127-K220 WeakPolarHBondContact O-CE 3.27Å; G127-K220 PolarHBondContact O-NZ 3.4Å
128	P	92.6	Very high	90.8	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.006	24%	0.244	C	C	.	.			trans	-71.4	144.1	174	30.7	-35.3	0	0	0	111.6	R153 Q156 K220 E224	P128-R153 PolarHBondContact O-NE 3.17Å; P128-Q156 HydrophobicContact CG-CB 4.33Å; P128-K220 HydrophobicContact CB-CG 4.16Å; P128-E224 WeakPolarHBondContact CA-OE1 3.43Å
129	R	91.1	Very high	90.5	Very high	150 Å²	150	51.2 Å²	51.2	57%	0.566	28%	0.282	S	S	*	.	S	Bend	trans	-92.8	-38.3	178.2	-62.1	-175.1	174.8	-161	-0.5	112.1	V148 E224	R129-V148 PolarHBondContact O-N 2.78Å; R129-E224 PolarHBondContact N-OE1 3.36Å
130	E	91.8	Very high	90.1	Very high	51 Å²	51	56.3 Å²	56.3	24%	0.238	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	144.5	-179	-61.7	176.7	174	0	0	110	A227	E130-A227 HydrophobicContact CB-CB 3.65Å
131	D	92.4	Very high	89.9	Confident	24 Å²	24	60.2 Å²	60.2	13%	0.128	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	162.6	173.2	-163.2	-5.7	0	0	0	108.4	V146 V148 R152	D131-V146 PolarHBondContact N-O 2.79Å; D131-V146 PolarHBondContact O-N 3.16Å; D131-V148 HydrophobicContact CB-CG2 3.58Å; D131-R152 IonicContact OD2-CZ 3.81Å; D131-R152 IonicContact OD2-NE 3.73Å; D131-R152 IonicContact OD2-NH2 3.84Å; D131-R152 PolarHBondContact OD2-NH2 3.2Å
132	S	90.9	Very high	89.8	Confident	29 Å²	29	65 Å²	65	20%	0.203	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	128.3	177.8	69.1	0	0	0	0	110.4
133	T	91.5	Very high	89.7	Confident	57 Å²	57	71.1 Å²	71.1	35%	0.35	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	144.3	175.3	64.5	0	0	0	0	110.6	I135 R143 Q144 V146	T133-I135 PolarHBondContact O-N 3.21Å; T133-R143 CarbonylContact O-C 3.4Å; T133-R143 VanDerWaalsContact O-CA 3.3Å; T133-R143 WeakPolarHBondContact O-CA 3.33Å; T133-Q144 PolarHBondContact N-O 3.28Å; T133-Q144 PolarHBondContact O-N 3.36Å; T133-V146 HydrophobicContact CG2-CB 3.99Å; T133-V146 HydrophobicContact CG2-CG1 4.48Å; T133-V146 HydrophobicContact CG2-CG2 3.79Å; T133-V146 WeakPolarHBondContact OG1-CG2 3.46Å
134	R	91	Very high	89.6	Confident	175 Å²	175	73.7 Å²	73.7	66%	0.66	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.8	111.3	175.5	-177	-176.8	-74	-89.8	6.5	108.3	V141	R134-V141 VanDerWaalsContact CD-CG1 3.49Å; R134-V141 HydrophobicContact CG-CG1 3.11Å
135	I	89.5	Confident	89.6	Confident	58 Å²	58	73.7 Å²	73.7	30%	0.297	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	116.3	174.1	-56.7	-176.8	0	0	0	108.1	T133 R142 Q144	T133-I135 PolarHBondContact O-N 3.21Å; I135-R142 PolarHBondContact N-O 3.47Å; I135-R142 PolarHBondContact O-N 3.36Å; I135-R142 VanDerWaalsContact O-N 3.15Å; I135-Q144 HydrophobicContact CD1-CB 3.46Å; I135-Q144 VanDerWaalsContact CD1-CB 3.46Å; I135-Q144 HydrophobicContact CD1-CG 3.83Å; I135-Q144 HydrophobicContact CG1-CB 4.02Å
136	G	86.8	Confident	89.8	Confident	50 Å²	50	75.1 Å²	75.1	52%	0.515	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	126	169.2	0	0	0	0	0	110.1
137	R	83.3	Confident	89.9	Confident	203 Å²	203	81.5 Å²	81.5	77%	0.766	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.2	121.7	159.5	-77.1	-168.7	177.7	-168.9	0	106.8	T140	R137-T140 PolarHBondContact N-O 3.08Å
138	A	85.3	Confident	90.1	Very high	109 Å²	109	82 Å²	82	90%	0.901	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	-139	-171	0	0	0	0	0	112.6
139	G	87	Confident	90.1	Very high	80 Å²	80	85.2 Å²	85.2	83%	0.825	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-3.5	-174.6	0	0	0	0	0	115.8
140	T	86.2	Confident	90.2	Very high	107 Å²	107	79.8 Å²	79.8	66%	0.656	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.1	137.5	177.3	61.2	0	0	0	0	111.1	R137	R137-T140 PolarHBondContact N-O 3.08Å
141	V	87.5	Confident	90.3	Very high	81 Å²	81	78.3 Å²	78.3	49%	0.491	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	113	-179.2	-178.9	0	0	0	0	108.9	R134	R134-V141 VanDerWaalsContact CD-CG1 3.49Å; R134-V141 HydrophobicContact CG-CG1 3.11Å
142	R	88.8	Confident	90.4	Very high	131 Å²	131	83 Å²	83	49%	0.494	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	157	178	63.7	-174.4	-177	85.2	-1.9	110.9	I135	I135-R142 PolarHBondContact N-O 3.47Å; I135-R142 PolarHBondContact O-N 3.36Å; I135-R142 VanDerWaalsContact O-N 3.15Å
143	R	91.1	Very high	90.5	Very high	130 Å²	130	83.1 Å²	83.1	49%	0.491	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	141.6	168.8	-72.3	-175.3	175.9	132	-3.7	109	T133 N230	T133-R143 CarbonylContact O-C 3.4Å; T133-R143 VanDerWaalsContact O-CA 3.3Å; T133-R143 WeakPolarHBondContact O-CA 3.33Å; R143-N230 HydrophobicContact CB-CB 4.06Å
144	Q	91	Very high	90.6	Very high	55 Å²	55	80.5 Å²	80.5	26%	0.257	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	134.7	173.7	-178.1	66.7	55.7	0	0	108	T133 I135	T133-Q144 PolarHBondContact N-O 3.28Å; T133-Q144 PolarHBondContact O-N 3.36Å; I135-Q144 HydrophobicContact CD1-CB 3.46Å; I135-Q144 VanDerWaalsContact CD1-CB 3.46Å; I135-Q144 HydrophobicContact CD1-CG 3.83Å; I135-Q144 HydrophobicContact CG1-CB 4.02Å
145	A	93.5	Very high	90.8	Very high	25 Å²	25	75.1 Å²	75.1	21%	0.207	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	131.9	170.4	0	0	0	0	0	110.9	A227 N230 R231	A145-A227 HydrophobicContact CB-CB 4.37Å; A145-A227 WeakPolarHBondContact CB-O 3.3Å; A145-N230 PolarHBondContact N-O 3.43Å; A145-R231 HydrophobicContact CB-CB 4.43Å
146	V	93.2	Very high	91.1	Very high	60 Å²	60	74 Å²	74	36%	0.364	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	142.3	179.6	179	0	0	0	0	109.8	D131 T133	D131-V146 PolarHBondContact N-O 2.79Å; D131-V146 PolarHBondContact O-N 3.16Å; T133-V146 HydrophobicContact CG2-CB 3.99Å; T133-V146 HydrophobicContact CG2-CG1 4.48Å; T133-V146 HydrophobicContact CG2-CG2 3.79Å; T133-V146 WeakPolarHBondContact OG1-CG2 3.46Å
147	D	93.5	Very high	91.4	Very high	134 Å²	134	71.6 Å²	71.6	72%	0.717	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.8	145.4	176.4	-56.9	-57.3	0	0	0	112.7
148	V	93.5	Very high	92	Very high	13 Å²	13	62 Å²	62	8%	0.079	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-95	130.5	-179.9	-178.7	0	0	0	0	110.9	R129 D131 R152 R153	R129-V148 PolarHBondContact O-N 2.78Å; D131-V148 HydrophobicContact CB-CG2 3.58Å; V148-R152 HydrophobicContact CG1-CB 3.76Å; V148-R152 HydrophobicContact CG1-CG 3.72Å; V148-R153 HydrophobicContact CG1-CB 4.41Å
149	S	93.2	Very high	92.5	Very high	67 Å²	67	63.2 Å²	63.2	47%	0.469	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-64.9	147.8	174.8	64.8	0	0	0	0	112.6	L151 R152 R153	S149-L151 VanDerWaalsContact C-N 3.3Å; S149-L151 PolarHBondContact O-N 2.76Å; S149-R152 WeakPolarHBondContact O-CA 3.5Å; S149-R152 WeakPolarHBondContact O-CB 3.5Å; S149-R152 PolarHBondContact O-N 3.43Å; S149-R152 WeakPolarHBondContact OG-CB 3.34Å; S149-R153 PolarHBondContact O-N 3.04Å
150	P	93.5	Very high	92.9	Very high	36 Å²	36	59.9 Å²	59.9	23%	0.234	30%	0.296	C	S	.	.	H	α-helix	trans	-58.6	-37.7	-177.6	-26	34.1	0	0	0	113.9	S41 L42 Y45 R152 R153 V154	S41-P150 WeakPolarHBondContact O-CB 3.32Å; L42-P150 HydrophobicContact CD2-CB 4.04Å; Y45-P150 HydrophobicContact CD2-CB 3.51Å; Y45-P150 HydrophobicContact CD2-CG 4.45Å; Y45-P150 HydrophobicContact CE2-CB 3.54Å; Y45-P150 HydrophobicContact CE2-CG 4.04Å; Y45-P150 HydrophobicContact CG-CB 4.32Å; P150-R152 VanDerWaalsContact C-N 3.32Å; P150-R152 PolarHBondContact O-N 3.45Å; P150-R153 WeakPolarHBondContact O-CB 3.43Å; P150-R153 PolarHBondContact O-N 3.49Å; P150-V154 PolarHBondContact O-N 2.99Å; P150-V154 VanDerWaalsContact O-N 3.08Å
151	L	93.7	Very high	93.3	Very high	21 Å²	21	54.8 Å²	54.8	11%	0.11	27%	0.265	C	S	.	.	H	α-helix	trans	-62	-40.2	174.9	-178.3	61.6	0	0	0	112	Y45 F68 S149 N155	Y45-L151 HydrophobicContact CD1-CB 3.79Å; Y45-L151 HydrophobicContact CD1-CD1 3.92Å; Y45-L151 HydrophobicContact CD1-CG 4.39Å; Y45-L151 HydrophobicContact CE1-CB 3.76Å; Y45-L151 HydrophobicContact CE1-CD1 4.47Å; F68-L151 HydrophobicContact CD1-CD2 4.12Å; S149-L151 VanDerWaalsContact C-N 3.3Å; S149-L151 PolarHBondContact O-N 2.76Å; L151-N155 VanDerWaalsContact O-CG 3.31Å; L151-N155 PolarHBondContact O-N 2.94Å; L151-N155 VanDerWaalsContact O-N 3.16Å; L151-N155 PolarHBondContact O-ND2 2.98Å
152	R	93.8	Very high	93.7	Very high	123 Å²	123	50.9 Å²	50.9	46%	0.464	24%	0.241	S	C	.	.	H	α-helix	trans	-69.3	-39.3	176.4	-178.9	170.4	172.9	127.7	-9.1	110.8	D131 V148 S149 P150 V154 N155 Q156	D131-R152 IonicContact OD2-CZ 3.81Å; D131-R152 IonicContact OD2-NE 3.73Å; D131-R152 IonicContact OD2-NH2 3.84Å; D131-R152 PolarHBondContact OD2-NH2 3.2Å; V148-R152 HydrophobicContact CG1-CB 3.76Å; V148-R152 HydrophobicContact CG1-CG 3.72Å; S149-R152 WeakPolarHBondContact O-CA 3.5Å; S149-R152 WeakPolarHBondContact O-CB 3.5Å; S149-R152 PolarHBondContact O-N 3.43Å; S149-R152 WeakPolarHBondContact OG-CB 3.34Å; P150-R152 VanDerWaalsContact C-N 3.32Å; P150-R152 PolarHBondContact O-N 3.45Å; R152-V154 PolarHBondContact O-N 3.47Å; R152-N155 PolarHBondContact O-N 3.39Å; R152-Q156 HydrophobicContact CG-CG 4.14Å; R152-Q156 WeakPolarHBondContact O-CB 3.48Å; R152-Q156 PolarHBondContact O-N 3.31Å
153	R	93.8	Very high	93.9	Very high	31 Å²	31	45.2 Å²	45.2	12%	0.117	22%	0.221	C	C	.	.	H	α-helix	trans	-54	-51	175.1	-171.9	178.8	-61.7	162.3	4.5	111.7	D39 S41 L42 P128 V148 S149 P150 Q156 A157	D39-R153 IonicContact OD2-NH1 2.86Å; S41-R153 PolarHBondContact OG-NH1 3Å; L42-R153 HydrophobicContact CD2-CB 4.38Å; L42-R153 HydrophobicContact CD2-CG 4.42Å; P128-R153 PolarHBondContact O-NE 3.17Å; V148-R153 HydrophobicContact CG1-CB 4.41Å; S149-R153 PolarHBondContact O-N 3.04Å; P150-R153 WeakPolarHBondContact O-CB 3.43Å; P150-R153 PolarHBondContact O-N 3.49Å; R153-Q156 PolarHBondContact O-N 3.48Å; R153-A157 WeakPolarHBondContact O-CB 3.33Å; R153-A157 PolarHBondContact O-N 2.97Å
154	V	94.4	Very high	94	Very high	1 Å²	1	39 Å²	39	1%	0.006	20%	0.198	C	C	.	.	H	α-helix	trans	-64.6	-42.5	177.6	-178.2	0	0	0	0	111.9	L42 I46 I75 R78 I123 P150 R152 A157 I158	L42-V154 HydrophobicContact CD2-CG2 3.73Å; I46-V154 HydrophobicContact CG1-CG2 4.19Å; I75-V154 HydrophobicContact CD1-CG1 3.81Å; R78-V154 VanDerWaalsContact NH2-CG1 3.32Å; I123-V154 HydrophobicContact CG2-CB 4.46Å; I123-V154 HydrophobicContact CG2-CG1 3.94Å; I123-V154 HydrophobicContact CG2-CG2 4.43Å; P150-V154 PolarHBondContact O-N 2.99Å; P150-V154 VanDerWaalsContact O-N 3.08Å; R152-V154 PolarHBondContact O-N 3.47Å; V154-A157 PolarHBondContact O-N 2.84Å; V154-I158 HydrophobicContact CG1-CD1 3.88Å; V154-I158 HydrophobicContact CG1-CG1 4.47Å; V154-I158 VanDerWaalsContact O-CG1 3.32Å; V154-I158 WeakPolarHBondContact O-CG1 3.3Å; V154-I158 PolarHBondContact O-N 2.98Å; V154-I158 VanDerWaalsContact O-N 3.11Å
155	N	94.9	Very high	94.2	Very high	62 Å²	62	36.4 Å²	36.4	33%	0.332	19%	0.186	S	C	.	.	H	α-helix	trans	-63.9	-43.9	179.5	-75.7	-40.8	0	0	0	112.4	R78 L151 R152 W159	R78-N155 PolarHBondContact NH2-OD1 3.11Å; L151-N155 VanDerWaalsContact O-CG 3.31Å; L151-N155 PolarHBondContact O-N 2.94Å; L151-N155 VanDerWaalsContact O-N 3.16Å; L151-N155 PolarHBondContact O-ND2 2.98Å; R152-N155 PolarHBondContact O-N 3.39Å; N155-W159 WeakPolarHBondContact O-CB 3.39Å; N155-W159 PolarHBondContact O-N 3.48Å
156	Q	94.5	Very high	94.2	Very high	34 Å²	34	37 Å²	37	16%	0.159	18%	0.182	C	C	.	.	H	α-helix	trans	-66.5	-42.6	177.7	-77.6	177.6	-28	0	0	111.1	P128 R152 R153 I158 W159 L160	P128-Q156 HydrophobicContact CG-CB 4.33Å; R152-Q156 HydrophobicContact CG-CG 4.14Å; R152-Q156 WeakPolarHBondContact O-CB 3.48Å; R152-Q156 PolarHBondContact O-N 3.31Å; R153-Q156 PolarHBondContact O-N 3.48Å; Q156-I158 PolarHBondContact O-N 3.49Å; Q156-W159 PolarHBondContact O-N 3.11Å; Q156-L160 WeakPolarHBondContact O-CB 3.3Å; Q156-L160 VanDerWaalsContact O-CG 3.3Å; Q156-L160 WeakPolarHBondContact O-CG 3.26Å; Q156-L160 PolarHBondContact O-N 2.71Å
157	A	94.8	Very high	94.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-56.1	-52.8	176.4	0	0	0	0	0	112	I123 R153 V154 W159 L160 L161	I123-A157 HydrophobicContact CG2-CB 4.08Å; I123-A157 WeakPolarHBondContact O-CB 3.3Å; R153-A157 WeakPolarHBondContact O-CB 3.33Å; R153-A157 PolarHBondContact O-N 2.97Å; V154-A157 PolarHBondContact O-N 2.84Å; A157-W159 VanDerWaalsContact C-N 3.31Å; A157-W159 PolarHBondContact O-N 3.46Å; A157-L160 PolarHBondContact O-N 2.97Å; A157-L161 VanDerWaalsContact O-CG 3.29Å; A157-L161 WeakPolarHBondContact O-CG 3.47Å; A157-L161 PolarHBondContact O-N 2.93Å
158	I	95.5	Very high	94.1	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-61	-42	179.1	-64.2	169.9	0	0	0	110.9	I75 R78 L79 S82 I123 V154 Q156 C162	I75-I158 HydrophobicContact CD1-CD1 3.72Å; R78-I158 HydrophobicContact CB-CD1 3.86Å; L79-I158 HydrophobicContact CD1-CG2 4.05Å; S82-I158 VanDerWaalsContact OG-CG2 3.32Å; S82-I158 WeakPolarHBondContact OG-CG2 3.46Å; I123-I158 HydrophobicContact CD1-CD1 4.27Å; I123-I158 HydrophobicContact CD1-CG1 3.84Å; I123-I158 HydrophobicContact CG1-CG1 4.12Å; V154-I158 HydrophobicContact CG1-CD1 3.88Å; V154-I158 HydrophobicContact CG1-CG1 4.47Å; V154-I158 VanDerWaalsContact O-CG1 3.32Å; V154-I158 WeakPolarHBondContact O-CG1 3.3Å; V154-I158 PolarHBondContact O-N 2.98Å; V154-I158 VanDerWaalsContact O-N 3.11Å; Q156-I158 PolarHBondContact O-N 3.49Å; I158-C162 WeakPolarHBondContact O-CB 3.39Å; I158-C162 PolarHBondContact O-N 3.25Å; I158-C162 VanDerWaalsContact O-N 3.08Å; I158-C162 PolarHBondContact O-SG 3.41Å; I158-C162 VanDerWaalsContact O-SG 3.4Å
159	W	95.3	Very high	94.1	Very high	136 Å²	136	35.8 Å²	35.8	52%	0.515	18%	0.177	S	C	.	.	H	α-helix	trans	-65.2	-44.4	-179.4	-177.7	80.2	0	0	0	112.2	N155 Q156 A157 C162 T163	N155-W159 WeakPolarHBondContact O-CB 3.39Å; N155-W159 PolarHBondContact O-N 3.48Å; Q156-W159 PolarHBondContact O-N 3.11Å; A157-W159 VanDerWaalsContact C-N 3.31Å; A157-W159 PolarHBondContact O-N 3.46Å; W159-C162 PolarHBondContact O-N 2.97Å; W159-T163 WeakPolarHBondContact O-CB 3.43Å; W159-T163 PolarHBondContact O-N 3.2Å; W159-T163 PolarHBondContact O-OG1 3.17Å
160	L	95.3	Very high	94	Very high	9 Å²	9	39.6 Å²	39.6	5%	0.047	19%	0.185	C	C	.	.	H	α-helix	trans	-65.5	-42.2	179	-73.3	173.4	0	0	0	111.9	Q156 A157 T163 G164 Y215 A216 K219	Q156-L160 WeakPolarHBondContact O-CB 3.3Å; Q156-L160 VanDerWaalsContact O-CG 3.3Å; Q156-L160 WeakPolarHBondContact O-CG 3.26Å; Q156-L160 PolarHBondContact O-N 2.71Å; A157-L160 PolarHBondContact O-N 2.97Å; L160-T163 PolarHBondContact O-N 3.16Å; L160-G164 PolarHBondContact O-N 3.01Å; L160-Y215 HydrophobicContact CD2-CE1 4.13Å; L160-A216 HydrophobicContact CB-CB 3.73Å; L160-K219 HydrophobicContact CD1-CB 4.21Å; L160-K219 HydrophobicContact CD2-CB 3.8Å; L160-K219 HydrophobicContact CD2-CG 4.19Å
161	L	94.9	Very high	93.9	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-59.5	-47.7	175	-72.3	166.1	0	0	0	111.5	A122 I123 A157 T163 G164 A165 L184 A187 A216	A122-L161 HydrophobicContact CB-CD1 4.35Å; I123-L161 HydrophobicContact CG1-CD1 4.25Å; A157-L161 VanDerWaalsContact O-CG 3.29Å; A157-L161 WeakPolarHBondContact O-CG 3.47Å; A157-L161 PolarHBondContact O-N 2.93Å; L161-T163 VanDerWaalsContact C-N 3.32Å; L161-T163 PolarHBondContact O-N 3.44Å; L161-G164 PolarHBondContact O-N 3.41Å; L161-A165 WeakPolarHBondContact O-CB 3.34Å; L161-A165 PolarHBondContact O-N 3.41Å; L161-L184 HydrophobicContact CD1-CD2 3.98Å; L161-L184 HydrophobicContact CD2-CD2 4.41Å; L161-A187 HydrophobicContact CD2-CB 3.73Å; L161-A216 HydrophobicContact CD2-CB 3.85Å; L161-A216 HydrophobicContact CG-CB 4.02Å
162	C	95.1	Very high	93.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-67.5	-30.8	177.5	-72.8	0	0	0	0	113.1	L79 L83 I158 W159 R166	L79-C162 VanDerWaalsContact CD1-SG 3.57Å; L83-C162 HydrophobicContact CD2-CB 4.21Å; I158-C162 WeakPolarHBondContact O-CB 3.39Å; I158-C162 PolarHBondContact O-N 3.25Å; I158-C162 VanDerWaalsContact O-N 3.08Å; I158-C162 PolarHBondContact O-SG 3.41Å; I158-C162 VanDerWaalsContact O-SG 3.4Å; W159-C162 PolarHBondContact O-N 2.97Å; C162-R166 WeakPolarHBondContact O-CG 3.29Å; C162-R166 PolarHBondContact O-N 3.38Å; C162-R166 PolarHBondContact O-NH1 3.46Å; C162-R166 VanDerWaalsContact O-NH1 3.09Å
163	T	94.3	Very high	93.8	Very high	12 Å²	12	54 Å²	54	7%	0.074	25%	0.251	C	S	.	.	H	α-helix	trans	-71.6	-47.2	177.2	-57.8	0	0	0	0	110	W159 L160 L161 A165 R166 E167 Y215	W159-T163 WeakPolarHBondContact O-CB 3.43Å; W159-T163 PolarHBondContact O-N 3.2Å; W159-T163 PolarHBondContact O-OG1 3.17Å; L160-T163 PolarHBondContact O-N 3.16Å; L161-T163 VanDerWaalsContact C-N 3.32Å; L161-T163 PolarHBondContact O-N 3.44Å; T163-A165 VanDerWaalsContact C-N 3.34Å; T163-A165 PolarHBondContact O-N 3.08Å; T163-R166 PolarHBondContact O-N 2.87Å; T163-R166 VanDerWaalsContact O-N 3.14Å; T163-E167 HydrophobicContact CG2-CG 4.49Å; T163-E167 PolarHBondContact O-N 3.18Å; T163-Y215 HydrophobicContact CG2-CE1 4.03Å
164	G	93	Very high	93.8	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-56.7	-44.9	173.2	0	0	0	0	0	113	L160 L161 R166 E167 S168	L160-G164 PolarHBondContact O-N 3.01Å; L161-G164 PolarHBondContact O-N 3.41Å; G164-R166 VanDerWaalsContact C-N 3.31Å; G164-R166 PolarHBondContact O-N 2.99Å; G164-E167 PolarHBondContact O-N 2.98Å; G164-S168 WeakPolarHBondContact O-CB 3.2Å; G164-S168 PolarHBondContact O-N 3.18Å; G164-S168 PolarHBondContact O-OG 3.45Å; G164-S168 VanDerWaalsContact O-OG 3.08Å
165	A	94.6	Very high	93.8	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-61.7	-37.5	177.4	0	0	0	0	0	112.7	L161 T163 A169 I176 L180 E183	L161-A165 WeakPolarHBondContact O-CB 3.34Å; L161-A165 PolarHBondContact O-N 3.41Å; T163-A165 VanDerWaalsContact C-N 3.34Å; T163-A165 PolarHBondContact O-N 3.08Å; A165-A169 VanDerWaalsContact O-CB 3.28Å; A165-A169 WeakPolarHBondContact O-CB 3.37Å; A165-A169 PolarHBondContact O-N 3.42Å; A165-A169 VanDerWaalsContact O-N 3.14Å; A165-I176 HydrophobicContact CB-CD1 4.17Å; A165-I176 VanDerWaalsContact O-CD1 3.29Å; A165-I176 WeakPolarHBondContact O-CD1 3.28Å; A165-L180 HydrophobicContact CB-CB 4.12Å; A165-L180 HydrophobicContact CB-CD1 3.8Å; A165-E183 HydrophobicContact CB-CG 4.5Å
166	R	93.1	Very high	93.8	Very high	37 Å²	37	60 Å²	60	14%	0.14	28%	0.282	C	S	.	.	H	α-helix	trans	-72.9	-44.1	177.7	-76.2	-173.6	-162.8	98	-12.2	113	S82 L83 C162 T163 G164 S168 A169 F170 I176	S82-R166 PolarHBondContact O-NH2 2.89Å; L83-R166 PolarHBondContact O-NH2 3.16Å; C162-R166 WeakPolarHBondContact O-CG 3.29Å; C162-R166 PolarHBondContact O-N 3.38Å; C162-R166 PolarHBondContact O-NH1 3.46Å; C162-R166 VanDerWaalsContact O-NH1 3.09Å; T163-R166 PolarHBondContact O-N 2.87Å; T163-R166 VanDerWaalsContact O-N 3.14Å; G164-R166 VanDerWaalsContact C-N 3.31Å; G164-R166 PolarHBondContact O-N 2.99Å; R166-S168 VanDerWaalsContact C-N 3.31Å; R166-A169 PolarHBondContact O-N 3.21Å; R166-F170 WeakPolarHBondContact O-CB 3.42Å; R166-F170 PolarHBondContact O-N 3.16Å; R166-I176 HydrophobicContact CG-CD1 4.42Å
167	E	92.4	Very high	93.8	Very high	108 Å²	108	58.7 Å²	58.7	51%	0.505	28%	0.278	S	S	.	.	H	α-helix	trans	-62	-42.5	178.4	-72	-178.3	-168	0	0	110.3	T163 G164 A169 F170 Y215	T163-E167 HydrophobicContact CG2-CG 4.49Å; T163-E167 PolarHBondContact O-N 3.18Å; G164-E167 PolarHBondContact O-N 2.98Å; E167-A169 VanDerWaalsContact C-N 3.35Å; E167-A169 PolarHBondContact O-N 3.38Å; E167-F170 PolarHBondContact O-N 3.45Å; E167-Y215 PolarHBondContact OE1-OH 3.31Å; E167-Y215 WeakPolarHBondContact OE2-CE2 3.45Å
168	S	92.4	Very high	93.9	Very high	52 Å²	52	62.4 Å²	62.4	36%	0.364	30%	0.295	S	S	.	.	H	α-helix	trans	-66.8	-30.9	176.5	-66.3	0	0	0	0	114.2	G164 R166 N172	G164-S168 WeakPolarHBondContact O-CB 3.2Å; G164-S168 PolarHBondContact O-N 3.18Å; G164-S168 PolarHBondContact O-OG 3.45Å; G164-S168 VanDerWaalsContact O-OG 3.08Å; R166-S168 VanDerWaalsContact C-N 3.31Å; S168-N172 WeakPolarHBondContact O-CB 3.25Å; S168-N172 PolarHBondContact O-ND2 3.05Å
169	A	93	Very high	93.8	Very high	21 Å²	21	62.6 Å²	62.6	17%	0.174	30%	0.297	C	S	.	.	H	α-helix	trans	-84.4	-20.6	177	0	0	0	0	0	112.9	A165 R166 E167 R171 N172 I176 C179	A165-A169 VanDerWaalsContact O-CB 3.28Å; A165-A169 WeakPolarHBondContact O-CB 3.37Å; A165-A169 PolarHBondContact O-N 3.42Å; A165-A169 VanDerWaalsContact O-N 3.14Å; R166-A169 PolarHBondContact O-N 3.21Å; E167-A169 VanDerWaalsContact C-N 3.35Å; E167-A169 PolarHBondContact O-N 3.38Å; A169-R171 PolarHBondContact O-N 3.26Å; A169-N172 PolarHBondContact O-N 3.12Å; A169-I176 HydrophobicContact CB-CB 4.28Å; A169-I176 HydrophobicContact CB-CD1 3.73Å; A169-C179 HydrophobicContact CB-CB 4.27Å
170	F	91.3	Very high	93.8	Very high	148 Å²	148	56.1 Å²	56.1	65%	0.649	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	118.8	-176.5	-171.7	-109.9	0	0	0	110.5	R166 E167 N172	R166-F170 WeakPolarHBondContact O-CB 3.42Å; R166-F170 PolarHBondContact O-N 3.16Å; E167-F170 PolarHBondContact O-N 3.45Å; F170-N172 PolarHBondContact O-N 3.27Å
171	R	91.8	Very high	93.8	Very high	228 Å²	228	55.7 Å²	55.7	86%	0.86	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	12.3	-175.7	-53.7	174.5	177.6	-178.7	-1.1	114.8	A169	A169-R171 PolarHBondContact O-N 3.26Å
172	N	91.2	Very high	93.7	Very high	82 Å²	82	58.6 Å²	58.6	44%	0.439	29%	0.286	S	S	.	.			trans	-95.7	155.6	174	-160.5	-15.5	0	0	0	110.3	S168 A169 F170 K174	S168-N172 WeakPolarHBondContact O-CB 3.25Å; S168-N172 PolarHBondContact O-ND2 3.05Å; A169-N172 PolarHBondContact O-N 3.12Å; F170-N172 PolarHBondContact O-N 3.27Å; N172-K174 VanDerWaalsContact C-N 3.34Å; N172-K174 PolarHBondContact OD1-N 3.28Å
173	I	94.8	Very high	93.6	Very high	172 Å²	172	59.2 Å²	59.2	88%	0.882	29%	0.288	S	S	*	.	S	Bend	trans	-73.3	-32.9	174.8	-59.9	164.6	0	0	0	110.1	T175	I173-T175 PolarHBondContact O-N 3.04Å
174	K	92.5	Very high	93.6	Very high	99 Å²	99	58.6 Å²	58.6	43%	0.43	29%	0.285	S	S	.	.	S	Bend	trans	-56.6	136.6	177.1	-71	-171.5	168.9	-166.6	0	111.2	N172 D182	N172-K174 VanDerWaalsContact C-N 3.34Å; N172-K174 PolarHBondContact OD1-N 3.28Å; K174-D182 IonicContact NZ-OD2 2.85Å; K174-D182 PolarHBondContact NZ-OD2 3.43Å
175	T	94.8	Very high	93.6	Very high	74 Å²	74	59 Å²	59	45%	0.454	29%	0.286	S	S	.	.			trans	-71.3	153.9	175.8	67.8	0	0	0	0	110.8	I173 A177 E178 C179	I173-T175 PolarHBondContact O-N 3.04Å; T175-A177 PolarHBondContact O-N 3.34Å; T175-A177 VanDerWaalsContact O-N 3.16Å; T175-E178 WeakPolarHBondContact CB-OE2 3.48Å; T175-E178 PolarHBondContact N-OE2 2.99Å; T175-E178 PolarHBondContact O-N 3.48Å; T175-E178 VanDerWaalsContact O-N 3.14Å; T175-E178 VanDerWaalsContact OG1-CD 3.3Å; T175-E178 WeakPolarHBondContact OG1-CG 3.49Å; T175-E178 PolarHBondContact OG1-N 2.87Å; T175-E178 PolarHBondContact OG1-OE2 2.72Å; T175-C179 PolarHBondContact O-N 2.83Å
176	I	94.9	Very high	93.4	Very high	46 Å²	46	60.7 Å²	60.7	24%	0.236	30%	0.296	C	S	.	.	H	α-helix	trans	-59.5	-27.2	176.2	-174.8	60.4	0	0	0	112.9	I99 A165 R166 A169 L180	I99-I176 HydrophobicContact CB-CG2 4.45Å; I99-I176 HydrophobicContact CD1-CG2 3.64Å; I99-I176 HydrophobicContact CG1-CG2 3.77Å; I99-I176 HydrophobicContact CG2-CG1 4.22Å; I99-I176 HydrophobicContact CG2-CG2 3.81Å; A165-I176 HydrophobicContact CB-CD1 4.17Å; A165-I176 VanDerWaalsContact O-CD1 3.29Å; A165-I176 WeakPolarHBondContact O-CD1 3.28Å; R166-I176 HydrophobicContact CG-CD1 4.42Å; A169-I176 HydrophobicContact CB-CB 4.28Å; A169-I176 HydrophobicContact CB-CD1 3.73Å; I176-L180 VanDerWaalsContact O-CB 3.24Å; I176-L180 WeakPolarHBondContact O-CB 3.4Å; I176-L180 PolarHBondContact O-N 3.27Å
177	A	95.6	Very high	93.3	Very high	8 Å²	8	59 Å²	59	7%	0.066	29%	0.289	C	S	.	.	H	α-helix	trans	-69.3	-42.9	177	0	0	0	0	0	111.6	I99 H102 A103 I106 T175 L180 A181	I99-A177 HydrophobicContact CG2-CB 4.39Å; H102-A177 HydrophobicContact CB-CB 3.88Å; A103-A177 WeakPolarHBondContact CB-O 3.31Å; I106-A177 HydrophobicContact CD1-CB 4.29Å; T175-A177 PolarHBondContact O-N 3.34Å; T175-A177 VanDerWaalsContact O-N 3.16Å; A177-L180 PolarHBondContact O-N 3.03Å; A177-A181 WeakPolarHBondContact O-CB 3.44Å; A177-A181 PolarHBondContact O-N 2.85Å
178	E	95.3	Very high	93.1	Very high	78 Å²	78	54.6 Å²	54.6	36%	0.364	27%	0.271	S	S	.	.	H	α-helix	trans	-66.3	-46.5	175	-67.2	161.8	142.7	0	0	111.1	I106 T175 L180 A181 D182	I106-E178 HydrophobicContact CD1-CB 4.46Å; I106-E178 HydrophobicContact CD1-CG 3.73Å; T175-E178 WeakPolarHBondContact CB-OE2 3.48Å; T175-E178 PolarHBondContact N-OE2 2.99Å; T175-E178 PolarHBondContact O-N 3.48Å; T175-E178 VanDerWaalsContact O-N 3.14Å; T175-E178 VanDerWaalsContact OG1-CD 3.3Å; T175-E178 WeakPolarHBondContact OG1-CG 3.49Å; T175-E178 PolarHBondContact OG1-N 2.87Å; T175-E178 PolarHBondContact OG1-OE2 2.72Å; E178-L180 VanDerWaalsContact C-N 3.29Å; E178-L180 PolarHBondContact O-N 3.25Å; E178-A181 PolarHBondContact O-N 3.18Å; E178-A181 VanDerWaalsContact O-N 3.16Å; E178-D182 WeakPolarHBondContact O-CB 3.27Å; E178-D182 PolarHBondContact O-N 2.93Å
179	C	94.8	Very high	92.7	Very high	5 Å²	5	57.1 Å²	57.1	3%	0.034	28%	0.276	C	S	.	.	H	α-helix	trans	-60.9	-38.2	177.6	-66.3	0	0	0	0	112.4	A169 T175 E183	A169-C179 HydrophobicContact CB-CB 4.27Å; T175-C179 PolarHBondContact O-N 2.83Å; C179-E183 WeakPolarHBondContact O-CB 3.39Å; C179-E183 WeakPolarHBondContact O-CG 3.45Å; C179-E183 PolarHBondContact O-N 2.75Å
180	L	95.3	Very high	91.4	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-68.3	-40.2	176	-175.7	64.4	0	0	0	111.7	L83 I99 V100 A103 A165 I176 A177 E178 L184	L83-L180 HydrophobicContact CD1-CD2 3.9Å; L83-L180 HydrophobicContact CD2-CD2 4.46Å; I99-L180 HydrophobicContact CG2-CD2 4.46Å; V100-L180 HydrophobicContact CG2-CD2 4.4Å; A103-L180 HydrophobicContact CB-CB 4.33Å; A103-L180 HydrophobicContact CB-CD2 4.03Å; A103-L180 HydrophobicContact CB-CG 4.35Å; A165-L180 HydrophobicContact CB-CB 4.12Å; A165-L180 HydrophobicContact CB-CD1 3.8Å; I176-L180 VanDerWaalsContact O-CB 3.24Å; I176-L180 WeakPolarHBondContact O-CB 3.4Å; I176-L180 PolarHBondContact O-N 3.27Å; A177-L180 PolarHBondContact O-N 3.03Å; E178-L180 VanDerWaalsContact C-N 3.29Å; E178-L180 PolarHBondContact O-N 3.25Å; L180-L184 HydrophobicContact CD1-CD1 4.39Å; L180-L184 HydrophobicContact CD1-CG 4.49Å; L180-L184 HydrophobicContact CG-CD1 4.1Å; L180-L184 WeakPolarHBondContact O-CB 3.44Å; L180-L184 VanDerWaalsContact O-CG 3.27Å; L180-L184 WeakPolarHBondContact O-CG 3.43Å; L180-L184 PolarHBondContact O-N 3.45Å
181	A	94.8	Very high	89.6	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63.1	-47.3	175.2	0	0	0	0	0	111.6	I106 I107 A177 E178 E183 L184 I185	I106-A181 HydrophobicContact CB-CB 3.94Å; I106-A181 HydrophobicContact CG2-CB 3.63Å; I107-A181 HydrophobicContact CD1-CB 4.45Å; I107-A181 HydrophobicContact CG1-CB 3.79Å; A177-A181 WeakPolarHBondContact O-CB 3.44Å; A177-A181 PolarHBondContact O-N 2.85Å; E178-A181 PolarHBondContact O-N 3.18Å; E178-A181 VanDerWaalsContact O-N 3.16Å; A181-E183 PolarHBondContact O-N 3.03Å; A181-L184 PolarHBondContact O-N 3.23Å; A181-I185 WeakPolarHBondContact O-CB 2.73Å; A181-I185 WeakPolarHBondContact O-CD1 3.31Å; A181-I185 VanDerWaalsContact O-CG1 3.26Å; A181-I185 WeakPolarHBondContact O-CG1 2.67Å; A181-I185 PolarHBondContact O-N 3.49Å
182	D	93.2	Very high	87.5	Confident	61 Å²	61	46.8 Å²	46.8	33%	0.326	26%	0.261	S	S	.	.	H	α-helix	trans	-56.6	-47.7	176.3	-75.6	-13.9	0	0	0	111	K174 E178 N186	K174-D182 IonicContact NZ-OD2 2.85Å; K174-D182 PolarHBondContact NZ-OD2 3.43Å; E178-D182 WeakPolarHBondContact O-CB 3.27Å; E178-D182 PolarHBondContact O-N 2.93Å; D182-N186 VanDerWaalsContact O-CB 3.26Å; D182-N186 WeakPolarHBondContact O-CB 3.32Å; D182-N186 PolarHBondContact O-N 3.23Å; D182-N186 PolarHBondContact O-ND2 3.23Å
183	E	92.7	Very high	84.9	Confident	12 Å²	12	47 Å²	47	6%	0.056	27%	0.274	C	S	.	.	H	α-helix	trans	-62.6	-43.6	177.8	-81.1	-64.4	130.1	0	0	112.4	A165 C179 A181 N186 A187 Y215	A165-E183 HydrophobicContact CB-CG 4.5Å; C179-E183 WeakPolarHBondContact O-CB 3.39Å; C179-E183 WeakPolarHBondContact O-CG 3.45Å; C179-E183 PolarHBondContact O-N 2.75Å; A181-E183 PolarHBondContact O-N 3.03Å; E183-N186 PolarHBondContact O-N 3.28Å; E183-A187 VanDerWaalsContact O-CB 3.3Å; E183-A187 WeakPolarHBondContact O-CB 3.46Å; E183-A187 PolarHBondContact O-N 3.23Å; E183-Y215 PolarHBondContact OE2-N 2.9Å
184	L	94	Very high	81.9	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65.7	-44.3	179.8	-74.4	172	0	0	0	112.2	I107 L119 A122 L161 L180 A181 A187 A188	I107-L184 HydrophobicContact CD1-CB 4Å; I107-L184 HydrophobicContact CD1-CD1 3.64Å; I107-L184 HydrophobicContact CD1-CG 4.47Å; L119-L184 HydrophobicContact CD1-CD1 4.33Å; L119-L184 HydrophobicContact CD1-CD2 3.53Å; A122-L184 HydrophobicContact CB-CD2 3.87Å; L161-L184 HydrophobicContact CD1-CD2 3.98Å; L161-L184 HydrophobicContact CD2-CD2 4.41Å; L180-L184 HydrophobicContact CD1-CD1 4.39Å; L180-L184 HydrophobicContact CD1-CG 4.49Å; L180-L184 HydrophobicContact CG-CD1 4.1Å; L180-L184 WeakPolarHBondContact O-CB 3.44Å; L180-L184 VanDerWaalsContact O-CG 3.27Å; L180-L184 WeakPolarHBondContact O-CG 3.43Å; L180-L184 PolarHBondContact O-N 3.45Å; A181-L184 PolarHBondContact O-N 3.23Å; L184-A187 PolarHBondContact O-N 3.35Å; L184-A188 WeakPolarHBondContact O-CB 3.33Å; L184-A188 PolarHBondContact O-N 3.01Å
185	I	92.9	Very high	78.9	Confident	7 Å²	7	52.9 Å²	52.9	4%	0.036	29%	0.289	C	S	.	.	H	α-helix	trans	-64.6	-44.3	178.1	-66.9	161	0	0	0	110.3	I107 H110 T111 A181 A187 A188 K189	I107-I185 HydrophobicContact CG1-CD1 4.22Å; I107-I185 HydrophobicContact CG1-CG1 4.19Å; I107-I185 HydrophobicContact CG2-CG1 4.47Å; H110-I185 HydrophobicContact CB-CD1 3.94Å; T111-I185 HydrophobicContact CG2-CD1 4.45Å; T111-I185 HydrophobicContact CG2-CG1 4.08Å; T111-I185 HydrophobicContact CG2-CG2 4.39Å; A181-I185 WeakPolarHBondContact O-CB 2.73Å; A181-I185 WeakPolarHBondContact O-CD1 3.31Å; A181-I185 VanDerWaalsContact O-CG1 3.26Å; A181-I185 WeakPolarHBondContact O-CG1 2.67Å; A181-I185 PolarHBondContact O-N 3.49Å; I185-A187 VanDerWaalsContact C-N 3.34Å; I185-A187 PolarHBondContact O-N 3.01Å; I185-A188 PolarHBondContact O-N 3.47Å; I185-K189 HydrophobicContact CG2-CD 4.08Å; I185-K189 WeakPolarHBondContact O-CG 3.43Å; I185-K189 PolarHBondContact O-N 2.96Å; I185-K189 VanDerWaalsContact O-N 3.11Å
186	N	91.3	Very high	75.7	Confident	37 Å²	37	55.7 Å²	55.7	20%	0.198	30%	0.3	C	S	.	.	H	α-helix	trans	-62	-42.5	177.8	-77.4	-37.2	0	0	0	111.8	D182 E183 V190 S211	D182-N186 VanDerWaalsContact O-CB 3.26Å; D182-N186 WeakPolarHBondContact O-CB 3.32Å; D182-N186 PolarHBondContact O-N 3.23Å; D182-N186 PolarHBondContact O-ND2 3.23Å; E183-N186 PolarHBondContact O-N 3.28Å; N186-V190 WeakPolarHBondContact O-CG2 3.34Å; N186-S211 WeakPolarHBondContact CB-OG 3.2Å; N186-S211 PolarHBondContact OD1-OG 2.91Å
187	A	90.2	Very high	72.6	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-68.1	-35.5	177.2	0	0	0	0	0	113	A122 N125 L161 E183 L184 I185 I217	A122-A187 HydrophobicContact CB-CB 3.76Å; N125-A187 WeakPolarHBondContact CB-O 3.26Å; N125-A187 PolarHBondContact ND2-O 3.3Å; L161-A187 HydrophobicContact CD2-CB 3.73Å; E183-A187 VanDerWaalsContact O-CB 3.3Å; E183-A187 WeakPolarHBondContact O-CB 3.46Å; E183-A187 PolarHBondContact O-N 3.23Å; L184-A187 PolarHBondContact O-N 3.35Å; I185-A187 VanDerWaalsContact C-N 3.34Å; I185-A187 PolarHBondContact O-N 3.01Å; A187-I217 HydrophobicContact CB-CD1 4.44Å
188	A	89.2	Confident	69.4	Low	16 Å²	16	64.5 Å²	64.5	13%	0.132	35%	0.346	C	S	.	.	H	α-helix	trans	-68.5	-41.1	179	0	0	0	0	0	112.7	V118 N121 A122 N125 L184 I185 V190 G191	V118-A188 HydrophobicContact CG1-CB 3.74Å; N121-A188 HydrophobicContact CB-CB 4.12Å; A122-A188 HydrophobicContact CB-CB 4.42Å; N125-A188 PolarHBondContact ND2-O 2.99Å; L184-A188 WeakPolarHBondContact O-CB 3.33Å; L184-A188 PolarHBondContact O-N 3.01Å; I185-A188 PolarHBondContact O-N 3.47Å; A188-V190 VanDerWaalsContact C-N 3.27Å; A188-V190 PolarHBondContact O-N 3.17Å; A188-G191 PolarHBondContact O-N 3.08Å
189	K	83.9	Confident	66.5	Low	106 Å²	106	65.3 Å²	65.3	46%	0.461	36%	0.36	S	S	.	.	H	α-helix	trans	-64.5	-22.9	-176.5	-74.6	175.9	178.5	175.8	0	114.7	I185 G191 S192	I185-K189 HydrophobicContact CG2-CD 4.08Å; I185-K189 WeakPolarHBondContact O-CG 3.43Å; I185-K189 PolarHBondContact O-N 2.96Å; I185-K189 VanDerWaalsContact O-N 3.11Å; K189-G191 PolarHBondContact O-N 3.43Å; K189-S192 PolarHBondContact O-N 3.15Å; K189-S192 PolarHBondContact O-OG 3.26Å
190	V	66.1	Low	63.6	Low	47 Å²	47	72.2 Å²	72.2	29%	0.285	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-25.6	-176.2	178.7	0	0	0	0	112.9	N186 A188 I217	N186-V190 WeakPolarHBondContact O-CG2 3.34Å; A188-V190 VanDerWaalsContact C-N 3.27Å; A188-V190 PolarHBondContact O-N 3.17Å; V190-I217 HydrophobicContact CB-CD1 3.53Å; V190-I217 HydrophobicContact CG1-CD1 3.93Å; V190-I217 HydrophobicContact CG2-CD1 3.18Å
191	G	52.7	Low	61.2	Low	46 Å²	46	79 Å²	79	47%	0.474	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-19.2	179.5	0	0	0	0	0	114.7	N125 A188 K189 A193	N125-G191 PolarHBondContact ND2-N 3.07Å; A188-G191 PolarHBondContact O-N 3.08Å; K189-G191 PolarHBondContact O-N 3.43Å; G191-A193 PolarHBondContact O-N 2.84Å
192	S	47.3	Very low	58.2	Low	87 Å²	87	85 Å²	85	61%	0.608	47%	0.469	S	S	*	.			trans	-86.3	58	-178.2	57.2	0	0	0	0	111.4	K189 F194	K189-S192 PolarHBondContact O-N 3.15Å; K189-S192 PolarHBondContact O-OG 3.26Å; S192-F194 PolarHBondContact O-N 3.46Å; S192-F194 VanDerWaalsContact O-N 3.17Å
193	A	36.7	Very low	55.6	Low	85 Å²	85	87.1 Å²	87.1	70%	0.702	50%	0.495	S	S	*	.			trans	-76.8	84.8	152.1	0	0	0	0	0	106.4	G191 Y195	G191-A193 PolarHBondContact O-N 2.84Å; A193-Y195 PolarHBondContact O-N 2.89Å; A193-Y195 VanDerWaalsContact O-N 3.12Å
194	F	32.1	Very low	52.7	Low	164 Å²	164	97.4 Å²	97.4	72%	0.719	53%	0.533	S	S	*	.			trans	-61.8	117.1	165.9	-156.5	-87.6	0	0	0	106	S192 L196	S192-F194 PolarHBondContact O-N 3.46Å; S192-F194 VanDerWaalsContact O-N 3.17Å; F194-L196 HydrophobicContact CD1-CB 3.57Å; F194-L196 HydrophobicContact CD1-CD1 3.41Å; F194-L196 VanDerWaalsContact CD1-CD1 3.41Å; F194-L196 HydrophobicContact CD1-CG 3.44Å; F194-L196 VanDerWaalsContact CD1-CG 3.44Å; F194-L196 HydrophobicContact CE1-CB 4.14Å; F194-L196 HydrophobicContact CE1-CD1 3.61Å; F194-L196 HydrophobicContact CE1-CG 3.55Å; F194-L196 HydrophobicContact CG-CD1 4.27Å; F194-L196 PolarHBondContact O-N 3.25Å
195	Y	28.6	Very low	49.9	Very low	232 Å²	232	103.4 Å²	103.4	91%	0.91	56%	0.564	S	S	*	*			trans	-62.7	77.8	157.3	-92.1	-95.1	0	0	0	106.6	A193 H197	A193-Y195 PolarHBondContact O-N 2.89Å; A193-Y195 VanDerWaalsContact O-N 3.12Å; Y195-H197 PolarHBondContact O-N 3.02Å
196	L	28.2	Very low	47	Very low	132 Å²	132	111.1 Å²	111.1	69%	0.691	60%	0.598	S	S	*	*			trans	-89.4	105.4	164.3	-125.2	144.9	0	0	0	104	F194 C198	F194-L196 HydrophobicContact CD1-CB 3.57Å; F194-L196 HydrophobicContact CD1-CD1 3.41Å; F194-L196 VanDerWaalsContact CD1-CD1 3.41Å; F194-L196 HydrophobicContact CD1-CG 3.44Å; F194-L196 VanDerWaalsContact CD1-CG 3.44Å; F194-L196 HydrophobicContact CE1-CB 4.14Å; F194-L196 HydrophobicContact CE1-CD1 3.61Å; F194-L196 HydrophobicContact CE1-CG 3.55Å; F194-L196 HydrophobicContact CG-CD1 4.27Å; F194-L196 PolarHBondContact O-N 3.25Å; L196-C198 PolarHBondContact O-N 3.45Å
197	H	29	Very low	44.2	Very low	168 Å²	168	115.2 Å²	115.2	78%	0.778	62%	0.624	S	S	*	*			trans	-41.9	104.5	164.4	-175.2	-115.7	0	0	0	108.3	Y195 S199	Y195-H197 PolarHBondContact O-N 3.02Å; H197-S199 VanDerWaalsContact C-N 3.31Å; H197-S199 PolarHBondContact O-N 2.89Å
198	C	29.2	Very low	41.5	Very low	72 Å²	72	123.6 Å²	123.6	49%	0.486	66%	0.661	S	S	.	*			trans	-66.3	95.8	171	-173.6	0	0	0	0	106.4	L196 L200 I205	L196-C198 PolarHBondContact O-N 3.45Å; C198-L200 PolarHBondContact O-N 3.47Å; C198-L200 VanDerWaalsContact O-N 3.17Å; C198-I205 HydrophobicContact CB-CD1 4.46Å
199	S	33.7	Very low	39	Very low	94 Å²	94	130.8 Å²	130.8	66%	0.657	69%	0.689	S	S	*	*			trans	-53.6	119.6	151.9	46.1	0	0	0	0	107	H197 T201	H197-S199 VanDerWaalsContact C-N 3.31Å; H197-S199 PolarHBondContact O-N 2.89Å; S199-T201 PolarHBondContact O-N 3.14Å
200	L	34.3	Very low	37	Very low	151 Å²	151	127.2 Å²	127.2	79%	0.791	68%	0.682	S	S	*	*	S	Bend	trans	-25.7	124.6	173.3	-68.8	68.6	0	0	0	112.7	C198	C198-L200 PolarHBondContact O-N 3.47Å; C198-L200 VanDerWaalsContact O-N 3.17Å
201	T	44.7	Very low	36.4	Very low	141 Å²	141	125.9 Å²	125.9	87%	0.865	68%	0.675	S	S	*	*			trans	167	-10.9	130.8	37.3	0	0	0	0	115.3	S199	S199-T201 PolarHBondContact O-N 3.14Å
202	D	32	Very low	36.8	Very low	127 Å²	127	126.7 Å²	126.7	68%	0.679	67%	0.674	S	S	*	*			trans	-117	94.3	176.8	-113.7	-39.8	0	0	0	113.1	R204	D202-R204 PolarHBondContact O-N 3.38Å
203	A	39.2	Very low	38.4	Very low	105 Å²	105	127.8 Å²	127.8	87%	0.868	67%	0.673	S	S	*	*			trans	-73.3	61.1	168.9	0	0	0	0	0	111.1
204	R	31.4	Very low	40.6	Very low	228 Å²	228	123.8 Å²	123.8	86%	0.86	64%	0.639	S	S	*	*			trans	-145.5	53.9	163.9	-69.6	-169.2	-173.5	165.9	4.2	109.6	D202 F206	D202-R204 PolarHBondContact O-N 3.38Å; R204-F206 VanDerWaalsContact C-N 3.25Å; R204-F206 PolarHBondContact O-N 3.32Å
205	I	36	Very low	43.4	Very low	127 Å²	127	118.3 Å²	118.3	65%	0.651	61%	0.614	S	S	*	*			trans	-73.7	92	167.4	-61.5	172.5	0	0	0	106.7	C198 V207	C198-I205 HydrophobicContact CB-CD1 4.46Å; I205-V207 PolarHBondContact O-N 3.31Å
206	F	31.4	Very low	46.4	Very low	169 Å²	169	107.3 Å²	107.3	74%	0.741	57%	0.571	S	S	*	*			trans	-50	108.7	161.8	-139.2	-100.4	0	0	0	106.6	R204 F208	R204-F206 VanDerWaalsContact C-N 3.25Å; R204-F206 PolarHBondContact O-N 3.32Å; F206-F208 AromaticContact CD1-CD2 3.77Å; F206-F208 HydrophobicContact CD1-CD2 3.77Å; F206-F208 AromaticContact CD1-CE2 3.92Å; F206-F208 HydrophobicContact CD1-CE2 3.92Å; F206-F208 HydrophobicContact CE1-CE2 4.35Å; F206-F208 PolarHBondContact O-N 3.46Å
207	V	33.3	Very low	49.4	Very low	123 Å²	123	101.4 Å²	101.4	75%	0.745	54%	0.54	S	S	*	.			trans	-64.7	86.9	166.8	178.9	0	0	0	0	105.3	I205 K209	I205-V207 PolarHBondContact O-N 3.31Å; V207-K209 PolarHBondContact O-N 2.87Å
208	F	32.4	Very low	52.4	Low	175 Å²	175	98.6 Å²	98.6	77%	0.768	53%	0.526	S	S	*	.			trans	-65.7	81.8	162.2	-112.9	-87.8	0	0	0	105.6	F206 G210	F206-F208 AromaticContact CD1-CD2 3.77Å; F206-F208 HydrophobicContact CD1-CD2 3.77Å; F206-F208 AromaticContact CD1-CE2 3.92Å; F206-F208 HydrophobicContact CD1-CE2 3.92Å; F206-F208 HydrophobicContact CE1-CE2 4.35Å; F206-F208 PolarHBondContact O-N 3.46Å; F208-G210 PolarHBondContact O-N 2.88Å
209	K	36.5	Very low	55.4	Low	167 Å²	167	98.5 Å²	98.5	73%	0.726	52%	0.517	S	S	*	.			trans	-49.6	109.9	164.9	-144.7	179.3	-174.9	177.9	0	104.6	V207 S211	V207-K209 PolarHBondContact O-N 2.87Å; K209-S211 PolarHBondContact O-N 2.89Å
210	G	41.8	Very low	58.1	Low	31 Å²	31	95.2 Å²	95.2	32%	0.32	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-42.6	131.2	-168.4	0	0	0	0	0	111.1	F208 S212	F208-G210 PolarHBondContact O-N 2.88Å; G210-S212 VanDerWaalsContact C-N 3.31Å; G210-S212 PolarHBondContact O-N 3.35Å; G210-S212 PolarHBondContact O-OG 2.85Å
211	S	53.9	Low	60.8	Low	19 Å²	19	92 Å²	92	13%	0.133	48%	0.475	C	S	.	.	T	Hydrogen-bonded Turn	trans	-22	87.2	-172.1	-171.6	0	0	0	0	113.2	N186 K209 N213	N186-S211 WeakPolarHBondContact CB-OG 3.2Å; N186-S211 PolarHBondContact OD1-OG 2.91Å; K209-S211 PolarHBondContact O-N 2.89Å; S211-N213 PolarHBondContact O-N 2.9Å
212	S	61.1	Low	62.9	Low	64 Å²	64	89.5 Å²	89.5	45%	0.448	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	25	173.5	-56.3	0	0	0	0	110.3	G210 K218	G210-S212 VanDerWaalsContact C-N 3.31Å; G210-S212 PolarHBondContact O-N 3.35Å; G210-S212 PolarHBondContact O-OG 2.85Å; S212-K218 WeakPolarHBondContact O-CE 3.47Å; S212-K218 PolarHBondContact O-NZ 3.45Å
213	N	80.7	Confident	65.7	Low	110 Å²	110	86.2 Å²	86.2	59%	0.588	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-33	-178.4	-65.3	-30.2	0	0	0	110.9	S211 Y215	S211-N213 PolarHBondContact O-N 2.9Å; N213-Y215 PolarHBondContact O-N 2.8Å
214	S	84.2	Confident	68.2	Low	0 Å²	0	82.4 Å²	82.4	0%	0	40%	0.4	C	S	.	.			trans	-65.7	135.3	179.9	66.6	0	0	0	0	111.9	A216 I217 K218	S214-A216 VanDerWaalsContact C-N 3.29Å; S214-A216 PolarHBondContact O-N 2.94Å; S214-I217 VanDerWaalsContact OG-CB 3.25Å; S214-I217 WeakPolarHBondContact OG-CB 3.25Å; S214-I217 WeakPolarHBondContact OG-CD1 3.46Å; S214-I217 WeakPolarHBondContact OG-CG1 3.49Å; S214-K218 WeakPolarHBondContact O-CG 3.23Å; S214-K218 PolarHBondContact O-N 3.04Å
215	Y	90.6	Very high	71	Confident	50 Å²	50	79 Å²	79	20%	0.196	39%	0.387	C	S	.	.	H	α-helix	trans	-64.1	-39.7	177.3	-179.4	-91.2	0	0	0	111.3	L160 T163 E167 E183 N213 I217 K218 K219	L160-Y215 HydrophobicContact CD2-CE1 4.13Å; T163-Y215 HydrophobicContact CG2-CE1 4.03Å; E167-Y215 PolarHBondContact OE1-OH 3.31Å; E167-Y215 WeakPolarHBondContact OE2-CE2 3.45Å; E183-Y215 PolarHBondContact OE2-N 2.9Å; N213-Y215 PolarHBondContact O-N 2.8Å; Y215-I217 PolarHBondContact O-N 2.95Å; Y215-K218 PolarHBondContact O-N 3.35Å; Y215-K219 HydrophobicContact CD1-CG 4.07Å; Y215-K219 HydrophobicContact CE1-CG 3.68Å; Y215-K219 HydrophobicContact CE2-CG 4.4Å; Y215-K219 WeakPolarHBondContact O-CG 3.37Å; Y215-K219 PolarHBondContact O-N 3.02Å
216	A	91.2	Very high	73.6	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-64.6	-40.6	-175.1	0	0	0	0	0	112.9	L160 L161 S214 K220	L160-A216 HydrophobicContact CB-CB 3.73Å; L161-A216 HydrophobicContact CD2-CB 3.85Å; L161-A216 HydrophobicContact CG-CB 4.02Å; S214-A216 VanDerWaalsContact C-N 3.29Å; S214-A216 PolarHBondContact O-N 2.94Å; A216-K220 WeakPolarHBondContact O-CB 3.46Å; A216-K220 PolarHBondContact O-N 3.47Å
217	I	90.9	Very high	76.5	Confident	9 Å²	9	66.8 Å²	66.8	5%	0.046	33%	0.332	C	S	.	.	H	α-helix	trans	-72.9	-42.4	179.1	-62.8	179.4	0	0	0	110.7	A187 V190 S214 Y215 K219 K220 D221	A187-I217 HydrophobicContact CB-CD1 4.44Å; V190-I217 HydrophobicContact CB-CD1 3.53Å; V190-I217 HydrophobicContact CG1-CD1 3.93Å; V190-I217 HydrophobicContact CG2-CD1 3.18Å; S214-I217 VanDerWaalsContact OG-CB 3.25Å; S214-I217 WeakPolarHBondContact OG-CB 3.25Å; S214-I217 WeakPolarHBondContact OG-CD1 3.46Å; S214-I217 WeakPolarHBondContact OG-CG1 3.49Å; Y215-I217 PolarHBondContact O-N 2.95Å; I217-K219 VanDerWaalsContact C-N 3.27Å; I217-K219 PolarHBondContact O-N 3.21Å; I217-K220 WeakPolarHBondContact O-CB 3.3Å; I217-K220 PolarHBondContact O-N 2.75Å; I217-D221 WeakPolarHBondContact O-CB 3.18Å; I217-D221 VanDerWaalsContact O-CG 3.29Å; I217-D221 PolarHBondContact O-N 3.29Å
218	K	91.3	Very high	79.3	Confident	108 Å²	108	67.3 Å²	67.3	47%	0.47	32%	0.324	S	S	.	.	H	α-helix	trans	-53.8	-46	173.6	-71.9	174.8	-174.7	172.4	0	111.8	S212 S214 Y215 E222	S212-K218 WeakPolarHBondContact O-CE 3.47Å; S212-K218 PolarHBondContact O-NZ 3.45Å; S214-K218 WeakPolarHBondContact O-CG 3.23Å; S214-K218 PolarHBondContact O-N 3.04Å; Y215-K218 PolarHBondContact O-N 3.35Å; K218-E222 VanDerWaalsContact O-CB 3.31Å; K218-E222 WeakPolarHBondContact O-CB 3.17Å; K218-E222 PolarHBondContact O-N 3.17Å
219	K	92	Very high	82.1	Confident	70 Å²	70	63.3 Å²	63.3	30%	0.304	32%	0.318	S	S	.	.	H	α-helix	trans	-71.2	-37.9	-179.8	-73.4	-71.6	162.9	-158.6	0	112.6	L160 Y215 I217 E222 L223	L160-K219 HydrophobicContact CD1-CB 4.21Å; L160-K219 HydrophobicContact CD2-CB 3.8Å; L160-K219 HydrophobicContact CD2-CG 4.19Å; Y215-K219 HydrophobicContact CD1-CG 4.07Å; Y215-K219 HydrophobicContact CE1-CG 3.68Å; Y215-K219 HydrophobicContact CE2-CG 4.4Å; Y215-K219 WeakPolarHBondContact O-CG 3.37Å; Y215-K219 PolarHBondContact O-N 3.02Å; I217-K219 VanDerWaalsContact C-N 3.27Å; I217-K219 PolarHBondContact O-N 3.21Å; K219-E222 IonicContact NZ-OE2 2.75Å; K219-E222 PolarHBondContact NZ-OE2 2.9Å; K219-L223 VanDerWaalsContact O-CG 3.27Å; K219-L223 WeakPolarHBondContact O-CG 3.35Å; K219-L223 PolarHBondContact O-N 2.63Å
220	K	91.5	Very high	84.6	Confident	25 Å²	25	57.5 Å²	57.5	11%	0.109	29%	0.294	C	S	.	.	H	α-helix	trans	-58.3	-53.2	171.2	168.1	-178.5	168.3	170.3	0	111.2	N125 G127 P128 A216 I217 E222 L223 E224	N125-K220 VanDerWaalsContact O-CD 3.32Å; N125-K220 WeakPolarHBondContact O-CD 3.29Å; N125-K220 PolarHBondContact O-NZ 2.96Å; G127-K220 WeakPolarHBondContact O-CD 3.42Å; G127-K220 VanDerWaalsContact O-CE 3.23Å; G127-K220 WeakPolarHBondContact O-CE 3.27Å; G127-K220 PolarHBondContact O-NZ 3.4Å; P128-K220 HydrophobicContact CB-CG 4.16Å; A216-K220 WeakPolarHBondContact O-CB 3.46Å; A216-K220 PolarHBondContact O-N 3.47Å; I217-K220 WeakPolarHBondContact O-CB 3.3Å; I217-K220 PolarHBondContact O-N 2.75Å; K220-E222 VanDerWaalsContact C-N 3.29Å; K220-E222 PolarHBondContact O-N 3.23Å; K220-L223 PolarHBondContact O-N 3.45Å; K220-L223 VanDerWaalsContact O-N 3.14Å; K220-E224 WeakPolarHBondContact CE-OE1 3.22Å; K220-E224 HydrophobicContact CG-CG 4.49Å; K220-E224 PolarHBondContact O-N 2.97Å
221	D	90	Very high	86.6	Confident	84 Å²	84	67.9 Å²	67.9	45%	0.449	32%	0.324	S	S	.	.	H	α-helix	trans	-64	-36.9	-176.9	-67.7	-12.2	0	0	0	111.2	I217 R225	I217-D221 WeakPolarHBondContact O-CB 3.18Å; I217-D221 VanDerWaalsContact O-CG 3.29Å; I217-D221 PolarHBondContact O-N 3.29Å; D221-R225 WeakPolarHBondContact O-CB 3.46Å; D221-R225 PolarHBondContact O-N 3.05Å
222	E	90.4	Very high	88.2	Confident	88 Å²	88	70.3 Å²	70.3	41%	0.411	33%	0.334	S	S	.	.	H	α-helix	trans	-60.1	-48	172.5	-175	-178.5	-177.7	0	0	111.6	K218 K219 K220 R225 V226	K218-E222 VanDerWaalsContact O-CB 3.31Å; K218-E222 WeakPolarHBondContact O-CB 3.17Å; K218-E222 PolarHBondContact O-N 3.17Å; K219-E222 IonicContact NZ-OE2 2.75Å; K219-E222 PolarHBondContact NZ-OE2 2.9Å; K220-E222 VanDerWaalsContact C-N 3.29Å; K220-E222 PolarHBondContact O-N 3.23Å; E222-R225 PolarHBondContact O-N 3.26Å; E222-V226 VanDerWaalsContact O-CG2 3.29Å; E222-V226 WeakPolarHBondContact O-CG2 3.36Å; E222-V226 PolarHBondContact O-N 2.75Å
223	L	90.4	Very high	89.7	Confident	58 Å²	58	70.6 Å²	70.6	30%	0.304	33%	0.328	S	S	.	.	H	α-helix	trans	-64.1	-46.5	178.7	-72.4	170.7	0	0	0	112	K219 K220 R225 V226 A227	K219-L223 VanDerWaalsContact O-CG 3.27Å; K219-L223 WeakPolarHBondContact O-CG 3.35Å; K219-L223 PolarHBondContact O-N 2.63Å; K220-L223 PolarHBondContact O-N 3.45Å; K220-L223 VanDerWaalsContact O-N 3.14Å; L223-R225 VanDerWaalsContact C-N 3.34Å; L223-R225 PolarHBondContact O-N 3.48Å; L223-V226 PolarHBondContact O-N 2.99Å; L223-A227 PolarHBondContact O-N 2.92Å
224	E	90.2	Very high	90.1	Very high	26 Å²	26	68.4 Å²	68.4	12%	0.121	31%	0.313	C	S	.	.	H	α-helix	trans	-65.8	-36.6	178.8	-70.4	-173.9	-179.6	0	0	111.6	P128 R129 K220 A227 K228	P128-E224 WeakPolarHBondContact CA-OE1 3.43Å; R129-E224 PolarHBondContact N-OE1 3.36Å; K220-E224 WeakPolarHBondContact CE-OE1 3.22Å; K220-E224 HydrophobicContact CG-CG 4.49Å; K220-E224 PolarHBondContact O-N 2.97Å; E224-A227 PolarHBondContact O-N 3.33Å; E224-K228 VanDerWaalsContact O-CG 3.3Å; E224-K228 WeakPolarHBondContact O-CG 3.3Å; E224-K228 PolarHBondContact O-N 3.4Å
225	R	91	Very high	90.5	Very high	156 Å²	156	72.5 Å²	72.5	59%	0.589	33%	0.331	S	S	*	.	H	α-helix	trans	-64.4	-42	173.8	-174.5	-173	64.6	78.1	2.2	111.7	D221 E222 L223 K228 S229	D221-R225 WeakPolarHBondContact O-CB 3.46Å; D221-R225 PolarHBondContact O-N 3.05Å; E222-R225 PolarHBondContact O-N 3.26Å; L223-R225 VanDerWaalsContact C-N 3.34Å; L223-R225 PolarHBondContact O-N 3.48Å; R225-K228 PolarHBondContact O-N 2.75Å; R225-S229 PolarHBondContact O-N 2.93Å
226	V	91.4	Very high	90.5	Very high	39 Å²	39	73.9 Å²	73.9	24%	0.236	34%	0.34	C	S	.	.	H	α-helix	trans	-65.9	-39.7	175.9	171.8	0	0	0	0	110.7	E222 L223 S229 N230	E222-V226 VanDerWaalsContact O-CG2 3.29Å; E222-V226 WeakPolarHBondContact O-CG2 3.36Å; E222-V226 PolarHBondContact O-N 2.75Å; L223-V226 PolarHBondContact O-N 2.99Å; V226-S229 PolarHBondContact O-N 2.78Å; V226-N230 WeakPolarHBondContact CG1-ND2 3.35Å; V226-N230 PolarHBondContact O-N 2.87Å; V226-N230 PolarHBondContact O-ND2 3.17Å
227	A	91.2	Very high	90.4	Very high	0 Å²	0	78.8 Å²	78.8	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-61.3	-49.5	175.1	0	0	0	0	0	111.2	E130 A145 L223 E224 S229 N230 R231	E130-A227 HydrophobicContact CB-CB 3.65Å; A145-A227 HydrophobicContact CB-CB 4.37Å; A145-A227 WeakPolarHBondContact CB-O 3.3Å; L223-A227 PolarHBondContact O-N 2.92Å; E224-A227 PolarHBondContact O-N 3.33Å; A227-S229 VanDerWaalsContact C-N 3.27Å; A227-S229 PolarHBondContact O-N 3.12Å; A227-N230 CarbonylContact O-C 3.53Å; A227-N230 PolarHBondContact O-N 2.88Å; A227-R231 PolarHBondContact O-N 2.95Å
228	K	92.1	Very high	90.4	Very high	134 Å²	134	83.8 Å²	83.8	58%	0.583	39%	0.385	S	S	*	.	H	α-helix	trans	-56.9	-37.6	176	-72.7	172.4	-175.7	173.9	0	113.5	E224 R225 N230	E224-K228 VanDerWaalsContact O-CG 3.3Å; E224-K228 WeakPolarHBondContact O-CG 3.3Å; E224-K228 PolarHBondContact O-N 3.4Å; R225-K228 PolarHBondContact O-N 2.75Å; K228-N230 VanDerWaalsContact C-N 3.28Å; K228-N230 PolarHBondContact O-N 3.48Å
229	S	91.6	Very high	90.3	Very high	91 Å²	91	81.9 Å²	81.9	64%	0.636	38%	0.379	S	S	*	.	H	α-helix	trans	-71.4	-19.8	176.9	-175.9	0	0	0	0	114	R225 V226 A227	R225-S229 PolarHBondContact O-N 2.93Å; V226-S229 PolarHBondContact O-N 2.78Å; A227-S229 VanDerWaalsContact C-N 3.27Å; A227-S229 PolarHBondContact O-N 3.12Å
230	N	88.6	Confident	90.2	Very high	45 Å²	45	82.9 Å²	82.9	24%	0.241	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	17.4	-179.8	-67.3	-62.5	0	0	0	112.3	R143 A145 V226 A227 K228	R143-N230 HydrophobicContact CB-CB 4.06Å; A145-N230 PolarHBondContact N-O 3.43Å; V226-N230 WeakPolarHBondContact CG1-ND2 3.35Å; V226-N230 PolarHBondContact O-N 2.87Å; V226-N230 PolarHBondContact O-ND2 3.17Å; A227-N230 CarbonylContact O-C 3.53Å; A227-N230 PolarHBondContact O-N 2.88Å; K228-N230 VanDerWaalsContact C-N 3.28Å; K228-N230 PolarHBondContact O-N 3.48Å
231	R	84	Confident	90.1	Very high	249 Å²	249	88.2 Å²	88.2	94%	0.94	41%	0.41	S	S	*	.			trans	-81.1	0	171.6	-175.5	174.5	-179.2	170.1	0.1	109.7	A145 A227	A145-R231 HydrophobicContact CB-CB 4.43Å; A227-R231 PolarHBondContact O-N 2.95Å

Retrieved 231 of 231 residues in 514.1 ms (Link to these results)

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