A0A087Y5L0_POEFO Loading...

UPF3A regulator of nonsense mediated mRNA decay

AlphaFold DB , UniProt , Accession A0A087Y5L0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 463 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	42.7	Very low	37.5	Very low	242 Å²	242	159.9 Å²	159.9	100%	1.192	86%	0.861	S	S	*	*				0	122	0	-75.2	177.5	169	0	0	109.3
2	R	38.7	Very low	37.4	Very low	246 Å²	246	164.8 Å²	164.8	93%	0.928	87%	0.868	S	S	*	*			trans	159.4	136.3	147.9	-92.4	171.9	-175.2	-96.6	0.5	107.7
3	S	39	Very low	37.4	Very low	108 Å²	108	166.6 Å²	166.6	76%	0.755	87%	0.869	S	S	*	*			trans	-149.5	122.3	-168.4	50.6	0	0	0	0	108.1
4	D	42.8	Very low	37.5	Very low	156 Å²	156	168.6 Å²	168.6	83%	0.834	87%	0.868	S	S	*	*			trans	-156.2	159.5	172.1	-78.1	-58.4	0	0	0	108.6
5	K	41.8	Very low	37.1	Very low	175 Å²	175	164.1 Å²	164.1	76%	0.761	86%	0.857	S	S	*	*				-165.4	130.9	-71.8	174.1	175	179.9	-178.8	0	108.2
6	D	40.1	Very low	36.9	Very low	124 Å²	124	162.3 Å²	162.3	66%	0.663	85%	0.847	S	S	*	*			trans	29	124.7	161	-47.2	-36.1	0	0	0	121.6
7	Q	34.3	Very low	36.5	Very low	202 Å²	202	163.9 Å²	163.9	94%	0.944	85%	0.846	S	S	*	*				-161.1	152.3	115.7	-112.2	161.9	106.6	0	0	113.6
8	M	35	Very low	36.2	Very low	184 Å²	184	163.5 Å²	163.5	91%	0.906	84%	0.839	S	S	*	*			trans	-105.5	148.4	176.8	-62	-178	-179.6	0	0	111.6
9	T	34.8	Very low	36.4	Very low	149 Å²	149	163.4 Å²	163.4	91%	0.914	84%	0.839	S	S	*	*			trans	-146.9	151	147.3	44.8	0	0	0	0	110
10	A	33.5	Very low	36.2	Very low	103 Å²	103	162.7 Å²	162.7	85%	0.851	83%	0.832	S	S	*	*			trans	-98.2	144.6	-164.8	0	0	0	0	0	115.6
11	G	30.4	Very low	36	Very low	70 Å²	70	162.5 Å²	162.5	72%	0.722	83%	0.832	S	S	*	*				53.5	127.8	128.1	0	0	0	0	0	121.9
12	K	35.8	Very low	35.6	Very low	218 Å²	218	159.4 Å²	159.4	95%	0.948	81%	0.812	S	S	*	*				-157.4	152	122.7	-108	156.4	-171.9	173.7	0	111.4
13	E	36.9	Very low	35.5	Very low	189 Å²	189	155.1 Å²	155.1	88%	0.883	81%	0.807	S	S	*	*			trans	-104.6	165.4	-156.2	-65.4	165.4	130.3	0	0	113.7
14	K	40	Very low	35.3	Very low	195 Å²	195	156.2 Å²	156.2	85%	0.848	81%	0.809	S	S	*	*			trans	-84.3	121.3	175.5	-61.8	172.1	-176.4	173.7	0	108.8	I16	K14-I16 PolarHBondContact O-N 3.2Å
15	S	31.2	Very low	35.2	Very low	100 Å²	100	154.5 Å²	154.5	70%	0.699	81%	0.806	S	S	*	*			trans	-73.6	109.8	174	-173.8	0	0	0	0	110.2	F17	S15-F17 WeakPolarHBondContact OG-CE2 3.47Å
16	I	33.8	Very low	34.8	Very low	136 Å²	136	156 Å²	156	70%	0.697	81%	0.807	S	S	*	*			trans	-112.5	122.1	166.1	-60.4	176	0	0	0	106	K14 E18	K14-I16 PolarHBondContact O-N 3.2Å; I16-E18 HydrophobicContact CG2-CG 4.15Å; I16-E18 PolarHBondContact O-N 3.49Å
17	F	30.5	Very low	34.5	Very low	189 Å²	189	159.2 Å²	159.2	83%	0.829	82%	0.818	S	S	*	*			trans	-95.4	89.4	175.3	-94.1	-90.8	0	0	0	109.9	S15	S15-F17 WeakPolarHBondContact OG-CE2 3.47Å
18	E	30.8	Very low	34.7	Very low	157 Å²	157	156.6 Å²	156.6	73%	0.734	81%	0.806	S	S	*	*			trans	-76.5	129.5	165	-66.2	-174.5	140.6	0	0	109.9	I16 Q20	I16-E18 HydrophobicContact CG2-CG 4.15Å; I16-E18 PolarHBondContact O-N 3.49Å; E18-Q20 PolarHBondContact O-N 3.43Å
19	I	39.8	Very low	34.6	Very low	162 Å²	162	156.8 Å²	156.8	83%	0.831	81%	0.805	S	S	*	*			trans	-90.2	100.2	174.1	-60	177.5	0	0	0	107.8	L21	I19-L21 PolarHBondContact O-N 3.42Å
20	Q	31.9	Very low	34.5	Very low	149 Å²	149	156.9 Å²	156.9	70%	0.696	80%	0.8	S	S	*	*			trans	-70.8	122.3	-179.4	-64.6	176.7	-4.2	0	0	111.3	E18	E18-Q20 PolarHBondContact O-N 3.43Å
21	L	33.4	Very low	34.8	Very low	158 Å²	158	159.1 Å²	159.1	83%	0.827	80%	0.796	S	S	*	*			trans	-66.5	148.3	153.4	-84.5	82	0	0	0	109	I19	I19-L21 PolarHBondContact O-N 3.42Å
22	K	33.6	Very low	35.1	Very low	178 Å²	178	161.6 Å²	161.6	77%	0.774	80%	0.799	S	S	*	*			trans	-121.3	108	173.9	-76.9	-171.7	174.3	-176.1	0	110.3
23	D	35.4	Very low	35.5	Very low	156 Å²	156	155.7 Å²	155.7	83%	0.834	79%	0.791	S	S	*	*			trans	-87.1	127.5	164	-65.7	-57.2	0	0	0	109.8
24	V	36.3	Very low	35.7	Very low	130 Å²	130	153.8 Å²	153.8	79%	0.788	79%	0.787	S	S	*	*			trans	-140.9	139.3	174.1	176.7	0	0	0	0	106.8
25	P	39.7	Very low	35.7	Very low	121 Å²	121	149.1 Å²	149.1	79%	0.786	79%	0.785	S	S	*	*			trans	-92.1	174.3	-142.3	35.2	-38.3	0	0	0	116.7
26	R	34.5	Very low	36.3	Very low	206 Å²	206	153 Å²	153	78%	0.777	79%	0.789	S	S	*	*			trans	-75.1	121.9	176.1	170.1	-169.4	178.2	178.7	0.3	112.2
27	E	33.7	Very low	36.6	Very low	191 Å²	191	152.3 Å²	152.3	89%	0.893	79%	0.793	S	S	*	*			trans	-124	156.8	155.8	-67.5	-167.8	150.8	0	0	110
28	Q	37.8	Very low	37.1	Very low	148 Å²	148	152.7 Å²	152.7	69%	0.692	80%	0.795	S	S	*	*			trans	-129.1	118.3	-177.6	-68.9	179.7	-117.7	0	0	109.9
29	E	33.5	Very low	37.8	Very low	187 Å²	187	152 Å²	152	87%	0.874	79%	0.791	S	S	*	*			trans	-142	174	165.2	-87.6	-93.8	120	0	0	109.1
30	N	32.1	Very low	38	Very low	151 Å²	151	153 Å²	153	81%	0.807	79%	0.792	S	S	*	*			trans	-87.6	159.8	-150.7	-85.2	-79.6	0	0	0	118.2
31	I	40.8	Very low	38.9	Very low	150 Å²	150	153.3 Å²	153.3	77%	0.769	79%	0.792	S	S	*	*			trans	-82.8	143.3	179.3	-56.6	162.7	0	0	0	111.2
32	P	35.9	Very low	39.7	Very low	122 Å²	122	154.6 Å²	154.6	79%	0.792	79%	0.79	S	S	*	*			trans	-113.7	142.7	135.7	34.3	-30.8	0	0	0	111.3
33	A	43.7	Very low	40.9	Very low	94 Å²	94	153.1 Å²	153.1	78%	0.777	79%	0.787	S	S	*	*			trans	-80.6	172.6	-167	0	0	0	0	0	114.5
34	N	41.8	Very low	42.5	Very low	149 Å²	149	149.5 Å²	149.5	80%	0.797	77%	0.77	S	S	*	*			trans	80	58	170.6	-162.6	20.4	0	0	0	117.5
35	A	39.7	Very low	44.7	Very low	98 Å²	98	147.3 Å²	147.3	81%	0.81	75%	0.75	S	S	*	*			trans	-103.8	124	143.8	0	0	0	0	0	108.6
36	K	42.8	Very low	47	Very low	181 Å²	181	143 Å²	143	79%	0.787	72%	0.722	S	S	*	*			trans	-63.7	140.7	176.8	-64.1	177.4	-178.1	177.1	0	109.5	K38	K36-K38 PolarHBondContact O-N 3.5Å
37	P	40.5	Very low	49.8	Very low	121 Å²	121	134 Å²	134	79%	0.786	69%	0.688	S	S	*	*			trans	-64.2	105.8	172.6	27.2	-33.1	0	0	0	109	E39	P37-E39 PolarHBondContact O-N 3.25Å
38	K	42.1	Very low	52.6	Low	198 Å²	198	125 Å²	125	86%	0.861	65%	0.646	S	S	*	*			trans	-62.2	112.4	144.6	-84.1	-174.4	176.5	179.5	0	105	K36 E40	K36-K38 PolarHBondContact O-N 3.5Å; K38-E40 PolarHBondContact O-N 3.31Å
39	E	44.3	Very low	55.2	Low	142 Å²	142	118.1 Å²	118.1	66%	0.664	61%	0.614	S	S	*	*			trans	-60.1	98.2	159.3	-66.3	-177.8	126.8	0	0	107	P37 K41	P37-E39 PolarHBondContact O-N 3.25Å; E39-K41 HydrophobicContact CB-CG 3.74Å; E39-K41 PolarHBondContact O-N 3.37Å; E39-K41 WeakPolarHBondContact OE2-CE 3.31Å; E39-K41 IonicContact OE2-NZ 3.67Å; E39-K41 PolarHBondContact OE2-NZ 3.44Å
40	E	44.3	Very low	58.1	Low	182 Å²	182	109.2 Å²	109.2	85%	0.85	57%	0.573	S	S	*	*			trans	-59.5	86.6	140.7	-72.7	-168.6	167.5	0	0	106	K38 K42	K38-E40 PolarHBondContact O-N 3.31Å; E40-K42 PolarHBondContact O-N 3.29Å
41	K	50.4	Low	61	Low	157 Å²	157	107.6 Å²	107.6	68%	0.683	56%	0.555	S	S	*	*			trans	-62.3	90.8	167.1	-65.7	-177.1	178.3	-176.9	0	105.1	E39 E43	E39-K41 HydrophobicContact CB-CG 3.74Å; E39-K41 PolarHBondContact O-N 3.37Å; E39-K41 WeakPolarHBondContact OE2-CE 3.31Å; E39-K41 IonicContact OE2-NZ 3.67Å; E39-K41 PolarHBondContact OE2-NZ 3.44Å; K41-E43 WeakPolarHBondContact O-CA 3.28Å; K41-E43 PolarHBondContact O-N 2.89Å
42	K	50.7	Low	63.4	Low	184 Å²	184	105.6 Å²	105.6	80%	0.8	54%	0.538	S	S	*	.			trans	-42	109.1	166.5	-66.1	-177.6	178.6	-177.6	0	104.9	E40 V44	E40-K42 PolarHBondContact O-N 3.29Å; K42-V44 VanDerWaalsContact C-N 3.28Å; K42-V44 WeakPolarHBondContact O-CG2 3.27Å; K42-V44 PolarHBondContact O-N 2.83Å
43	E	58.3	Low	66.1	Low	148 Å²	148	99.8 Å²	99.8	69%	0.692	50%	0.5	S	S	*	.			trans	-74.2	93.5	-164.5	-168.8	167	-147.1	0	0	106.9	K41 F45	K41-E43 WeakPolarHBondContact O-CA 3.28Å; K41-E43 PolarHBondContact O-N 2.89Å; E43-F45 HydrophobicContact CB-CZ 4.15Å; E43-F45 HydrophobicContact CG-CE1 4.15Å; E43-F45 HydrophobicContact CG-CZ 4.2Å; E43-F45 WeakPolarHBondContact O-CD2 3.48Å; E43-F45 WeakPolarHBondContact O-CE2 3.41Å; E43-F45 WeakPolarHBondContact O-CG 3.49Å; E43-F45 PolarHBondContact O-N 3.14Å
44	V	69.9	Low	68.4	Low	80 Å²	80	95.4 Å²	95.4	49%	0.485	46%	0.464	S	S	.	.			trans	-72.2	95.9	-164.1	-169.2	0	0	0	0	108.6	K42 T46 T99	K42-V44 VanDerWaalsContact C-N 3.28Å; K42-V44 WeakPolarHBondContact O-CG2 3.27Å; K42-V44 PolarHBondContact O-N 2.83Å; V44-T46 HydrophobicContact CG1-CG2 3.86Å; V44-T46 PolarHBondContact O-N 3.05Å; V44-T99 HydrophobicContact CG1-CG2 3.24Å
45	F	81.9	Confident	70.6	Confident	83 Å²	83	90 Å²	90	36%	0.364	44%	0.437	S	S	.	.			trans	-69.4	78	175.5	-60.5	-62.6	0	0	0	110	E43 K47 I102 F128 Q132	E43-F45 HydrophobicContact CB-CZ 4.15Å; E43-F45 HydrophobicContact CG-CE1 4.15Å; E43-F45 HydrophobicContact CG-CZ 4.2Å; E43-F45 WeakPolarHBondContact O-CD2 3.48Å; E43-F45 WeakPolarHBondContact O-CE2 3.41Å; E43-F45 WeakPolarHBondContact O-CG 3.49Å; E43-F45 PolarHBondContact O-N 3.14Å; F45-K47 PolarHBondContact O-N 2.88Å; F45-I102 WeakPolarHBondContact O-CD1 3.47Å; F45-F128 HydrophobicContact CB-CB 4.17Å; F45-F128 HydrophobicContact CB-CD1 3.32Å; F45-F128 HydrophobicContact CB-CE1 3.73Å; F45-F128 HydrophobicContact CB-CG 3.76Å; F45-F128 HydrophobicContact CB-CZ 4.48Å; F45-F128 HydrophobicContact CG-CD1 4.37Å; F45-F128 HydrophobicContact CG-CG 4.37Å; F45-F128 VanDerWaalsContact O-CD1 3.26Å; F45-F128 WeakPolarHBondContact O-CD1 3.26Å; F45-F128 WeakPolarHBondContact O-CE1 3.39Å; F45-Q132 VanDerWaalsContact CA-OE1 3.25Å; F45-Q132 HydrophobicContact CD1-CB 4.15Å; F45-Q132 HydrophobicContact CD1-CG 4.11Å
46	T	88.6	Confident	72.9	Confident	32 Å²	32	87.6 Å²	87.6	20%	0.196	41%	0.414	C	S	.	.			trans	-71	-11.9	178.7	41.5	0	0	0	0	113.6	V44 N95 F96 Q132	V44-T46 HydrophobicContact CG1-CG2 3.86Å; V44-T46 PolarHBondContact O-N 3.05Å; T46-N95 CarbonylContact O-C 3.44Å; T46-N95 WeakPolarHBondContact O-CA 3.41Å; T46-N95 PolarHBondContact O-OD1 3.26Å; T46-N95 PolarHBondContact OG1-OD1 3.03Å; T46-N95 VanDerWaalsContact OG1-OD1 3.12Å; T46-F96 WeakPolarHBondContact CB-O 3.17Å; T46-F96 PolarHBondContact O-N 2.93Å; T46-Q132 PolarHBondContact OG1-NE2 3.12Å
47	K	92.3	Very high	75	Confident	16 Å²	16	79.7 Å²	79.7	7%	0.07	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	116.4	-175.1	-166.3	-175.1	173.2	-169.1	0	110.6	F45 I94 N95 A129 F131 Q132 K133 I134	F45-K47 PolarHBondContact O-N 2.88Å; K47-I94 CarbonylContact C-O 3.46Å; K47-I94 VanDerWaalsContact CA-O 3.3Å; K47-I94 WeakPolarHBondContact CA-O 3.38Å; K47-N95 WeakPolarHBondContact CB-OD1 3.49Å; K47-N95 HydrophobicContact CG-CB 4.49Å; K47-N95 PolarHBondContact N-OD1 2.94Å; K47-A129 HydrophobicContact CB-CB 4.12Å; K47-A129 HydrophobicContact CD-CB 3.87Å; K47-A129 HydrophobicContact CG-CB 3.73Å; K47-A129 WeakPolarHBondContact O-CB 3.5Å; K47-A129 PolarHBondContact O-N 3.19Å; K47-F131 WeakPolarHBondContact CD-O 3.49Å; K47-F131 PolarHBondContact NZ-O 2.76Å; K47-Q132 WeakPolarHBondContact CD-O 3.31Å; K47-K133 PolarHBondContact NZ-O 2.94Å; K47-I134 HydrophobicContact CD-CG1 4.31Å
48	V	92.4	Very high	77.5	Confident	2 Å²	2	75.8 Å²	75.8	1%	0.012	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	148.7	178.8	179.1	0	0	0	0	109	Y93 I94 F96 I102 F105 V126 E127	V48-Y93 WeakPolarHBondContact O-CA 3.42Å; V48-I94 PolarHBondContact N-O 3.38Å; V48-I94 PolarHBondContact O-N 2.97Å; V48-F96 HydrophobicContact CB-CD2 4.35Å; V48-F96 HydrophobicContact CB-CE2 3.98Å; V48-F96 HydrophobicContact CG2-CD2 3.79Å; V48-F96 HydrophobicContact CG2-CE2 3.77Å; V48-I102 HydrophobicContact CG2-CB 4.44Å; V48-I102 HydrophobicContact CG2-CD1 4.37Å; V48-I102 HydrophobicContact CG2-CG1 4.1Å; V48-I102 HydrophobicContact CG2-CG2 3.64Å; V48-F105 HydrophobicContact CG1-CD1 4.24Å; V48-F105 HydrophobicContact CG1-CE1 4.21Å; V48-V126 HydrophobicContact CG1-CG1 3.5Å; V48-E127 CarbonylContact C-O 3.57Å; V48-E127 WeakPolarHBondContact CA-O 3.18Å
49	V	93.9	Very high	79.8	Confident	3 Å²	3	70.6 Å²	70.6	2%	0.018	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	126.4	168.2	64.2	0	0	0	0	110	R51 A92 Y93 E127 A129	V49-R51 HydrophobicContact CG1-CG 4.11Å; V49-R51 HydrophobicContact CG2-CG 3.92Å; V49-A92 CarbonylContact C-O 3.59Å; V49-A92 VanDerWaalsContact CA-O 3.32Å; V49-A92 WeakPolarHBondContact CA-O 3.32Å; V49-Y93 HydrophobicContact CB-CD1 3.75Å; V49-Y93 HydrophobicContact CB-CE1 3.74Å; V49-Y93 HydrophobicContact CG2-CD1 3.7Å; V49-Y93 HydrophobicContact CG2-CE1 3.42Å; V49-Y93 VanDerWaalsContact CG2-CE1 3.42Å; V49-Y93 HydrophobicContact CG2-CE2 4.37Å; V49-Y93 HydrophobicContact CG2-CG 4.3Å; V49-E127 HydrophobicContact CG1-CB 4Å; V49-E127 PolarHBondContact N-O 3.02Å; V49-E127 PolarHBondContact O-N 3.44Å; V49-A129 HydrophobicContact CB-CB 4.22Å; V49-A129 HydrophobicContact CG1-CB 4.46Å
50	I	93.8	Very high	82	Confident	1 Å²	1	70.8 Å²	70.8	1%	0.005	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	123.3	167.5	-41	172.1	0	0	0	107.2	L53 L62 L66 R91 A92 I94 F105 A124 V126	I50-L53 HydrophobicContact CB-CD1 4.19Å; I50-L53 HydrophobicContact CG2-CD1 4.08Å; I50-L53 HydrophobicContact CG2-CD2 3.81Å; I50-L53 HydrophobicContact CG2-CG 3.94Å; I50-L62 HydrophobicContact CD1-CD1 4.22Å; I50-L62 HydrophobicContact CD1-CD2 4.37Å; I50-L66 HydrophobicContact CD1-CD1 3.61Å; I50-L66 HydrophobicContact CD1-CD2 4.19Å; I50-L66 HydrophobicContact CD1-CG 4.49Å; I50-R91 VanDerWaalsContact O-CA 3.26Å; I50-R91 WeakPolarHBondContact O-CA 3.3Å; I50-A92 HydrophobicContact CB-CB 4.49Å; I50-A92 HydrophobicContact CD1-CB 4.33Å; I50-A92 PolarHBondContact N-O 3.1Å; I50-A92 PolarHBondContact O-N 2.79Å; I50-I94 HydrophobicContact CD1-CD1 4Å; I50-F105 HydrophobicContact CD1-CE1 4.17Å; I50-F105 HydrophobicContact CD1-CZ 3.64Å; I50-F105 HydrophobicContact CG1-CE1 4.06Å; I50-F105 HydrophobicContact CG1-CZ 4.06Å; I50-A124 HydrophobicContact CG2-CB 4.16Å; I50-V126 HydrophobicContact CG2-CG2 4.39Å
51	R	93.8	Very high	84.2	Confident	117 Å²	117	65.7 Å²	65.7	44%	0.442	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	163.8	-178.5	-59.4	176.6	68.4	-165.1	-3.3	110.1	V49 L53 A124 V125 E127	V49-R51 HydrophobicContact CG1-CG 4.11Å; V49-R51 HydrophobicContact CG2-CG 3.92Å; R51-L53 VanDerWaalsContact C-N 3.28Å; R51-L53 PolarHBondContact O-N 2.91Å; R51-A124 WeakPolarHBondContact O-CA 3.4Å; R51-V125 HydrophobicContact CB-CB 4.48Å; R51-V125 PolarHBondContact N-O 3.08Å; R51-V125 PolarHBondContact O-N 3.39Å; R51-V125 VanDerWaalsContact O-N 3.08Å; R51-E127 WeakPolarHBondContact CD-OE2 3.44Å; R51-E127 IonicContact CZ-OE2 3.05Å; R51-E127 IonicContact NE-OE2 2.94Å; R51-E127 VanDerWaalsContact NH1-CD 3.28Å; R51-E127 IonicContact NH1-OE1 2.65Å; R51-E127 PolarHBondContact NH1-OE1 2.8Å; R51-E127 IonicContact NH1-OE2 3.55Å; R51-E127 PolarHBondContact NH1-OE2 2.86Å
52	R	90.7	Very high	86.1	Confident	108 Å²	108	58.2 Å²	58.2	41%	0.408	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	64	23.6	177.5	-54.3	178.6	66.2	-163.8	-0.5	115	F89 Y122 P123	R52-F89 HydrophobicContact CB-CD1 4.14Å; R52-F89 HydrophobicContact CB-CE1 4.38Å; R52-Y122 WeakPolarHBondContact O-CB 3.47Å; R52-P123 PolarHBondContact NH1-O 2.85Å
53	L	92.1	Very high	87.9	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	152.4	173.2	-64.6	172.8	0	0	0	110.9	I50 R51 L57 L62 F77 S90 A92 F114 A124	I50-L53 HydrophobicContact CB-CD1 4.19Å; I50-L53 HydrophobicContact CG2-CD1 4.08Å; I50-L53 HydrophobicContact CG2-CD2 3.81Å; I50-L53 HydrophobicContact CG2-CG 3.94Å; R51-L53 VanDerWaalsContact C-N 3.28Å; R51-L53 PolarHBondContact O-N 2.91Å; L53-L57 HydrophobicContact CB-CD2 4.21Å; L53-L57 HydrophobicContact CD1-CD2 4.33Å; L53-L57 HydrophobicContact CD2-CD2 4.06Å; L53-L57 HydrophobicContact CG-CD2 4.44Å; L53-L62 HydrophobicContact CD1-CD1 3.93Å; L53-L62 HydrophobicContact CD1-CD2 3.71Å; L53-L62 HydrophobicContact CD1-CG 4.46Å; L53-L62 HydrophobicContact CD2-CD1 4.11Å; L53-F77 HydrophobicContact CD1-CE2 4.29Å; L53-S90 PolarHBondContact N-O 2.94Å; L53-S90 PolarHBondContact O-N 3.05Å; L53-A92 HydrophobicContact CD1-CB 4.26Å; L53-F114 HydrophobicContact CD2-CD2 3.61Å; L53-F114 HydrophobicContact CD2-CE1 4.38Å; L53-F114 HydrophobicContact CD2-CE2 3.37Å; L53-F114 HydrophobicContact CD2-CG 4.22Å; L53-F114 HydrophobicContact CD2-CZ 3.8Å; L53-A124 HydrophobicContact CD2-CB 4.3Å
54	P	91.6	Very high	89.3	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.013	25%	0.25	C	C	.	.			trans	-57.4	148.3	179	-22.2	30	0	0	0	112.9	S56 L57 S90 F114 D116 Y122	P54-S56 PolarHBondContact O-N 3.14Å; P54-L57 HydrophobicContact CB-CB 4.19Å; P54-L57 HydrophobicContact CG-CB 4.38Å; P54-L57 PolarHBondContact O-N 2.96Å; P54-S90 VanDerWaalsContact O-CB 3.31Å; P54-S90 WeakPolarHBondContact O-CB 3.35Å; P54-S90 PolarHBondContact O-OG 2.89Å; P54-F114 HydrophobicContact CG-CB 3.51Å; P54-F114 HydrophobicContact CG-CG 4.46Å; P54-D116 HydrophobicContact CB-CB 4.4Å; P54-Y122 HydrophobicContact CB-CD2 3.88Å; P54-Y122 HydrophobicContact CB-CE2 4.16Å; P54-Y122 HydrophobicContact CB-CG 4.22Å; P54-Y122 HydrophobicContact CG-CD2 3.83Å; P54-Y122 HydrophobicContact CG-CG 3.96Å
55	P	89	Confident	90.1	Very high	36 Å²	36	51.8 Å²	51.8	23%	0.234	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-16.1	178.9	28.7	-35.1	0	0	0	114	A80 L88 Y122	P55-A80 HydrophobicContact CB-CB 3.5Å; P55-L88 HydrophobicContact CB-CB 3.98Å; P55-L88 WeakPolarHBondContact CB-O 3.46Å; P55-L88 WeakPolarHBondContact CD-O 3.32Å; P55-L88 HydrophobicContact CG-CB 4.35Å; P55-Y122 VanDerWaalsContact CD-CZ 3.45Å; P55-Y122 VanDerWaalsContact CD-OH 3.31Å; P55-Y122 WeakPolarHBondContact CD-OH 3.35Å
56	S	86.8	Confident	90.2	Very high	46 Å²	46	48 Å²	48	32%	0.322	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-13.8	178.9	52.9	0	0	0	0	114.2	P54 S58 D116	P54-S56 PolarHBondContact O-N 3.14Å; S56-S58 PolarHBondContact O-N 3.13Å; S56-D116 WeakPolarHBondContact CB-OD1 3.46Å; S56-D116 PolarHBondContact OG-OD1 3.41Å
57	L	88.6	Confident	89.7	Confident	15 Å²	15	50.4 Å²	50.4	8%	0.079	25%	0.247	C	C	.	.			trans	-64.3	129.1	-176.9	-171.8	70.9	0	0	0	109.9	L53 P54 Q61 L62 F77 F114	L53-L57 HydrophobicContact CB-CD2 4.21Å; L53-L57 HydrophobicContact CD1-CD2 4.33Å; L53-L57 HydrophobicContact CD2-CD2 4.06Å; L53-L57 HydrophobicContact CG-CD2 4.44Å; P54-L57 HydrophobicContact CB-CB 4.19Å; P54-L57 HydrophobicContact CG-CB 4.38Å; P54-L57 PolarHBondContact O-N 2.96Å; L57-Q61 HydrophobicContact CD1-CB 3.62Å; L57-Q61 HydrophobicContact CG-CB 4.37Å; L57-L62 HydrophobicContact CD2-CB 4.01Å; L57-L62 HydrophobicContact CD2-CD1 4Å; L57-L62 HydrophobicContact CG-CB 4.49Å; L57-F77 WeakPolarHBondContact O-CZ 3.42Å; L57-F114 HydrophobicContact CD2-CD1 4.23Å; L57-F114 HydrophobicContact CD2-CE1 4.3Å
58	S	91.9	Very high	89.1	Confident	39 Å²	39	54.8 Å²	54.8	27%	0.273	28%	0.277	S	S	.	.			trans	-82.4	162	175	94.7	0	0	0	0	111.9	S56 E60 Q61 L62	S56-S58 PolarHBondContact O-N 3.13Å; S58-E60 PolarHBondContact O-N 3.15Å; S58-E60 PolarHBondContact OG-N 2.93Å; S58-Q61 PolarHBondContact O-N 2.8Å; S58-Q61 WeakPolarHBondContact OG-CG 3.29Å; S58-Q61 PolarHBondContact OG-N 3.34Å; S58-L62 PolarHBondContact O-N 2.85Å; S58-L62 VanDerWaalsContact O-N 3.11Å
59	K	90.8	Very high	88.1	Confident	90 Å²	90	56.8 Å²	56.8	39%	0.391	29%	0.287	S	S	.	.	H	α-helix	trans	-54.3	-42.9	171	-179.8	-171.7	167.1	-74.5	0	111.5	L62 E63 F75 F77	K59-L62 PolarHBondContact O-N 3.17Å; K59-E63 WeakPolarHBondContact CE-OE1 2.97Å; K59-E63 IonicContact NZ-OE1 2.69Å; K59-E63 PolarHBondContact NZ-OE1 3.09Å; K59-E63 IonicContact NZ-OE2 2.77Å; K59-E63 PolarHBondContact NZ-OE2 2.94Å; K59-E63 WeakPolarHBondContact O-CG 3.39Å; K59-E63 PolarHBondContact O-N 3.05Å; K59-F75 HydrophobicContact CD-CE1 4.49Å; K59-F75 HydrophobicContact CG-CE1 3.83Å; K59-F77 HydrophobicContact CB-CB 4.01Å; K59-F77 HydrophobicContact CB-CD1 4.23Å; K59-F77 HydrophobicContact CB-CG 4.14Å; K59-F77 HydrophobicContact CG-CB 3.91Å
60	E	90.3	Very high	87.2	Confident	145 Å²	145	57.9 Å²	57.9	68%	0.678	29%	0.294	S	S	*	.	H	α-helix	trans	-74	-41.6	-174.1	-67.2	154.2	-171.3	0	0	111.3	S58 L62 E63 E64	S58-E60 PolarHBondContact O-N 3.15Å; S58-E60 PolarHBondContact OG-N 2.93Å; E60-L62 VanDerWaalsContact C-N 3.27Å; E60-L62 PolarHBondContact O-N 2.79Å; E60-E63 PolarHBondContact O-N 2.95Å; E60-E63 VanDerWaalsContact O-N 3.14Å; E60-E64 PolarHBondContact O-N 3.49Å
61	Q	90.8	Very high	86.4	Confident	75 Å²	75	61 Å²	61	35%	0.35	32%	0.317	S	S	.	.	H	α-helix	trans	-61.1	-37.5	172.9	-71	173.2	-40.7	0	0	111.6	L57 S58 E64 H65	L57-Q61 HydrophobicContact CD1-CB 3.62Å; L57-Q61 HydrophobicContact CG-CB 4.37Å; S58-Q61 PolarHBondContact O-N 2.8Å; S58-Q61 WeakPolarHBondContact OG-CG 3.29Å; S58-Q61 PolarHBondContact OG-N 3.34Å; Q61-E64 PolarHBondContact O-N 3.34Å; Q61-H65 WeakPolarHBondContact O-CB 3.49Å; Q61-H65 PolarHBondContact O-CD2 2.85Å; Q61-H65 PolarHBondContact O-N 2.69Å
62	L	89.9	Confident	86	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-66.2	-45.7	172.7	-176.5	65.8	0	0	0	111.3	I50 L53 L57 S58 K59 E60 E64 H65 L66 F75 F77 A92 F114	I50-L62 HydrophobicContact CD1-CD1 4.22Å; I50-L62 HydrophobicContact CD1-CD2 4.37Å; L53-L62 HydrophobicContact CD1-CD1 3.93Å; L53-L62 HydrophobicContact CD1-CD2 3.71Å; L53-L62 HydrophobicContact CD1-CG 4.46Å; L53-L62 HydrophobicContact CD2-CD1 4.11Å; L57-L62 HydrophobicContact CD2-CB 4.01Å; L57-L62 HydrophobicContact CD2-CD1 4Å; L57-L62 HydrophobicContact CG-CB 4.49Å; S58-L62 PolarHBondContact O-N 2.85Å; S58-L62 VanDerWaalsContact O-N 3.11Å; K59-L62 PolarHBondContact O-N 3.17Å; E60-L62 VanDerWaalsContact C-N 3.27Å; E60-L62 PolarHBondContact O-N 2.79Å; L62-E64 VanDerWaalsContact C-N 3.25Å; L62-E64 PolarHBondContact O-N 2.82Å; L62-H65 PolarHBondContact O-N 2.95Å; L62-L66 HydrophobicContact CD1-CD1 3.92Å; L62-L66 HydrophobicContact CD1-CD2 4.28Å; L62-L66 HydrophobicContact CD1-CG 3.94Å; L62-L66 HydrophobicContact CD2-CD1 4.43Å; L62-L66 HydrophobicContact CG-CD1 3.83Å; L62-L66 HydrophobicContact CG-CG 4.19Å; L62-L66 WeakPolarHBondContact O-CB 3.48Å; L62-L66 WeakPolarHBondContact O-CG 3.47Å; L62-L66 PolarHBondContact O-N 3.06Å; L62-F75 HydrophobicContact CD2-CE2 4.45Å; L62-F75 HydrophobicContact CD2-CZ 4Å; L62-F75 HydrophobicContact CG-CZ 4.41Å; L62-F77 HydrophobicContact CD2-CD2 3.76Å; L62-F77 HydrophobicContact CD2-CE2 4.15Å; L62-A92 HydrophobicContact CD2-CB 3.39Å; L62-F114 HydrophobicContact CD1-CE1 4.41Å; L62-F114 HydrophobicContact CD1-CZ 4.17Å
63	E	88.5	Confident	85.7	Confident	46 Å²	46	59.7 Å²	59.7	22%	0.215	32%	0.32	C	S	.	.	H	α-helix	trans	-61.1	-33.7	176.8	-74.5	168.3	148.2	0	0	112.6	K59 E60 S67 F75	K59-E63 WeakPolarHBondContact CE-OE1 2.97Å; K59-E63 IonicContact NZ-OE1 2.69Å; K59-E63 PolarHBondContact NZ-OE1 3.09Å; K59-E63 IonicContact NZ-OE2 2.77Å; K59-E63 PolarHBondContact NZ-OE2 2.94Å; K59-E63 WeakPolarHBondContact O-CG 3.39Å; K59-E63 PolarHBondContact O-N 3.05Å; E60-E63 PolarHBondContact O-N 2.95Å; E60-E63 VanDerWaalsContact O-N 3.14Å; E63-S67 PolarHBondContact O-N 2.88Å; E63-F75 HydrophobicContact CG-CD1 4.26Å; E63-F75 HydrophobicContact CG-CE1 3.5Å; E63-F75 HydrophobicContact CG-CE2 4.34Å; E63-F75 HydrophobicContact CG-CZ 3.56Å; E63-F75 VanDerWaalsContact OE1-CD1 3.26Å; E63-F75 WeakPolarHBondContact OE1-CD1 3.1Å; E63-F75 VanDerWaalsContact OE1-CE1 3.22Å; E63-F75 WeakPolarHBondContact OE1-CE1 3.46Å
64	E	89	Confident	85.4	Confident	147 Å²	147	61.5 Å²	61.5	69%	0.687	33%	0.327	S	S	*	.	H	α-helix	trans	-67.7	-51.3	171.9	-175.5	174.8	-161.2	0	0	112.1	E60 Q61 L62 L66 S67	E60-E64 PolarHBondContact O-N 3.49Å; Q61-E64 PolarHBondContact O-N 3.34Å; L62-E64 VanDerWaalsContact C-N 3.25Å; L62-E64 PolarHBondContact O-N 2.82Å; E64-L66 PolarHBondContact O-N 2.79Å; E64-S67 WeakPolarHBondContact O-CB 3.4Å; E64-S67 PolarHBondContact O-N 2.78Å
65	H	85.6	Confident	85.4	Confident	85 Å²	85	62.6 Å²	62.6	39%	0.394	33%	0.332	S	S	.	.	H	α-helix	trans	-62.3	-28.4	178.1	-76.5	-55.9	0	0	0	113.9	Q61 L62 S67 F109 F114	Q61-H65 WeakPolarHBondContact O-CB 3.49Å; Q61-H65 PolarHBondContact O-CD2 2.85Å; Q61-H65 PolarHBondContact O-N 2.69Å; L62-H65 PolarHBondContact O-N 2.95Å; H65-S67 VanDerWaalsContact C-N 3.33Å; H65-F109 VanDerWaalsContact O-CE1 3.32Å; H65-F109 WeakPolarHBondContact O-CE1 3.41Å; H65-F109 WeakPolarHBondContact O-CZ 3.39Å; H65-F114 HydrophobicContact CB-CE1 3.94Å; H65-F114 AromaticContact CD2-CE1 3.76Å; H65-F114 AromaticContact CG-CE1 3.93Å
66	L	84	Confident	85.4	Confident	3 Å²	3	62.9 Å²	62.9	2%	0.016	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-3.5	176.2	-59.8	-178.9	0	0	0	113.2	I50 L62 E64 P68 L69 F75 I94 F105 F109	I50-L66 HydrophobicContact CD1-CD1 3.61Å; I50-L66 HydrophobicContact CD1-CD2 4.19Å; I50-L66 HydrophobicContact CD1-CG 4.49Å; L62-L66 HydrophobicContact CD1-CD1 3.92Å; L62-L66 HydrophobicContact CD1-CD2 4.28Å; L62-L66 HydrophobicContact CD1-CG 3.94Å; L62-L66 HydrophobicContact CD2-CD1 4.43Å; L62-L66 HydrophobicContact CG-CD1 3.83Å; L62-L66 HydrophobicContact CG-CG 4.19Å; L62-L66 WeakPolarHBondContact O-CB 3.48Å; L62-L66 WeakPolarHBondContact O-CG 3.47Å; L62-L66 PolarHBondContact O-N 3.06Å; E64-L66 PolarHBondContact O-N 2.79Å; L66-P68 CarbonylContact O-C 3.58Å; L66-P68 VanDerWaalsContact O-C 3.32Å; L66-L69 HydrophobicContact CB-CD1 4.1Å; L66-L69 HydrophobicContact CB-CD2 3.71Å; L66-L69 HydrophobicContact CB-CG 3.7Å; L66-L69 HydrophobicContact CD1-CD2 4.23Å; L66-L69 WeakPolarHBondContact O-CG 3.43Å; L66-L69 PolarHBondContact O-N 3.19Å; L66-F75 HydrophobicContact CD1-CE2 4.38Å; L66-I94 HydrophobicContact CD1-CD1 3.68Å; L66-F105 HydrophobicContact CB-CE2 4.4Å; L66-F105 HydrophobicContact CD1-CE2 3.98Å; L66-F105 HydrophobicContact CD1-CZ 3.98Å; L66-F105 HydrophobicContact CD2-CE2 3.69Å; L66-F105 HydrophobicContact CD2-CZ 3.68Å; L66-F105 HydrophobicContact CG-CE2 4.21Å; L66-F105 HydrophobicContact CG-CZ 4.4Å; L66-F109 HydrophobicContact CB-CZ 4.45Å; L66-F109 HydrophobicContact CD2-CD1 3.64Å; L66-F109 HydrophobicContact CD2-CD2 3.78Å; L66-F109 HydrophobicContact CD2-CE1 3.64Å; L66-F109 HydrophobicContact CD2-CE2 3.78Å; L66-F109 HydrophobicContact CD2-CG 3.72Å; L66-F109 HydrophobicContact CD2-CZ 3.72Å
67	S	78.1	Confident	85.7	Confident	83 Å²	83	62.2 Å²	62.2	58%	0.58	32%	0.321	S	S	*	.			trans	-71.1	133.9	178.7	-165.7	0	0	0	0	111.4	E63 E64 H65	E63-S67 PolarHBondContact O-N 2.88Å; E64-S67 WeakPolarHBondContact O-CB 3.4Å; E64-S67 PolarHBondContact O-N 2.78Å; H65-S67 VanDerWaalsContact C-N 3.33Å
68	P	78.8	Confident	85.8	Confident	108 Å²	108	65.2 Å²	65.2	70%	0.701	33%	0.334	S	S	*	.	S	Bend	cis	-80.4	115.1	1.8	31.3	-33.7	0	0	0	112.7	L66 P70	L66-P68 CarbonylContact O-C 3.58Å; L66-P68 VanDerWaalsContact O-C 3.32Å; P68-P70 WeakPolarHBondContact O-CD 3.15Å
69	L	72.2	Confident	85.7	Confident	43 Å²	43	67.5 Å²	67.5	23%	0.225	35%	0.348	C	S	.	.			trans	-72.2	128.5	176.6	-93.8	173.6	0	0	0	111	L66 Y72 I94 F96 F105	L66-L69 HydrophobicContact CB-CD1 4.1Å; L66-L69 HydrophobicContact CB-CD2 3.71Å; L66-L69 HydrophobicContact CB-CG 3.7Å; L66-L69 HydrophobicContact CD1-CD2 4.23Å; L66-L69 WeakPolarHBondContact O-CG 3.43Å; L66-L69 PolarHBondContact O-N 3.19Å; L69-Y72 HydrophobicContact CB-CD1 4.4Å; L69-Y72 HydrophobicContact CB-CE1 4.24Å; L69-Y72 HydrophobicContact CD1-CD1 4.34Å; L69-Y72 HydrophobicContact CD1-CE1 3.85Å; L69-I94 HydrophobicContact CD2-CD1 4.45Å; L69-F96 HydrophobicContact CD2-CE1 4.44Å; L69-F105 HydrophobicContact CD2-CE2 4.15Å
70	P	75.9	Confident	85.6	Confident	26 Å²	26	64.1 Å²	64.1	17%	0.169	34%	0.337	C	S	.	.			trans	-63.9	172.2	168.2	-18.8	29.6	0	0	0	113.3	P68 Y72 F96 D101	P68-P70 WeakPolarHBondContact O-CD 3.15Å; P70-Y72 WeakPolarHBondContact O-CD1 3.31Å; P70-Y72 PolarHBondContact O-N 3.35Å; P70-Y72 VanDerWaalsContact O-N 3.08Å; P70-F96 HydrophobicContact CB-CD1 4.2Å; P70-F96 HydrophobicContact CB-CE1 4.32Å; P70-F96 HydrophobicContact CG-CE1 4.26Å; P70-D101 HydrophobicContact CB-CB 3.64Å; P70-D101 WeakPolarHBondContact CB-OD1 3.26Å; P70-D101 WeakPolarHBondContact CB-OD2 3.3Å; P70-D101 HydrophobicContact CG-CB 3.97Å
71	S	76.9	Confident	85.4	Confident	68 Å²	68	60.4 Å²	60.4	48%	0.476	32%	0.321	S	S	.	.			trans	-71.8	109.1	-170.3	-154.3	0	0	0	0	112.5	K97	S71-K97 WeakPolarHBondContact O-CB 3.26Å; S71-K97 WeakPolarHBondContact O-CG 3.36Å; S71-K97 PolarHBondContact O-N 3.27Å; S71-K97 PolarHBondContact OG-NZ 2.91Å
72	Y	83.8	Confident	85.1	Confident	91 Å²	91	65 Å²	65	36%	0.357	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	155.3	178.4	61.9	-94.3	0	0	0	113.2	L69 P70 F75 I94 N95	L69-Y72 HydrophobicContact CB-CD1 4.4Å; L69-Y72 HydrophobicContact CB-CE1 4.24Å; L69-Y72 HydrophobicContact CD1-CD1 4.34Å; L69-Y72 HydrophobicContact CD1-CE1 3.85Å; P70-Y72 WeakPolarHBondContact O-CD1 3.31Å; P70-Y72 PolarHBondContact O-N 3.35Å; P70-Y72 VanDerWaalsContact O-N 3.08Å; Y72-F75 HydrophobicContact CD2-CB 3.92Å; Y72-F75 HydrophobicContact CE2-CB 3.7Å; Y72-I94 HydrophobicContact CG-CG2 4.42Å; Y72-N95 CarbonylContact C-O 3.5Å; Y72-N95 WeakPolarHBondContact CA-O 3.32Å; Y72-N95 VanDerWaalsContact CB-O 3.3Å; Y72-N95 WeakPolarHBondContact CB-O 3.42Å
73	D	85.6	Confident	84.8	Confident	106 Å²	106	69.4 Å²	69.4	57%	0.567	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.5	-25	173.6	-79.2	-29.2	0	0	0	112.9	N95 K97	D73-N95 PolarHBondContact N-O 2.94Å; D73-K97 WeakPolarHBondContact OD1-CE 3.45Å; D73-K97 IonicContact OD1-NZ 3.55Å
74	Y	86.2	Confident	84.5	Confident	38 Å²	38	71.6 Å²	71.6	15%	0.149	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	134.6	-173	-176.9	-105.8	0	0	0	109.8	E76 I94 N95 I134	Y74-E76 HydrophobicContact CD1-CB 4.5Å; Y74-E76 HydrophobicContact CE1-CB 3.61Å; Y74-E76 HydrophobicContact CE2-CB 4.46Å; Y74-E76 VanDerWaalsContact OH-CB 3.31Å; Y74-E76 WeakPolarHBondContact OH-CB 3.22Å; Y74-E76 VanDerWaalsContact OH-CD 3.28Å; Y74-E76 WeakPolarHBondContact OH-CG 3.2Å; Y74-E76 PolarHBondContact OH-OE2 3.28Å; Y74-I94 CarbonylContact O-C 3.56Å; Y74-I94 WeakPolarHBondContact O-CA 3.48Å; Y74-N95 PolarHBondContact O-N 3.26Å; Y74-I134 HydrophobicContact CD1-CG2 3.95Å; Y74-I134 HydrophobicContact CD2-CG2 3.79Å; Y74-I134 HydrophobicContact CE1-CG2 4.27Å; Y74-I134 HydrophobicContact CE2-CG2 4.16Å; Y74-I134 HydrophobicContact CG-CG2 3.68Å
75	F	89.9	Confident	84.1	Confident	25 Å²	25	73.3 Å²	73.3	11%	0.11	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	124.2	175.2	-178.1	-96.2	0	0	0	108.6	K59 L62 E63 L66 Y72 Y93 I94	K59-F75 HydrophobicContact CD-CE1 4.49Å; K59-F75 HydrophobicContact CG-CE1 3.83Å; L62-F75 HydrophobicContact CD2-CE2 4.45Å; L62-F75 HydrophobicContact CD2-CZ 4Å; L62-F75 HydrophobicContact CG-CZ 4.41Å; E63-F75 HydrophobicContact CG-CD1 4.26Å; E63-F75 HydrophobicContact CG-CE1 3.5Å; E63-F75 HydrophobicContact CG-CE2 4.34Å; E63-F75 HydrophobicContact CG-CZ 3.56Å; E63-F75 VanDerWaalsContact OE1-CD1 3.26Å; E63-F75 WeakPolarHBondContact OE1-CD1 3.1Å; E63-F75 VanDerWaalsContact OE1-CE1 3.22Å; E63-F75 WeakPolarHBondContact OE1-CE1 3.46Å; L66-F75 HydrophobicContact CD1-CE2 4.38Å; Y72-F75 HydrophobicContact CD2-CB 3.92Å; Y72-F75 HydrophobicContact CE2-CB 3.7Å; F75-Y93 WeakPolarHBondContact CA-O 3.11Å; F75-I94 HydrophobicContact CD2-CB 4.43Å; F75-I94 HydrophobicContact CD2-CD1 3.85Å; F75-I94 HydrophobicContact CD2-CG1 3.68Å; F75-I94 HydrophobicContact CD2-CG2 4.3Å; F75-I94 HydrophobicContact CE2-CD1 3.71Å; F75-I94 HydrophobicContact CE2-CG1 3.89Å
76	E	90.1	Very high	83.9	Confident	42 Å²	42	73.5 Å²	73.5	20%	0.196	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	112.5	-177.2	-169.7	89.2	-152.9	0	0	110.4	Y74 F78 A92 Y93 K137	Y74-E76 HydrophobicContact CD1-CB 4.5Å; Y74-E76 HydrophobicContact CE1-CB 3.61Å; Y74-E76 HydrophobicContact CE2-CB 4.46Å; Y74-E76 VanDerWaalsContact OH-CB 3.31Å; Y74-E76 WeakPolarHBondContact OH-CB 3.22Å; Y74-E76 VanDerWaalsContact OH-CD 3.28Å; Y74-E76 WeakPolarHBondContact OH-CG 3.2Å; Y74-E76 PolarHBondContact OH-OE2 3.28Å; E76-F78 HydrophobicContact CB-CE2 4.18Å; E76-F78 HydrophobicContact CG-CD2 4.16Å; E76-F78 HydrophobicContact CG-CE2 3.45Å; E76-F78 VanDerWaalsContact CG-CE2 3.45Å; E76-F78 HydrophobicContact CG-CZ 3.88Å; E76-A92 WeakPolarHBondContact O-CA 3.49Å; E76-Y93 PolarHBondContact N-O 3.01Å; E76-Y93 PolarHBondContact O-N 3.32Å; E76-K137 IonicContact OE1-NZ 3.39Å; E76-K137 PolarHBondContact OE1-NZ 2.66Å; E76-K137 VanDerWaalsContact OE2-CE 3.22Å; E76-K137 WeakPolarHBondContact OE2-CE 3.49Å; E76-K137 IonicContact OE2-NZ 2.66Å; E76-K137 PolarHBondContact OE2-NZ 3.43Å
77	F	92.4	Very high	83.7	Confident	31 Å²	31	79.3 Å²	79.3	14%	0.136	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	130	175.8	-178	-95.1	0	0	0	110.7	L53 L57 K59 L62 P79 A92	L53-F77 HydrophobicContact CD1-CE2 4.29Å; L57-F77 WeakPolarHBondContact O-CZ 3.42Å; K59-F77 HydrophobicContact CB-CB 4.01Å; K59-F77 HydrophobicContact CB-CD1 4.23Å; K59-F77 HydrophobicContact CB-CG 4.14Å; K59-F77 HydrophobicContact CG-CB 3.91Å; L62-F77 HydrophobicContact CD2-CD2 3.76Å; L62-F77 HydrophobicContact CD2-CE2 4.15Å; F77-P79 HydrophobicContact CE1-CB 4.05Å; F77-A92 HydrophobicContact CD2-CB 4.22Å
78	F	90.5	Very high	84.2	Confident	78 Å²	78	77.6 Å²	77.6	34%	0.342	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	116.5	171	-67.5	-99.3	0	0	0	108.6	E76 S90 R91 Y93	E76-F78 HydrophobicContact CB-CE2 4.18Å; E76-F78 HydrophobicContact CG-CD2 4.16Å; E76-F78 HydrophobicContact CG-CE2 3.45Å; E76-F78 VanDerWaalsContact CG-CE2 3.45Å; E76-F78 HydrophobicContact CG-CZ 3.88Å; F78-S90 WeakPolarHBondContact O-CA 3.22Å; F78-R91 HydrophobicContact CB-CG 3.77Å; F78-R91 HydrophobicContact CG-CG 4.47Å; F78-R91 PolarHBondContact N-O 3.49Å; F78-R91 PolarHBondContact O-N 3.29Å; F78-R91 VanDerWaalsContact O-O 3.14Å; F78-Y93 AromaticContact CD2-CD2 3.66Å; F78-Y93 HydrophobicContact CD2-CD2 3.66Å; F78-Y93 AromaticContact CD2-CE2 3.68Å; F78-Y93 HydrophobicContact CD2-CE2 3.68Å; F78-Y93 AromaticContact CE2-CD2 3.5Å; F78-Y93 HydrophobicContact CE2-CD2 3.5Å; F78-Y93 VanDerWaalsContact CE2-CD2 3.5Å; F78-Y93 AromaticContact CE2-CE2 3.66Å; F78-Y93 HydrophobicContact CE2-CE2 3.66Å
79	P	90.6	Very high	84.7	Confident	87 Å²	87	75.4 Å²	75.4	57%	0.565	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-65.5	163.9	174.4	29.7	-35.4	0	0	0	111.1	F77 D81	F77-P79 HydrophobicContact CE1-CB 4.05Å; P79-D81 PolarHBondContact O-N 3.01Å
80	A	89	Confident	85.7	Confident	19 Å²	19	73.4 Å²	73.4	16%	0.157	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-57	127.8	176.9	0	0	0	0	0	112.6	P55 Q82 L88 F89 S90	P55-A80 HydrophobicContact CB-CB 3.5Å; A80-Q82 PolarHBondContact O-N 2.86Å; A80-L88 HydrophobicContact CB-CB 4.18Å; A80-F89 WeakPolarHBondContact CA-O 3.46Å; A80-S90 PolarHBondContact N-OG 3.37Å; A80-S90 VanDerWaalsContact N-OG 3.15Å
81	D	86.3	Confident	86.5	Confident	67 Å²	67	75.8 Å²	75.8	36%	0.358	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-79.5	116.2	178.2	-169.5	-31.5	0	0	0	110	P79 S83 L84 L88	P79-D81 PolarHBondContact O-N 3.01Å; D81-S83 VanDerWaalsContact CG-OG 3.23Å; D81-S83 PolarHBondContact O-N 3.38Å; D81-S83 VanDerWaalsContact OD1-CB 3.32Å; D81-S83 WeakPolarHBondContact OD1-CB 3.47Å; D81-S83 PolarHBondContact OD1-N 3.38Å; D81-S83 PolarHBondContact OD1-OG 3.18Å; D81-L84 HydrophobicContact CB-CD1 4Å; D81-L84 HydrophobicContact CB-CG 4.06Å; D81-L84 PolarHBondContact O-N 3.2Å; D81-L84 VanDerWaalsContact O-N 3.1Å; D81-L88 WeakPolarHBondContact O-CD2 3.42Å
82	Q	84.8	Confident	87.3	Confident	171 Å²	171	72.6 Å²	72.6	80%	0.799	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-63.7	-21.1	-177.7	-63.4	-177.3	7.7	0	0	113.1	A80 L84	A80-Q82 PolarHBondContact O-N 2.86Å; Q82-L84 PolarHBondContact O-N 3.12Å
83	S	83.6	Confident	87.7	Confident	94 Å²	94	70.8 Å²	70.8	66%	0.657	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-71	-18.3	176	69.5	0	0	0	0	113.6	D81 Y85	D81-S83 VanDerWaalsContact CG-OG 3.23Å; D81-S83 PolarHBondContact O-N 3.38Å; D81-S83 VanDerWaalsContact OD1-CB 3.32Å; D81-S83 WeakPolarHBondContact OD1-CB 3.47Å; D81-S83 PolarHBondContact OD1-N 3.38Å; D81-S83 PolarHBondContact OD1-OG 3.18Å; S83-Y85 VanDerWaalsContact C-N 3.33Å; S83-Y85 PolarHBondContact O-N 3.17Å
84	L	81.7	Confident	88	Confident	91 Å²	91	65.8 Å²	65.8	48%	0.476	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-92.3	15.4	-177.9	-57.6	-178.9	0	0	0	113.5	D81 Q82 H87	D81-L84 HydrophobicContact CB-CD1 4Å; D81-L84 HydrophobicContact CB-CG 4.06Å; D81-L84 PolarHBondContact O-N 3.2Å; D81-L84 VanDerWaalsContact O-N 3.1Å; Q82-L84 PolarHBondContact O-N 3.12Å; L84-H87 CarbonylContact O-C 3.53Å; L84-H87 WeakPolarHBondContact O-CA 3.12Å; L84-H87 PolarHBondContact O-N 2.53Å
85	Y	79.8	Confident	88.2	Confident	183 Å²	183	64.2 Å²	64.2	72%	0.718	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	132.5	176.5	-173.2	-90	0	0	0	111.5	S83 L88	S83-Y85 VanDerWaalsContact C-N 3.33Å; S83-Y85 PolarHBondContact O-N 3.17Å; Y85-L88 HydrophobicContact CD2-CD1 3.96Å; Y85-L88 HydrophobicContact CD2-CD2 4.42Å; Y85-L88 HydrophobicContact CD2-CG 4.08Å; Y85-L88 HydrophobicContact CE2-CD1 4.49Å
86	P	81.6	Confident	88.2	Confident	89 Å²	89	63 Å²	63	58%	0.578	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	cis	-85.3	-6.4	12	34.7	-37.7	0	0	0	115.7	L88	P86-L88 PolarHBondContact O-N 3.35Å
87	H	81	Confident	88.2	Confident	126 Å²	126	66.5 Å²	66.5	58%	0.583	33%	0.329	S	S	*	.			trans	-83.5	57.9	-173.5	-64.7	-50.2	0	0	0	113.1	L84 F89	L84-H87 CarbonylContact O-C 3.53Å; L84-H87 WeakPolarHBondContact O-CA 3.12Å; L84-H87 PolarHBondContact O-N 2.53Å; H87-F89 HydrophobicContact CB-CD2 3.93Å; H87-F89 HydrophobicContact CB-CE2 3.71Å; H87-F89 AromaticContact ND1-CE2 3.83Å; H87-F89 WeakPolarHBondContact O-CD2 3.33Å; H87-F89 PolarHBondContact O-N 2.84Å
88	L	88	Confident	87.9	Confident	47 Å²	47	66.7 Å²	66.7	25%	0.246	34%	0.335	C	S	.	.			trans	-71.2	86.6	175.5	-58.9	-177.1	0	0	0	110.7	P55 A80 D81 Y85 P86	P55-L88 HydrophobicContact CB-CB 3.98Å; P55-L88 WeakPolarHBondContact CB-O 3.46Å; P55-L88 WeakPolarHBondContact CD-O 3.32Å; P55-L88 HydrophobicContact CG-CB 4.35Å; A80-L88 HydrophobicContact CB-CB 4.18Å; D81-L88 WeakPolarHBondContact O-CD2 3.42Å; Y85-L88 HydrophobicContact CD2-CD1 3.96Å; Y85-L88 HydrophobicContact CD2-CD2 4.42Å; Y85-L88 HydrophobicContact CD2-CG 4.08Å; Y85-L88 HydrophobicContact CE2-CD1 4.49Å; P86-L88 PolarHBondContact O-N 3.35Å
89	F	89.6	Confident	87.8	Confident	62 Å²	62	66.4 Å²	66.4	27%	0.272	34%	0.34	S	S	.	.			trans	-119.2	131.4	176.4	-60.6	-68.5	0	0	0	111.5	R52 A80 H87 Y122	R52-F89 HydrophobicContact CB-CD1 4.14Å; R52-F89 HydrophobicContact CB-CE1 4.38Å; A80-F89 WeakPolarHBondContact CA-O 3.46Å; H87-F89 HydrophobicContact CB-CD2 3.93Å; H87-F89 HydrophobicContact CB-CE2 3.71Å; H87-F89 AromaticContact ND1-CE2 3.83Å; H87-F89 WeakPolarHBondContact O-CD2 3.33Å; H87-F89 PolarHBondContact O-N 2.84Å; F89-Y122 AromaticContact CD1-CD1 3.68Å; F89-Y122 HydrophobicContact CD1-CD1 3.68Å; F89-Y122 AromaticContact CD1-CE1 3.59Å; F89-Y122 HydrophobicContact CD1-CE1 3.59Å; F89-Y122 AromaticContact CE1-CD1 3.61Å; F89-Y122 HydrophobicContact CE1-CD1 3.61Å; F89-Y122 AromaticContact CE1-CE1 3.51Å; F89-Y122 HydrophobicContact CE1-CE1 3.51Å
90	S	92.3	Very high	87.7	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	160.3	167.1	-58.3	0	0	0	0	110.5	L53 P54 F78 A80	L53-S90 PolarHBondContact N-O 2.94Å; L53-S90 PolarHBondContact O-N 3.05Å; P54-S90 VanDerWaalsContact O-CB 3.31Å; P54-S90 WeakPolarHBondContact O-CB 3.35Å; P54-S90 PolarHBondContact O-OG 2.89Å; F78-S90 WeakPolarHBondContact O-CA 3.22Å; A80-S90 PolarHBondContact N-OG 3.37Å; A80-S90 VanDerWaalsContact N-OG 3.15Å
91	R	92.5	Very high	87.6	Confident	77 Å²	77	69.8 Å²	69.8	29%	0.291	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	144.3	179.3	62	-172	175.6	-105.6	-0.7	111.3	I50 F78 Y93	I50-R91 VanDerWaalsContact O-CA 3.26Å; I50-R91 WeakPolarHBondContact O-CA 3.3Å; F78-R91 HydrophobicContact CB-CG 3.77Å; F78-R91 HydrophobicContact CG-CG 4.47Å; F78-R91 PolarHBondContact N-O 3.49Å; F78-R91 PolarHBondContact O-N 3.29Å; F78-R91 VanDerWaalsContact O-O 3.14Å; R91-Y93 HydrophobicContact CG-CE2 4.36Å
92	A	93.4	Very high	87.7	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	141.3	178.4	0	0	0	0	0	111	V49 I50 L53 L62 E76 F77	V49-A92 CarbonylContact C-O 3.59Å; V49-A92 VanDerWaalsContact CA-O 3.32Å; V49-A92 WeakPolarHBondContact CA-O 3.32Å; I50-A92 HydrophobicContact CB-CB 4.49Å; I50-A92 HydrophobicContact CD1-CB 4.33Å; I50-A92 PolarHBondContact N-O 3.1Å; I50-A92 PolarHBondContact O-N 2.79Å; L53-A92 HydrophobicContact CD1-CB 4.26Å; L62-A92 HydrophobicContact CD2-CB 3.39Å; E76-A92 WeakPolarHBondContact O-CA 3.49Å; F77-A92 HydrophobicContact CD2-CB 4.22Å
93	Y	92.8	Very high	87.9	Confident	54 Å²	54	63.8 Å²	63.8	21%	0.212	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	127.3	173.1	-62.1	-91.2	0	0	0	109.6	V48 V49 F75 E76 F78 R91 A129	V48-Y93 WeakPolarHBondContact O-CA 3.42Å; V49-Y93 HydrophobicContact CB-CD1 3.75Å; V49-Y93 HydrophobicContact CB-CE1 3.74Å; V49-Y93 HydrophobicContact CG2-CD1 3.7Å; V49-Y93 HydrophobicContact CG2-CE1 3.42Å; V49-Y93 VanDerWaalsContact CG2-CE1 3.42Å; V49-Y93 HydrophobicContact CG2-CE2 4.37Å; V49-Y93 HydrophobicContact CG2-CG 4.3Å; F75-Y93 WeakPolarHBondContact CA-O 3.11Å; E76-Y93 PolarHBondContact N-O 3.01Å; E76-Y93 PolarHBondContact O-N 3.32Å; F78-Y93 AromaticContact CD2-CD2 3.66Å; F78-Y93 HydrophobicContact CD2-CD2 3.66Å; F78-Y93 AromaticContact CD2-CE2 3.68Å; F78-Y93 HydrophobicContact CD2-CE2 3.68Å; F78-Y93 AromaticContact CE2-CD2 3.5Å; F78-Y93 HydrophobicContact CE2-CD2 3.5Å; F78-Y93 VanDerWaalsContact CE2-CD2 3.5Å; F78-Y93 AromaticContact CE2-CE2 3.66Å; F78-Y93 HydrophobicContact CE2-CE2 3.66Å; R91-Y93 HydrophobicContact CG-CE2 4.36Å; Y93-A129 HydrophobicContact CD1-CB 3.91Å; Y93-A129 HydrophobicContact CE1-CB 4.19Å
94	I	91.4	Very high	88.2	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	137.5	179.7	-42.3	-168.8	0	0	0	108	K47 V48 I50 L66 L69 Y72 Y74 F75 F96 F105	K47-I94 CarbonylContact C-O 3.46Å; K47-I94 VanDerWaalsContact CA-O 3.3Å; K47-I94 WeakPolarHBondContact CA-O 3.38Å; V48-I94 PolarHBondContact N-O 3.38Å; V48-I94 PolarHBondContact O-N 2.97Å; I50-I94 HydrophobicContact CD1-CD1 4Å; L66-I94 HydrophobicContact CD1-CD1 3.68Å; L69-I94 HydrophobicContact CD2-CD1 4.45Å; Y72-I94 HydrophobicContact CG-CG2 4.42Å; Y74-I94 CarbonylContact O-C 3.56Å; Y74-I94 WeakPolarHBondContact O-CA 3.48Å; F75-I94 HydrophobicContact CD2-CB 4.43Å; F75-I94 HydrophobicContact CD2-CD1 3.85Å; F75-I94 HydrophobicContact CD2-CG1 3.68Å; F75-I94 HydrophobicContact CD2-CG2 4.3Å; F75-I94 HydrophobicContact CE2-CD1 3.71Å; F75-I94 HydrophobicContact CE2-CG1 3.89Å; I94-F96 HydrophobicContact CB-CD2 4.48Å; I94-F96 HydrophobicContact CB-CE2 3.84Å; I94-F96 HydrophobicContact CB-CZ 4.11Å; I94-F96 HydrophobicContact CD1-CZ 4.25Å; I94-F96 HydrophobicContact CG2-CD2 4.19Å; I94-F96 HydrophobicContact CG2-CE1 4.05Å; I94-F96 HydrophobicContact CG2-CE2 3.71Å; I94-F96 HydrophobicContact CG2-CZ 3.63Å; I94-F105 HydrophobicContact CD1-CE2 4.23Å; I94-F105 HydrophobicContact CD1-CZ 4.03Å
95	N	91.7	Very high	88.6	Confident	6 Å²	6	59.5 Å²	59.5	3%	0.032	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	111.3	168.9	-168.9	91.1	0	0	0	110.8	T46 K47 Y72 D73 Y74 I134	T46-N95 CarbonylContact O-C 3.44Å; T46-N95 WeakPolarHBondContact O-CA 3.41Å; T46-N95 PolarHBondContact O-OD1 3.26Å; T46-N95 PolarHBondContact OG1-OD1 3.03Å; T46-N95 VanDerWaalsContact OG1-OD1 3.12Å; K47-N95 WeakPolarHBondContact CB-OD1 3.49Å; K47-N95 HydrophobicContact CG-CB 4.49Å; K47-N95 PolarHBondContact N-OD1 2.94Å; Y72-N95 CarbonylContact C-O 3.5Å; Y72-N95 WeakPolarHBondContact CA-O 3.32Å; Y72-N95 VanDerWaalsContact CB-O 3.3Å; Y72-N95 WeakPolarHBondContact CB-O 3.42Å; D73-N95 PolarHBondContact N-O 2.94Å; Y74-N95 PolarHBondContact O-N 3.26Å; N95-I134 HydrophobicContact CB-CD1 3.61Å; N95-I134 HydrophobicContact CB-CG1 4.44Å; N95-I134 VanDerWaalsContact CG-CD1 3.43Å
96	F	89.8	Confident	89.1	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	155.7	178.6	-64.1	-83.5	0	0	0	111.6	T46 V48 L69 P70 I94 D101 I102 F105	T46-F96 WeakPolarHBondContact CB-O 3.17Å; T46-F96 PolarHBondContact O-N 2.93Å; V48-F96 HydrophobicContact CB-CD2 4.35Å; V48-F96 HydrophobicContact CB-CE2 3.98Å; V48-F96 HydrophobicContact CG2-CD2 3.79Å; V48-F96 HydrophobicContact CG2-CE2 3.77Å; L69-F96 HydrophobicContact CD2-CE1 4.44Å; P70-F96 HydrophobicContact CB-CD1 4.2Å; P70-F96 HydrophobicContact CB-CE1 4.32Å; P70-F96 HydrophobicContact CG-CE1 4.26Å; I94-F96 HydrophobicContact CB-CD2 4.48Å; I94-F96 HydrophobicContact CB-CE2 3.84Å; I94-F96 HydrophobicContact CB-CZ 4.11Å; I94-F96 HydrophobicContact CD1-CZ 4.25Å; I94-F96 HydrophobicContact CG2-CD2 4.19Å; I94-F96 HydrophobicContact CG2-CE1 4.05Å; I94-F96 HydrophobicContact CG2-CE2 3.71Å; I94-F96 HydrophobicContact CG2-CZ 3.63Å; F96-D101 HydrophobicContact CB-CB 4.47Å; F96-D101 HydrophobicContact CD1-CB 4.13Å; F96-I102 HydrophobicContact CB-CD1 4.14Å; F96-I102 HydrophobicContact CB-CG1 3.74Å; F96-I102 HydrophobicContact CD2-CD1 4.41Å; F96-I102 HydrophobicContact CD2-CG1 3.65Å; F96-I102 HydrophobicContact CG-CG1 3.88Å; F96-F105 HydrophobicContact CE1-CD2 4.2Å; F96-F105 HydrophobicContact CE1-CG 4.5Å; F96-F105 HydrophobicContact CE2-CD1 4.31Å; F96-F105 HydrophobicContact CE2-CD2 4.42Å; F96-F105 HydrophobicContact CE2-CG 4.14Å; F96-F105 HydrophobicContact CZ-CB 4.14Å; F96-F105 HydrophobicContact CZ-CD1 4.19Å; F96-F105 AromaticContact CZ-CD2 3.53Å; F96-F105 HydrophobicContact CZ-CD2 3.53Å; F96-F105 AromaticContact CZ-CE2 3.98Å; F96-F105 HydrophobicContact CZ-CE2 3.98Å; F96-F105 AromaticContact CZ-CG 3.66Å; F96-F105 HydrophobicContact CZ-CG 3.66Å
97	K	88.6	Confident	89.6	Confident	114 Å²	114	58.8 Å²	58.8	50%	0.496	28%	0.282	S	S	.	.	S	Bend	trans	-86.9	-35.9	175.5	-68.1	171.1	-169	153.3	0	112.9	S71 D73	S71-K97 WeakPolarHBondContact O-CB 3.26Å; S71-K97 WeakPolarHBondContact O-CG 3.36Å; S71-K97 PolarHBondContact O-N 3.27Å; S71-K97 PolarHBondContact OG-NZ 2.91Å; D73-K97 WeakPolarHBondContact OD1-CE 3.45Å; D73-K97 IonicContact OD1-NZ 3.55Å
98	S	87	Confident	89.9	Confident	36 Å²	36	59.3 Å²	59.3	25%	0.252	28%	0.279	S	S	.	.			trans	-101.1	154	174.6	-173.7	0	0	0	0	111.7	E100 D101	S98-E100 PolarHBondContact OG-N 2.85Å; S98-D101 WeakPolarHBondContact CB-OD2 3.47Å
99	T	88.3	Confident	90	Very high	72 Å²	72	58.2 Å²	58.2	44%	0.442	27%	0.273	S	S	.	.	S	Bend	trans	-78.4	-28.2	167.7	43.8	0	0	0	0	113.1	V44 I102 L103	V44-T99 HydrophobicContact CG1-CG2 3.24Å; T99-I102 WeakPolarHBondContact O-CB 3.5Å; T99-I102 PolarHBondContact O-N 2.83Å; T99-L103 PolarHBondContact O-N 2.94Å
100	E	88.4	Confident	90.2	Very high	136 Å²	136	58.1 Å²	58.1	64%	0.636	28%	0.275	S	S	*	.	H	α-helix	trans	-67.2	-43.8	-179	-63.3	168.9	175.8	0	0	109.8	S98 I102 L103 L104	S98-E100 PolarHBondContact OG-N 2.85Å; E100-I102 PolarHBondContact O-N 2.77Å; E100-L103 PolarHBondContact O-N 3.19Å; E100-L103 VanDerWaalsContact O-N 3.12Å; E100-L104 WeakPolarHBondContact O-CD1 3.45Å; E100-L104 PolarHBondContact O-N 3.1Å
101	D	88.1	Confident	90.1	Very high	41 Å²	41	60.1 Å²	60.1	22%	0.219	30%	0.296	C	S	.	.	H	α-helix	trans	-50.7	-37.5	170.8	-68.8	-21.6	0	0	0	112.7	P70 F96 S98 F105	P70-D101 HydrophobicContact CB-CB 3.64Å; P70-D101 WeakPolarHBondContact CB-OD1 3.26Å; P70-D101 WeakPolarHBondContact CB-OD2 3.3Å; P70-D101 HydrophobicContact CG-CB 3.97Å; F96-D101 HydrophobicContact CB-CB 4.47Å; F96-D101 HydrophobicContact CD1-CB 4.13Å; S98-D101 WeakPolarHBondContact CB-OD2 3.47Å; D101-F105 WeakPolarHBondContact O-CB 3.38Å; D101-F105 PolarHBondContact O-N 3.37Å
102	I	88.6	Confident	90.1	Very high	10 Å²	10	61.4 Å²	61.4	5%	0.051	30%	0.301	C	S	.	.	H	α-helix	trans	-71.7	-38.5	-177.8	-62.9	171.3	0	0	0	111.5	F45 V48 F96 T99 E100 F105 R106 F128	F45-I102 WeakPolarHBondContact O-CD1 3.47Å; V48-I102 HydrophobicContact CG2-CB 4.44Å; V48-I102 HydrophobicContact CG2-CD1 4.37Å; V48-I102 HydrophobicContact CG2-CG1 4.1Å; V48-I102 HydrophobicContact CG2-CG2 3.64Å; F96-I102 HydrophobicContact CB-CD1 4.14Å; F96-I102 HydrophobicContact CB-CG1 3.74Å; F96-I102 HydrophobicContact CD2-CD1 4.41Å; F96-I102 HydrophobicContact CD2-CG1 3.65Å; F96-I102 HydrophobicContact CG-CG1 3.88Å; T99-I102 WeakPolarHBondContact O-CB 3.5Å; T99-I102 PolarHBondContact O-N 2.83Å; E100-I102 PolarHBondContact O-N 2.77Å; I102-F105 PolarHBondContact O-N 2.86Å; I102-R106 WeakPolarHBondContact O-CB 3.1Å; I102-R106 PolarHBondContact O-N 2.83Å; I102-F128 HydrophobicContact CG2-CE1 3.85Å; I102-F128 HydrophobicContact CG2-CZ 4.31Å
103	L	88.6	Confident	90	Very high	101 Å²	101	64.4 Å²	64.4	53%	0.529	32%	0.319	S	S	.	.	H	α-helix	trans	-66.7	-50.9	175.3	-61.3	175.1	0	0	0	109.8	T99 E100 F105 R106 D107	T99-L103 PolarHBondContact O-N 2.94Å; E100-L103 PolarHBondContact O-N 3.19Å; E100-L103 VanDerWaalsContact O-N 3.12Å; L103-F105 PolarHBondContact O-N 3.4Å; L103-F105 VanDerWaalsContact O-N 3.15Å; L103-R106 PolarHBondContact O-N 2.83Å; L103-R106 VanDerWaalsContact O-N 3.13Å; L103-D107 VanDerWaalsContact O-CG 3.28Å; L103-D107 PolarHBondContact O-N 2.96Å
104	L	89.5	Confident	89.9	Confident	95 Å²	95	62.1 Å²	62.1	50%	0.497	31%	0.311	S	S	.	.	H	α-helix	trans	-61.8	-22.6	175.3	-88.8	75.8	0	0	0	113.5	E100 R108	E100-L104 WeakPolarHBondContact O-CD1 3.45Å; E100-L104 PolarHBondContact O-N 3.1Å; L104-R108 PolarHBondContact O-NE 2.61Å; L104-R108 PolarHBondContact O-NH2 2.86Å; L104-R108 VanDerWaalsContact O-NH2 3.17Å
105	F	90.1	Very high	89.9	Confident	1 Å²	1	67.6 Å²	67.6	0%	0.004	34%	0.338	C	S	.	.	H	α-helix	trans	-79.5	-48.6	173.1	-175.9	-89.4	0	0	0	111	V48 I50 L66 L69 I94 F96 D101 I102 L103 R108 F109 V126	V48-F105 HydrophobicContact CG1-CD1 4.24Å; V48-F105 HydrophobicContact CG1-CE1 4.21Å; I50-F105 HydrophobicContact CD1-CE1 4.17Å; I50-F105 HydrophobicContact CD1-CZ 3.64Å; I50-F105 HydrophobicContact CG1-CE1 4.06Å; I50-F105 HydrophobicContact CG1-CZ 4.06Å; L66-F105 HydrophobicContact CB-CE2 4.4Å; L66-F105 HydrophobicContact CD1-CE2 3.98Å; L66-F105 HydrophobicContact CD1-CZ 3.98Å; L66-F105 HydrophobicContact CD2-CE2 3.69Å; L66-F105 HydrophobicContact CD2-CZ 3.68Å; L66-F105 HydrophobicContact CG-CE2 4.21Å; L66-F105 HydrophobicContact CG-CZ 4.4Å; L69-F105 HydrophobicContact CD2-CE2 4.15Å; I94-F105 HydrophobicContact CD1-CE2 4.23Å; I94-F105 HydrophobicContact CD1-CZ 4.03Å; F96-F105 HydrophobicContact CE1-CD2 4.2Å; F96-F105 HydrophobicContact CE1-CG 4.5Å; F96-F105 HydrophobicContact CE2-CD1 4.31Å; F96-F105 HydrophobicContact CE2-CD2 4.42Å; F96-F105 HydrophobicContact CE2-CG 4.14Å; F96-F105 HydrophobicContact CZ-CB 4.14Å; F96-F105 HydrophobicContact CZ-CD1 4.19Å; F96-F105 AromaticContact CZ-CD2 3.53Å; F96-F105 HydrophobicContact CZ-CD2 3.53Å; F96-F105 AromaticContact CZ-CE2 3.98Å; F96-F105 HydrophobicContact CZ-CE2 3.98Å; F96-F105 AromaticContact CZ-CG 3.66Å; F96-F105 HydrophobicContact CZ-CG 3.66Å; D101-F105 WeakPolarHBondContact O-CB 3.38Å; D101-F105 PolarHBondContact O-N 3.37Å; I102-F105 PolarHBondContact O-N 2.86Å; L103-F105 PolarHBondContact O-N 3.4Å; L103-F105 VanDerWaalsContact O-N 3.15Å; F105-R108 PolarHBondContact O-N 2.79Å; F105-F109 HydrophobicContact CD1-CD2 4.36Å; F105-F109 AromaticContact CD2-CD2 3.62Å; F105-F109 HydrophobicContact CD2-CD2 3.62Å; F105-F109 AromaticContact CD2-CE2 3.89Å; F105-F109 HydrophobicContact CD2-CE2 3.89Å; F105-F109 HydrophobicContact CE1-CB 4.26Å; F105-F109 HydrophobicContact CE1-CD2 4.19Å; F105-F109 AromaticContact CE2-CD2 3.45Å; F105-F109 HydrophobicContact CE2-CD2 3.45Å; F105-F109 VanDerWaalsContact CE2-CD2 3.45Å; F105-F109 AromaticContact CE2-CE2 3.77Å; F105-F109 HydrophobicContact CE2-CE2 3.77Å; F105-F109 HydrophobicContact CE2-CG 4.34Å; F105-F109 HydrophobicContact CG-CD2 4.06Å; F105-F109 HydrophobicContact CZ-CB 4.28Å; F105-F109 AromaticContact CZ-CD2 3.72Å; F105-F109 HydrophobicContact CZ-CD2 3.72Å; F105-F109 HydrophobicContact CZ-CE2 4.44Å; F105-F109 HydrophobicContact CZ-CG 4.21Å; F105-F109 VanDerWaalsContact O-CD2 3.3Å; F105-F109 WeakPolarHBondContact O-CD2 3.35Å; F105-F109 PolarHBondContact O-N 3.31Å; F105-F109 VanDerWaalsContact O-N 3.09Å; F105-V126 HydrophobicContact CD1-CG1 3.81Å; F105-V126 HydrophobicContact CE1-CG1 3.84Å; F105-V126 HydrophobicContact CE1-CG2 4.11Å
106	R	90.3	Very high	89.8	Confident	130 Å²	130	67.6 Å²	67.6	49%	0.491	34%	0.339	S	S	.	.	H	α-helix	trans	-57.9	-52	177.5	-173.5	-174.1	175.8	-147.3	-6.9	111.3	I102 L103 R108 F109 D110 V126	I102-R106 WeakPolarHBondContact O-CB 3.1Å; I102-R106 PolarHBondContact O-N 2.83Å; L103-R106 PolarHBondContact O-N 2.83Å; L103-R106 VanDerWaalsContact O-N 3.13Å; R106-R108 PolarHBondContact O-N 2.77Å; R106-F109 PolarHBondContact O-N 3.44Å; R106-F109 VanDerWaalsContact O-N 3.14Å; R106-D110 HydrophobicContact CG-CB 3.77Å; R106-D110 IonicContact CZ-OD2 3.35Å; R106-D110 IonicContact NE-OD2 3.13Å; R106-D110 PolarHBondContact NE-OD2 2.8Å; R106-D110 IonicContact NH2-OD2 3.25Å; R106-D110 PolarHBondContact NH2-OD2 3.32Å; R106-D110 WeakPolarHBondContact O-CB 3.45Å; R106-D110 PolarHBondContact O-N 3.44Å; R106-V126 HydrophobicContact CB-CG1 4.25Å; R106-V126 HydrophobicContact CG-CB 4.42Å; R106-V126 HydrophobicContact CG-CG1 4.31Å
107	D	91.4	Very high	89.6	Confident	127 Å²	127	74.3 Å²	74.3	68%	0.679	37%	0.374	S	S	*	.	H	α-helix	trans	-64.3	-11.6	-174	-62.7	-10.6	0	0	0	113.7	L103	L103-D107 VanDerWaalsContact O-CG 3.28Å; L103-D107 PolarHBondContact O-N 2.96Å
108	R	88.6	Confident	89.4	Confident	136 Å²	136	75.9 Å²	75.9	51%	0.513	38%	0.381	S	S	.	.	H	α-helix	trans	-106.9	-25.6	175.8	-73.6	-176.3	-73.5	-161.1	3.7	114.8	L104 F105 R106	L104-R108 PolarHBondContact O-NE 2.61Å; L104-R108 PolarHBondContact O-NH2 2.86Å; L104-R108 VanDerWaalsContact O-NH2 3.17Å; F105-R108 PolarHBondContact O-N 2.79Å; R106-R108 PolarHBondContact O-N 2.77Å
109	F	88.9	Confident	89.3	Confident	25 Å²	25	76.9 Å²	76.9	11%	0.11	40%	0.397	C	S	.	.	H	α-helix	trans	-119.9	-13.7	-172.5	-61.7	-64.9	0	0	0	114.9	H65 L66 F105 R106 G111 Y112 V126	H65-F109 VanDerWaalsContact O-CE1 3.32Å; H65-F109 WeakPolarHBondContact O-CE1 3.41Å; H65-F109 WeakPolarHBondContact O-CZ 3.39Å; L66-F109 HydrophobicContact CB-CZ 4.45Å; L66-F109 HydrophobicContact CD2-CD1 3.64Å; L66-F109 HydrophobicContact CD2-CD2 3.78Å; L66-F109 HydrophobicContact CD2-CE1 3.64Å; L66-F109 HydrophobicContact CD2-CE2 3.78Å; L66-F109 HydrophobicContact CD2-CG 3.72Å; L66-F109 HydrophobicContact CD2-CZ 3.72Å; F105-F109 HydrophobicContact CD1-CD2 4.36Å; F105-F109 AromaticContact CD2-CD2 3.62Å; F105-F109 HydrophobicContact CD2-CD2 3.62Å; F105-F109 AromaticContact CD2-CE2 3.89Å; F105-F109 HydrophobicContact CD2-CE2 3.89Å; F105-F109 HydrophobicContact CE1-CB 4.26Å; F105-F109 HydrophobicContact CE1-CD2 4.19Å; F105-F109 AromaticContact CE2-CD2 3.45Å; F105-F109 HydrophobicContact CE2-CD2 3.45Å; F105-F109 VanDerWaalsContact CE2-CD2 3.45Å; F105-F109 AromaticContact CE2-CE2 3.77Å; F105-F109 HydrophobicContact CE2-CE2 3.77Å; F105-F109 HydrophobicContact CE2-CG 4.34Å; F105-F109 HydrophobicContact CG-CD2 4.06Å; F105-F109 HydrophobicContact CZ-CB 4.28Å; F105-F109 AromaticContact CZ-CD2 3.72Å; F105-F109 HydrophobicContact CZ-CD2 3.72Å; F105-F109 HydrophobicContact CZ-CE2 4.44Å; F105-F109 HydrophobicContact CZ-CG 4.21Å; F105-F109 VanDerWaalsContact O-CD2 3.3Å; F105-F109 WeakPolarHBondContact O-CD2 3.35Å; F105-F109 PolarHBondContact O-N 3.31Å; F105-F109 VanDerWaalsContact O-N 3.09Å; R106-F109 PolarHBondContact O-N 3.44Å; R106-F109 VanDerWaalsContact O-N 3.14Å; F109-G111 PolarHBondContact O-N 3.15Å; F109-Y112 PolarHBondContact O-N 2.91Å; F109-V126 HydrophobicContact CB-CG2 3.96Å
110	D	93.1	Very high	89.3	Confident	59 Å²	59	78.1 Å²	78.1	32%	0.316	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	118.4	171.6	-153.9	14.9	0	0	0	108.9	R106 V126	R106-D110 HydrophobicContact CG-CB 3.77Å; R106-D110 IonicContact CZ-OD2 3.35Å; R106-D110 IonicContact NE-OD2 3.13Å; R106-D110 PolarHBondContact NE-OD2 2.8Å; R106-D110 IonicContact NH2-OD2 3.25Å; R106-D110 PolarHBondContact NH2-OD2 3.32Å; R106-D110 WeakPolarHBondContact O-CB 3.45Å; R106-D110 PolarHBondContact O-N 3.44Å; D110-V126 HydrophobicContact CB-CB 3.96Å; D110-V126 HydrophobicContact CB-CG2 4.25Å; D110-V126 PolarHBondContact OD1-N 3.44Å
111	G	91	Very high	89.6	Confident	43 Å²	43	78.5 Å²	78.5	44%	0.443	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	-2.2	-173.1	0	0	0	0	0	116	F109 V113 A124	F109-G111 PolarHBondContact O-N 3.15Å; G111-V113 PolarHBondContact O-N 2.81Å; G111-A124 VanDerWaalsContact CA-O 3.28Å; G111-A124 WeakPolarHBondContact CA-O 3.46Å; G111-A124 PolarHBondContact N-O 2.95Å
112	Y	91.7	Very high	89.7	Confident	104 Å²	104	77.7 Å²	77.7	41%	0.408	39%	0.394	S	S	.	.			trans	-62.1	126.4	178.6	-176.3	-84.3	0	0	0	111.3	F109 F114 A124	F109-Y112 PolarHBondContact O-N 2.91Å; Y112-F114 HydrophobicContact CD1-CD1 4.23Å; Y112-F114 AromaticContact CD1-CD2 3.66Å; Y112-F114 HydrophobicContact CD1-CD2 3.66Å; Y112-F114 HydrophobicContact CD1-CE1 4.12Å; Y112-F114 AromaticContact CD1-CE2 3.53Å; Y112-F114 HydrophobicContact CD1-CE2 3.53Å; Y112-F114 HydrophobicContact CD1-CG 4.01Å; Y112-F114 AromaticContact CD1-CZ 3.78Å; Y112-F114 HydrophobicContact CD1-CZ 3.78Å; Y112-F114 HydrophobicContact CE1-CD1 4.02Å; Y112-F114 HydrophobicContact CE1-CD2 4.25Å; Y112-F114 HydrophobicContact CE1-CE1 4Å; Y112-F114 HydrophobicContact CE1-CE2 4.23Å; Y112-F114 HydrophobicContact CE1-CG 4.14Å; Y112-F114 HydrophobicContact CE1-CZ 4.11Å; Y112-F114 HydrophobicContact CG-CE2 4.4Å; Y112-F114 PolarHBondContact O-N 2.88Å; Y112-A124 WeakPolarHBondContact O-CB 3.3Å; Y112-A124 PolarHBondContact O-N 3.03Å
113	V	91.9	Very high	90	Very high	62 Å²	62	79.1 Å²	79.1	38%	0.376	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	101.6	-177.7	-174	0	0	0	0	110.2	G111 E121 P123	G111-V113 PolarHBondContact O-N 2.81Å; V113-E121 HydrophobicContact CG1-CB 3.7Å; V113-E121 HydrophobicContact CG1-CG 3.88Å; V113-P123 HydrophobicContact CG2-CB 4.24Å
114	F	91	Very high	90.2	Very high	7 Å²	7	74.3 Å²	74.3	3%	0.031	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	148	166.5	-68.1	-90.8	0	0	0	110.1	L53 P54 L57 L62 H65 Y112 Y122 A124	L53-F114 HydrophobicContact CD2-CD2 3.61Å; L53-F114 HydrophobicContact CD2-CE1 4.38Å; L53-F114 HydrophobicContact CD2-CE2 3.37Å; L53-F114 HydrophobicContact CD2-CG 4.22Å; L53-F114 HydrophobicContact CD2-CZ 3.8Å; P54-F114 HydrophobicContact CG-CB 3.51Å; P54-F114 HydrophobicContact CG-CG 4.46Å; L57-F114 HydrophobicContact CD2-CD1 4.23Å; L57-F114 HydrophobicContact CD2-CE1 4.3Å; L62-F114 HydrophobicContact CD1-CE1 4.41Å; L62-F114 HydrophobicContact CD1-CZ 4.17Å; H65-F114 HydrophobicContact CB-CE1 3.94Å; H65-F114 AromaticContact CD2-CE1 3.76Å; H65-F114 AromaticContact CG-CE1 3.93Å; Y112-F114 HydrophobicContact CD1-CD1 4.23Å; Y112-F114 AromaticContact CD1-CD2 3.66Å; Y112-F114 HydrophobicContact CD1-CD2 3.66Å; Y112-F114 HydrophobicContact CD1-CE1 4.12Å; Y112-F114 AromaticContact CD1-CE2 3.53Å; Y112-F114 HydrophobicContact CD1-CE2 3.53Å; Y112-F114 HydrophobicContact CD1-CG 4.01Å; Y112-F114 AromaticContact CD1-CZ 3.78Å; Y112-F114 HydrophobicContact CD1-CZ 3.78Å; Y112-F114 HydrophobicContact CE1-CD1 4.02Å; Y112-F114 HydrophobicContact CE1-CD2 4.25Å; Y112-F114 HydrophobicContact CE1-CE1 4Å; Y112-F114 HydrophobicContact CE1-CE2 4.23Å; Y112-F114 HydrophobicContact CE1-CG 4.14Å; Y112-F114 HydrophobicContact CE1-CZ 4.11Å; Y112-F114 HydrophobicContact CG-CE2 4.4Å; Y112-F114 PolarHBondContact O-N 2.88Å; F114-Y122 PolarHBondContact N-O 2.88Å; F114-Y122 WeakPolarHBondContact O-CB 3.47Å; F114-Y122 PolarHBondContact O-N 3.34Å; F114-A124 HydrophobicContact CD2-CB 3.85Å; F114-A124 HydrophobicContact CE2-CB 3.68Å
115	I	90.3	Very high	90.4	Very high	114 Å²	114	71.6 Å²	71.6	59%	0.585	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.9	125	-179.4	-55.8	178.3	0	0	0	108.9	Q120	I115-Q120 WeakPolarHBondContact CA-O 3.49Å
116	D	89.6	Confident	90.6	Very high	7 Å²	7	72 Å²	72	4%	0.037	37%	0.368	C	S	.	.			trans	-67	155.3	171.4	-175.1	4.7	0	0	0	109.8	P54 S56 K118 G119 Q120 Y122	P54-D116 HydrophobicContact CB-CB 4.4Å; S56-D116 WeakPolarHBondContact CB-OD1 3.46Å; S56-D116 PolarHBondContact OG-OD1 3.41Å; D116-K118 HydrophobicContact CB-CB 4.45Å; D116-K118 PolarHBondContact O-N 3.35Å; D116-K118 WeakPolarHBondContact OD2-CD 2.78Å; D116-K118 WeakPolarHBondContact OD2-CG 3.47Å; D116-K118 IonicContact OD2-NZ 3.56Å; D116-K118 PolarHBondContact OD2-NZ 3.49Å; D116-G119 PolarHBondContact O-N 3.08Å; D116-Q120 HydrophobicContact CB-CB 4.18Å; D116-Q120 PolarHBondContact N-O 3.19Å; D116-Y122 HydrophobicContact CB-CD2 4.41Å; D116-Y122 HydrophobicContact CB-CE2 3.97Å
117	N	86.1	Confident	90.7	Very high	140 Å²	140	69.3 Å²	69.3	75%	0.749	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	-14.5	165.8	-60.4	-51.5	0	0	0	113.9
118	K	85.1	Confident	90.8	Very high	148 Å²	148	68.5 Å²	68.5	64%	0.643	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	3.7	174.8	-58.1	179.1	-164.1	132.9	0	114.5	D116 Q120	D116-K118 HydrophobicContact CB-CB 4.45Å; D116-K118 PolarHBondContact O-N 3.35Å; D116-K118 WeakPolarHBondContact OD2-CD 2.78Å; D116-K118 WeakPolarHBondContact OD2-CG 3.47Å; D116-K118 IonicContact OD2-NZ 3.56Å; D116-K118 PolarHBondContact OD2-NZ 3.49Å; K118-Q120 VanDerWaalsContact C-N 3.28Å; K118-Q120 HydrophobicContact CB-CG 4.37Å; K118-Q120 PolarHBondContact O-N 3.11Å
119	G	85.1	Confident	91	Very high	56 Å²	56	62.2 Å²	62.2	58%	0.577	33%	0.329	S	S	*	.	S	Bend	trans	69.9	20.8	-173.7	0	0	0	0	0	114.2	D116	D116-G119 PolarHBondContact O-N 3.08Å
120	Q	88.8	Confident	91	Very high	98 Å²	98	66.8 Å²	66.8	46%	0.458	36%	0.361	S	S	.	.			trans	-88.5	130.9	176.1	-70.6	-174.9	-14.4	0	0	110.2	I115 D116 K118 Y122	I115-Q120 WeakPolarHBondContact CA-O 3.49Å; D116-Q120 HydrophobicContact CB-CB 4.18Å; D116-Q120 PolarHBondContact N-O 3.19Å; K118-Q120 VanDerWaalsContact C-N 3.28Å; K118-Q120 HydrophobicContact CB-CG 4.37Å; K118-Q120 PolarHBondContact O-N 3.11Å; Q120-Y122 HydrophobicContact CB-CD2 4.35Å; Q120-Y122 HydrophobicContact CB-CE2 3.68Å; Q120-Y122 VanDerWaalsContact O-CD2 3.27Å; Q120-Y122 WeakPolarHBondContact O-CD2 3.5Å; Q120-Y122 PolarHBondContact OE1-OH 3.04Å
121	E	93	Very high	90.8	Very high	144 Å²	144	70.2 Å²	70.2	67%	0.673	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	131.3	-178.1	-71.6	176.2	-159.6	0	0	112.3	V113	V113-E121 HydrophobicContact CG1-CB 3.7Å; V113-E121 HydrophobicContact CG1-CG 3.88Å
122	Y	91.3	Very high	90.8	Very high	24 Å²	24	70.3 Å²	70.3	9%	0.094	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	86.2	-175.3	-75.5	-88.9	0	0	0	110	R52 P54 P55 F89 F114 D116 Q120 A124	R52-Y122 WeakPolarHBondContact O-CB 3.47Å; P54-Y122 HydrophobicContact CB-CD2 3.88Å; P54-Y122 HydrophobicContact CB-CE2 4.16Å; P54-Y122 HydrophobicContact CB-CG 4.22Å; P54-Y122 HydrophobicContact CG-CD2 3.83Å; P54-Y122 HydrophobicContact CG-CG 3.96Å; P55-Y122 VanDerWaalsContact CD-CZ 3.45Å; P55-Y122 VanDerWaalsContact CD-OH 3.31Å; P55-Y122 WeakPolarHBondContact CD-OH 3.35Å; F89-Y122 AromaticContact CD1-CD1 3.68Å; F89-Y122 HydrophobicContact CD1-CD1 3.68Å; F89-Y122 AromaticContact CD1-CE1 3.59Å; F89-Y122 HydrophobicContact CD1-CE1 3.59Å; F89-Y122 AromaticContact CE1-CD1 3.61Å; F89-Y122 HydrophobicContact CE1-CD1 3.61Å; F89-Y122 AromaticContact CE1-CE1 3.51Å; F89-Y122 HydrophobicContact CE1-CE1 3.51Å; F114-Y122 PolarHBondContact N-O 2.88Å; F114-Y122 WeakPolarHBondContact O-CB 3.47Å; F114-Y122 PolarHBondContact O-N 3.34Å; D116-Y122 HydrophobicContact CB-CD2 4.41Å; D116-Y122 HydrophobicContact CB-CE2 3.97Å; Q120-Y122 HydrophobicContact CB-CD2 4.35Å; Q120-Y122 HydrophobicContact CB-CE2 3.68Å; Q120-Y122 VanDerWaalsContact O-CD2 3.27Å; Q120-Y122 WeakPolarHBondContact O-CD2 3.5Å; Q120-Y122 PolarHBondContact OE1-OH 3.04Å; Y122-A124 PolarHBondContact O-N 3.14Å; Y122-A124 VanDerWaalsContact O-N 3.1Å
123	P	93.6	Very high	90.6	Very high	41 Å²	41	72.8 Å²	72.8	27%	0.266	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	110.9	170.6	24.1	-31.1	0	0	0	109.7	R52 V113	R52-P123 PolarHBondContact NH1-O 2.85Å; V113-P123 HydrophobicContact CG2-CB 4.24Å
124	A	93.8	Very high	90	Very high	0 Å²	0	72.3 Å²	72.3	0%	0	37%	0.37	C	S	.	.			trans	-66.2	156.8	176.2	0	0	0	0	0	111.4	I50 R51 L53 G111 Y112 F114 Y122	I50-A124 HydrophobicContact CG2-CB 4.16Å; R51-A124 WeakPolarHBondContact O-CA 3.4Å; L53-A124 HydrophobicContact CD2-CB 4.3Å; G111-A124 VanDerWaalsContact CA-O 3.28Å; G111-A124 WeakPolarHBondContact CA-O 3.46Å; G111-A124 PolarHBondContact N-O 2.95Å; Y112-A124 WeakPolarHBondContact O-CB 3.3Å; Y112-A124 PolarHBondContact O-N 3.03Å; F114-A124 HydrophobicContact CD2-CB 3.85Å; F114-A124 HydrophobicContact CE2-CB 3.68Å; Y122-A124 PolarHBondContact O-N 3.14Å; Y122-A124 VanDerWaalsContact O-N 3.1Å
125	V	93.9	Very high	89	Confident	37 Å²	37	76 Å²	76	22%	0.224	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	129.5	176.1	169.8	0	0	0	0	108	R51 E127	R51-V125 HydrophobicContact CB-CB 4.48Å; R51-V125 PolarHBondContact N-O 3.08Å; R51-V125 PolarHBondContact O-N 3.39Å; R51-V125 VanDerWaalsContact O-N 3.08Å; V125-E127 HydrophobicContact CG1-CG 3.89Å
126	V	93.8	Very high	88	Confident	10 Å²	10	79.4 Å²	79.4	6%	0.061	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	102.9	-175.2	178.3	0	0	0	0	109.5	V48 I50 F105 R106 F109 D110	V48-V126 HydrophobicContact CG1-CG1 3.5Å; I50-V126 HydrophobicContact CG2-CG2 4.39Å; F105-V126 HydrophobicContact CD1-CG1 3.81Å; F105-V126 HydrophobicContact CE1-CG1 3.84Å; F105-V126 HydrophobicContact CE1-CG2 4.11Å; R106-V126 HydrophobicContact CB-CG1 4.25Å; R106-V126 HydrophobicContact CG-CB 4.42Å; R106-V126 HydrophobicContact CG-CG1 4.31Å; F109-V126 HydrophobicContact CB-CG2 3.96Å; D110-V126 HydrophobicContact CB-CB 3.96Å; D110-V126 HydrophobicContact CB-CG2 4.25Å; D110-V126 PolarHBondContact OD1-N 3.44Å
127	E	93	Very high	86.8	Confident	74 Å²	74	85.4 Å²	85.4	35%	0.346	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	160.6	-178	-74.5	165.4	-179.4	0	0	110.9	V48 V49 R51 V125	V48-E127 CarbonylContact C-O 3.57Å; V48-E127 WeakPolarHBondContact CA-O 3.18Å; V49-E127 HydrophobicContact CG1-CB 4Å; V49-E127 PolarHBondContact N-O 3.02Å; V49-E127 PolarHBondContact O-N 3.44Å; R51-E127 WeakPolarHBondContact CD-OE2 3.44Å; R51-E127 IonicContact CZ-OE2 3.05Å; R51-E127 IonicContact NE-OE2 2.94Å; R51-E127 VanDerWaalsContact NH1-CD 3.28Å; R51-E127 IonicContact NH1-OE1 2.65Å; R51-E127 PolarHBondContact NH1-OE1 2.8Å; R51-E127 IonicContact NH1-OE2 3.55Å; R51-E127 PolarHBondContact NH1-OE2 2.86Å; V125-E127 HydrophobicContact CG1-CG 3.89Å
128	F	92.9	Very high	85.3	Confident	109 Å²	109	87.9 Å²	87.9	48%	0.478	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	138.4	160.7	-68.1	-66.3	0	0	0	109.9	F45 I102 P130	F45-F128 HydrophobicContact CB-CB 4.17Å; F45-F128 HydrophobicContact CB-CD1 3.32Å; F45-F128 HydrophobicContact CB-CE1 3.73Å; F45-F128 HydrophobicContact CB-CG 3.76Å; F45-F128 HydrophobicContact CB-CZ 4.48Å; F45-F128 HydrophobicContact CG-CD1 4.37Å; F45-F128 HydrophobicContact CG-CG 4.37Å; F45-F128 VanDerWaalsContact O-CD1 3.26Å; F45-F128 WeakPolarHBondContact O-CD1 3.26Å; F45-F128 WeakPolarHBondContact O-CE1 3.39Å; I102-F128 HydrophobicContact CG2-CE1 3.85Å; I102-F128 HydrophobicContact CG2-CZ 4.31Å; F128-P130 VanDerWaalsContact O-CD 3.29Å; F128-P130 WeakPolarHBondContact O-CD 3.22Å
129	A	92.1	Very high	84	Confident	4 Å²	4	87.8 Å²	87.8	3%	0.033	44%	0.443	C	S	.	.			trans	-67.4	120.6	-178.2	0	0	0	0	0	110.2	K47 V49 Y93 F131 Q132	K47-A129 HydrophobicContact CB-CB 4.12Å; K47-A129 HydrophobicContact CD-CB 3.87Å; K47-A129 HydrophobicContact CG-CB 3.73Å; K47-A129 WeakPolarHBondContact O-CB 3.5Å; K47-A129 PolarHBondContact O-N 3.19Å; V49-A129 HydrophobicContact CB-CB 4.22Å; V49-A129 HydrophobicContact CG1-CB 4.46Å; Y93-A129 HydrophobicContact CD1-CB 3.91Å; Y93-A129 HydrophobicContact CE1-CB 4.19Å; A129-F131 CarbonylContact O-C 3.32Å; A129-F131 PolarHBondContact O-N 3.43Å; A129-Q132 PolarHBondContact O-N 3.26Å
130	P	90.9	Very high	83.1	Confident	121 Å²	121	94.4 Å²	94.4	79%	0.786	46%	0.456	S	S	*	.	S	Bend	trans	-57.9	-16.1	-176.7	-28	35.8	0	0	0	115.1	F128	F128-P130 VanDerWaalsContact O-CD 3.29Å; F128-P130 WeakPolarHBondContact O-CD 3.22Å
131	F	88.5	Confident	82.1	Confident	132 Å²	132	99.3 Å²	99.3	58%	0.579	48%	0.476	S	S	*	.	S	Bend	trans	-119.8	91.1	167.4	-171.5	-115.5	0	0	0	109.7	K47 A129 K133	K47-F131 WeakPolarHBondContact CD-O 3.49Å; K47-F131 PolarHBondContact NZ-O 2.76Å; A129-F131 CarbonylContact O-C 3.32Å; A129-F131 PolarHBondContact O-N 3.43Å; F131-K133 HydrophobicContact CD1-CB 4.23Å; F131-K133 WeakPolarHBondContact CD1-O 3.2Å; F131-K133 HydrophobicContact CE1-CB 3.7Å; F131-K133 HydrophobicContact CE2-CB 4.13Å; F131-K133 HydrophobicContact CE2-CD 4.11Å; F131-K133 HydrophobicContact CE2-CG 4.43Å; F131-K133 HydrophobicContact CZ-CB 3.66Å; F131-K133 HydrophobicContact CZ-CD 4.03Å; F131-K133 HydrophobicContact CZ-CG 4.32Å; F131-K133 PolarHBondContact O-N 3.41Å
132	Q	90.3	Very high	80.8	Confident	44 Å²	44	100.9 Å²	100.9	21%	0.206	48%	0.48	C	S	.	.			trans	-60.8	-25.9	-179.1	177.8	53.9	42.3	0	0	113.4	F45 T46 K47 A129 I134	F45-Q132 VanDerWaalsContact CA-OE1 3.25Å; F45-Q132 HydrophobicContact CD1-CB 4.15Å; F45-Q132 HydrophobicContact CD1-CG 4.11Å; T46-Q132 PolarHBondContact OG1-NE2 3.12Å; K47-Q132 WeakPolarHBondContact CD-O 3.31Å; A129-Q132 PolarHBondContact O-N 3.26Å; Q132-I134 PolarHBondContact O-N 2.92Å
133	K	86.7	Confident	79.7	Confident	156 Å²	156	104.6 Å²	104.6	68%	0.678	50%	0.502	S	S	*	.			trans	-64	135.3	178.2	-67.8	177.1	-177.5	173.4	0	110.9	K47 F131	K47-K133 PolarHBondContact NZ-O 2.94Å; F131-K133 HydrophobicContact CD1-CB 4.23Å; F131-K133 WeakPolarHBondContact CD1-O 3.2Å; F131-K133 HydrophobicContact CE1-CB 3.7Å; F131-K133 HydrophobicContact CE2-CB 4.13Å; F131-K133 HydrophobicContact CE2-CD 4.11Å; F131-K133 HydrophobicContact CE2-CG 4.43Å; F131-K133 HydrophobicContact CZ-CB 3.66Å; F131-K133 HydrophobicContact CZ-CD 4.03Å; F131-K133 HydrophobicContact CZ-CG 4.32Å; F131-K133 PolarHBondContact O-N 3.41Å
134	I	80.7	Confident	78.7	Confident	52 Å²	52	107.3 Å²	107.3	27%	0.267	53%	0.528	S	S	.	.			trans	-97.3	118.3	170.4	-51.2	169.1	0	0	0	106.9	K47 Y74 N95 Q132 K136	K47-I134 HydrophobicContact CD-CG1 4.31Å; Y74-I134 HydrophobicContact CD1-CG2 3.95Å; Y74-I134 HydrophobicContact CD2-CG2 3.79Å; Y74-I134 HydrophobicContact CE1-CG2 4.27Å; Y74-I134 HydrophobicContact CE2-CG2 4.16Å; Y74-I134 HydrophobicContact CG-CG2 3.68Å; N95-I134 HydrophobicContact CB-CD1 3.61Å; N95-I134 HydrophobicContact CB-CG1 4.44Å; N95-I134 VanDerWaalsContact CG-CD1 3.43Å; Q132-I134 PolarHBondContact O-N 2.92Å; I134-K136 PolarHBondContact O-N 2.81Å
135	S	69.9	Low	77.7	Confident	85 Å²	85	115 Å²	115	59%	0.594	56%	0.561	S	S	*	*			trans	-66	92.5	158.6	42.1	0	0	0	0	107	K137	S135-K137 VanDerWaalsContact C-N 3.31Å; S135-K137 PolarHBondContact O-N 3.04Å
136	K	69.4	Low	76.6	Confident	186 Å²	186	118.8 Å²	118.8	81%	0.809	58%	0.584	S	S	*	*			trans	-52	104.7	165.7	-69.2	-171.2	179.3	-172.8	0	105.7	I134 K138	I134-K136 PolarHBondContact O-N 2.81Å; K136-K138 PolarHBondContact O-N 2.85Å
137	K	63.2	Low	75.4	Confident	132 Å²	132	120.8 Å²	120.8	57%	0.574	61%	0.607	S	S	*	*			trans	-59.6	92.8	171.9	-79.3	177.1	173.4	170.6	0	104.6	E76 S135 L139	E76-K137 IonicContact OE1-NZ 3.39Å; E76-K137 PolarHBondContact OE1-NZ 2.66Å; E76-K137 VanDerWaalsContact OE2-CE 3.22Å; E76-K137 WeakPolarHBondContact OE2-CE 3.49Å; E76-K137 IonicContact OE2-NZ 2.66Å; E76-K137 PolarHBondContact OE2-NZ 3.43Å; S135-K137 VanDerWaalsContact C-N 3.31Å; S135-K137 PolarHBondContact O-N 3.04Å; K137-L139 PolarHBondContact O-N 2.63Å
138	K	55.1	Low	74.8	Confident	193 Å²	193	119.4 Å²	119.4	84%	0.839	61%	0.605	S	S	*	*			trans	-51.7	113.9	168.3	-67.4	-175.5	-178.8	-178.4	0	103.1	K136 K140	K136-K138 PolarHBondContact O-N 2.85Å; K138-K140 VanDerWaalsContact C-N 3.28Å; K138-K140 PolarHBondContact O-N 3.41Å
139	L	59	Low	74.1	Confident	145 Å²	145	119.1 Å²	119.1	76%	0.759	61%	0.607	S	S	*	*			trans	-54	109.9	166.2	-77.6	83.8	0	0	0	103.2	K137 K141	K137-L139 PolarHBondContact O-N 2.63Å; L139-K141 PolarHBondContact O-N 2.92Å
140	K	65.6	Low	73.5	Confident	196 Å²	196	125.7 Å²	125.7	85%	0.852	64%	0.637	S	S	*	*			trans	-51.4	114.4	171.4	-70.9	-176.4	177.9	-177.7	0	102.9	K138 K142	K138-K140 VanDerWaalsContact C-N 3.28Å; K138-K140 PolarHBondContact O-N 3.41Å; K140-K142 PolarHBondContact O-N 3.39Å
141	K	68.3	Low	72.9	Confident	200 Å²	200	126.4 Å²	126.4	87%	0.87	63%	0.63	S	S	*	*			trans	-42.9	113.9	-171.3	-71.9	-176.3	176.4	-175.2	0	105.6	L139 D143	L139-K141 PolarHBondContact O-N 2.92Å; K141-D143 PolarHBondContact O-N 2.66Å
142	K	64.9	Low	72.8	Confident	178 Å²	178	123.5 Å²	123.5	77%	0.774	62%	0.621	S	S	*	*			trans	-53.1	115.1	-174.4	-73.3	-173.1	177.8	-175.8	0	104.7	K140 A144	K140-K142 PolarHBondContact O-N 3.39Å; K142-A144 PolarHBondContact O-N 3Å
143	D	68.1	Low	72.5	Confident	101 Å²	101	125.2 Å²	125.2	54%	0.54	64%	0.636	S	S	.	*			trans	-57.7	132.3	-172.1	177.3	-8.8	0	0	0	106.4	K141 K145 V146	K141-D143 PolarHBondContact O-N 2.66Å; D143-K145 PolarHBondContact O-N 2.88Å; D143-K145 PolarHBondContact OD1-N 2.69Å; D143-K145 VanDerWaalsContact OD1-N 3.17Å; D143-V146 HydrophobicContact CB-CG2 3.98Å; D143-V146 WeakPolarHBondContact O-CB 3.35Å; D143-V146 PolarHBondContact O-N 2.62Å
144	A	73.6	Confident	72.4	Confident	98 Å²	98	123.2 Å²	123.2	81%	0.81	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	-12.5	-174.2	0	0	0	0	0	112.4	K142	K142-A144 PolarHBondContact O-N 3Å
145	K	71.3	Confident	72.6	Confident	161 Å²	161	124.6 Å²	124.6	70%	0.7	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-4.4	173.6	-57.4	-173	176.4	-169.1	0	114.8	D143 G147 S148	D143-K145 PolarHBondContact O-N 2.88Å; D143-K145 PolarHBondContact OD1-N 2.69Å; D143-K145 VanDerWaalsContact OD1-N 3.17Å; K145-G147 PolarHBondContact O-N 3.05Å; K145-G147 VanDerWaalsContact O-N 3.13Å; K145-S148 PolarHBondContact O-N 2.65Å; K145-S148 VanDerWaalsContact O-N 3.15Å
146	V	71.3	Confident	73.3	Confident	118 Å²	118	125.7 Å²	125.7	72%	0.715	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	103.8	176.8	172.2	0	0	0	0	109.1	D143	D143-V146 HydrophobicContact CB-CG2 3.98Å; D143-V146 WeakPolarHBondContact O-CB 3.35Å; D143-V146 PolarHBondContact O-N 2.62Å
147	G	69.8	Low	74.1	Confident	52 Å²	52	123.3 Å²	123.3	54%	0.536	61%	0.611	S	S	.	*	T	Hydrogen-bonded Turn	trans	124.3	-29.6	-172.8	0	0	0	0	0	112.2	K145 I149	K145-G147 PolarHBondContact O-N 3.05Å; K145-G147 VanDerWaalsContact O-N 3.13Å; G147-I149 PolarHBondContact O-N 2.88Å
148	S	79.6	Confident	75.1	Confident	44 Å²	44	122.8 Å²	122.8	31%	0.308	61%	0.609	S	S	.	*	G	3₁₀ helix	trans	-69	0.8	-177.8	-53	0	0	0	0	115.1	K145 E150 E151 D152	K145-S148 PolarHBondContact O-N 2.65Å; K145-S148 VanDerWaalsContact O-N 3.15Å; S148-E150 PolarHBondContact O-N 3.23Å; S148-E151 PolarHBondContact O-N 3.04Å; S148-E151 VanDerWaalsContact O-N 3.09Å; S148-D152 PolarHBondContact O-N 2.83Å
149	I	78.3	Confident	76.5	Confident	103 Å²	103	117.5 Å²	117.5	53%	0.528	59%	0.59	S	S	.	*	G	3₁₀ helix	trans	-62.6	-33.2	175	-168.7	169.2	0	0	0	111.6	G147 E151 D152 Y155	G147-I149 PolarHBondContact O-N 2.88Å; I149-E151 PolarHBondContact O-N 2.91Å; I149-D152 WeakPolarHBondContact O-CB 3.42Å; I149-D152 PolarHBondContact O-N 3.42Å; I149-Y155 HydrophobicContact CG1-CD2 4.21Å; I149-Y155 HydrophobicContact CG1-CG 4.21Å; I149-Y155 WeakPolarHBondContact O-CB 3.45Å; I149-Y155 WeakPolarHBondContact O-CD1 3.36Å; I149-Y155 VanDerWaalsContact O-CG 3.31Å
150	E	78.5	Confident	77.6	Confident	142 Å²	142	116.8 Å²	116.8	66%	0.664	58%	0.583	S	S	*	*	G	3₁₀ helix	trans	-70.2	-22.4	175.5	-65.9	178.4	-168.7	0	0	112.6	S148 Y155 K156	S148-E150 PolarHBondContact O-N 3.23Å; E150-Y155 HydrophobicContact CG-CE1 4.17Å; E150-K156 WeakPolarHBondContact O-CE 3.22Å
151	E	78.9	Confident	78.2	Confident	136 Å²	136	112.1 Å²	112.1	64%	0.636	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-19.2	175.4	-65	-170.3	114.4	0	0	113.4	S148 I149 K156	S148-E151 PolarHBondContact O-N 3.04Å; S148-E151 VanDerWaalsContact O-N 3.09Å; I149-E151 PolarHBondContact O-N 2.91Å; E151-K156 WeakPolarHBondContact O-CE 2.85Å; E151-K156 PolarHBondContact O-NZ 3.09Å
152	D	86.8	Confident	78.7	Confident	71 Å²	71	109.4 Å²	109.4	38%	0.38	55%	0.552	S	S	.	*			trans	-61.5	126.2	-173.9	-167.2	-37.9	0	0	0	111.5	S148 I149 E154 Y155 K156	S148-D152 PolarHBondContact O-N 2.83Å; I149-D152 WeakPolarHBondContact O-CB 3.42Å; I149-D152 PolarHBondContact O-N 3.42Å; D152-E154 PolarHBondContact O-N 2.71Å; D152-E154 WeakPolarHBondContact OD1-CB 3.42Å; D152-E154 PolarHBondContact OD1-N 2.78Å; D152-Y155 PolarHBondContact O-N 2.95Å; D152-Y155 VanDerWaalsContact O-N 3.14Å; D152-K156 WeakPolarHBondContact O-CG 3.2Å; D152-K156 PolarHBondContact O-N 2.69Å
153	P	84.4	Confident	78.7	Confident	80 Å²	80	104 Å²	104	52%	0.519	54%	0.537	S	S	.	.	H	α-helix	trans	-58.7	-30.4	177.2	24.9	-35.3	0	0	0	113.4	R157	P153-R157 WeakPolarHBondContact O-CB 3.45Å; P153-R157 WeakPolarHBondContact O-CD 3.43Å; P153-R157 VanDerWaalsContact O-CG 3.24Å; P153-R157 WeakPolarHBondContact O-CG 3.39Å; P153-R157 PolarHBondContact O-N 2.76Å
154	E	83.1	Confident	77.9	Confident	114 Å²	114	101.2 Å²	101.2	53%	0.533	53%	0.525	S	S	.	.	H	α-helix	trans	-73.1	-34	177.1	-114.4	58.2	-105.5	0	0	111.9	D152 R157 F158	D152-E154 PolarHBondContact O-N 2.71Å; D152-E154 WeakPolarHBondContact OD1-CB 3.42Å; D152-E154 PolarHBondContact OD1-N 2.78Å; E154-R157 VanDerWaalsContact OE1-CD 3.26Å; E154-R157 WeakPolarHBondContact OE1-CD 3.28Å; E154-R157 IonicContact OE1-CZ 2.78Å; E154-R157 IonicContact OE1-NE 2.71Å; E154-R157 IonicContact OE1-NH1 3.68Å; E154-R157 PolarHBondContact OE1-NH1 2.88Å; E154-R157 IonicContact OE2-NH1 2.75Å; E154-F158 WeakPolarHBondContact O-CB 3.46Å; E154-F158 PolarHBondContact O-N 3.23Å
155	Y	85.4	Confident	77	Confident	81 Å²	81	101 Å²	101	32%	0.318	51%	0.51	S	S	.	.	H	α-helix	trans	-73.2	-38.9	173.2	-178.3	-106.3	0	0	0	112.1	I149 E150 D152 F158 L159	I149-Y155 HydrophobicContact CG1-CD2 4.21Å; I149-Y155 HydrophobicContact CG1-CG 4.21Å; I149-Y155 WeakPolarHBondContact O-CB 3.45Å; I149-Y155 WeakPolarHBondContact O-CD1 3.36Å; I149-Y155 VanDerWaalsContact O-CG 3.31Å; E150-Y155 HydrophobicContact CG-CE1 4.17Å; D152-Y155 PolarHBondContact O-N 2.95Å; D152-Y155 VanDerWaalsContact O-N 3.14Å; Y155-F158 WeakPolarHBondContact O-CB 3.25Å; Y155-F158 PolarHBondContact O-N 2.88Å; Y155-F158 VanDerWaalsContact O-N 3.12Å; Y155-L159 HydrophobicContact CD1-CD1 4.01Å; Y155-L159 HydrophobicContact CE1-CD1 3.53Å; Y155-L159 HydrophobicContact CE1-CG 4.15Å; Y155-L159 PolarHBondContact O-N 3.35Å
156	K	85.7	Confident	76.2	Confident	108 Å²	108	99.5 Å²	99.5	47%	0.47	51%	0.505	S	S	.	.	H	α-helix	trans	-60.5	-44.6	172.6	-73.5	166.7	176.7	163.4	0	111.5	E150 E151 D152 F158 L159 E160	E150-K156 WeakPolarHBondContact O-CE 3.22Å; E151-K156 WeakPolarHBondContact O-CE 2.85Å; E151-K156 PolarHBondContact O-NZ 3.09Å; D152-K156 WeakPolarHBondContact O-CG 3.2Å; D152-K156 PolarHBondContact O-N 2.69Å; K156-F158 VanDerWaalsContact C-N 3.32Å; K156-F158 PolarHBondContact O-N 3.07Å; K156-L159 PolarHBondContact O-N 3.3Å; K156-E160 VanDerWaalsContact O-CB 3.32Å; K156-E160 WeakPolarHBondContact O-CB 3.32Å; K156-E160 PolarHBondContact O-N 3.46Å
157	R	85.3	Confident	75.4	Confident	136 Å²	136	100.4 Å²	100.4	51%	0.513	50%	0.502	S	S	.	.	H	α-helix	trans	-62.6	-34.1	171.4	-77.5	167.8	171.1	171.8	-0.3	113.1	P153 E154 N161	P153-R157 WeakPolarHBondContact O-CB 3.45Å; P153-R157 WeakPolarHBondContact O-CD 3.43Å; P153-R157 VanDerWaalsContact O-CG 3.24Å; P153-R157 WeakPolarHBondContact O-CG 3.39Å; P153-R157 PolarHBondContact O-N 2.76Å; E154-R157 VanDerWaalsContact OE1-CD 3.26Å; E154-R157 WeakPolarHBondContact OE1-CD 3.28Å; E154-R157 IonicContact OE1-CZ 2.78Å; E154-R157 IonicContact OE1-NE 2.71Å; E154-R157 IonicContact OE1-NH1 3.68Å; E154-R157 PolarHBondContact OE1-NH1 2.88Å; E154-R157 IonicContact OE2-NH1 2.75Å; R157-N161 WeakPolarHBondContact O-CB 3.49Å; R157-N161 PolarHBondContact O-N 3.11Å; R157-N161 PolarHBondContact O-ND2 3.49Å
158	F	85.1	Confident	74.5	Confident	122 Å²	122	102.5 Å²	102.5	54%	0.535	50%	0.496	S	S	.	.	H	α-helix	trans	-66.3	-46.4	174.3	172.3	-97.8	0	0	0	111.3	E154 Y155 K156 N161 Y162	E154-F158 WeakPolarHBondContact O-CB 3.46Å; E154-F158 PolarHBondContact O-N 3.23Å; Y155-F158 WeakPolarHBondContact O-CB 3.25Å; Y155-F158 PolarHBondContact O-N 2.88Å; Y155-F158 VanDerWaalsContact O-N 3.12Å; K156-F158 VanDerWaalsContact C-N 3.32Å; K156-F158 PolarHBondContact O-N 3.07Å; F158-N161 PolarHBondContact O-N 3.03Å; F158-Y162 WeakPolarHBondContact O-CB 3.48Å; F158-Y162 PolarHBondContact O-N 3.2Å
159	L	83.8	Confident	73.1	Confident	81 Å²	81	105.2 Å²	105.2	42%	0.424	52%	0.515	S	S	.	.	H	α-helix	trans	-62.2	-43.5	174.4	-72.3	174.9	0	0	0	112.3	Y155 K156 Y162 S163	Y155-L159 HydrophobicContact CD1-CD1 4.01Å; Y155-L159 HydrophobicContact CE1-CD1 3.53Å; Y155-L159 HydrophobicContact CE1-CG 4.15Å; Y155-L159 PolarHBondContact O-N 3.35Å; K156-L159 PolarHBondContact O-N 3.3Å; L159-Y162 WeakPolarHBondContact O-CB 3.46Å; L159-Y162 PolarHBondContact O-N 3.19Å; L159-S163 PolarHBondContact O-N 2.71Å; L159-S163 PolarHBondContact O-OG 3.02Å
160	E	81.6	Confident	71.8	Confident	131 Å²	131	108.2 Å²	108.2	61%	0.612	53%	0.529	S	S	*	.	H	α-helix	trans	-61.3	-42.3	175.8	-178	178.1	-143.4	0	0	112	K156 S163 C164	K156-E160 VanDerWaalsContact O-CB 3.32Å; K156-E160 WeakPolarHBondContact O-CB 3.32Å; K156-E160 PolarHBondContact O-N 3.46Å; E160-S163 PolarHBondContact O-OG 2.91Å; E160-C164 WeakPolarHBondContact O-CB 3.41Å; E160-C164 PolarHBondContact O-N 3.1Å
161	N	78.6	Confident	70.9	Confident	98 Å²	98	103.8 Å²	103.8	52%	0.524	52%	0.517	S	S	.	.	H	α-helix	trans	-67.4	-35.9	173.1	-79.5	-61.2	0	0	0	112.3	R157 F158 C164 D165	R157-N161 WeakPolarHBondContact O-CB 3.49Å; R157-N161 PolarHBondContact O-N 3.11Å; R157-N161 PolarHBondContact O-ND2 3.49Å; F158-N161 PolarHBondContact O-N 3.03Å; N161-C164 CarbonylContact O-C 3.55Å; N161-C164 PolarHBondContact O-N 3.39Å; N161-D165 PolarHBondContact O-N 2.9Å
162	Y	78.1	Confident	70.1	Confident	142 Å²	142	101.3 Å²	101.3	56%	0.557	51%	0.508	S	S	*	.	H	α-helix	trans	-67	-48.4	179.2	-173.7	-83.6	0	0	0	111.8	F158 L159 D165 E166	F158-Y162 WeakPolarHBondContact O-CB 3.48Å; F158-Y162 PolarHBondContact O-N 3.2Å; L159-Y162 WeakPolarHBondContact O-CB 3.46Å; L159-Y162 PolarHBondContact O-N 3.19Å; Y162-D165 PolarHBondContact O-N 3.44Å; Y162-D165 VanDerWaalsContact O-N 3.14Å; Y162-E166 PolarHBondContact O-N 2.84Å
163	S	65.7	Low	69	Low	65 Å²	65	102.9 Å²	102.9	46%	0.455	52%	0.522	S	S	.	.	H	α-helix	trans	-69.1	-33.5	174.1	57.5	0	0	0	0	112.3	L159 E160 D165 E166 E167	L159-S163 PolarHBondContact O-N 2.71Å; L159-S163 PolarHBondContact O-OG 3.02Å; E160-S163 PolarHBondContact O-OG 2.91Å; S163-D165 PolarHBondContact O-N 3.35Å; S163-E166 WeakPolarHBondContact O-CB 3.46Å; S163-E166 PolarHBondContact O-N 3.47Å; S163-E167 PolarHBondContact O-N 2.94Å
164	C	51.5	Low	68.4	Low	42 Å²	42	106.4 Å²	106.4	28%	0.284	53%	0.531	S	S	.	.	H	α-helix	trans	-67.4	-22.7	171	-170.9	0	0	0	0	112.2	E160 N161 K168	E160-C164 WeakPolarHBondContact O-CB 3.41Å; E160-C164 PolarHBondContact O-N 3.1Å; N161-C164 CarbonylContact O-C 3.55Å; N161-C164 PolarHBondContact O-N 3.39Å; C164-K168 WeakPolarHBondContact O-CB 3.47Å; C164-K168 VanDerWaalsContact O-CG 3.24Å; C164-K168 WeakPolarHBondContact O-CG 3.42Å; C164-K168 PolarHBondContact O-N 2.88Å; C164-K168 PolarHBondContact O-NZ 3.23Å; C164-K168 PolarHBondContact SG-NZ 2.94Å
165	D	54.7	Low	67.8	Low	94 Å²	94	104.6 Å²	104.6	50%	0.503	53%	0.528	S	S	.	.	H	α-helix	trans	-78	-28.6	171.3	-87.3	-0.5	0	0	0	112.1	N161 Y162 S163 K168 S169	N161-D165 PolarHBondContact O-N 2.9Å; Y162-D165 PolarHBondContact O-N 3.44Å; Y162-D165 VanDerWaalsContact O-N 3.14Å; S163-D165 PolarHBondContact O-N 3.35Å; D165-K168 IonicContact OD1-NZ 3.52Å; D165-K168 PolarHBondContact OD1-NZ 3.31Å; D165-S169 PolarHBondContact O-N 2.85Å; D165-S169 PolarHBondContact O-OG 3.05Å
166	E	53.8	Low	67.2	Low	129 Å²	129	105.1 Å²	105.1	60%	0.603	54%	0.536	S	S	*	.	H	α-helix	trans	-65.9	-41.7	163.7	-64.3	-169.5	147.9	0	0	111.1	Y162 S163 S169	Y162-E166 PolarHBondContact O-N 2.84Å; S163-E166 WeakPolarHBondContact O-CB 3.46Å; S163-E166 PolarHBondContact O-N 3.47Å; E166-S169 WeakPolarHBondContact O-CA 3.32Å; E166-S169 VanDerWaalsContact O-CB 3.24Å; E166-S169 WeakPolarHBondContact O-CB 3.26Å; E166-S169 PolarHBondContact O-N 3.42Å
167	E	54.3	Low	66.6	Low	138 Å²	138	104.9 Å²	104.9	65%	0.645	54%	0.54	S	S	*	.	H	α-helix	trans	-66.9	-40.2	176.8	-162.9	172.3	-138.8	0	0	112.2	S163 S169 M170	S163-E167 PolarHBondContact O-N 2.94Å; E167-S169 PolarHBondContact O-N 3.42Å; E167-M170 PolarHBondContact O-N 2.86Å
168	K	50.8	Low	66.1	Low	96 Å²	96	100 Å²	100	42%	0.417	53%	0.531	S	S	.	.	H	α-helix	trans	-63.2	-22.4	169.1	-74.3	178.8	-136.1	75.5	0	112.9	C164 D165 M170 A171	C164-K168 WeakPolarHBondContact O-CB 3.47Å; C164-K168 VanDerWaalsContact O-CG 3.24Å; C164-K168 WeakPolarHBondContact O-CG 3.42Å; C164-K168 PolarHBondContact O-N 2.88Å; C164-K168 PolarHBondContact O-NZ 3.23Å; C164-K168 PolarHBondContact SG-NZ 2.94Å; D165-K168 IonicContact OD1-NZ 3.52Å; D165-K168 PolarHBondContact OD1-NZ 3.31Å; K168-M170 PolarHBondContact O-N 3.28Å; K168-A171 WeakPolarHBondContact O-CB 3.41Å; K168-A171 PolarHBondContact O-N 2.96Å
169	S	51.3	Low	65.8	Low	101 Å²	101	98.9 Å²	98.9	71%	0.706	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-6.2	174.1	-59.6	0	0	0	0	113.1	D165 E166 E167	D165-S169 PolarHBondContact O-N 2.85Å; D165-S169 PolarHBondContact O-OG 3.05Å; E166-S169 WeakPolarHBondContact O-CA 3.32Å; E166-S169 VanDerWaalsContact O-CB 3.24Å; E166-S169 WeakPolarHBondContact O-CB 3.26Å; E166-S169 PolarHBondContact O-N 3.42Å; E167-S169 PolarHBondContact O-N 3.42Å
170	M	50.7	Low	65.4	Low	166 Å²	166	99.4 Å²	99.4	82%	0.818	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-2.5	164.3	-61.1	-145.7	-60.8	0	0	113.9	E167 K168	E167-M170 PolarHBondContact O-N 2.86Å; K168-M170 PolarHBondContact O-N 3.28Å
171	A	58.8	Low	65.3	Low	49 Å²	49	97.4 Å²	97.4	41%	0.405	52%	0.521	S	S	.	.	S	Bend	trans	-70.6	138	172.7	0	0	0	0	0	110.9	K168	K168-A171 WeakPolarHBondContact O-CB 3.41Å; K168-A171 PolarHBondContact O-N 2.96Å
172	N	62.2	Low	65.2	Low	84 Å²	84	95 Å²	95	45%	0.449	51%	0.514	S	S	.	.			trans	-55.1	133.5	177.4	175.6	-12.3	0	0	0	110.1	E174 T175 L176	N172-E174 PolarHBondContact O-N 3.03Å; N172-E174 PolarHBondContact OD1-N 3.27Å; N172-T175 PolarHBondContact N-OG1 2.96Å; N172-T175 PolarHBondContact O-N 3.49Å; N172-T175 PolarHBondContact O-OG1 3.02Å; N172-L176 PolarHBondContact O-N 2.87Å
173	P	64.8	Low	65.1	Low	103 Å²	103	93.6 Å²	93.6	67%	0.669	51%	0.511	S	S	*	.	H	α-helix	trans	-53.1	-28.8	178.5	18.9	-33.1	0	0	0	114.3	L177	P173-L177 WeakPolarHBondContact O-CB 3.42Å; P173-L177 PolarHBondContact O-N 2.8Å
174	E	70.2	Confident	65.4	Low	154 Å²	154	93.9 Å²	93.9	72%	0.72	51%	0.51	S	S	*	.	H	α-helix	trans	-66.3	-41	173.8	-67.4	-167.6	128.6	0	0	112.8	N172 L177 G178	N172-E174 PolarHBondContact O-N 3.03Å; N172-E174 PolarHBondContact OD1-N 3.27Å; E174-L177 PolarHBondContact O-N 3.35Å; E174-G178 PolarHBondContact O-N 3.32Å
175	T	71.8	Confident	66.7	Low	77 Å²	77	98.6 Å²	98.6	47%	0.472	52%	0.521	S	S	.	.	H	α-helix	trans	-69.6	-39.1	178.4	39.7	0	0	0	0	112.1	N172 G178 E179	N172-T175 PolarHBondContact N-OG1 2.96Å; N172-T175 PolarHBondContact O-N 3.49Å; N172-T175 PolarHBondContact O-OG1 3.02Å; T175-G178 PolarHBondContact O-N 3.28Å; T175-E179 PolarHBondContact O-N 3.38Å
176	L	71.8	Confident	67.6	Low	92 Å²	92	98.8 Å²	98.8	48%	0.482	52%	0.52	S	S	.	.	H	α-helix	trans	-64.3	-41.9	174.8	-179.5	60.5	0	0	0	111.6	N172 E179 I180	N172-L176 PolarHBondContact O-N 2.87Å; L176-E179 PolarHBondContact O-N 2.89Å; L176-I180 HydrophobicContact CD1-CD1 4.2Å; L176-I180 HydrophobicContact CG-CD1 4.06Å; L176-I180 VanDerWaalsContact O-CG1 3.29Å; L176-I180 WeakPolarHBondContact O-CG1 3.35Å; L176-I180 PolarHBondContact O-N 3.02Å
177	L	73.2	Confident	68.4	Low	103 Å²	103	97.4 Å²	97.4	54%	0.539	52%	0.516	S	S	.	.	H	α-helix	trans	-63.4	-44	174.3	-175.5	61.8	0	0	0	111.4	P173 E174 E179 I180 E181	P173-L177 WeakPolarHBondContact O-CB 3.42Å; P173-L177 PolarHBondContact O-N 2.8Å; E174-L177 PolarHBondContact O-N 3.35Å; L177-E179 VanDerWaalsContact C-N 3.33Å; L177-E179 PolarHBondContact O-N 2.78Å; L177-I180 PolarHBondContact O-N 3.01Å; L177-E181 WeakPolarHBondContact O-CG 3.45Å; L177-E181 PolarHBondContact O-N 3.13Å
178	G	76.1	Confident	69.2	Low	32 Å²	32	96 Å²	96	33%	0.33	51%	0.512	S	S	.	.	H	α-helix	trans	-58.4	-41	175.6	0	0	0	0	0	113.2	E174 T175 A182	E174-G178 PolarHBondContact O-N 3.32Å; T175-G178 PolarHBondContact O-N 3.28Å; G178-A182 VanDerWaalsContact O-CB 3.27Å; G178-A182 WeakPolarHBondContact O-CB 3.47Å; G178-A182 PolarHBondContact O-N 3.38Å
179	E	78.5	Confident	70.2	Confident	99 Å²	99	94.6 Å²	94.6	46%	0.463	52%	0.517	S	S	.	.	H	α-helix	trans	-67.2	-42.9	173.9	-83.7	-164.4	-132.2	0	0	113.3	T175 L176 L177 E181 A182 K183	T175-E179 PolarHBondContact O-N 3.38Å; L176-E179 PolarHBondContact O-N 2.89Å; L177-E179 VanDerWaalsContact C-N 3.33Å; L177-E179 PolarHBondContact O-N 2.78Å; E179-E181 VanDerWaalsContact C-N 3.33Å; E179-A182 PolarHBondContact O-N 2.99Å; E179-K183 WeakPolarHBondContact O-CB 3.26Å; E179-K183 WeakPolarHBondContact O-CG 3.43Å; E179-K183 PolarHBondContact O-N 3.08Å; E179-K183 WeakPolarHBondContact OE2-CE 3.31Å; E179-K183 IonicContact OE2-NZ 2.68Å; E179-K183 PolarHBondContact OE2-NZ 3Å
180	I	75.1	Confident	71.2	Confident	93 Å²	93	97.1 Å²	97.1	48%	0.477	52%	0.516	S	S	.	.	H	α-helix	trans	-63.3	-42.8	177	-69.8	165.5	0	0	0	110	L176 L177 T184	L176-I180 HydrophobicContact CD1-CD1 4.2Å; L176-I180 HydrophobicContact CG-CD1 4.06Å; L176-I180 VanDerWaalsContact O-CG1 3.29Å; L176-I180 WeakPolarHBondContact O-CG1 3.35Å; L176-I180 PolarHBondContact O-N 3.02Å; L177-I180 PolarHBondContact O-N 3.01Å; I180-T184 WeakPolarHBondContact O-CB 3.25Å; I180-T184 WeakPolarHBondContact O-CG2 3.34Å; I180-T184 PolarHBondContact O-N 3.32Å; I180-T184 PolarHBondContact O-OG1 3.37Å
181	E	79.8	Confident	72.1	Confident	89 Å²	89	98.5 Å²	98.5	42%	0.416	51%	0.512	S	S	.	.	H	α-helix	trans	-65.5	-38.3	172.6	-70.2	-161.6	157.9	0	0	112.7	L177 E179 T184 R185	L177-E181 WeakPolarHBondContact O-CG 3.45Å; L177-E181 PolarHBondContact O-N 3.13Å; E179-E181 VanDerWaalsContact C-N 3.33Å; E181-T184 WeakPolarHBondContact CA-OG1 3.49Å; E181-T184 PolarHBondContact O-OG1 3.24Å; E181-R185 VanDerWaalsContact O-CB 3.23Å; E181-R185 WeakPolarHBondContact O-CB 3.31Å; E181-R185 WeakPolarHBondContact O-CG 3.41Å; E181-R185 PolarHBondContact O-N 2.8Å; E181-R185 PolarHBondContact O-NE 3.06Å; E181-R185 IonicContact OE2-CZ 3.9Å; E181-R185 IonicContact OE2-NH1 3.85Å; E181-R185 PolarHBondContact OE2-NH1 3.41Å; E181-R185 IonicContact OE2-NH2 2.68Å; E181-R185 PolarHBondContact OE2-NH2 3.35Å
182	A	76.4	Confident	72.9	Confident	46 Å²	46	99.5 Å²	99.5	38%	0.38	51%	0.513	S	S	.	.	H	α-helix	trans	-64.3	-52.1	177.4	0	0	0	0	0	111.3	G178 E179 T184 R185 E186	G178-A182 VanDerWaalsContact O-CB 3.27Å; G178-A182 WeakPolarHBondContact O-CB 3.47Å; G178-A182 PolarHBondContact O-N 3.38Å; E179-A182 PolarHBondContact O-N 2.99Å; A182-T184 VanDerWaalsContact C-N 3.3Å; A182-T184 PolarHBondContact O-N 3.39Å; A182-R185 PolarHBondContact O-N 2.97Å; A182-E186 WeakPolarHBondContact O-CB 3.4Å; A182-E186 PolarHBondContact O-N 3.41Å
183	K	76.6	Confident	73.8	Confident	114 Å²	114	98.9 Å²	98.9	50%	0.496	51%	0.512	S	S	.	.	H	α-helix	trans	-61.3	-36.7	178.2	-69.9	165.6	-174.1	165.2	0	111.8	E179 L187	E179-K183 WeakPolarHBondContact O-CB 3.26Å; E179-K183 WeakPolarHBondContact O-CG 3.43Å; E179-K183 PolarHBondContact O-N 3.08Å; E179-K183 WeakPolarHBondContact OE2-CE 3.31Å; E179-K183 IonicContact OE2-NZ 2.68Å; E179-K183 PolarHBondContact OE2-NZ 3Å; K183-L187 VanDerWaalsContact O-CB 3.32Å; K183-L187 WeakPolarHBondContact O-CB 3.38Å; K183-L187 WeakPolarHBondContact O-CG 3.25Å; K183-L187 PolarHBondContact O-N 2.99Å
184	T	70.4	Confident	74.5	Confident	70 Å²	70	99.2 Å²	99.2	43%	0.429	51%	0.514	S	S	.	.	H	α-helix	trans	-74.7	-39.2	174.2	52.7	0	0	0	0	113.2	I180 E181 A182 E186 L187 I188	I180-T184 WeakPolarHBondContact O-CB 3.25Å; I180-T184 WeakPolarHBondContact O-CG2 3.34Å; I180-T184 PolarHBondContact O-N 3.32Å; I180-T184 PolarHBondContact O-OG1 3.37Å; E181-T184 WeakPolarHBondContact CA-OG1 3.49Å; E181-T184 PolarHBondContact O-OG1 3.24Å; A182-T184 VanDerWaalsContact C-N 3.3Å; A182-T184 PolarHBondContact O-N 3.39Å; T184-E186 VanDerWaalsContact C-N 3.3Å; T184-E186 PolarHBondContact O-N 3.22Å; T184-L187 PolarHBondContact O-N 3.03Å; T184-I188 WeakPolarHBondContact O-CB 3.38Å; T184-I188 WeakPolarHBondContact O-CD1 3.47Å; T184-I188 WeakPolarHBondContact O-CG1 3.4Å; T184-I188 PolarHBondContact O-N 3.49Å
185	R	78.8	Confident	74.8	Confident	141 Å²	141	97.3 Å²	97.3	53%	0.532	51%	0.508	S	S	.	.	H	α-helix	trans	-58.4	-43.1	170.6	-80.3	-177	-80.2	-106.9	3.3	111.4	E181 A182 I188 A189	E181-R185 VanDerWaalsContact O-CB 3.23Å; E181-R185 WeakPolarHBondContact O-CB 3.31Å; E181-R185 WeakPolarHBondContact O-CG 3.41Å; E181-R185 PolarHBondContact O-N 2.8Å; E181-R185 PolarHBondContact O-NE 3.06Å; E181-R185 IonicContact OE2-CZ 3.9Å; E181-R185 IonicContact OE2-NH1 3.85Å; E181-R185 PolarHBondContact OE2-NH1 3.41Å; E181-R185 IonicContact OE2-NH2 2.68Å; E181-R185 PolarHBondContact OE2-NH2 3.35Å; A182-R185 PolarHBondContact O-N 2.97Å; R185-I188 PolarHBondContact O-N 2.82Å; R185-A189 WeakPolarHBondContact O-CB 3.48Å; R185-A189 PolarHBondContact O-N 2.87Å
186	E	74.6	Confident	75.3	Confident	99 Å²	99	98 Å²	98	46%	0.463	51%	0.509	S	S	.	.	H	α-helix	trans	-66.1	-47.1	177.4	-168.9	-166.2	159.2	0	0	112	A182 T184 I188 A189 K190	A182-E186 WeakPolarHBondContact O-CB 3.4Å; A182-E186 PolarHBondContact O-N 3.41Å; T184-E186 VanDerWaalsContact C-N 3.3Å; T184-E186 PolarHBondContact O-N 3.22Å; E186-I188 VanDerWaalsContact C-N 3.27Å; E186-I188 PolarHBondContact O-N 2.89Å; E186-A189 PolarHBondContact O-N 2.88Å; E186-K190 HydrophobicContact CG-CD 4.19Å; E186-K190 WeakPolarHBondContact O-CB 3.4Å; E186-K190 WeakPolarHBondContact O-CG 3.15Å; E186-K190 PolarHBondContact O-N 3.49Å; E186-K190 VanDerWaalsContact OE1-CE 3.26Å; E186-K190 WeakPolarHBondContact OE1-CE 3.35Å; E186-K190 IonicContact OE1-NZ 3.68Å; E186-K190 PolarHBondContact OE1-NZ 3.16Å
187	L	69.9	Low	75.8	Confident	100 Å²	100	98.9 Å²	98.9	52%	0.524	51%	0.51	S	S	.	.	H	α-helix	trans	-61.8	-33.7	174	-83.6	164.3	0	0	0	112.6	K183 T184 R191	K183-L187 VanDerWaalsContact O-CB 3.32Å; K183-L187 WeakPolarHBondContact O-CB 3.38Å; K183-L187 WeakPolarHBondContact O-CG 3.25Å; K183-L187 PolarHBondContact O-N 2.99Å; T184-L187 PolarHBondContact O-N 3.03Å; L187-R191 VanDerWaalsContact O-CB 3.28Å; L187-R191 WeakPolarHBondContact O-CB 3.18Å; L187-R191 WeakPolarHBondContact O-CD 3.48Å; L187-R191 WeakPolarHBondContact O-CG 3.34Å; L187-R191 PolarHBondContact O-N 3.15Å
188	I	72.6	Confident	76.4	Confident	109 Å²	109	100.2 Å²	100.2	56%	0.559	51%	0.509	S	S	*	.	H	α-helix	trans	-68.5	-47.9	173	-71.8	164	0	0	0	110	T184 R185 E186 K190 R191 T192	T184-I188 WeakPolarHBondContact O-CB 3.38Å; T184-I188 WeakPolarHBondContact O-CD1 3.47Å; T184-I188 WeakPolarHBondContact O-CG1 3.4Å; T184-I188 PolarHBondContact O-N 3.49Å; R185-I188 PolarHBondContact O-N 2.82Å; E186-I188 VanDerWaalsContact C-N 3.27Å; E186-I188 PolarHBondContact O-N 2.89Å; I188-K190 VanDerWaalsContact C-N 3.34Å; I188-K190 PolarHBondContact O-N 2.98Å; I188-R191 CarbonylContact O-C 3.54Å; I188-R191 PolarHBondContact O-N 3.06Å; I188-T192 HydrophobicContact CG2-CG2 4.3Å; I188-T192 PolarHBondContact O-N 3.47Å; I188-T192 PolarHBondContact O-OG1 2.85Å
189	A	70.7	Confident	76.9	Confident	65 Å²	65	102 Å²	102	54%	0.537	51%	0.511	S	S	.	.	H	α-helix	trans	-61.2	-40	178.1	0	0	0	0	0	112.7	R185 E186 R191 T192	R185-A189 WeakPolarHBondContact O-CB 3.48Å; R185-A189 PolarHBondContact O-N 2.87Å; E186-A189 PolarHBondContact O-N 2.88Å; A189-R191 PolarHBondContact O-N 2.86Å; A189-T192 WeakPolarHBondContact CA-OG1 3.21Å; A189-T192 PolarHBondContact O-OG1 3.39Å
190	K	72.6	Confident	77.3	Confident	154 Å²	154	103.7 Å²	103.7	67%	0.67	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-14.2	174.3	-72	177	172.8	177	0	113.7	E186 I188	E186-K190 HydrophobicContact CG-CD 4.19Å; E186-K190 WeakPolarHBondContact O-CB 3.4Å; E186-K190 WeakPolarHBondContact O-CG 3.15Å; E186-K190 PolarHBondContact O-N 3.49Å; E186-K190 VanDerWaalsContact OE1-CE 3.26Å; E186-K190 WeakPolarHBondContact OE1-CE 3.35Å; E186-K190 IonicContact OE1-NZ 3.68Å; E186-K190 PolarHBondContact OE1-NZ 3.16Å; I188-K190 VanDerWaalsContact C-N 3.34Å; I188-K190 PolarHBondContact O-N 2.98Å
191	R	69.1	Low	77.8	Confident	196 Å²	196	103 Å²	103	74%	0.74	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.8	-6	178.8	-65.2	175.7	85.3	124.8	4.2	114	L187 I188 A189 T193	L187-R191 VanDerWaalsContact O-CB 3.28Å; L187-R191 WeakPolarHBondContact O-CB 3.18Å; L187-R191 WeakPolarHBondContact O-CD 3.48Å; L187-R191 WeakPolarHBondContact O-CG 3.34Å; L187-R191 PolarHBondContact O-N 3.15Å; I188-R191 CarbonylContact O-C 3.54Å; I188-R191 PolarHBondContact O-N 3.06Å; A189-R191 PolarHBondContact O-N 2.86Å; R191-T193 PolarHBondContact O-N 3.22Å
192	T	76.6	Confident	78.2	Confident	70 Å²	70	104.4 Å²	104.4	43%	0.429	52%	0.519	S	S	.	.			trans	-71.5	110.3	173	31.9	0	0	0	0	110.6	I188 A189	I188-T192 HydrophobicContact CG2-CG2 4.3Å; I188-T192 PolarHBondContact O-N 3.47Å; I188-T192 PolarHBondContact O-OG1 2.85Å; A189-T192 WeakPolarHBondContact CA-OG1 3.21Å; A189-T192 PolarHBondContact O-OG1 3.39Å
193	T	80.6	Confident	78.7	Confident	71 Å²	71	108.6 Å²	108.6	44%	0.436	53%	0.528	S	S	.	.			trans	-78	157.1	169.4	64.4	0	0	0	0	110.7	R191 L195 L196 E197	R191-T193 PolarHBondContact O-N 3.22Å; T193-L195 PolarHBondContact O-N 3.44Å; T193-L196 WeakPolarHBondContact O-CB 3.46Å; T193-L196 PolarHBondContact O-N 3.03Å; T193-E197 PolarHBondContact O-N 3.47Å
194	P	79.9	Confident	79.3	Confident	109 Å²	109	107.3 Å²	107.3	71%	0.708	53%	0.526	S	S	*	.	H	α-helix	trans	-55	-29.1	177.8	-28.5	36	0	0	0	114	Y198	P194-Y198 WeakPolarHBondContact O-CB 3.45Å; P194-Y198 PolarHBondContact O-N 3.35Å
195	L	76.6	Confident	79.8	Confident	114 Å²	114	107.4 Å²	107.4	60%	0.597	52%	0.521	S	S	*	.	H	α-helix	trans	-69.8	-40	174.2	-179.7	59.8	0	0	0	112.6	T193 Y198 I199	T193-L195 PolarHBondContact O-N 3.44Å; L195-Y198 PolarHBondContact O-N 2.88Å; L195-I199 HydrophobicContact CD1-CD1 4.1Å; L195-I199 HydrophobicContact CD1-CG1 4.41Å; L195-I199 HydrophobicContact CG-CD1 4.01Å; L195-I199 WeakPolarHBondContact O-CB 3.36Å; L195-I199 WeakPolarHBondContact O-CD1 3.39Å; L195-I199 WeakPolarHBondContact O-CG1 3.32Å; L195-I199 PolarHBondContact O-N 2.93Å
196	L	82.5	Confident	80.2	Confident	93 Å²	93	106.9 Å²	106.9	49%	0.487	52%	0.523	S	S	.	.	H	α-helix	trans	-67.4	-38.7	175.8	-70.3	173.8	0	0	0	111.2	T193 I199 K200	T193-L196 WeakPolarHBondContact O-CB 3.46Å; T193-L196 PolarHBondContact O-N 3.03Å; L196-I199 PolarHBondContact O-N 3.27Å; L196-K200 WeakPolarHBondContact O-CB 3.45Å; L196-K200 PolarHBondContact O-N 3.02Å
197	E	80.6	Confident	80.5	Confident	109 Å²	109	107.9 Å²	107.9	51%	0.509	53%	0.527	S	S	.	.	H	α-helix	trans	-64.2	-47.9	172.6	-176.4	172.6	-163.4	0	0	111.8	T193 I199 K200 N201	T193-E197 PolarHBondContact O-N 3.47Å; E197-I199 VanDerWaalsContact C-N 3.28Å; E197-I199 PolarHBondContact O-N 3.43Å; E197-K200 WeakPolarHBondContact O-CA 3.37Å; E197-K200 WeakPolarHBondContact O-CB 3.46Å; E197-K200 PolarHBondContact O-N 3.3Å; E197-N201 WeakPolarHBondContact O-CB 3.24Å; E197-N201 VanDerWaalsContact O-CG 3.31Å; E197-N201 PolarHBondContact O-N 3.28Å
198	Y	86.3	Confident	81.1	Confident	131 Å²	131	109.9 Å²	109.9	51%	0.514	53%	0.528	S	S	.	.	H	α-helix	trans	-57	-40.6	174	178.2	-100.8	0	0	0	112.1	P194 L195 N201 K202	P194-Y198 WeakPolarHBondContact O-CB 3.45Å; P194-Y198 PolarHBondContact O-N 3.35Å; L195-Y198 PolarHBondContact O-N 2.88Å; Y198-N201 PolarHBondContact O-N 3.35Å; Y198-K202 HydrophobicContact CD1-CD 4.44Å; Y198-K202 HydrophobicContact CE1-CD 3.61Å; Y198-K202 WeakPolarHBondContact O-CB 3.34Å; Y198-K202 PolarHBondContact O-N 3.49Å; Y198-K202 PolarHBondContact OH-NZ 2.68Å
199	I	87.6	Confident	81.3	Confident	71 Å²	71	108.7 Å²	108.7	36%	0.364	52%	0.522	S	S	.	.	H	α-helix	trans	-66.5	-38	175.6	-70.9	164.8	0	0	0	111.7	L195 L196 E197 K203	L195-I199 HydrophobicContact CD1-CD1 4.1Å; L195-I199 HydrophobicContact CD1-CG1 4.41Å; L195-I199 HydrophobicContact CG-CD1 4.01Å; L195-I199 WeakPolarHBondContact O-CB 3.36Å; L195-I199 WeakPolarHBondContact O-CD1 3.39Å; L195-I199 WeakPolarHBondContact O-CG1 3.32Å; L195-I199 PolarHBondContact O-N 2.93Å; L196-I199 PolarHBondContact O-N 3.27Å; E197-I199 VanDerWaalsContact C-N 3.28Å; E197-I199 PolarHBondContact O-N 3.43Å; I199-K203 HydrophobicContact CG2-CD 4.5Å; I199-K203 VanDerWaalsContact O-CG 3.32Å; I199-K203 WeakPolarHBondContact O-CG 3.29Å; I199-K203 PolarHBondContact O-N 3.17Å; I199-K203 VanDerWaalsContact O-N 3.08Å
200	K	86	Confident	81.5	Confident	134 Å²	134	113 Å²	113	58%	0.583	52%	0.524	S	S	*	.	H	α-helix	trans	-63.7	-51.3	174.1	-175.3	-174.1	177.5	-170.9	0	110.5	L196 E197 K202 K203 I204	L196-K200 WeakPolarHBondContact O-CB 3.45Å; L196-K200 PolarHBondContact O-N 3.02Å; E197-K200 WeakPolarHBondContact O-CA 3.37Å; E197-K200 WeakPolarHBondContact O-CB 3.46Å; E197-K200 PolarHBondContact O-N 3.3Å; K200-K202 PolarHBondContact O-N 3.08Å; K200-K203 WeakPolarHBondContact O-CB 3.45Å; K200-K203 PolarHBondContact O-N 3.15Å; K200-K203 VanDerWaalsContact O-N 3.09Å; K200-I204 HydrophobicContact CG-CD1 4.06Å; K200-I204 WeakPolarHBondContact O-CG1 3.24Å; K200-I204 PolarHBondContact O-N 2.85Å
201	N	86.1	Confident	81.7	Confident	77 Å²	77	111.4 Å²	111.4	41%	0.412	52%	0.519	S	S	.	.	H	α-helix	trans	-65.6	-38.5	-178.3	-64	-7.1	0	0	0	111.2	E197 Y198 K203 I204 E205	E197-N201 WeakPolarHBondContact O-CB 3.24Å; E197-N201 VanDerWaalsContact O-CG 3.31Å; E197-N201 PolarHBondContact O-N 3.28Å; Y198-N201 PolarHBondContact O-N 3.35Å; N201-K203 VanDerWaalsContact C-N 3.32Å; N201-K203 PolarHBondContact O-N 3.13Å; N201-I204 PolarHBondContact O-N 3.24Å; N201-E205 WeakPolarHBondContact O-CB 3.49Å; N201-E205 PolarHBondContact O-N 2.95Å
202	K	88.9	Confident	82	Confident	120 Å²	120	107.3 Å²	107.3	52%	0.522	51%	0.508	S	S	.	.	H	α-helix	trans	-68.5	-24.2	173.7	-167.2	168.2	-166.1	164.2	0	113.8	Y198 K200 K206	Y198-K202 HydrophobicContact CD1-CD 4.44Å; Y198-K202 HydrophobicContact CE1-CD 3.61Å; Y198-K202 WeakPolarHBondContact O-CB 3.34Å; Y198-K202 PolarHBondContact O-N 3.49Å; Y198-K202 PolarHBondContact OH-NZ 2.68Å; K200-K202 PolarHBondContact O-N 3.08Å; K202-K206 WeakPolarHBondContact O-CB 3.32Å; K202-K206 PolarHBondContact O-N 3.38Å
203	K	86.2	Confident	82	Confident	134 Å²	134	110.4 Å²	110.4	58%	0.583	52%	0.516	S	S	*	.	H	α-helix	trans	-75.2	-47.2	168.6	-77.3	172.1	179.8	178.3	0	111.1	I199 K200 N201 K206 Q207	I199-K203 HydrophobicContact CG2-CD 4.5Å; I199-K203 VanDerWaalsContact O-CG 3.32Å; I199-K203 WeakPolarHBondContact O-CG 3.29Å; I199-K203 PolarHBondContact O-N 3.17Å; I199-K203 VanDerWaalsContact O-N 3.08Å; K200-K203 WeakPolarHBondContact O-CB 3.45Å; K200-K203 PolarHBondContact O-N 3.15Å; K200-K203 VanDerWaalsContact O-N 3.09Å; N201-K203 VanDerWaalsContact C-N 3.32Å; N201-K203 PolarHBondContact O-N 3.13Å; K203-K206 CarbonylContact O-C 3.55Å; K203-K206 PolarHBondContact O-N 3.09Å; K203-Q207 PolarHBondContact O-N 2.89Å
204	I	87.9	Confident	81.4	Confident	87 Å²	87	114.8 Å²	114.8	45%	0.446	52%	0.524	S	S	.	.	H	α-helix	trans	-58.4	-50.1	178	-67.6	165.5	0	0	0	110.2	K200 N201 K206 Q207 R208	K200-I204 HydrophobicContact CG-CD1 4.06Å; K200-I204 WeakPolarHBondContact O-CG1 3.24Å; K200-I204 PolarHBondContact O-N 2.85Å; N201-I204 PolarHBondContact O-N 3.24Å; I204-K206 VanDerWaalsContact C-N 3.31Å; I204-K206 PolarHBondContact O-N 3.19Å; I204-Q207 CarbonylContact O-C 3.54Å; I204-Q207 WeakPolarHBondContact O-CA 3.35Å; I204-Q207 WeakPolarHBondContact O-CB 3.24Å; I204-Q207 PolarHBondContact O-N 3.49Å; I204-R208 PolarHBondContact O-N 3.18Å
205	E	82.6	Confident	80.9	Confident	72 Å²	72	116 Å²	116	34%	0.336	52%	0.521	S	S	.	.	H	α-helix	trans	-62.7	-38.6	179.5	-172.8	57.5	-162.2	0	0	112.1	N201 Q207 R208 I209	N201-E205 WeakPolarHBondContact O-CB 3.49Å; N201-E205 PolarHBondContact O-N 2.95Å; E205-Q207 PolarHBondContact O-N 2.91Å; E205-R208 VanDerWaalsContact CD-NH2 3.33Å; E205-R208 PolarHBondContact O-N 2.98Å; E205-R208 IonicContact OE1-CZ 3.23Å; E205-R208 IonicContact OE1-NE 2.73Å; E205-R208 IonicContact OE1-NH2 3.19Å; E205-R208 PolarHBondContact OE1-NH2 3.12Å; E205-R208 IonicContact OE2-CZ 3.58Å; E205-R208 IonicContact OE2-NE 3.61Å; E205-R208 PolarHBondContact OE2-NE 3.39Å; E205-R208 IonicContact OE2-NH2 3.28Å; E205-R208 PolarHBondContact OE2-NH2 3.28Å; E205-R208 VanDerWaalsContact OE2-NH2 3.13Å; E205-I209 HydrophobicContact CG-CD1 3.93Å; E205-I209 WeakPolarHBondContact O-CB 3.21Å; E205-I209 VanDerWaalsContact O-CG1 3.31Å; E205-I209 WeakPolarHBondContact O-CG1 3.35Å; E205-I209 PolarHBondContact O-N 3.25Å
206	K	86.4	Confident	80.6	Confident	130 Å²	130	114.4 Å²	114.4	57%	0.565	51%	0.51	S	S	*	.	H	α-helix	trans	-69	-20.1	173.8	-171.9	171.3	-176.9	173.8	0	113.3	K202 K203 I204 R210	K202-K206 WeakPolarHBondContact O-CB 3.32Å; K202-K206 PolarHBondContact O-N 3.38Å; K203-K206 CarbonylContact O-C 3.55Å; K203-K206 PolarHBondContact O-N 3.09Å; I204-K206 VanDerWaalsContact C-N 3.31Å; I204-K206 PolarHBondContact O-N 3.19Å; K206-R210 VanDerWaalsContact O-CD 3.25Å; K206-R210 WeakPolarHBondContact O-CD 3.25Å; K206-R210 VanDerWaalsContact O-CG 3.24Å; K206-R210 WeakPolarHBondContact O-CG 3.44Å
207	Q	81	Confident	79.9	Confident	119 Å²	119	117.9 Å²	117.9	56%	0.556	52%	0.517	S	S	*	.	H	α-helix	trans	-81	-47.3	167.8	-73.2	174.9	-97.3	0	0	110.7	K203 I204 E205 I209 R210 E211	K203-Q207 PolarHBondContact O-N 2.89Å; I204-Q207 CarbonylContact O-C 3.54Å; I204-Q207 WeakPolarHBondContact O-CA 3.35Å; I204-Q207 WeakPolarHBondContact O-CB 3.24Å; I204-Q207 PolarHBondContact O-N 3.49Å; E205-Q207 PolarHBondContact O-N 2.91Å; Q207-I209 PolarHBondContact O-N 3.38Å; Q207-R210 CarbonylContact O-C 3.48Å; Q207-R210 WeakPolarHBondContact O-CA 3.43Å; Q207-R210 WeakPolarHBondContact O-CB 3.21Å; Q207-R210 PolarHBondContact O-N 2.92Å; Q207-E211 PolarHBondContact O-N 3.12Å
208	R	82.1	Confident	79.3	Confident	143 Å²	143	121.3 Å²	121.3	54%	0.54	53%	0.525	S	S	.	.	H	α-helix	trans	-52.8	-51.7	176.9	-165.1	172.2	74	111.4	6.7	111.9	I204 E205 R210 E211 E212	I204-R208 PolarHBondContact O-N 3.18Å; E205-R208 VanDerWaalsContact CD-NH2 3.33Å; E205-R208 PolarHBondContact O-N 2.98Å; E205-R208 IonicContact OE1-CZ 3.23Å; E205-R208 IonicContact OE1-NE 2.73Å; E205-R208 IonicContact OE1-NH2 3.19Å; E205-R208 PolarHBondContact OE1-NH2 3.12Å; E205-R208 IonicContact OE2-CZ 3.58Å; E205-R208 IonicContact OE2-NE 3.61Å; E205-R208 PolarHBondContact OE2-NE 3.39Å; E205-R208 IonicContact OE2-NH2 3.28Å; E205-R208 PolarHBondContact OE2-NH2 3.28Å; E205-R208 VanDerWaalsContact OE2-NH2 3.13Å; R208-R210 PolarHBondContact O-N 3.31Å; R208-E211 WeakPolarHBondContact O-CB 3.4Å; R208-E211 PolarHBondContact O-N 2.74Å; R208-E212 VanDerWaalsContact O-CB 3.28Å; R208-E212 WeakPolarHBondContact O-CB 3.01Å; R208-E212 PolarHBondContact O-N 3.05Å
209	I	76.8	Confident	78.5	Confident	84 Å²	84	124 Å²	124	43%	0.431	53%	0.534	S	S	.	.	H	α-helix	trans	-60.8	-28.6	176.2	-66.4	166.1	0	0	0	112.6	E205 Q207 K213	E205-I209 HydrophobicContact CG-CD1 3.93Å; E205-I209 WeakPolarHBondContact O-CB 3.21Å; E205-I209 VanDerWaalsContact O-CG1 3.31Å; E205-I209 WeakPolarHBondContact O-CG1 3.35Å; E205-I209 PolarHBondContact O-N 3.25Å; Q207-I209 PolarHBondContact O-N 3.38Å; I209-K213 WeakPolarHBondContact O-CB 3.32Å; I209-K213 PolarHBondContact O-N 3.37Å
210	R	75.3	Confident	77.5	Confident	155 Å²	155	127.5 Å²	127.5	59%	0.585	54%	0.543	S	S	*	.	H	α-helix	trans	-80.3	-29	175.4	-77	172.9	167.7	179.9	-8.5	112.9	K206 Q207 R208 R214	K206-R210 VanDerWaalsContact O-CD 3.25Å; K206-R210 WeakPolarHBondContact O-CD 3.25Å; K206-R210 VanDerWaalsContact O-CG 3.24Å; K206-R210 WeakPolarHBondContact O-CG 3.44Å; Q207-R210 CarbonylContact O-C 3.48Å; Q207-R210 WeakPolarHBondContact O-CA 3.43Å; Q207-R210 WeakPolarHBondContact O-CB 3.21Å; Q207-R210 PolarHBondContact O-N 2.92Å; R208-R210 PolarHBondContact O-N 3.31Å; R210-R214 WeakPolarHBondContact O-CG 3.14Å
211	E	76.1	Confident	76.7	Confident	120 Å²	120	127.1 Å²	127.1	56%	0.561	54%	0.544	S	S	*	.	H	α-helix	trans	-76.3	-53.3	177.3	-167.4	121.8	-106.9	0	0	110.3	Q207 R208 K213 R214 E215	Q207-E211 PolarHBondContact O-N 3.12Å; R208-E211 WeakPolarHBondContact O-CB 3.4Å; R208-E211 PolarHBondContact O-N 2.74Å; E211-K213 PolarHBondContact O-N 3.14Å; E211-R214 WeakPolarHBondContact O-CA 3.41Å; E211-R214 WeakPolarHBondContact O-CB 3.43Å; E211-R214 PolarHBondContact O-N 2.94Å; E211-E215 PolarHBondContact O-N 3.31Å
212	E	75.9	Confident	75.7	Confident	110 Å²	110	129 Å²	129	51%	0.514	55%	0.553	S	S	.	*	H	α-helix	trans	-50.9	-42.5	170.8	-176.7	179.2	-155.6	0	0	111.1	R208 R214 E215 E216	R208-E212 VanDerWaalsContact O-CB 3.28Å; R208-E212 WeakPolarHBondContact O-CB 3.01Å; R208-E212 PolarHBondContact O-N 3.05Å; E212-R214 VanDerWaalsContact C-N 3.26Å; E212-R214 PolarHBondContact O-N 3.15Å; E212-E215 PolarHBondContact O-N 3.18Å; E212-E216 VanDerWaalsContact O-CB 3.24Å; E212-E216 WeakPolarHBondContact O-CB 3.24Å; E212-E216 PolarHBondContact O-N 3.23Å
213	K	77.7	Confident	74.8	Confident	136 Å²	136	126.8 Å²	126.8	59%	0.591	54%	0.544	S	S	*	.	H	α-helix	trans	-72	-10.1	176.6	-166.9	160.7	-170	160.2	0	115.1	I209 E211	I209-K213 WeakPolarHBondContact O-CB 3.32Å; I209-K213 PolarHBondContact O-N 3.37Å; E211-K213 PolarHBondContact O-N 3.14Å
214	R	67.6	Low	74.1	Confident	162 Å²	162	126.9 Å²	126.9	61%	0.611	55%	0.545	S	S	*	.	H	α-helix	trans	-91.8	-40.9	165.6	-67.3	174.2	-176.7	132	-9.3	111	R210 E211 E212 R217 R218	R210-R214 WeakPolarHBondContact O-CG 3.14Å; E211-R214 WeakPolarHBondContact O-CA 3.41Å; E211-R214 WeakPolarHBondContact O-CB 3.43Å; E211-R214 PolarHBondContact O-N 2.94Å; E212-R214 VanDerWaalsContact C-N 3.26Å; E212-R214 PolarHBondContact O-N 3.15Å; R214-R217 WeakPolarHBondContact O-CB 3.46Å; R214-R217 PolarHBondContact O-N 2.91Å; R214-R218 PolarHBondContact O-N 3.27Å
215	E	68.3	Low	73.3	Confident	135 Å²	135	128.9 Å²	128.9	63%	0.631	55%	0.55	S	S	*	*	H	α-helix	trans	-65.6	-39.3	177.5	-174.3	160.8	-138.7	0	0	112	E211 E212 R217 R218 R219	E211-E215 PolarHBondContact O-N 3.31Å; E212-E215 PolarHBondContact O-N 3.18Å; E215-R217 VanDerWaalsContact C-N 3.26Å; E215-R217 PolarHBondContact O-N 3.29Å; E215-R218 CarbonylContact O-C 3.53Å; E215-R218 WeakPolarHBondContact O-CA 3.36Å; E215-R218 WeakPolarHBondContact O-CB 3.28Å; E215-R218 PolarHBondContact O-N 3.03Å; E215-R219 PolarHBondContact O-N 2.74Å
216	E	70.8	Confident	72.6	Confident	81 Å²	81	131.9 Å²	131.9	38%	0.379	56%	0.559	S	S	.	*	H	α-helix	trans	-58.2	-37.1	172.6	-166.8	-161.7	-155.3	0	0	111.8	E212 R219 R220	E212-E216 VanDerWaalsContact O-CB 3.24Å; E212-E216 WeakPolarHBondContact O-CB 3.24Å; E212-E216 PolarHBondContact O-N 3.23Å; E216-R219 PolarHBondContact O-N 3.15Å; E216-R220 VanDerWaalsContact CD-NE 3.3Å; E216-R220 HydrophobicContact CG-CG 4.49Å; E216-R220 WeakPolarHBondContact O-CB 3.42Å; E216-R220 WeakPolarHBondContact O-CD 3.38Å; E216-R220 WeakPolarHBondContact O-CG 3.19Å; E216-R220 PolarHBondContact O-N 2.87Å; E216-R220 IonicContact OE1-CZ 2.89Å; E216-R220 VanDerWaalsContact OE1-CZ 3.28Å; E216-R220 IonicContact OE1-NE 2.59Å; E216-R220 PolarHBondContact OE1-NE 3.25Å; E216-R220 IonicContact OE1-NH2 3.89Å; E216-R220 PolarHBondContact OE1-NH2 2.97Å; E216-R220 IonicContact OE2-CZ 3.21Å; E216-R220 IonicContact OE2-NE 2.68Å; E216-R220 IonicContact OE2-NH2 2.7Å; E216-R220 PolarHBondContact OE2-NH2 2.94Å
217	R	66.9	Low	71.6	Confident	166 Å²	166	131 Å²	131	63%	0.626	56%	0.557	S	S	*	*	H	α-helix	trans	-64.4	-47.5	173.2	-69	-179.9	174.7	-156.6	-3.7	111	R214 E215 R219 R220 E221	R214-R217 WeakPolarHBondContact O-CB 3.46Å; R214-R217 PolarHBondContact O-N 2.91Å; E215-R217 VanDerWaalsContact C-N 3.26Å; E215-R217 PolarHBondContact O-N 3.29Å; R217-R219 VanDerWaalsContact C-N 3.31Å; R217-R219 PolarHBondContact O-N 2.99Å; R217-R220 PolarHBondContact O-N 3.06Å; R217-E221 WeakPolarHBondContact O-CB 3.32Å; R217-E221 VanDerWaalsContact O-CG 3.29Å; R217-E221 WeakPolarHBondContact O-CG 3.37Å; R217-E221 PolarHBondContact O-N 2.78Å
218	R	69.6	Low	70.8	Confident	181 Å²	181	134 Å²	134	68%	0.683	56%	0.562	S	S	*	*	H	α-helix	trans	-59.2	-40.8	174.6	-70.7	-178.4	167.6	-173	-4.3	111.9	R214 E215 E221 L222	R214-R218 PolarHBondContact O-N 3.27Å; E215-R218 CarbonylContact O-C 3.53Å; E215-R218 WeakPolarHBondContact O-CA 3.36Å; E215-R218 WeakPolarHBondContact O-CB 3.28Å; E215-R218 PolarHBondContact O-N 3.03Å; R218-E221 PolarHBondContact O-N 2.89Å; R218-L222 WeakPolarHBondContact O-CB 3.38Å; R218-L222 VanDerWaalsContact O-CG 3.3Å; R218-L222 WeakPolarHBondContact O-CG 3.35Å; R218-L222 PolarHBondContact O-N 3.42Å
219	R	68.6	Low	70.4	Confident	186 Å²	186	132.9 Å²	132.9	70%	0.702	56%	0.564	S	S	*	*	H	α-helix	trans	-63.8	-46.7	176.2	-169.9	177.3	178.3	-168.2	-0.2	111.7	E215 E216 R217 E221 L222 E223	E215-R219 PolarHBondContact O-N 2.74Å; E216-R219 PolarHBondContact O-N 3.15Å; R217-R219 VanDerWaalsContact C-N 3.31Å; R217-R219 PolarHBondContact O-N 2.99Å; R219-E221 VanDerWaalsContact C-N 3.31Å; R219-E221 PolarHBondContact O-N 3.25Å; R219-L222 PolarHBondContact O-N 3.14Å; R219-E223 WeakPolarHBondContact O-CB 3.22Å; R219-E223 PolarHBondContact O-N 2.97Å
220	R	66.7	Low	69.9	Low	145 Å²	145	133.7 Å²	133.7	55%	0.547	57%	0.565	S	S	.	*	H	α-helix	trans	-65	-31.7	175.3	-69.6	167.6	179.6	-146.5	5.5	112.6	E216 R217 K224	E216-R220 VanDerWaalsContact CD-NE 3.3Å; E216-R220 HydrophobicContact CG-CG 4.49Å; E216-R220 WeakPolarHBondContact O-CB 3.42Å; E216-R220 WeakPolarHBondContact O-CD 3.38Å; E216-R220 WeakPolarHBondContact O-CG 3.19Å; E216-R220 PolarHBondContact O-N 2.87Å; E216-R220 IonicContact OE1-CZ 2.89Å; E216-R220 VanDerWaalsContact OE1-CZ 3.28Å; E216-R220 IonicContact OE1-NE 2.59Å; E216-R220 PolarHBondContact OE1-NE 3.25Å; E216-R220 IonicContact OE1-NH2 3.89Å; E216-R220 PolarHBondContact OE1-NH2 2.97Å; E216-R220 IonicContact OE2-CZ 3.21Å; E216-R220 IonicContact OE2-NE 2.68Å; E216-R220 IonicContact OE2-NH2 2.7Å; E216-R220 PolarHBondContact OE2-NH2 2.94Å; R217-R220 PolarHBondContact O-N 3.06Å; R220-K224 WeakPolarHBondContact O-CG 3.23Å; R220-K224 PolarHBondContact O-N 2.93Å; R220-K224 VanDerWaalsContact O-N 3.14Å
221	E	68.8	Low	69.7	Low	127 Å²	127	132.8 Å²	132.8	59%	0.593	57%	0.568	S	S	*	*	H	α-helix	trans	-72.5	-43.2	173.7	-75.9	164	-167.9	0	0	112	R217 R218 R219 K224 K225	R217-E221 WeakPolarHBondContact O-CB 3.32Å; R217-E221 VanDerWaalsContact O-CG 3.29Å; R217-E221 WeakPolarHBondContact O-CG 3.37Å; R217-E221 PolarHBondContact O-N 2.78Å; R218-E221 PolarHBondContact O-N 2.89Å; R219-E221 VanDerWaalsContact C-N 3.31Å; R219-E221 PolarHBondContact O-N 3.25Å; E221-K224 PolarHBondContact O-N 2.87Å; E221-K225 WeakPolarHBondContact O-CB 3.33Å; E221-K225 PolarHBondContact O-N 3Å
222	L	65.9	Low	69.5	Low	115 Å²	115	134.5 Å²	134.5	60%	0.602	57%	0.574	S	S	*	*	H	α-helix	trans	-63.7	-38.2	173.4	-74	168.5	0	0	0	112	R218 R219 K225 R226	R218-L222 WeakPolarHBondContact O-CB 3.38Å; R218-L222 VanDerWaalsContact O-CG 3.3Å; R218-L222 WeakPolarHBondContact O-CG 3.35Å; R218-L222 PolarHBondContact O-N 3.42Å; R219-L222 PolarHBondContact O-N 3.14Å; L222-K225 WeakPolarHBondContact O-CB 3.34Å; L222-K225 PolarHBondContact O-N 3.46Å; L222-R226 WeakPolarHBondContact O-CB 3.26Å; L222-R226 PolarHBondContact O-N 3.46Å
223	E	69.2	Low	69.1	Low	75 Å²	75	136.8 Å²	136.8	35%	0.35	58%	0.578	S	S	.	*	H	α-helix	trans	-63.4	-45.8	174.2	-168	120.8	-105.1	0	0	111.8	R219 K225 R226 Q227	R219-E223 WeakPolarHBondContact O-CB 3.22Å; R219-E223 PolarHBondContact O-N 2.97Å; E223-K225 VanDerWaalsContact C-N 3.29Å; E223-K225 PolarHBondContact O-N 2.9Å; E223-R226 PolarHBondContact O-N 3.03Å; E223-R226 IonicContact OE1-CZ 2.73Å; E223-R226 IonicContact OE1-NH1 3.82Å; E223-R226 PolarHBondContact OE1-NH1 2.68Å; E223-R226 IonicContact OE1-NH2 2.71Å; E223-R226 PolarHBondContact OE1-NH2 2.8Å; E223-Q227 WeakPolarHBondContact O-CG 3.44Å; E223-Q227 PolarHBondContact O-N 3.18Å
224	K	71.1	Confident	68.9	Low	135 Å²	135	137.4 Å²	137.4	59%	0.587	58%	0.58	S	S	*	*	H	α-helix	trans	-65.2	-30.5	173.5	-75.5	-179.5	176.6	-174.1	0	113	R220 E221 R228	R220-K224 WeakPolarHBondContact O-CG 3.23Å; R220-K224 PolarHBondContact O-N 2.93Å; R220-K224 VanDerWaalsContact O-N 3.14Å; E221-K224 PolarHBondContact O-N 2.87Å; K224-R228 WeakPolarHBondContact O-CG 3.09Å; K224-R228 PolarHBondContact O-N 3Å
225	K	73	Confident	69	Low	130 Å²	130	139.1 Å²	139.1	57%	0.565	59%	0.587	S	S	*	*	H	α-helix	trans	-66.7	-49	170.9	-171.3	-175.1	174.3	-169.5	0	110.3	E221 L222 E223 Q227 R228 E229	E221-K225 WeakPolarHBondContact O-CB 3.33Å; E221-K225 PolarHBondContact O-N 3Å; L222-K225 WeakPolarHBondContact O-CB 3.34Å; L222-K225 PolarHBondContact O-N 3.46Å; E223-K225 VanDerWaalsContact C-N 3.29Å; E223-K225 PolarHBondContact O-N 2.9Å; K225-Q227 PolarHBondContact O-N 2.83Å; K225-R228 PolarHBondContact O-N 3.07Å; K225-E229 WeakPolarHBondContact O-CB 3.39Å; K225-E229 PolarHBondContact O-N 3.3Å
226	R	66.4	Low	69	Low	135 Å²	135	141.6 Å²	141.6	51%	0.509	59%	0.59	S	S	.	*	H	α-helix	trans	-57.3	-45.5	178.3	-162.2	179.6	76.8	-115.3	-2.6	111.8	L222 E223 E229 E230	L222-R226 WeakPolarHBondContact O-CB 3.26Å; L222-R226 PolarHBondContact O-N 3.46Å; E223-R226 PolarHBondContact O-N 3.03Å; E223-R226 IonicContact OE1-CZ 2.73Å; E223-R226 IonicContact OE1-NH1 3.82Å; E223-R226 PolarHBondContact OE1-NH1 2.68Å; E223-R226 IonicContact OE1-NH2 2.71Å; E223-R226 PolarHBondContact OE1-NH2 2.8Å; R226-E229 PolarHBondContact O-N 3.4Å; R226-E230 VanDerWaalsContact O-CB 3.27Å; R226-E230 WeakPolarHBondContact O-CB 3.27Å; R226-E230 PolarHBondContact O-N 3.21Å
227	Q	65.8	Low	69	Low	112 Å²	112	143.7 Å²	143.7	52%	0.523	60%	0.6	S	S	.	*	H	α-helix	trans	-60	-46.2	176.1	-73.5	175	-17.9	0	0	112.8	E223 K225 E229 E230 E231	E223-Q227 WeakPolarHBondContact O-CG 3.44Å; E223-Q227 PolarHBondContact O-N 3.18Å; K225-Q227 PolarHBondContact O-N 2.83Å; Q227-E229 VanDerWaalsContact C-N 3.29Å; Q227-E229 PolarHBondContact O-N 2.87Å; Q227-E230 PolarHBondContact O-N 2.92Å; Q227-E231 VanDerWaalsContact O-CB 3.32Å; Q227-E231 WeakPolarHBondContact O-CB 3.47Å; Q227-E231 PolarHBondContact O-N 2.93Å
228	R	64.6	Low	69	Low	180 Å²	180	140.4 Å²	140.4	68%	0.679	59%	0.592	S	S	*	*	H	α-helix	trans	-67.4	-28.9	177.2	-72.4	171.1	171.7	-177	-4.1	113.4	K224 K225 K232	K224-R228 WeakPolarHBondContact O-CG 3.09Å; K224-R228 PolarHBondContact O-N 3Å; K225-R228 PolarHBondContact O-N 3.07Å; R228-K232 WeakPolarHBondContact O-CB 3.22Å; R228-K232 WeakPolarHBondContact O-CG 3.38Å; R228-K232 PolarHBondContact O-N 3Å; R228-K232 VanDerWaalsContact O-N 3.14Å
229	E	72.6	Confident	69	Low	121 Å²	121	138 Å²	138	57%	0.565	59%	0.588	S	S	*	*	H	α-helix	trans	-77.6	-40	177.3	-172.1	160.2	-169.9	0	0	111.4	K225 R226 Q227 K232 R233	K225-E229 WeakPolarHBondContact O-CB 3.39Å; K225-E229 PolarHBondContact O-N 3.3Å; R226-E229 PolarHBondContact O-N 3.4Å; Q227-E229 VanDerWaalsContact C-N 3.29Å; Q227-E229 PolarHBondContact O-N 2.87Å; E229-K232 PolarHBondContact O-N 2.88Å; E229-R233 WeakPolarHBondContact O-CB 3.48Å; E229-R233 PolarHBondContact O-N 2.73Å
230	E	68.3	Low	69.1	Low	100 Å²	100	138 Å²	138	47%	0.467	59%	0.588	S	S	.	*	H	α-helix	trans	-66.5	-40.3	172.6	-174.8	156.6	-135.2	0	0	112.2	R226 Q227 R233 K234	R226-E230 VanDerWaalsContact O-CB 3.27Å; R226-E230 WeakPolarHBondContact O-CB 3.27Å; R226-E230 PolarHBondContact O-N 3.21Å; Q227-E230 PolarHBondContact O-N 2.92Å; E230-R233 PolarHBondContact O-N 3.38Å; E230-R233 IonicContact OE1-NH2 3.38Å; E230-K234 WeakPolarHBondContact O-CB 3.38Å; E230-K234 PolarHBondContact O-N 3.41Å
231	E	69.4	Low	69.4	Low	137 Å²	137	139.9 Å²	139.9	64%	0.64	60%	0.595	S	S	*	*	H	α-helix	trans	-59.9	-46.6	170.3	-174.1	-173.3	-179.4	0	0	111.6	Q227 R233 K234 R235	Q227-E231 VanDerWaalsContact O-CB 3.32Å; Q227-E231 WeakPolarHBondContact O-CB 3.47Å; Q227-E231 PolarHBondContact O-N 2.93Å; E231-R233 VanDerWaalsContact C-N 3.33Å; E231-R233 PolarHBondContact O-N 3.45Å; E231-K234 PolarHBondContact O-N 2.93Å; E231-R235 PolarHBondContact O-N 2.83Å
232	K	71.8	Confident	69.6	Low	156 Å²	156	139.7 Å²	139.7	68%	0.678	59%	0.592	S	S	*	*	H	α-helix	trans	-61.8	-38	173.2	-84.7	-175.8	173.1	-176.6	0	112.7	R228 E229 R236	R228-K232 WeakPolarHBondContact O-CB 3.22Å; R228-K232 WeakPolarHBondContact O-CG 3.38Å; R228-K232 PolarHBondContact O-N 3Å; R228-K232 VanDerWaalsContact O-N 3.14Å; E229-K232 PolarHBondContact O-N 2.88Å; K232-R236 WeakPolarHBondContact O-CG 3.31Å; K232-R236 PolarHBondContact O-N 3.37Å
233	R	67.5	Low	69.8	Low	158 Å²	158	143.9 Å²	143.9	60%	0.596	60%	0.6	S	S	*	*	H	α-helix	trans	-65.7	-47.9	176.1	-165.8	178.7	74.4	-162.7	-4	110.5	E229 E230 E231 R235 R236 E237	E229-R233 WeakPolarHBondContact O-CB 3.48Å; E229-R233 PolarHBondContact O-N 2.73Å; E230-R233 PolarHBondContact O-N 3.38Å; E230-R233 IonicContact OE1-NH2 3.38Å; E231-R233 VanDerWaalsContact C-N 3.33Å; E231-R233 PolarHBondContact O-N 3.45Å; R233-R235 VanDerWaalsContact C-N 3.34Å; R233-R235 PolarHBondContact O-N 3.22Å; R233-R236 PolarHBondContact O-N 2.85Å; R233-E237 WeakPolarHBondContact O-CB 3.41Å; R233-E237 PolarHBondContact O-N 2.85Å
234	K	74.7	Confident	70	Confident	149 Å²	149	146.8 Å²	146.8	65%	0.648	61%	0.612	S	S	*	*	H	α-helix	trans	-59.2	-41.6	177.6	-169	174.9	-177.8	179.4	0	112	E230 E231 E237 E238	E230-K234 WeakPolarHBondContact O-CB 3.38Å; E230-K234 PolarHBondContact O-N 3.41Å; E231-K234 PolarHBondContact O-N 2.93Å; K234-E237 PolarHBondContact O-N 3.45Å; K234-E238 WeakPolarHBondContact O-CB 3.5Å; K234-E238 PolarHBondContact O-N 3.35Å
235	R	70	Confident	70.1	Confident	197 Å²	197	145.5 Å²	145.5	74%	0.743	61%	0.608	S	S	*	*	H	α-helix	trans	-63.1	-44.1	175.2	-171.3	176.8	177.6	-165.5	-2.2	112.6	E231 R233 E237 E238 E239	E231-R235 PolarHBondContact O-N 2.83Å; R233-R235 VanDerWaalsContact C-N 3.34Å; R233-R235 PolarHBondContact O-N 3.22Å; R235-E237 VanDerWaalsContact C-N 3.3Å; R235-E237 PolarHBondContact O-N 3.36Å; R235-E238 PolarHBondContact O-N 2.7Å; R235-E239 WeakPolarHBondContact O-CB 3.46Å; R235-E239 PolarHBondContact O-N 3.21Å
236	R	67.1	Low	70.1	Confident	188 Å²	188	142.2 Å²	142.2	71%	0.709	61%	0.605	S	S	*	*	H	α-helix	trans	-64.6	-33.5	174.8	-74.7	174.5	167.5	-177.5	-5.1	112.6	K232 R233 R240	K232-R236 WeakPolarHBondContact O-CG 3.31Å; K232-R236 PolarHBondContact O-N 3.37Å; R233-R236 PolarHBondContact O-N 2.85Å; R236-R240 WeakPolarHBondContact O-CG 3.45Å; R236-R240 PolarHBondContact O-N 2.88Å
237	E	70.4	Confident	70.4	Confident	125 Å²	125	140.1 Å²	140.1	58%	0.584	60%	0.601	S	S	*	*	H	α-helix	trans	-74.5	-40.7	178.1	-173.5	163.7	-154.3	0	0	112.1	R233 K234 R235 E239 R240 R241	R233-E237 WeakPolarHBondContact O-CB 3.41Å; R233-E237 PolarHBondContact O-N 2.85Å; K234-E237 PolarHBondContact O-N 3.45Å; R235-E237 VanDerWaalsContact C-N 3.3Å; R235-E237 PolarHBondContact O-N 3.36Å; E237-E239 VanDerWaalsContact C-N 3.34Å; E237-R240 PolarHBondContact O-N 3.3Å; E237-R241 WeakPolarHBondContact O-CB 3.14Å; E237-R241 PolarHBondContact O-N 3.39Å
238	E	68.6	Low	70.9	Confident	96 Å²	96	142 Å²	142	45%	0.449	61%	0.607	S	S	.	*	H	α-helix	trans	-63.2	-38.9	171.3	-165.4	-168.7	141.7	0	0	111.7	K234 R235 R241 K242	K234-E238 WeakPolarHBondContact O-CB 3.5Å; K234-E238 PolarHBondContact O-N 3.35Å; R235-E238 PolarHBondContact O-N 2.7Å; E238-R241 WeakPolarHBondContact O-CB 3.48Å; E238-R241 PolarHBondContact O-N 2.89Å; E238-K242 PolarHBondContact O-N 2.68Å; E238-K242 WeakPolarHBondContact OE1-CE 3.41Å; E238-K242 IonicContact OE1-NZ 2.6Å; E238-K242 PolarHBondContact OE1-NZ 2.91Å
239	E	69.4	Low	71	Confident	132 Å²	132	140 Å²	140	62%	0.617	61%	0.606	S	S	*	*	H	α-helix	trans	-62.1	-44.6	173.1	-172.7	-179	172.8	0	0	111.8	R235 E237 R241 K242 R243	R235-E239 WeakPolarHBondContact O-CB 3.46Å; R235-E239 PolarHBondContact O-N 3.21Å; E237-E239 VanDerWaalsContact C-N 3.34Å; E239-R241 VanDerWaalsContact C-N 3.32Å; E239-R241 PolarHBondContact O-N 2.85Å; E239-K242 PolarHBondContact O-N 2.59Å; E239-R243 WeakPolarHBondContact O-CB 3.4Å; E239-R243 PolarHBondContact O-N 2.94Å
240	R	70.8	Confident	70.9	Confident	184 Å²	184	140.1 Å²	140.1	69%	0.694	60%	0.604	S	S	*	*	H	α-helix	trans	-63	-35.8	171.6	-72.7	-179.8	80.7	-160.5	8.5	112.3	R236 E237 R243 K244	R236-R240 WeakPolarHBondContact O-CG 3.45Å; R236-R240 PolarHBondContact O-N 2.88Å; E237-R240 PolarHBondContact O-N 3.3Å; R240-R243 PolarHBondContact O-N 3.06Å; R240-K244 WeakPolarHBondContact O-CG 3.4Å; R240-K244 PolarHBondContact O-N 3.06Å
241	R	71.8	Confident	71	Confident	186 Å²	186	140.9 Å²	140.9	70%	0.702	61%	0.606	S	S	*	*	H	α-helix	trans	-66.8	-48.5	176.5	-173	173.4	176.2	164.4	-0.9	111.1	E237 E238 E239 R243 K244 E245	E237-R241 WeakPolarHBondContact O-CB 3.14Å; E237-R241 PolarHBondContact O-N 3.39Å; E238-R241 WeakPolarHBondContact O-CB 3.48Å; E238-R241 PolarHBondContact O-N 2.89Å; E239-R241 VanDerWaalsContact C-N 3.32Å; E239-R241 PolarHBondContact O-N 2.85Å; R241-R243 VanDerWaalsContact C-N 3.32Å; R241-R243 PolarHBondContact O-N 2.93Å; R241-K244 PolarHBondContact O-N 3.49Å; R241-E245 WeakPolarHBondContact O-CB 3.4Å; R241-E245 PolarHBondContact O-N 2.85Å
242	K	73.3	Confident	70.5	Confident	122 Å²	122	139.4 Å²	139.4	53%	0.53	60%	0.602	S	S	.	*	H	α-helix	trans	-60	-38.4	173.8	-80.3	173.1	170.8	160	0	112.3	E238 E239 E245 A246	E238-K242 PolarHBondContact O-N 2.68Å; E238-K242 WeakPolarHBondContact OE1-CE 3.41Å; E238-K242 IonicContact OE1-NZ 2.6Å; E238-K242 PolarHBondContact OE1-NZ 2.91Å; E239-K242 PolarHBondContact O-N 2.59Å; K242-E245 PolarHBondContact O-N 2.89Å; K242-A246 WeakPolarHBondContact O-CB 3.24Å; K242-A246 PolarHBondContact O-N 3.46Å
243	R	69.3	Low	70	Confident	203 Å²	203	134.4 Å²	134.4	77%	0.766	59%	0.587	S	S	*	*	H	α-helix	trans	-64.5	-43.7	173.6	-169.5	172.3	178.5	179	-0.9	112.3	E239 R240 R241 E245 E247	E239-R243 WeakPolarHBondContact O-CB 3.4Å; E239-R243 PolarHBondContact O-N 2.94Å; R240-R243 PolarHBondContact O-N 3.06Å; R241-R243 VanDerWaalsContact C-N 3.32Å; R241-R243 PolarHBondContact O-N 2.93Å; R243-E245 VanDerWaalsContact C-N 3.29Å; R243-E245 PolarHBondContact O-N 3.23Å; R243-E247 VanDerWaalsContact O-CB 3.3Å; R243-E247 WeakPolarHBondContact O-CB 3.28Å; R243-E247 PolarHBondContact O-N 2.95Å
244	K	75.2	Confident	69.8	Low	136 Å²	136	129.9 Å²	129.9	59%	0.591	57%	0.574	S	S	*	*	H	α-helix	trans	-64.4	-30.9	173.1	-75.9	-175.4	173.7	-168.6	0	112.9	R240 R241 K248	R240-K244 WeakPolarHBondContact O-CG 3.4Å; R240-K244 PolarHBondContact O-N 3.06Å; R241-K244 PolarHBondContact O-N 3.49Å; K244-K248 WeakPolarHBondContact O-CG 3.29Å; K244-K248 PolarHBondContact O-N 3.27Å
245	E	71.9	Confident	69.3	Low	109 Å²	109	129.1 Å²	129.1	51%	0.509	57%	0.571	S	S	.	*	H	α-helix	trans	-77.7	-42.1	179.4	-171	157.5	-142.1	0	0	112.1	R241 K242 R243 E247 K248 Q249	R241-E245 WeakPolarHBondContact O-CB 3.4Å; R241-E245 PolarHBondContact O-N 2.85Å; K242-E245 PolarHBondContact O-N 2.89Å; R243-E245 VanDerWaalsContact C-N 3.29Å; R243-E245 PolarHBondContact O-N 3.23Å; E245-E247 VanDerWaalsContact C-N 3.31Å; E245-E247 PolarHBondContact O-N 2.96Å; E245-K248 WeakPolarHBondContact O-CB 3.4Å; E245-K248 PolarHBondContact O-N 3.37Å; E245-Q249 PolarHBondContact O-N 2.85Å
246	A	74.1	Confident	68.7	Low	60 Å²	60	124.7 Å²	124.7	50%	0.496	56%	0.562	S	S	.	*	H	α-helix	trans	-62.5	-37.4	168.2	0	0	0	0	0	111.8	K242 Q249 K250	K242-A246 WeakPolarHBondContact O-CB 3.24Å; K242-A246 PolarHBondContact O-N 3.46Å; A246-Q249 PolarHBondContact O-N 3.34Å; A246-K250 WeakPolarHBondContact O-CB 3.45Å; A246-K250 PolarHBondContact O-N 3.09Å
247	E	72.6	Confident	68.2	Low	91 Å²	91	121 Å²	121	43%	0.425	56%	0.556	S	S	.	*	H	α-helix	trans	-65.4	-38.1	172.3	-167.3	-162.1	137.4	0	0	111.9	R243 E245 K250 K251	R243-E247 VanDerWaalsContact O-CB 3.3Å; R243-E247 WeakPolarHBondContact O-CB 3.28Å; R243-E247 PolarHBondContact O-N 2.95Å; E245-E247 VanDerWaalsContact C-N 3.31Å; E245-E247 PolarHBondContact O-N 2.96Å; E247-K250 PolarHBondContact O-N 3.08Å; E247-K251 HydrophobicContact CG-CD 4.34Å; E247-K251 VanDerWaalsContact O-CB 3.31Å; E247-K251 WeakPolarHBondContact O-CB 3.43Å; E247-K251 VanDerWaalsContact O-CG 3.31Å; E247-K251 WeakPolarHBondContact O-CG 3.45Å; E247-K251 PolarHBondContact O-N 3.43Å; E247-K251 WeakPolarHBondContact OE1-CE 3.41Å; E247-K251 IonicContact OE1-NZ 2.66Å; E247-K251 PolarHBondContact OE1-NZ 3.35Å
248	K	74.9	Confident	67.4	Low	151 Å²	151	122.2 Å²	122.2	66%	0.657	56%	0.559	S	S	*	*	H	α-helix	trans	-64	-44.9	171.3	-81.8	-176.7	176.2	-169.2	0	112.1	K244 E245 K251 L252	K244-K248 WeakPolarHBondContact O-CG 3.29Å; K244-K248 PolarHBondContact O-N 3.27Å; E245-K248 WeakPolarHBondContact O-CB 3.4Å; E245-K248 PolarHBondContact O-N 3.37Å; K248-K251 CarbonylContact O-C 3.47Å; K248-K251 PolarHBondContact O-N 3.27Å; K248-L252 WeakPolarHBondContact O-CG 3.26Å; K248-L252 PolarHBondContact O-N 2.92Å
249	Q	67.3	Low	66.7	Low	139 Å²	139	124.1 Å²	124.1	65%	0.65	57%	0.571	S	S	*	*	H	α-helix	trans	-64.4	-39.7	175.7	-74.4	-166.3	-9	0	0	111.7	E245 A246 K251 L252 S253	E245-Q249 PolarHBondContact O-N 2.85Å; A246-Q249 PolarHBondContact O-N 3.34Å; Q249-K251 VanDerWaalsContact C-N 3.35Å; Q249-K251 PolarHBondContact O-N 3.28Å; Q249-L252 WeakPolarHBondContact O-CB 3.3Å; Q249-L252 PolarHBondContact O-N 2.96Å; Q249-S253 PolarHBondContact O-N 3.4Å
250	K	71.3	Confident	65.9	Low	123 Å²	123	126.9 Å²	126.9	54%	0.535	58%	0.581	S	S	.	*	H	α-helix	trans	-63.4	-40	171.6	-157.6	-153.6	175.1	-130.8	0	111.9	A246 E247 L252 S253 D254	A246-K250 WeakPolarHBondContact O-CB 3.45Å; A246-K250 PolarHBondContact O-N 3.09Å; E247-K250 PolarHBondContact O-N 3.08Å; K250-L252 PolarHBondContact O-N 2.82Å; K250-S253 WeakPolarHBondContact CA-OG 3.19Å; K250-S253 PolarHBondContact O-N 2.91Å; K250-S253 PolarHBondContact O-OG 2.84Å; K250-S253 VanDerWaalsContact O-OG 3.07Å; K250-D254 WeakPolarHBondContact CE-OD1 3.47Å; K250-D254 VanDerWaalsContact CE-OD2 3.26Å; K250-D254 WeakPolarHBondContact CE-OD2 3.42Å; K250-D254 IonicContact NZ-OD1 3.52Å; K250-D254 IonicContact NZ-OD2 2.74Å; K250-D254 PolarHBondContact NZ-OD2 3.03Å; K250-D254 WeakPolarHBondContact O-CB 3.4Å; K250-D254 VanDerWaalsContact O-CG 3.23Å; K250-D254 PolarHBondContact O-N 3.37Å
251	K	69.9	Low	64.9	Low	117 Å²	117	124.8 Å²	124.8	51%	0.509	58%	0.582	S	S	.	*	H	α-helix	trans	-68.9	-11.7	173.6	-77.2	172.6	169.6	173.6	0	113.8	E247 K248 Q249 K255	E247-K251 HydrophobicContact CG-CD 4.34Å; E247-K251 VanDerWaalsContact O-CB 3.31Å; E247-K251 WeakPolarHBondContact O-CB 3.43Å; E247-K251 VanDerWaalsContact O-CG 3.31Å; E247-K251 WeakPolarHBondContact O-CG 3.45Å; E247-K251 PolarHBondContact O-N 3.43Å; E247-K251 WeakPolarHBondContact OE1-CE 3.41Å; E247-K251 IonicContact OE1-NZ 2.66Å; E247-K251 PolarHBondContact OE1-NZ 3.35Å; K248-K251 CarbonylContact O-C 3.47Å; K248-K251 PolarHBondContact O-N 3.27Å; Q249-K251 VanDerWaalsContact C-N 3.35Å; Q249-K251 PolarHBondContact O-N 3.28Å; K251-K255 VanDerWaalsContact O-CD 3.28Å; K251-K255 WeakPolarHBondContact O-CD 3.48Å; K251-K255 WeakPolarHBondContact O-CG 3.33Å
252	L	59.3	Low	63.4	Low	105 Å²	105	122.9 Å²	122.9	55%	0.55	59%	0.585	S	S	.	*	H	α-helix	trans	-88.6	-49.1	167.3	-70	167.3	0	0	0	110.4	K248 Q249 K250 D254 K255 D256	K248-L252 WeakPolarHBondContact O-CG 3.26Å; K248-L252 PolarHBondContact O-N 2.92Å; Q249-L252 WeakPolarHBondContact O-CB 3.3Å; Q249-L252 PolarHBondContact O-N 2.96Å; K250-L252 PolarHBondContact O-N 2.82Å; L252-D254 VanDerWaalsContact C-N 3.35Å; L252-D254 PolarHBondContact O-N 3.19Å; L252-K255 CarbonylContact O-C 3.53Å; L252-K255 WeakPolarHBondContact O-CA 3.42Å; L252-K255 VanDerWaalsContact O-CB 3.31Å; L252-K255 WeakPolarHBondContact O-CB 3.35Å; L252-K255 PolarHBondContact O-N 3.26Å; L252-D256 PolarHBondContact O-N 3.06Å
253	S	61.2	Low	61.7	Low	51 Å²	51	125.1 Å²	125.1	36%	0.357	60%	0.595	S	S	.	*	H	α-helix	trans	-62.5	-38.6	176	64.7	0	0	0	0	113.1	Q249 K250 K255 D256 I257	Q249-S253 PolarHBondContact O-N 3.4Å; K250-S253 WeakPolarHBondContact CA-OG 3.19Å; K250-S253 PolarHBondContact O-N 2.91Å; K250-S253 PolarHBondContact O-OG 2.84Å; K250-S253 VanDerWaalsContact O-OG 3.07Å; S253-K255 PolarHBondContact O-N 2.9Å; S253-D256 PolarHBondContact O-N 3.25Å; S253-I257 WeakPolarHBondContact O-CB 3.5Å; S253-I257 WeakPolarHBondContact O-CD1 3.32Å; S253-I257 WeakPolarHBondContact O-CG1 3.36Å; S253-I257 PolarHBondContact O-N 2.84Å
254	D	63.3	Low	60.2	Low	64 Å²	64	123.8 Å²	123.8	34%	0.342	60%	0.595	S	S	.	*	H	α-helix	trans	-65.9	-25.5	173.8	-71.6	-10	0	0	0	110.7	K250 L252 K258	K250-D254 WeakPolarHBondContact CE-OD1 3.47Å; K250-D254 VanDerWaalsContact CE-OD2 3.26Å; K250-D254 WeakPolarHBondContact CE-OD2 3.42Å; K250-D254 IonicContact NZ-OD1 3.52Å; K250-D254 IonicContact NZ-OD2 2.74Å; K250-D254 PolarHBondContact NZ-OD2 3.03Å; K250-D254 WeakPolarHBondContact O-CB 3.4Å; K250-D254 VanDerWaalsContact O-CG 3.23Å; K250-D254 PolarHBondContact O-N 3.37Å; L252-D254 VanDerWaalsContact C-N 3.35Å; L252-D254 PolarHBondContact O-N 3.19Å; D254-K258 WeakPolarHBondContact O-CB 3.39Å; D254-K258 PolarHBondContact O-N 2.83Å
255	K	63.8	Low	58.2	Low	133 Å²	133	122 Å²	122	58%	0.578	60%	0.599	S	S	*	*	H	α-helix	trans	-77.4	-41.9	170.1	-77.6	175.2	-176.1	-172.1	0	112.2	K251 L252 S253 I257 K258 I259	K251-K255 VanDerWaalsContact O-CD 3.28Å; K251-K255 WeakPolarHBondContact O-CD 3.48Å; K251-K255 WeakPolarHBondContact O-CG 3.33Å; L252-K255 CarbonylContact O-C 3.53Å; L252-K255 WeakPolarHBondContact O-CA 3.42Å; L252-K255 VanDerWaalsContact O-CB 3.31Å; L252-K255 WeakPolarHBondContact O-CB 3.35Å; L252-K255 PolarHBondContact O-N 3.26Å; S253-K255 PolarHBondContact O-N 2.9Å; K255-I257 VanDerWaalsContact C-N 3.28Å; K255-I257 PolarHBondContact O-N 3.23Å; K255-K258 CarbonylContact O-C 3.5Å; K255-K258 PolarHBondContact O-N 3.03Å; K255-K258 VanDerWaalsContact O-N 3.1Å; K255-I259 WeakPolarHBondContact O-CG1 3.27Å; K255-I259 PolarHBondContact O-N 3.19Å
256	D	56.5	Low	56.4	Low	104 Å²	104	124 Å²	124	56%	0.556	61%	0.613	S	S	*	*	H	α-helix	trans	-64	-34.8	175.3	-63.3	-35.9	0	0	0	111.9	L252 S253	L252-D256 PolarHBondContact O-N 3.06Å; S253-D256 PolarHBondContact O-N 3.25Å
257	I	58.2	Low	54.6	Low	111 Å²	111	131.2 Å²	131.2	57%	0.569	63%	0.628	S	S	*	*	H	α-helix	trans	-68.6	-43.8	169.8	-67.3	163.4	0	0	0	110.4	S253 K255 I259 K260 L261	S253-I257 WeakPolarHBondContact O-CB 3.5Å; S253-I257 WeakPolarHBondContact O-CD1 3.32Å; S253-I257 WeakPolarHBondContact O-CG1 3.36Å; S253-I257 PolarHBondContact O-N 2.84Å; K255-I257 VanDerWaalsContact C-N 3.28Å; K255-I257 PolarHBondContact O-N 3.23Å; I257-I259 VanDerWaalsContact C-N 3.3Å; I257-I259 PolarHBondContact O-N 3.23Å; I257-K260 WeakPolarHBondContact O-CA 3.41Å; I257-K260 WeakPolarHBondContact O-CB 3.33Å; I257-K260 PolarHBondContact O-N 2.74Å; I257-L261 PolarHBondContact O-N 3.21Å
258	K	53.4	Low	52.8	Low	150 Å²	150	132.9 Å²	132.9	65%	0.652	64%	0.639	S	S	*	*	H	α-helix	trans	-68.1	-24.1	177.8	-170	166.3	-175.9	171.6	0	113.6	D254 K255 K260 L261	D254-K258 WeakPolarHBondContact O-CB 3.39Å; D254-K258 PolarHBondContact O-N 2.83Å; K255-K258 CarbonylContact O-C 3.5Å; K255-K258 PolarHBondContact O-N 3.03Å; K255-K258 VanDerWaalsContact O-N 3.1Å; K258-K260 PolarHBondContact O-N 2.93Å; K258-L261 CarbonylContact O-C 3.59Å; K258-L261 PolarHBondContact O-N 2.9Å; K258-L261 VanDerWaalsContact O-O 3.13Å
259	I	53.8	Low	50.9	Low	136 Å²	136	132.8 Å²	132.8	70%	0.697	65%	0.646	S	S	*	*	H	α-helix	trans	-66.2	-23.9	169.1	-74	164.4	0	0	0	111.3	K255 I257	K255-I259 WeakPolarHBondContact O-CG1 3.27Å; K255-I259 PolarHBondContact O-N 3.19Å; I257-I259 VanDerWaalsContact C-N 3.3Å; I257-I259 PolarHBondContact O-N 3.23Å
260	K	51.6	Low	49.4	Very low	190 Å²	190	132.7 Å²	132.7	83%	0.826	65%	0.65	S	S	*	*	H	α-helix	trans	-93.3	-11.2	172.3	-67.3	-176.8	178.2	178.8	0	114.5	I257 K258	I257-K260 WeakPolarHBondContact O-CA 3.41Å; I257-K260 WeakPolarHBondContact O-CB 3.33Å; I257-K260 PolarHBondContact O-N 2.74Å; K258-K260 PolarHBondContact O-N 2.93Å
261	L	50.8	Low	47.9	Very low	139 Å²	139	132.2 Å²	132.2	73%	0.728	66%	0.657	S	S	*	*	S	Bend	trans	-116.6	91.1	176.9	-149.5	77.4	0	0	0	111.6	I257 K258	I257-L261 PolarHBondContact O-N 3.21Å; K258-L261 CarbonylContact O-C 3.59Å; K258-L261 PolarHBondContact O-N 2.9Å; K258-L261 VanDerWaalsContact O-O 3.13Å
262	L	40	Very low	46.1	Very low	147 Å²	147	133.5 Å²	133.5	77%	0.77	67%	0.67	S	S	*	*			trans	-65.8	148.7	-172.2	-166.2	73.8	0	0	0	114
263	K	37.5	Very low	45	Very low	169 Å²	169	133.9 Å²	133.9	74%	0.735	68%	0.681	S	S	*	*			trans	87.2	137.1	155.8	-129.2	86	173.8	-176.2	0	118.6
264	K	38.4	Very low	43.6	Very low	175 Å²	175	137.5 Å²	137.5	76%	0.761	70%	0.696	S	S	*	*			trans	74	110.6	164.2	-60.2	-170.1	-178.2	-174.1	0	115.1
265	S	32.3	Very low	42.1	Very low	97 Å²	97	143.7 Å²	143.7	68%	0.678	72%	0.715	S	S	*	*				72.2	136.8	74	72.7	0	0	0	0	112.8
266	D	33.5	Very low	40.7	Very low	151 Å²	151	144.5 Å²	144.5	81%	0.807	72%	0.723	S	S	*	*			cis	-162	175.8	1.1	-127.4	-49.9	0	0	0	111.5
267	R	37.7	Very low	39.4	Very low	213 Å²	213	146.6 Å²	146.6	80%	0.804	73%	0.727	S	S	*	*			trans	68.4	117.3	165.8	-72	-177.3	155.5	162.7	-6	122.1
268	D	33.2	Very low	38	Very low	125 Å²	125	148.4 Å²	148.4	67%	0.668	73%	0.733	S	S	*	*				48.8	122.4	103.6	-43	-17.2	0	0	0	118.4
269	D	35.6	Very low	36.8	Very low	150 Å²	150	150 Å²	150	80%	0.802	74%	0.74	S	S	*	*				83.2	139.7	59.9	-75.1	-7.2	0	0	0	112.6
270	D	37.3	Very low	35.6	Very low	137 Å²	137	149 Å²	149	73%	0.733	75%	0.745	S	S	*	*			cis	-160.7	-173.7	-5.2	-151.8	-12.6	0	0	0	111.3
271	V	38.6	Very low	34.7	Very low	112 Å²	112	148.7 Å²	148.7	68%	0.679	75%	0.747	S	S	*	*			trans	46.9	111	147.3	168.1	0	0	0	0	118.5
272	D	32.4	Very low	34.1	Very low	145 Å²	145	148.2 Å²	148.2	78%	0.775	75%	0.752	S	S	*	*				66	116.9	60.7	-166.2	16.3	0	0	0	116
273	S	35.8	Very low	33.4	Very low	113 Å²	113	146.8 Å²	146.8	79%	0.79	75%	0.753	S	S	*	*			trans	177.7	116.1	149.5	-85.2	0	0	0	0	116.4
274	D	32.4	Very low	32.8	Very low	126 Å²	126	146.3 Å²	146.3	67%	0.674	76%	0.758	S	S	*	*				73	148.3	122.7	-152.4	29.7	0	0	0	124.6
275	R	31	Very low	32.4	Very low	194 Å²	194	142.3 Å²	142.3	73%	0.732	76%	0.758	S	S	*	*			trans	47	128.6	158	-86.4	166.9	-160.9	-153.9	-3.7	120.9
276	M	34.6	Very low	32.2	Very low	150 Å²	150	141.4 Å²	141.4	74%	0.739	76%	0.764	S	S	*	*				-158.9	145.5	67.8	-80.4	-60.6	172.8	0	0	108.9
277	K	29.6	Very low	32	Very low	149 Å²	149	141.7 Å²	141.7	65%	0.648	77%	0.771	S	S	*	*				86.4	123.3	54.7	-175.7	-174.6	165.3	-173.5	0	113.8
278	E	27.6	Very low	31.7	Very low	149 Å²	149	135 Å²	135	70%	0.696	77%	0.768	S	S	*	*			trans	64.6	163.1	167	-80.5	172	-173	0	0	117.2
279	K	28.9	Very low	31.5	Very low	184 Å²	184	137.5 Å²	137.5	80%	0.8	77%	0.773	S	S	*	*			cis	176.2	107.2	-33	166.4	-169.9	171	-172.3	0	108.2
280	S	28.9	Very low	31.2	Very low	115 Å²	115	142.5 Å²	142.5	80%	0.804	78%	0.781	S	S	*	*			trans	-167.3	132.9	166.2	40	0	0	0	0	113
281	E	32.1	Very low	30.8	Very low	183 Å²	183	142.4 Å²	142.4	86%	0.855	78%	0.776	S	S	*	*			trans	-92.2	160.3	140.8	-62.9	-176.9	124.5	0	0	107
282	P	38.8	Very low	30.6	Very low	128 Å²	128	145.4 Å²	145.4	83%	0.831	78%	0.78	S	S	*	*				-139.9	177.1	93	38.6	-25.3	0	0	0	114.2
283	C	25.2	Very low	30.4	Very low	118 Å²	118	145.7 Å²	145.7	80%	0.797	79%	0.787	S	S	*	*			trans	-75	155.5	-176.7	-51.8	0	0	0	0	114.5
284	D	25.9	Very low	29.9	Very low	158 Å²	158	143.9 Å²	143.9	85%	0.845	79%	0.787	S	S	*	*				142.3	161.6	113.2	-165.4	39.3	0	0	0	114.8
285	A	28.6	Very low	29.7	Very low	92 Å²	92	142 Å²	142	76%	0.76	80%	0.796	S	S	*	*			trans	68.5	135.1	168.5	0	0	0	0	0	118.2
286	G	29	Very low	29.6	Very low	78 Å²	78	141.2 Å²	141.2	80%	0.804	80%	0.801	S	S	*	*			trans	161.7	49.6	176.2	0	0	0	0	0	117.6	G288	G286-G288 PolarHBondContact O-N 3.4Å
287	V	29.3	Very low	29.3	Very low	156 Å²	156	142.2 Å²	142.2	95%	0.945	81%	0.806	S	S	*	*			trans	-72.1	112	172.6	175.9	0	0	0	0	110.2
288	G	30.7	Very low	29.3	Very low	73 Å²	73	143.9 Å²	143.9	75%	0.753	81%	0.814	S	S	*	*			trans	-133.5	78.9	-174.1	0	0	0	0	0	114.5	G286	G286-G288 PolarHBondContact O-N 3.4Å
289	K	30.2	Very low	29.3	Very low	177 Å²	177	141.8 Å²	141.8	77%	0.77	82%	0.815	S	S	*	*			trans	-85.2	113.9	176.7	170.8	-155.2	171.5	-173.3	0	111.2
290	W	28.9	Very low	29.4	Very low	255 Å²	255	142.3 Å²	142.3	97%	0.966	82%	0.817	S	S	*	*			trans	-128.7	148.3	162.9	-69.5	-25.1	0	0	0	112
291	E	27.4	Very low	29.6	Very low	136 Å²	136	143.8 Å²	143.8	64%	0.636	81%	0.812	S	S	*	*			trans	-114.2	154.5	-178.5	-98.8	-163.4	92.7	0	0	113.5
292	K	34.8	Very low	30.2	Very low	174 Å²	174	141.2 Å²	141.2	76%	0.757	81%	0.811	S	S	*	*			trans	9.6	124.7	152.1	-55.9	170	-170.2	136.9	0	118.9
293	T	28.4	Very low	30.1	Very low	151 Å²	151	142.9 Å²	142.9	93%	0.926	81%	0.805	S	S	*	*				-173.3	163.7	114.1	23.1	0	0	0	0	107.4
294	G	25.6	Very low	30.4	Very low	76 Å²	76	146.8 Å²	146.8	78%	0.784	81%	0.811	S	S	*	*			cis	168.6	152.8	-4.3	0	0	0	0	0	108
295	G	27.3	Very low	30.8	Very low	85 Å²	85	149 Å²	149	88%	0.876	81%	0.814	S	S	*	*			trans	146.3	137.4	175.3	0	0	0	0	0	115.7
296	Q	29.3	Very low	31.5	Very low	179 Å²	179	148.4 Å²	148.4	84%	0.836	82%	0.816	S	S	*	*			trans	-149.8	136.4	-175.3	174.7	-172.8	8.9	0	0	107.5
297	M	28.4	Very low	32.2	Very low	171 Å²	171	153.2 Å²	153.2	84%	0.842	82%	0.818	S	S	*	*			trans	173.9	121.1	137.3	-95.8	175.7	84.1	0	0	116.3
298	K	30.5	Very low	33.1	Very low	184 Å²	184	149.9 Å²	149.9	80%	0.8	81%	0.806	S	S	*	*			trans	19.2	142	143.3	-64.2	-172.7	173.7	-178.1	0	124.8
299	S	27	Very low	33.8	Very low	105 Å²	105	154.4 Å²	154.4	73%	0.734	81%	0.808	S	S	*	*			trans	83.8	153.8	140.2	79.2	0	0	0	0	118.6
300	K	31	Very low	34.8	Very low	194 Å²	194	149.6 Å²	149.6	84%	0.843	80%	0.797	S	S	*	*			cis	-135.6	167.4	13.2	-66.9	175.3	178.9	174.9	0	113.5
301	E	32.3	Very low	35.9	Very low	147 Å²	147	142.7 Å²	142.7	69%	0.687	78%	0.779	S	S	*	*			trans	-68.2	167.8	160	-74.4	-173	120.9	0	0	111.9
302	P	45.9	Very low	37.1	Very low	129 Å²	129	143.5 Å²	143.5	84%	0.838	78%	0.78	S	S	*	*				-125.4	162.4	101.2	37.6	-34.4	0	0	0	114.4
303	K	35.4	Very low	37.9	Very low	162 Å²	162	142.5 Å²	142.5	70%	0.704	78%	0.778	S	S	*	*			trans	-94.9	155.6	179.1	-68.6	175.8	177.4	172.1	0	112.4
304	E	31.8	Very low	39.2	Very low	200 Å²	200	141.6 Å²	141.6	94%	0.935	76%	0.763	S	S	*	*			trans	-136.3	167.4	139.8	-133.6	171.1	-164.5	0	0	110.9
305	K	35.1	Very low	40.6	Very low	206 Å²	206	147.1 Å²	147.1	90%	0.896	76%	0.76	S	S	*	*			trans	-113.8	137.7	-165.7	-59.5	171.1	-177.9	170.7	0	111
306	G	42.7	Very low	42	Very low	79 Å²	79	148.4 Å²	148.4	81%	0.814	75%	0.748	S	S	*	*			trans	176.4	9.3	171.9	0	0	0	0	0	121.9
307	Q	45.1	Very low	43.3	Very low	179 Å²	179	144.8 Å²	144.8	84%	0.836	73%	0.731	S	S	*	*			trans	-150.3	92	-179.8	-107	169.7	-6.7	0	0	112.3
308	A	47.8	Very low	44.5	Very low	85 Å²	85	142.5 Å²	142.5	70%	0.702	72%	0.717	S	S	*	*	S	Bend	trans	-110.2	-17.8	-172.8	0	0	0	0	0	115.7
309	E	45.9	Very low	45.9	Very low	169 Å²	169	135.6 Å²	135.6	79%	0.79	70%	0.698	S	S	*	*	S	Bend	trans	-101.7	-46.7	-174.7	-64.6	-162.9	116.8	0	0	113.9	D311 K312	E309-D311 PolarHBondContact O-N 2.82Å; E309-D311 VanDerWaalsContact O-N 3.12Å; E309-K312 PolarHBondContact O-N 3.21Å; E309-K312 VanDerWaalsContact O-N 3.16Å
310	S	50	Low	47.4	Very low	75 Å²	75	139.5 Å²	139.5	52%	0.524	70%	0.697	S	S	.	*	H	α-helix	trans	-59.4	-27.9	-177.1	-172.3	0	0	0	0	113.9	K312	S310-K312 PolarHBondContact O-N 3.43Å
311	D	51.5	Low	48.6	Very low	111 Å²	111	137.5 Å²	137.5	59%	0.594	68%	0.684	S	S	*	*	H	α-helix	trans	-75	-22.7	-177	-157.7	45.4	0	0	0	113.1	E309 R315	E309-D311 PolarHBondContact O-N 2.82Å; E309-D311 VanDerWaalsContact O-N 3.12Å; D311-R315 VanDerWaalsContact O-CB 3.31Å; D311-R315 WeakPolarHBondContact O-CB 3.46Å; D311-R315 PolarHBondContact O-N 2.9Å; D311-R315 VanDerWaalsContact O-N 3.15Å
312	K	54.4	Low	49.9	Very low	153 Å²	153	135 Å²	135	67%	0.665	67%	0.673	S	S	*	*	H	α-helix	trans	-67.2	-50.3	178.1	-78.2	-178.3	177.5	172.8	0	112.2	E309 S310 Q314 R315 D316	E309-K312 PolarHBondContact O-N 3.21Å; E309-K312 VanDerWaalsContact O-N 3.16Å; S310-K312 PolarHBondContact O-N 3.43Å; K312-Q314 VanDerWaalsContact C-N 3.35Å; K312-Q314 PolarHBondContact O-N 2.84Å; K312-R315 PolarHBondContact O-N 2.6Å; K312-D316 PolarHBondContact O-N 3.41Å
313	E	51.4	Low	50.4	Low	153 Å²	153	137.3 Å²	137.3	72%	0.715	67%	0.665	S	S	*	*	H	α-helix	trans	-64	-40.4	-177.8	-69.7	-156.6	124.2	0	0	112.2	R315 D316 Q317	E313-R315 VanDerWaalsContact C-N 3.33Å; E313-R315 PolarHBondContact O-N 3.44Å; E313-D316 PolarHBondContact O-N 3.4Å; E313-Q317 WeakPolarHBondContact O-CB 3.45Å; E313-Q317 PolarHBondContact O-N 2.78Å
314	Q	54.9	Low	51.5	Low	131 Å²	131	134.8 Å²	134.8	61%	0.612	66%	0.659	S	S	*	*	H	α-helix	trans	-62	-42.6	175.9	-65.8	-163.7	47.7	0	0	111.2	K312 Q317 H318	K312-Q314 VanDerWaalsContact C-N 3.35Å; K312-Q314 PolarHBondContact O-N 2.84Å; Q314-Q317 PolarHBondContact O-N 3.06Å; Q314-H318 WeakPolarHBondContact O-CB 3.44Å; Q314-H318 PolarHBondContact O-N 3.28Å
315	R	55.5	Low	52.9	Low	192 Å²	192	132.7 Å²	132.7	73%	0.725	65%	0.647	S	S	*	*	H	α-helix	trans	-64.1	-42.5	179.9	-164	171.5	-168.7	-133	2.2	112.7	D311 K312 E313 H318 G319	D311-R315 VanDerWaalsContact O-CB 3.31Å; D311-R315 WeakPolarHBondContact O-CB 3.46Å; D311-R315 PolarHBondContact O-N 2.9Å; D311-R315 VanDerWaalsContact O-N 3.15Å; K312-R315 PolarHBondContact O-N 2.6Å; E313-R315 VanDerWaalsContact C-N 3.33Å; E313-R315 PolarHBondContact O-N 3.44Å; R315-H318 PolarHBondContact O-N 3.34Å; R315-G319 PolarHBondContact O-N 2.86Å
316	D	55.9	Low	54.3	Low	113 Å²	113	127.1 Å²	127.1	60%	0.604	63%	0.627	S	S	*	*	H	α-helix	trans	-71.4	-36.9	177.5	-82.3	-16.4	0	0	0	112.8	K312 E313 H318 G319 R320	K312-D316 PolarHBondContact O-N 3.41Å; E313-D316 PolarHBondContact O-N 3.4Å; D316-H318 VanDerWaalsContact C-N 3.32Å; D316-H318 PolarHBondContact O-N 3.29Å; D316-G319 PolarHBondContact O-N 2.86Å; D316-R320 WeakPolarHBondContact O-CG 3.49Å; D316-R320 PolarHBondContact O-N 2.65Å
317	Q	56.3	Low	55.2	Low	103 Å²	103	128.9 Å²	128.9	48%	0.481	61%	0.613	S	S	.	*	H	α-helix	trans	-64.1	-38.7	172.5	-121.8	-175	92.5	0	0	111.7	E313 Q314 R321	E313-Q317 WeakPolarHBondContact O-CB 3.45Å; E313-Q317 PolarHBondContact O-N 2.78Å; Q314-Q317 PolarHBondContact O-N 3.06Å; Q317-R321 WeakPolarHBondContact O-CG 3.48Å; Q317-R321 PolarHBondContact O-N 3.2Å; Q317-R321 VanDerWaalsContact OE1-CZ 3.31Å
318	H	54.5	Low	56.1	Low	122 Å²	122	129.8 Å²	129.8	57%	0.565	61%	0.609	S	S	*	*	H	α-helix	trans	-69.8	-39.7	175.6	-144.1	-74.4	0	0	0	111.6	Q314 R315 D316 R321 Q322	Q314-H318 WeakPolarHBondContact O-CB 3.44Å; Q314-H318 PolarHBondContact O-N 3.28Å; R315-H318 PolarHBondContact O-N 3.34Å; D316-H318 VanDerWaalsContact C-N 3.32Å; D316-H318 PolarHBondContact O-N 3.29Å; H318-R321 PolarHBondContact O-N 3.22Å; H318-Q322 WeakPolarHBondContact O-CB 3.5Å; H318-Q322 PolarHBondContact O-N 2.9Å
319	G	58.9	Low	57	Low	39 Å²	39	127.7 Å²	127.7	40%	0.402	60%	0.596	S	S	.	*	H	α-helix	trans	-60.9	-43.7	176.8	0	0	0	0	0	113.5	R315 D316 Q322 R323	R315-G319 PolarHBondContact O-N 2.86Å; D316-G319 PolarHBondContact O-N 2.86Å; G319-Q322 WeakPolarHBondContact O-CB 3.44Å; G319-Q322 PolarHBondContact O-N 2.87Å; G319-R323 PolarHBondContact O-N 3.38Å
320	R	58.3	Low	58	Low	188 Å²	188	125.8 Å²	125.8	71%	0.709	59%	0.585	S	S	*	*	H	α-helix	trans	-63.2	-47.8	174.2	-67.8	-178.9	-169.8	-123	4.5	111.6	D316 Q322 R323 D324	D316-R320 WeakPolarHBondContact O-CG 3.49Å; D316-R320 PolarHBondContact O-N 2.65Å; R320-Q322 VanDerWaalsContact C-N 3.27Å; R320-Q322 PolarHBondContact O-N 2.77Å; R320-R323 PolarHBondContact O-N 3.23Å; R320-R323 VanDerWaalsContact O-N 3.13Å; R320-D324 PolarHBondContact O-N 3.36Å
321	R	57.8	Low	58.8	Low	152 Å²	152	125.8 Å²	125.8	57%	0.574	58%	0.579	S	S	*	*	H	α-helix	trans	-61.6	-31.7	176.9	-72.3	176.8	179.8	139.8	9.9	113.4	Q317 H318 K325	Q317-R321 WeakPolarHBondContact O-CG 3.48Å; Q317-R321 PolarHBondContact O-N 3.2Å; Q317-R321 VanDerWaalsContact OE1-CZ 3.31Å; H318-R321 PolarHBondContact O-N 3.22Å; R321-K325 PolarHBondContact O-N 3.13Å
322	Q	58.5	Low	59.6	Low	95 Å²	95	124.1 Å²	124.1	44%	0.444	57%	0.568	S	S	.	*	H	α-helix	trans	-66.5	-51.6	172.2	-160.9	85.2	3.1	0	0	110.3	H318 G319 R320 D324 K325 D326	H318-Q322 WeakPolarHBondContact O-CB 3.5Å; H318-Q322 PolarHBondContact O-N 2.9Å; G319-Q322 WeakPolarHBondContact O-CB 3.44Å; G319-Q322 PolarHBondContact O-N 2.87Å; R320-Q322 VanDerWaalsContact C-N 3.27Å; R320-Q322 PolarHBondContact O-N 2.77Å; Q322-D324 VanDerWaalsContact C-N 3.32Å; Q322-D324 PolarHBondContact O-N 2.88Å; Q322-K325 VanDerWaalsContact O-CB 3.31Å; Q322-K325 WeakPolarHBondContact O-CB 3.44Å; Q322-K325 PolarHBondContact O-N 2.88Å; Q322-K325 VanDerWaalsContact O-N 3.08Å; Q322-D326 VanDerWaalsContact O-CG 3.32Å; Q322-D326 PolarHBondContact O-N 2.75Å
323	R	56.1	Low	60.5	Low	177 Å²	177	122.1 Å²	122.1	67%	0.668	56%	0.561	S	S	*	*	H	α-helix	trans	-60.2	-39.4	-177.6	-157	178.3	-142.6	-150.1	6.4	112.6	G319 R320 D326 H327	G319-R323 PolarHBondContact O-N 3.38Å; R320-R323 PolarHBondContact O-N 3.23Å; R320-R323 VanDerWaalsContact O-N 3.13Å; R323-D326 PolarHBondContact O-N 3.14Å; R323-H327 PolarHBondContact O-N 2.89Å; R323-H327 PolarHBondContact O-ND1 3.41Å
324	D	58.8	Low	61.4	Low	108 Å²	108	122 Å²	122	58%	0.578	55%	0.554	S	S	*	*	H	α-helix	trans	-67.9	-38.5	175.8	-70	-21.2	0	0	0	112.3	R320 Q322 D326 R328	R320-D324 PolarHBondContact O-N 3.36Å; Q322-D324 VanDerWaalsContact C-N 3.32Å; Q322-D324 PolarHBondContact O-N 2.88Å; D324-D326 VanDerWaalsContact C-N 3.35Å; D324-R328 VanDerWaalsContact O-CB 3.25Å; D324-R328 WeakPolarHBondContact O-CB 3.38Å; D324-R328 PolarHBondContact O-N 2.93Å
325	K	62.3	Low	62.4	Low	157 Å²	157	121.4 Å²	121.4	68%	0.683	55%	0.549	S	S	*	.	H	α-helix	trans	-59.5	-45.6	171.8	-99	179.1	175.9	176.9	0	111.3	R321 Q322 R328 G329	R321-K325 PolarHBondContact O-N 3.13Å; Q322-K325 VanDerWaalsContact O-CB 3.31Å; Q322-K325 WeakPolarHBondContact O-CB 3.44Å; Q322-K325 PolarHBondContact O-N 2.88Å; Q322-K325 VanDerWaalsContact O-N 3.08Å; K325-R328 PolarHBondContact O-N 2.84Å; K325-G329 PolarHBondContact O-N 3.34Å
326	D	63.3	Low	63.3	Low	89 Å²	89	120.8 Å²	120.8	48%	0.476	55%	0.547	S	S	.	.	H	α-helix	trans	-68.9	-38.2	-176.4	-62.3	-26.3	0	0	0	112.1	Q322 R323 D324 G329 K330	Q322-D326 VanDerWaalsContact O-CG 3.32Å; Q322-D326 PolarHBondContact O-N 2.75Å; R323-D326 PolarHBondContact O-N 3.14Å; D324-D326 VanDerWaalsContact C-N 3.35Å; D326-G329 PolarHBondContact O-N 3.22Å; D326-K330 WeakPolarHBondContact O-CG 3.37Å; D326-K330 PolarHBondContact O-N 3.27Å
327	H	61.1	Low	64.1	Low	115 Å²	115	121 Å²	121	53%	0.532	54%	0.544	S	S	.	.	H	α-helix	trans	-66.1	-46.2	173.2	-76.4	72.7	0	0	0	111.4	R323 G329 K330 D331	R323-H327 PolarHBondContact O-N 2.89Å; R323-H327 PolarHBondContact O-ND1 3.41Å; H327-G329 VanDerWaalsContact C-N 3.28Å; H327-G329 PolarHBondContact O-N 3.42Å; H327-K330 PolarHBondContact O-N 3.42Å; H327-D331 PolarHBondContact O-N 2.94Å
328	R	64.2	Low	65	Low	198 Å²	198	124.3 Å²	124.3	75%	0.747	55%	0.552	S	S	*	*	H	α-helix	trans	-64.6	-32.8	178	-159	172.2	-167.1	162.5	4.5	112.2	D324 K325 E332	D324-R328 VanDerWaalsContact O-CB 3.25Å; D324-R328 WeakPolarHBondContact O-CB 3.38Å; D324-R328 PolarHBondContact O-N 2.93Å; K325-R328 PolarHBondContact O-N 2.84Å; R328-E332 WeakPolarHBondContact O-CG 3.45Å; R328-E332 PolarHBondContact O-N 3.25Å; R328-E332 VanDerWaalsContact O-N 3.08Å
329	G	66.8	Low	66	Low	41 Å²	41	125.1 Å²	125.1	42%	0.423	56%	0.556	S	S	.	*	H	α-helix	trans	-63.8	-49.6	171	0	0	0	0	0	112.5	K325 D326 H327 D331 E332 E333	K325-G329 PolarHBondContact O-N 3.34Å; D326-G329 PolarHBondContact O-N 3.22Å; H327-G329 VanDerWaalsContact C-N 3.28Å; H327-G329 PolarHBondContact O-N 3.42Å; G329-D331 VanDerWaalsContact C-N 3.33Å; G329-D331 PolarHBondContact O-N 3.41Å; G329-E332 PolarHBondContact O-N 3.18Å; G329-E333 PolarHBondContact O-N 3.22Å
330	K	67.1	Low	67.1	Low	129 Å²	129	129.6 Å²	129.6	56%	0.561	57%	0.566	S	S	*	*	H	α-helix	trans	-63	-35.1	177.9	-74.3	177.6	179.1	-178.3	0	113.1	D326 H327 E333 R334	D326-K330 WeakPolarHBondContact O-CG 3.37Å; D326-K330 PolarHBondContact O-N 3.27Å; H327-K330 PolarHBondContact O-N 3.42Å; K330-E333 PolarHBondContact O-N 2.85Å; K330-R334 WeakPolarHBondContact O-CB 3.4Å; K330-R334 WeakPolarHBondContact O-CD 3.47Å; K330-R334 VanDerWaalsContact O-CG 3.25Å; K330-R334 WeakPolarHBondContact O-CG 3.47Å; K330-R334 PolarHBondContact O-N 2.73Å
331	D	66.6	Low	68.2	Low	75 Å²	75	128.1 Å²	128.1	40%	0.401	56%	0.562	S	S	.	*	H	α-helix	trans	-74.9	-32.9	174.9	-79.4	-18.6	0	0	0	113.3	H327 G329 E333 R334 K335	H327-D331 PolarHBondContact O-N 2.94Å; G329-D331 VanDerWaalsContact C-N 3.33Å; G329-D331 PolarHBondContact O-N 3.41Å; D331-E333 VanDerWaalsContact C-N 3.34Å; D331-R334 VanDerWaalsContact OD1-CD 3.28Å; D331-R334 WeakPolarHBondContact OD1-CD 3.3Å; D331-R334 IonicContact OD1-CZ 2.69Å; D331-R334 IonicContact OD1-NE 2.62Å; D331-R334 IonicContact OD1-NH1 2.65Å; D331-R334 PolarHBondContact OD1-NH1 2.71Å; D331-K335 VanDerWaalsContact O-CG 3.26Å; D331-K335 WeakPolarHBondContact O-CG 3.48Å; D331-K335 PolarHBondContact O-N 3.26Å
332	E	69.2	Low	69.2	Low	77 Å²	77	126.2 Å²	126.2	36%	0.36	56%	0.559	S	S	.	*	H	α-helix	trans	-66.6	-35.9	168.2	-74.9	-60.7	126.6	0	0	112.1	R328 G329 K335 R336	R328-E332 WeakPolarHBondContact O-CG 3.45Å; R328-E332 PolarHBondContact O-N 3.25Å; R328-E332 VanDerWaalsContact O-N 3.08Å; G329-E332 PolarHBondContact O-N 3.18Å; E332-K335 PolarHBondContact O-N 2.94Å; E332-K335 WeakPolarHBondContact OE1-CD 3.44Å; E332-K335 IonicContact OE1-NZ 3.92Å; E332-K335 PolarHBondContact OE1-NZ 3.28Å; E332-R336 VanDerWaalsContact O-CG 3.25Å; E332-R336 WeakPolarHBondContact O-CG 3.41Å; E332-R336 PolarHBondContact O-N 3.35Å
333	E	72.3	Confident	70.2	Confident	110 Å²	110	127.2 Å²	127.2	51%	0.514	56%	0.562	S	S	.	*	H	α-helix	trans	-65	-47.1	172.8	-177.4	169.7	-143.4	0	0	112	G329 K330 D331 K335 R336 Q337	G329-E333 PolarHBondContact O-N 3.22Å; K330-E333 PolarHBondContact O-N 2.85Å; D331-E333 VanDerWaalsContact C-N 3.34Å; E333-K335 VanDerWaalsContact C-N 3.3Å; E333-K335 PolarHBondContact O-N 3.4Å; E333-R336 WeakPolarHBondContact O-CB 3.4Å; E333-R336 PolarHBondContact O-N 3.14Å; E333-R336 VanDerWaalsContact O-N 3.1Å; E333-Q337 WeakPolarHBondContact O-CG 3.37Å; E333-Q337 PolarHBondContact O-N 2.86Å
334	R	71.3	Confident	71.3	Confident	152 Å²	152	121.3 Å²	121.3	57%	0.574	54%	0.544	S	S	*	.	H	α-helix	trans	-57.4	-39.7	172.9	-73.9	161.8	171.5	172.3	-4.5	112.5	K330 D331 R338	K330-R334 WeakPolarHBondContact O-CB 3.4Å; K330-R334 WeakPolarHBondContact O-CD 3.47Å; K330-R334 VanDerWaalsContact O-CG 3.25Å; K330-R334 WeakPolarHBondContact O-CG 3.47Å; K330-R334 PolarHBondContact O-N 2.73Å; D331-R334 VanDerWaalsContact OD1-CD 3.28Å; D331-R334 WeakPolarHBondContact OD1-CD 3.3Å; D331-R334 IonicContact OD1-CZ 2.69Å; D331-R334 IonicContact OD1-NE 2.62Å; D331-R334 IonicContact OD1-NH1 2.65Å; D331-R334 PolarHBondContact OD1-NH1 2.71Å; R334-R338 WeakPolarHBondContact O-CB 3.26Å; R334-R338 PolarHBondContact O-N 2.73Å
335	K	75.5	Confident	72.2	Confident	117 Å²	117	121.5 Å²	121.5	51%	0.509	54%	0.54	S	S	.	.	H	α-helix	trans	-64.1	-43.9	173.7	-73.6	171.8	-161.5	172.8	0	111.8	D331 E332 E333 R338 H339	D331-K335 VanDerWaalsContact O-CG 3.26Å; D331-K335 WeakPolarHBondContact O-CG 3.48Å; D331-K335 PolarHBondContact O-N 3.26Å; E332-K335 PolarHBondContact O-N 2.94Å; E332-K335 WeakPolarHBondContact OE1-CD 3.44Å; E332-K335 IonicContact OE1-NZ 3.92Å; E332-K335 PolarHBondContact OE1-NZ 3.28Å; E333-K335 VanDerWaalsContact C-N 3.3Å; E333-K335 PolarHBondContact O-N 3.4Å; K335-R338 PolarHBondContact O-N 2.83Å; K335-H339 WeakPolarHBondContact O-CB 3.46Å; K335-H339 PolarHBondContact O-N 3.45Å
336	R	75.3	Confident	73.1	Confident	180 Å²	180	119.6 Å²	119.6	68%	0.679	53%	0.532	S	S	*	.	H	α-helix	trans	-62.2	-43.8	176.4	-69.9	165.3	-168.5	-163.5	2.6	111.6	E332 E333 H339 H340	E332-R336 VanDerWaalsContact O-CG 3.25Å; E332-R336 WeakPolarHBondContact O-CG 3.41Å; E332-R336 PolarHBondContact O-N 3.35Å; E333-R336 WeakPolarHBondContact O-CB 3.4Å; E333-R336 PolarHBondContact O-N 3.14Å; E333-R336 VanDerWaalsContact O-N 3.1Å; R336-H339 PolarHBondContact O-N 2.86Å; R336-H340 WeakPolarHBondContact O-CB 3.45Å; R336-H340 PolarHBondContact O-N 3.35Å
337	Q	71.5	Confident	73.6	Confident	118 Å²	118	117.9 Å²	117.9	55%	0.551	52%	0.521	S	S	*	.	H	α-helix	trans	-62.8	-43.4	175.6	-69.7	175.7	4.1	0	0	111.8	E333 H340 Y341	E333-Q337 WeakPolarHBondContact O-CG 3.37Å; E333-Q337 PolarHBondContact O-N 2.86Å; Q337-H340 PolarHBondContact O-N 3.29Å; Q337-Y341 WeakPolarHBondContact O-CB 3.36Å; Q337-Y341 PolarHBondContact O-N 3.45Å
338	R	75.1	Confident	74.1	Confident	172 Å²	172	119.9 Å²	119.9	65%	0.649	52%	0.524	S	S	*	.	H	α-helix	trans	-59.2	-47.9	171.6	-83.4	-177.3	167	-89.1	-0.3	112.4	R334 K335 H340 Y341 E342	R334-R338 WeakPolarHBondContact O-CB 3.26Å; R334-R338 PolarHBondContact O-N 2.73Å; K335-R338 PolarHBondContact O-N 2.83Å; R338-H340 VanDerWaalsContact C-N 3.3Å; R338-H340 PolarHBondContact O-N 3.05Å; R338-Y341 PolarHBondContact O-N 2.91Å; R338-E342 WeakPolarHBondContact O-CB 3.44Å; R338-E342 WeakPolarHBondContact O-CG 3.43Å; R338-E342 PolarHBondContact O-N 2.98Å
339	H	75.9	Confident	74	Confident	138 Å²	138	116.6 Å²	116.6	64%	0.639	51%	0.512	S	S	*	.	H	α-helix	trans	-68.6	-30.1	-177.9	-159.8	-50.8	0	0	0	112.3	K335 R336 F343	K335-H339 WeakPolarHBondContact O-CB 3.46Å; K335-H339 PolarHBondContact O-N 3.45Å; R336-H339 PolarHBondContact O-N 2.86Å; H339-F343 VanDerWaalsContact O-CB 3.26Å; H339-F343 WeakPolarHBondContact O-CB 3.47Å; H339-F343 PolarHBondContact O-N 3.23Å
340	H	82.8	Confident	74	Confident	133 Å²	133	119.1 Å²	119.1	62%	0.616	51%	0.511	S	S	*	.	H	α-helix	trans	-69.3	-45.8	170.6	-177.6	61.7	0	0	0	111.3	R336 Q337 R338 E342 F343 D344	R336-H340 WeakPolarHBondContact O-CB 3.45Å; R336-H340 PolarHBondContact O-N 3.35Å; Q337-H340 PolarHBondContact O-N 3.29Å; R338-H340 VanDerWaalsContact C-N 3.3Å; R338-H340 PolarHBondContact O-N 3.05Å; H340-E342 PolarHBondContact O-N 3.19Å; H340-F343 PolarHBondContact O-N 3.47Å; H340-D344 WeakPolarHBondContact O-CB 3.41Å; H340-D344 PolarHBondContact O-N 3.44Å
341	Y	80.6	Confident	73.5	Confident	157 Å²	157	116.1 Å²	116.1	62%	0.616	50%	0.501	S	S	*	.	H	α-helix	trans	-63.7	-38.3	175.8	-178.1	-99.5	0	0	0	113	Q337 R338 K345	Q337-Y341 WeakPolarHBondContact O-CB 3.36Å; Q337-Y341 PolarHBondContact O-N 3.45Å; R338-Y341 PolarHBondContact O-N 2.91Å; Y341-K345 HydrophobicContact CE1-CD 4.47Å; Y341-K345 WeakPolarHBondContact O-CB 3.4Å; Y341-K345 PolarHBondContact O-N 3.27Å
342	E	78.7	Confident	73	Confident	112 Å²	112	118.6 Å²	118.6	52%	0.523	51%	0.511	S	S	.	.	H	α-helix	trans	-70.3	-35	175.1	-75.3	175.7	-168.7	0	0	112.4	R338 H340 F346	R338-E342 WeakPolarHBondContact O-CB 3.44Å; R338-E342 WeakPolarHBondContact O-CG 3.43Å; R338-E342 PolarHBondContact O-N 2.98Å; H340-E342 PolarHBondContact O-N 3.19Å; E342-F346 WeakPolarHBondContact O-CB 3.42Å; E342-F346 PolarHBondContact O-N 2.82Å
343	F	79.9	Confident	72.5	Confident	116 Å²	116	120.7 Å²	120.7	51%	0.509	53%	0.528	S	S	.	.	H	α-helix	trans	-66.3	-44.4	171.6	-179.3	-93.3	0	0	0	111.9	H339 H340 F346 M347	H339-F343 VanDerWaalsContact O-CB 3.26Å; H339-F343 WeakPolarHBondContact O-CB 3.47Å; H339-F343 PolarHBondContact O-N 3.23Å; H340-F343 PolarHBondContact O-N 3.47Å; F343-F346 WeakPolarHBondContact O-CA 3.31Å; F343-F346 WeakPolarHBondContact O-CB 3.36Å; F343-F346 PolarHBondContact O-N 2.86Å; F343-M347 HydrophobicContact CD1-CG 4.31Å; F343-M347 HydrophobicContact CE1-CG 3.89Å; F343-M347 HydrophobicContact CZ-CG 4.19Å; F343-M347 HydrophobicContact CZ-SD 4.49Å; F343-M347 PolarHBondContact O-N 3.46Å
344	D	79.5	Confident	71.6	Confident	54 Å²	54	122.9 Å²	122.9	29%	0.289	54%	0.536	S	S	.	.	H	α-helix	trans	-65.4	-41.4	177.2	-165.4	67.8	0	0	0	111.5	H340 F346 M347 R348	H340-D344 WeakPolarHBondContact O-CB 3.41Å; H340-D344 PolarHBondContact O-N 3.44Å; D344-F346 PolarHBondContact O-N 2.88Å; D344-M347 PolarHBondContact O-N 2.91Å; D344-R348 WeakPolarHBondContact O-CG 3.2Å; D344-R348 PolarHBondContact O-N 3.2Å; D344-R348 IonicContact OD2-CZ 3.35Å; D344-R348 IonicContact OD2-NE 3.15Å; D344-R348 PolarHBondContact OD2-NE 2.86Å; D344-R348 IonicContact OD2-NH2 2.63Å; D344-R348 PolarHBondContact OD2-NH2 2.83Å
345	K	78	Confident	70.4	Confident	112 Å²	112	126.6 Å²	126.6	49%	0.487	55%	0.55	S	S	.	*	H	α-helix	trans	-66.2	-17.7	170.4	-173.3	176.8	177.2	-178.3	0	113.4	Y341 R349	Y341-K345 HydrophobicContact CE1-CD 4.47Å; Y341-K345 WeakPolarHBondContact O-CB 3.4Å; Y341-K345 PolarHBondContact O-N 3.27Å; K345-R349 PolarHBondContact O-NE 3.44Å; K345-R349 PolarHBondContact O-NH2 3Å
346	F	80	Confident	69.2	Low	117 Å²	117	124.2 Å²	124.2	51%	0.513	56%	0.559	S	S	.	*	H	α-helix	trans	-82.9	-44.4	170.1	173.5	-98.7	0	0	0	111	E342 F343 D344 R349 K350	E342-F346 WeakPolarHBondContact O-CB 3.42Å; E342-F346 PolarHBondContact O-N 2.82Å; F343-F346 WeakPolarHBondContact O-CA 3.31Å; F343-F346 WeakPolarHBondContact O-CB 3.36Å; F343-F346 PolarHBondContact O-N 2.86Å; D344-F346 PolarHBondContact O-N 2.88Å; F346-R349 PolarHBondContact O-N 3.46Å; F346-K350 HydrophobicContact CE1-CD 4.47Å; F346-K350 WeakPolarHBondContact O-CB 3.28Å; F346-K350 PolarHBondContact O-N 3.18Å
347	M	74.6	Confident	67.7	Low	52 Å²	52	125.7 Å²	125.7	26%	0.256	57%	0.57	S	S	.	*	H	α-helix	trans	-58	-51.1	175	-76	-63.4	-55.5	0	0	112.2	F343 D344 R349 K350 D351	F343-M347 HydrophobicContact CD1-CG 4.31Å; F343-M347 HydrophobicContact CE1-CG 3.89Å; F343-M347 HydrophobicContact CZ-CG 4.19Å; F343-M347 HydrophobicContact CZ-SD 4.49Å; F343-M347 PolarHBondContact O-N 3.46Å; D344-M347 PolarHBondContact O-N 2.91Å; M347-R349 VanDerWaalsContact C-N 3.33Å; M347-R349 PolarHBondContact O-N 3.48Å; M347-K350 WeakPolarHBondContact O-CA 3.2Å; M347-K350 WeakPolarHBondContact O-CB 3.19Å; M347-K350 PolarHBondContact O-N 3.49Å; M347-K350 HydrophobicContact SD-CD 4.01Å; M347-D351 VanDerWaalsContact O-CG 3.32Å; M347-D351 PolarHBondContact O-N 3.41Å
348	R	71.2	Confident	66.5	Low	157 Å²	157	123.6 Å²	123.6	59%	0.592	58%	0.581	S	S	*	*	H	α-helix	trans	-53.9	-45.6	179	-65.3	178.4	-160.5	-140.8	3.2	112.9	D344 K350 D351 E352	D344-R348 WeakPolarHBondContact O-CG 3.2Å; D344-R348 PolarHBondContact O-N 3.2Å; D344-R348 IonicContact OD2-CZ 3.35Å; D344-R348 IonicContact OD2-NE 3.15Å; D344-R348 PolarHBondContact OD2-NE 2.86Å; D344-R348 IonicContact OD2-NH2 2.63Å; D344-R348 PolarHBondContact OD2-NH2 2.83Å; R348-K350 PolarHBondContact O-N 3.07Å; R348-D351 PolarHBondContact O-N 2.66Å; R348-E352 WeakPolarHBondContact O-CB 3.31Å; R348-E352 WeakPolarHBondContact O-CG 3.49Å; R348-E352 PolarHBondContact O-N 3.48Å
349	R	63.1	Low	64.5	Low	130 Å²	130	126.1 Å²	126.1	49%	0.491	59%	0.592	S	S	.	*	H	α-helix	trans	-66.2	-35	175.3	-81.9	177.9	-68.4	151.6	4	113.8	K345 F346 M347 D351 E352 T353	K345-R349 PolarHBondContact O-NE 3.44Å; K345-R349 PolarHBondContact O-NH2 3Å; F346-R349 PolarHBondContact O-N 3.46Å; M347-R349 VanDerWaalsContact C-N 3.33Å; M347-R349 PolarHBondContact O-N 3.48Å; R349-D351 VanDerWaalsContact C-N 3.35Å; R349-E352 WeakPolarHBondContact CA-OE2 3.46Å; R349-T353 WeakPolarHBondContact O-CB 3.31Å; R349-T353 PolarHBondContact O-N 2.92Å; R349-T353 VanDerWaalsContact O-N 3.09Å; R349-T353 PolarHBondContact O-OG1 3.37Å
350	K	65.4	Low	62.5	Low	94 Å²	94	124.7 Å²	124.7	41%	0.409	60%	0.596	S	S	.	*	H	α-helix	trans	-66.7	-39	175.3	178.7	-165.8	174.5	-162.6	0	110.8	F346 M347 R348 T353 K354	F346-K350 HydrophobicContact CE1-CD 4.47Å; F346-K350 WeakPolarHBondContact O-CB 3.28Å; F346-K350 PolarHBondContact O-N 3.18Å; M347-K350 WeakPolarHBondContact O-CA 3.2Å; M347-K350 WeakPolarHBondContact O-CB 3.19Å; M347-K350 PolarHBondContact O-N 3.49Å; M347-K350 HydrophobicContact SD-CD 4.01Å; R348-K350 PolarHBondContact O-N 3.07Å; K350-T353 PolarHBondContact O-N 2.87Å; K350-K354 PolarHBondContact O-N 3.2Å; K350-K354 VanDerWaalsContact O-N 3.11Å
351	D	56.5	Low	60.4	Low	66 Å²	66	127.9 Å²	127.9	35%	0.353	61%	0.611	S	S	.	*	H	α-helix	trans	-79.1	-37.3	-178.3	-59.3	-33.2	0	0	0	111.8	M347 R348 R349 T353 K354 W355	M347-D351 VanDerWaalsContact O-CG 3.32Å; M347-D351 PolarHBondContact O-N 3.41Å; R348-D351 PolarHBondContact O-N 2.66Å; R349-D351 VanDerWaalsContact C-N 3.35Å; D351-T353 VanDerWaalsContact C-N 3.25Å; D351-T353 PolarHBondContact O-N 2.74Å; D351-K354 PolarHBondContact O-N 2.89Å; D351-W355 PolarHBondContact O-N 3.07Å; D351-W355 VanDerWaalsContact O-N 3.07Å
352	E	57.4	Low	58.6	Low	127 Å²	127	128.1 Å²	128.1	59%	0.593	62%	0.623	S	S	*	*	H	α-helix	trans	-52.4	-43.2	164.1	-75.7	162.4	-168.5	0	0	111.4	R348 R349 K354 G356	R348-E352 WeakPolarHBondContact O-CB 3.31Å; R348-E352 WeakPolarHBondContact O-CG 3.49Å; R348-E352 PolarHBondContact O-N 3.48Å; R349-E352 WeakPolarHBondContact CA-OE2 3.46Å; E352-K354 VanDerWaalsContact C-N 3.31Å; E352-K354 PolarHBondContact O-N 2.95Å; E352-G356 WeakPolarHBondContact O-CA 3.17Å; E352-G356 PolarHBondContact O-N 2.94Å
353	T	57.7	Low	56.4	Low	120 Å²	120	134.3 Å²	134.3	74%	0.736	64%	0.642	S	S	*	*	H	α-helix	trans	-73.3	-20.7	178.2	-50.1	0	0	0	0	112.9	R349 K350 D351	R349-T353 WeakPolarHBondContact O-CB 3.31Å; R349-T353 PolarHBondContact O-N 2.92Å; R349-T353 VanDerWaalsContact O-N 3.09Å; R349-T353 PolarHBondContact O-OG1 3.37Å; K350-T353 PolarHBondContact O-N 2.87Å; D351-T353 VanDerWaalsContact C-N 3.25Å; D351-T353 PolarHBondContact O-N 2.74Å
354	K	54.4	Low	54.3	Low	156 Å²	156	133.2 Å²	133.2	68%	0.678	65%	0.654	S	S	*	*	H	α-helix	trans	-88.5	-31.1	179.9	-90.2	-163	163.4	-152.8	0	114.7	K350 D351 E352	K350-K354 PolarHBondContact O-N 3.2Å; K350-K354 VanDerWaalsContact O-N 3.11Å; D351-K354 PolarHBondContact O-N 2.89Å; E352-K354 VanDerWaalsContact C-N 3.31Å; E352-K354 PolarHBondContact O-N 2.95Å
355	W	45.6	Very low	52.1	Low	230 Å²	230	140.9 Å²	140.9	87%	0.871	69%	0.685	S	S	*	*	H	α-helix	trans	-109.3	-6.7	-180	-67	93.9	0	0	0	113.7	D351 K357	D351-W355 PolarHBondContact O-N 3.07Å; D351-W355 VanDerWaalsContact O-N 3.07Å; W355-K357 PolarHBondContact O-N 3.18Å
356	G	49.9	Very low	50.1	Low	67 Å²	67	143.9 Å²	143.9	69%	0.691	70%	0.698	S	S	*	*	S	Bend	trans	-77.3	27.6	-177.4	0	0	0	0	0	116.9	E352	E352-G356 WeakPolarHBondContact O-CA 3.17Å; E352-G356 PolarHBondContact O-N 2.94Å
357	K	43	Very low	47.7	Very low	211 Å²	211	145.6 Å²	145.6	92%	0.917	71%	0.708	S	S	*	*	S	Bend	trans	-151.1	83.3	178.3	-151.9	176.1	-172.2	-175.6	0	114.5	W355	W355-K357 PolarHBondContact O-N 3.18Å
358	G	46.2	Very low	45.7	Very low	74 Å²	74	146.7 Å²	146.7	76%	0.763	73%	0.732	S	S	*	*	S	Bend	trans	114.7	66.8	159.7	0	0	0	0	0	116.9
359	Y	34.8	Very low	43.9	Very low	225 Å²	225	148 Å²	148	88%	0.882	75%	0.745	S	S	*	*			trans	-152.6	162.3	150.8	-149	-114.6	0	0	0	111.3
360	C	33	Very low	42.3	Very low	109 Å²	109	150.1 Å²	150.1	74%	0.736	76%	0.76	S	S	*	*			trans	59.9	78.4	178.7	-66	0	0	0	0	117.3
361	Q	39.5	Very low	40.6	Very low	200 Å²	200	155 Å²	155	94%	0.935	78%	0.783	S	S	*	*			trans	-132.7	53.3	142.1	-158.2	-172.7	46.8	0	0	111.2
362	D	42	Very low	39.1	Very low	161 Å²	161	156.3 Å²	156.3	86%	0.861	80%	0.798	S	S	*	*			trans	-146	76	175.5	-144.4	-22	0	0	0	113.1
363	R	32.9	Very low	37.7	Very low	243 Å²	243	160 Å²	160	92%	0.917	81%	0.808	S	S	*	*	S	Bend	trans	-159.3	118.9	150.7	-148.8	166.2	-177.5	152.4	0.6	111.9
364	A	35.5	Very low	36.4	Very low	92 Å²	92	159.6 Å²	159.6	76%	0.76	81%	0.81	S	S	*	*			trans	50.4	92.9	157.8	0	0	0	0	0	118.8
365	K	33.3	Very low	35	Very low	215 Å²	215	161.6 Å²	161.6	94%	0.935	82%	0.815	S	S	*	*			trans	-122.1	96.3	133.7	-87.4	-164.1	172.1	-172.1	0	109.7
366	K	36.3	Very low	34.2	Very low	176 Å²	176	154.8 Å²	154.8	77%	0.765	80%	0.801	S	S	*	*			trans	-80.6	136.1	165.7	-163.3	175.4	-165.4	-87.8	0	108.3
367	E	29.7	Very low	34.7	Very low	153 Å²	153	156.7 Å²	156.7	72%	0.715	80%	0.801	S	S	*	*			trans	26.3	115.9	157.8	-63.5	163.2	146	0	0	119.1
368	G	31.3	Very low	34	Very low	75 Å²	75	154.5 Å²	154.5	77%	0.773	80%	0.8	S	S	*	*			trans	-100.5	105.1	157.1	0	0	0	0	0	110.3
369	H	33.8	Very low	33.2	Very low	185 Å²	185	154 Å²	154	86%	0.856	80%	0.795	S	S	*	*			trans	-148.6	84.1	172.7	-113	57.8	0	0	0	111.3
370	H	29.9	Very low	33	Very low	174 Å²	174	147.5 Å²	147.5	81%	0.806	79%	0.787	S	S	*	*			trans	-165.9	124	138	-126.3	-112.1	0	0	0	110.7
371	H	29.4	Very low	32.9	Very low	196 Å²	196	149.1 Å²	149.1	91%	0.907	79%	0.788	S	S	*	*			trans	-129.2	94.8	156.8	-155.8	-35	0	0	0	105.8
372	S	25.9	Very low	32.8	Very low	94 Å²	94	148.8 Å²	148.8	66%	0.657	78%	0.784	S	S	*	*			trans	-119.1	151.7	174.5	-171.1	0	0	0	0	109.1
373	Y	28	Very low	32.2	Very low	203 Å²	203	150 Å²	150	80%	0.796	79%	0.787	S	S	*	*			trans	-123.1	120.1	-164.8	169.2	-88.3	0	0	0	109.4
374	S	28.9	Very low	32.1	Very low	113 Å²	113	141.9 Å²	141.9	79%	0.79	78%	0.779	S	S	*	*			trans	-150.3	120.3	170.9	58.6	0	0	0	0	112.6
375	Y	26.4	Very low	32.1	Very low	198 Å²	198	147.7 Å²	147.7	78%	0.776	79%	0.787	S	S	*	*			trans	-54.5	163.7	155	-128.4	-145.7	0	0	0	110.5
376	C	28.6	Very low	32.1	Very low	86 Å²	86	146.1 Å²	146.1	58%	0.581	78%	0.783	S	S	*	*			cis	-153.9	-143.3	3.6	-152.5	0	0	0	0	111.6
377	P	59.3	Low	32	Very low	107 Å²	107	144.3 Å²	144.3	70%	0.695	78%	0.781	S	S	*	*			trans	-119.9	174.5	-136.9	43.9	-26.1	0	0	0	116.2
378	D	28.2	Very low	32.2	Very low	166 Å²	166	146.2 Å²	146.2	89%	0.888	78%	0.782	S	S	*	*				-175.9	176.5	119.3	-139.7	-46.5	0	0	0	110.7
379	G	30.6	Very low	32.4	Very low	64 Å²	64	150 Å²	150	66%	0.66	78%	0.78	S	S	*	*			trans	119.2	65.6	150.4	0	0	0	0	0	120.8
380	A	29.6	Very low	32.5	Very low	87 Å²	87	147.4 Å²	147.4	72%	0.719	77%	0.772	S	S	*	*			trans	37.7	118.5	142.9	0	0	0	0	0	123.5
381	D	31.3	Very low	32.9	Very low	143 Å²	143	148 Å²	148	77%	0.765	78%	0.78	S	S	*	*				32.4	123	129.6	-47.8	-52.8	0	0	0	122.6
382	K	37.2	Very low	33.5	Very low	194 Å²	194	142.5 Å²	142.5	84%	0.843	76%	0.764	S	S	*	*				179.8	154.8	98.8	-96.4	159.6	-168.6	169.5	0	114.9
383	M	30.4	Very low	34.2	Very low	186 Å²	186	144.7 Å²	144.7	92%	0.916	77%	0.768	S	S	*	*			trans	-1.9	140.7	159.5	-58.6	166.8	175.3	0	0	118.6
384	G	29.8	Very low	34.6	Very low	73 Å²	73	147 Å²	147	75%	0.753	78%	0.776	S	S	*	*			cis	121.9	120.2	7.7	0	0	0	0	0	112.4
385	K	36.1	Very low	35.3	Very low	214 Å²	214	151 Å²	151	93%	0.93	78%	0.779	S	S	*	*			trans	-160.6	151.6	160.1	-123.8	177.9	-177.2	-178.1	0	110.7
386	E	34.2	Very low	36.3	Very low	182 Å²	182	149.5 Å²	149.5	85%	0.85	78%	0.779	S	S	*	*			trans	-103.8	-179	-167.1	-62.4	174.9	113.3	0	0	113
387	D	32.3	Very low	37.3	Very low	137 Å²	137	157 Å²	157	73%	0.733	80%	0.795	S	S	*	*			trans	67.1	152.5	166.1	-73.3	-31.9	0	0	0	118.9
388	R	35.3	Very low	37.1	Very low	193 Å²	193	158.1 Å²	158.1	73%	0.728	79%	0.794	S	S	*	*			cis	-170	159.3	-37.6	-137.7	-176.5	162.5	122.5	-3.6	106.2
389	E	34.1	Very low	38.2	Very low	155 Å²	155	159.8 Å²	159.8	72%	0.724	79%	0.788	S	S	*	*			trans	50.4	86.4	155	-70.1	169.6	-140.4	0	0	119.3
390	D	36.3	Very low	39.1	Very low	131 Å²	131	164.7 Å²	164.7	70%	0.701	80%	0.799	S	S	*	*			trans	-147.6	50.7	140.4	-157.7	-4.3	0	0	0	112.8	S392	D390-S392 PolarHBondContact O-N 2.86Å; D390-S392 VanDerWaalsContact O-N 3.14Å; D390-S392 PolarHBondContact OD1-OG 3.42Å
391	L	39.8	Very low	40.4	Very low	186 Å²	186	169.7 Å²	169.7	97%	0.974	81%	0.805	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	31.5	-179.1	-69.8	175.4	0	0	0	113.4
392	S	41.4	Very low	41.7	Very low	81 Å²	81	167.7 Å²	167.7	57%	0.566	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	-27.9	-168.7	67.6	0	0	0	0	115.3	D390	D390-S392 PolarHBondContact O-N 2.86Å; D390-S392 VanDerWaalsContact O-N 3.14Å; D390-S392 PolarHBondContact OD1-OG 3.42Å
393	N	40.1	Very low	42.7	Very low	140 Å²	140	168.6 Å²	168.6	75%	0.749	79%	0.792	S	S	*	*			trans	-120.8	8.2	-159.2	-92.6	-57	0	0	0	117.2	K395	N393-K395 VanDerWaalsContact C-N 3.31Å; N393-K395 PolarHBondContact O-N 3.24Å
394	R	36.8	Very low	44.4	Very low	251 Å²	251	165.2 Å²	165.2	95%	0.947	78%	0.784	S	S	*	*			trans	-78.8	79.2	172.4	-76.7	-169.6	177.6	-176.5	1.9	111.7	E396	R394-E396 PolarHBondContact O-N 3.36Å
395	K	44.3	Very low	46	Very low	197 Å²	197	166.4 Å²	166.4	86%	0.857	79%	0.787	S	S	*	*			trans	-61.5	100.1	171.2	-174.9	169.9	-174.6	165.8	0	110.7	N393	N393-K395 VanDerWaalsContact C-N 3.31Å; N393-K395 PolarHBondContact O-N 3.24Å
396	E	45.8	Very low	46.9	Very low	167 Å²	167	165 Å²	165	78%	0.78	79%	0.786	S	S	*	*			trans	-58.7	134.9	-174.4	-170.8	169.2	-145.4	0	0	112.5	R394 L398	R394-E396 PolarHBondContact O-N 3.36Å; E396-L398 VanDerWaalsContact C-N 3.32Å; E396-L398 PolarHBondContact O-N 2.93Å
397	R	50.6	Low	48.5	Very low	244 Å²	244	165.3 Å²	165.3	92%	0.921	79%	0.787	S	S	*	*			trans	-81.6	81.5	175.9	-76.8	176.8	127.4	127.7	-6.7	109.2	R399	R397-R399 PolarHBondContact O-N 3.38Å
398	L	54.9	Low	49.5	Very low	129 Å²	129	166.3 Å²	166.3	68%	0.675	79%	0.792	S	S	*	*			trans	-37.6	124.8	172.5	-81.4	161.4	0	0	0	111.5	E396 D402	E396-L398 VanDerWaalsContact C-N 3.32Å; E396-L398 PolarHBondContact O-N 2.93Å; L398-D402 HydrophobicContact CD2-CB 4.32Å
399	R	51.2	Low	50.7	Low	201 Å²	201	166.5 Å²	166.5	76%	0.758	79%	0.794	S	S	*	*			trans	-66.2	149	-177.6	-143.1	172.8	-178.2	176	0.9	109	R397 K401 D402	R397-R399 PolarHBondContact O-N 3.38Å; R399-K401 PolarHBondContact O-N 2.75Å; R399-D402 WeakPolarHBondContact CB-OD2 3.33Å; R399-D402 PolarHBondContact O-N 3.31Å
400	N	50.3	Low	51.4	Low	167 Å²	167	167 Å²	167	89%	0.893	80%	0.796	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	-2.4	-173.9	-81.3	-17.8	0	0	0	116.1
401	K	57.2	Low	51.6	Low	192 Å²	192	165.7 Å²	165.7	84%	0.835	80%	0.795	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	-22.1	176.5	-64.4	-171.9	175.8	-172.9	0	113.4	R399 R403	R399-K401 PolarHBondContact O-N 2.75Å; K401-R403 VanDerWaalsContact C-N 3.32Å; K401-R403 PolarHBondContact O-N 2.87Å
402	D	57.6	Low	52.1	Low	101 Å²	101	160.3 Å²	160.3	54%	0.54	78%	0.784	S	S	.	*	S	Bend	trans	-98.4	20.9	-171.7	-47.6	-65.6	0	0	0	112.2	L398 R399	L398-D402 HydrophobicContact CD2-CB 4.32Å; R399-D402 WeakPolarHBondContact CB-OD2 3.33Å; R399-D402 PolarHBondContact O-N 3.31Å
403	R	57.8	Low	52.2	Low	213 Å²	213	161.1 Å²	161.1	80%	0.804	80%	0.796	S	S	*	*	S	Bend	trans	-87.3	119.1	175.8	-167.4	178.6	-165.6	-175.6	3.9	108.4	K401 A405	K401-R403 VanDerWaalsContact C-N 3.32Å; K401-R403 PolarHBondContact O-N 2.87Å; R403-A405 PolarHBondContact O-N 2.83Å
404	P	67.3	Low	52.4	Low	116 Å²	116	165.5 Å²	165.5	75%	0.753	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-58.1	138.9	179.4	23.5	-33.3	0	0	0	110.5	M406	P404-M406 PolarHBondContact O-N 3.27Å
405	A	63.5	Low	52.7	Low	98 Å²	98	161.2 Å²	161.2	81%	0.81	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-57.3	133.4	-173.6	0	0	0	0	0	111.2	R403 Q407	R403-A405 PolarHBondContact O-N 2.83Å; A405-Q407 PolarHBondContact O-N 3.1Å
406	M	54.3	Low	52.7	Low	185 Å²	185	163.6 Å²	163.6	91%	0.911	80%	0.802	S	S	*	*			trans	-66.6	109.4	-179.8	-172.6	173.6	70.5	0	0	109.3	P404 L408	P404-M406 PolarHBondContact O-N 3.27Å; M406-L408 PolarHBondContact O-N 3Å
407	Q	67.6	Low	52.4	Low	187 Å²	187	165.2 Å²	165.2	87%	0.874	81%	0.806	S	S	*	*			trans	-59.7	118.9	-169	-165.1	170.7	15.2	0	0	111.3	A405	A405-Q407 PolarHBondContact O-N 3.1Å
408	L	52.5	Low	51.9	Low	159 Å²	159	164.7 Å²	164.7	83%	0.832	80%	0.804	S	S	*	*			trans	-68.4	138.4	-176.7	-163.8	68.8	0	0	0	110.4	M406 Q410	M406-L408 PolarHBondContact O-N 3Å; L408-Q410 PolarHBondContact O-N 3.39Å
409	Y	60.5	Low	51	Low	197 Å²	197	167 Å²	167	77%	0.773	81%	0.813	S	S	*	*			trans	-63.3	115.4	-172.6	173.3	-100.5	0	0	0	112.4	P411	Y409-P411 HydrophobicContact CE1-CB 3.86Å; Y409-P411 HydrophobicContact CE1-CG 4.2Å
410	Q	48.8	Very low	50.1	Low	165 Å²	165	162.2 Å²	162.2	77%	0.771	81%	0.811	S	S	*	*			trans	-102.5	111.1	170.7	-71.1	-171.9	-8.6	0	0	110.5	L408 G412	L408-Q410 PolarHBondContact O-N 3.39Å; Q410-G412 PolarHBondContact O-N 2.98Å
411	P	40.3	Very low	49.5	Very low	104 Å²	104	159.7 Å²	159.7	68%	0.675	81%	0.807	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	111.1	173.8	29.2	-31.8	0	0	0	110.5	Y409	Y409-P411 HydrophobicContact CE1-CB 3.86Å; Y409-P411 HydrophobicContact CE1-CG 4.2Å
412	G	50.6	Low	48.3	Very low	72 Å²	72	155.4 Å²	155.4	74%	0.742	81%	0.807	S	S	*	*	T	Hydrogen-bonded Turn	trans	156.8	-25.1	172.8	0	0	0	0	0	115.8	Q410 R414	Q410-G412 PolarHBondContact O-N 2.98Å; G412-R414 PolarHBondContact O-N 3.2Å
413	A	45	Very low	47.1	Very low	99 Å²	99	157.9 Å²	157.9	82%	0.818	82%	0.82	S	S	*	*			trans	-73.4	66.7	-175.7	0	0	0	0	0	113.7	N415	A413-N415 PolarHBondContact O-N 3.38Å
414	R	43.3	Very low	46.1	Very low	232 Å²	232	157.8 Å²	157.8	88%	0.875	83%	0.825	S	S	*	*			trans	-74	113.2	179.7	-172.1	175	-178.2	171.8	-0.4	110.9	G412 R416	G412-R414 PolarHBondContact O-N 3.2Å; R414-R416 PolarHBondContact O-N 2.8Å
415	N	43.1	Very low	44.4	Very low	161 Å²	161	155.1 Å²	155.1	86%	0.861	82%	0.819	S	S	*	*			trans	-12.6	112.5	169.4	-97.3	-36.9	0	0	0	115.6	A413	A413-N415 PolarHBondContact O-N 3.38Å
416	R	44.7	Very low	43	Very low	246 Å²	246	160.9 Å²	160.9	93%	0.928	82%	0.822	S	S	*	*			trans	-106.7	139.5	154.5	-94	-172	-86.4	-174.3	-4.2	110.3	R414	R414-R416 PolarHBondContact O-N 2.8Å
417	K	39.8	Very low	42.2	Very low	202 Å²	202	158.8 Å²	158.8	88%	0.878	81%	0.814	S	S	*	*			trans	-83.1	164	-152.4	-144.7	173.8	-175.5	-179.4	0	112.1	M419	K417-M419 PolarHBondContact O-N 3.23Å
418	R	39.7	Very low	40.4	Very low	233 Å²	233	156 Å²	156	88%	0.879	81%	0.814	S	S	*	*			trans	-52.4	136.7	155.1	-61.6	179.1	179.5	-152.7	-0.5	109.7
419	M	36.4	Very low	39.5	Very low	176 Å²	176	156.5 Å²	156.5	87%	0.867	82%	0.816	S	S	*	*				-161.8	158.8	126.5	-92	-79.6	73.5	0	0	107.6	K417	K417-M419 PolarHBondContact O-N 3.23Å
420	S	32.6	Very low	39.6	Very low	102 Å²	102	152.5 Å²	152.5	71%	0.713	82%	0.815	S	S	*	*			trans	-103.7	156.1	-172.6	-58.3	0	0	0	0	112.6
421	S	36.2	Very low	38.8	Very low	114 Å²	114	153 Å²	153	80%	0.797	82%	0.821	S	S	*	*			trans	49.6	111.9	146.3	58.9	0	0	0	0	120.1
422	A	32.7	Very low	38.3	Very low	102 Å²	102	150.7 Å²	150.7	84%	0.843	82%	0.816	S	S	*	*				-173.4	143.6	114.8	0	0	0	0	0	114.4
423	N	33.2	Very low	37.3	Very low	152 Å²	152	156.4 Å²	156.4	81%	0.813	82%	0.823	S	S	*	*			trans	-36.4	161.8	174.1	-65.2	-36.9	0	0	0	121.2
424	K	36.5	Very low	36.9	Very low	211 Å²	211	156.4 Å²	156.4	92%	0.917	82%	0.818	S	S	*	*			trans	75.2	147.6	167.7	-52.8	171.7	-176	-179.9	0	114.8
425	G	31.2	Very low	37.2	Very low	61 Å²	61	151.2 Å²	151.2	63%	0.629	81%	0.814	S	S	*	*			cis	162.2	150.1	-8.6	0	0	0	0	0	112.2
426	Y	33.5	Very low	36.9	Very low	219 Å²	219	152.1 Å²	152.1	86%	0.859	81%	0.813	S	S	*	*			trans	74.1	116.9	172.7	-55.8	-78.7	0	0	0	120.1
427	D	37.3	Very low	36.2	Very low	140 Å²	140	146.7 Å²	146.7	75%	0.749	81%	0.811	S	S	*	*			trans	26.2	125.9	132.3	-45.9	-49.7	0	0	0	122.4
428	C	30.2	Very low	35.8	Very low	129 Å²	129	148.1 Å²	148.1	87%	0.872	81%	0.811	S	S	*	*				179.4	172.1	107.3	-101.9	0	0	0	0	112.9
429	L	34	Very low	35.6	Very low	169 Å²	169	142.8 Å²	142.8	89%	0.885	81%	0.805	S	S	*	*			trans	-109.3	-153.3	-167.7	-53.4	171.2	0	0	0	113.1
430	P	63	Low	35.4	Very low	114 Å²	114	142.4 Å²	142.4	74%	0.74	80%	0.801	S	S	*	*				-126.3	172.2	-127.6	34.2	-10.9	0	0	0	116.1
431	I	31.6	Very low	35.6	Very low	174 Å²	174	145 Å²	145	89%	0.892	80%	0.801	S	S	*	*			trans	-174.5	151.7	162.2	-99.8	145.1	0	0	0	106.5
432	G	29	Very low	35.4	Very low	57 Å²	57	144.2 Å²	144.2	59%	0.588	79%	0.794	S	S	*	*			cis	155.1	152.7	-3.9	0	0	0	0	0	111.2
433	H	29.5	Very low	35.4	Very low	191 Å²	191	150.2 Å²	150.2	88%	0.884	80%	0.797	S	S	*	*			trans	71.4	126	168.2	-66.6	-84.3	0	0	0	121.6
434	S	38.1	Very low	35.5	Very low	100 Å²	100	150.7 Å²	150.7	70%	0.699	79%	0.794	S	S	*	*			trans	-77.9	160.5	150.5	-179.4	0	0	0	0	110
435	P	49.8	Very low	35.5	Very low	123 Å²	123	146.1 Å²	146.1	80%	0.799	78%	0.784	S	S	*	*				-140.7	166.5	113.9	38.6	-27.3	0	0	0	115.6
436	E	36.1	Very low	35.5	Very low	180 Å²	180	149.4 Å²	149.4	84%	0.841	79%	0.791	S	S	*	*			trans	-84.3	165.7	172.9	-52.7	179.9	131.1	0	0	113.1
437	C	29.2	Very low	35.7	Very low	132 Å²	132	143.3 Å²	143.3	89%	0.892	79%	0.786	S	S	*	*			trans	-135.6	133.3	158	-75.2	0	0	0	0	111.7
438	R	31.8	Very low	35.6	Very low	231 Å²	231	145.5 Å²	145.5	87%	0.872	79%	0.794	S	S	*	*			trans	-82.1	179.6	156.7	-63.9	175.6	164.3	-170.3	-5.7	109.2
439	T	35.4	Very low	35.9	Very low	122 Å²	122	146.2 Å²	146.2	75%	0.748	80%	0.795	S	S	*	*			cis	-147.7	-165.1	7.5	-19.4	0	0	0	0	106.9
440	E	32.6	Very low	36	Very low	168 Å²	168	143.2 Å²	143.2	79%	0.785	79%	0.794	S	S	*	*			cis	-121	-165	5.3	-84.5	-154.4	71.3	0	0	109.7
441	H	36	Very low	34.5	Very low	157 Å²	157	141.6 Å²	141.6	73%	0.727	80%	0.798	S	S	*	*			cis	71.2	133.9	24.1	-70.2	37.4	0	0	0	115.7
442	C	33.7	Very low	34.9	Very low	96 Å²	96	142.8 Å²	142.8	65%	0.649	80%	0.802	S	S	*	*			cis	-146.3	162.7	-8.6	-118.8	0	0	0	0	109.8
443	Y	31.5	Very low	35.3	Very low	228 Å²	228	146.6 Å²	146.6	89%	0.894	81%	0.805	S	S	*	*				-163.6	153.8	86.1	-107.2	-87.9	0	0	0	112.9
444	E	34.8	Very low	35.7	Very low	163 Å²	163	147.9 Å²	147.9	76%	0.762	80%	0.802	S	S	*	*			trans	-94	174.8	168.4	-97.3	-158.5	104.5	0	0	111.9
445	V	36.3	Very low	35.5	Very low	115 Å²	115	146.2 Å²	146.2	70%	0.697	80%	0.8	S	S	*	*			cis	-131.4	-163.8	15.8	-128.9	0	0	0	0	109.1
446	V	33.2	Very low	34.7	Very low	130 Å²	130	150 Å²	150	79%	0.788	81%	0.805	S	S	*	*			cis	-148.8	157.5	18.7	-156.6	0	0	0	0	109.6
447	A	36.6	Very low	34.8	Very low	90 Å²	90	149.8 Å²	149.8	74%	0.744	80%	0.804	S	S	*	*			trans	-138	159.2	162.9	0	0	0	0	0	111.5
448	M	34.4	Very low	35.7	Very low	187 Å²	187	152.8 Å²	152.8	92%	0.921	80%	0.802	S	S	*	*			trans	-136.5	135.4	168.3	-86.1	-164.4	169.2	0	0	112
449	T	37.6	Very low	36.1	Very low	144 Å²	144	146.9 Å²	146.9	88%	0.883	80%	0.795	S	S	*	*			trans	-134.6	136.5	175	49.3	0	0	0	0	109.1
450	A	35.4	Very low	36.8	Very low	106 Å²	106	150.9 Å²	150.9	88%	0.876	80%	0.803	S	S	*	*			trans	-153.8	114.4	166.7	0	0	0	0	0	109.7
451	G	32.6	Very low	37.8	Very low	79 Å²	79	150.4 Å²	150.4	81%	0.814	81%	0.805	S	S	*	*			trans	-97.3	162.6	159.2	0	0	0	0	0	109.7
452	M	40	Very low	38.6	Very low	200 Å²	200	150.8 Å²	150.8	99%	0.985	81%	0.807	S	S	*	*			trans	-130.1	152	173.1	-154	86.4	101.4	0	0	109.3
453	E	37	Very low	39.1	Very low	137 Å²	137	157.9 Å²	157.9	64%	0.64	83%	0.831	S	S	*	*			trans	-127.7	156.1	-156.5	-147.5	-164	-122.8	0	0	113.7
454	R	37.1	Very low	39.5	Very low	218 Å²	218	154.4 Å²	154.4	82%	0.823	83%	0.828	S	S	*	*			trans	69.7	150.1	167.4	-52.9	172.2	-65.9	-117.1	11.3	115.6
455	G	34.6	Very low	39.7	Very low	65 Å²	65	153.9 Å²	153.9	67%	0.67	83%	0.832	S	S	*	*			cis	126.3	115.2	-3	0	0	0	0	0	112.3
456	F	33.5	Very low	39.9	Very low	203 Å²	203	156.1 Å²	156.1	89%	0.89	84%	0.839	S	S	*	*			trans	-158.4	118.2	170.7	-113.1	-73.7	0	0	0	111.8
457	E	37.6	Very low	40.3	Very low	174 Å²	174	157.6 Å²	157.6	81%	0.813	84%	0.842	S	S	*	*			trans	-90.5	157.8	161.1	-73.5	178.5	103.7	0	0	110.5
458	K	47.3	Very low	40.5	Very low	196 Å²	196	161.9 Å²	161.9	85%	0.852	85%	0.848	S	S	*	*			trans	-157.8	87.8	157	-129	171.1	-173.1	174.1	0	112.7
459	S	41.1	Very low	40.9	Very low	106 Å²	106	160.2 Å²	160.2	74%	0.741	84%	0.843	S	S	*	*			trans	-65.8	149.1	164.4	-48.1	0	0	0	0	110.4
460	K	49.7	Very low	41.2	Very low	207 Å²	207	161.4 Å²	161.4	90%	0.9	84%	0.84	S	S	*	*			trans	-156.4	72	167	-146.3	-170.3	-176	-154.4	0	113.2
461	D	53	Low	41.6	Very low	158 Å²	158	165.6 Å²	165.6	85%	0.845	84%	0.838	S	S	*	*			trans	-92.6	132.8	154.3	-71.6	-63.7	0	0	0	108.4
462	E	54.5	Low	42.4	Very low	164 Å²	164	172.8 Å²	172.8	77%	0.766	84%	0.84	S	S	*	*			trans	-175.6	139	131.5	-103.2	-160	117.2	0	0	111.2
463	Q	43.2	Very low	42.6	Very low	246 Å²	246	170.4 Å²	170.4	100%	1.15	83%	0.826	S	S	*	*			trans	43.5	0	152.5	-52.3	-170.7	44.7	0	0	118.6

Retrieved 463 of 463 residues in 269.4 ms (Link to these results)

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