A0A5K4FCI3_SCHMA Loading...

26S proteasome non-ATPase regulatory subunit 1

Component of the 26S proteasome, a multiprotein complex involved in the ATP-dependent degradation of ubiquitinated proteins. This complex plays a key role in the maintenance of protein homeostasis by removing misfolded or damaged proteins, which could impair cellular functions, and by removing proteins whose functions are no longer required. Therefore, the proteasome participates in numerous cellular processes, including cell cycle progression, apoptosis, or DNA damage repair.

AlphaFold DB , UniProt , Accession A0A5K4FCI3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,240 aa.

						>A0A5K4FCI3_SCHMA|A0A5K4FCI3
MALTSAAGLVSLLDDKGSDVKAFALKRLYDMVDEFWAEISEAVMKIEILHEDSNFEYNKLAALLVSKVYYHLAVYDDALHYALCAEDLFDINTNTEFVETIIAKCIDKYTALRTAQDQFVDSSGPVVTENSEDSTWSVTSPTYKRLEHVVNKMFDRCFDHKQYKQALGIAIETRRLDIFEKAIISSDDQEGMLRYAFRVVLTLIDSVRLRNRFLKILVSVYMNRALPSDAVNVCQCLVLMDDPQATADTLEHLLLQSQEAAVTAYQIGFDLYENATQNFLQRVSASLARSSKLSHIMSLIERDKNATKSPKTPEGSACTNVETTDGDKNKSDKKEAEEAVETASSGETNKEIEIPADETLSEFDKEIKSRLMHLVSILSGDKVIELHLQFLIRNNKADLRLLERIRDEVRHSVTHNATVIANGIMHCGTTSDQFLRDHLNWLGKAVNWAKFTATATLGVIHKGHEKEALRLMSAYLPKDASGSSGSVYTEGGGLFALGLIHANHGGTMTEYLLNQCKEATAEPVRHGACLGLGLAAMGTGREDVYDQIKLNLYQDDAITGEAAGIGIGLVMLGTGSTRAIEDLLGYAKETAHEKIIRGVALGIALVMYGRVEEADELIDNLIIDNDPILRWSGMATIAMAYCGTGNNQAVKRLLHAAVSDTNDDVRRWAVTALGFVLFKNPEQVPSLVSLLVESYHPHLRYGAAMAVGIACAGTALKEAVSLLETLHEGTVPFVRQGALIANAMVLIQQNAVTSPKSVDFRQKLLKIIGDRHEDLLAKFGAIIACGILDAGGCNMTISLQTRTGNANMAAAVGLLIFQNFWFWHPLTNFISLAFTPTALIALNKDLNMPKIQFRSNAKPSTFAYPQPLQQEKEKKREKVETAILSITAKQRKKEADRKQHKEQQQSTTTGGAQTLKDSQTKEVKMDIDAPLETVKEEKPSTSTTETKEEKEPNFSLLNNPARVMRSQQRYVTLPESSRYITLKPISQGGILMVQDKSPQDAEVLVENVLGHGPTLDRSGVGGGTGSASGTSSSDLAAALGSGSNSKTELIHASTIGAYLDEDDDDDDEEDEDDDEDSSSDMHEEDEDDDEEEFDVAAATVSTVEIEESDDHTSKGDIEMSESSTEVKREKSRGSTSGRRGSRSHVSGSEPNPPEPFLYIEEGTTSQTTTVTTTSSNAGSSSTSSKSDSTVATDTSSYTNAKQSPPTSSSEPMDVTLETDKEAEKKSDSELDSKSKENNDK
					

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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	73.2	Confident	231 Å²	231	71.3 Å²	71.3	100%	1.138	46%	0.459	S	S	*	.				0	138.3	0	-56.5	172.6	-165.9	0	0	105.6
2	A	53.4	Low	74.2	Confident	93 Å²	93	70 Å²	70	77%	0.769	45%	0.445	S	S	*	.			trans	-63	135.2	158.7	0	0	0	0	0	107
3	L	61.2	Low	74.9	Confident	77 Å²	77	65.2 Å²	65.2	40%	0.403	41%	0.413	S	S	.	.			trans	-71.6	142.5	167.8	-80.7	76.3	0	0	0	107.1	L9 M31 F35	L3-L9 HydrophobicContact CD2-CD1 4.4Å; L3-M31 HydrophobicContact CD1-CE 3.84Å; L3-M31 HydrophobicContact CD1-SD 4.5Å; L3-M31 HydrophobicContact CD2-CE 4.01Å; L3-M31 HydrophobicContact CD2-SD 3.95Å; L3-M31 HydrophobicContact CG-CE 4.49Å; L3-F35 WeakPolarHBondContact O-CZ 3.36Å
4	T	70.7	Confident	75.4	Confident	140 Å²	140	67.9 Å²	67.9	86%	0.859	42%	0.424	S	S	*	.	S	Bend	trans	-96.5	-0.8	179.7	51.3	0	0	0	0	112.9
5	S	81.1	Confident	75.9	Confident	42 Å²	42	68.3 Å²	68.3	29%	0.294	42%	0.422	S	S	.	.			trans	-172.5	146.9	179.5	158.7	0	0	0	0	109.8	A7 E38	S5-A7 VanDerWaalsContact OG-CB 3.27Å; S5-A7 WeakPolarHBondContact OG-CB 3.21Å; S5-A7 PolarHBondContact OG-N 3.34Å; S5-A7 VanDerWaalsContact OG-N 3.09Å; S5-E38 VanDerWaalsContact CA-OE1 3.27Å; S5-E38 WeakPolarHBondContact CA-OE1 3.36Å; S5-E38 WeakPolarHBondContact CA-OE2 3.42Å; S5-E38 WeakPolarHBondContact CB-OE1 3.22Å; S5-E38 WeakPolarHBondContact CB-OE2 3.42Å; S5-E38 PolarHBondContact OG-OE1 2.83Å; S5-E38 PolarHBondContact OG-OE2 3.29Å
6	A	81.3	Confident	75.9	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	45%	0.451	C	S	.	.	S	Bend	trans	-87.6	-13.8	172.8	0	0	0	0	0	113.3	G8 L9 V10 L28 F35 E38 I39	A6-G8 PolarHBondContact O-N 2.96Å; A6-L9 WeakPolarHBondContact O-CA 3.21Å; A6-L9 WeakPolarHBondContact O-CB 3.36Å; A6-L9 PolarHBondContact O-N 3.16Å; A6-V10 PolarHBondContact O-N 3.17Å; A6-L28 HydrophobicContact CB-CD2 4.33Å; A6-F35 HydrophobicContact CB-CB 3.74Å; A6-F35 HydrophobicContact CB-CD1 4.33Å; A6-F35 HydrophobicContact CB-CG 4.08Å; A6-E38 HydrophobicContact CB-CB 4.25Å; A6-E38 PolarHBondContact N-OE2 3.48Å; A6-I39 HydrophobicContact CB-CG1 4.35Å
7	A	82.2	Confident	76.2	Confident	53 Å²	53	73.8 Å²	73.8	44%	0.438	44%	0.44	S	S	.	.	H	α-helix	trans	-50	-33	179.4	0	0	0	0	0	114.1	S5 V10 S11 E38	S5-A7 VanDerWaalsContact OG-CB 3.27Å; S5-A7 WeakPolarHBondContact OG-CB 3.21Å; S5-A7 PolarHBondContact OG-N 3.34Å; S5-A7 VanDerWaalsContact OG-N 3.09Å; A7-V10 PolarHBondContact O-N 3.4Å; A7-S11 PolarHBondContact O-N 2.59Å; A7-E38 PolarHBondContact N-OE2 3.06Å
8	G	82.7	Confident	76.4	Confident	46 Å²	46	72.7 Å²	72.7	47%	0.474	44%	0.436	S	S	.	.	H	α-helix	trans	-60	-43.1	172.2	0	0	0	0	0	113.3	A6 S11	A6-G8 PolarHBondContact O-N 2.96Å; G8-S11 PolarHBondContact O-OG 3.31Å
9	L	82.3	Confident	76.8	Confident	15 Å²	15	76.1 Å²	76.1	8%	0.079	45%	0.452	C	S	.	.	H	α-helix	trans	-73.6	-37	175.2	-62.9	173.6	0	0	0	112	L3 A6 S11 L12 R27 L28 M31	L3-L9 HydrophobicContact CD2-CD1 4.4Å; A6-L9 WeakPolarHBondContact O-CA 3.21Å; A6-L9 WeakPolarHBondContact O-CB 3.36Å; A6-L9 PolarHBondContact O-N 3.16Å; L9-S11 VanDerWaalsContact C-N 3.27Å; L9-S11 PolarHBondContact O-N 2.55Å; L9-L12 HydrophobicContact CD2-CD1 4.2Å; L9-L12 WeakPolarHBondContact O-CB 3.44Å; L9-L12 PolarHBondContact O-N 2.75Å; L9-L12 VanDerWaalsContact O-N 3.08Å; L9-R27 HydrophobicContact CD1-CB 3.79Å; L9-R27 HydrophobicContact CD2-CB 3.9Å; L9-R27 HydrophobicContact CG-CB 4.49Å; L9-L28 HydrophobicContact CB-CD2 3.66Å; L9-L28 HydrophobicContact CB-CG 3.96Å; L9-L28 HydrophobicContact CD1-CD2 4.21Å; L9-L28 HydrophobicContact CD1-CG 4.48Å; L9-M31 HydrophobicContact CD1-CE 4.27Å; L9-M31 HydrophobicContact CD1-SD 3.63Å
10	V	83.8	Confident	77.2	Confident	18 Å²	18	74.5 Å²	74.5	11%	0.109	44%	0.442	C	S	.	.	H	α-helix	trans	-58.6	-40.1	173.8	172.3	0	0	0	0	110.9	A6 A7 L12 L13 L28 A42	A6-V10 PolarHBondContact O-N 3.17Å; A7-V10 PolarHBondContact O-N 3.4Å; V10-L12 PolarHBondContact O-N 2.77Å; V10-L13 VanDerWaalsContact O-CB 3.32Å; V10-L13 WeakPolarHBondContact O-CB 3.35Å; V10-L13 WeakPolarHBondContact O-CG 3.48Å; V10-L13 PolarHBondContact O-N 3.39Å; V10-L13 VanDerWaalsContact O-N 3.13Å; V10-L28 HydrophobicContact CG2-CD2 4.22Å; V10-A42 HydrophobicContact CG1-CB 3.51Å; V10-A42 HydrophobicContact CG2-CB 4.33Å
11	S	84.3	Confident	77.5	Confident	69 Å²	69	73.1 Å²	73.1	48%	0.483	43%	0.431	S	S	.	.	H	α-helix	trans	-66.8	-20.6	176.8	75.1	0	0	0	0	114.4	A7 G8 L9 L13 D14	A7-S11 PolarHBondContact O-N 2.59Å; G8-S11 PolarHBondContact O-OG 3.31Å; L9-S11 VanDerWaalsContact C-N 3.27Å; L9-S11 PolarHBondContact O-N 2.55Å; S11-L13 VanDerWaalsContact C-N 3.28Å; S11-L13 PolarHBondContact O-N 3.45Å; S11-D14 PolarHBondContact O-N 3.36Å
12	L	84.9	Confident	79.5	Confident	56 Å²	56	62.3 Å²	62.3	29%	0.293	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-76.5	-14.7	174.3	-64.5	175.2	0	0	0	112.8	L9 V10 D14 D15 V20 A24	L9-L12 HydrophobicContact CD2-CD1 4.2Å; L9-L12 WeakPolarHBondContact O-CB 3.44Å; L9-L12 PolarHBondContact O-N 2.75Å; L9-L12 VanDerWaalsContact O-N 3.08Å; V10-L12 PolarHBondContact O-N 2.77Å; L12-D14 PolarHBondContact O-N 3.08Å; L12-D15 PolarHBondContact O-N 3.2Å; L12-V20 HydrophobicContact CB-CG1 4.12Å; L12-V20 HydrophobicContact CD2-CG1 4.08Å; L12-A24 HydrophobicContact CB-CB 3.76Å
13	L	82.8	Confident	81.1	Confident	7 Å²	7	63.4 Å²	63.4	4%	0.037	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-70.5	-22.2	173.2	-57.6	175.8	0	0	0	112.3	V10 S11 D15 K21 A24 L25 L28 I46 L49	V10-L13 VanDerWaalsContact O-CB 3.32Å; V10-L13 WeakPolarHBondContact O-CB 3.35Å; V10-L13 WeakPolarHBondContact O-CG 3.48Å; V10-L13 PolarHBondContact O-N 3.39Å; V10-L13 VanDerWaalsContact O-N 3.13Å; S11-L13 VanDerWaalsContact C-N 3.28Å; S11-L13 PolarHBondContact O-N 3.45Å; L13-D15 VanDerWaalsContact C-N 3.32Å; L13-K21 WeakPolarHBondContact O-CE 3.44Å; L13-A24 HydrophobicContact CD2-CB 3.78Å; L13-A24 HydrophobicContact CG-CB 4.47Å; L13-L25 HydrophobicContact CD2-CD2 3.95Å; L13-L25 HydrophobicContact CD2-CG 4.1Å; L13-L28 HydrophobicContact CD1-CD1 3.87Å; L13-L28 HydrophobicContact CD2-CD1 4.06Å; L13-L28 HydrophobicContact CG-CD1 4.17Å; L13-I46 HydrophobicContact CD1-CG1 3.94Å; L13-L49 HydrophobicContact CD2-CD1 3.9Å
14	D	82.6	Confident	82.3	Confident	104 Å²	104	59.8 Å²	59.8	56%	0.556	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-81.8	-6.3	178.2	-62	-35.7	0	0	0	113.2	S11 L12 K45	S11-D14 PolarHBondContact O-N 3.36Å; L12-D14 PolarHBondContact O-N 3.08Å; D14-K45 WeakPolarHBondContact OD1-CE 3.47Å; D14-K45 IonicContact OD1-NZ 3.85Å; D14-K45 PolarHBondContact OD1-NZ 3.38Å; D14-K45 IonicContact OD2-NZ 3.81Å; D14-K45 PolarHBondContact OD2-NZ 2.91Å
15	D	82.8	Confident	83.1	Confident	74 Å²	74	53.1 Å²	53.1	40%	0.396	31%	0.306	S	S	.	.	S	Bend	trans	-69.3	156.3	175.3	-157.6	-45.2	0	0	0	111.2	L12 L13 G17 V20 K21	L12-D15 PolarHBondContact O-N 3.2Å; L13-D15 VanDerWaalsContact C-N 3.32Å; D15-G17 PolarHBondContact OD1-N 2.86Å; D15-V20 HydrophobicContact CB-CB 4.13Å; D15-V20 HydrophobicContact CB-CG1 3.8Å; D15-K21 WeakPolarHBondContact O-CE 3.44Å
16	K	76.2	Confident	83.4	Confident	205 Å²	205	55.3 Å²	55.3	89%	0.891	31%	0.31	S	S	*	.	S	Bend	trans	-84.6	-17.9	174	-61.5	-176.7	-179.7	-177.3	0	112.9	S18	K16-S18 PolarHBondContact O-N 2.99Å
17	G	80.2	Confident	83.6	Confident	25 Å²	25	60.5 Å²	60.5	26%	0.258	33%	0.33	S	S	.	.			trans	-72.4	118	179.8	0	0	0	0	0	112.8	D15 D19 V20 K21	D15-G17 PolarHBondContact OD1-N 2.86Å; G17-D19 VanDerWaalsContact C-N 3.27Å; G17-D19 PolarHBondContact O-N 2.85Å; G17-V20 WeakPolarHBondContact O-CB 3.41Å; G17-V20 PolarHBondContact O-N 3.04Å; G17-K21 PolarHBondContact O-N 2.85Å
18	S	80.3	Confident	83.9	Confident	53 Å²	53	58 Å²	58	37%	0.371	31%	0.309	S	S	.	.	H	α-helix	trans	-55.3	-43.4	174.7	-168.4	0	0	0	0	111.7	K16 V20 K21 A22	K16-S18 PolarHBondContact O-N 2.99Å; S18-V20 VanDerWaalsContact C-N 3.28Å; S18-V20 PolarHBondContact O-N 2.95Å; S18-K21 PolarHBondContact O-N 3.47Å; S18-A22 WeakPolarHBondContact O-CB 3.45Å; S18-A22 PolarHBondContact O-N 3.19Å
19	D	83.2	Confident	84.1	Confident	137 Å²	137	59.7 Å²	59.7	73%	0.733	30%	0.302	S	S	*	.	H	α-helix	trans	-61.3	-34.3	176.1	-56.6	-56.1	0	0	0	113.1	G17 F23	G17-D19 VanDerWaalsContact C-N 3.27Å; G17-D19 PolarHBondContact O-N 2.85Å; D19-F23 WeakPolarHBondContact O-CB 3.25Å; D19-F23 PolarHBondContact O-N 3.04Å
20	V	85.4	Confident	84.2	Confident	44 Å²	44	63.6 Å²	63.6	27%	0.267	32%	0.323	S	S	.	.	H	α-helix	trans	-71.5	-45.7	179.5	-176.8	0	0	0	0	109.8	L12 D15 G17 S18 A22 F23 A24	L12-V20 HydrophobicContact CB-CG1 4.12Å; L12-V20 HydrophobicContact CD2-CG1 4.08Å; D15-V20 HydrophobicContact CB-CB 4.13Å; D15-V20 HydrophobicContact CB-CG1 3.8Å; G17-V20 WeakPolarHBondContact O-CB 3.41Å; G17-V20 PolarHBondContact O-N 3.04Å; S18-V20 VanDerWaalsContact C-N 3.28Å; S18-V20 PolarHBondContact O-N 2.95Å; V20-A22 VanDerWaalsContact C-N 3.34Å; V20-A22 PolarHBondContact O-N 3.38Å; V20-F23 PolarHBondContact O-N 3.08Å; V20-A24 WeakPolarHBondContact O-CB 3.46Å; V20-A24 PolarHBondContact O-N 3.35Å
21	K	84.5	Confident	84.3	Confident	46 Å²	46	64 Å²	64	20%	0.2	32%	0.324	C	S	.	.	H	α-helix	trans	-60.2	-43.4	172.1	-64.7	-172.9	177.4	-168.2	0	111.7	L13 D15 G17 S18 F23 A24 L25 L49 F55	L13-K21 WeakPolarHBondContact O-CE 3.44Å; D15-K21 WeakPolarHBondContact O-CE 3.44Å; G17-K21 PolarHBondContact O-N 2.85Å; S18-K21 PolarHBondContact O-N 3.47Å; K21-F23 VanDerWaalsContact C-N 3.35Å; K21-F23 PolarHBondContact O-N 3.1Å; K21-A24 PolarHBondContact O-N 3.43Å; K21-L25 WeakPolarHBondContact O-CB 3.27Å; K21-L25 WeakPolarHBondContact O-CG 3.34Å; K21-L25 PolarHBondContact O-N 3.11Å; K21-L49 HydrophobicContact CD-CD1 4.36Å; K21-L49 HydrophobicContact CD-CD2 3.67Å; K21-L49 VanDerWaalsContact NZ-CD2 3.32Å; K21-F55 HydrophobicContact CB-CE2 3.93Å; K21-F55 HydrophobicContact CB-CZ 3.82Å; K21-F55 HydrophobicContact CD-CE2 4.48Å
22	A	84.3	Confident	84.4	Confident	4 Å²	4	60.7 Å²	60.7	3%	0.033	30%	0.301	C	S	.	.	H	α-helix	trans	-63.9	-37.3	177.3	0	0	0	0	0	112.8	S18 V20 K26 Y57	S18-A22 WeakPolarHBondContact O-CB 3.45Å; S18-A22 PolarHBondContact O-N 3.19Å; V20-A22 VanDerWaalsContact C-N 3.34Å; V20-A22 PolarHBondContact O-N 3.38Å; A22-K26 WeakPolarHBondContact O-CD 3.44Å; A22-K26 VanDerWaalsContact O-CG 3.24Å; A22-K26 WeakPolarHBondContact O-CG 3.3Å; A22-K26 PolarHBondContact O-N 2.49Å; A22-Y57 HydrophobicContact CB-CD2 3.4Å; A22-Y57 HydrophobicContact CB-CE2 3.45Å; A22-Y57 VanDerWaalsContact CB-CE2 3.45Å; A22-Y57 HydrophobicContact CB-CG 3.99Å
23	F	86.1	Confident	84.4	Confident	117 Å²	117	62.2 Å²	62.2	51%	0.513	31%	0.309	S	S	.	.	H	α-helix	trans	-68.1	-43.8	172.9	179.9	-93.6	0	0	0	111.9	D19 V20 K21 K26 R27	D19-F23 WeakPolarHBondContact O-CB 3.25Å; D19-F23 PolarHBondContact O-N 3.04Å; V20-F23 PolarHBondContact O-N 3.08Å; K21-F23 VanDerWaalsContact C-N 3.35Å; K21-F23 PolarHBondContact O-N 3.1Å; F23-K26 PolarHBondContact O-N 3Å; F23-R27 HydrophobicContact CE1-CG 4.2Å; F23-R27 HydrophobicContact CZ-CG 4.12Å; F23-R27 PolarHBondContact O-N 3.46Å; F23-R27 VanDerWaalsContact O-N 3.09Å
24	A	86.3	Confident	84.5	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-60	-51.3	177	0	0	0	0	0	111.5	L12 L13 V20 K21 K26 R27 L28	L12-A24 HydrophobicContact CB-CB 3.76Å; L13-A24 HydrophobicContact CD2-CB 3.78Å; L13-A24 HydrophobicContact CG-CB 4.47Å; V20-A24 WeakPolarHBondContact O-CB 3.46Å; V20-A24 PolarHBondContact O-N 3.35Å; K21-A24 PolarHBondContact O-N 3.43Å; A24-K26 PolarHBondContact O-N 3.21Å; A24-R27 CarbonylContact O-C 3.54Å; A24-R27 PolarHBondContact O-N 3.05Å; A24-R27 VanDerWaalsContact O-N 3.12Å; A24-L28 WeakPolarHBondContact O-CB 3.5Å; A24-L28 VanDerWaalsContact O-CG 3.31Å; A24-L28 WeakPolarHBondContact O-CG 3.28Å; A24-L28 PolarHBondContact O-N 3.47Å
25	L	87.5	Confident	84.7	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-59.7	-42.7	178.9	-71	173.2	0	0	0	112.9	L13 K21 R27 L28 Y29 I46 L49 F55 L60 A61 L64	L13-L25 HydrophobicContact CD2-CD2 3.95Å; L13-L25 HydrophobicContact CD2-CG 4.1Å; K21-L25 WeakPolarHBondContact O-CB 3.27Å; K21-L25 WeakPolarHBondContact O-CG 3.34Å; K21-L25 PolarHBondContact O-N 3.11Å; L25-R27 VanDerWaalsContact C-N 3.31Å; L25-R27 PolarHBondContact O-N 3.39Å; L25-L28 PolarHBondContact O-N 2.84Å; L25-Y29 WeakPolarHBondContact O-CB 3.33Å; L25-Y29 PolarHBondContact O-N 3.08Å; L25-I46 HydrophobicContact CD2-CG2 3.89Å; L25-L49 HydrophobicContact CD1-CD1 4.26Å; L25-L49 HydrophobicContact CD2-CD1 4.34Å; L25-F55 HydrophobicContact CD1-CE1 3.46Å; L25-F55 VanDerWaalsContact CD1-CE1 3.46Å; L25-F55 HydrophobicContact CD1-CZ 3.76Å; L25-L60 HydrophobicContact CB-CD2 4.14Å; L25-L60 HydrophobicContact CB-CG 4.49Å; L25-A61 HydrophobicContact CD1-CB 4.15Å; L25-A61 HydrophobicContact CD2-CB 4.49Å; L25-L64 HydrophobicContact CD2-CD2 3.71Å
26	K	87.4	Confident	84.9	Confident	89 Å²	89	67 Å²	67	39%	0.387	32%	0.321	S	S	.	.	H	α-helix	trans	-61.1	-40.4	175.4	-72.3	169.3	-171.7	170.7	0	111.6	A22 F23 A24 D30 Y57 L60	A22-K26 WeakPolarHBondContact O-CD 3.44Å; A22-K26 VanDerWaalsContact O-CG 3.24Å; A22-K26 WeakPolarHBondContact O-CG 3.3Å; A22-K26 PolarHBondContact O-N 2.49Å; F23-K26 PolarHBondContact O-N 3Å; A24-K26 PolarHBondContact O-N 3.21Å; K26-D30 PolarHBondContact O-N 2.63Å; K26-D30 VanDerWaalsContact O-N 3.11Å; K26-Y57 VanDerWaalsContact NZ-CZ 3.31Å; K26-Y57 PolarHBondContact NZ-OH 3.36Å; K26-L60 HydrophobicContact CG-CD2 3.59Å
27	R	85.9	Confident	85.4	Confident	109 Å²	109	60 Å²	60	41%	0.411	30%	0.301	S	S	.	.	H	α-helix	trans	-78	-28.1	178.9	-77.3	-71.5	173.7	-149.8	-8.4	114.5	L9 F23 A24 L25 D30 M31	L9-R27 HydrophobicContact CD1-CB 3.79Å; L9-R27 HydrophobicContact CD2-CB 3.9Å; L9-R27 HydrophobicContact CG-CB 4.49Å; F23-R27 HydrophobicContact CE1-CG 4.2Å; F23-R27 HydrophobicContact CZ-CG 4.12Å; F23-R27 PolarHBondContact O-N 3.46Å; F23-R27 VanDerWaalsContact O-N 3.09Å; A24-R27 CarbonylContact O-C 3.54Å; A24-R27 PolarHBondContact O-N 3.05Å; A24-R27 VanDerWaalsContact O-N 3.12Å; L25-R27 VanDerWaalsContact C-N 3.31Å; L25-R27 PolarHBondContact O-N 3.39Å; R27-D30 IonicContact CZ-OD2 2.67Å; R27-D30 IonicContact NE-OD2 2.94Å; R27-D30 IonicContact NH1-OD2 3.94Å; R27-D30 PolarHBondContact NH1-OD2 3.5Å; R27-M31 VanDerWaalsContact O-CG 3.29Å; R27-M31 WeakPolarHBondContact O-CG 3.21Å; R27-M31 PolarHBondContact O-N 3.45Å
28	L	88.4	Confident	85.7	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-70	-39.7	169.6	-70.4	167.6	0	0	0	110.7	A6 L9 V10 L13 A24 L25 M31 V32 I39 L64	A6-L28 HydrophobicContact CB-CD2 4.33Å; L9-L28 HydrophobicContact CB-CD2 3.66Å; L9-L28 HydrophobicContact CB-CG 3.96Å; L9-L28 HydrophobicContact CD1-CD2 4.21Å; L9-L28 HydrophobicContact CD1-CG 4.48Å; V10-L28 HydrophobicContact CG2-CD2 4.22Å; L13-L28 HydrophobicContact CD1-CD1 3.87Å; L13-L28 HydrophobicContact CD2-CD1 4.06Å; L13-L28 HydrophobicContact CG-CD1 4.17Å; A24-L28 WeakPolarHBondContact O-CB 3.5Å; A24-L28 VanDerWaalsContact O-CG 3.31Å; A24-L28 WeakPolarHBondContact O-CG 3.28Å; A24-L28 PolarHBondContact O-N 3.47Å; L25-L28 PolarHBondContact O-N 2.84Å; L28-M31 CarbonylContact O-C 3.57Å; L28-M31 PolarHBondContact O-N 3.4Å; L28-M31 VanDerWaalsContact O-N 3.09Å; L28-V32 WeakPolarHBondContact O-CB 3.47Å; L28-V32 PolarHBondContact O-N 3.2Å; L28-I39 HydrophobicContact CB-CD1 4.47Å; L28-I39 HydrophobicContact CD2-CD1 3.97Å; L28-I39 HydrophobicContact CD2-CG1 4.04Å; L28-L64 HydrophobicContact CB-CD1 4.26Å; L28-L64 HydrophobicContact CB-CD2 3.65Å; L28-L64 HydrophobicContact CD1-CD2 4.2Å
29	Y	86.4	Confident	86	Confident	82 Å²	82	59 Å²	59	32%	0.322	28%	0.284	S	S	.	.	H	α-helix	trans	-62.8	-40	174	-176.3	-95.9	0	0	0	112.8	L25 M31 V32 L60 L63 K67	L25-Y29 WeakPolarHBondContact O-CB 3.33Å; L25-Y29 PolarHBondContact O-N 3.08Å; Y29-M31 PolarHBondContact O-N 3.18Å; Y29-V32 WeakPolarHBondContact O-CG1 3.45Å; Y29-L60 HydrophobicContact CD2-CD1 4.39Å; Y29-L60 HydrophobicContact CG-CD1 4.28Å; Y29-L63 HydrophobicContact CD2-CD2 4.41Å; Y29-L63 HydrophobicContact CE2-CD2 3.59Å; Y29-L63 HydrophobicContact CE2-CG 3.86Å; Y29-K67 HydrophobicContact CE2-CD 4.15Å
30	D	86	Confident	86.2	Confident	97 Å²	97	54.2 Å²	54.2	52%	0.519	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-21.7	172.6	-72.6	-14.2	0	0	0	113.6	K26 R27	K26-D30 PolarHBondContact O-N 2.63Å; K26-D30 VanDerWaalsContact O-N 3.11Å; R27-D30 IonicContact CZ-OD2 2.67Å; R27-D30 IonicContact NE-OD2 2.94Å; R27-D30 IonicContact NH1-OD2 3.94Å; R27-D30 PolarHBondContact NH1-OD2 3.5Å
31	M	85.3	Confident	86.2	Confident	26 Å²	26	60.4 Å²	60.4	13%	0.128	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121	-1.2	-167.9	-65.5	179.5	-165.7	0	0	114	L3 L9 R27 L28 Y29 D33 E34 F35	L3-M31 HydrophobicContact CD1-CE 3.84Å; L3-M31 HydrophobicContact CD1-SD 4.5Å; L3-M31 HydrophobicContact CD2-CE 4.01Å; L3-M31 HydrophobicContact CD2-SD 3.95Å; L3-M31 HydrophobicContact CG-CE 4.49Å; L9-M31 HydrophobicContact CD1-CE 4.27Å; L9-M31 HydrophobicContact CD1-SD 3.63Å; R27-M31 VanDerWaalsContact O-CG 3.29Å; R27-M31 WeakPolarHBondContact O-CG 3.21Å; R27-M31 PolarHBondContact O-N 3.45Å; L28-M31 CarbonylContact O-C 3.57Å; L28-M31 PolarHBondContact O-N 3.4Å; L28-M31 VanDerWaalsContact O-N 3.09Å; Y29-M31 PolarHBondContact O-N 3.18Å; M31-D33 VanDerWaalsContact C-N 3.31Å; M31-D33 PolarHBondContact O-N 3.36Å; M31-E34 PolarHBondContact O-N 3.07Å; M31-E34 VanDerWaalsContact O-N 3.1Å; M31-F35 HydrophobicContact CB-CD2 4.2Å; M31-F35 PolarHBondContact O-N 3.02Å
32	V	85.9	Confident	86.2	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-61.9	-37	-171.3	63.2	0	0	0	0	112.7	L28 Y29 E34 F35 W36 I39 L64 K67 V68	L28-V32 WeakPolarHBondContact O-CB 3.47Å; L28-V32 PolarHBondContact O-N 3.2Å; Y29-V32 WeakPolarHBondContact O-CG1 3.45Å; V32-E34 PolarHBondContact O-N 3Å; V32-F35 PolarHBondContact O-N 3.38Å; V32-W36 WeakPolarHBondContact O-CA 3.17Å; V32-W36 VanDerWaalsContact O-CB 3.26Å; V32-W36 WeakPolarHBondContact O-CB 3.3Å; V32-W36 PolarHBondContact O-N 2.83Å; V32-I39 HydrophobicContact CB-CD1 4.23Å; V32-I39 HydrophobicContact CG2-CD1 4.28Å; V32-L64 HydrophobicContact CB-CD1 3.93Å; V32-L64 HydrophobicContact CG2-CD1 3.92Å; V32-K67 HydrophobicContact CG1-CB 4.3Å; V32-K67 HydrophobicContact CG1-CD 3.44Å; V32-K67 VanDerWaalsContact CG1-CD 3.44Å; V32-K67 HydrophobicContact CG2-CB 4.09Å; V32-V68 HydrophobicContact CG2-CG2 3.77Å
33	D	84.1	Confident	86.3	Confident	88 Å²	88	58.7 Å²	58.7	47%	0.471	28%	0.281	S	S	.	.	H	α-helix	trans	-74.5	-14.9	-178.6	-50.1	-49.4	0	0	0	112.7	M31 K67 H71	M31-D33 VanDerWaalsContact C-N 3.31Å; M31-D33 PolarHBondContact O-N 3.36Å; D33-K67 IonicContact OD1-NZ 2.69Å; D33-K67 PolarHBondContact OD1-NZ 3.24Å; D33-K67 IonicContact OD2-NZ 2.93Å; D33-K67 PolarHBondContact OD2-NZ 3.45Å; D33-H71 IonicContact OD1-CD2 3.8Å; D33-H71 IonicContact OD1-CE1 2.68Å; D33-H71 IonicContact OD1-NE2 2.7Å; D33-H71 PolarHBondContact OD1-NE2 3.33Å
34	E	85.9	Confident	86.3	Confident	158 Å²	158	59.6 Å²	59.6	74%	0.738	29%	0.288	S	S	*	.	H	α-helix	trans	-96.3	-36	171.6	-68.8	-175	170.6	0	0	112.7	M31 V32	M31-E34 PolarHBondContact O-N 3.07Å; M31-E34 VanDerWaalsContact O-N 3.1Å; V32-E34 PolarHBondContact O-N 3Å
35	F	86.9	Confident	86.2	Confident	34 Å²	34	63.2 Å²	63.2	15%	0.149	30%	0.304	C	S	.	.	H	α-helix	trans	-122	17.2	-167.9	-68.1	-86.3	0	0	0	115.1	L3 A6 M31 V32 A37 E38 I39	L3-F35 WeakPolarHBondContact O-CZ 3.36Å; A6-F35 HydrophobicContact CB-CB 3.74Å; A6-F35 HydrophobicContact CB-CD1 4.33Å; A6-F35 HydrophobicContact CB-CG 4.08Å; M31-F35 HydrophobicContact CB-CD2 4.2Å; M31-F35 PolarHBondContact O-N 3.02Å; V32-F35 PolarHBondContact O-N 3.38Å; F35-A37 PolarHBondContact O-N 3.21Å; F35-E38 PolarHBondContact O-N 3.44Å; F35-I39 WeakPolarHBondContact O-CG1 3.48Å; F35-I39 PolarHBondContact O-N 2.86Å
36	W	87.7	Confident	86.1	Confident	94 Å²	94	63.2 Å²	63.2	36%	0.356	30%	0.304	S	S	.	.	H	α-helix	trans	-47.8	-34.3	179.6	59.7	-92.9	0	0	0	113.9	V32 E38 I39 S40 H71 L72	V32-W36 WeakPolarHBondContact O-CA 3.17Å; V32-W36 VanDerWaalsContact O-CB 3.26Å; V32-W36 WeakPolarHBondContact O-CB 3.3Å; V32-W36 PolarHBondContact O-N 2.83Å; W36-E38 VanDerWaalsContact C-N 3.34Å; W36-E38 PolarHBondContact O-N 3.48Å; W36-I39 PolarHBondContact O-N 3.13Å; W36-I39 VanDerWaalsContact O-N 3.16Å; W36-S40 WeakPolarHBondContact O-CB 3.48Å; W36-S40 PolarHBondContact O-N 2.89Å; W36-S40 PolarHBondContact O-OG 3.07Å; W36-H71 HydrophobicContact CB-CB 3.88Å; W36-H71 AromaticContact CD1-CG 3.95Å; W36-H71 HydrophobicContact CD2-CB 3.79Å; W36-H71 HydrophobicContact CE3-CB 4.12Å; W36-H71 HydrophobicContact CG-CB 3.68Å; W36-H71 AromaticContact CG-CG 3.89Å; W36-L72 HydrophobicContact CZ3-CD2 4.33Å
37	A	86.4	Confident	86	Confident	56 Å²	56	60.8 Å²	60.8	46%	0.463	29%	0.294	S	S	.	.	H	α-helix	trans	-70.1	-21.1	179.4	0	0	0	0	0	114.9	F35 S40	F35-A37 PolarHBondContact O-N 3.21Å; A37-S40 PolarHBondContact O-OG 3.08Å; A37-S40 VanDerWaalsContact O-OG 3.08Å
38	E	85.6	Confident	86.1	Confident	58 Å²	58	60.6 Å²	60.6	27%	0.271	30%	0.3	S	S	.	.	H	α-helix	trans	-90.7	-22.8	168.8	-72.3	-173.4	-142.5	0	0	112.1	S5 A6 A7 F35 W36	S5-E38 VanDerWaalsContact CA-OE1 3.27Å; S5-E38 WeakPolarHBondContact CA-OE1 3.36Å; S5-E38 WeakPolarHBondContact CA-OE2 3.42Å; S5-E38 WeakPolarHBondContact CB-OE1 3.22Å; S5-E38 WeakPolarHBondContact CB-OE2 3.42Å; S5-E38 PolarHBondContact OG-OE1 2.83Å; S5-E38 PolarHBondContact OG-OE2 3.29Å; A6-E38 HydrophobicContact CB-CB 4.25Å; A6-E38 PolarHBondContact N-OE2 3.48Å; A7-E38 PolarHBondContact N-OE2 3.06Å; F35-E38 PolarHBondContact O-N 3.44Å; W36-E38 VanDerWaalsContact C-N 3.34Å; W36-E38 PolarHBondContact O-N 3.48Å
39	I	86.5	Confident	85.9	Confident	0 Å²	0	61 Å²	61	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-83.1	-30.1	-179.8	-55.4	173	0	0	0	110.4	A6 L28 V32 F35 W36 E41 A42 V43 I46 V68	A6-I39 HydrophobicContact CB-CG1 4.35Å; L28-I39 HydrophobicContact CB-CD1 4.47Å; L28-I39 HydrophobicContact CD2-CD1 3.97Å; L28-I39 HydrophobicContact CD2-CG1 4.04Å; V32-I39 HydrophobicContact CB-CD1 4.23Å; V32-I39 HydrophobicContact CG2-CD1 4.28Å; F35-I39 WeakPolarHBondContact O-CG1 3.48Å; F35-I39 PolarHBondContact O-N 2.86Å; W36-I39 PolarHBondContact O-N 3.13Å; W36-I39 VanDerWaalsContact O-N 3.16Å; I39-E41 VanDerWaalsContact C-N 3.35Å; I39-E41 PolarHBondContact O-N 3.46Å; I39-A42 CarbonylContact O-C 3.57Å; I39-A42 WeakPolarHBondContact O-CA 3.4Å; I39-A42 PolarHBondContact O-N 2.74Å; I39-V43 PolarHBondContact O-N 3.45Å; I39-I46 HydrophobicContact CG2-CD1 3.67Å; I39-V68 HydrophobicContact CB-CG2 4.15Å; I39-V68 HydrophobicContact CG2-CG2 3.67Å
40	S	87.1	Confident	85.7	Confident	36 Å²	36	58.8 Å²	58.8	25%	0.252	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-57.2	-41.7	176.8	59.6	0	0	0	0	112.9	W36 A37 A42 V43	W36-S40 WeakPolarHBondContact O-CB 3.48Å; W36-S40 PolarHBondContact O-N 2.89Å; W36-S40 PolarHBondContact O-OG 3.07Å; A37-S40 PolarHBondContact O-OG 3.08Å; A37-S40 VanDerWaalsContact O-OG 3.08Å; S40-A42 PolarHBondContact O-N 3.28Å; S40-V43 PolarHBondContact O-N 3.02Å
41	E	86.5	Confident	85.6	Confident	174 Å²	174	61.2 Å²	61.2	81%	0.813	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-58.1	-20.5	174.3	-63.6	-165.9	163.5	0	0	113.3	I39	I39-E41 VanDerWaalsContact C-N 3.35Å; I39-E41 PolarHBondContact O-N 3.46Å
42	A	84	Confident	85.5	Confident	6 Å²	6	63.1 Å²	63.1	5%	0.05	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-112.2	6	-175.8	0	0	0	0	0	114.5	V10 I39 S40 M44 K45 I46	V10-A42 HydrophobicContact CG1-CB 3.51Å; V10-A42 HydrophobicContact CG2-CB 4.33Å; I39-A42 CarbonylContact O-C 3.57Å; I39-A42 WeakPolarHBondContact O-CA 3.4Å; I39-A42 PolarHBondContact O-N 2.74Å; S40-A42 PolarHBondContact O-N 3.28Å; A42-M44 VanDerWaalsContact C-N 3.31Å; A42-M44 PolarHBondContact O-N 2.83Å; A42-K45 VanDerWaalsContact O-CB 3.31Å; A42-K45 WeakPolarHBondContact O-CB 3.31Å; A42-K45 PolarHBondContact O-N 3.01Å; A42-I46 PolarHBondContact O-N 2.95Å
43	V	86.4	Confident	84.9	Confident	9 Å²	9	68.1 Å²	68.1	6%	0.055	35%	0.348	C	S	.	.	H	α-helix	trans	-51.8	-46.6	-176.1	165.1	0	0	0	0	112.4	I39 S40 K45 I46 E47 V65 V68 Y69	I39-V43 PolarHBondContact O-N 3.45Å; S40-V43 PolarHBondContact O-N 3.02Å; V43-K45 PolarHBondContact O-N 3.5Å; V43-I46 CarbonylContact O-C 3.58Å; V43-I46 WeakPolarHBondContact O-CA 3.35Å; V43-I46 WeakPolarHBondContact O-CB 3.44Å; V43-I46 PolarHBondContact O-N 2.77Å; V43-E47 HydrophobicContact CG1-CG 3.93Å; V43-E47 WeakPolarHBondContact O-CG 3.43Å; V43-E47 PolarHBondContact O-N 3.31Å; V43-V65 HydrophobicContact CG1-CG1 4.34Å; V43-V68 HydrophobicContact CG2-CB 4.17Å; V43-V68 HydrophobicContact CG2-CG1 3.5Å; V43-Y69 HydrophobicContact CG1-CE2 3.82Å
44	M	85.7	Confident	84.6	Confident	135 Å²	135	71 Å²	71	67%	0.665	36%	0.364	S	S	*	.	H	α-helix	trans	-51	-33.6	174.9	-67.8	-178.9	-71.6	0	0	114.3	A42 E47 I48	A42-M44 VanDerWaalsContact C-N 3.31Å; A42-M44 PolarHBondContact O-N 2.83Å; M44-E47 WeakPolarHBondContact CA-OE2 3.48Å; M44-E47 PolarHBondContact N-OE2 2.86Å; M44-I48 WeakPolarHBondContact O-CD1 3.39Å; M44-I48 VanDerWaalsContact O-CG1 3.25Å; M44-I48 WeakPolarHBondContact O-CG1 3.27Å; M44-I48 PolarHBondContact O-N 3.46Å
45	K	83.9	Confident	84.2	Confident	77 Å²	77	64 Å²	64	34%	0.335	33%	0.331	S	S	.	.	H	α-helix	trans	-70.4	-37.6	175.6	-59.5	-171	178.2	-170.4	0	111.5	D14 A42 V43 L49	D14-K45 WeakPolarHBondContact OD1-CE 3.47Å; D14-K45 IonicContact OD1-NZ 3.85Å; D14-K45 PolarHBondContact OD1-NZ 3.38Å; D14-K45 IonicContact OD2-NZ 3.81Å; D14-K45 PolarHBondContact OD2-NZ 2.91Å; A42-K45 VanDerWaalsContact O-CB 3.31Å; A42-K45 WeakPolarHBondContact O-CB 3.31Å; A42-K45 PolarHBondContact O-N 3.01Å; V43-K45 PolarHBondContact O-N 3.5Å; K45-L49 WeakPolarHBondContact O-CG 3.35Å; K45-L49 PolarHBondContact O-N 2.96Å
46	I	85.6	Confident	83.8	Confident	0 Å²	0	70 Å²	70	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-77.9	-34	-177.2	-45.7	168.7	0	0	0	110.3	L13 L25 I39 A42 V43 L49 H50 A61 L64 V65	L13-I46 HydrophobicContact CD1-CG1 3.94Å; L25-I46 HydrophobicContact CD2-CG2 3.89Å; I39-I46 HydrophobicContact CG2-CD1 3.67Å; A42-I46 PolarHBondContact O-N 2.95Å; V43-I46 CarbonylContact O-C 3.58Å; V43-I46 WeakPolarHBondContact O-CA 3.35Å; V43-I46 WeakPolarHBondContact O-CB 3.44Å; V43-I46 PolarHBondContact O-N 2.77Å; I46-L49 CarbonylContact O-C 3.44Å; I46-L49 WeakPolarHBondContact O-CA 3.22Å; I46-L49 WeakPolarHBondContact O-CB 3.38Å; I46-L49 PolarHBondContact O-N 3.07Å; I46-L49 VanDerWaalsContact O-N 3.1Å; I46-H50 PolarHBondContact O-N 2.82Å; I46-A61 HydrophobicContact CG2-CB 4.02Å; I46-L64 HydrophobicContact CD1-CD2 3.96Å; I46-L64 HydrophobicContact CD1-CG 4.32Å; I46-L64 HydrophobicContact CG2-CD2 4.19Å; I46-V65 HydrophobicContact CB-CG2 3.63Å; I46-V65 HydrophobicContact CG2-CG2 3.46Å; I46-V65 VanDerWaalsContact CG2-CG2 3.46Å
47	E	86.7	Confident	83.5	Confident	37 Å²	37	69 Å²	69	17%	0.173	36%	0.356	C	S	.	.	H	α-helix	trans	-58.5	-47.2	169.3	-67	175.8	123.1	0	0	111.3	V43 M44 L49 H50 E51 V65 Y69 Y81	V43-E47 HydrophobicContact CG1-CG 3.93Å; V43-E47 WeakPolarHBondContact O-CG 3.43Å; V43-E47 PolarHBondContact O-N 3.31Å; M44-E47 WeakPolarHBondContact CA-OE2 3.48Å; M44-E47 PolarHBondContact N-OE2 2.86Å; E47-L49 PolarHBondContact O-N 3.4Å; E47-H50 WeakPolarHBondContact O-CA 3.37Å; E47-H50 WeakPolarHBondContact O-CB 3.44Å; E47-H50 PolarHBondContact O-N 3.36Å; E47-E51 PolarHBondContact O-N 3.37Å; E47-V65 HydrophobicContact CG-CG1 4.21Å; E47-V65 HydrophobicContact CG-CG2 4.33Å; E47-Y69 PolarHBondContact OE1-OH 3.07Å; E47-Y81 PolarHBondContact OE1-OH 3.16Å
48	I	86.7	Confident	83.3	Confident	106 Å²	106	68.3 Å²	68.3	54%	0.544	35%	0.345	S	S	.	.	H	α-helix	trans	-60.2	-29.7	174.2	-67.3	164.3	0	0	0	112.1	M44 H50 D52	M44-I48 WeakPolarHBondContact O-CD1 3.39Å; M44-I48 VanDerWaalsContact O-CG1 3.25Å; M44-I48 WeakPolarHBondContact O-CG1 3.27Å; M44-I48 PolarHBondContact O-N 3.46Å; I48-H50 VanDerWaalsContact C-N 3.35Å; I48-D52 PolarHBondContact O-N 3.34Å
49	L	84.4	Confident	83.3	Confident	7 Å²	7	68.2 Å²	68.2	4%	0.037	34%	0.343	C	S	.	.	H	α-helix	trans	-78.5	-16	172.7	-61	-178.6	0	0	0	113.8	L13 K21 L25 K45 I46 E47 F55 A61	L13-L49 HydrophobicContact CD2-CD1 3.9Å; K21-L49 HydrophobicContact CD-CD1 4.36Å; K21-L49 HydrophobicContact CD-CD2 3.67Å; K21-L49 VanDerWaalsContact NZ-CD2 3.32Å; L25-L49 HydrophobicContact CD1-CD1 4.26Å; L25-L49 HydrophobicContact CD2-CD1 4.34Å; K45-L49 WeakPolarHBondContact O-CG 3.35Å; K45-L49 PolarHBondContact O-N 2.96Å; I46-L49 CarbonylContact O-C 3.44Å; I46-L49 WeakPolarHBondContact O-CA 3.22Å; I46-L49 WeakPolarHBondContact O-CB 3.38Å; I46-L49 PolarHBondContact O-N 3.07Å; I46-L49 VanDerWaalsContact O-N 3.1Å; E47-L49 PolarHBondContact O-N 3.4Å; L49-F55 HydrophobicContact CB-CD1 4.48Å; L49-F55 HydrophobicContact CB-CE1 4.48Å; L49-F55 WeakPolarHBondContact O-CD1 3.4Å; L49-A61 HydrophobicContact CB-CB 4.15Å
50	H	82.7	Confident	83.3	Confident	37 Å²	37	69.2 Å²	69.2	17%	0.171	35%	0.349	C	S	.	.	H	α-helix	trans	-82.7	-41.9	169.3	178.1	52.1	0	0	0	111.3	I46 E47 I48 D52 N58 A61 Y81 C84	I46-H50 PolarHBondContact O-N 2.82Å; E47-H50 WeakPolarHBondContact O-CA 3.37Å; E47-H50 WeakPolarHBondContact O-CB 3.44Å; E47-H50 PolarHBondContact O-N 3.36Å; I48-H50 VanDerWaalsContact C-N 3.35Å; H50-D52 VanDerWaalsContact C-N 3.33Å; H50-D52 PolarHBondContact O-N 3.02Å; H50-N58 PolarHBondContact ND1-O 3.12Å; H50-N58 VanDerWaalsContact ND1-O 3.07Å; H50-A61 HydrophobicContact CB-CB 4.31Å; H50-Y81 AromaticContact CD2-CE1 3.92Å; H50-C84 WeakPolarHBondContact NE2-CB 3.33Å
51	E	82.9	Confident	83.4	Confident	147 Å²	147	67.5 Å²	67.5	69%	0.687	34%	0.337	S	S	*	.	H	α-helix	trans	-63.8	-32.5	177.8	-67.4	-171.8	149.2	0	0	113.4	E47 S53	E47-E51 PolarHBondContact O-N 3.37Å; E51-S53 PolarHBondContact O-N 3.37Å
52	D	83.6	Confident	83.5	Confident	66 Å²	66	59.2 Å²	59.2	35%	0.353	30%	0.298	S	S	.	.			trans	-66.9	95.2	177	-171.7	1.9	0	0	0	111.7	I48 H50 N54 F55	I48-D52 PolarHBondContact O-N 3.34Å; H50-D52 VanDerWaalsContact C-N 3.33Å; H50-D52 PolarHBondContact O-N 3.02Å; D52-N54 PolarHBondContact O-N 3.36Å; D52-N54 WeakPolarHBondContact OD1-CB 3.35Å; D52-N54 PolarHBondContact OD1-N 2.95Å; D52-N54 PolarHBondContact OD1-ND2 3.02Å; D52-F55 HydrophobicContact CB-CB 4.3Å; D52-F55 WeakPolarHBondContact O-CB 3.47Å; D52-F55 PolarHBondContact O-N 2.96Å
53	S	74.1	Confident	83.6	Confident	105 Å²	105	59.3 Å²	59.3	73%	0.734	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-10	178.3	-61.3	0	0	0	0	114.2	E51	E51-S53 PolarHBondContact O-N 3.37Å
54	N	77.5	Confident	83.8	Confident	148 Å²	148	58.9 Å²	58.9	79%	0.791	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-8.4	174.5	-51.6	-76.5	0	0	0	113.1	D52	D52-N54 PolarHBondContact O-N 3.36Å; D52-N54 WeakPolarHBondContact OD1-CB 3.35Å; D52-N54 PolarHBondContact OD1-N 2.95Å; D52-N54 PolarHBondContact OD1-ND2 3.02Å
55	F	78	Confident	84	Confident	11 Å²	11	52.5 Å²	52.5	5%	0.048	26%	0.263	C	S	.	.			trans	-93	113.7	-171.6	-175.8	-118.8	0	0	0	112	K21 L25 L49 D52 Y57 N58	K21-F55 HydrophobicContact CB-CE2 3.93Å; K21-F55 HydrophobicContact CB-CZ 3.82Å; K21-F55 HydrophobicContact CD-CE2 4.48Å; L25-F55 HydrophobicContact CD1-CE1 3.46Å; L25-F55 VanDerWaalsContact CD1-CE1 3.46Å; L25-F55 HydrophobicContact CD1-CZ 3.76Å; L49-F55 HydrophobicContact CB-CD1 4.48Å; L49-F55 HydrophobicContact CB-CE1 4.48Å; L49-F55 WeakPolarHBondContact O-CD1 3.4Å; D52-F55 HydrophobicContact CB-CB 4.3Å; D52-F55 WeakPolarHBondContact O-CB 3.47Å; D52-F55 PolarHBondContact O-N 2.96Å; F55-Y57 HydrophobicContact CZ-CD2 4.44Å; F55-Y57 PolarHBondContact O-N 3.07Å; F55-N58 HydrophobicContact CD1-CB 4.45Å; F55-N58 WeakPolarHBondContact O-CB 3.34Å; F55-N58 VanDerWaalsContact O-CG 3.25Å; F55-N58 PolarHBondContact O-N 3.48Å
56	E	77.7	Confident	84.3	Confident	162 Å²	162	48.8 Å²	48.8	76%	0.757	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-18.7	-175.2	-61.9	-174.3	159.4	0	0	115
57	Y	81.3	Confident	84.5	Confident	73 Å²	73	49.9 Å²	49.9	29%	0.286	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	19.4	-179.3	-62.9	-87.9	0	0	0	113.2	A22 K26 F55 K59 L60 A61	A22-Y57 HydrophobicContact CB-CD2 3.4Å; A22-Y57 HydrophobicContact CB-CE2 3.45Å; A22-Y57 VanDerWaalsContact CB-CE2 3.45Å; A22-Y57 HydrophobicContact CB-CG 3.99Å; K26-Y57 VanDerWaalsContact NZ-CZ 3.31Å; K26-Y57 PolarHBondContact NZ-OH 3.36Å; F55-Y57 HydrophobicContact CZ-CD2 4.44Å; F55-Y57 PolarHBondContact O-N 3.07Å; Y57-K59 PolarHBondContact O-N 3.49Å; Y57-L60 HydrophobicContact CD1-CD2 4.3Å; Y57-L60 WeakPolarHBondContact O-CA 3.44Å; Y57-L60 WeakPolarHBondContact O-CB 3.49Å; Y57-L60 PolarHBondContact O-N 3Å; Y57-A61 PolarHBondContact O-N 2.89Å
58	N	83.4	Confident	84.7	Confident	41 Å²	41	48.1 Å²	48.1	22%	0.219	24%	0.244	C	C	.	.	H	α-helix	trans	-57.5	-31.4	177	62.5	-0.6	0	0	0	114	H50 F55 A61 A62	H50-N58 PolarHBondContact ND1-O 3.12Å; H50-N58 VanDerWaalsContact ND1-O 3.07Å; F55-N58 HydrophobicContact CD1-CB 4.45Å; F55-N58 WeakPolarHBondContact O-CB 3.34Å; F55-N58 VanDerWaalsContact O-CG 3.25Å; F55-N58 PolarHBondContact O-N 3.48Å; N58-A61 PolarHBondContact O-N 3.14Å; N58-A62 PolarHBondContact O-N 3.26Å
59	K	85	Confident	85	Confident	56 Å²	56	44.7 Å²	44.7	24%	0.243	22%	0.224	C	C	.	.	H	α-helix	trans	-66.5	-35.2	171.1	-71	-175.8	171.3	-176.1	0	112.8	Y57 L63 E86 D87 L88	Y57-K59 PolarHBondContact O-N 3.49Å; K59-L63 PolarHBondContact O-N 3.48Å; K59-L63 VanDerWaalsContact O-N 3.11Å; K59-E86 HydrophobicContact CD-CB 4.41Å; K59-E86 WeakPolarHBondContact CE-OE2 3.29Å; K59-E86 IonicContact NZ-OE2 3.19Å; K59-E86 PolarHBondContact NZ-OE2 2.69Å; K59-D87 IonicContact NZ-OD2 2.74Å; K59-D87 PolarHBondContact NZ-OD2 2.65Å; K59-L88 HydrophobicContact CB-CD1 3.79Å; K59-L88 HydrophobicContact CB-CG 4.32Å
60	L	86.6	Confident	85.3	Confident	21 Å²	21	46.2 Å²	46.2	11%	0.11	23%	0.23	C	C	.	.	H	α-helix	trans	-75.4	-35	176.8	-178	64.8	0	0	0	111.2	L25 K26 Y29 Y57 L63 L64 L88	L25-L60 HydrophobicContact CB-CD2 4.14Å; L25-L60 HydrophobicContact CB-CG 4.49Å; K26-L60 HydrophobicContact CG-CD2 3.59Å; Y29-L60 HydrophobicContact CD2-CD1 4.39Å; Y29-L60 HydrophobicContact CG-CD1 4.28Å; Y57-L60 HydrophobicContact CD1-CD2 4.3Å; Y57-L60 WeakPolarHBondContact O-CA 3.44Å; Y57-L60 WeakPolarHBondContact O-CB 3.49Å; Y57-L60 PolarHBondContact O-N 3Å; L60-L63 PolarHBondContact O-N 2.79Å; L60-L64 WeakPolarHBondContact O-CB 3.45Å; L60-L64 PolarHBondContact O-N 3.18Å; L60-L88 HydrophobicContact CB-CD1 3.99Å; L60-L88 HydrophobicContact CD1-CD1 4.42Å
61	A	88.1	Confident	85.6	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-59	-47.5	169.8	0	0	0	0	0	110.8	L25 I46 L49 H50 Y57 N58 L63 L64 V65	L25-A61 HydrophobicContact CD1-CB 4.15Å; L25-A61 HydrophobicContact CD2-CB 4.49Å; I46-A61 HydrophobicContact CG2-CB 4.02Å; L49-A61 HydrophobicContact CB-CB 4.15Å; H50-A61 HydrophobicContact CB-CB 4.31Å; Y57-A61 PolarHBondContact O-N 2.89Å; N58-A61 PolarHBondContact O-N 3.14Å; A61-L63 PolarHBondContact O-N 2.92Å; A61-L64 PolarHBondContact O-N 3.41Å; A61-V65 WeakPolarHBondContact O-CG2 3.44Å; A61-V65 PolarHBondContact O-N 3.2Å
62	A	88.5	Confident	86	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-57.5	-46.1	175.3	0	0	0	0	0	113	N58 L64 V65 S66 Y81 C84 A85	N58-A62 PolarHBondContact O-N 3.26Å; A62-L64 VanDerWaalsContact C-N 3.34Å; A62-L64 PolarHBondContact O-N 3.33Å; A62-V65 PolarHBondContact O-N 3.1Å; A62-S66 VanDerWaalsContact O-CB 3.31Å; A62-S66 WeakPolarHBondContact O-CB 3.47Å; A62-S66 PolarHBondContact O-N 3.28Å; A62-Y81 WeakPolarHBondContact CB-O 3.5Å; A62-C84 HydrophobicContact CB-CB 4.21Å; A62-A85 HydrophobicContact CB-CB 4.16Å
63	L	87.7	Confident	86.2	Confident	8 Å²	8	42.7 Å²	42.7	4%	0.042	22%	0.223	C	C	.	.	H	α-helix	trans	-65	-36.9	179	-171	65.2	0	0	0	112.6	Y29 K59 L60 A61 K67 A85 L88 F89 F97	Y29-L63 HydrophobicContact CD2-CD2 4.41Å; Y29-L63 HydrophobicContact CE2-CD2 3.59Å; Y29-L63 HydrophobicContact CE2-CG 3.86Å; K59-L63 PolarHBondContact O-N 3.48Å; K59-L63 VanDerWaalsContact O-N 3.11Å; L60-L63 PolarHBondContact O-N 2.79Å; A61-L63 PolarHBondContact O-N 2.92Å; L63-K67 PolarHBondContact O-N 3.38Å; L63-A85 HydrophobicContact CB-CB 3.96Å; L63-A85 HydrophobicContact CD1-CB 4.32Å; L63-L88 HydrophobicContact CD2-CB 4.12Å; L63-F89 HydrophobicContact CD1-CD2 4.31Å; L63-F97 HydrophobicContact CD1-CE1 4.12Å; L63-F97 HydrophobicContact CD1-CZ 4.35Å
64	L	89.2	Confident	87	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-66.1	-46.9	174.5	178.2	60.7	0	0	0	111.4	L25 L28 V32 I46 L60 A61 A62 S66 K67 V68	L25-L64 HydrophobicContact CD2-CD2 3.71Å; L28-L64 HydrophobicContact CB-CD1 4.26Å; L28-L64 HydrophobicContact CB-CD2 3.65Å; L28-L64 HydrophobicContact CD1-CD2 4.2Å; V32-L64 HydrophobicContact CB-CD1 3.93Å; V32-L64 HydrophobicContact CG2-CD1 3.92Å; I46-L64 HydrophobicContact CD1-CD2 3.96Å; I46-L64 HydrophobicContact CD1-CG 4.32Å; I46-L64 HydrophobicContact CG2-CD2 4.19Å; L60-L64 WeakPolarHBondContact O-CB 3.45Å; L60-L64 PolarHBondContact O-N 3.18Å; A61-L64 PolarHBondContact O-N 3.41Å; A62-L64 VanDerWaalsContact C-N 3.34Å; A62-L64 PolarHBondContact O-N 3.33Å; L64-S66 VanDerWaalsContact C-N 3.35Å; L64-S66 PolarHBondContact O-N 3.47Å; L64-K67 PolarHBondContact O-N 2.79Å; L64-V68 WeakPolarHBondContact O-CG2 2.97Å; L64-V68 PolarHBondContact O-N 2.98Å
65	V	90.7	Very high	87.6	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59.3	-46	175.9	171.9	0	0	0	0	110.8	V43 I46 E47 A61 A62 K67 V68 Y69 Y81	V43-V65 HydrophobicContact CG1-CG1 4.34Å; I46-V65 HydrophobicContact CB-CG2 3.63Å; I46-V65 HydrophobicContact CG2-CG2 3.46Å; I46-V65 VanDerWaalsContact CG2-CG2 3.46Å; E47-V65 HydrophobicContact CG-CG1 4.21Å; E47-V65 HydrophobicContact CG-CG2 4.33Å; A61-V65 WeakPolarHBondContact O-CG2 3.44Å; A61-V65 PolarHBondContact O-N 3.2Å; A62-V65 PolarHBondContact O-N 3.1Å; V65-K67 PolarHBondContact O-N 2.89Å; V65-V68 PolarHBondContact O-N 2.92Å; V65-V68 VanDerWaalsContact O-N 3.12Å; V65-Y69 HydrophobicContact CG1-CD2 3.49Å; V65-Y69 VanDerWaalsContact CG1-CD2 3.49Å; V65-Y69 HydrophobicContact CG1-CE2 3.43Å; V65-Y69 VanDerWaalsContact CG1-CE2 3.43Å; V65-Y69 WeakPolarHBondContact O-CD2 3.34Å; V65-Y69 PolarHBondContact O-N 3.43Å; V65-Y81 HydrophobicContact CB-CD1 4.4Å; V65-Y81 HydrophobicContact CB-CD2 4.47Å; V65-Y81 HydrophobicContact CB-CG 4.18Å; V65-Y81 HydrophobicContact CG1-CD1 3.93Å; V65-Y81 HydrophobicContact CG1-CD2 3.39Å; V65-Y81 HydrophobicContact CG1-CE1 4.19Å; V65-Y81 HydrophobicContact CG1-CE2 3.7Å; V65-Y81 HydrophobicContact CG1-CG 3.54Å
66	S	90.3	Very high	88	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-56.4	-45.9	175.9	178	0	0	0	0	112.7	A62 L64 V68 Y69 Y70 A78 A82 F97	A62-S66 VanDerWaalsContact O-CB 3.31Å; A62-S66 WeakPolarHBondContact O-CB 3.47Å; A62-S66 PolarHBondContact O-N 3.28Å; L64-S66 VanDerWaalsContact C-N 3.35Å; L64-S66 PolarHBondContact O-N 3.47Å; S66-V68 PolarHBondContact O-N 3Å; S66-Y69 PolarHBondContact O-N 3.37Å; S66-Y70 WeakPolarHBondContact O-CB 3.22Å; S66-Y70 PolarHBondContact O-N 3.11Å; S66-A78 WeakPolarHBondContact CB-O 3.49Å; S66-A78 PolarHBondContact OG-O 3.45Å; S66-A82 WeakPolarHBondContact OG-CB 3.28Å; S66-A82 PolarHBondContact OG-N 3.13Å; S66-F97 WeakPolarHBondContact OG-CZ 3.22Å
67	K	89.9	Confident	88.5	Confident	23 Å²	23	36 Å²	36	10%	0.1	18%	0.181	C	C	.	.	H	α-helix	trans	-63.7	-37.8	174.7	-93.7	-158.5	164	-152.9	0	113.3	Y29 V32 D33 L63 L64 V65 Y70 H71 F97	Y29-K67 HydrophobicContact CE2-CD 4.15Å; V32-K67 HydrophobicContact CG1-CB 4.3Å; V32-K67 HydrophobicContact CG1-CD 3.44Å; V32-K67 VanDerWaalsContact CG1-CD 3.44Å; V32-K67 HydrophobicContact CG2-CB 4.09Å; D33-K67 IonicContact OD1-NZ 2.69Å; D33-K67 PolarHBondContact OD1-NZ 3.24Å; D33-K67 IonicContact OD2-NZ 2.93Å; D33-K67 PolarHBondContact OD2-NZ 3.45Å; L63-K67 PolarHBondContact O-N 3.38Å; L64-K67 PolarHBondContact O-N 2.79Å; V65-K67 PolarHBondContact O-N 2.89Å; K67-Y70 PolarHBondContact O-N 3.32Å; K67-H71 PolarHBondContact O-CD2 3.27Å; K67-H71 PolarHBondContact O-N 2.98Å; K67-H71 VanDerWaalsContact O-N 3.13Å; K67-F97 HydrophobicContact CB-CE2 4.41Å; K67-F97 HydrophobicContact CG-CD1 4.28Å; K67-F97 HydrophobicContact CG-CD2 3.99Å; K67-F97 HydrophobicContact CG-CE1 4.07Å; K67-F97 HydrophobicContact CG-CE2 3.76Å; K67-F97 HydrophobicContact CG-CG 4.25Å; K67-F97 HydrophobicContact CG-CZ 3.81Å
68	V	91.2	Very high	88.9	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-68.2	-42.5	176.8	177.5	0	0	0	0	110.7	V32 I39 V43 L64 V65 S66 Y70 H71 L72	V32-V68 HydrophobicContact CG2-CG2 3.77Å; I39-V68 HydrophobicContact CB-CG2 4.15Å; I39-V68 HydrophobicContact CG2-CG2 3.67Å; V43-V68 HydrophobicContact CG2-CB 4.17Å; V43-V68 HydrophobicContact CG2-CG1 3.5Å; L64-V68 WeakPolarHBondContact O-CG2 2.97Å; L64-V68 PolarHBondContact O-N 2.98Å; V65-V68 PolarHBondContact O-N 2.92Å; V65-V68 VanDerWaalsContact O-N 3.12Å; S66-V68 PolarHBondContact O-N 3Å; V68-Y70 VanDerWaalsContact C-N 3.33Å; V68-Y70 PolarHBondContact O-N 2.92Å; V68-H71 PolarHBondContact O-N 3.33Å; V68-L72 HydrophobicContact CG1-CD1 3.99Å; V68-L72 HydrophobicContact CG1-CG 4.44Å; V68-L72 WeakPolarHBondContact O-CG 3.34Å; V68-L72 PolarHBondContact O-N 3.08Å
69	Y	91.6	Very high	89.1	Confident	34 Å²	34	30.6 Å²	30.6	13%	0.133	16%	0.157	C	C	.	.	H	α-helix	trans	-65.3	-33.3	174.7	-81.2	-63.1	0	0	0	113.6	V43 E47 V65 S66 L72 A73 V74 D77 Y81	V43-Y69 HydrophobicContact CG1-CE2 3.82Å; E47-Y69 PolarHBondContact OE1-OH 3.07Å; V65-Y69 HydrophobicContact CG1-CD2 3.49Å; V65-Y69 VanDerWaalsContact CG1-CD2 3.49Å; V65-Y69 HydrophobicContact CG1-CE2 3.43Å; V65-Y69 VanDerWaalsContact CG1-CE2 3.43Å; V65-Y69 WeakPolarHBondContact O-CD2 3.34Å; V65-Y69 PolarHBondContact O-N 3.43Å; S66-Y69 PolarHBondContact O-N 3.37Å; Y69-L72 HydrophobicContact CD1-CD1 4.19Å; Y69-L72 CarbonylContact O-C 3.6Å; Y69-L72 PolarHBondContact O-N 3.29Å; Y69-A73 PolarHBondContact O-N 2.97Å; Y69-V74 HydrophobicContact CD1-CB 3.9Å; Y69-V74 HydrophobicContact CD1-CG1 4.38Å; Y69-V74 HydrophobicContact CD1-CG2 4.36Å; Y69-V74 PolarHBondContact O-N 3.4Å; Y69-D77 HydrophobicContact CD1-CB 3.89Å; Y69-D77 HydrophobicContact CD2-CB 3.87Å; Y69-D77 HydrophobicContact CE1-CB 4Å; Y69-D77 HydrophobicContact CE2-CB 4.02Å; Y69-D77 HydrophobicContact CG-CB 3.8Å; Y69-Y81 AromaticContact CD2-CD2 3.85Å; Y69-Y81 HydrophobicContact CD2-CD2 3.85Å; Y69-Y81 HydrophobicContact CD2-CE2 4.14Å; Y69-Y81 AromaticContact CE2-CD2 3.84Å; Y69-Y81 HydrophobicContact CE2-CD2 3.84Å; Y69-Y81 AromaticContact CE2-CE2 3.63Å; Y69-Y81 HydrophobicContact CE2-CE2 3.63Å
70	Y	91.4	Very high	89.2	Confident	39 Å²	39	30.1 Å²	30.1	15%	0.153	16%	0.155	C	C	.	.	H	α-helix	trans	-59.9	-47.4	169.7	166.7	-93.8	0	0	0	111.9	S66 K67 V68 L72 A73 Y75 F97 T100	S66-Y70 WeakPolarHBondContact O-CB 3.22Å; S66-Y70 PolarHBondContact O-N 3.11Å; K67-Y70 PolarHBondContact O-N 3.32Å; V68-Y70 VanDerWaalsContact C-N 3.33Å; V68-Y70 PolarHBondContact O-N 2.92Å; Y70-L72 VanDerWaalsContact C-N 3.28Å; Y70-L72 PolarHBondContact O-N 3.47Å; Y70-A73 WeakPolarHBondContact O-CA 3.06Å; Y70-A73 PolarHBondContact O-N 3.09Å; Y70-Y75 HydrophobicContact CD2-CE1 4.17Å; Y70-F97 AromaticContact CD1-CD2 3.96Å; Y70-F97 HydrophobicContact CD1-CD2 3.96Å; Y70-F97 AromaticContact CD2-CD2 3.86Å; Y70-F97 HydrophobicContact CD2-CD2 3.86Å; Y70-F97 HydrophobicContact CE1-CB 4.38Å; Y70-F97 HydrophobicContact CE2-CD2 4.43Å; Y70-F97 AromaticContact CG-CD2 3.6Å; Y70-F97 HydrophobicContact CG-CD2 3.6Å; Y70-F97 HydrophobicContact CG-CE2 4.23Å; Y70-T100 HydrophobicContact CD2-CG2 4.38Å; Y70-T100 HydrophobicContact CE2-CG2 3.96Å
71	H	89.4	Confident	89.3	Confident	52 Å²	52	30.7 Å²	30.7	24%	0.241	16%	0.156	C	C	.	.	H	α-helix	trans	-68.9	-23.9	175.9	-71.4	-60	0	0	0	113.2	D33 W36 K67 V68 A73	D33-H71 IonicContact OD1-CD2 3.8Å; D33-H71 IonicContact OD1-CE1 2.68Å; D33-H71 IonicContact OD1-NE2 2.7Å; D33-H71 PolarHBondContact OD1-NE2 3.33Å; W36-H71 HydrophobicContact CB-CB 3.88Å; W36-H71 AromaticContact CD1-CG 3.95Å; W36-H71 HydrophobicContact CD2-CB 3.79Å; W36-H71 HydrophobicContact CE3-CB 4.12Å; W36-H71 HydrophobicContact CG-CB 3.68Å; W36-H71 AromaticContact CG-CG 3.89Å; K67-H71 PolarHBondContact O-CD2 3.27Å; K67-H71 PolarHBondContact O-N 2.98Å; K67-H71 VanDerWaalsContact O-N 3.13Å; V68-H71 PolarHBondContact O-N 3.33Å; H71-A73 VanDerWaalsContact C-N 3.28Å
72	L	90.5	Very high	89.3	Confident	69 Å²	69	30.8 Å²	30.8	36%	0.361	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-0.3	168.8	-66.4	169.4	0	0	0	113.6	W36 V68 Y69 Y70 V74	W36-L72 HydrophobicContact CZ3-CD2 4.33Å; V68-L72 HydrophobicContact CG1-CD1 3.99Å; V68-L72 HydrophobicContact CG1-CG 4.44Å; V68-L72 WeakPolarHBondContact O-CG 3.34Å; V68-L72 PolarHBondContact O-N 3.08Å; Y69-L72 HydrophobicContact CD1-CD1 4.19Å; Y69-L72 CarbonylContact O-C 3.6Å; Y69-L72 PolarHBondContact O-N 3.29Å; Y70-L72 VanDerWaalsContact C-N 3.28Å; Y70-L72 PolarHBondContact O-N 3.47Å; L72-V74 HydrophobicContact CB-CG2 4.24Å; L72-V74 PolarHBondContact O-N 2.83Å
73	A	88.9	Confident	89.1	Confident	55 Å²	55	31.3 Å²	31.3	46%	0.455	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	18.4	-174.6	0	0	0	0	0	116	Y69 Y70 H71 Y75	Y69-A73 PolarHBondContact O-N 2.97Å; Y70-A73 WeakPolarHBondContact O-CA 3.06Å; Y70-A73 PolarHBondContact O-N 3.09Å; H71-A73 VanDerWaalsContact C-N 3.28Å; A73-Y75 HydrophobicContact CB-CE2 4.15Å; A73-Y75 VanDerWaalsContact O-CD2 3.25Å; A73-Y75 WeakPolarHBondContact O-CD2 3.44Å; A73-Y75 WeakPolarHBondContact O-CE2 3.43Å; A73-Y75 PolarHBondContact O-N 3.34Å
74	V	90.6	Very high	89	Confident	62 Å²	62	31.2 Å²	31.2	38%	0.376	16%	0.159	S	C	.	.			trans	-91.3	77.5	176.3	-170	0	0	0	0	109.2	Y69 L72 D76 D77 A78	Y69-V74 HydrophobicContact CD1-CB 3.9Å; Y69-V74 HydrophobicContact CD1-CG1 4.38Å; Y69-V74 HydrophobicContact CD1-CG2 4.36Å; Y69-V74 PolarHBondContact O-N 3.4Å; L72-V74 HydrophobicContact CB-CG2 4.24Å; L72-V74 PolarHBondContact O-N 2.83Å; V74-D76 VanDerWaalsContact C-N 3.32Å; V74-D76 PolarHBondContact O-N 3.01Å; V74-D77 HydrophobicContact CG1-CB 4.13Å; V74-D77 VanDerWaalsContact CG1-OD2 3.31Å; V74-D77 WeakPolarHBondContact CG1-OD2 3.16Å; V74-D77 PolarHBondContact O-N 3.13Å; V74-A78 WeakPolarHBondContact O-CB 3.31Å; V74-A78 PolarHBondContact O-N 2.75Å
75	Y	89.7	Confident	88.6	Confident	86 Å²	86	31.2 Å²	31.2	34%	0.337	16%	0.159	S	C	.	.	H	α-helix	trans	-65.8	-27.1	-168.2	-61.3	-69.8	0	0	0	115.3	Y70 A73 L79 T100 K104	Y70-Y75 HydrophobicContact CD2-CE1 4.17Å; A73-Y75 HydrophobicContact CB-CE2 4.15Å; A73-Y75 VanDerWaalsContact O-CD2 3.25Å; A73-Y75 WeakPolarHBondContact O-CD2 3.44Å; A73-Y75 WeakPolarHBondContact O-CE2 3.43Å; A73-Y75 PolarHBondContact O-N 3.34Å; Y75-L79 VanDerWaalsContact O-CB 3.24Å; Y75-L79 WeakPolarHBondContact O-CB 3.45Å; Y75-L79 PolarHBondContact O-N 2.79Å; Y75-T100 HydrophobicContact CD1-CG2 4.1Å; Y75-T100 HydrophobicContact CE1-CG2 3.73Å; Y75-K104 HydrophobicContact CD1-CG 4.38Å; Y75-K104 HydrophobicContact CG-CD 4.32Å; Y75-K104 HydrophobicContact CG-CG 4.19Å
76	D	86.5	Confident	88.1	Confident	72 Å²	72	35 Å²	35	39%	0.385	18%	0.177	S	C	.	.	H	α-helix	trans	-69.7	-45.4	179.3	-88.9	-37.3	0	0	0	112.3	V74 L79 H80 K108	V74-D76 VanDerWaalsContact C-N 3.32Å; V74-D76 PolarHBondContact O-N 3.01Å; D76-L79 PolarHBondContact O-N 2.72Å; D76-H80 PolarHBondContact O-N 2.97Å; D76-K108 VanDerWaalsContact OD1-CD 3.3Å; D76-K108 WeakPolarHBondContact OD1-CD 3.32Å; D76-K108 WeakPolarHBondContact OD1-CE 3.25Å; D76-K108 IonicContact OD1-NZ 3.09Å; D76-K108 PolarHBondContact OD1-NZ 3.47Å; D76-K108 IonicContact OD2-NZ 2.66Å; D76-K108 PolarHBondContact OD2-NZ 3.23Å
77	D	87.1	Confident	87.5	Confident	66 Å²	66	41.3 Å²	41.3	35%	0.353	21%	0.211	S	C	.	.	H	α-helix	trans	-67.3	-42.6	173.3	-64.3	-26.3	0	0	0	110.3	Y69 V74 L79 H80 Y81	Y69-D77 HydrophobicContact CD1-CB 3.89Å; Y69-D77 HydrophobicContact CD2-CB 3.87Å; Y69-D77 HydrophobicContact CE1-CB 4Å; Y69-D77 HydrophobicContact CE2-CB 4.02Å; Y69-D77 HydrophobicContact CG-CB 3.8Å; V74-D77 HydrophobicContact CG1-CB 4.13Å; V74-D77 VanDerWaalsContact CG1-OD2 3.31Å; V74-D77 WeakPolarHBondContact CG1-OD2 3.16Å; V74-D77 PolarHBondContact O-N 3.13Å; D77-L79 VanDerWaalsContact C-N 3.26Å; D77-L79 PolarHBondContact O-N 3.01Å; D77-H80 PolarHBondContact O-N 3.37Å; D77-H80 VanDerWaalsContact O-N 3.12Å; D77-Y81 HydrophobicContact CB-CD2 4.46Å; D77-Y81 HydrophobicContact CB-CE2 4.49Å; D77-Y81 WeakPolarHBondContact O-CD2 3.41Å; D77-Y81 PolarHBondContact O-N 2.74Å
78	A	89.7	Confident	87	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-55.5	-42.3	175.1	0	0	0	0	0	111.9	S66 V74 A82 I101	S66-A78 WeakPolarHBondContact CB-O 3.49Å; S66-A78 PolarHBondContact OG-O 3.45Å; V74-A78 WeakPolarHBondContact O-CB 3.31Å; V74-A78 PolarHBondContact O-N 2.75Å; A78-A82 VanDerWaalsContact O-CB 3.27Å; A78-A82 WeakPolarHBondContact O-CB 3.43Å; A78-A82 PolarHBondContact O-N 2.69Å; A78-I101 HydrophobicContact CB-CD1 3.7Å
79	L	88.3	Confident	86.5	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-67.9	-44.9	175.1	178.1	63.6	0	0	0	111.8	Y75 D76 D77 Y81 A82 L83 I101 C105 K108 W136 L146	Y75-L79 VanDerWaalsContact O-CB 3.24Å; Y75-L79 WeakPolarHBondContact O-CB 3.45Å; Y75-L79 PolarHBondContact O-N 2.79Å; D76-L79 PolarHBondContact O-N 2.72Å; D77-L79 VanDerWaalsContact C-N 3.26Å; D77-L79 PolarHBondContact O-N 3.01Å; L79-Y81 PolarHBondContact O-N 3.11Å; L79-A82 PolarHBondContact O-N 3.29Å; L79-L83 HydrophobicContact CD1-CD1 4.24Å; L79-L83 HydrophobicContact CD1-CG 4.17Å; L79-L83 HydrophobicContact CG-CD1 4.2Å; L79-L83 VanDerWaalsContact O-CG 3.28Å; L79-L83 WeakPolarHBondContact O-CG 3.48Å; L79-L83 PolarHBondContact O-N 3.21Å; L79-I101 HydrophobicContact CD1-CG2 4.08Å; L79-C105 HydrophobicContact CD1-CB 3.66Å; L79-K108 HydrophobicContact CD2-CB 3.95Å; L79-K108 HydrophobicContact CD2-CG 4.33Å; L79-W136 HydrophobicContact CB-CH2 4.5Å; L79-W136 HydrophobicContact CD2-CH2 3.82Å; L79-W136 HydrophobicContact CD2-CZ3 4.34Å; L79-W136 HydrophobicContact CG-CH2 3.96Å; L79-L146 HydrophobicContact CD1-CD1 4.34Å; L79-L146 HydrophobicContact CD2-CD1 4.04Å; L79-L146 HydrophobicContact CG-CD1 4.48Å
80	H	88.2	Confident	85.9	Confident	45 Å²	45	47.2 Å²	47.2	21%	0.208	24%	0.244	C	C	.	.	H	α-helix	trans	-55	-51.5	176.7	-177.5	78.2	0	0	0	111.3	D76 D77 L83 C84 W136	D76-H80 PolarHBondContact O-N 2.97Å; D77-H80 PolarHBondContact O-N 3.37Å; D77-H80 VanDerWaalsContact O-N 3.12Å; H80-L83 PolarHBondContact O-N 2.92Å; H80-C84 PolarHBondContact O-N 3.33Å; H80-C84 VanDerWaalsContact O-N 3.11Å; H80-C84 PolarHBondContact O-SG 2.86Å; H80-C84 VanDerWaalsContact O-SG 3.35Å; H80-W136 HydrophobicContact CB-CZ2 4.36Å
81	Y	87.7	Confident	85.1	Confident	34 Å²	34	45.9 Å²	45.9	13%	0.133	24%	0.24	C	C	.	.	H	α-helix	trans	-71.2	-30.2	180	-69.8	-68.8	0	0	0	113.2	E47 H50 A62 V65 Y69 D77 L79 C84 A85	E47-Y81 PolarHBondContact OE1-OH 3.16Å; H50-Y81 AromaticContact CD2-CE1 3.92Å; A62-Y81 WeakPolarHBondContact CB-O 3.5Å; V65-Y81 HydrophobicContact CB-CD1 4.4Å; V65-Y81 HydrophobicContact CB-CD2 4.47Å; V65-Y81 HydrophobicContact CB-CG 4.18Å; V65-Y81 HydrophobicContact CG1-CD1 3.93Å; V65-Y81 HydrophobicContact CG1-CD2 3.39Å; V65-Y81 HydrophobicContact CG1-CE1 4.19Å; V65-Y81 HydrophobicContact CG1-CE2 3.7Å; V65-Y81 HydrophobicContact CG1-CG 3.54Å; Y69-Y81 AromaticContact CD2-CD2 3.85Å; Y69-Y81 HydrophobicContact CD2-CD2 3.85Å; Y69-Y81 HydrophobicContact CD2-CE2 4.14Å; Y69-Y81 AromaticContact CE2-CD2 3.84Å; Y69-Y81 HydrophobicContact CE2-CD2 3.84Å; Y69-Y81 AromaticContact CE2-CE2 3.63Å; Y69-Y81 HydrophobicContact CE2-CE2 3.63Å; D77-Y81 HydrophobicContact CB-CD2 4.46Å; D77-Y81 HydrophobicContact CB-CE2 4.49Å; D77-Y81 WeakPolarHBondContact O-CD2 3.41Å; D77-Y81 PolarHBondContact O-N 2.74Å; L79-Y81 PolarHBondContact O-N 3.11Å; Y81-C84 PolarHBondContact O-N 2.84Å; Y81-A85 PolarHBondContact O-N 3Å; Y81-A85 VanDerWaalsContact O-N 3.12Å
82	A	87.3	Confident	84.3	Confident	2 Å²	2	49 Å²	49	2%	0.017	26%	0.258	C	S	.	.	H	α-helix	trans	-62.1	-46.1	171.2	0	0	0	0	0	111.7	S66 A78 L79 C84 A85 F89 I101	S66-A82 WeakPolarHBondContact OG-CB 3.28Å; S66-A82 PolarHBondContact OG-N 3.13Å; A78-A82 VanDerWaalsContact O-CB 3.27Å; A78-A82 WeakPolarHBondContact O-CB 3.43Å; A78-A82 PolarHBondContact O-N 2.69Å; L79-A82 PolarHBondContact O-N 3.29Å; A82-C84 VanDerWaalsContact C-N 3.26Å; A82-C84 PolarHBondContact O-N 3.22Å; A82-A85 WeakPolarHBondContact O-CB 3.47Å; A82-A85 PolarHBondContact O-N 3.05Å; A82-A85 VanDerWaalsContact O-N 3.13Å; A82-F89 HydrophobicContact CB-CD2 4.16Å; A82-F89 HydrophobicContact CB-CE2 4.2Å; A82-I101 HydrophobicContact CB-CG2 3.74Å
83	L	85.8	Confident	83.7	Confident	10 Å²	10	48.7 Å²	48.7	5%	0.052	26%	0.26	C	S	.	.	H	α-helix	trans	-62.9	-34.6	176.9	-66.5	174	0	0	0	111.8	L79 H80 A85 E86 W136 T142 R145 L146 V149	L79-L83 HydrophobicContact CD1-CD1 4.24Å; L79-L83 HydrophobicContact CD1-CG 4.17Å; L79-L83 HydrophobicContact CG-CD1 4.2Å; L79-L83 VanDerWaalsContact O-CG 3.28Å; L79-L83 WeakPolarHBondContact O-CG 3.48Å; L79-L83 PolarHBondContact O-N 3.21Å; H80-L83 PolarHBondContact O-N 2.92Å; L83-A85 VanDerWaalsContact C-N 3.33Å; L83-E86 PolarHBondContact O-N 2.8Å; L83-W136 HydrophobicContact CD1-CH2 4.37Å; L83-W136 HydrophobicContact CD1-CZ3 4.16Å; L83-T142 HydrophobicContact CD1-CG2 4.11Å; L83-R145 HydrophobicContact CB-CB 4.04Å; L83-R145 HydrophobicContact CD2-CB 4.24Å; L83-R145 WeakPolarHBondContact O-CD 3.35Å; L83-L146 HydrophobicContact CD1-CB 3.95Å; L83-L146 HydrophobicContact CD1-CD1 3.84Å; L83-V149 HydrophobicContact CD2-CB 4.38Å; L83-V149 HydrophobicContact CD2-CG2 3.67Å
84	C	84.1	Confident	83.3	Confident	6 Å²	6	51.7 Å²	51.7	4%	0.041	27%	0.268	C	S	.	.	H	α-helix	trans	-73.7	-16.4	175.8	-71.2	0	0	0	0	114.7	H50 A62 H80 Y81 A82 E86 R145	H50-C84 WeakPolarHBondContact NE2-CB 3.33Å; A62-C84 HydrophobicContact CB-CB 4.21Å; H80-C84 PolarHBondContact O-N 3.33Å; H80-C84 VanDerWaalsContact O-N 3.11Å; H80-C84 PolarHBondContact O-SG 2.86Å; H80-C84 VanDerWaalsContact O-SG 3.35Å; Y81-C84 PolarHBondContact O-N 2.84Å; A82-C84 VanDerWaalsContact C-N 3.26Å; A82-C84 PolarHBondContact O-N 3.22Å; C84-E86 VanDerWaalsContact C-N 3.31Å; C84-R145 PolarHBondContact SG-NH1 3.02Å
85	A	81.9	Confident	83	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-16.4	173.9	0	0	0	0	0	113.7	A62 L63 Y81 A82 L83 D87 L88	A62-A85 HydrophobicContact CB-CB 4.16Å; L63-A85 HydrophobicContact CB-CB 3.96Å; L63-A85 HydrophobicContact CD1-CB 4.32Å; Y81-A85 PolarHBondContact O-N 3Å; Y81-A85 VanDerWaalsContact O-N 3.12Å; A82-A85 WeakPolarHBondContact O-CB 3.47Å; A82-A85 PolarHBondContact O-N 3.05Å; A82-A85 VanDerWaalsContact O-N 3.13Å; L83-A85 VanDerWaalsContact C-N 3.33Å; A85-D87 PolarHBondContact O-N 2.93Å; A85-L88 PolarHBondContact O-N 3Å
86	E	79.8	Confident	82.8	Confident	79 Å²	79	54.6 Å²	54.6	37%	0.369	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	46.9	-103.8	177.1	-61.9	-176.8	161.3	0	0	113.9	K59 L83 C84 L88 F89 R145	K59-E86 HydrophobicContact CD-CB 4.41Å; K59-E86 WeakPolarHBondContact CE-OE2 3.29Å; K59-E86 IonicContact NZ-OE2 3.19Å; K59-E86 PolarHBondContact NZ-OE2 2.69Å; L83-E86 PolarHBondContact O-N 2.8Å; C84-E86 VanDerWaalsContact C-N 3.31Å; E86-L88 PolarHBondContact O-N 3.04Å; E86-F89 PolarHBondContact O-N 2.99Å; E86-R145 IonicContact OE1-CZ 2.89Å; E86-R145 IonicContact OE1-NE 3.88Å; E86-R145 PolarHBondContact OE1-NE 2.95Å; E86-R145 IonicContact OE1-NH2 2.66Å; E86-R145 PolarHBondContact OE1-NH2 3.02Å
87	D	77.9	Confident	82.9	Confident	133 Å²	133	51.9 Å²	51.9	71%	0.711	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-71.4	-15.6	-172	-45.4	-76.7	0	0	0	114	K59 A85	K59-D87 IonicContact NZ-OD2 2.74Å; K59-D87 PolarHBondContact NZ-OD2 2.65Å; A85-D87 PolarHBondContact O-N 2.93Å
88	L	80.1	Confident	82.9	Confident	86 Å²	86	49.1 Å²	49.1	45%	0.45	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-85.4	-12	177.3	-62.5	-179.2	0	0	0	113.2	K59 L60 L63 A85 E86 D90	K59-L88 HydrophobicContact CB-CD1 3.79Å; K59-L88 HydrophobicContact CB-CG 4.32Å; L60-L88 HydrophobicContact CB-CD1 3.99Å; L60-L88 HydrophobicContact CD1-CD1 4.42Å; L63-L88 HydrophobicContact CD2-CB 4.12Å; A85-L88 PolarHBondContact O-N 3Å; E86-L88 PolarHBondContact O-N 3.04Å; L88-D90 PolarHBondContact O-N 2.69Å
89	F	80.5	Confident	82.8	Confident	18 Å²	18	53.7 Å²	53.7	8%	0.079	28%	0.276	C	S	.	.			trans	-92.5	82.5	176.4	-173.3	-100.8	0	0	0	110.4	L63 A82 E86 I91 F97 V98 I101	L63-F89 HydrophobicContact CD1-CD2 4.31Å; A82-F89 HydrophobicContact CB-CD2 4.16Å; A82-F89 HydrophobicContact CB-CE2 4.2Å; E86-F89 PolarHBondContact O-N 2.99Å; F89-I91 HydrophobicContact CD1-CG1 4.1Å; F89-I91 HydrophobicContact CE1-CG1 4.02Å; F89-I91 PolarHBondContact O-N 2.84Å; F89-F97 HydrophobicContact CD2-CE1 4.28Å; F89-F97 AromaticContact CE2-CE1 3.96Å; F89-F97 HydrophobicContact CE2-CE1 3.96Å; F89-F97 HydrophobicContact CE2-CZ 4.43Å; F89-V98 HydrophobicContact CE2-CG2 4.1Å; F89-V98 HydrophobicContact CZ-CG1 4.24Å; F89-V98 HydrophobicContact CZ-CG2 4.41Å; F89-I101 HydrophobicContact CE1-CG2 4.41Å; F89-I101 HydrophobicContact CE2-CB 4.22Å; F89-I101 HydrophobicContact CE2-CG2 3.86Å; F89-I101 HydrophobicContact CZ-CB 3.99Å; F89-I101 HydrophobicContact CZ-CG2 3.54Å
90	D	77.6	Confident	82.8	Confident	77 Å²	77	55.6 Å²	55.6	41%	0.412	29%	0.288	S	S	.	.			trans	-80.4	101.7	178.9	-173.6	8.4	0	0	0	112.4	L88 N92 T93	L88-D90 PolarHBondContact O-N 2.69Å; D90-N92 PolarHBondContact O-N 2.89Å; D90-N92 VanDerWaalsContact O-N 3.07Å; D90-N92 WeakPolarHBondContact OD1-CB 3.05Å; D90-N92 PolarHBondContact OD1-N 2.96Å; D90-N92 PolarHBondContact OD1-ND2 2.71Å; D90-T93 WeakPolarHBondContact O-CB 3.44Å; D90-T93 PolarHBondContact O-N 2.84Å; D90-T93 PolarHBondContact O-OG1 2.78Å
91	I	74.9	Confident	82.8	Confident	11 Å²	11	53.6 Å²	53.6	6%	0.056	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-21.8	174.4	-63	173.9	0	0	0	113.3	F89 T93 I102 V149 K152 R156	F89-I91 HydrophobicContact CD1-CG1 4.1Å; F89-I91 HydrophobicContact CE1-CG1 4.02Å; F89-I91 PolarHBondContact O-N 2.84Å; I91-T93 VanDerWaalsContact C-N 3.3Å; I91-I102 HydrophobicContact CB-CD1 4.5Å; I91-I102 HydrophobicContact CG2-CD1 3.87Å; I91-V149 HydrophobicContact CD1-CB 4.34Å; I91-V149 HydrophobicContact CD1-CG1 3.88Å; I91-V149 HydrophobicContact CD1-CG2 4.32Å; I91-K152 HydrophobicContact CD1-CB 3.81Å; I91-K152 HydrophobicContact CD1-CD 3.67Å; I91-K152 HydrophobicContact CD1-CG 4.4Å; I91-R156 PolarHBondContact O-NH1 2.96Å; I91-R156 VanDerWaalsContact O-NH1 3.1Å
92	N	73.3	Confident	82.8	Confident	117 Å²	117	52.6 Å²	52.6	63%	0.626	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-11.6	177.6	-56.7	-75.4	0	0	0	113.1	D90 N94	D90-N92 PolarHBondContact O-N 2.89Å; D90-N92 VanDerWaalsContact O-N 3.07Å; D90-N92 WeakPolarHBondContact OD1-CB 3.05Å; D90-N92 PolarHBondContact OD1-N 2.96Å; D90-N92 PolarHBondContact OD1-ND2 2.71Å; N92-N94 PolarHBondContact O-N 2.82Å
93	T	78.5	Confident	82.9	Confident	64 Å²	64	54.7 Å²	54.7	39%	0.393	29%	0.293	S	S	.	.			trans	-78.7	108.7	-176.7	-40.2	0	0	0	0	110.7	D90 I91 T95 V98	D90-T93 WeakPolarHBondContact O-CB 3.44Å; D90-T93 PolarHBondContact O-N 2.84Å; D90-T93 PolarHBondContact O-OG1 2.78Å; I91-T93 VanDerWaalsContact C-N 3.3Å; T93-T95 HydrophobicContact CG2-CG2 3.97Å; T93-T95 PolarHBondContact O-N 2.93Å; T93-V98 WeakPolarHBondContact O-CB 3.31Å; T93-V98 WeakPolarHBondContact O-CG1 3.45Å
94	N	79.2	Confident	83	Confident	117 Å²	117	58 Å²	58	63%	0.626	31%	0.307	S	S	*	.			trans	-76.3	70.2	-176	-150.5	104.8	0	0	0	112.4	N92 E99	N92-N94 PolarHBondContact O-N 2.82Å; N94-E99 PolarHBondContact ND2-OE1 3.28Å; N94-E99 PolarHBondContact OD1-OE1 2.96Å
95	T	85.8	Confident	83.2	Confident	61 Å²	61	57.8 Å²	57.8	37%	0.374	31%	0.305	S	S	.	.			trans	-121.9	146.8	178.6	53.8	0	0	0	0	110.7	T93 F97 V98 E99	T93-T95 HydrophobicContact CG2-CG2 3.97Å; T93-T95 PolarHBondContact O-N 2.93Å; T95-F97 PolarHBondContact O-N 2.6Å; T95-F97 VanDerWaalsContact O-N 3.16Å; T95-V98 PolarHBondContact O-N 3.02Å; T95-V98 WeakPolarHBondContact OG1-CG2 3.32Å; T95-E99 PolarHBondContact O-N 3.05Å
96	E	85.5	Confident	83.5	Confident	148 Å²	148	59 Å²	59	69%	0.692	31%	0.312	S	S	*	.	H	α-helix	trans	-53.1	-38.1	-178.9	-60.7	172.4	173.8	0	0	112.5	T100	E96-T100 VanDerWaalsContact O-CB 3.25Å; E96-T100 WeakPolarHBondContact O-CB 3.38Å; E96-T100 PolarHBondContact O-N 3.16Å; E96-T100 PolarHBondContact O-OG1 3.48Å
97	F	87.6	Confident	84	Confident	15 Å²	15	58.8 Å²	58.8	7%	0.066	31%	0.313	C	S	.	.	H	α-helix	trans	-58.4	-53.4	172.2	169.5	-107.2	0	0	0	112.4	L63 S66 K67 Y70 F89 T95 T100 I101	L63-F97 HydrophobicContact CD1-CE1 4.12Å; L63-F97 HydrophobicContact CD1-CZ 4.35Å; S66-F97 WeakPolarHBondContact OG-CZ 3.22Å; K67-F97 HydrophobicContact CB-CE2 4.41Å; K67-F97 HydrophobicContact CG-CD1 4.28Å; K67-F97 HydrophobicContact CG-CD2 3.99Å; K67-F97 HydrophobicContact CG-CE1 4.07Å; K67-F97 HydrophobicContact CG-CE2 3.76Å; K67-F97 HydrophobicContact CG-CG 4.25Å; K67-F97 HydrophobicContact CG-CZ 3.81Å; Y70-F97 AromaticContact CD1-CD2 3.96Å; Y70-F97 HydrophobicContact CD1-CD2 3.96Å; Y70-F97 AromaticContact CD2-CD2 3.86Å; Y70-F97 HydrophobicContact CD2-CD2 3.86Å; Y70-F97 HydrophobicContact CE1-CB 4.38Å; Y70-F97 HydrophobicContact CE2-CD2 4.43Å; Y70-F97 AromaticContact CG-CD2 3.6Å; Y70-F97 HydrophobicContact CG-CD2 3.6Å; Y70-F97 HydrophobicContact CG-CE2 4.23Å; F89-F97 HydrophobicContact CD2-CE1 4.28Å; F89-F97 AromaticContact CE2-CE1 3.96Å; F89-F97 HydrophobicContact CE2-CE1 3.96Å; F89-F97 HydrophobicContact CE2-CZ 4.43Å; T95-F97 PolarHBondContact O-N 2.6Å; T95-F97 VanDerWaalsContact O-N 3.16Å; F97-T100 PolarHBondContact O-N 2.93Å; F97-I101 HydrophobicContact CD2-CG1 4.02Å; F97-I101 HydrophobicContact CE2-CD1 4.27Å; F97-I101 HydrophobicContact CE2-CG1 3.77Å; F97-I101 HydrophobicContact CZ-CG1 4.18Å; F97-I101 WeakPolarHBondContact O-CB 3.41Å; F97-I101 WeakPolarHBondContact O-CG1 3.24Å; F97-I101 PolarHBondContact O-N 2.96Å
98	V	87.1	Confident	84.5	Confident	9 Å²	9	54.6 Å²	54.6	6%	0.055	29%	0.289	C	S	.	.	H	α-helix	trans	-66	-42	-178.8	170.8	0	0	0	0	111	F89 T93 T95 I101 I102	F89-V98 HydrophobicContact CE2-CG2 4.1Å; F89-V98 HydrophobicContact CZ-CG1 4.24Å; F89-V98 HydrophobicContact CZ-CG2 4.41Å; T93-V98 WeakPolarHBondContact O-CB 3.31Å; T93-V98 WeakPolarHBondContact O-CG1 3.45Å; T95-V98 PolarHBondContact O-N 3.02Å; T95-V98 WeakPolarHBondContact OG1-CG2 3.32Å; V98-I101 PolarHBondContact O-N 3.18Å; V98-I102 HydrophobicContact CG1-CD1 3.57Å; V98-I102 HydrophobicContact CG1-CG1 4.34Å; V98-I102 WeakPolarHBondContact O-CB 3.06Å; V98-I102 WeakPolarHBondContact O-CD1 3.4Å; V98-I102 WeakPolarHBondContact O-CG1 3.45Å; V98-I102 PolarHBondContact O-N 2.98Å
99	E	87	Confident	84.9	Confident	95 Å²	95	50.5 Å²	50.5	44%	0.444	27%	0.267	S	S	.	.	H	α-helix	trans	-61.5	-45.9	176.8	-69.3	-179.9	178.8	0	0	111.9	N94 T95 I102 A103	N94-E99 PolarHBondContact ND2-OE1 3.28Å; N94-E99 PolarHBondContact OD1-OE1 2.96Å; T95-E99 PolarHBondContact O-N 3.05Å; E99-I102 PolarHBondContact O-N 2.99Å; E99-A103 PolarHBondContact O-N 3.15Å
100	T	88.8	Confident	85.3	Confident	41 Å²	41	51 Å²	51	25%	0.252	27%	0.272	S	S	.	.	H	α-helix	trans	-66.7	-41.9	178.9	-55.7	0	0	0	0	112.2	Y70 Y75 E96 F97 I102 A103 K104	Y70-T100 HydrophobicContact CD2-CG2 4.38Å; Y70-T100 HydrophobicContact CE2-CG2 3.96Å; Y75-T100 HydrophobicContact CD1-CG2 4.1Å; Y75-T100 HydrophobicContact CE1-CG2 3.73Å; E96-T100 VanDerWaalsContact O-CB 3.25Å; E96-T100 WeakPolarHBondContact O-CB 3.38Å; E96-T100 PolarHBondContact O-N 3.16Å; E96-T100 PolarHBondContact O-OG1 3.48Å; F97-T100 PolarHBondContact O-N 2.93Å; T100-I102 VanDerWaalsContact C-N 3.35Å; T100-A103 PolarHBondContact O-N 3.38Å; T100-K104 WeakPolarHBondContact O-CG 3.44Å; T100-K104 PolarHBondContact O-N 3.01Å
101	I	88.4	Confident	85.8	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.01	28%	0.275	C	S	.	.	H	α-helix	trans	-67.9	-34.6	176.6	-66	-68.7	0	0	0	111.1	A78 L79 A82 F89 F97 V98 C105	A78-I101 HydrophobicContact CB-CD1 3.7Å; L79-I101 HydrophobicContact CD1-CG2 4.08Å; A82-I101 HydrophobicContact CB-CG2 3.74Å; F89-I101 HydrophobicContact CE1-CG2 4.41Å; F89-I101 HydrophobicContact CE2-CB 4.22Å; F89-I101 HydrophobicContact CE2-CG2 3.86Å; F89-I101 HydrophobicContact CZ-CB 3.99Å; F89-I101 HydrophobicContact CZ-CG2 3.54Å; F97-I101 HydrophobicContact CD2-CG1 4.02Å; F97-I101 HydrophobicContact CE2-CD1 4.27Å; F97-I101 HydrophobicContact CE2-CG1 3.77Å; F97-I101 HydrophobicContact CZ-CG1 4.18Å; F97-I101 WeakPolarHBondContact O-CB 3.41Å; F97-I101 WeakPolarHBondContact O-CG1 3.24Å; F97-I101 PolarHBondContact O-N 2.96Å; V98-I101 PolarHBondContact O-N 3.18Å; I101-C105 WeakPolarHBondContact O-CB 3.4Å; I101-C105 PolarHBondContact O-N 3.44Å
102	I	87.8	Confident	86.3	Confident	14 Å²	14	51.4 Å²	51.4	7%	0.072	28%	0.282	C	S	.	.	H	α-helix	trans	-67.2	-42.7	172.6	-70.7	164.7	0	0	0	111.1	I91 V98 E99 T100 C105 I106 M153	I91-I102 HydrophobicContact CB-CD1 4.5Å; I91-I102 HydrophobicContact CG2-CD1 3.87Å; V98-I102 HydrophobicContact CG1-CD1 3.57Å; V98-I102 HydrophobicContact CG1-CG1 4.34Å; V98-I102 WeakPolarHBondContact O-CB 3.06Å; V98-I102 WeakPolarHBondContact O-CD1 3.4Å; V98-I102 WeakPolarHBondContact O-CG1 3.45Å; V98-I102 PolarHBondContact O-N 2.98Å; E99-I102 PolarHBondContact O-N 2.99Å; T100-I102 VanDerWaalsContact C-N 3.35Å; I102-C105 WeakPolarHBondContact O-CB 3.37Å; I102-C105 PolarHBondContact O-N 3.49Å; I102-I106 HydrophobicContact CG2-CD1 4.04Å; I102-I106 WeakPolarHBondContact O-CG1 3.21Å; I102-I106 PolarHBondContact O-N 3.15Å; I102-M153 HydrophobicContact CG2-SD 4.33Å
103	A	88.5	Confident	86.8	Confident	45 Å²	45	48.8 Å²	48.8	37%	0.372	26%	0.263	S	S	.	.	H	α-helix	trans	-58.4	-51.2	174.9	0	0	0	0	0	110.8	E99 T100 C105 I106 D107	E99-A103 PolarHBondContact O-N 3.15Å; T100-A103 PolarHBondContact O-N 3.38Å; A103-C105 VanDerWaalsContact C-N 3.31Å; A103-C105 PolarHBondContact O-N 3.1Å; A103-I106 PolarHBondContact O-N 2.66Å; A103-D107 VanDerWaalsContact O-CG 3.29Å; A103-D107 PolarHBondContact O-N 3.17Å
104	K	89.3	Confident	87	Confident	80 Å²	80	47.8 Å²	47.8	35%	0.348	26%	0.257	S	S	.	.	H	α-helix	trans	-65.3	-31.3	178.1	-67.3	-73.2	157.6	-137.3	0	113.3	Y75 T100 D107 K108	Y75-K104 HydrophobicContact CD1-CG 4.38Å; Y75-K104 HydrophobicContact CG-CD 4.32Å; Y75-K104 HydrophobicContact CG-CG 4.19Å; T100-K104 WeakPolarHBondContact O-CG 3.44Å; T100-K104 PolarHBondContact O-N 3.01Å; K104-D107 IonicContact NZ-OD2 3.19Å; K104-D107 PolarHBondContact NZ-OD2 2.97Å; K104-K108 WeakPolarHBondContact O-CB 3.45Å; K104-K108 PolarHBondContact O-N 3.37Å
105	C	88.7	Confident	87.1	Confident	1 Å²	1	44 Å²	44	1%	0.007	24%	0.242	C	C	.	.	H	α-helix	trans	-61	-43.4	170.3	178.6	0	0	0	0	111.7	L79 I101 I102 A103 Y109 L146	L79-C105 HydrophobicContact CD1-CB 3.66Å; I101-C105 WeakPolarHBondContact O-CB 3.4Å; I101-C105 PolarHBondContact O-N 3.44Å; I102-C105 WeakPolarHBondContact O-CB 3.37Å; I102-C105 PolarHBondContact O-N 3.49Å; A103-C105 VanDerWaalsContact C-N 3.31Å; A103-C105 PolarHBondContact O-N 3.1Å; C105-Y109 VanDerWaalsContact O-CB 3.25Å; C105-Y109 WeakPolarHBondContact O-CB 3.36Å; C105-Y109 PolarHBondContact O-N 3.36Å; C105-Y109 VanDerWaalsContact O-N 3.14Å; C105-L146 HydrophobicContact CB-CD1 4.28Å; C105-L146 WeakPolarHBondContact SG-CD1 3.46Å
106	I	88	Confident	86.7	Confident	26 Å²	26	43 Å²	43	13%	0.133	23%	0.233	C	C	.	.	H	α-helix	trans	-70.2	-48.9	177.6	-64.7	166.2	0	0	0	109.8	I102 A103 K108 Y109 T110 M153 I169	I102-I106 HydrophobicContact CG2-CD1 4.04Å; I102-I106 WeakPolarHBondContact O-CG1 3.21Å; I102-I106 PolarHBondContact O-N 3.15Å; A103-I106 PolarHBondContact O-N 2.66Å; I106-K108 VanDerWaalsContact C-N 3.35Å; I106-K108 PolarHBondContact O-N 3.25Å; I106-Y109 PolarHBondContact O-N 3.29Å; I106-Y109 VanDerWaalsContact O-N 3.09Å; I106-T110 HydrophobicContact CG2-CG2 4.14Å; I106-T110 WeakPolarHBondContact O-CG2 3.47Å; I106-T110 PolarHBondContact O-N 2.97Å; I106-T110 PolarHBondContact O-OG1 3.15Å; I106-M153 HydrophobicContact CD1-CG 4.44Å; I106-I169 HydrophobicContact CG2-CG2 4.4Å
107	D	90.3	Very high	85.9	Confident	75 Å²	75	37.2 Å²	37.2	40%	0.401	21%	0.207	S	C	.	.	H	α-helix	trans	-51.7	-49.4	176.8	-65	-15.6	0	0	0	112.2	A103 K104 T110 A111	A103-D107 VanDerWaalsContact O-CG 3.29Å; A103-D107 PolarHBondContact O-N 3.17Å; K104-D107 IonicContact NZ-OD2 3.19Å; K104-D107 PolarHBondContact NZ-OD2 2.97Å; D107-T110 PolarHBondContact O-OG1 3.12Å; D107-A111 WeakPolarHBondContact O-CB 3.34Å; D107-A111 PolarHBondContact O-N 2.73Å; D107-A111 VanDerWaalsContact O-N 3.09Å
108	K	86.8	Confident	84.8	Confident	45 Å²	45	42.5 Å²	42.5	20%	0.196	23%	0.231	C	C	.	.	H	α-helix	trans	-68.3	-36.5	-179.5	-157.6	74.7	168.6	-166.8	0	111.2	D76 L79 K104 I106 L112 W136	D76-K108 VanDerWaalsContact OD1-CD 3.3Å; D76-K108 WeakPolarHBondContact OD1-CD 3.32Å; D76-K108 WeakPolarHBondContact OD1-CE 3.25Å; D76-K108 IonicContact OD1-NZ 3.09Å; D76-K108 PolarHBondContact OD1-NZ 3.47Å; D76-K108 IonicContact OD2-NZ 2.66Å; D76-K108 PolarHBondContact OD2-NZ 3.23Å; L79-K108 HydrophobicContact CD2-CB 3.95Å; L79-K108 HydrophobicContact CD2-CG 4.33Å; K104-K108 WeakPolarHBondContact O-CB 3.45Å; K104-K108 PolarHBondContact O-N 3.37Å; I106-K108 VanDerWaalsContact C-N 3.35Å; I106-K108 PolarHBondContact O-N 3.25Å; K108-L112 HydrophobicContact CG-CD1 4.24Å; K108-L112 WeakPolarHBondContact O-CB 3.31Å; K108-L112 WeakPolarHBondContact O-CD1 3.47Å; K108-L112 WeakPolarHBondContact O-CG 3.49Å; K108-L112 PolarHBondContact O-N 3.29Å; K108-W136 HydrophobicContact CG-CE3 4.43Å; K108-W136 HydrophobicContact CG-CZ3 4.48Å
109	Y	89.3	Confident	83.4	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-72.1	-39.6	179.1	-174.6	-103.8	0	0	0	112.9	C105 I106 R113 Y143 L146 E147 V150 T173	C105-Y109 VanDerWaalsContact O-CB 3.25Å; C105-Y109 WeakPolarHBondContact O-CB 3.36Å; C105-Y109 PolarHBondContact O-N 3.36Å; C105-Y109 VanDerWaalsContact O-N 3.14Å; I106-Y109 PolarHBondContact O-N 3.29Å; I106-Y109 VanDerWaalsContact O-N 3.09Å; Y109-R113 HydrophobicContact CD1-CG 4.26Å; Y109-R113 HydrophobicContact CE1-CG 3.94Å; Y109-R113 HydrophobicContact CE2-CG 4.33Å; Y109-R113 VanDerWaalsContact O-CB 3.28Å; Y109-R113 WeakPolarHBondContact O-CB 3.26Å; Y109-R113 VanDerWaalsContact O-CG 3.3Å; Y109-R113 WeakPolarHBondContact O-CG 3.19Å; Y109-R113 PolarHBondContact O-N 3.4Å; Y109-R113 PolarHBondContact OH-NE 2.94Å; Y109-R113 VanDerWaalsContact OH-NE 3.12Å; Y109-R113 PolarHBondContact OH-NH2 3.31Å; Y109-Y143 HydrophobicContact CD2-CE2 4.2Å; Y109-Y143 HydrophobicContact CE2-CE2 4.17Å; Y109-Y143 AromaticContact CE2-CZ 3.84Å; Y109-L146 HydrophobicContact CD2-CD2 3.89Å; Y109-L146 HydrophobicContact CD2-CG 4.1Å; Y109-L146 HydrophobicContact CG-CD2 4.42Å; Y109-E147 HydrophobicContact CE2-CB 3.94Å; Y109-E147 HydrophobicContact CE2-CG 4.29Å; Y109-E147 PolarHBondContact OH-OE1 2.68Å; Y109-V150 HydrophobicContact CD1-CB 4.4Å; Y109-V150 HydrophobicContact CD1-CG1 3.97Å; Y109-V150 HydrophobicContact CD1-CG2 3.98Å; Y109-V150 HydrophobicContact CE1-CG1 3.9Å; Y109-V150 HydrophobicContact CG-CG2 3.99Å; Y109-T173 HydrophobicContact CD1-CG2 3.61Å; Y109-T173 HydrophobicContact CE1-CG2 3.83Å
110	T	88.2	Confident	82	Confident	29 Å²	29	50.6 Å²	50.6	18%	0.178	28%	0.275	C	S	.	.	H	α-helix	trans	-66.9	-40.4	174.7	55.3	0	0	0	0	111.5	I106 D107 R113 T114 E172 T173	I106-T110 HydrophobicContact CG2-CG2 4.14Å; I106-T110 WeakPolarHBondContact O-CG2 3.47Å; I106-T110 PolarHBondContact O-N 2.97Å; I106-T110 PolarHBondContact O-OG1 3.15Å; D107-T110 PolarHBondContact O-OG1 3.12Å; T110-R113 PolarHBondContact O-N 2.84Å; T110-T114 VanDerWaalsContact O-CB 3.3Å; T110-T114 WeakPolarHBondContact O-CB 3.4Å; T110-T114 PolarHBondContact O-N 2.81Å; T110-T114 PolarHBondContact O-OG1 3.43Å; T110-E172 HydrophobicContact CG2-CB 3.91Å; T110-T173 HydrophobicContact CG2-CG2 3.59Å
111	A	88.2	Confident	80.1	Confident	57 Å²	57	52.9 Å²	52.9	47%	0.471	29%	0.285	S	S	.	.	H	α-helix	trans	-61.3	-50.9	173.5	0	0	0	0	0	112	D107 R113 T114 A115	D107-A111 WeakPolarHBondContact O-CB 3.34Å; D107-A111 PolarHBondContact O-N 2.73Å; D107-A111 VanDerWaalsContact O-N 3.09Å; A111-R113 PolarHBondContact O-N 3.43Å; A111-T114 PolarHBondContact O-N 3.38Å; A111-A115 PolarHBondContact O-N 2.94Å
112	L	86.8	Confident	77.9	Confident	39 Å²	39	56.7 Å²	56.7	20%	0.204	31%	0.312	C	S	.	.	H	α-helix	trans	-61.9	-40.4	177.4	-72.2	168.8	0	0	0	112.2	K108 Q116 W136 Y143 L146	K108-L112 HydrophobicContact CG-CD1 4.24Å; K108-L112 WeakPolarHBondContact O-CB 3.31Å; K108-L112 WeakPolarHBondContact O-CD1 3.47Å; K108-L112 WeakPolarHBondContact O-CG 3.49Å; K108-L112 PolarHBondContact O-N 3.29Å; L112-Q116 WeakPolarHBondContact O-CB 3.36Å; L112-Q116 WeakPolarHBondContact O-CG 3.41Å; L112-Q116 PolarHBondContact O-N 3.05Å; L112-W136 HydrophobicContact CD1-CB 4.2Å; L112-W136 HydrophobicContact CD1-CE3 4.24Å; L112-W136 HydrophobicContact CD2-CB 4.17Å; L112-Y143 HydrophobicContact CB-CE2 4.35Å; L112-Y143 HydrophobicContact CD1-CD2 4.27Å; L112-Y143 HydrophobicContact CD1-CE2 4.38Å; L112-L146 HydrophobicContact CD1-CD2 3.98Å
113	R	83	Confident	75.4	Confident	61 Å²	61	62.5 Å²	62.5	23%	0.23	35%	0.354	C	S	.	.	H	α-helix	trans	-65.6	-38.9	174.9	-79.8	-72.7	-175	-155.3	8.8	112.3	Y109 T110 A111 D117 Y143 E147 T173	Y109-R113 HydrophobicContact CD1-CG 4.26Å; Y109-R113 HydrophobicContact CE1-CG 3.94Å; Y109-R113 HydrophobicContact CE2-CG 4.33Å; Y109-R113 VanDerWaalsContact O-CB 3.28Å; Y109-R113 WeakPolarHBondContact O-CB 3.26Å; Y109-R113 VanDerWaalsContact O-CG 3.3Å; Y109-R113 WeakPolarHBondContact O-CG 3.19Å; Y109-R113 PolarHBondContact O-N 3.4Å; Y109-R113 PolarHBondContact OH-NE 2.94Å; Y109-R113 VanDerWaalsContact OH-NE 3.12Å; Y109-R113 PolarHBondContact OH-NH2 3.31Å; T110-R113 PolarHBondContact O-N 2.84Å; A111-R113 PolarHBondContact O-N 3.43Å; R113-D117 PolarHBondContact O-N 3.49Å; R113-Y143 PolarHBondContact NE-OH 2.89Å; R113-Y143 PolarHBondContact NH1-OH 3.3Å; R113-E147 IonicContact CZ-OE1 2.99Å; R113-E147 IonicContact NH2-OE1 3.82Å; R113-E147 PolarHBondContact NH2-OE1 3.12Å; R113-T173 WeakPolarHBondContact CG-O 3.46Å
114	T	83.4	Confident	72.7	Confident	43 Å²	43	63 Å²	63	26%	0.264	36%	0.363	S	S	.	.	H	α-helix	trans	-66.3	-43.5	176.8	-78.1	0	0	0	0	112.3	T110 A111 D117 Q118 R174	T110-T114 VanDerWaalsContact O-CB 3.3Å; T110-T114 WeakPolarHBondContact O-CB 3.4Å; T110-T114 PolarHBondContact O-N 2.81Å; T110-T114 PolarHBondContact O-OG1 3.43Å; A111-T114 PolarHBondContact O-N 3.38Å; T114-D117 PolarHBondContact O-N 3.35Å; T114-Q118 PolarHBondContact O-N 3.1Å; T114-R174 PolarHBondContact OG1-NE 3.47Å; T114-R174 VanDerWaalsContact OG1-NE 3.13Å; T114-R174 PolarHBondContact OG1-NH2 3.21Å
115	A	81.4	Confident	70	Confident	37 Å²	37	64.8 Å²	64.8	31%	0.306	38%	0.383	S	S	.	.	H	α-helix	trans	-64.1	-44.3	175.2	0	0	0	0	0	112.1	A111 D117 Q118 F119	A111-A115 PolarHBondContact O-N 2.94Å; A115-D117 VanDerWaalsContact C-N 3.29Å; A115-D117 PolarHBondContact O-N 3.13Å; A115-Q118 PolarHBondContact O-N 3.33Å; A115-F119 VanDerWaalsContact O-CD2 3.27Å; A115-F119 WeakPolarHBondContact O-CD2 3.35Å; A115-F119 PolarHBondContact O-N 3.4Å
116	Q	76.4	Confident	67.4	Low	42 Å²	42	71 Å²	71	20%	0.196	42%	0.421	C	S	.	.	H	α-helix	trans	-53.8	-45.5	175.8	-76.4	165.9	25.6	0	0	112.3	L112 Q118 F119 V120 V138 Y143	L112-Q116 WeakPolarHBondContact O-CB 3.36Å; L112-Q116 WeakPolarHBondContact O-CG 3.41Å; L112-Q116 PolarHBondContact O-N 3.05Å; Q116-Q118 VanDerWaalsContact C-N 3.3Å; Q116-Q118 PolarHBondContact O-N 3.24Å; Q116-F119 PolarHBondContact O-N 3.47Å; Q116-V120 PolarHBondContact O-N 3.49Å; Q116-V138 HydrophobicContact CG-CG2 4.09Å; Q116-Y143 PolarHBondContact NE2-OH 3.35Å; Q116-Y143 PolarHBondContact OE1-OH 2.88Å
117	D	68.7	Low	64.7	Low	26 Å²	26	74.6 Å²	74.6	14%	0.139	44%	0.444	C	S	.	.	H	α-helix	trans	-65.8	-32.5	-175.4	-148.4	52.4	0	0	0	112	R113 T114 A115 R174 R212	R113-D117 PolarHBondContact O-N 3.49Å; T114-D117 PolarHBondContact O-N 3.35Å; A115-D117 VanDerWaalsContact C-N 3.29Å; A115-D117 PolarHBondContact O-N 3.13Å; D117-R174 VanDerWaalsContact OD2-CD 3.28Å; D117-R174 WeakPolarHBondContact OD2-CD 3.46Å; D117-R174 IonicContact OD2-CZ 2.73Å; D117-R174 IonicContact OD2-NE 3.7Å; D117-R174 IonicContact OD2-NH1 2.89Å; D117-R174 PolarHBondContact OD2-NH1 2.89Å; D117-R212 IonicContact OD1-CZ 3.99Å; D117-R212 IonicContact OD1-NH1 3.87Å; D117-R212 PolarHBondContact OD1-NH1 2.54Å; D117-R212 IonicContact OD1-NH2 3.84Å; D117-R212 PolarHBondContact OD1-NH2 3.41Å; D117-R212 VanDerWaalsContact OD1-NH2 3.12Å; D117-R212 IonicContact OD2-NH1 3.99Å
118	Q	64.8	Low	62.2	Low	125 Å²	125	77.1 Å²	77.1	58%	0.584	46%	0.462	S	S	*	.	H	α-helix	trans	-71.5	-36.6	174.4	-69.2	173.6	-28.5	0	0	113	T114 A115 Q116	T114-Q118 PolarHBondContact O-N 3.1Å; A115-Q118 PolarHBondContact O-N 3.33Å; Q116-Q118 VanDerWaalsContact C-N 3.3Å; Q116-Q118 PolarHBondContact O-N 3.24Å
119	F	56.6	Low	59.5	Low	156 Å²	156	82.1 Å²	82.1	68%	0.684	49%	0.486	S	S	*	.	H	α-helix	trans	-73.8	-25.2	-178.1	-82.3	-68.6	0	0	0	113.9	A115 Q116 D121 S122	A115-F119 VanDerWaalsContact O-CD2 3.27Å; A115-F119 WeakPolarHBondContact O-CD2 3.35Å; A115-F119 PolarHBondContact O-N 3.4Å; Q116-F119 PolarHBondContact O-N 3.47Å; F119-D121 PolarHBondContact O-N 3.33Å; F119-S122 PolarHBondContact O-N 2.92Å
120	V	57.9	Low	56.7	Low	119 Å²	119	90.1 Å²	90.1	72%	0.721	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-26.1	177.5	172.9	0	0	0	0	112.4	Q116 S122	Q116-V120 PolarHBondContact O-N 3.49Å; V120-S122 VanDerWaalsContact C-N 3.28Å; V120-S122 PolarHBondContact O-N 2.93Å
121	D	49.3	Very low	54.4	Low	88 Å²	88	93.7 Å²	93.7	47%	0.471	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75	-15.5	178.2	-69.6	-31	0	0	0	113.1	F119 R208	F119-D121 PolarHBondContact O-N 3.33Å; D121-R208 IonicContact OD1-NH1 2.77Å; D121-R208 WeakPolarHBondContact OD2-CD 3.46Å; D121-R208 IonicContact OD2-CZ 3.82Å; D121-R208 IonicContact OD2-NE 3.21Å; D121-R208 IonicContact OD2-NH1 2.8Å; D121-R208 PolarHBondContact OD2-NH1 3.4Å
122	S	41.8	Very low	52.2	Low	82 Å²	82	100.5 Å²	100.5	57%	0.573	58%	0.577	S	S	*	*	S	Bend	trans	-92.3	115.1	171.3	-69.3	0	0	0	0	110.3	F119 V120 G124	F119-S122 PolarHBondContact O-N 2.92Å; V120-S122 VanDerWaalsContact C-N 3.28Å; V120-S122 PolarHBondContact O-N 2.93Å; S122-G124 PolarHBondContact O-N 3.12Å
123	S	35.1	Very low	50.4	Low	137 Å²	137	103.8 Å²	103.8	96%	0.958	60%	0.595	S	S	*	*			trans	-76.3	42.4	-173.9	49.4	0	0	0	0	115
124	G	32.3	Very low	49.1	Very low	55 Å²	55	105.4 Å²	105.4	57%	0.567	62%	0.615	S	S	*	*			trans	-103	147.9	174.7	0	0	0	0	0	113.1	S122	S122-G124 PolarHBondContact O-N 3.12Å
125	P	34.1	Very low	48	Very low	117 Å²	117	106.5 Å²	106.5	76%	0.76	62%	0.622	S	S	*	*			trans	-68.4	152.7	170.1	31	-34.9	0	0	0	111	V127	P125-V127 PolarHBondContact O-N 3.18Å
126	V	33.3	Very low	47.3	Very low	133 Å²	133	105.7 Å²	105.7	81%	0.806	61%	0.611	S	S	*	*			trans	-62.2	104.1	-178.1	-178.4	0	0	0	0	111.3	T128	V126-T128 HydrophobicContact CG1-CG2 4.3Å
127	V	31.7	Very low	46.6	Very low	100 Å²	100	105.7 Å²	105.7	61%	0.606	62%	0.616	S	S	*	*			trans	-127.1	74.3	167.6	-173.2	0	0	0	0	108.2	P125 E129	P125-V127 PolarHBondContact O-N 3.18Å; V127-E129 HydrophobicContact CG1-CB 4.25Å; V127-E129 HydrophobicContact CG1-CG 3.94Å; V127-E129 PolarHBondContact O-N 3Å
128	T	36.8	Very low	46.3	Very low	129 Å²	129	108.1 Å²	108.1	79%	0.791	63%	0.631	S	S	*	*			trans	-78.5	65.8	169.5	52.7	0	0	0	0	109.9	V126	V126-T128 HydrophobicContact CG1-CG2 4.3Å
129	E	30.4	Very low	46.2	Very low	150 Å²	150	108 Å²	108	70%	0.701	64%	0.64	S	S	*	*			trans	-99.7	131.9	164.9	-66.5	-173.8	173.3	0	0	108.1	V127	V127-E129 HydrophobicContact CG1-CB 4.25Å; V127-E129 HydrophobicContact CG1-CG 3.94Å; V127-E129 PolarHBondContact O-N 3Å
130	N	30.3	Very low	46.7	Very low	168 Å²	168	101.5 Å²	101.5	90%	0.898	61%	0.613	S	S	*	*	S	Bend	trans	80.2	55.1	-177.9	-40.5	-69.2	0	0	0	117
131	S	39.5	Very low	47.4	Very low	104 Å²	104	100 Å²	100	73%	0.727	61%	0.606	S	S	*	*			trans	-145.5	144.3	144.5	-171.1	0	0	0	0	108.5
132	E	42.3	Very low	48.6	Very low	200 Å²	200	96.3 Å²	96.3	94%	0.935	59%	0.587	S	S	*	*	S	Bend	trans	-81.9	-16.9	-162.7	-60.7	-175.8	129.1	0	0	113.5	S134	E132-S134 VanDerWaalsContact C-N 3.31Å; E132-S134 PolarHBondContact O-N 3.5Å
133	D	49.6	Very low	50.4	Low	108 Å²	108	92.6 Å²	92.6	58%	0.578	56%	0.56	S	S	*	*			trans	-80.1	53.7	-178	-83.9	-31.5	0	0	0	115.2	T135 W136	D133-T135 PolarHBondContact O-N 2.88Å; D133-T135 VanDerWaalsContact O-N 3.12Å; D133-W136 PolarHBondContact O-N 3.32Å
134	S	55.1	Low	52.5	Low	94 Å²	94	92.7 Å²	92.7	66%	0.657	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-61.2	-20.6	175.3	-165.9	0	0	0	0	113.5	E132 W136 S140	E132-S134 VanDerWaalsContact C-N 3.31Å; E132-S134 PolarHBondContact O-N 3.5Å; S134-W136 VanDerWaalsContact C-N 3.29Å; S134-W136 PolarHBondContact O-N 3.12Å; S134-S140 PolarHBondContact O-OG 3.06Å
135	T	60.9	Low	54.9	Low	67 Å²	67	93.5 Å²	93.5	41%	0.411	53%	0.529	S	S	.	.	G	3₁₀ helix	trans	-58.2	-31.9	177.6	45.5	0	0	0	0	114.5	D133 S140 T142	D133-T135 PolarHBondContact O-N 2.88Å; D133-T135 VanDerWaalsContact O-N 3.12Å; T135-S140 WeakPolarHBondContact O-CB 3.48Å; T135-T142 WeakPolarHBondContact O-CB 3.4Å; T135-T142 PolarHBondContact O-OG1 3.3Å
136	W	66.6	Low	57.4	Low	19 Å²	19	88 Å²	88	7%	0.072	49%	0.493	C	S	.	.	G	3₁₀ helix	trans	-106.6	5.1	-171	-64.1	107.2	0	0	0	115	L79 H80 L83 K108 L112 D133 S134 T142 L146	L79-W136 HydrophobicContact CB-CH2 4.5Å; L79-W136 HydrophobicContact CD2-CH2 3.82Å; L79-W136 HydrophobicContact CD2-CZ3 4.34Å; L79-W136 HydrophobicContact CG-CH2 3.96Å; H80-W136 HydrophobicContact CB-CZ2 4.36Å; L83-W136 HydrophobicContact CD1-CH2 4.37Å; L83-W136 HydrophobicContact CD1-CZ3 4.16Å; K108-W136 HydrophobicContact CG-CE3 4.43Å; K108-W136 HydrophobicContact CG-CZ3 4.48Å; L112-W136 HydrophobicContact CD1-CB 4.2Å; L112-W136 HydrophobicContact CD1-CE3 4.24Å; L112-W136 HydrophobicContact CD2-CB 4.17Å; D133-W136 PolarHBondContact O-N 3.32Å; S134-W136 VanDerWaalsContact C-N 3.29Å; S134-W136 PolarHBondContact O-N 3.12Å; W136-T142 HydrophobicContact CE3-CG2 4.02Å; W136-T142 HydrophobicContact CH2-CG2 4.08Å; W136-T142 HydrophobicContact CZ3-CG2 3.67Å; W136-L146 HydrophobicContact CE3-CD2 4.48Å; W136-L146 HydrophobicContact CZ3-CD1 4.38Å; W136-L146 HydrophobicContact CZ3-CD2 4.3Å
137	S	62.1	Low	59.9	Low	42 Å²	42	84 Å²	84	29%	0.294	47%	0.466	S	S	.	.			trans	-58.1	153.4	-179.7	92.8	0	0	0	0	113	T139 S140 Y143	S137-T139 PolarHBondContact O-N 2.73Å; S137-T139 VanDerWaalsContact O-N 3.09Å; S137-T139 PolarHBondContact OG-N 2.92Å; S137-S140 VanDerWaalsContact O-CB 3.26Å; S137-S140 WeakPolarHBondContact O-CB 3.42Å; S137-S140 PolarHBondContact O-N 3.31Å; S137-S140 PolarHBondContact O-OG 3.15Å; S137-S140 PolarHBondContact OG-N 3.37Å; S137-S140 PolarHBondContact OG-OG 3.21Å; S137-Y143 WeakPolarHBondContact O-CB 3.41Å
138	V	61.9	Low	62.4	Low	77 Å²	77	85 Å²	85	47%	0.467	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-28.2	178.6	-158.8	0	0	0	0	112.5	Q116 Y143	Q116-V138 HydrophobicContact CG-CG2 4.09Å; V138-Y143 HydrophobicContact CG1-CD1 4.1Å; V138-Y143 HydrophobicContact CG1-CE1 3.94Å
139	T	62.3	Low	64.8	Low	124 Å²	124	79.6 Å²	79.6	76%	0.761	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-23	178.6	-38.4	0	0	0	0	112.3	S137	S137-T139 PolarHBondContact O-N 2.73Å; S137-T139 VanDerWaalsContact O-N 3.09Å; S137-T139 PolarHBondContact OG-N 2.92Å
140	S	67.8	Low	67.5	Low	18 Å²	18	72.6 Å²	72.6	13%	0.126	40%	0.398	C	S	.	.	S	Bend	trans	-69.3	141.5	-173.5	-58.7	0	0	0	0	111.5	S134 T135 S137 T142 Y143	S134-S140 PolarHBondContact O-OG 3.06Å; T135-S140 WeakPolarHBondContact O-CB 3.48Å; S137-S140 VanDerWaalsContact O-CB 3.26Å; S137-S140 WeakPolarHBondContact O-CB 3.42Å; S137-S140 PolarHBondContact O-N 3.31Å; S137-S140 PolarHBondContact O-OG 3.15Å; S137-S140 PolarHBondContact OG-N 3.37Å; S137-S140 PolarHBondContact OG-OG 3.21Å; S140-T142 PolarHBondContact O-N 3.49Å; S140-Y143 WeakPolarHBondContact O-CB 3.4Å; S140-Y143 PolarHBondContact O-N 3.39Å
141	P	73.2	Confident	70.3	Confident	89 Å²	89	66.6 Å²	66.6	58%	0.578	37%	0.366	S	S	*	.	H	α-helix	trans	-61.8	-28.8	-179.2	25.5	-34.3	0	0	0	112.5	Y143 K144 R145	P141-Y143 VanDerWaalsContact C-N 3.28Å; P141-Y143 PolarHBondContact O-N 2.82Å; P141-K144 PolarHBondContact O-N 3.43Å; P141-R145 PolarHBondContact O-N 3.06Å; P141-R145 VanDerWaalsContact O-N 3.16Å
142	T	72.9	Confident	72.5	Confident	9 Å²	9	66.3 Å²	66.3	6%	0.055	35%	0.352	C	S	.	.	H	α-helix	trans	-50.6	-45.5	170.8	-27.5	0	0	0	0	112	L83 T135 W136 S140 K144 R145 L146	L83-T142 HydrophobicContact CD1-CG2 4.11Å; T135-T142 WeakPolarHBondContact O-CB 3.4Å; T135-T142 PolarHBondContact O-OG1 3.3Å; W136-T142 HydrophobicContact CE3-CG2 4.02Å; W136-T142 HydrophobicContact CH2-CG2 4.08Å; W136-T142 HydrophobicContact CZ3-CG2 3.67Å; S140-T142 PolarHBondContact O-N 3.49Å; T142-K144 PolarHBondContact O-N 3.47Å; T142-R145 PolarHBondContact O-N 3.43Å; T142-L146 WeakPolarHBondContact O-CB 3.44Å; T142-L146 PolarHBondContact O-N 3.28Å
143	Y	80	Confident	74.6	Confident	5 Å²	5	59 Å²	59	2%	0.02	32%	0.318	C	S	.	.	H	α-helix	trans	-65.7	-37.9	-176.7	-173.2	-95.9	0	0	0	112.2	Y109 L112 R113 Q116 S137 V138 S140 P141 L146 E147	Y109-Y143 HydrophobicContact CD2-CE2 4.2Å; Y109-Y143 HydrophobicContact CE2-CE2 4.17Å; Y109-Y143 AromaticContact CE2-CZ 3.84Å; L112-Y143 HydrophobicContact CB-CE2 4.35Å; L112-Y143 HydrophobicContact CD1-CD2 4.27Å; L112-Y143 HydrophobicContact CD1-CE2 4.38Å; R113-Y143 PolarHBondContact NE-OH 2.89Å; R113-Y143 PolarHBondContact NH1-OH 3.3Å; Q116-Y143 PolarHBondContact NE2-OH 3.35Å; Q116-Y143 PolarHBondContact OE1-OH 2.88Å; S137-Y143 WeakPolarHBondContact O-CB 3.41Å; V138-Y143 HydrophobicContact CG1-CD1 4.1Å; V138-Y143 HydrophobicContact CG1-CE1 3.94Å; S140-Y143 WeakPolarHBondContact O-CB 3.4Å; S140-Y143 PolarHBondContact O-N 3.39Å; P141-Y143 VanDerWaalsContact C-N 3.28Å; P141-Y143 PolarHBondContact O-N 2.82Å; Y143-L146 HydrophobicContact CD2-CD2 4.5Å; Y143-L146 WeakPolarHBondContact O-CB 3.39Å; Y143-L146 PolarHBondContact O-N 3.47Å; Y143-E147 WeakPolarHBondContact O-CB 3.39Å; Y143-E147 PolarHBondContact O-N 2.7Å
144	K	80.5	Confident	76.4	Confident	139 Å²	139	54 Å²	54	60%	0.604	29%	0.291	S	S	*	.	H	α-helix	trans	-70.1	-34.2	176.5	-64.9	179.4	-178.9	174	0	112.4	P141 T142 H148	P141-K144 PolarHBondContact O-N 3.43Å; T142-K144 PolarHBondContact O-N 3.47Å; K144-H148 WeakPolarHBondContact O-CB 3.42Å; K144-H148 PolarHBondContact O-N 3.49Å
145	R	82.7	Confident	78.1	Confident	72 Å²	72	53 Å²	53	27%	0.272	28%	0.278	S	S	.	.	H	α-helix	trans	-67.6	-44.9	172	-70.9	168.3	166.5	165.6	-2.1	111.1	L83 C84 E86 P141 T142 H148 V149	L83-R145 HydrophobicContact CB-CB 4.04Å; L83-R145 HydrophobicContact CD2-CB 4.24Å; L83-R145 WeakPolarHBondContact O-CD 3.35Å; C84-R145 PolarHBondContact SG-NH1 3.02Å; E86-R145 IonicContact OE1-CZ 2.89Å; E86-R145 IonicContact OE1-NE 3.88Å; E86-R145 PolarHBondContact OE1-NE 2.95Å; E86-R145 IonicContact OE1-NH2 2.66Å; E86-R145 PolarHBondContact OE1-NH2 3.02Å; P141-R145 PolarHBondContact O-N 3.06Å; P141-R145 VanDerWaalsContact O-N 3.16Å; T142-R145 PolarHBondContact O-N 3.43Å; R145-H148 WeakPolarHBondContact O-CB 3.48Å; R145-H148 PolarHBondContact O-N 3.26Å; R145-H148 VanDerWaalsContact O-N 3.15Å; R145-V149 PolarHBondContact O-N 3.39Å
146	L	85	Confident	79.3	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-56.2	-50.9	175	-171.3	74.6	0	0	0	110.9	L79 L83 C105 Y109 L112 W136 T142 Y143 H148 V149 V150	L79-L146 HydrophobicContact CD1-CD1 4.34Å; L79-L146 HydrophobicContact CD2-CD1 4.04Å; L79-L146 HydrophobicContact CG-CD1 4.48Å; L83-L146 HydrophobicContact CD1-CB 3.95Å; L83-L146 HydrophobicContact CD1-CD1 3.84Å; C105-L146 HydrophobicContact CB-CD1 4.28Å; C105-L146 WeakPolarHBondContact SG-CD1 3.46Å; Y109-L146 HydrophobicContact CD2-CD2 3.89Å; Y109-L146 HydrophobicContact CD2-CG 4.1Å; Y109-L146 HydrophobicContact CG-CD2 4.42Å; L112-L146 HydrophobicContact CD1-CD2 3.98Å; W136-L146 HydrophobicContact CE3-CD2 4.48Å; W136-L146 HydrophobicContact CZ3-CD1 4.38Å; W136-L146 HydrophobicContact CZ3-CD2 4.3Å; T142-L146 WeakPolarHBondContact O-CB 3.44Å; T142-L146 PolarHBondContact O-N 3.28Å; Y143-L146 HydrophobicContact CD2-CD2 4.5Å; Y143-L146 WeakPolarHBondContact O-CB 3.39Å; Y143-L146 PolarHBondContact O-N 3.47Å; L146-H148 VanDerWaalsContact C-N 3.31Å; L146-H148 PolarHBondContact O-N 3.2Å; L146-V149 PolarHBondContact O-N 3.23Å; L146-V150 WeakPolarHBondContact O-CG2 3.38Å; L146-V150 PolarHBondContact O-N 2.99Å
147	E	85.9	Confident	80.3	Confident	49 Å²	49	52.4 Å²	52.4	23%	0.229	27%	0.269	C	S	.	.	H	α-helix	trans	-62	-34.3	175.8	-179.1	156.9	-102.3	0	0	112.9	Y109 R113 Y143 N151	Y109-E147 HydrophobicContact CE2-CB 3.94Å; Y109-E147 HydrophobicContact CE2-CG 4.29Å; Y109-E147 PolarHBondContact OH-OE1 2.68Å; R113-E147 IonicContact CZ-OE1 2.99Å; R113-E147 IonicContact NH2-OE1 3.82Å; R113-E147 PolarHBondContact NH2-OE1 3.12Å; Y143-E147 WeakPolarHBondContact O-CB 3.39Å; Y143-E147 PolarHBondContact O-N 2.7Å; E147-N151 WeakPolarHBondContact CG-ND2 3.45Å; E147-N151 WeakPolarHBondContact O-CB 3.37Å; E147-N151 PolarHBondContact O-N 3.31Å; E147-N151 PolarHBondContact O-ND2 2.72Å
148	H	85.7	Confident	81.6	Confident	122 Å²	122	51.4 Å²	51.4	57%	0.565	26%	0.26	S	S	*	.	H	α-helix	trans	-68.1	-40.2	175.8	-177.4	64	0	0	0	112.9	K144 R145 L146 N151 K152	K144-H148 WeakPolarHBondContact O-CB 3.42Å; K144-H148 PolarHBondContact O-N 3.49Å; R145-H148 WeakPolarHBondContact O-CB 3.48Å; R145-H148 PolarHBondContact O-N 3.26Å; R145-H148 VanDerWaalsContact O-N 3.15Å; L146-H148 VanDerWaalsContact C-N 3.31Å; L146-H148 PolarHBondContact O-N 3.2Å; H148-N151 PolarHBondContact O-N 2.91Å; H148-K152 PolarHBondContact O-N 3.2Å
149	V	85.3	Confident	82.8	Confident	16 Å²	16	54.5 Å²	54.5	10%	0.097	27%	0.273	C	S	.	.	H	α-helix	trans	-63.7	-45.2	173.5	171.9	0	0	0	0	110.7	L83 I91 R145 L146 N151 K152 M153	L83-V149 HydrophobicContact CD2-CB 4.38Å; L83-V149 HydrophobicContact CD2-CG2 3.67Å; I91-V149 HydrophobicContact CD1-CB 4.34Å; I91-V149 HydrophobicContact CD1-CG1 3.88Å; I91-V149 HydrophobicContact CD1-CG2 4.32Å; R145-V149 PolarHBondContact O-N 3.39Å; L146-V149 PolarHBondContact O-N 3.23Å; V149-N151 PolarHBondContact O-N 2.97Å; V149-K152 PolarHBondContact O-N 3.43Å; V149-M153 PolarHBondContact O-N 2.78Å
150	V	87.7	Confident	84.1	Confident	3 Å²	3	53.8 Å²	53.8	2%	0.018	26%	0.261	C	S	.	.	H	α-helix	trans	-61.4	-43.4	176.1	170	0	0	0	0	111.7	Y109 L146 K152 M153 F154	Y109-V150 HydrophobicContact CD1-CB 4.4Å; Y109-V150 HydrophobicContact CD1-CG1 3.97Å; Y109-V150 HydrophobicContact CD1-CG2 3.98Å; Y109-V150 HydrophobicContact CE1-CG1 3.9Å; Y109-V150 HydrophobicContact CG-CG2 3.99Å; L146-V150 WeakPolarHBondContact O-CG2 3.38Å; L146-V150 PolarHBondContact O-N 2.99Å; V150-K152 PolarHBondContact O-N 3.19Å; V150-M153 WeakPolarHBondContact O-CB 3.46Å; V150-M153 PolarHBondContact O-N 3.1Å; V150-M153 VanDerWaalsContact O-N 3.17Å; V150-F154 HydrophobicContact CG1-CD2 3.77Å; V150-F154 HydrophobicContact CG1-CE2 3.46Å; V150-F154 VanDerWaalsContact CG1-CE2 3.46Å; V150-F154 WeakPolarHBondContact O-CD2 3.24Å; V150-F154 PolarHBondContact O-N 3.21Å
151	N	89.5	Confident	85	Confident	42 Å²	42	58.5 Å²	58.5	23%	0.225	28%	0.28	C	S	.	.	H	α-helix	trans	-59.9	-43.9	174.6	-79.3	-58.8	0	0	0	112.4	E147 H148 V149 M153 F154 D155 R175	E147-N151 WeakPolarHBondContact CG-ND2 3.45Å; E147-N151 WeakPolarHBondContact O-CB 3.37Å; E147-N151 PolarHBondContact O-N 3.31Å; E147-N151 PolarHBondContact O-ND2 2.72Å; H148-N151 PolarHBondContact O-N 2.91Å; V149-N151 PolarHBondContact O-N 2.97Å; N151-M153 VanDerWaalsContact C-N 3.28Å; N151-M153 PolarHBondContact O-N 2.84Å; N151-F154 PolarHBondContact O-N 2.92Å; N151-D155 PolarHBondContact O-N 3.29Å; N151-R175 PolarHBondContact OD1-NH1 2.82Å; N151-R175 PolarHBondContact OD1-NH2 3.11Å
152	K	86.3	Confident	85.8	Confident	98 Å²	98	59.2 Å²	59.2	43%	0.426	28%	0.275	S	S	.	.	H	α-helix	trans	-60.2	-36.7	174.6	-78.5	178.8	172.7	164.5	0	112.4	I91 H148 V149 V150 D155 R156	I91-K152 HydrophobicContact CD1-CB 3.81Å; I91-K152 HydrophobicContact CD1-CD 3.67Å; I91-K152 HydrophobicContact CD1-CG 4.4Å; H148-K152 PolarHBondContact O-N 3.2Å; V149-K152 PolarHBondContact O-N 3.43Å; V150-K152 PolarHBondContact O-N 3.19Å; K152-D155 PolarHBondContact O-N 3.13Å; K152-R156 WeakPolarHBondContact O-CB 3.42Å; K152-R156 PolarHBondContact O-N 3.48Å
153	M	84.9	Confident	86.6	Confident	45 Å²	45	60.2 Å²	60.2	22%	0.222	28%	0.278	C	S	.	.	H	α-helix	trans	-67.3	-39.2	175.6	-170.6	60.9	-178.5	0	0	111.9	I102 I106 V149 V150 N151 R156 C157	I102-M153 HydrophobicContact CG2-SD 4.33Å; I106-M153 HydrophobicContact CD1-CG 4.44Å; V149-M153 PolarHBondContact O-N 2.78Å; V150-M153 WeakPolarHBondContact O-CB 3.46Å; V150-M153 PolarHBondContact O-N 3.1Å; V150-M153 VanDerWaalsContact O-N 3.17Å; N151-M153 VanDerWaalsContact C-N 3.28Å; N151-M153 PolarHBondContact O-N 2.84Å; M153-R156 WeakPolarHBondContact O-CB 3.41Å; M153-R156 PolarHBondContact O-N 3.38Å; M153-C157 PolarHBondContact O-N 3.43Å; M153-C157 PolarHBondContact O-SG 3.33Å; M153-C157 VanDerWaalsContact O-SG 3.4Å
154	F	89.2	Confident	87.1	Confident	4 Å²	4	65.7 Å²	65.7	2%	0.018	30%	0.302	C	S	.	.	H	α-helix	trans	-63.9	-42.6	172.8	-77.4	-67.3	0	0	0	112.8	V150 N151 R156 C157 F158 A166 I169 A170 I178	V150-F154 HydrophobicContact CG1-CD2 3.77Å; V150-F154 HydrophobicContact CG1-CE2 3.46Å; V150-F154 VanDerWaalsContact CG1-CE2 3.46Å; V150-F154 WeakPolarHBondContact O-CD2 3.24Å; V150-F154 PolarHBondContact O-N 3.21Å; N151-F154 PolarHBondContact O-N 2.92Å; F154-R156 VanDerWaalsContact C-N 3.34Å; F154-R156 PolarHBondContact O-N 3.09Å; F154-C157 WeakPolarHBondContact O-CB 3.48Å; F154-C157 PolarHBondContact O-N 3.27Å; F154-C157 VanDerWaalsContact O-N 3.11Å; F154-F158 HydrophobicContact CB-CE2 4.2Å; F154-F158 WeakPolarHBondContact O-CD2 3.44Å; F154-F158 WeakPolarHBondContact O-CG 3.46Å; F154-F158 PolarHBondContact O-N 2.86Å; F154-A166 HydrophobicContact CD1-CB 4.33Å; F154-A166 WeakPolarHBondContact CE1-O 3.23Å; F154-I169 HydrophobicContact CE1-CB 3.72Å; F154-I169 HydrophobicContact CE1-CG2 3.79Å; F154-I169 HydrophobicContact CE2-CG2 4.33Å; F154-I169 HydrophobicContact CZ-CB 3.94Å; F154-I169 HydrophobicContact CZ-CG2 3.52Å; F154-A170 HydrophobicContact CE1-CB 4.36Å; F154-I178 HydrophobicContact CB-CD1 3.94Å; F154-I178 HydrophobicContact CD1-CD1 4.14Å; F154-I178 HydrophobicContact CD1-CG2 3.61Å; F154-I178 HydrophobicContact CD2-CD1 3.2Å; F154-I178 HydrophobicContact CD2-CG2 4.49Å; F154-I178 HydrophobicContact CE1-CD1 4.4Å; F154-I178 HydrophobicContact CE1-CG2 3.67Å; F154-I178 HydrophobicContact CE2-CD1 3.54Å; F154-I178 HydrophobicContact CG-CD1 3.52Å; F154-I178 HydrophobicContact CG-CG2 4.03Å; F154-I178 HydrophobicContact CZ-CD1 4.12Å; F154-I178 HydrophobicContact CZ-CG2 4.13Å
155	D	89.2	Confident	87.5	Confident	72 Å²	72	63.9 Å²	63.9	39%	0.385	30%	0.296	S	S	.	.	H	α-helix	trans	-63.6	-38.8	174.9	-70.4	-34.8	0	0	0	111.7	N151 K152 C157 F158 D159 K181	N151-D155 PolarHBondContact O-N 3.29Å; K152-D155 PolarHBondContact O-N 3.13Å; D155-C157 VanDerWaalsContact C-N 3.34Å; D155-C157 PolarHBondContact O-N 3.42Å; D155-F158 PolarHBondContact O-N 3.26Å; D155-F158 VanDerWaalsContact O-N 3.1Å; D155-D159 PolarHBondContact O-N 2.91Å; D155-K181 IonicContact OD1-NZ 2.75Å; D155-K181 PolarHBondContact OD1-NZ 3.28Å
156	R	86.4	Confident	87.8	Confident	70 Å²	70	60.5 Å²	60.5	26%	0.264	28%	0.283	S	S	.	.	H	α-helix	trans	-58.6	-40.6	168.7	177.6	175.6	175.2	-178.1	-4.1	112.6	I91 K152 M153 F154 F158 D159 H160	I91-R156 PolarHBondContact O-NH1 2.96Å; I91-R156 VanDerWaalsContact O-NH1 3.1Å; K152-R156 WeakPolarHBondContact O-CB 3.42Å; K152-R156 PolarHBondContact O-N 3.48Å; M153-R156 WeakPolarHBondContact O-CB 3.41Å; M153-R156 PolarHBondContact O-N 3.38Å; F154-R156 VanDerWaalsContact C-N 3.34Å; F154-R156 PolarHBondContact O-N 3.09Å; R156-F158 VanDerWaalsContact C-N 3.34Å; R156-D159 PolarHBondContact O-N 3.06Å; R156-H160 PolarHBondContact O-CD2 3.43Å; R156-H160 PolarHBondContact O-N 2.94Å
157	C	87.2	Confident	88.1	Confident	5 Å²	5	60.6 Å²	60.6	3%	0.034	28%	0.284	C	S	.	.	H	α-helix	trans	-65.4	-34.4	174.1	-70.5	0	0	0	0	112.8	M153 F154 D155 K161 Q162 A166	M153-C157 PolarHBondContact O-N 3.43Å; M153-C157 PolarHBondContact O-SG 3.33Å; M153-C157 VanDerWaalsContact O-SG 3.4Å; F154-C157 WeakPolarHBondContact O-CB 3.48Å; F154-C157 PolarHBondContact O-N 3.27Å; F154-C157 VanDerWaalsContact O-N 3.11Å; D155-C157 VanDerWaalsContact C-N 3.34Å; D155-C157 PolarHBondContact O-N 3.42Å; C157-K161 PolarHBondContact O-N 3.25Å; C157-Q162 PolarHBondContact O-N 2.89Å; C157-A166 HydrophobicContact CB-CB 4.12Å
158	F	89.4	Confident	88.2	Confident	21 Å²	21	59.1 Å²	59.1	9%	0.092	28%	0.282	C	S	.	.	H	α-helix	trans	-71.3	-42.8	174.9	-64.3	-49	0	0	0	112.3	F154 D155 R156 H160 K161 Y163 A166 I178 K181 A182	F154-F158 HydrophobicContact CB-CE2 4.2Å; F154-F158 WeakPolarHBondContact O-CD2 3.44Å; F154-F158 WeakPolarHBondContact O-CG 3.46Å; F154-F158 PolarHBondContact O-N 2.86Å; D155-F158 PolarHBondContact O-N 3.26Å; D155-F158 VanDerWaalsContact O-N 3.1Å; R156-F158 VanDerWaalsContact C-N 3.34Å; F158-H160 VanDerWaalsContact C-N 3.3Å; F158-H160 PolarHBondContact O-N 3.02Å; F158-K161 WeakPolarHBondContact O-CA 3.47Å; F158-K161 PolarHBondContact O-N 3.04Å; F158-Y163 AromaticContact CD1-CD1 3.87Å; F158-Y163 HydrophobicContact CD1-CD1 3.87Å; F158-Y163 AromaticContact CD1-CE1 3.89Å; F158-Y163 HydrophobicContact CD1-CE1 3.89Å; F158-Y163 HydrophobicContact CE1-CD1 4.2Å; F158-A166 HydrophobicContact CD1-CB 4.35Å; F158-A166 HydrophobicContact CE1-CB 3.68Å; F158-A166 HydrophobicContact CZ-CB 4.03Å; F158-I178 HydrophobicContact CE2-CG2 4.42Å; F158-I178 HydrophobicContact CZ-CG2 3.99Å; F158-K181 HydrophobicContact CD2-CD 4.3Å; F158-K181 HydrophobicContact CE2-CD 3.63Å; F158-K181 HydrophobicContact CE2-CG 4.13Å; F158-K181 HydrophobicContact CZ-CD 4.06Å; F158-K181 HydrophobicContact CZ-CG 4.07Å; F158-A182 HydrophobicContact CE1-CB 3.77Å; F158-A182 HydrophobicContact CZ-CB 4.07Å
159	D	88.7	Confident	88.4	Confident	141 Å²	141	54 Å²	54	75%	0.754	26%	0.258	S	S	*	.	H	α-helix	trans	-61.1	-37.7	175.1	-75.4	-22.1	0	0	0	112.2	D155 R156 K161	D155-D159 PolarHBondContact O-N 2.91Å; R156-D159 PolarHBondContact O-N 3.06Å; D159-K161 PolarHBondContact O-N 3.2Å
160	H	89	Confident	88.6	Confident	109 Å²	109	53.2 Å²	53.2	51%	0.505	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	2.9	172.5	-65.6	-47.3	0	0	0	114.4	R156 F158 Q162	R156-H160 PolarHBondContact O-CD2 3.43Å; R156-H160 PolarHBondContact O-N 2.94Å; F158-H160 VanDerWaalsContact C-N 3.3Å; F158-H160 PolarHBondContact O-N 3.02Å; H160-Q162 HydrophobicContact CB-CG 4Å; H160-Q162 PolarHBondContact O-N 3.24Å
161	K	86.8	Confident	88.6	Confident	117 Å²	117	54 Å²	54	51%	0.509	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	24.7	-175.2	-64.3	-168	161.6	-146.9	0	115.1	C157 F158 D159 Y163 D187	C157-K161 PolarHBondContact O-N 3.25Å; F158-K161 WeakPolarHBondContact O-CA 3.47Å; F158-K161 PolarHBondContact O-N 3.04Å; D159-K161 PolarHBondContact O-N 3.2Å; K161-Y163 HydrophobicContact CB-CE2 3.88Å; K161-Y163 HydrophobicContact CG-CE2 4.22Å; K161-Y163 VanDerWaalsContact O-CD2 3.26Å; K161-Y163 WeakPolarHBondContact O-CD2 3.47Å; K161-Y163 PolarHBondContact O-N 3.17Å; K161-D187 WeakPolarHBondContact CD-OD2 3.49Å; K161-D187 WeakPolarHBondContact CE-OD2 3.34Å; K161-D187 IonicContact NZ-OD1 3.91Å; K161-D187 PolarHBondContact NZ-OD1 2.74Å; K161-D187 IonicContact NZ-OD2 3.69Å; K161-D187 PolarHBondContact NZ-OD2 3.35Å
162	Q	89.1	Confident	88.4	Confident	104 Å²	104	57.1 Å²	57.1	49%	0.486	27%	0.271	S	S	.	.			trans	-86	52.8	-177.1	-66	-176.2	-6.9	0	0	112.2	C157 H160 K164 Q165 A166	C157-Q162 PolarHBondContact O-N 2.89Å; H160-Q162 HydrophobicContact CB-CG 4Å; H160-Q162 PolarHBondContact O-N 3.24Å; Q162-K164 VanDerWaalsContact C-N 3.25Å; Q162-K164 PolarHBondContact O-N 3.07Å; Q162-K164 VanDerWaalsContact O-N 3.14Å; Q162-Q165 HydrophobicContact CB-CB 4.25Å; Q162-Q165 PolarHBondContact O-N 3.16Å; Q162-A166 PolarHBondContact O-N 3.48Å; Q162-A166 VanDerWaalsContact O-N 3.09Å
163	Y	90.3	Very high	88.5	Confident	30 Å²	30	52.5 Å²	52.5	12%	0.118	25%	0.251	C	S	.	.	H	α-helix	trans	-55.1	-35.6	-174.1	-57	-70.6	0	0	0	113.8	F158 K161 Q165 A166 L167 S185	F158-Y163 AromaticContact CD1-CD1 3.87Å; F158-Y163 HydrophobicContact CD1-CD1 3.87Å; F158-Y163 AromaticContact CD1-CE1 3.89Å; F158-Y163 HydrophobicContact CD1-CE1 3.89Å; F158-Y163 HydrophobicContact CE1-CD1 4.2Å; K161-Y163 HydrophobicContact CB-CE2 3.88Å; K161-Y163 HydrophobicContact CG-CE2 4.22Å; K161-Y163 VanDerWaalsContact O-CD2 3.26Å; K161-Y163 WeakPolarHBondContact O-CD2 3.47Å; K161-Y163 PolarHBondContact O-N 3.17Å; Y163-Q165 VanDerWaalsContact C-N 3.35Å; Y163-Q165 PolarHBondContact O-N 3.25Å; Y163-A166 PolarHBondContact O-N 3.07Å; Y163-L167 WeakPolarHBondContact O-CB 3.46Å; Y163-L167 PolarHBondContact O-N 2.99Å; Y163-S185 PolarHBondContact OH-O 3.44Å; Y163-S185 VanDerWaalsContact OH-O 3.08Å
164	K	89.4	Confident	88.5	Confident	120 Å²	120	52.7 Å²	52.7	52%	0.522	25%	0.249	S	C	.	.	H	α-helix	trans	-62	-39.1	175.2	-65.6	-178.1	-178.2	175.6	0	112.8	Q162 L167 G168 M192 Y195	Q162-K164 VanDerWaalsContact C-N 3.25Å; Q162-K164 PolarHBondContact O-N 3.07Å; Q162-K164 VanDerWaalsContact O-N 3.14Å; K164-L167 PolarHBondContact O-N 2.94Å; K164-G168 PolarHBondContact O-N 3.28Å; K164-G168 VanDerWaalsContact O-N 3.11Å; K164-M192 HydrophobicContact CD-CE 4.49Å; K164-M192 HydrophobicContact CG-CE 3.93Å; K164-M192 HydrophobicContact CG-SD 3.85Å; K164-Y195 HydrophobicContact CB-CE1 3.92Å; K164-Y195 HydrophobicContact CD-CE1 4.48Å; K164-Y195 HydrophobicContact CG-CD1 4.11Å; K164-Y195 HydrophobicContact CG-CE1 3.96Å
165	Q	89.3	Confident	88.4	Confident	102 Å²	102	53.5 Å²	53.5	48%	0.477	25%	0.252	S	S	.	.	H	α-helix	trans	-73.9	-42.4	178.7	-168.3	62.9	27.5	0	0	111	Q162 Y163 L167 G168 I169	Q162-Q165 HydrophobicContact CB-CB 4.25Å; Q162-Q165 PolarHBondContact O-N 3.16Å; Y163-Q165 VanDerWaalsContact C-N 3.35Å; Y163-Q165 PolarHBondContact O-N 3.25Å; Q165-L167 PolarHBondContact O-N 3.47Å; Q165-G168 PolarHBondContact O-N 2.91Å; Q165-I169 HydrophobicContact CG-CD1 4.01Å; Q165-I169 WeakPolarHBondContact O-CG1 3.46Å; Q165-I169 PolarHBondContact O-N 2.86Å
166	A	90.4	Very high	88.3	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-58.3	-38.2	172.8	0	0	0	0	0	111.7	F154 C157 F158 Q162 Y163 A170 A182	F154-A166 HydrophobicContact CD1-CB 4.33Å; F154-A166 WeakPolarHBondContact CE1-O 3.23Å; C157-A166 HydrophobicContact CB-CB 4.12Å; F158-A166 HydrophobicContact CD1-CB 4.35Å; F158-A166 HydrophobicContact CE1-CB 3.68Å; F158-A166 HydrophobicContact CZ-CB 4.03Å; Q162-A166 PolarHBondContact O-N 3.48Å; Q162-A166 VanDerWaalsContact O-N 3.09Å; Y163-A166 PolarHBondContact O-N 3.07Å; A166-A170 WeakPolarHBondContact O-CB 3.37Å; A166-A170 PolarHBondContact O-N 3.48Å; A166-A182 HydrophobicContact CB-CB 4.31Å
167	L	90	Very high	88.5	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-65.8	-43.8	175.3	-165.8	79.7	0	0	0	112.5	Y163 K164 Q165 A170 I171 F179 A182 I183 Y195 A196	Y163-L167 WeakPolarHBondContact O-CB 3.46Å; Y163-L167 PolarHBondContact O-N 2.99Å; K164-L167 PolarHBondContact O-N 2.94Å; Q165-L167 PolarHBondContact O-N 3.47Å; L167-A170 PolarHBondContact O-N 3.32Å; L167-I171 WeakPolarHBondContact O-CG1 3.09Å; L167-I171 PolarHBondContact O-N 2.62Å; L167-I171 VanDerWaalsContact O-N 3.14Å; L167-F179 HydrophobicContact CD1-CD2 3.48Å; L167-F179 VanDerWaalsContact CD1-CD2 3.48Å; L167-F179 HydrophobicContact CD1-CE2 3.67Å; L167-F179 HydrophobicContact CD1-CG 4.07Å; L167-F179 HydrophobicContact CD1-CZ 4.38Å; L167-F179 HydrophobicContact CG-CD2 4.2Å; L167-F179 HydrophobicContact CG-CE2 4.22Å; L167-A182 HydrophobicContact CD1-CB 4.41Å; L167-I183 HydrophobicContact CD1-CD1 4.33Å; L167-I183 HydrophobicContact CD1-CG1 4.02Å; L167-Y195 HydrophobicContact CD2-CD1 3.72Å; L167-Y195 HydrophobicContact CD2-CE1 3.97Å; L167-A196 HydrophobicContact CD1-CB 4.41Å; L167-A196 HydrophobicContact CD2-CB 3.72Å
168	G	89.4	Confident	88.6	Confident	19 Å²	19	53.2 Å²	53.2	20%	0.196	26%	0.255	C	S	.	.	H	α-helix	trans	-59.9	-53.9	177	0	0	0	0	0	112.3	K164 Q165 A170 I171 E172	K164-G168 PolarHBondContact O-N 3.28Å; K164-G168 VanDerWaalsContact O-N 3.11Å; Q165-G168 PolarHBondContact O-N 2.91Å; G168-A170 PolarHBondContact O-N 3.33Å; G168-I171 WeakPolarHBondContact O-CB 3.33Å; G168-I171 PolarHBondContact O-N 3.27Å; G168-E172 PolarHBondContact O-N 3.12Å
169	I	88.8	Confident	88.6	Confident	13 Å²	13	52.2 Å²	52.2	7%	0.067	25%	0.251	C	S	.	.	H	α-helix	trans	-63.3	-32.2	179	-54.7	166.9	0	0	0	110.6	I106 F154 Q165 I171 T173	I106-I169 HydrophobicContact CG2-CG2 4.4Å; F154-I169 HydrophobicContact CE1-CB 3.72Å; F154-I169 HydrophobicContact CE1-CG2 3.79Å; F154-I169 HydrophobicContact CE2-CG2 4.33Å; F154-I169 HydrophobicContact CZ-CB 3.94Å; F154-I169 HydrophobicContact CZ-CG2 3.52Å; Q165-I169 HydrophobicContact CG-CD1 4.01Å; Q165-I169 WeakPolarHBondContact O-CG1 3.46Å; Q165-I169 PolarHBondContact O-N 2.86Å; I169-I171 VanDerWaalsContact C-N 3.32Å; I169-I171 PolarHBondContact O-N 3.28Å; I169-T173 HydrophobicContact CG2-CG2 4.08Å; I169-T173 WeakPolarHBondContact O-CB 3.5Å; I169-T173 VanDerWaalsContact O-CG2 3.28Å; I169-T173 WeakPolarHBondContact O-CG2 3.43Å; I169-T173 PolarHBondContact O-N 2.91Å; I169-T173 PolarHBondContact O-OG1 3.4Å
170	A	89.5	Confident	88.7	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-65.1	-32.5	173.7	0	0	0	0	0	113.2	F154 A166 L167 G168 T173 R174 R175 I178 F179	F154-A170 HydrophobicContact CE1-CB 4.36Å; A166-A170 WeakPolarHBondContact O-CB 3.37Å; A166-A170 PolarHBondContact O-N 3.48Å; L167-A170 PolarHBondContact O-N 3.32Å; G168-A170 PolarHBondContact O-N 3.33Å; A170-T173 PolarHBondContact O-OG1 2.73Å; A170-R174 CarbonylContact O-C 3.47Å; A170-R174 PolarHBondContact O-N 3.03Å; A170-R175 PolarHBondContact O-N 3.13Å; A170-I178 HydrophobicContact CB-CB 4.18Å; A170-I178 HydrophobicContact CB-CG2 3.93Å; A170-F179 HydrophobicContact CB-CB 4.21Å
171	I	88.3	Confident	88.6	Confident	20 Å²	20	47.4 Å²	47.4	10%	0.103	22%	0.223	C	C	.	.	H	α-helix	trans	-73.9	-47.9	175.3	-66	168.2	0	0	0	110.5	L167 G168 I169 T173 R174 F179 V199 I204 F213	L167-I171 WeakPolarHBondContact O-CG1 3.09Å; L167-I171 PolarHBondContact O-N 2.62Å; L167-I171 VanDerWaalsContact O-N 3.14Å; G168-I171 WeakPolarHBondContact O-CB 3.33Å; G168-I171 PolarHBondContact O-N 3.27Å; I169-I171 VanDerWaalsContact C-N 3.32Å; I169-I171 PolarHBondContact O-N 3.28Å; I171-T173 VanDerWaalsContact C-N 3.32Å; I171-T173 PolarHBondContact O-N 3.06Å; I171-R174 WeakPolarHBondContact O-CA 3.44Å; I171-R174 PolarHBondContact O-N 3.15Å; I171-F179 HydrophobicContact CD1-CD2 4.33Å; I171-F179 HydrophobicContact CD1-CE2 4.01Å; I171-F179 HydrophobicContact CG1-CD2 3.9Å; I171-F179 HydrophobicContact CG1-CE2 4.02Å; I171-V199 HydrophobicContact CD1-CB 4.48Å; I171-V199 HydrophobicContact CD1-CG1 3.4Å; I171-I204 HydrophobicContact CG2-CD1 3.8Å; I171-I204 HydrophobicContact CG2-CG1 4.1Å; I171-F213 HydrophobicContact CB-CZ 4.42Å; I171-F213 HydrophobicContact CG1-CE1 4.33Å; I171-F213 HydrophobicContact CG1-CE2 4.5Å; I171-F213 HydrophobicContact CG1-CZ 4.13Å; I171-F213 HydrophobicContact CG2-CE2 4.4Å
172	E	85.8	Confident	88.7	Confident	108 Å²	108	41.9 Å²	41.9	51%	0.505	20%	0.199	S	C	.	.	H	α-helix	trans	-58.5	-41.4	177.1	-67.3	163.4	-168.9	0	0	112.3	T110 G168 R174	T110-E172 HydrophobicContact CG2-CB 3.91Å; G168-E172 PolarHBondContact O-N 3.12Å; E172-R174 PolarHBondContact O-N 3.02Å
173	T	87	Confident	88.6	Confident	0 Å²	0	37 Å²	37	0%	0	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	0.6	176.1	59.5	0	0	0	0	113.9	Y109 T110 R113 I169 A170 I171 R175	Y109-T173 HydrophobicContact CD1-CG2 3.61Å; Y109-T173 HydrophobicContact CE1-CG2 3.83Å; T110-T173 HydrophobicContact CG2-CG2 3.59Å; R113-T173 WeakPolarHBondContact CG-O 3.46Å; I169-T173 HydrophobicContact CG2-CG2 4.08Å; I169-T173 WeakPolarHBondContact O-CB 3.5Å; I169-T173 VanDerWaalsContact O-CG2 3.28Å; I169-T173 WeakPolarHBondContact O-CG2 3.43Å; I169-T173 PolarHBondContact O-N 2.91Å; I169-T173 PolarHBondContact O-OG1 3.4Å; A170-T173 PolarHBondContact O-OG1 2.73Å; I171-T173 VanDerWaalsContact C-N 3.32Å; I171-T173 PolarHBondContact O-N 3.06Å; T173-R175 PolarHBondContact O-N 3.12Å
174	R	85.6	Confident	88.5	Confident	49 Å²	49	39.6 Å²	39.6	19%	0.185	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	28.9	-177.1	-50.5	-170.5	-176.1	-146.9	-1.6	114	T114 D117 A170 I171 E172 L176 L209	T114-R174 PolarHBondContact OG1-NE 3.47Å; T114-R174 VanDerWaalsContact OG1-NE 3.13Å; T114-R174 PolarHBondContact OG1-NH2 3.21Å; D117-R174 VanDerWaalsContact OD2-CD 3.28Å; D117-R174 WeakPolarHBondContact OD2-CD 3.46Å; D117-R174 IonicContact OD2-CZ 2.73Å; D117-R174 IonicContact OD2-NE 3.7Å; D117-R174 IonicContact OD2-NH1 2.89Å; D117-R174 PolarHBondContact OD2-NH1 2.89Å; A170-R174 CarbonylContact O-C 3.47Å; A170-R174 PolarHBondContact O-N 3.03Å; I171-R174 WeakPolarHBondContact O-CA 3.44Å; I171-R174 PolarHBondContact O-N 3.15Å; E172-R174 PolarHBondContact O-N 3.02Å; R174-L176 PolarHBondContact O-N 3.24Å; R174-L209 HydrophobicContact CB-CD1 4.17Å; R174-L209 HydrophobicContact CG-CD1 4.26Å; R174-L209 HydrophobicContact CG-CD2 4.02Å
175	R	86.5	Confident	88.3	Confident	21 Å²	21	36.7 Å²	36.7	8%	0.079	19%	0.186	C	C	.	.			trans	-92.1	95.7	-175	-81.8	-168.1	71.1	175.9	-2.4	113.3	N151 A170 T173 D177 I178 F179	N151-R175 PolarHBondContact OD1-NH1 2.82Å; N151-R175 PolarHBondContact OD1-NH2 3.11Å; A170-R175 PolarHBondContact O-N 3.13Å; T173-R175 PolarHBondContact O-N 3.12Å; R175-D177 VanDerWaalsContact C-N 3.29Å; R175-D177 WeakPolarHBondContact CB-OD1 3.33Å; R175-D177 IonicContact CZ-OD1 3Å; R175-D177 IonicContact CZ-OD2 3.66Å; R175-D177 IonicContact NE-OD1 2.67Å; R175-D177 PolarHBondContact NE-OD1 3.12Å; R175-D177 IonicContact NE-OD2 3.56Å; R175-D177 IonicContact NH2-OD1 3.13Å; R175-D177 IonicContact NH2-OD2 3.28Å; R175-D177 PolarHBondContact NH2-OD2 3.4Å; R175-D177 PolarHBondContact O-N 3.33Å; R175-I178 HydrophobicContact CB-CB 4.47Å; R175-I178 VanDerWaalsContact NH2-CD1 3.34Å; R175-I178 PolarHBondContact O-N 3.22Å; R175-F179 WeakPolarHBondContact O-CB 3.45Å; R175-F179 PolarHBondContact O-N 2.81Å; R175-F179 VanDerWaalsContact O-N 3.12Å
176	L	87.8	Confident	88	Confident	51 Å²	51	32.2 Å²	32.2	27%	0.267	17%	0.166	S	C	.	.	H	α-helix	trans	-55.6	-38.5	174.8	-59.2	-171.4	0	0	0	113.5	R174 E180 R212 F213 I216	R174-L176 PolarHBondContact O-N 3.24Å; L176-E180 PolarHBondContact O-N 2.78Å; L176-E180 VanDerWaalsContact O-N 3.15Å; L176-R212 HydrophobicContact CD1-CB 4.33Å; L176-R212 HydrophobicContact CD2-CB 4.12Å; L176-F213 HydrophobicContact CD2-CD1 3.87Å; L176-F213 HydrophobicContact CD2-CE1 3.72Å; L176-F213 HydrophobicContact CD2-CG 4.33Å; L176-F213 HydrophobicContact CD2-CZ 4.07Å; L176-I216 HydrophobicContact CB-CD1 3.53Å; L176-I216 HydrophobicContact CD1-CD1 4.23Å; L176-I216 HydrophobicContact CD2-CD1 3.71Å; L176-I216 HydrophobicContact CG-CD1 3.98Å
177	D	89.1	Confident	87.6	Confident	87 Å²	87	37.9 Å²	37.9	47%	0.465	20%	0.196	S	C	.	.	H	α-helix	trans	-69.9	-41.3	-175.7	66.8	-46.3	0	0	0	112.9	R175 K181	R175-D177 VanDerWaalsContact C-N 3.29Å; R175-D177 WeakPolarHBondContact CB-OD1 3.33Å; R175-D177 IonicContact CZ-OD1 3Å; R175-D177 IonicContact CZ-OD2 3.66Å; R175-D177 IonicContact NE-OD1 2.67Å; R175-D177 PolarHBondContact NE-OD1 3.12Å; R175-D177 IonicContact NE-OD2 3.56Å; R175-D177 IonicContact NH2-OD1 3.13Å; R175-D177 IonicContact NH2-OD2 3.28Å; R175-D177 PolarHBondContact NH2-OD2 3.4Å; R175-D177 PolarHBondContact O-N 3.33Å; D177-K181 PolarHBondContact O-N 3.35Å; D177-K181 VanDerWaalsContact O-N 3.1Å
178	I	89.8	Confident	87.3	Confident	4 Å²	4	42 Å²	42	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-77.2	-32.7	177	-66.1	-168.6	0	0	0	111.3	F154 F158 A170 R175 E180 K181 A182	F154-I178 HydrophobicContact CB-CD1 3.94Å; F154-I178 HydrophobicContact CD1-CD1 4.14Å; F154-I178 HydrophobicContact CD1-CG2 3.61Å; F154-I178 HydrophobicContact CD2-CD1 3.2Å; F154-I178 HydrophobicContact CD2-CG2 4.49Å; F154-I178 HydrophobicContact CE1-CD1 4.4Å; F154-I178 HydrophobicContact CE1-CG2 3.67Å; F154-I178 HydrophobicContact CE2-CD1 3.54Å; F154-I178 HydrophobicContact CG-CD1 3.52Å; F154-I178 HydrophobicContact CG-CG2 4.03Å; F154-I178 HydrophobicContact CZ-CD1 4.12Å; F154-I178 HydrophobicContact CZ-CG2 4.13Å; F158-I178 HydrophobicContact CE2-CG2 4.42Å; F158-I178 HydrophobicContact CZ-CG2 3.99Å; A170-I178 HydrophobicContact CB-CB 4.18Å; A170-I178 HydrophobicContact CB-CG2 3.93Å; R175-I178 HydrophobicContact CB-CB 4.47Å; R175-I178 VanDerWaalsContact NH2-CD1 3.34Å; R175-I178 PolarHBondContact O-N 3.22Å; I178-E180 VanDerWaalsContact C-N 3.33Å; I178-E180 PolarHBondContact O-N 3.48Å; I178-K181 PolarHBondContact O-N 3.27Å; I178-A182 VanDerWaalsContact O-CB 3.24Å; I178-A182 WeakPolarHBondContact O-CB 3.36Å; I178-A182 PolarHBondContact O-N 3.36Å
179	F	90.4	Very high	87	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-58	-45.2	172.3	-178.7	-86	0	0	0	111.4	L167 A170 I171 R175 I183 A196 V200 F213 I216 L217	L167-F179 HydrophobicContact CD1-CD2 3.48Å; L167-F179 VanDerWaalsContact CD1-CD2 3.48Å; L167-F179 HydrophobicContact CD1-CE2 3.67Å; L167-F179 HydrophobicContact CD1-CG 4.07Å; L167-F179 HydrophobicContact CD1-CZ 4.38Å; L167-F179 HydrophobicContact CG-CD2 4.2Å; L167-F179 HydrophobicContact CG-CE2 4.22Å; A170-F179 HydrophobicContact CB-CB 4.21Å; I171-F179 HydrophobicContact CD1-CD2 4.33Å; I171-F179 HydrophobicContact CD1-CE2 4.01Å; I171-F179 HydrophobicContact CG1-CD2 3.9Å; I171-F179 HydrophobicContact CG1-CE2 4.02Å; R175-F179 WeakPolarHBondContact O-CB 3.45Å; R175-F179 PolarHBondContact O-N 2.81Å; R175-F179 VanDerWaalsContact O-N 3.12Å; F179-I183 HydrophobicContact CD1-CD1 3.96Å; F179-I183 HydrophobicContact CE1-CD1 3.62Å; F179-I183 HydrophobicContact CZ-CD1 4.1Å; F179-I183 WeakPolarHBondContact O-CG1 3.19Å; F179-I183 PolarHBondContact O-N 2.9Å; F179-A196 HydrophobicContact CE2-CB 4.41Å; F179-A196 HydrophobicContact CZ-CB 4.06Å; F179-V200 HydrophobicContact CE2-CG2 4.01Å; F179-V200 HydrophobicContact CZ-CG2 3.94Å; F179-F213 HydrophobicContact CB-CD1 4.19Å; F179-F213 HydrophobicContact CB-CE1 3.82Å; F179-F213 AromaticContact CD1-CD1 3.81Å; F179-F213 HydrophobicContact CD1-CD1 3.81Å; F179-F213 HydrophobicContact CD1-CE1 4.32Å; F179-F213 AromaticContact CD2-CD1 3.56Å; F179-F213 HydrophobicContact CD2-CD1 3.56Å; F179-F213 AromaticContact CD2-CE1 3.58Å; F179-F213 HydrophobicContact CD2-CE1 3.58Å; F179-F213 AromaticContact CE1-CD1 3.97Å; F179-F213 HydrophobicContact CE1-CD1 3.97Å; F179-F213 AromaticContact CE2-CD1 3.74Å; F179-F213 HydrophobicContact CE2-CD1 3.74Å; F179-F213 HydrophobicContact CE2-CE1 4.17Å; F179-F213 HydrophobicContact CE2-CG 4.42Å; F179-F213 AromaticContact CG-CD1 3.59Å; F179-F213 HydrophobicContact CG-CD1 3.59Å; F179-F213 AromaticContact CG-CE1 3.67Å; F179-F213 HydrophobicContact CG-CE1 3.67Å; F179-F213 HydrophobicContact CZ-CB 4.35Å; F179-F213 AromaticContact CZ-CD1 3.94Å; F179-F213 HydrophobicContact CZ-CD1 3.94Å; F179-F213 HydrophobicContact CZ-CG 4.48Å; F179-I216 HydrophobicContact CD1-CG2 4.08Å; F179-I216 HydrophobicContact CE1-CG2 4.41Å; F179-L217 HydrophobicContact CE1-CD2 3.89Å; F179-L217 HydrophobicContact CE1-CG 3.98Å; F179-L217 HydrophobicContact CZ-CD1 4.35Å; F179-L217 HydrophobicContact CZ-CD2 3.99Å; F179-L217 HydrophobicContact CZ-CG 4.1Å
180	E	89.4	Confident	86.6	Confident	67 Å²	67	47.2 Å²	47.2	31%	0.313	24%	0.237	S	C	.	.	H	α-helix	trans	-64.6	-49.3	173.6	-173.2	168.3	-156.1	0	0	112.2	L176 I178 A182 I183 I184 I216 V220	L176-E180 PolarHBondContact O-N 2.78Å; L176-E180 VanDerWaalsContact O-N 3.15Å; I178-E180 VanDerWaalsContact C-N 3.33Å; I178-E180 PolarHBondContact O-N 3.48Å; E180-A182 VanDerWaalsContact C-N 3.3Å; E180-A182 PolarHBondContact O-N 3.11Å; E180-I183 PolarHBondContact O-N 3.44Å; E180-I184 HydrophobicContact CG-CD1 3.68Å; E180-I184 HydrophobicContact CG-CG1 4.4Å; E180-I184 WeakPolarHBondContact O-CG1 3.2Å; E180-I184 PolarHBondContact O-N 3.04Å; E180-I216 HydrophobicContact CB-CG2 3.85Å; E180-I216 HydrophobicContact CG-CG2 4.2Å; E180-V220 HydrophobicContact CG-CG2 3.98Å
181	K	88.4	Confident	86.4	Confident	81 Å²	81	48.2 Å²	48.2	35%	0.352	25%	0.248	S	C	.	.	H	α-helix	trans	-54.2	-44.9	177	-177.5	-178.7	170.7	-171.7	0	111.8	D155 F158 D177 I178 I183 I184 S185	D155-K181 IonicContact OD1-NZ 2.75Å; D155-K181 PolarHBondContact OD1-NZ 3.28Å; F158-K181 HydrophobicContact CD2-CD 4.3Å; F158-K181 HydrophobicContact CE2-CD 3.63Å; F158-K181 HydrophobicContact CE2-CG 4.13Å; F158-K181 HydrophobicContact CZ-CD 4.06Å; F158-K181 HydrophobicContact CZ-CG 4.07Å; D177-K181 PolarHBondContact O-N 3.35Å; D177-K181 VanDerWaalsContact O-N 3.1Å; I178-K181 PolarHBondContact O-N 3.27Å; K181-I183 VanDerWaalsContact C-N 3.35Å; K181-I183 PolarHBondContact O-N 3.06Å; K181-I184 PolarHBondContact O-N 3.36Å; K181-S185 VanDerWaalsContact O-CB 3.32Å; K181-S185 WeakPolarHBondContact O-CB 3.44Å; K181-S185 PolarHBondContact O-N 3.22Å; K181-S185 PolarHBondContact O-OG 3.28Å; K181-S185 VanDerWaalsContact O-OG 3.13Å
182	A	88.6	Confident	86.3	Confident	2 Å²	2	48.2 Å²	48.2	2%	0.017	25%	0.247	C	C	.	.	H	α-helix	trans	-66.1	-33.6	-176.9	0	0	0	0	0	113.6	F158 A166 L167 I178 E180	F158-A182 HydrophobicContact CE1-CB 3.77Å; F158-A182 HydrophobicContact CZ-CB 4.07Å; A166-A182 HydrophobicContact CB-CB 4.31Å; L167-A182 HydrophobicContact CD1-CB 4.41Å; I178-A182 VanDerWaalsContact O-CB 3.24Å; I178-A182 WeakPolarHBondContact O-CB 3.36Å; I178-A182 PolarHBondContact O-N 3.36Å; E180-A182 VanDerWaalsContact C-N 3.3Å; E180-A182 PolarHBondContact O-N 3.11Å
183	I	86.9	Confident	86.3	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-73.5	-49.9	174.5	-63.1	166.8	0	0	0	109.9	L167 F179 E180 K181 S185 S186 L193 A196 L217 V220	L167-I183 HydrophobicContact CD1-CD1 4.33Å; L167-I183 HydrophobicContact CD1-CG1 4.02Å; F179-I183 HydrophobicContact CD1-CD1 3.96Å; F179-I183 HydrophobicContact CE1-CD1 3.62Å; F179-I183 HydrophobicContact CZ-CD1 4.1Å; F179-I183 WeakPolarHBondContact O-CG1 3.19Å; F179-I183 PolarHBondContact O-N 2.9Å; E180-I183 PolarHBondContact O-N 3.44Å; K181-I183 VanDerWaalsContact C-N 3.35Å; K181-I183 PolarHBondContact O-N 3.06Å; I183-S185 PolarHBondContact O-N 2.88Å; I183-S186 PolarHBondContact O-N 3.4Å; I183-S186 PolarHBondContact O-OG 2.81Å; I183-L193 HydrophobicContact CD1-CD2 4.48Å; I183-L193 HydrophobicContact CG2-CD2 3.79Å; I183-L193 HydrophobicContact CG2-CG 3.8Å; I183-A196 HydrophobicContact CD1-CB 4.15Å; I183-L217 HydrophobicContact CD1-CD2 3.77Å; I183-V220 HydrophobicContact CG2-CG1 3.93Å
184	I	87.6	Confident	86.1	Confident	85 Å²	85	50 Å²	50	44%	0.436	25%	0.25	S	C	.	.	H	α-helix	trans	-63.4	-42.5	-175.4	-66.6	175.9	0	0	0	112.1	E180 K181 S186 Q189	E180-I184 HydrophobicContact CG-CD1 3.68Å; E180-I184 HydrophobicContact CG-CG1 4.4Å; E180-I184 WeakPolarHBondContact O-CG1 3.2Å; E180-I184 PolarHBondContact O-N 3.04Å; K181-I184 PolarHBondContact O-N 3.36Å; I184-S186 VanDerWaalsContact C-N 3.25Å; I184-S186 PolarHBondContact O-N 3.17Å; I184-Q189 PolarHBondContact O-NE2 3.21Å
185	S	86.5	Confident	86.2	Confident	58 Å²	58	51 Å²	51	41%	0.406	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-10	-178	-64.1	0	0	0	0	114.9	Y163 K181 I183	Y163-S185 PolarHBondContact OH-O 3.44Å; Y163-S185 VanDerWaalsContact OH-O 3.08Å; K181-S185 VanDerWaalsContact O-CB 3.32Å; K181-S185 WeakPolarHBondContact O-CB 3.44Å; K181-S185 PolarHBondContact O-N 3.22Å; K181-S185 PolarHBondContact O-OG 3.28Å; K181-S185 VanDerWaalsContact O-OG 3.13Å; I183-S185 PolarHBondContact O-N 2.88Å
186	S	82.9	Confident	86.3	Confident	8 Å²	8	50 Å²	50	6%	0.056	25%	0.25	C	C	.	.			trans	-74.4	143	-173.8	67.7	0	0	0	0	113.9	I183 I184 D188 Q189 M192	I183-S186 PolarHBondContact O-N 3.4Å; I183-S186 PolarHBondContact O-OG 2.81Å; I184-S186 VanDerWaalsContact C-N 3.25Å; I184-S186 PolarHBondContact O-N 3.17Å; S186-D188 VanDerWaalsContact C-N 3.27Å; S186-D188 PolarHBondContact O-N 2.92Å; S186-Q189 WeakPolarHBondContact OG-CA 3.39Å; S186-M192 VanDerWaalsContact CB-CG 3.46Å; S186-M192 VanDerWaalsContact OG-CG 3.31Å; S186-M192 WeakPolarHBondContact OG-CG 3.49Å
187	D	80.7	Confident	86.2	Confident	119 Å²	119	48.9 Å²	48.9	64%	0.636	24%	0.243	S	C	*	.	S	Bend	trans	-67.3	-28.6	175.2	-56.3	-78.6	0	0	0	112.2	K161	K161-D187 WeakPolarHBondContact CD-OD2 3.49Å; K161-D187 WeakPolarHBondContact CE-OD2 3.34Å; K161-D187 IonicContact NZ-OD1 3.91Å; K161-D187 PolarHBondContact NZ-OD1 2.74Å; K161-D187 IonicContact NZ-OD2 3.69Å; K161-D187 PolarHBondContact NZ-OD2 3.35Å
188	D	83.9	Confident	86	Confident	88 Å²	88	52.3 Å²	52.3	47%	0.471	25%	0.249	S	C	.	.			trans	-119.5	82.3	175.1	172.8	22.5	0	0	0	110.5	S186 E190 G191 M192	S186-D188 VanDerWaalsContact C-N 3.27Å; S186-D188 PolarHBondContact O-N 2.92Å; D188-E190 VanDerWaalsContact C-N 3.27Å; D188-E190 PolarHBondContact O-N 3.21Å; D188-E190 PolarHBondContact OD1-N 3.22Å; D188-G191 PolarHBondContact OD1-N 3.2Å; D188-G191 WeakPolarHBondContact OD2-CA 3.43Å; D188-G191 PolarHBondContact OD2-N 2.91Å; D188-M192 WeakPolarHBondContact O-CB 3.41Å; D188-M192 WeakPolarHBondContact O-CG 3.32Å; D188-M192 PolarHBondContact O-N 3.48Å
189	Q	82.8	Confident	85.8	Confident	65 Å²	65	52.7 Å²	52.7	30%	0.304	25%	0.252	S	S	.	.	H	α-helix	trans	-63.4	-30.9	177.5	-65.9	179.7	-13.1	0	0	113.1	I184 S186 L193 R224	I184-Q189 PolarHBondContact O-NE2 3.21Å; S186-Q189 WeakPolarHBondContact OG-CA 3.39Å; Q189-L193 VanDerWaalsContact O-CB 3.26Å; Q189-L193 WeakPolarHBondContact O-CB 3.47Å; Q189-L193 WeakPolarHBondContact O-CD1 3.41Å; Q189-L193 WeakPolarHBondContact O-CG 3.5Å; Q189-L193 PolarHBondContact O-N 3.12Å; Q189-R224 VanDerWaalsContact OE1-NH2 3.14Å
190	E	81.4	Confident	85.5	Confident	78 Å²	78	52.7 Å²	52.7	36%	0.364	25%	0.252	S	S	.	.	H	α-helix	trans	-75.6	-43.8	-175.3	-166.6	-174.6	133.7	0	0	111	D188 L193 R194	D188-E190 VanDerWaalsContact C-N 3.27Å; D188-E190 PolarHBondContact O-N 3.21Å; D188-E190 PolarHBondContact OD1-N 3.22Å; E190-L193 PolarHBondContact O-N 3.03Å; E190-R194 WeakPolarHBondContact O-CG 3.46Å; E190-R194 PolarHBondContact O-N 3.44Å; E190-R194 IonicContact OE1-CZ 2.74Å; E190-R194 IonicContact OE1-NH1 3.57Å; E190-R194 PolarHBondContact OE1-NH1 3.41Å; E190-R194 IonicContact OE1-NH2 3.94Å; E190-R194 PolarHBondContact OE1-NH2 3.4Å
191	G	84.2	Confident	85.1	Confident	21 Å²	21	52.6 Å²	52.6	22%	0.216	25%	0.254	C	S	.	.	H	α-helix	trans	-64.8	-38.9	170.2	0	0	0	0	0	112.7	D188 Y195	D188-G191 PolarHBondContact OD1-N 3.2Å; D188-G191 WeakPolarHBondContact OD2-CA 3.43Å; D188-G191 PolarHBondContact OD2-N 2.91Å; G191-Y195 VanDerWaalsContact O-CB 3.26Å; G191-Y195 WeakPolarHBondContact O-CB 3.36Å; G191-Y195 PolarHBondContact O-N 3.01Å
192	M	86.5	Confident	84.6	Confident	19 Å²	19	53.2 Å²	53.2	9%	0.094	26%	0.264	C	S	.	.	H	α-helix	trans	-65.4	-43.4	174.5	-74.2	-44.5	98.3	0	0	112.1	K164 S186 D188 Y195 A196	K164-M192 HydrophobicContact CD-CE 4.49Å; K164-M192 HydrophobicContact CG-CE 3.93Å; K164-M192 HydrophobicContact CG-SD 3.85Å; S186-M192 VanDerWaalsContact CB-CG 3.46Å; S186-M192 VanDerWaalsContact OG-CG 3.31Å; S186-M192 WeakPolarHBondContact OG-CG 3.49Å; D188-M192 WeakPolarHBondContact O-CB 3.41Å; D188-M192 WeakPolarHBondContact O-CG 3.32Å; D188-M192 PolarHBondContact O-N 3.48Å; M192-Y195 PolarHBondContact O-N 3.22Å; M192-A196 VanDerWaalsContact O-CB 3.27Å; M192-A196 WeakPolarHBondContact O-CB 3.4Å; M192-A196 PolarHBondContact O-N 3.17Å
193	L	85.9	Confident	84.3	Confident	2 Å²	2	59.1 Å²	59.1	1%	0.01	30%	0.295	C	S	.	.	H	α-helix	trans	-62.8	-44.7	177.8	-79.8	162.4	0	0	0	112	I183 Q189 E190 Y195 A196 F197 L217 V220 Y221	I183-L193 HydrophobicContact CD1-CD2 4.48Å; I183-L193 HydrophobicContact CG2-CD2 3.79Å; I183-L193 HydrophobicContact CG2-CG 3.8Å; Q189-L193 VanDerWaalsContact O-CB 3.26Å; Q189-L193 WeakPolarHBondContact O-CB 3.47Å; Q189-L193 WeakPolarHBondContact O-CD1 3.41Å; Q189-L193 WeakPolarHBondContact O-CG 3.5Å; Q189-L193 PolarHBondContact O-N 3.12Å; E190-L193 PolarHBondContact O-N 3.03Å; L193-Y195 PolarHBondContact O-N 3.17Å; L193-A196 PolarHBondContact O-N 3.03Å; L193-F197 WeakPolarHBondContact O-CB 3.21Å; L193-F197 PolarHBondContact O-N 2.96Å; L193-L217 HydrophobicContact CD2-CD2 3.91Å; L193-V220 HydrophobicContact CD2-CG1 4.03Å; L193-Y221 HydrophobicContact CB-CE1 3.93Å; L193-Y221 HydrophobicContact CD1-CD1 3.94Å; L193-Y221 HydrophobicContact CD1-CE1 3.71Å; L193-Y221 HydrophobicContact CD2-CD1 4.29Å; L193-Y221 HydrophobicContact CD2-CE1 4Å; L193-Y221 HydrophobicContact CD2-CE2 4.3Å; L193-Y221 HydrophobicContact CG-CE1 4.09Å
194	R	83.6	Confident	83.9	Confident	144 Å²	144	59.6 Å²	59.6	54%	0.543	30%	0.297	S	S	.	.	H	α-helix	trans	-62	-41.1	173.7	-73.5	-171.5	-176.8	108.2	8.8	112.6	E190 R198	E190-R194 WeakPolarHBondContact O-CG 3.46Å; E190-R194 PolarHBondContact O-N 3.44Å; E190-R194 IonicContact OE1-CZ 2.74Å; E190-R194 IonicContact OE1-NH1 3.57Å; E190-R194 PolarHBondContact OE1-NH1 3.41Å; E190-R194 IonicContact OE1-NH2 3.94Å; E190-R194 PolarHBondContact OE1-NH2 3.4Å; R194-R198 WeakPolarHBondContact O-CB 3.27Å; R194-R198 PolarHBondContact O-N 2.83Å; R194-R198 VanDerWaalsContact O-N 3.14Å
195	Y	86.7	Confident	83.2	Confident	69 Å²	69	60.8 Å²	60.8	27%	0.271	31%	0.305	S	S	.	.	H	α-helix	trans	-65.7	-46.4	177.6	179.1	-111.4	0	0	0	111.2	K164 L167 G191 M192 L193 R198 V199	K164-Y195 HydrophobicContact CB-CE1 3.92Å; K164-Y195 HydrophobicContact CD-CE1 4.48Å; K164-Y195 HydrophobicContact CG-CD1 4.11Å; K164-Y195 HydrophobicContact CG-CE1 3.96Å; L167-Y195 HydrophobicContact CD2-CD1 3.72Å; L167-Y195 HydrophobicContact CD2-CE1 3.97Å; G191-Y195 VanDerWaalsContact O-CB 3.26Å; G191-Y195 WeakPolarHBondContact O-CB 3.36Å; G191-Y195 PolarHBondContact O-N 3.01Å; M192-Y195 PolarHBondContact O-N 3.22Å; L193-Y195 PolarHBondContact O-N 3.17Å; Y195-R198 PolarHBondContact O-N 2.96Å; Y195-V199 HydrophobicContact CD1-CG2 4.38Å; Y195-V199 HydrophobicContact CD2-CG2 4.09Å; Y195-V199 HydrophobicContact CE1-CG2 4.06Å; Y195-V199 HydrophobicContact CE2-CG2 3.74Å; Y195-V199 HydrophobicContact CG-CG2 4.39Å; Y195-V199 WeakPolarHBondContact O-CB 3.42Å; Y195-V199 VanDerWaalsContact O-CG2 3.26Å; Y195-V199 WeakPolarHBondContact O-CG2 3.24Å; Y195-V199 PolarHBondContact O-N 2.95Å
196	A	88.8	Confident	82.7	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-59.8	-48.8	177.6	0	0	0	0	0	112.2	L167 F179 I183 M192 L193 R198 V199 V200 L217	L167-A196 HydrophobicContact CD1-CB 4.41Å; L167-A196 HydrophobicContact CD2-CB 3.72Å; F179-A196 HydrophobicContact CE2-CB 4.41Å; F179-A196 HydrophobicContact CZ-CB 4.06Å; I183-A196 HydrophobicContact CD1-CB 4.15Å; M192-A196 VanDerWaalsContact O-CB 3.27Å; M192-A196 WeakPolarHBondContact O-CB 3.4Å; M192-A196 PolarHBondContact O-N 3.17Å; L193-A196 PolarHBondContact O-N 3.03Å; A196-R198 VanDerWaalsContact C-N 3.34Å; A196-R198 PolarHBondContact O-N 2.75Å; A196-V199 PolarHBondContact O-N 3.07Å; A196-V200 WeakPolarHBondContact O-CB 3.26Å; A196-V200 VanDerWaalsContact O-CG2 3.26Å; A196-V200 WeakPolarHBondContact O-CG2 3.46Å; A196-V200 PolarHBondContact O-N 2.77Å; A196-L217 HydrophobicContact CB-CD2 3.98Å
197	F	85.5	Confident	82.4	Confident	29 Å²	29	61.5 Å²	61.5	13%	0.127	31%	0.307	C	S	.	.	H	α-helix	trans	-58.8	-43.7	176.9	-177.9	-111.7	0	0	0	112.1	L193 L201 L214 L217 Q235 C236 L239	L193-F197 WeakPolarHBondContact O-CB 3.21Å; L193-F197 PolarHBondContact O-N 2.96Å; F197-L201 HydrophobicContact CD1-CD1 4.08Å; F197-L201 HydrophobicContact CD2-CD1 4.48Å; F197-L201 HydrophobicContact CE1-CD1 3.6Å; F197-L201 HydrophobicContact CE2-CD1 4.04Å; F197-L201 HydrophobicContact CZ-CD1 3.59Å; F197-L201 WeakPolarHBondContact O-CB 3.39Å; F197-L201 WeakPolarHBondContact O-CG 3.34Å; F197-L201 PolarHBondContact O-N 3.35Å; F197-L201 VanDerWaalsContact O-N 3.15Å; F197-L214 HydrophobicContact CD2-CD2 4.22Å; F197-L214 HydrophobicContact CE2-CD2 4.13Å; F197-L217 HydrophobicContact CB-CD1 4.42Å; F197-L217 HydrophobicContact CD2-CD1 4.39Å; F197-Q235 HydrophobicContact CZ-CB 4.16Å; F197-C236 VanDerWaalsContact CE2-SG 3.51Å; F197-L239 HydrophobicContact CE2-CD1 3.86Å; F197-L239 HydrophobicContact CZ-CD1 3.95Å
198	R	84.5	Confident	82.5	Confident	158 Å²	158	61.4 Å²	61.4	60%	0.596	30%	0.298	S	S	*	.	H	α-helix	trans	-62.7	-48.7	175.8	-172.5	179.4	70	168.3	4.6	111.9	R194 Y195 A196 V200 L201 T202	R194-R198 WeakPolarHBondContact O-CB 3.27Å; R194-R198 PolarHBondContact O-N 2.83Å; R194-R198 VanDerWaalsContact O-N 3.14Å; Y195-R198 PolarHBondContact O-N 2.96Å; A196-R198 VanDerWaalsContact C-N 3.34Å; A196-R198 PolarHBondContact O-N 2.75Å; R198-V200 PolarHBondContact O-N 3.01Å; R198-L201 PolarHBondContact O-N 3.48Å; R198-L201 VanDerWaalsContact O-N 3.13Å; R198-T202 HydrophobicContact CG-CG2 4.35Å; R198-T202 WeakPolarHBondContact O-CG2 3.48Å; R198-T202 PolarHBondContact O-N 3.29Å; R198-T202 PolarHBondContact O-OG1 3.15Å; R198-T202 VanDerWaalsContact O-OG1 3.11Å
199	V	86.3	Confident	82.5	Confident	13 Å²	13	57.8 Å²	57.8	8%	0.079	28%	0.278	C	S	.	.	H	α-helix	trans	-61.6	-44.4	-178.9	168	0	0	0	0	111.1	I171 Y195 A196 L201 T202 L203	I171-V199 HydrophobicContact CD1-CB 4.48Å; I171-V199 HydrophobicContact CD1-CG1 3.4Å; Y195-V199 HydrophobicContact CD1-CG2 4.38Å; Y195-V199 HydrophobicContact CD2-CG2 4.09Å; Y195-V199 HydrophobicContact CE1-CG2 4.06Å; Y195-V199 HydrophobicContact CE2-CG2 3.74Å; Y195-V199 HydrophobicContact CG-CG2 4.39Å; Y195-V199 WeakPolarHBondContact O-CB 3.42Å; Y195-V199 VanDerWaalsContact O-CG2 3.26Å; Y195-V199 WeakPolarHBondContact O-CG2 3.24Å; Y195-V199 PolarHBondContact O-N 2.95Å; A196-V199 PolarHBondContact O-N 3.07Å; V199-L201 PolarHBondContact O-N 2.85Å; V199-T202 PolarHBondContact O-N 3.34Å; V199-L203 HydrophobicContact CG1-CD1 3.97Å; V199-L203 WeakPolarHBondContact O-CB 3.44Å; V199-L203 PolarHBondContact O-N 2.92Å
200	V	85.3	Confident	82.6	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.4	-29.2	175.5	167.1	0	0	0	0	112.4	F179 A196 R198 I204 R210 F213 L214 L217	F179-V200 HydrophobicContact CE2-CG2 4.01Å; F179-V200 HydrophobicContact CZ-CG2 3.94Å; A196-V200 WeakPolarHBondContact O-CB 3.26Å; A196-V200 VanDerWaalsContact O-CG2 3.26Å; A196-V200 WeakPolarHBondContact O-CG2 3.46Å; A196-V200 PolarHBondContact O-N 2.77Å; R198-V200 PolarHBondContact O-N 3.01Å; V200-I204 HydrophobicContact CB-CD1 4.27Å; V200-I204 HydrophobicContact CG1-CD1 4.29Å; V200-I204 HydrophobicContact CG2-CD1 4.03Å; V200-R210 HydrophobicContact CG1-CG 3.87Å; V200-F213 HydrophobicContact CG1-CB 4.21Å; V200-F213 HydrophobicContact CG2-CB 3.95Å; V200-F213 HydrophobicContact CG2-CG 4.41Å; V200-L214 HydrophobicContact CG1-CD2 4.16Å; V200-L214 HydrophobicContact CG1-CG 4.14Å; V200-L217 HydrophobicContact CG2-CD1 4.44Å
201	L	79.6	Confident	82.8	Confident	65 Å²	65	55.3 Å²	55.3	34%	0.34	27%	0.266	S	S	.	.	H	α-helix	trans	-85.4	-26	176.8	-79.6	177.2	0	0	0	115	F197 R198 V199 L239	F197-L201 HydrophobicContact CD1-CD1 4.08Å; F197-L201 HydrophobicContact CD2-CD1 4.48Å; F197-L201 HydrophobicContact CE1-CD1 3.6Å; F197-L201 HydrophobicContact CE2-CD1 4.04Å; F197-L201 HydrophobicContact CZ-CD1 3.59Å; F197-L201 WeakPolarHBondContact O-CB 3.39Å; F197-L201 WeakPolarHBondContact O-CG 3.34Å; F197-L201 PolarHBondContact O-N 3.35Å; F197-L201 VanDerWaalsContact O-N 3.15Å; R198-L201 PolarHBondContact O-N 3.48Å; R198-L201 VanDerWaalsContact O-N 3.13Å; V199-L201 PolarHBondContact O-N 2.85Å; L201-L239 HydrophobicContact CD1-CD1 4.43Å; L201-L239 HydrophobicContact CD2-CD1 3.83Å; L201-L239 HydrophobicContact CD2-CD2 4.15Å
202	T	78.7	Confident	83	Confident	94 Å²	94	58.8 Å²	58.8	58%	0.577	27%	0.272	S	S	*	.	H	α-helix	trans	-102.3	-18.1	-174.2	57.4	0	0	0	0	114.9	R198 V199	R198-T202 HydrophobicContact CG-CG2 4.35Å; R198-T202 WeakPolarHBondContact O-CG2 3.48Å; R198-T202 PolarHBondContact O-N 3.29Å; R198-T202 PolarHBondContact O-OG1 3.15Å; R198-T202 VanDerWaalsContact O-OG1 3.11Å; V199-T202 PolarHBondContact O-N 3.34Å
203	L	81.2	Confident	83.1	Confident	125 Å²	125	57.9 Å²	57.9	65%	0.654	27%	0.268	S	S	*	.	S	Bend	trans	-126.2	-0.8	-170.4	-71.3	158.7	0	0	0	114.3	V199	V199-L203 HydrophobicContact CG1-CD1 3.97Å; V199-L203 WeakPolarHBondContact O-CB 3.44Å; V199-L203 PolarHBondContact O-N 2.92Å
204	I	80.2	Confident	83.2	Confident	11 Å²	11	57.8 Å²	57.8	6%	0.056	27%	0.267	C	S	.	.			trans	-117.2	91.7	-178.8	-48.8	-174.5	0	0	0	110.2	I171 V200 L209 R210 F213	I171-I204 HydrophobicContact CG2-CD1 3.8Å; I171-I204 HydrophobicContact CG2-CG1 4.1Å; V200-I204 HydrophobicContact CB-CD1 4.27Å; V200-I204 HydrophobicContact CG1-CD1 4.29Å; V200-I204 HydrophobicContact CG2-CD1 4.03Å; I204-L209 HydrophobicContact CG2-CB 4.01Å; I204-L209 HydrophobicContact CG2-CD2 4.08Å; I204-L209 HydrophobicContact CG2-CG 4.03Å; I204-R210 HydrophobicContact CB-CB 4.33Å; I204-R210 HydrophobicContact CG2-CB 3.9Å; I204-F213 HydrophobicContact CD1-CD2 3.53Å; I204-F213 HydrophobicContact CD1-CE2 3.88Å; I204-F213 HydrophobicContact CD1-CG 4.4Å
205	D	71.7	Confident	83.4	Confident	111 Å²	111	57.4 Å²	57.4	59%	0.594	27%	0.27	S	S	*	.			trans	-64.7	-45.1	177.3	-60	-35.7	0	0	0	111.8	V207	D205-V207 PolarHBondContact O-N 3.35Å; D205-V207 VanDerWaalsContact O-N 3.15Å
206	S	75.8	Confident	83.3	Confident	30 Å²	30	55.1 Å²	55.1	21%	0.21	26%	0.262	C	S	.	.			trans	-67.2	113.5	-177	-178.2	0	0	0	0	111.7	R208 L209 R210	S206-R208 VanDerWaalsContact C-N 3.26Å; S206-R208 PolarHBondContact O-N 3.09Å; S206-L209 PolarHBondContact O-N 3.11Å; S206-R210 WeakPolarHBondContact O-CB 3.1Å; S206-R210 PolarHBondContact O-N 3.4Å
207	V	77.1	Confident	83.2	Confident	50 Å²	50	55.1 Å²	55.1	30%	0.303	26%	0.262	S	S	.	.	H	α-helix	trans	-57.9	-38.2	179.9	-177.6	0	0	0	0	111.5	D205 R210 N211 V611	D205-V207 PolarHBondContact O-N 3.35Å; D205-V207 VanDerWaalsContact O-N 3.15Å; V207-R210 PolarHBondContact O-N 3.49Å; V207-N211 WeakPolarHBondContact O-CB 3.33Å; V207-N211 PolarHBondContact O-N 2.91Å; V207-N211 PolarHBondContact O-OD1 3.43Å; V207-V611 HydrophobicContact CG2-CG2 4.47Å
208	R	81.9	Confident	83.2	Confident	118 Å²	118	54.3 Å²	54.3	45%	0.445	26%	0.259	S	S	.	.	H	α-helix	trans	-61.3	-46.4	178.7	-63.6	-179	-174.8	145.8	9.1	111.7	D121 S206 R212	D121-R208 IonicContact OD1-NH1 2.77Å; D121-R208 WeakPolarHBondContact OD2-CD 3.46Å; D121-R208 IonicContact OD2-CZ 3.82Å; D121-R208 IonicContact OD2-NE 3.21Å; D121-R208 IonicContact OD2-NH1 2.8Å; D121-R208 PolarHBondContact OD2-NH1 3.4Å; S206-R208 VanDerWaalsContact C-N 3.26Å; S206-R208 PolarHBondContact O-N 3.09Å; R208-R212 WeakPolarHBondContact O-CD 3.32Å; R208-R212 WeakPolarHBondContact O-CG 3.35Å; R208-R212 PolarHBondContact O-N 2.96Å
209	L	83.8	Confident	83.2	Confident	11 Å²	11	48.9 Å²	48.9	6%	0.058	25%	0.245	C	C	.	.	H	α-helix	trans	-71	-43.4	178.5	-175.7	60.4	0	0	0	111.6	R174 I204 S206 N211 R212 F213	R174-L209 HydrophobicContact CB-CD1 4.17Å; R174-L209 HydrophobicContact CG-CD1 4.26Å; R174-L209 HydrophobicContact CG-CD2 4.02Å; I204-L209 HydrophobicContact CG2-CB 4.01Å; I204-L209 HydrophobicContact CG2-CD2 4.08Å; I204-L209 HydrophobicContact CG2-CG 4.03Å; S206-L209 PolarHBondContact O-N 3.11Å; L209-N211 VanDerWaalsContact C-N 3.34Å; L209-N211 PolarHBondContact O-N 2.94Å; L209-R212 WeakPolarHBondContact O-CB 3.08Å; L209-R212 PolarHBondContact O-N 3.1Å; L209-R212 VanDerWaalsContact O-N 3.12Å; L209-F213 HydrophobicContact CD1-CD2 4.12Å; L209-F213 HydrophobicContact CD1-CE2 3.59Å; L209-F213 HydrophobicContact CD1-CZ 4.41Å; L209-F213 HydrophobicContact CD2-CE2 4.29Å; L209-F213 HydrophobicContact CG-CD2 4.06Å; L209-F213 HydrophobicContact CG-CE2 3.74Å; L209-F213 WeakPolarHBondContact O-CD2 3.48Å; L209-F213 PolarHBondContact O-N 3.09Å
210	R	85.7	Confident	83.1	Confident	54 Å²	54	48.6 Å²	48.6	20%	0.204	24%	0.244	C	C	.	.	H	α-helix	trans	-57	-46.4	177	-169.8	179	68.8	-136.9	4.4	111.5	V200 I204 S206 V207 R212 F213 L214	V200-R210 HydrophobicContact CG1-CG 3.87Å; I204-R210 HydrophobicContact CB-CB 4.33Å; I204-R210 HydrophobicContact CG2-CB 3.9Å; S206-R210 WeakPolarHBondContact O-CB 3.1Å; S206-R210 PolarHBondContact O-N 3.4Å; V207-R210 PolarHBondContact O-N 3.49Å; R210-R212 VanDerWaalsContact C-N 3.28Å; R210-R212 PolarHBondContact O-N 3.28Å; R210-F213 PolarHBondContact O-N 3.33Å; R210-L214 HydrophobicContact CG-CD1 4.02Å; R210-L214 HydrophobicContact CG-CG 4.44Å; R210-L214 WeakPolarHBondContact O-CG 3.26Å; R210-L214 PolarHBondContact O-N 3.34Å
211	N	86.2	Confident	82.9	Confident	38 Å²	38	48.9 Å²	48.9	20%	0.203	25%	0.245	C	C	.	.	H	α-helix	trans	-67.3	-27.1	179.8	-69	4	0	0	0	112.5	V207 L209 K215 L239 M240	V207-N211 WeakPolarHBondContact O-CB 3.33Å; V207-N211 PolarHBondContact O-N 2.91Å; V207-N211 PolarHBondContact O-OD1 3.43Å; L209-N211 VanDerWaalsContact C-N 3.34Å; L209-N211 PolarHBondContact O-N 2.94Å; N211-K215 WeakPolarHBondContact O-CG 3.45Å; N211-K215 PolarHBondContact O-N 3.06Å; N211-L239 PolarHBondContact OD1-O 3.19Å; N211-M240 HydrophobicContact CB-CG 4.33Å
212	R	87.8	Confident	82.9	Confident	93 Å²	93	50.5 Å²	50.5	35%	0.351	25%	0.252	S	S	.	.	H	α-helix	trans	-69.1	-43	171.8	-75.3	159.9	60.5	-173.4	-5.4	112.2	D117 L176 R208 L209 R210	D117-R212 IonicContact OD1-CZ 3.99Å; D117-R212 IonicContact OD1-NH1 3.87Å; D117-R212 PolarHBondContact OD1-NH1 2.54Å; D117-R212 IonicContact OD1-NH2 3.84Å; D117-R212 PolarHBondContact OD1-NH2 3.41Å; D117-R212 VanDerWaalsContact OD1-NH2 3.12Å; D117-R212 IonicContact OD2-NH1 3.99Å; L176-R212 HydrophobicContact CD1-CB 4.33Å; L176-R212 HydrophobicContact CD2-CB 4.12Å; R208-R212 WeakPolarHBondContact O-CD 3.32Å; R208-R212 WeakPolarHBondContact O-CG 3.35Å; R208-R212 PolarHBondContact O-N 2.96Å; L209-R212 WeakPolarHBondContact O-CB 3.08Å; L209-R212 PolarHBondContact O-N 3.1Å; L209-R212 VanDerWaalsContact O-N 3.12Å; R210-R212 VanDerWaalsContact C-N 3.28Å; R210-R212 PolarHBondContact O-N 3.28Å
213	F	89.7	Confident	82.9	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-68.7	-39.1	174.5	-73.7	-67	0	0	0	112.7	I171 L176 F179 V200 I204 L209 R210 K215 I216 L217	I171-F213 HydrophobicContact CB-CZ 4.42Å; I171-F213 HydrophobicContact CG1-CE1 4.33Å; I171-F213 HydrophobicContact CG1-CE2 4.5Å; I171-F213 HydrophobicContact CG1-CZ 4.13Å; I171-F213 HydrophobicContact CG2-CE2 4.4Å; L176-F213 HydrophobicContact CD2-CD1 3.87Å; L176-F213 HydrophobicContact CD2-CE1 3.72Å; L176-F213 HydrophobicContact CD2-CG 4.33Å; L176-F213 HydrophobicContact CD2-CZ 4.07Å; F179-F213 HydrophobicContact CB-CD1 4.19Å; F179-F213 HydrophobicContact CB-CE1 3.82Å; F179-F213 AromaticContact CD1-CD1 3.81Å; F179-F213 HydrophobicContact CD1-CD1 3.81Å; F179-F213 HydrophobicContact CD1-CE1 4.32Å; F179-F213 AromaticContact CD2-CD1 3.56Å; F179-F213 HydrophobicContact CD2-CD1 3.56Å; F179-F213 AromaticContact CD2-CE1 3.58Å; F179-F213 HydrophobicContact CD2-CE1 3.58Å; F179-F213 AromaticContact CE1-CD1 3.97Å; F179-F213 HydrophobicContact CE1-CD1 3.97Å; F179-F213 AromaticContact CE2-CD1 3.74Å; F179-F213 HydrophobicContact CE2-CD1 3.74Å; F179-F213 HydrophobicContact CE2-CE1 4.17Å; F179-F213 HydrophobicContact CE2-CG 4.42Å; F179-F213 AromaticContact CG-CD1 3.59Å; F179-F213 HydrophobicContact CG-CD1 3.59Å; F179-F213 AromaticContact CG-CE1 3.67Å; F179-F213 HydrophobicContact CG-CE1 3.67Å; F179-F213 HydrophobicContact CZ-CB 4.35Å; F179-F213 AromaticContact CZ-CD1 3.94Å; F179-F213 HydrophobicContact CZ-CD1 3.94Å; F179-F213 HydrophobicContact CZ-CG 4.48Å; V200-F213 HydrophobicContact CG1-CB 4.21Å; V200-F213 HydrophobicContact CG2-CB 3.95Å; V200-F213 HydrophobicContact CG2-CG 4.41Å; I204-F213 HydrophobicContact CD1-CD2 3.53Å; I204-F213 HydrophobicContact CD1-CE2 3.88Å; I204-F213 HydrophobicContact CD1-CG 4.4Å; L209-F213 HydrophobicContact CD1-CD2 4.12Å; L209-F213 HydrophobicContact CD1-CE2 3.59Å; L209-F213 HydrophobicContact CD1-CZ 4.41Å; L209-F213 HydrophobicContact CD2-CE2 4.29Å; L209-F213 HydrophobicContact CG-CD2 4.06Å; L209-F213 HydrophobicContact CG-CE2 3.74Å; L209-F213 WeakPolarHBondContact O-CD2 3.48Å; L209-F213 PolarHBondContact O-N 3.09Å; R210-F213 PolarHBondContact O-N 3.33Å; F213-K215 VanDerWaalsContact C-N 3.33Å; F213-K215 PolarHBondContact O-N 3.35Å; F213-I216 PolarHBondContact O-N 2.73Å; F213-I216 VanDerWaalsContact O-N 3.15Å; F213-L217 PolarHBondContact O-N 2.93Å
214	L	86.7	Confident	82.3	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-62	-36.1	176.9	-72.1	170.5	0	0	0	112.6	F197 V200 R210 I216 L217 V218 C236 L239 M240	F197-L214 HydrophobicContact CD2-CD2 4.22Å; F197-L214 HydrophobicContact CE2-CD2 4.13Å; V200-L214 HydrophobicContact CG1-CD2 4.16Å; V200-L214 HydrophobicContact CG1-CG 4.14Å; R210-L214 HydrophobicContact CG-CD1 4.02Å; R210-L214 HydrophobicContact CG-CG 4.44Å; R210-L214 WeakPolarHBondContact O-CG 3.26Å; R210-L214 PolarHBondContact O-N 3.34Å; L214-I216 VanDerWaalsContact C-N 3.29Å; L214-I216 PolarHBondContact O-N 3.17Å; L214-L217 HydrophobicContact CD2-CD1 4.32Å; L214-L217 PolarHBondContact O-N 3.39Å; L214-V218 WeakPolarHBondContact O-CG2 3.46Å; L214-V218 PolarHBondContact O-N 3.3Å; L214-C236 HydrophobicContact CD2-CB 4.13Å; L214-L239 HydrophobicContact CD1-CB 3.71Å; L214-L239 HydrophobicContact CD2-CD1 4.49Å; L214-M240 HydrophobicContact CB-CE 4.35Å; L214-M240 HydrophobicContact CB-CG 3.69Å; L214-M240 HydrophobicContact CB-SD 3.44Å; L214-M240 WeakPolarHBondContact CB-SD 3.46Å; L214-M240 HydrophobicContact CD1-CG 3.88Å; L214-M240 HydrophobicContact CG-CG 4.45Å
215	K	87.5	Confident	81.3	Confident	137 Å²	137	53.2 Å²	53.2	60%	0.596	27%	0.274	S	S	*	.	H	α-helix	trans	-60.6	-37	174	-75.1	-179.2	-177.3	-175.9	0	112.6	N211 F213 V218 S219 M240	N211-K215 WeakPolarHBondContact O-CG 3.45Å; N211-K215 PolarHBondContact O-N 3.06Å; F213-K215 VanDerWaalsContact C-N 3.33Å; F213-K215 PolarHBondContact O-N 3.35Å; K215-V218 PolarHBondContact O-N 3Å; K215-S219 PolarHBondContact O-N 3.43Å; K215-M240 HydrophobicContact CB-SD 4.28Å; K215-M240 HydrophobicContact CG-CE 4.23Å; K215-M240 HydrophobicContact CG-SD 3.43Å; K215-M240 WeakPolarHBondContact CG-SD 3.48Å; K215-M240 PolarHBondContact N-SD 2.94Å; K215-M240 VanDerWaalsContact N-SD 3.41Å
216	I	85.9	Confident	81	Confident	21 Å²	21	51.9 Å²	51.9	11%	0.108	27%	0.267	C	S	.	.	H	α-helix	trans	-74.9	-39	178.5	-60.3	164.5	0	0	0	110.9	L176 F179 E180 F213 L214 V218 S219 V220	L176-I216 HydrophobicContact CB-CD1 3.53Å; L176-I216 HydrophobicContact CD1-CD1 4.23Å; L176-I216 HydrophobicContact CD2-CD1 3.71Å; L176-I216 HydrophobicContact CG-CD1 3.98Å; F179-I216 HydrophobicContact CD1-CG2 4.08Å; F179-I216 HydrophobicContact CE1-CG2 4.41Å; E180-I216 HydrophobicContact CB-CG2 3.85Å; E180-I216 HydrophobicContact CG-CG2 4.2Å; F213-I216 PolarHBondContact O-N 2.73Å; F213-I216 VanDerWaalsContact O-N 3.15Å; L214-I216 VanDerWaalsContact C-N 3.29Å; L214-I216 PolarHBondContact O-N 3.17Å; I216-V218 VanDerWaalsContact C-N 3.28Å; I216-V218 PolarHBondContact O-N 3.41Å; I216-S219 WeakPolarHBondContact CA-OG 3.4Å; I216-S219 PolarHBondContact O-N 3.42Å; I216-S219 PolarHBondContact O-OG 3.49Å; I216-V220 HydrophobicContact CG2-CG2 4.33Å; I216-V220 WeakPolarHBondContact O-CB 3.5Å; I216-V220 VanDerWaalsContact O-CG2 3.31Å; I216-V220 WeakPolarHBondContact O-CG2 3.42Å; I216-V220 PolarHBondContact O-N 2.88Å
217	L	86.6	Confident	80.1	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-59.6	-42.3	171.3	-69.5	173.1	0	0	0	110.7	F179 I183 L193 A196 F197 V200 F213 L214 V220 Y221	F179-L217 HydrophobicContact CE1-CD2 3.89Å; F179-L217 HydrophobicContact CE1-CG 3.98Å; F179-L217 HydrophobicContact CZ-CD1 4.35Å; F179-L217 HydrophobicContact CZ-CD2 3.99Å; F179-L217 HydrophobicContact CZ-CG 4.1Å; I183-L217 HydrophobicContact CD1-CD2 3.77Å; L193-L217 HydrophobicContact CD2-CD2 3.91Å; A196-L217 HydrophobicContact CB-CD2 3.98Å; F197-L217 HydrophobicContact CB-CD1 4.42Å; F197-L217 HydrophobicContact CD2-CD1 4.39Å; V200-L217 HydrophobicContact CG2-CD1 4.44Å; F213-L217 PolarHBondContact O-N 2.93Å; L214-L217 HydrophobicContact CD2-CD1 4.32Å; L214-L217 PolarHBondContact O-N 3.39Å; L217-V220 PolarHBondContact O-N 2.8Å; L217-Y221 HydrophobicContact CB-CD2 4.46Å; L217-Y221 HydrophobicContact CB-CE2 4.43Å; L217-Y221 WeakPolarHBondContact O-CB 3.41Å; L217-Y221 WeakPolarHBondContact O-CD2 3.09Å; L217-Y221 PolarHBondContact O-N 3.08Å
218	V	85.5	Confident	79.3	Confident	11 Å²	11	54.5 Å²	54.5	7%	0.067	29%	0.286	C	S	.	.	H	α-helix	trans	-62.7	-45	174.5	170.5	0	0	0	0	112.3	L214 K215 I216 Y221 M222 V233 C236 L237 M240	L214-V218 WeakPolarHBondContact O-CG2 3.46Å; L214-V218 PolarHBondContact O-N 3.3Å; K215-V218 PolarHBondContact O-N 3Å; I216-V218 VanDerWaalsContact C-N 3.28Å; I216-V218 PolarHBondContact O-N 3.41Å; V218-Y221 PolarHBondContact O-N 3.48Å; V218-M222 HydrophobicContact CG1-CE 3.73Å; V218-M222 HydrophobicContact CG1-CG 4.24Å; V218-M222 HydrophobicContact CG1-SD 3.88Å; V218-M222 WeakPolarHBondContact O-CB 3.11Å; V218-M222 VanDerWaalsContact O-CG 3.31Å; V218-M222 WeakPolarHBondContact O-CG 2.92Å; V218-M222 PolarHBondContact O-N 2.95Å; V218-V233 HydrophobicContact CG1-CG1 4.25Å; V218-C236 HydrophobicContact CG2-CB 3.45Å; V218-C236 VanDerWaalsContact CG2-CB 3.45Å; V218-L237 HydrophobicContact CG1-CD2 4.24Å; V218-L237 HydrophobicContact CG2-CD2 4.21Å; V218-L237 HydrophobicContact CG2-CG 4.29Å; V218-M240 HydrophobicContact CG2-CE 3.78Å
219	S	84.1	Confident	78.6	Confident	44 Å²	44	49.1 Å²	49.1	31%	0.308	27%	0.266	S	S	.	.	H	α-helix	trans	-65.1	-41.3	177.9	60.6	0	0	0	0	112.5	K215 I216 M222 N223	K215-S219 PolarHBondContact O-N 3.43Å; I216-S219 WeakPolarHBondContact CA-OG 3.4Å; I216-S219 PolarHBondContact O-N 3.42Å; I216-S219 PolarHBondContact O-OG 3.49Å; S219-M222 PolarHBondContact O-N 3.48Å; S219-N223 VanDerWaalsContact O-CG 3.3Å; S219-N223 PolarHBondContact O-N 3.14Å; S219-N223 VanDerWaalsContact O-N 3.14Å; S219-N223 PolarHBondContact O-ND2 2.94Å; S219-N223 VanDerWaalsContact O-ND2 3.12Å
220	V	83.4	Confident	77.9	Confident	7 Å²	7	49.5 Å²	49.5	4%	0.042	27%	0.271	C	S	.	.	H	α-helix	trans	-65.6	-40.9	176.2	175	0	0	0	0	111.6	E180 I183 L193 I216 L217 N223 R224	E180-V220 HydrophobicContact CG-CG2 3.98Å; I183-V220 HydrophobicContact CG2-CG1 3.93Å; L193-V220 HydrophobicContact CD2-CG1 4.03Å; I216-V220 HydrophobicContact CG2-CG2 4.33Å; I216-V220 WeakPolarHBondContact O-CB 3.5Å; I216-V220 VanDerWaalsContact O-CG2 3.31Å; I216-V220 WeakPolarHBondContact O-CG2 3.42Å; I216-V220 PolarHBondContact O-N 2.88Å; L217-V220 PolarHBondContact O-N 2.8Å; V220-N223 PolarHBondContact O-N 3.46Å; V220-R224 WeakPolarHBondContact O-CG 3.43Å
221	Y	82.5	Confident	77.5	Confident	7 Å²	7	48.3 Å²	48.3	3%	0.027	27%	0.269	C	S	.	.	H	α-helix	trans	-67.4	-41.6	173.8	-78.3	-57.2	0	0	0	112.6	L193 L217 V218 N223 R224 D229 N232 V233	L193-Y221 HydrophobicContact CB-CE1 3.93Å; L193-Y221 HydrophobicContact CD1-CD1 3.94Å; L193-Y221 HydrophobicContact CD1-CE1 3.71Å; L193-Y221 HydrophobicContact CD2-CD1 4.29Å; L193-Y221 HydrophobicContact CD2-CE1 4Å; L193-Y221 HydrophobicContact CD2-CE2 4.3Å; L193-Y221 HydrophobicContact CG-CE1 4.09Å; L217-Y221 HydrophobicContact CB-CD2 4.46Å; L217-Y221 HydrophobicContact CB-CE2 4.43Å; L217-Y221 WeakPolarHBondContact O-CB 3.41Å; L217-Y221 WeakPolarHBondContact O-CD2 3.09Å; L217-Y221 PolarHBondContact O-N 3.08Å; V218-Y221 PolarHBondContact O-N 3.48Å; Y221-N223 PolarHBondContact O-N 3.01Å; Y221-R224 CarbonylContact O-C 3.59Å; Y221-R224 WeakPolarHBondContact O-CA 3.26Å; Y221-R224 PolarHBondContact O-N 2.86Å; Y221-R224 VanDerWaalsContact O-O 3.09Å; Y221-D229 HydrophobicContact CD1-CB 3.7Å; Y221-D229 HydrophobicContact CE1-CB 4.33Å; Y221-D229 HydrophobicContact CG-CB 4.44Å; Y221-N232 HydrophobicContact CD2-CB 4.27Å; Y221-N232 HydrophobicContact CE1-CB 4.02Å; Y221-N232 HydrophobicContact CE2-CB 3.62Å; Y221-N232 VanDerWaalsContact CZ-CB 3.46Å; Y221-V233 HydrophobicContact CD2-CG2 4.19Å; Y221-V233 HydrophobicContact CG-CG2 4.02Å
222	M	78.7	Confident	77.1	Confident	99 Å²	99	48.1 Å²	48.1	49%	0.488	27%	0.268	S	S	.	.	H	α-helix	trans	-61.9	-29.7	178	-78.2	-179.1	171.1	0	0	112.7	V218 S219 R224 V233 T249	V218-M222 HydrophobicContact CG1-CE 3.73Å; V218-M222 HydrophobicContact CG1-CG 4.24Å; V218-M222 HydrophobicContact CG1-SD 3.88Å; V218-M222 WeakPolarHBondContact O-CB 3.11Å; V218-M222 VanDerWaalsContact O-CG 3.31Å; V218-M222 WeakPolarHBondContact O-CG 2.92Å; V218-M222 PolarHBondContact O-N 2.95Å; S219-M222 PolarHBondContact O-N 3.48Å; M222-R224 PolarHBondContact O-N 3.28Å; M222-V233 HydrophobicContact CE-CG1 4.24Å; M222-T249 HydrophobicContact CE-CG2 3.57Å
223	N	80	Confident	76.7	Confident	131 Å²	131	44 Å²	44	70%	0.701	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-11.1	172.3	-71	-32.5	0	0	0	113.7	S219 V220 Y221	S219-N223 VanDerWaalsContact O-CG 3.3Å; S219-N223 PolarHBondContact O-N 3.14Å; S219-N223 VanDerWaalsContact O-N 3.14Å; S219-N223 PolarHBondContact O-ND2 2.94Å; S219-N223 VanDerWaalsContact O-ND2 3.12Å; V220-N223 PolarHBondContact O-N 3.46Å; Y221-N223 PolarHBondContact O-N 3.01Å
224	R	67.8	Low	76.1	Confident	49 Å²	49	44.2 Å²	44.2	19%	0.185	26%	0.255	C	S	.	.	S	Bend	trans	-111.4	99.8	-179.2	-61.4	175.5	94.5	-106.1	3.3	109.9	Q189 V220 Y221 M222 L226 D229	Q189-R224 VanDerWaalsContact OE1-NH2 3.14Å; V220-R224 WeakPolarHBondContact O-CG 3.43Å; Y221-R224 CarbonylContact O-C 3.59Å; Y221-R224 WeakPolarHBondContact O-CA 3.26Å; Y221-R224 PolarHBondContact O-N 2.86Å; Y221-R224 VanDerWaalsContact O-O 3.09Å; M222-R224 PolarHBondContact O-N 3.28Å; R224-L226 HydrophobicContact CB-CD1 4.31Å; R224-L226 PolarHBondContact O-N 3.22Å; R224-D229 IonicContact CZ-OD2 2.74Å; R224-D229 IonicContact NH1-OD1 3.54Å; R224-D229 IonicContact NH1-OD2 3.08Å; R224-D229 PolarHBondContact NH1-OD2 3.1Å
225	A	59.7	Low	75.7	Confident	106 Å²	106	45.6 Å²	45.6	88%	0.876	26%	0.261	S	S	*	.			trans	-74	41.8	-172.6	0	0	0	0	0	115.6
226	L	64	Low	75.4	Confident	83 Å²	83	39.1 Å²	39.1	44%	0.435	23%	0.233	S	C	.	.			trans	-97.1	133.7	174.3	-69.6	94.8	0	0	0	111.1	R224 S228 D229	R224-L226 HydrophobicContact CB-CD1 4.31Å; R224-L226 PolarHBondContact O-N 3.22Å; L226-S228 WeakPolarHBondContact CB-OG 3.42Å; L226-S228 PolarHBondContact O-N 3.3Å; L226-S228 VanDerWaalsContact O-N 3.13Å; L226-D229 PolarHBondContact O-N 2.94Å
227	P	56.9	Low	75.2	Confident	79 Å²	79	38.2 Å²	38.2	51%	0.513	23%	0.229	S	C	.	.	H	α-helix	trans	-59.9	-23.4	177.6	-26.5	35.5	0	0	0	115	D229	P227-D229 VanDerWaalsContact C-N 3.28Å; P227-D229 PolarHBondContact O-N 3.37Å
228	S	62.1	Low	75	Confident	57 Å²	57	39.2 Å²	39.2	40%	0.399	24%	0.235	S	C	.	.	H	α-helix	trans	-60.9	-36.6	172.5	48.5	0	0	0	0	113	L226 A230 V231	L226-S228 WeakPolarHBondContact CB-OG 3.42Å; L226-S228 PolarHBondContact O-N 3.3Å; L226-S228 VanDerWaalsContact O-N 3.13Å; S228-A230 VanDerWaalsContact C-N 3.32Å; S228-A230 PolarHBondContact O-N 2.97Å; S228-V231 PolarHBondContact O-N 2.97Å
229	D	66.7	Low	74.7	Confident	5 Å²	5	40.1 Å²	40.1	3%	0.027	24%	0.239	C	C	.	.	H	α-helix	trans	-78.3	-26.2	-168.1	-68.3	21.3	0	0	0	110	Y221 R224 L226 P227 V231 N232 V233	Y221-D229 HydrophobicContact CD1-CB 3.7Å; Y221-D229 HydrophobicContact CE1-CB 4.33Å; Y221-D229 HydrophobicContact CG-CB 4.44Å; R224-D229 IonicContact CZ-OD2 2.74Å; R224-D229 IonicContact NH1-OD1 3.54Å; R224-D229 IonicContact NH1-OD2 3.08Å; R224-D229 PolarHBondContact NH1-OD2 3.1Å; L226-D229 PolarHBondContact O-N 2.94Å; P227-D229 VanDerWaalsContact C-N 3.28Å; P227-D229 PolarHBondContact O-N 3.37Å; D229-V231 VanDerWaalsContact C-N 3.28Å; D229-V231 PolarHBondContact O-N 3.06Å; D229-N232 PolarHBondContact O-N 3.43Å; D229-N232 VanDerWaalsContact O-N 3.12Å; D229-V233 WeakPolarHBondContact O-CG2 3.4Å; D229-V233 PolarHBondContact O-N 3.45Å
230	A	69.2	Low	74.6	Confident	19 Å²	19	39.2 Å²	39.2	16%	0.157	23%	0.23	C	C	.	.	H	α-helix	trans	-59.5	-32.5	174.2	0	0	0	0	0	113.9	S228 V233 C234 L253 I267	S228-A230 VanDerWaalsContact C-N 3.32Å; S228-A230 PolarHBondContact O-N 2.97Å; A230-V233 PolarHBondContact O-N 2.71Å; A230-C234 PolarHBondContact O-N 3.06Å; A230-C234 PolarHBondContact O-SG 3Å; A230-L253 HydrophobicContact CB-CD1 4.15Å; A230-L253 HydrophobicContact CB-CD2 4.38Å; A230-I267 HydrophobicContact CB-CD1 4.04Å
231	V	76.5	Confident	74.5	Confident	28 Å²	28	42.6 Å²	42.6	17%	0.17	25%	0.248	C	C	.	.	H	α-helix	trans	-67.3	-43.2	175.5	-178.9	0	0	0	0	110.4	S228 D229 C234 Q235 T263 I267	S228-V231 PolarHBondContact O-N 2.97Å; D229-V231 VanDerWaalsContact C-N 3.28Å; D229-V231 PolarHBondContact O-N 3.06Å; V231-C234 PolarHBondContact O-N 2.7Å; V231-Q235 WeakPolarHBondContact O-CG 3.33Å; V231-Q235 PolarHBondContact O-N 2.91Å; V231-Q235 VanDerWaalsContact O-N 3.08Å; V231-T263 HydrophobicContact CG2-CG2 4.44Å; V231-I267 HydrophobicContact CG2-CD1 4.38Å; V231-I267 HydrophobicContact CG2-CG1 4.03Å
232	N	78.1	Confident	74.6	Confident	34 Å²	34	45 Å²	45	18%	0.182	26%	0.261	C	S	.	.	H	α-helix	trans	-68.3	-39.5	177	-53	-45.5	0	0	0	111.2	Y221 D229 C234 Q235 C236	Y221-N232 HydrophobicContact CD2-CB 4.27Å; Y221-N232 HydrophobicContact CE1-CB 4.02Å; Y221-N232 HydrophobicContact CE2-CB 3.62Å; Y221-N232 VanDerWaalsContact CZ-CB 3.46Å; D229-N232 PolarHBondContact O-N 3.43Å; D229-N232 VanDerWaalsContact O-N 3.12Å; N232-C234 PolarHBondContact O-N 3.12Å; N232-Q235 PolarHBondContact O-N 3.38Å; N232-C236 PolarHBondContact O-N 3.47Å; N232-C236 PolarHBondContact O-SG 2.94Å
233	V	80.1	Confident	74.9	Confident	6 Å²	6	41 Å²	41	4%	0.036	24%	0.242	C	C	.	.	H	α-helix	trans	-55.4	-51.1	172.5	167.9	0	0	0	0	110.7	V218 Y221 M222 D229 A230 Q235 C236 L237 T249	V218-V233 HydrophobicContact CG1-CG1 4.25Å; Y221-V233 HydrophobicContact CD2-CG2 4.19Å; Y221-V233 HydrophobicContact CG-CG2 4.02Å; M222-V233 HydrophobicContact CE-CG1 4.24Å; D229-V233 WeakPolarHBondContact O-CG2 3.4Å; D229-V233 PolarHBondContact O-N 3.45Å; A230-V233 PolarHBondContact O-N 2.71Å; V233-Q235 VanDerWaalsContact C-N 3.32Å; V233-Q235 PolarHBondContact O-N 2.86Å; V233-C236 WeakPolarHBondContact O-CB 3.38Å; V233-C236 PolarHBondContact O-N 2.84Å; V233-C236 VanDerWaalsContact O-N 3.15Å; V233-L237 HydrophobicContact CG1-CD1 3.68Å; V233-L237 HydrophobicContact CG1-CG 4.16Å; V233-L237 VanDerWaalsContact O-CG 3.29Å; V233-L237 WeakPolarHBondContact O-CG 3.33Å; V233-L237 PolarHBondContact O-N 3Å; V233-T249 HydrophobicContact CG1-CG2 4.23Å
234	C	76.5	Confident	75.3	Confident	5 Å²	5	39 Å²	39	3%	0.034	23%	0.229	C	C	.	.	H	α-helix	trans	-65.5	-35.3	-178.5	-64.3	0	0	0	0	112.4	A230 V231 N232 L237 V238 I267 L271	A230-C234 PolarHBondContact O-N 3.06Å; A230-C234 PolarHBondContact O-SG 3Å; V231-C234 PolarHBondContact O-N 2.7Å; N232-C234 PolarHBondContact O-N 3.12Å; C234-L237 PolarHBondContact O-N 2.93Å; C234-V238 WeakPolarHBondContact O-CG2 3.18Å; C234-V238 PolarHBondContact O-N 2.81Å; C234-I267 HydrophobicContact CB-CG2 3.73Å; C234-I267 VanDerWaalsContact SG-CG2 3.53Å; C234-L271 HydrophobicContact CB-CD2 4.37Å
235	Q	77.6	Confident	76.1	Confident	30 Å²	30	37.7 Å²	37.7	14%	0.14	23%	0.228	C	C	.	.	H	α-helix	trans	-63	-44.6	171.4	-70.9	174.4	13.7	0	0	111.8	F197 V231 N232 V233 L237 L239	F197-Q235 HydrophobicContact CZ-CB 4.16Å; V231-Q235 WeakPolarHBondContact O-CG 3.33Å; V231-Q235 PolarHBondContact O-N 2.91Å; V231-Q235 VanDerWaalsContact O-N 3.08Å; N232-Q235 PolarHBondContact O-N 3.38Å; V233-Q235 VanDerWaalsContact C-N 3.32Å; V233-Q235 PolarHBondContact O-N 2.86Å; Q235-L237 PolarHBondContact O-N 2.91Å; Q235-L239 WeakPolarHBondContact O-CD1 3.43Å; Q235-L239 VanDerWaalsContact O-CG 3.27Å; Q235-L239 WeakPolarHBondContact O-CG 3.49Å; Q235-L239 PolarHBondContact O-N 2.96Å; Q235-L239 VanDerWaalsContact O-N 3.15Å
236	C	81.1	Confident	77.3	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61	-41.2	173.3	-67.1	0	0	0	0	112.6	F197 L214 V218 N232 V233 L239 M240	F197-C236 VanDerWaalsContact CE2-SG 3.51Å; L214-C236 HydrophobicContact CD2-CB 4.13Å; V218-C236 HydrophobicContact CG2-CB 3.45Å; V218-C236 VanDerWaalsContact CG2-CB 3.45Å; N232-C236 PolarHBondContact O-N 3.47Å; N232-C236 PolarHBondContact O-SG 2.94Å; V233-C236 WeakPolarHBondContact O-CB 3.38Å; V233-C236 PolarHBondContact O-N 2.84Å; V233-C236 VanDerWaalsContact O-N 3.15Å; C236-L239 PolarHBondContact O-N 2.85Å; C236-M240 WeakPolarHBondContact O-CG 3.49Å; C236-M240 PolarHBondContact O-N 3.32Å
237	L	82.5	Confident	78.3	Confident	3 Å²	3	28.9 Å²	28.9	2%	0.016	17%	0.168	C	C	.	.	H	α-helix	trans	-67.3	-40.1	-179.4	-69.6	172.3	0	0	0	112.6	V218 V233 C234 Q235 M240 D241 D242 A245 T246 T249	V218-L237 HydrophobicContact CG1-CD2 4.24Å; V218-L237 HydrophobicContact CG2-CD2 4.21Å; V218-L237 HydrophobicContact CG2-CG 4.29Å; V233-L237 HydrophobicContact CG1-CD1 3.68Å; V233-L237 HydrophobicContact CG1-CG 4.16Å; V233-L237 VanDerWaalsContact O-CG 3.29Å; V233-L237 WeakPolarHBondContact O-CG 3.33Å; V233-L237 PolarHBondContact O-N 3Å; C234-L237 PolarHBondContact O-N 2.93Å; Q235-L237 PolarHBondContact O-N 2.91Å; L237-M240 HydrophobicContact CD2-CE 3.84Å; L237-M240 PolarHBondContact O-N 3.21Å; L237-D241 PolarHBondContact O-N 3.49Å; L237-D242 HydrophobicContact CD2-CB 4.32Å; L237-D242 PolarHBondContact O-N 3.3Å; L237-A245 HydrophobicContact CD1-CB 4.16Å; L237-A245 HydrophobicContact CD2-CB 3.69Å; L237-T246 WeakPolarHBondContact CB-OG1 3.42Å; L237-T249 HydrophobicContact CD1-CG2 4.49Å
238	V	81.9	Confident	79.7	Confident	21 Å²	21	30 Å²	30	13%	0.127	17%	0.169	C	C	.	.	H	α-helix	trans	-60.5	-44.9	171.7	169.6	0	0	0	0	111.1	C234 M240 D241 L271 A275 F279	C234-V238 WeakPolarHBondContact O-CG2 3.18Å; C234-V238 PolarHBondContact O-N 2.81Å; V238-M240 PolarHBondContact O-N 2.75Å; V238-M240 VanDerWaalsContact O-N 3.14Å; V238-D241 PolarHBondContact O-N 3.49Å; V238-D241 VanDerWaalsContact O-N 3.15Å; V238-L271 HydrophobicContact CG2-CD2 3.25Å; V238-A275 HydrophobicContact CG1-CB 4.02Å; V238-A275 HydrophobicContact CG2-CB 4.22Å; V238-F279 HydrophobicContact CG2-CE1 3.75Å; V238-F279 HydrophobicContact CG2-CZ 3.97Å
239	L	79.8	Confident	80.7	Confident	30 Å²	30	28.3 Å²	28.3	16%	0.157	16%	0.157	C	C	.	.	H	α-helix	trans	-64.9	-15.1	179.1	-71.9	163.3	0	0	0	113.9	F197 L201 N211 L214 Q235 C236	F197-L239 HydrophobicContact CE2-CD1 3.86Å; F197-L239 HydrophobicContact CZ-CD1 3.95Å; L201-L239 HydrophobicContact CD1-CD1 4.43Å; L201-L239 HydrophobicContact CD2-CD1 3.83Å; L201-L239 HydrophobicContact CD2-CD2 4.15Å; N211-L239 PolarHBondContact OD1-O 3.19Å; L214-L239 HydrophobicContact CD1-CB 3.71Å; L214-L239 HydrophobicContact CD2-CD1 4.49Å; Q235-L239 WeakPolarHBondContact O-CD1 3.43Å; Q235-L239 VanDerWaalsContact O-CG 3.27Å; Q235-L239 WeakPolarHBondContact O-CG 3.49Å; Q235-L239 PolarHBondContact O-N 2.96Å; Q235-L239 VanDerWaalsContact O-N 3.15Å; C236-L239 PolarHBondContact O-N 2.85Å
240	M	80.8	Confident	81.5	Confident	24 Å²	24	28.1 Å²	28.1	12%	0.118	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-2.8	177.2	-67.3	-172.7	-62.1	0	0	114.4	N211 L214 K215 V218 C236 L237 V238 D242	N211-M240 HydrophobicContact CB-CG 4.33Å; L214-M240 HydrophobicContact CB-CE 4.35Å; L214-M240 HydrophobicContact CB-CG 3.69Å; L214-M240 HydrophobicContact CB-SD 3.44Å; L214-M240 WeakPolarHBondContact CB-SD 3.46Å; L214-M240 HydrophobicContact CD1-CG 3.88Å; L214-M240 HydrophobicContact CG-CG 4.45Å; K215-M240 HydrophobicContact CB-SD 4.28Å; K215-M240 HydrophobicContact CG-CE 4.23Å; K215-M240 HydrophobicContact CG-SD 3.43Å; K215-M240 WeakPolarHBondContact CG-SD 3.48Å; K215-M240 PolarHBondContact N-SD 2.94Å; K215-M240 VanDerWaalsContact N-SD 3.41Å; V218-M240 HydrophobicContact CG2-CE 3.78Å; C236-M240 WeakPolarHBondContact O-CG 3.49Å; C236-M240 PolarHBondContact O-N 3.32Å; L237-M240 HydrophobicContact CD2-CE 3.84Å; L237-M240 PolarHBondContact O-N 3.21Å; V238-M240 PolarHBondContact O-N 2.75Å; V238-M240 VanDerWaalsContact O-N 3.14Å; M240-D242 PolarHBondContact O-N 2.92Å
241	D	81.9	Confident	82.2	Confident	78 Å²	78	27.6 Å²	27.6	42%	0.417	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	41.4	-172.1	-162.3	42.6	0	0	0	114	L237 V238 P243 F279 R282	L237-D241 PolarHBondContact O-N 3.49Å; V238-D241 PolarHBondContact O-N 3.49Å; V238-D241 VanDerWaalsContact O-N 3.15Å; D241-P243 WeakPolarHBondContact O-CD 3.34Å; D241-F279 WeakPolarHBondContact OD1-CD2 3.37Å; D241-R282 IonicContact OD2-NH1 2.72Å; D241-R282 PolarHBondContact OD2-NH1 3.35Å
242	D	85.4	Confident	82.5	Confident	57 Å²	57	31.5 Å²	31.5	31%	0.305	17%	0.166	S	C	.	.			trans	-101.6	94.4	173.2	-167.3	-28	0	0	0	112.8	L237 M240 Q244 A245 T246	L237-D242 HydrophobicContact CD2-CB 4.32Å; L237-D242 PolarHBondContact O-N 3.3Å; M240-D242 PolarHBondContact O-N 2.92Å; D242-Q244 PolarHBondContact OD1-N 3.05Å; D242-A245 PolarHBondContact OD1-N 3.46Å; D242-T246 WeakPolarHBondContact O-CB 3.34Å; D242-T246 PolarHBondContact O-OG1 2.96Å
243	P	85.1	Confident	82.6	Confident	15 Å²	15	30.4 Å²	30.4	10%	0.097	16%	0.16	C	C	.	.	H	α-helix	trans	-79.5	-14.8	178.6	31.8	-37	0	0	0	113.9	D241 A247 F279 R282 V283	D241-P243 WeakPolarHBondContact O-CD 3.34Å; P243-A247 PolarHBondContact O-N 2.87Å; P243-F279 HydrophobicContact CB-CD2 4.11Å; P243-F279 HydrophobicContact CB-CE2 3.99Å; P243-R282 HydrophobicContact CB-CB 3.71Å; P243-R282 HydrophobicContact CG-CB 3.84Å; P243-V283 HydrophobicContact CB-CG2 3.64Å
244	Q	86.8	Confident	82.7	Confident	91 Å²	91	30.2 Å²	30.2	43%	0.425	16%	0.159	S	C	.	.	H	α-helix	trans	-77.9	-54.4	179.9	-59.8	-48.6	-80.1	0	0	109.8	D242 T246 A247 D248 S286	D242-Q244 PolarHBondContact OD1-N 3.05Å; Q244-T246 PolarHBondContact O-N 3.21Å; Q244-T246 VanDerWaalsContact O-N 3.16Å; Q244-A247 WeakPolarHBondContact O-CB 3.4Å; Q244-A247 PolarHBondContact O-N 3.1Å; Q244-D248 PolarHBondContact O-N 3.31Å; Q244-S286 PolarHBondContact NE2-OG 3.42Å
245	A	85.2	Confident	82.9	Confident	20 Å²	20	32.7 Å²	32.7	17%	0.165	17%	0.172	C	C	.	.	H	α-helix	trans	-61.3	-27.5	176.9	0	0	0	0	0	112.4	L237 D242 T249	L237-A245 HydrophobicContact CD1-CB 4.16Å; L237-A245 HydrophobicContact CD2-CB 3.69Å; D242-A245 PolarHBondContact OD1-N 3.46Å; A245-T249 WeakPolarHBondContact O-CB 3.28Å; A245-T249 WeakPolarHBondContact O-CG2 3.44Å; A245-T249 PolarHBondContact O-N 3.11Å; A245-T249 PolarHBondContact O-OG1 3.36Å
246	T	85	Confident	82.9	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-70.3	-40	172.4	-56.2	0	0	0	0	112.1	L237 D242 Q244 T249 L250 L271 F279 V283	L237-T246 WeakPolarHBondContact CB-OG1 3.42Å; D242-T246 WeakPolarHBondContact O-CB 3.34Å; D242-T246 PolarHBondContact O-OG1 2.96Å; Q244-T246 PolarHBondContact O-N 3.21Å; Q244-T246 VanDerWaalsContact O-N 3.16Å; T246-T249 WeakPolarHBondContact CA-OG1 3.49Å; T246-T249 PolarHBondContact O-OG1 2.96Å; T246-T249 VanDerWaalsContact O-OG1 3.12Å; T246-L250 HydrophobicContact CG2-CD1 4.3Å; T246-L250 WeakPolarHBondContact O-CB 3.28Å; T246-L250 VanDerWaalsContact O-CG 3.28Å; T246-L250 WeakPolarHBondContact O-CG 3.3Å; T246-L250 PolarHBondContact O-N 3.37Å; T246-L250 VanDerWaalsContact O-N 3.15Å; T246-L271 HydrophobicContact CG2-CD1 3.82Å; T246-L271 HydrophobicContact CG2-CD2 4.15Å; T246-F279 HydrophobicContact CG2-CE1 4.18Å; T246-F279 HydrophobicContact CG2-CZ 4.16Å; T246-F279 WeakPolarHBondContact OG1-CZ 3.28Å; T246-V283 HydrophobicContact CG2-CG1 4.33Å; T246-V283 HydrophobicContact CG2-CG2 3.99Å
247	A	85.6	Confident	82.6	Confident	5 Å²	5	39 Å²	39	4%	0.041	21%	0.206	C	C	.	.	H	α-helix	trans	-67.8	-42	174	0	0	0	0	0	112	P243 Q244 L250 E251	P243-A247 PolarHBondContact O-N 2.87Å; Q244-A247 WeakPolarHBondContact O-CB 3.4Å; Q244-A247 PolarHBondContact O-N 3.1Å; A247-L250 PolarHBondContact O-N 3.25Å; A247-E251 PolarHBondContact O-N 3.4Å
248	D	85.7	Confident	82.3	Confident	101 Å²	101	43.6 Å²	43.6	54%	0.54	23%	0.228	S	C	.	.	H	α-helix	trans	-63.7	-41.8	179.3	-68.2	-27.9	0	0	0	112.2	Q244 E251 H252	Q244-D248 PolarHBondContact O-N 3.31Å; D248-E251 PolarHBondContact O-N 3.22Å; D248-H252 WeakPolarHBondContact O-CB 3.46Å; D248-H252 PolarHBondContact O-N 3.35Å
249	T	83.1	Confident	82	Confident	23 Å²	23	47.9 Å²	47.9	14%	0.141	25%	0.246	C	C	.	.	H	α-helix	trans	-68.5	-39	176.6	45.5	0	0	0	0	112.3	M222 V233 L237 A245 T246 H252 L253	M222-T249 HydrophobicContact CE-CG2 3.57Å; V233-T249 HydrophobicContact CG1-CG2 4.23Å; L237-T249 HydrophobicContact CD1-CG2 4.49Å; A245-T249 WeakPolarHBondContact O-CB 3.28Å; A245-T249 WeakPolarHBondContact O-CG2 3.44Å; A245-T249 PolarHBondContact O-N 3.11Å; A245-T249 PolarHBondContact O-OG1 3.36Å; T246-T249 WeakPolarHBondContact CA-OG1 3.49Å; T246-T249 PolarHBondContact O-OG1 2.96Å; T246-T249 VanDerWaalsContact O-OG1 3.12Å; T249-H252 PolarHBondContact O-N 3.44Å; T249-L253 WeakPolarHBondContact O-CG 3.27Å; T249-L253 PolarHBondContact O-N 2.88Å; T249-L253 VanDerWaalsContact O-N 3.11Å
250	L	83.7	Confident	81.9	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-64.6	-43.3	172.8	-75.6	170.8	0	0	0	112.4	T246 A247 H252 L253 L254 A264 I267 L271 V283 L374	T246-L250 HydrophobicContact CG2-CD1 4.3Å; T246-L250 WeakPolarHBondContact O-CB 3.28Å; T246-L250 VanDerWaalsContact O-CG 3.28Å; T246-L250 WeakPolarHBondContact O-CG 3.3Å; T246-L250 PolarHBondContact O-N 3.37Å; T246-L250 VanDerWaalsContact O-N 3.15Å; A247-L250 PolarHBondContact O-N 3.25Å; L250-H252 PolarHBondContact O-N 3.29Å; L250-L253 PolarHBondContact O-N 2.69Å; L250-L254 WeakPolarHBondContact O-CG 3.47Å; L250-L254 PolarHBondContact O-N 2.77Å; L250-A264 HydrophobicContact CD2-CB 4.16Å; L250-I267 HydrophobicContact CD2-CB 4.31Å; L250-I267 HydrophobicContact CD2-CG2 3.78Å; L250-L271 HydrophobicContact CD1-CD1 3.87Å; L250-V283 HydrophobicContact CD1-CG1 4.06Å; L250-L374 HydrophobicContact CB-CD2 4.33Å; L250-L374 HydrophobicContact CD1-CD2 4.4Å; L250-L374 HydrophobicContact CD2-CD1 4.48Å; L250-L374 HydrophobicContact CD2-CD2 4.21Å
251	E	84.3	Confident	82	Confident	8 Å²	8	45.6 Å²	45.6	4%	0.037	24%	0.235	C	C	.	.	H	α-helix	trans	-59.2	-47.5	174.5	-178.5	-171.5	146.9	0	0	111.2	A247 D248 L253 L254 L255 L287 S290 K292 L293	A247-E251 PolarHBondContact O-N 3.4Å; D248-E251 PolarHBondContact O-N 3.22Å; E251-L253 VanDerWaalsContact C-N 3.31Å; E251-L253 PolarHBondContact O-N 2.93Å; E251-L254 PolarHBondContact O-N 3.25Å; E251-L255 HydrophobicContact CG-CD1 3.75Å; E251-L255 HydrophobicContact CG-CG 4.28Å; E251-L255 WeakPolarHBondContact O-CG 3.37Å; E251-L255 PolarHBondContact O-N 3.12Å; E251-L287 HydrophobicContact CB-CD1 4.41Å; E251-S290 VanDerWaalsContact OE2-CB 3.25Å; E251-S290 WeakPolarHBondContact OE2-CB 3.26Å; E251-S290 PolarHBondContact OE2-OG 2.91Å; E251-K292 WeakPolarHBondContact OE1-CD 3.43Å; E251-K292 WeakPolarHBondContact OE1-CG 3.49Å; E251-K292 IonicContact OE1-NZ 2.59Å; E251-K292 PolarHBondContact OE1-NZ 2.95Å; E251-L293 HydrophobicContact CB-CD1 4.46Å; E251-L293 HydrophobicContact CG-CD1 4.1Å; E251-L293 HydrophobicContact CG-CG 4.38Å
252	H	82.3	Confident	82.1	Confident	110 Å²	110	42.5 Å²	42.5	51%	0.509	22%	0.219	S	C	.	.	H	α-helix	trans	-57.3	-44.2	179.4	-178.7	-129.6	0	0	0	111.8	D248 T249 L250 L255 Q256	D248-H252 WeakPolarHBondContact O-CB 3.46Å; D248-H252 PolarHBondContact O-N 3.35Å; T249-H252 PolarHBondContact O-N 3.44Å; L250-H252 PolarHBondContact O-N 3.29Å; H252-L255 PolarHBondContact O-N 3.18Å; H252-Q256 PolarHBondContact CE1-NE2 2.9Å; H252-Q256 PolarHBondContact NE2-NE2 3.44Å; H252-Q256 WeakPolarHBondContact O-CG 3.31Å; H252-Q256 PolarHBondContact O-N 2.88Å
253	L	80.9	Confident	82	Confident	11 Å²	11	40.4 Å²	40.4	6%	0.058	21%	0.209	C	C	.	.	H	α-helix	trans	-65.6	-41.6	176.1	-69.9	170.8	0	0	0	113.1	A230 T249 L250 E251 L255 Q256 A260 A264 I267	A230-L253 HydrophobicContact CB-CD1 4.15Å; A230-L253 HydrophobicContact CB-CD2 4.38Å; T249-L253 WeakPolarHBondContact O-CG 3.27Å; T249-L253 PolarHBondContact O-N 2.88Å; T249-L253 VanDerWaalsContact O-N 3.11Å; L250-L253 PolarHBondContact O-N 2.69Å; E251-L253 VanDerWaalsContact C-N 3.31Å; E251-L253 PolarHBondContact O-N 2.93Å; L253-L255 VanDerWaalsContact C-N 3.29Å; L253-L255 PolarHBondContact O-N 3.41Å; L253-Q256 PolarHBondContact O-N 3.49Å; L253-A260 HydrophobicContact CB-CB 4.43Å; L253-A260 HydrophobicContact CD2-CB 4.1Å; L253-A260 CarbonylContact O-C 3.56Å; L253-A260 WeakPolarHBondContact O-CB 3.31Å; L253-A264 HydrophobicContact CB-CB 3.99Å; L253-A264 HydrophobicContact CD1-CB 4.34Å; L253-I267 HydrophobicContact CD1-CD1 3.56Å
254	L	82.1	Confident	82	Confident	3 Å²	3	39.7 Å²	39.7	2%	0.016	20%	0.204	C	C	.	.	H	α-helix	trans	-62.1	-36.3	178	-75.4	175.2	0	0	0	112.9	L250 E251 A261 A264 R370 L371 L374	L250-L254 WeakPolarHBondContact O-CG 3.47Å; L250-L254 PolarHBondContact O-N 2.77Å; E251-L254 PolarHBondContact O-N 3.25Å; L254-A261 HydrophobicContact CD2-CB 4.35Å; L254-A264 HydrophobicContact CD2-CB 4.36Å; L254-R370 HydrophobicContact CD2-CB 4.09Å; L254-R370 PolarHBondContact O-NH1 3.12Å; L254-R370 VanDerWaalsContact O-NH1 3.13Å; L254-L371 HydrophobicContact CD1-CD1 4.08Å; L254-L374 HydrophobicContact CD1-CD2 3.78Å; L254-L374 HydrophobicContact CD2-CD2 4.41Å; L254-L374 HydrophobicContact CG-CD2 4.29Å
255	L	80.2	Confident	82.1	Confident	57 Å²	57	35.5 Å²	35.5	30%	0.298	19%	0.185	S	C	.	.	H	α-helix	trans	-80.3	-27.7	-178.1	-68.4	174.7	0	0	0	113.8	E251 H252 L253 K292 I367	E251-L255 HydrophobicContact CG-CD1 3.75Å; E251-L255 HydrophobicContact CG-CG 4.28Å; E251-L255 WeakPolarHBondContact O-CG 3.37Å; E251-L255 PolarHBondContact O-N 3.12Å; H252-L255 PolarHBondContact O-N 3.18Å; L253-L255 VanDerWaalsContact C-N 3.29Å; L253-L255 PolarHBondContact O-N 3.41Å; L255-K292 HydrophobicContact CD1-CD 3.97Å; L255-I367 HydrophobicContact CD2-CD1 4.1Å
256	Q	78.1	Confident	82.1	Confident	115 Å²	115	34.8 Å²	34.8	54%	0.537	18%	0.178	S	C	.	.	H	α-helix	trans	-68.8	-61.1	-173.4	-87.8	-174.3	-7.9	0	0	114.2	H252 L253 A260	H252-Q256 PolarHBondContact CE1-NE2 2.9Å; H252-Q256 PolarHBondContact NE2-NE2 3.44Å; H252-Q256 WeakPolarHBondContact O-CG 3.31Å; H252-Q256 PolarHBondContact O-N 2.88Å; L253-Q256 PolarHBondContact O-N 3.49Å; Q256-A260 HydrophobicContact CB-CB 4.04Å
257	S	74.8	Confident	82.1	Confident	46 Å²	46	34.9 Å²	34.9	32%	0.322	18%	0.178	S	C	.	.			trans	-158	167.3	-171.1	84.1	0	0	0	0	112.3	E259 A260 A261	S257-E259 VanDerWaalsContact C-N 3.28Å; S257-E259 PolarHBondContact O-N 3.31Å; S257-E259 PolarHBondContact OG-N 2.98Å; S257-A260 PolarHBondContact O-N 3.47Å; S257-A260 WeakPolarHBondContact OG-CB 3.48Å; S257-A260 PolarHBondContact OG-N 3.37Å; S257-A261 PolarHBondContact O-N 3.44Å; S257-A261 VanDerWaalsContact O-N 3.09Å
258	Q	74.9	Confident	82.2	Confident	100 Å²	100	34.6 Å²	34.6	47%	0.467	18%	0.176	S	C	.	.	H	α-helix	trans	-62.2	-37	173.8	-173.2	-179.6	-87.5	0	0	111.9	A261 V262 K844	Q258-A261 PolarHBondContact O-N 3.01Å; Q258-V262 WeakPolarHBondContact O-CG2 3.28Å; Q258-V262 PolarHBondContact O-N 3.43Å; Q258-K844 HydrophobicContact CG-CD 4.18Å
259	E	75.8	Confident	82.3	Confident	111 Å²	111	30.2 Å²	30.2	52%	0.519	15%	0.152	S	C	.	.	H	α-helix	trans	-71.9	-42.7	-179.7	-60.4	179.3	140.8	0	0	110.9	S257 A261 V262 T263 Q994	S257-E259 VanDerWaalsContact C-N 3.28Å; S257-E259 PolarHBondContact O-N 3.31Å; S257-E259 PolarHBondContact OG-N 2.98Å; E259-A261 VanDerWaalsContact C-N 3.26Å; E259-A261 PolarHBondContact O-N 3.41Å; E259-V262 PolarHBondContact O-N 3.12Å; E259-T263 PolarHBondContact O-N 3.27Å; E259-T263 PolarHBondContact O-OG1 3.48Å; E259-Q994 PolarHBondContact OE1-NE2 2.94Å
260	A	78.6	Confident	82.4	Confident	4 Å²	4	29.6 Å²	29.6	3%	0.033	15%	0.148	C	C	.	.	H	α-helix	trans	-61.4	-33.5	174.6	0	0	0	0	0	112.2	L253 Q256 S257 T263 A264	L253-A260 HydrophobicContact CB-CB 4.43Å; L253-A260 HydrophobicContact CD2-CB 4.1Å; L253-A260 CarbonylContact O-C 3.56Å; L253-A260 WeakPolarHBondContact O-CB 3.31Å; Q256-A260 HydrophobicContact CB-CB 4.04Å; S257-A260 PolarHBondContact O-N 3.47Å; S257-A260 WeakPolarHBondContact OG-CB 3.48Å; S257-A260 PolarHBondContact OG-N 3.37Å; A260-T263 WeakPolarHBondContact O-CB 3.43Å; A260-T263 PolarHBondContact O-N 2.86Å; A260-A264 WeakPolarHBondContact O-CB 3.25Å; A260-A264 PolarHBondContact O-N 3.34Å
261	A	82	Confident	82.5	Confident	2 Å²	2	29.9 Å²	29.9	2%	0.017	15%	0.149	C	C	.	.	H	α-helix	trans	-66.3	-35	171.6	0	0	0	0	0	113.1	L254 S257 Q258 E259 A264 Y265 R370	L254-A261 HydrophobicContact CD2-CB 4.35Å; S257-A261 PolarHBondContact O-N 3.44Å; S257-A261 VanDerWaalsContact O-N 3.09Å; Q258-A261 PolarHBondContact O-N 3.01Å; E259-A261 VanDerWaalsContact C-N 3.26Å; E259-A261 PolarHBondContact O-N 3.41Å; A261-A264 WeakPolarHBondContact O-CB 3.33Å; A261-A264 PolarHBondContact O-N 2.9Å; A261-Y265 WeakPolarHBondContact O-CD1 3.45Å; A261-Y265 VanDerWaalsContact O-CG 3.32Å; A261-Y265 PolarHBondContact O-N 3.39Å; A261-R370 HydrophobicContact CB-CG 4.36Å
262	V	84.2	Confident	82.6	Confident	13 Å²	13	32 Å²	32	8%	0.079	16%	0.157	C	C	.	.	H	α-helix	trans	-70.5	-36.5	173.5	-178.7	0	0	0	0	110.9	Q258 E259 A264 Y265 Q266 K844 L982 M992	Q258-V262 WeakPolarHBondContact O-CG2 3.28Å; Q258-V262 PolarHBondContact O-N 3.43Å; E259-V262 PolarHBondContact O-N 3.12Å; V262-A264 VanDerWaalsContact C-N 3.34Å; V262-Y265 PolarHBondContact O-N 2.8Å; V262-Q266 PolarHBondContact O-N 3.47Å; V262-K844 HydrophobicContact CG2-CG 4.28Å; V262-L982 HydrophobicContact CB-CD1 4.23Å; V262-L982 HydrophobicContact CG1-CD1 3.64Å; V262-M992 HydrophobicContact CG1-CB 3.8Å; V262-M992 HydrophobicContact CG1-CE 3.96Å; V262-M992 HydrophobicContact CG1-CG 4.38Å
263	T	83.6	Confident	82.7	Confident	13 Å²	13	28.8 Å²	28.8	8%	0.08	14%	0.143	C	C	.	.	H	α-helix	trans	-61.2	-41.4	168.1	-55.5	0	0	0	0	111.4	V231 E259 A260 Y265 Q266 I267	V231-T263 HydrophobicContact CG2-CG2 4.44Å; E259-T263 PolarHBondContact O-N 3.27Å; E259-T263 PolarHBondContact O-OG1 3.48Å; A260-T263 WeakPolarHBondContact O-CB 3.43Å; A260-T263 PolarHBondContact O-N 2.86Å; T263-Y265 VanDerWaalsContact C-N 3.33Å; T263-Y265 PolarHBondContact O-N 2.71Å; T263-Q266 PolarHBondContact O-N 3.4Å; T263-I267 HydrophobicContact CG2-CD1 4.04Å; T263-I267 WeakPolarHBondContact O-CG1 3.33Å; T263-I267 PolarHBondContact O-N 3.09Å
264	A	85.7	Confident	82.7	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-63.2	-34.8	175.1	0	0	0	0	0	112.6	L250 L253 L254 A260 A261 V262 I267 G268 L374	L250-A264 HydrophobicContact CD2-CB 4.16Å; L253-A264 HydrophobicContact CB-CB 3.99Å; L253-A264 HydrophobicContact CD1-CB 4.34Å; L254-A264 HydrophobicContact CD2-CB 4.36Å; A260-A264 WeakPolarHBondContact O-CB 3.25Å; A260-A264 PolarHBondContact O-N 3.34Å; A261-A264 WeakPolarHBondContact O-CB 3.33Å; A261-A264 PolarHBondContact O-N 2.9Å; V262-A264 VanDerWaalsContact C-N 3.34Å; A264-I267 PolarHBondContact O-N 3.4Å; A264-G268 PolarHBondContact O-N 3.48Å; A264-L374 WeakPolarHBondContact O-CD1 3.39Å
265	Y	87.5	Confident	82.6	Confident	4 Å²	4	30 Å²	30	2%	0.016	15%	0.152	C	C	.	.	H	α-helix	trans	-66.7	-43.7	171.4	-57.2	-25.4	0	0	0	112.1	A261 V262 T263 I267 G268 F269 R370 H373 L374 I377 L846 M992	A261-Y265 WeakPolarHBondContact O-CD1 3.45Å; A261-Y265 VanDerWaalsContact O-CG 3.32Å; A261-Y265 PolarHBondContact O-N 3.39Å; V262-Y265 PolarHBondContact O-N 2.8Å; T263-Y265 VanDerWaalsContact C-N 3.33Å; T263-Y265 PolarHBondContact O-N 2.71Å; Y265-I267 VanDerWaalsContact C-N 3.29Å; Y265-I267 PolarHBondContact O-N 3.41Å; Y265-G268 WeakPolarHBondContact O-CA 3.35Å; Y265-G268 PolarHBondContact O-N 2.82Å; Y265-F269 WeakPolarHBondContact O-CD2 3.13Å; Y265-F269 PolarHBondContact O-N 3.41Å; Y265-R370 WeakPolarHBondContact OH-CA 3.31Å; Y265-H373 HydrophobicContact CE1-CB 3.73Å; Y265-L374 HydrophobicContact CD1-CB 4.39Å; Y265-L374 HydrophobicContact CD1-CD1 4.5Å; Y265-L374 HydrophobicContact CE1-CB 4.4Å; Y265-I377 HydrophobicContact CD1-CD1 4.03Å; Y265-I377 HydrophobicContact CG-CD1 4.03Å; Y265-L846 HydrophobicContact CD2-CD2 4.13Å; Y265-L846 HydrophobicContact CG-CD2 4.48Å; Y265-M992 HydrophobicContact CD2-CE 4.02Å
266	Q	86	Confident	82.6	Confident	4 Å²	4	30 Å²	30	2%	0.019	15%	0.154	C	C	.	.	H	α-helix	trans	-60.8	-41.4	175	-176.3	65.3	71.1	0	0	111.2	V262 T263 G268 F269 D270 K983 I990 M992	V262-Q266 PolarHBondContact O-N 3.47Å; T263-Q266 PolarHBondContact O-N 3.4Å; Q266-G268 VanDerWaalsContact C-N 3.34Å; Q266-F269 PolarHBondContact O-N 2.97Å; Q266-D270 PolarHBondContact NE2-OD1 2.63Å; Q266-D270 WeakPolarHBondContact O-CB 3.2Å; Q266-D270 PolarHBondContact O-N 3.22Å; Q266-K983 HydrophobicContact CG-CB 4.33Å; Q266-K983 HydrophobicContact CG-CD 4.07Å; Q266-I990 PolarHBondContact NE2-O 3.47Å; Q266-I990 VanDerWaalsContact NE2-O 3.12Å; Q266-M992 HydrophobicContact CB-CB 4.2Å; Q266-M992 HydrophobicContact CB-CG 3.89Å
267	I	85.3	Confident	82.8	Confident	2 Å²	2	25.5 Å²	25.5	1%	0.01	13%	0.133	C	C	.	.	H	α-helix	trans	-61.3	-43.8	171.8	-70.2	166	0	0	0	110	A230 V231 C234 L250 L253 T263 A264 Y265 F269 D270 L271	A230-I267 HydrophobicContact CB-CD1 4.04Å; V231-I267 HydrophobicContact CG2-CD1 4.38Å; V231-I267 HydrophobicContact CG2-CG1 4.03Å; C234-I267 HydrophobicContact CB-CG2 3.73Å; C234-I267 VanDerWaalsContact SG-CG2 3.53Å; L250-I267 HydrophobicContact CD2-CB 4.31Å; L250-I267 HydrophobicContact CD2-CG2 3.78Å; L253-I267 HydrophobicContact CD1-CD1 3.56Å; T263-I267 HydrophobicContact CG2-CD1 4.04Å; T263-I267 WeakPolarHBondContact O-CG1 3.33Å; T263-I267 PolarHBondContact O-N 3.09Å; A264-I267 PolarHBondContact O-N 3.4Å; Y265-I267 VanDerWaalsContact C-N 3.29Å; Y265-I267 PolarHBondContact O-N 3.41Å; I267-F269 PolarHBondContact O-N 3.2Å; I267-D270 CarbonylContact O-C 3.57Å; I267-D270 PolarHBondContact O-N 2.93Å; I267-D270 VanDerWaalsContact O-N 3.17Å; I267-L271 HydrophobicContact CG2-CD1 3.86Å; I267-L271 HydrophobicContact CG2-CG 3.96Å; I267-L271 WeakPolarHBondContact O-CB 3.36Å; I267-L271 VanDerWaalsContact O-CG 3.24Å; I267-L271 WeakPolarHBondContact O-CG 3.42Å; I267-L271 PolarHBondContact O-N 2.88Å
268	G	87.3	Confident	83.1	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-56.2	-44.3	175.3	0	0	0	0	0	113.6	A264 Y265 Q266 L271 Y272 I377	A264-G268 PolarHBondContact O-N 3.48Å; Y265-G268 WeakPolarHBondContact O-CA 3.35Å; Y265-G268 PolarHBondContact O-N 2.82Å; Q266-G268 VanDerWaalsContact C-N 3.34Å; G268-L271 PolarHBondContact O-N 3.45Å; G268-Y272 WeakPolarHBondContact O-CB 3.48Å; G268-Y272 PolarHBondContact O-N 3.35Å; G268-I377 VanDerWaalsContact C-CG2 3.41Å
269	F	88.2	Confident	83.6	Confident	9 Å²	9	20.2 Å²	20.2	4%	0.039	11%	0.105	C	C	.	.	H	α-helix	trans	-65.2	-41.7	174.9	-72.7	-64.6	0	0	0	112.2	Y265 Q266 I267 E273 I377 V383 L842 L846 I990 M992	Y265-F269 WeakPolarHBondContact O-CD2 3.13Å; Y265-F269 PolarHBondContact O-N 3.41Å; Q266-F269 PolarHBondContact O-N 2.97Å; I267-F269 PolarHBondContact O-N 3.2Å; F269-E273 PolarHBondContact O-N 3.24Å; F269-I377 HydrophobicContact CD1-CG2 3.67Å; F269-I377 HydrophobicContact CD2-CD1 4.29Å; F269-I377 HydrophobicContact CD2-CG2 4.26Å; F269-I377 HydrophobicContact CE1-CB 4.48Å; F269-I377 HydrophobicContact CE1-CD1 4.45Å; F269-I377 HydrophobicContact CE1-CG1 3.98Å; F269-I377 HydrophobicContact CE1-CG2 3.81Å; F269-I377 HydrophobicContact CE2-CD1 3.63Å; F269-I377 HydrophobicContact CE2-CG1 4.07Å; F269-I377 HydrophobicContact CE2-CG2 4.37Å; F269-I377 HydrophobicContact CG-CG2 3.9Å; F269-I377 HydrophobicContact CZ-CD1 3.73Å; F269-I377 HydrophobicContact CZ-CG1 3.65Å; F269-I377 HydrophobicContact CZ-CG2 4.16Å; F269-V383 HydrophobicContact CD1-CG2 3.72Å; F269-V383 HydrophobicContact CE1-CG2 3.8Å; F269-L842 HydrophobicContact CE1-CD1 4.41Å; F269-L842 HydrophobicContact CE2-CD1 3.81Å; F269-L842 HydrophobicContact CZ-CD1 3.53Å; F269-L846 HydrophobicContact CE2-CD2 4.21Å; F269-L846 HydrophobicContact CZ-CD2 4.3Å; F269-I990 HydrophobicContact CD1-CB 4.17Å; F269-I990 HydrophobicContact CD1-CD1 3.77Å; F269-I990 HydrophobicContact CD1-CG2 3.88Å; F269-I990 HydrophobicContact CD2-CG2 3.89Å; F269-I990 HydrophobicContact CE1-CD1 3.8Å; F269-I990 HydrophobicContact CE1-CG2 3.89Å; F269-I990 HydrophobicContact CE2-CG2 3.91Å; F269-I990 HydrophobicContact CG-CB 4.26Å; F269-I990 HydrophobicContact CG-CG2 3.89Å; F269-I990 HydrophobicContact CZ-CG2 3.91Å; F269-M992 HydrophobicContact CD2-CG 4.31Å; F269-M992 HydrophobicContact CD2-SD 4.06Å; F269-M992 HydrophobicContact CE2-CG 4.39Å; F269-M992 HydrophobicContact CE2-SD 3.57Å; F269-M992 VanDerWaalsContact CE2-SD 3.57Å
270	D	85	Confident	84	Confident	10 Å²	10	15.1 Å²	15.1	5%	0.053	8%	0.081	C	C	.	.	H	α-helix	trans	-66.3	-39.4	175.6	-77.2	29.9	0	0	0	111.7	Q266 I267 E273 N274 K983	Q266-D270 PolarHBondContact NE2-OD1 2.63Å; Q266-D270 WeakPolarHBondContact O-CB 3.2Å; Q266-D270 PolarHBondContact O-N 3.22Å; I267-D270 CarbonylContact O-C 3.57Å; I267-D270 PolarHBondContact O-N 2.93Å; I267-D270 VanDerWaalsContact O-N 3.17Å; D270-E273 PolarHBondContact O-N 2.95Å; D270-N274 WeakPolarHBondContact O-CB 3.35Å; D270-N274 PolarHBondContact O-N 3.07Å; D270-N274 PolarHBondContact O-ND2 3.14Å; D270-K983 IonicContact OD1-NZ 2.85Å; D270-K983 PolarHBondContact OD1-NZ 3.11Å; D270-K983 IonicContact OD2-NZ 2.68Å; D270-K983 PolarHBondContact OD2-NZ 2.77Å
271	L	85.8	Confident	84.3	Confident	5 Å²	5	18.3 Å²	18.3	3%	0.026	10%	0.095	C	C	.	.	H	α-helix	trans	-63.5	-47.4	176	-72.5	177.5	0	0	0	110.6	C234 V238 T246 L250 I267 G268 E273 N274 A275 F279 L280 L378	C234-L271 HydrophobicContact CB-CD2 4.37Å; V238-L271 HydrophobicContact CG2-CD2 3.25Å; T246-L271 HydrophobicContact CG2-CD1 3.82Å; T246-L271 HydrophobicContact CG2-CD2 4.15Å; L250-L271 HydrophobicContact CD1-CD1 3.87Å; I267-L271 HydrophobicContact CG2-CD1 3.86Å; I267-L271 HydrophobicContact CG2-CG 3.96Å; I267-L271 WeakPolarHBondContact O-CB 3.36Å; I267-L271 VanDerWaalsContact O-CG 3.24Å; I267-L271 WeakPolarHBondContact O-CG 3.42Å; I267-L271 PolarHBondContact O-N 2.88Å; G268-L271 PolarHBondContact O-N 3.45Å; L271-E273 VanDerWaalsContact C-N 3.29Å; L271-E273 PolarHBondContact O-N 3.03Å; L271-N274 PolarHBondContact O-N 3.33Å; L271-A275 VanDerWaalsContact O-CB 3.22Å; L271-A275 WeakPolarHBondContact O-CB 3.39Å; L271-A275 PolarHBondContact O-N 3.29Å; L271-F279 HydrophobicContact CD2-CE1 4.34Å; L271-L280 HydrophobicContact CB-CD2 4.11Å; L271-L378 HydrophobicContact CB-CD2 4.33Å; L271-L378 HydrophobicContact CD1-CD2 4.16Å
272	Y	86.8	Confident	84.4	Confident	52 Å²	52	23.3 Å²	23.3	20%	0.204	11%	0.114	C	C	.	.	H	α-helix	trans	-59.7	-36.2	179	172.2	-87.8	0	0	0	113	G268 L280 V383 H504	G268-Y272 WeakPolarHBondContact O-CB 3.48Å; G268-Y272 PolarHBondContact O-N 3.35Å; Y272-L280 HydrophobicContact CD2-CD1 4.2Å; Y272-V383 HydrophobicContact CD1-CB 4.04Å; Y272-V383 HydrophobicContact CD1-CG1 3.84Å; Y272-V383 HydrophobicContact CD1-CG2 3.73Å; Y272-V383 HydrophobicContact CE1-CB 3.78Å; Y272-V383 HydrophobicContact CE1-CG1 3.48Å; Y272-V383 VanDerWaalsContact CE1-CG1 3.48Å; Y272-V383 HydrophobicContact CE1-CG2 4Å; Y272-V383 HydrophobicContact CG-CG2 4.11Å; Y272-H504 AromaticContact CE2-CE1 4Å; Y272-H504 AromaticContact CE2-NE2 3.48Å; Y272-H504 WeakPolarHBondContact CE2-NE2 3.45Å; Y272-H504 AromaticContact CZ-CE1 3.99Å; Y272-H504 AromaticContact CZ-NE2 3.76Å; Y272-H504 PolarHBondContact OH-CE1 2.93Å; Y272-H504 PolarHBondContact OH-NE2 3.32Å
273	E	83.5	Confident	84.5	Confident	43 Å²	43	22.7 Å²	22.7	20%	0.201	11%	0.11	C	C	.	.	H	α-helix	trans	-74.1	-30.9	177.1	179.4	176.8	176.5	0	0	113.8	F269 D270 L271 T801 R802	F269-E273 PolarHBondContact O-N 3.24Å; D270-E273 PolarHBondContact O-N 2.95Å; L271-E273 VanDerWaalsContact C-N 3.29Å; L271-E273 PolarHBondContact O-N 3.03Å; E273-T801 HydrophobicContact CG-CG2 4.2Å; E273-T801 VanDerWaalsContact O-CG2 3.31Å; E273-T801 WeakPolarHBondContact O-CG2 3.43Å; E273-R802 WeakPolarHBondContact OE1-CB 3.39Å; E273-R802 IonicContact OE1-CZ 2.75Å; E273-R802 PolarHBondContact OE1-N 3.46Å; E273-R802 IonicContact OE1-NE 3.88Å; E273-R802 IonicContact OE1-NH1 2.62Å; E273-R802 PolarHBondContact OE1-NH1 3.02Å; E273-R802 IonicContact OE1-NH2 3.71Å; E273-R802 PolarHBondContact OE1-NH2 3.19Å; E273-R802 IonicContact OE2-CZ 3.18Å; E273-R802 IonicContact OE2-NH1 2.76Å; E273-R802 PolarHBondContact OE2-NH1 3.29Å; E273-R802 IonicContact OE2-NH2 2.69Å; E273-R802 PolarHBondContact OE2-NH2 3.35Å
274	N	82.3	Confident	84.5	Confident	21 Å²	21	24 Å²	24	11%	0.112	12%	0.119	C	C	.	.	H	α-helix	trans	-111.3	-18.3	-164.7	-67	-66.7	0	0	0	115.3	D270 L271 T801 T803	D270-N274 WeakPolarHBondContact O-CB 3.35Å; D270-N274 PolarHBondContact O-N 3.07Å; D270-N274 PolarHBondContact O-ND2 3.14Å; L271-N274 PolarHBondContact O-N 3.33Å; N274-T801 WeakPolarHBondContact OD1-CB 3.16Å; N274-T801 PolarHBondContact OD1-OG1 2.83Å; N274-T803 VanDerWaalsContact ND2-CG2 3.26Å; N274-T803 WeakPolarHBondContact ND2-CG2 3.39Å; N274-T803 VanDerWaalsContact OD1-CG2 3.31Å; N274-T803 WeakPolarHBondContact OD1-CG2 3.49Å; N274-T803 PolarHBondContact OD1-OG1 3.38Å
275	A	79.5	Confident	84.4	Confident	20 Å²	20	26.3 Å²	26.3	17%	0.165	14%	0.138	C	C	.	.	S	Bend	trans	-99.2	164.3	-175.6	0	0	0	0	0	112.7	V238 L271 F279 L280	V238-A275 HydrophobicContact CG1-CB 4.02Å; V238-A275 HydrophobicContact CG2-CB 4.22Å; L271-A275 VanDerWaalsContact O-CB 3.22Å; L271-A275 WeakPolarHBondContact O-CB 3.39Å; L271-A275 PolarHBondContact O-N 3.29Å; A275-F279 HydrophobicContact CB-CB 4.27Å; A275-F279 HydrophobicContact CB-CD1 3.56Å; A275-F279 HydrophobicContact CB-CE1 4.21Å; A275-F279 HydrophobicContact CB-CG 4.19Å; A275-L280 HydrophobicContact CB-CD2 4.18Å; A275-L280 HydrophobicContact CB-CG 4.24Å
276	T	80.5	Confident	84.2	Confident	56 Å²	56	26.5 Å²	26.5	34%	0.344	14%	0.14	S	C	.	.			trans	-78.1	154.8	172.4	63.1	0	0	0	0	111	N278 F279 L280 M808	T276-N278 VanDerWaalsContact C-N 3.27Å; T276-N278 PolarHBondContact O-N 3.24Å; T276-F279 WeakPolarHBondContact O-CB 3.43Å; T276-F279 PolarHBondContact O-N 3.4Å; T276-F279 WeakPolarHBondContact OG1-CB 3.18Å; T276-F279 PolarHBondContact OG1-N 3.06Å; T276-L280 PolarHBondContact O-N 3.14Å; T276-M808 HydrophobicContact CG2-SD 4.13Å
277	Q	81.2	Confident	84	Confident	20 Å²	20	26.3 Å²	26.3	9%	0.093	14%	0.14	C	C	.	.	H	α-helix	trans	-61.9	-36.8	179.7	-164.4	64.2	-3.6	0	0	111.9	F279 L280 Q281 N503 T539	Q277-F279 PolarHBondContact O-N 3.38Å; Q277-L280 PolarHBondContact O-N 3.15Å; Q277-Q281 WeakPolarHBondContact O-CB 3.22Å; Q277-Q281 WeakPolarHBondContact O-CG 3.36Å; Q277-Q281 PolarHBondContact O-N 2.99Å; Q277-N503 PolarHBondContact NE2-O 3.14Å; Q277-T539 HydrophobicContact CG-CG2 4.39Å
278	N	82.3	Confident	83.5	Confident	33 Å²	33	27.9 Å²	27.9	18%	0.176	15%	0.153	C	C	.	.	H	α-helix	trans	-55.9	-45.6	170.2	-156.9	-29.2	0	0	0	112.1	T276 Q281 R282 G538	T276-N278 VanDerWaalsContact C-N 3.27Å; T276-N278 PolarHBondContact O-N 3.24Å; N278-Q281 PolarHBondContact O-N 3.45Å; N278-R282 WeakPolarHBondContact O-CB 3.27Å; N278-R282 VanDerWaalsContact O-CG 3.23Å; N278-R282 WeakPolarHBondContact O-CG 3.35Å; N278-R282 PolarHBondContact O-N 2.92Å; N278-R282 PolarHBondContact OD1-NE 2.99Å; N278-R282 PolarHBondContact OD1-NH2 2.81Å; N278-G538 WeakPolarHBondContact CB-O 3.38Å; N278-G538 PolarHBondContact N-O 3.45Å; N278-G538 VanDerWaalsContact N-O 3.07Å
279	F	84.4	Confident	82.9	Confident	3 Å²	3	36 Å²	36	1%	0.013	18%	0.183	C	C	.	.	H	α-helix	trans	-63.1	-45.1	176.8	-177.3	-91.1	0	0	0	111.9	V238 D241 P243 T246 L271 A275 T276 Q277 Q281 R282 V283	V238-F279 HydrophobicContact CG2-CE1 3.75Å; V238-F279 HydrophobicContact CG2-CZ 3.97Å; D241-F279 WeakPolarHBondContact OD1-CD2 3.37Å; P243-F279 HydrophobicContact CB-CD2 4.11Å; P243-F279 HydrophobicContact CB-CE2 3.99Å; T246-F279 HydrophobicContact CG2-CE1 4.18Å; T246-F279 HydrophobicContact CG2-CZ 4.16Å; T246-F279 WeakPolarHBondContact OG1-CZ 3.28Å; L271-F279 HydrophobicContact CD2-CE1 4.34Å; A275-F279 HydrophobicContact CB-CB 4.27Å; A275-F279 HydrophobicContact CB-CD1 3.56Å; A275-F279 HydrophobicContact CB-CE1 4.21Å; A275-F279 HydrophobicContact CB-CG 4.19Å; T276-F279 WeakPolarHBondContact O-CB 3.43Å; T276-F279 PolarHBondContact O-N 3.4Å; T276-F279 WeakPolarHBondContact OG1-CB 3.18Å; T276-F279 PolarHBondContact OG1-N 3.06Å; Q277-F279 PolarHBondContact O-N 3.38Å; F279-Q281 VanDerWaalsContact C-N 3.34Å; F279-Q281 PolarHBondContact O-N 3.48Å; F279-R282 PolarHBondContact O-N 3.27Å; F279-V283 HydrophobicContact CD1-CG2 3.83Å; F279-V283 HydrophobicContact CE1-CG2 3.54Å; F279-V283 HydrophobicContact CE2-CG2 4.5Å; F279-V283 HydrophobicContact CG-CG2 4.45Å; F279-V283 HydrophobicContact CZ-CG2 3.93Å; F279-V283 WeakPolarHBondContact O-CG2 3.48Å; F279-V283 PolarHBondContact O-N 2.84Å
280	L	85	Confident	81.9	Confident	3 Å²	3	36.5 Å²	36.5	2%	0.016	19%	0.188	C	C	.	.	H	α-helix	trans	-63.4	-38.8	178	-63.4	171.1	0	0	0	112.1	L271 Y272 A275 T276 Q277 S284 L378	L271-L280 HydrophobicContact CB-CD2 4.11Å; Y272-L280 HydrophobicContact CD2-CD1 4.2Å; A275-L280 HydrophobicContact CB-CD2 4.18Å; A275-L280 HydrophobicContact CB-CG 4.24Å; T276-L280 PolarHBondContact O-N 3.14Å; Q277-L280 PolarHBondContact O-N 3.15Å; L280-S284 WeakPolarHBondContact O-CB 3.26Å; L280-S284 PolarHBondContact O-N 3.07Å; L280-S284 PolarHBondContact O-OG 2.91Å; L280-L378 HydrophobicContact CD2-CD2 4.16Å
281	Q	84.1	Confident	80.6	Confident	72 Å²	72	40.4 Å²	40.4	34%	0.336	22%	0.216	S	C	.	.	H	α-helix	trans	-65.3	-41.4	172.3	-72.5	180	-7.4	0	0	111.9	Q277 N278 F279 S284 A285	Q277-Q281 WeakPolarHBondContact O-CB 3.22Å; Q277-Q281 WeakPolarHBondContact O-CG 3.36Å; Q277-Q281 PolarHBondContact O-N 2.99Å; N278-Q281 PolarHBondContact O-N 3.45Å; F279-Q281 VanDerWaalsContact C-N 3.34Å; F279-Q281 PolarHBondContact O-N 3.48Å; Q281-S284 WeakPolarHBondContact CA-OG 3.41Å; Q281-S284 PolarHBondContact O-OG 2.68Å; Q281-S284 VanDerWaalsContact O-OG 3.11Å; Q281-A285 WeakPolarHBondContact O-CB 3.39Å; Q281-A285 PolarHBondContact O-N 3.15Å
282	R	84.9	Confident	79.4	Confident	107 Å²	107	46.6 Å²	46.6	40%	0.404	24%	0.243	S	C	.	.	H	α-helix	trans	-65	-43.3	174.4	-70.8	168.7	-174	-169.1	-3.5	112.5	D241 P243 N278 F279 S286	D241-R282 IonicContact OD2-NH1 2.72Å; D241-R282 PolarHBondContact OD2-NH1 3.35Å; P243-R282 HydrophobicContact CB-CB 3.71Å; P243-R282 HydrophobicContact CG-CB 3.84Å; N278-R282 WeakPolarHBondContact O-CB 3.27Å; N278-R282 VanDerWaalsContact O-CG 3.23Å; N278-R282 WeakPolarHBondContact O-CG 3.35Å; N278-R282 PolarHBondContact O-N 2.92Å; N278-R282 PolarHBondContact OD1-NE 2.99Å; N278-R282 PolarHBondContact OD1-NH2 2.81Å; F279-R282 PolarHBondContact O-N 3.27Å; R282-S286 VanDerWaalsContact O-CB 3.31Å; R282-S286 WeakPolarHBondContact O-CB 3.4Å; R282-S286 PolarHBondContact O-N 2.89Å; R282-S286 PolarHBondContact O-OG 3.11Å
283	V	85.5	Confident	78.1	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63.2	-50.5	177.6	170.3	0	0	0	0	110.3	P243 T246 L250 F279 A285 S286 L287 L378	P243-V283 HydrophobicContact CB-CG2 3.64Å; T246-V283 HydrophobicContact CG2-CG1 4.33Å; T246-V283 HydrophobicContact CG2-CG2 3.99Å; L250-V283 HydrophobicContact CD1-CG1 4.06Å; F279-V283 HydrophobicContact CD1-CG2 3.83Å; F279-V283 HydrophobicContact CE1-CG2 3.54Å; F279-V283 HydrophobicContact CE2-CG2 4.5Å; F279-V283 HydrophobicContact CG-CG2 4.45Å; F279-V283 HydrophobicContact CZ-CG2 3.93Å; F279-V283 WeakPolarHBondContact O-CG2 3.48Å; F279-V283 PolarHBondContact O-N 2.84Å; V283-A285 PolarHBondContact O-N 3.5Å; V283-S286 PolarHBondContact O-N 3.04Å; V283-L287 WeakPolarHBondContact O-CB 3.43Å; V283-L287 PolarHBondContact O-N 2.81Å; V283-L378 HydrophobicContact CG1-CD1 4.46Å
284	S	83.3	Confident	76.7	Confident	40 Å²	40	44.7 Å²	44.7	28%	0.28	24%	0.242	S	C	.	.	H	α-helix	trans	-63.5	-41.6	179.2	53.7	0	0	0	0	112.7	L280 Q281 S286 L287 A288	L280-S284 WeakPolarHBondContact O-CB 3.26Å; L280-S284 PolarHBondContact O-N 3.07Å; L280-S284 PolarHBondContact O-OG 2.91Å; Q281-S284 WeakPolarHBondContact CA-OG 3.41Å; Q281-S284 PolarHBondContact O-OG 2.68Å; Q281-S284 VanDerWaalsContact O-OG 3.11Å; S284-S286 PolarHBondContact O-N 3.2Å; S284-L287 PolarHBondContact O-N 3.25Å; S284-A288 WeakPolarHBondContact O-CB 3.48Å; S284-A288 PolarHBondContact O-N 3.19Å
285	A	84.8	Confident	75.4	Confident	48 Å²	48	49.4 Å²	49.4	40%	0.397	26%	0.263	S	S	.	.	H	α-helix	trans	-66.6	-18.5	172.9	0	0	0	0	0	113.8	Q281 V283 R289	Q281-A285 WeakPolarHBondContact O-CB 3.39Å; Q281-A285 PolarHBondContact O-N 3.15Å; V283-A285 PolarHBondContact O-N 3.5Å; A285-R289 VanDerWaalsContact O-CG 3.3Å; A285-R289 WeakPolarHBondContact O-CG 3.38Å; A285-R289 PolarHBondContact O-NE 3.2Å
286	S	83.5	Confident	74.4	Confident	8 Å²	8	49.1 Å²	49.1	6%	0.056	26%	0.259	C	S	.	.	H	α-helix	trans	-90.4	-41.1	176.6	-53.9	0	0	0	0	111.3	Q244 R282 V283 S284 A288 R289 S290	Q244-S286 PolarHBondContact NE2-OG 3.42Å; R282-S286 VanDerWaalsContact O-CB 3.31Å; R282-S286 WeakPolarHBondContact O-CB 3.4Å; R282-S286 PolarHBondContact O-N 2.89Å; R282-S286 PolarHBondContact O-OG 3.11Å; V283-S286 PolarHBondContact O-N 3.04Å; S284-S286 PolarHBondContact O-N 3.2Å; S286-A288 PolarHBondContact O-N 3.22Å; S286-R289 PolarHBondContact O-N 3.34Å; S286-R289 PolarHBondContact OG-NH2 2.7Å; S286-S290 PolarHBondContact O-N 3.14Å; S286-S290 VanDerWaalsContact O-N 3.07Å
287	L	81.1	Confident	73.3	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-57.7	-35.4	168.4	-167.5	70.5	0	0	0	111.7	E251 V283 S284 L293 M297 L371 L374	E251-L287 HydrophobicContact CB-CD1 4.41Å; V283-L287 WeakPolarHBondContact O-CB 3.43Å; V283-L287 PolarHBondContact O-N 2.81Å; S284-L287 PolarHBondContact O-N 3.25Å; L287-L293 HydrophobicContact CD1-CD1 3.5Å; L287-L293 VanDerWaalsContact CD1-CD1 3.5Å; L287-L293 HydrophobicContact CG-CD1 3.93Å; L287-M297 HydrophobicContact CD2-CE 4.42Å; L287-M297 HydrophobicContact CG-CE 4.19Å; L287-L371 HydrophobicContact CD2-CD1 3.76Å; L287-L371 HydrophobicContact CG-CD1 4.12Å; L287-L374 HydrophobicContact CD2-CD2 4.11Å
288	A	75.5	Confident	71.9	Confident	35 Å²	35	48 Å²	48	29%	0.289	25%	0.253	S	S	.	.	H	α-helix	trans	-68.6	-32.3	173.5	0	0	0	0	0	113.9	S284 S286 M297	S284-A288 WeakPolarHBondContact O-CB 3.48Å; S284-A288 PolarHBondContact O-N 3.19Å; S286-A288 PolarHBondContact O-N 3.22Å; A288-M297 HydrophobicContact CB-CE 4.1Å; A288-M297 HydrophobicContact CB-SD 4.29Å
289	R	74.1	Confident	70.4	Confident	169 Å²	169	48.6 Å²	48.6	64%	0.638	26%	0.256	S	S	*	.	H	α-helix	trans	-85.2	-12.4	179.3	-74.5	178.3	-65	155.6	7.4	113.8	A285 S286 S291	A285-R289 VanDerWaalsContact O-CG 3.3Å; A285-R289 WeakPolarHBondContact O-CG 3.38Å; A285-R289 PolarHBondContact O-NE 3.2Å; S286-R289 PolarHBondContact O-N 3.34Å; S286-R289 PolarHBondContact OG-NH2 2.7Å; R289-S291 PolarHBondContact O-N 3.46Å
290	S	67.5	Low	69.1	Low	20 Å²	20	49.1 Å²	49.1	14%	0.14	26%	0.259	C	S	.	.			trans	-62.8	132.4	-177.3	178.6	0	0	0	0	112.5	E251 S286 K292 L293 S294	E251-S290 VanDerWaalsContact OE2-CB 3.25Å; E251-S290 WeakPolarHBondContact OE2-CB 3.26Å; E251-S290 PolarHBondContact OE2-OG 2.91Å; S286-S290 PolarHBondContact O-N 3.14Å; S286-S290 VanDerWaalsContact O-N 3.07Å; S290-K292 VanDerWaalsContact C-N 3.31Å; S290-K292 PolarHBondContact O-N 3.41Å; S290-L293 PolarHBondContact O-N 3.31Å; S290-L293 VanDerWaalsContact O-N 3.11Å; S290-S294 WeakPolarHBondContact O-CB 3.48Å; S290-S294 PolarHBondContact O-N 3.29Å
291	S	57.5	Low	67.7	Low	93 Å²	93	54.7 Å²	54.7	65%	0.65	29%	0.285	S	S	*	.	H	α-helix	trans	-47.3	-46.5	-177.9	58.9	0	0	0	0	114	R289 S294	R289-S291 PolarHBondContact O-N 3.46Å; S291-S294 PolarHBondContact O-OG 2.96Å
292	K	59.8	Low	65.8	Low	134 Å²	134	58.8 Å²	58.8	58%	0.583	30%	0.297	S	S	*	.	H	α-helix	trans	-75.1	-27.9	-175.3	-48.4	-163.3	-154.9	85.2	0	113.3	E251 L255 S290	E251-K292 WeakPolarHBondContact OE1-CD 3.43Å; E251-K292 WeakPolarHBondContact OE1-CG 3.49Å; E251-K292 IonicContact OE1-NZ 2.59Å; E251-K292 PolarHBondContact OE1-NZ 2.95Å; L255-K292 HydrophobicContact CD1-CD 3.97Å; S290-K292 VanDerWaalsContact C-N 3.31Å; S290-K292 PolarHBondContact O-N 3.41Å
293	L	59.7	Low	64.3	Low	1 Å²	1	57.4 Å²	57.4	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-95.6	-19.8	-178.6	-60.7	177.6	0	0	0	112.7	E251 L287 S290 H295 I296 M297 I367 L371	E251-L293 HydrophobicContact CB-CD1 4.46Å; E251-L293 HydrophobicContact CG-CD1 4.1Å; E251-L293 HydrophobicContact CG-CG 4.38Å; L287-L293 HydrophobicContact CD1-CD1 3.5Å; L287-L293 VanDerWaalsContact CD1-CD1 3.5Å; L287-L293 HydrophobicContact CG-CD1 3.93Å; S290-L293 PolarHBondContact O-N 3.31Å; S290-L293 VanDerWaalsContact O-N 3.11Å; L293-H295 VanDerWaalsContact C-N 3.32Å; L293-H295 PolarHBondContact O-N 2.95Å; L293-I296 WeakPolarHBondContact O-CA 3.26Å; L293-I296 PolarHBondContact O-N 2.68Å; L293-M297 PolarHBondContact O-N 2.92Å; L293-I367 HydrophobicContact CD2-CG2 4.24Å; L293-L371 HydrophobicContact CB-CD2 4.46Å; L293-L371 HydrophobicContact CD1-CD1 4.04Å; L293-L371 HydrophobicContact CD2-CD2 4.36Å
294	S	54.2	Low	62.7	Low	55 Å²	55	63.5 Å²	63.5	39%	0.385	33%	0.325	S	S	.	.	H	α-helix	trans	-49.7	-44.7	-176.4	65.5	0	0	0	0	114.1	S290 S291 M297 S298	S290-S294 WeakPolarHBondContact O-CB 3.48Å; S290-S294 PolarHBondContact O-N 3.29Å; S291-S294 PolarHBondContact O-OG 2.96Å; S294-M297 PolarHBondContact O-N 2.85Å; S294-S298 WeakPolarHBondContact O-CB 3.19Å; S294-S298 PolarHBondContact O-N 3.04Å
295	H	54.8	Low	60.7	Low	120 Å²	120	66.7 Å²	66.7	56%	0.556	34%	0.339	S	S	*	.	H	α-helix	trans	-62.5	-46.1	178.1	-171.7	63.4	0	0	0	111.3	L293 S298 L299	L293-H295 VanDerWaalsContact C-N 3.32Å; L293-H295 PolarHBondContact O-N 2.95Å; H295-S298 PolarHBondContact O-N 3.04Å; H295-S298 PolarHBondContact O-OG 2.87Å; H295-L299 WeakPolarHBondContact O-CG 3.37Å; H295-L299 PolarHBondContact O-N 3.43Å
296	I	59.1	Low	58.6	Low	13 Å²	13	67.1 Å²	67.1	7%	0.067	34%	0.342	C	S	.	.	H	α-helix	trans	-66.6	-44.2	179.1	-57.4	178.6	0	0	0	110.9	L293 S298 L299 I300 I367 K368 L371	L293-I296 WeakPolarHBondContact O-CA 3.26Å; L293-I296 PolarHBondContact O-N 2.68Å; I296-S298 PolarHBondContact O-N 3.43Å; I296-L299 WeakPolarHBondContact O-CB 3.05Å; I296-L299 PolarHBondContact O-N 3.07Å; I296-L299 VanDerWaalsContact O-N 3.1Å; I296-I300 HydrophobicContact CG2-CD1 4.39Å; I296-I300 WeakPolarHBondContact O-CG1 3.32Å; I296-I300 PolarHBondContact O-N 2.62Å; I296-I300 VanDerWaalsContact O-N 3.08Å; I296-I367 HydrophobicContact CD1-CB 4.2Å; I296-I367 HydrophobicContact CD1-CG2 3.6Å; I296-K368 HydrophobicContact CG2-CB 3.73Å; I296-K368 HydrophobicContact CG2-CG 3.84Å; I296-L371 HydrophobicContact CG2-CD2 4.17Å
297	M	56.5	Low	56.8	Low	20 Å²	20	72.6 Å²	72.6	10%	0.099	38%	0.376	C	S	.	.	H	α-helix	trans	-57.5	-46.4	174.4	-75.3	-76.3	-164.4	0	0	111.5	L287 A288 L293 S294 L299 I300 E301 L371 V375	L287-M297 HydrophobicContact CD2-CE 4.42Å; L287-M297 HydrophobicContact CG-CE 4.19Å; A288-M297 HydrophobicContact CB-CE 4.1Å; A288-M297 HydrophobicContact CB-SD 4.29Å; L293-M297 PolarHBondContact O-N 2.92Å; S294-M297 PolarHBondContact O-N 2.85Å; M297-L299 PolarHBondContact O-N 3.05Å; M297-L299 VanDerWaalsContact O-N 3.08Å; M297-I300 WeakPolarHBondContact O-CA 3.45Å; M297-I300 WeakPolarHBondContact O-CB 3.45Å; M297-I300 PolarHBondContact O-N 2.89Å; M297-E301 PolarHBondContact O-N 3.01Å; M297-L371 HydrophobicContact CE-CD1 3.88Å; M297-L371 HydrophobicContact CE-CD2 3.82Å; M297-L371 HydrophobicContact CE-CG 4.01Å; M297-L371 HydrophobicContact CG-CD2 4.05Å; M297-L371 HydrophobicContact SD-CD2 3.98Å; M297-V375 HydrophobicContact CE-CG2 4.28Å
298	S	52.6	Low	54.9	Low	32 Å²	32	80.1 Å²	80.1	22%	0.224	41%	0.408	C	S	.	.	H	α-helix	trans	-63.3	-17.9	178.1	85.8	0	0	0	0	113.9	S294 H295 I296 R302	S294-S298 WeakPolarHBondContact O-CB 3.19Å; S294-S298 PolarHBondContact O-N 3.04Å; H295-S298 PolarHBondContact O-N 3.04Å; H295-S298 PolarHBondContact O-OG 2.87Å; I296-S298 PolarHBondContact O-N 3.43Å; S298-R302 VanDerWaalsContact O-CG 3.27Å; S298-R302 WeakPolarHBondContact O-CG 3.39Å; S298-R302 PolarHBondContact O-N 3.27Å; S298-R302 PolarHBondContact O-NH1 2.93Å; S298-R302 PolarHBondContact OG-NH1 2.84Å
299	L	51	Low	52.5	Low	46 Å²	46	82 Å²	82	24%	0.241	42%	0.419	C	S	.	.	H	α-helix	trans	-88.8	-31	173	-65.4	167.1	0	0	0	111.7	H295 I296 M297 D303 L360	H295-L299 WeakPolarHBondContact O-CG 3.37Å; H295-L299 PolarHBondContact O-N 3.43Å; I296-L299 WeakPolarHBondContact O-CB 3.05Å; I296-L299 PolarHBondContact O-N 3.07Å; I296-L299 VanDerWaalsContact O-N 3.1Å; M297-L299 PolarHBondContact O-N 3.05Å; M297-L299 VanDerWaalsContact O-N 3.08Å; L299-D303 PolarHBondContact O-N 3.47Å; L299-L360 HydrophobicContact CD1-CD1 4.26Å; L299-L360 HydrophobicContact CD1-CD2 3.96Å
300	I	56.6	Low	50.5	Low	15 Å²	15	79.6 Å²	79.6	8%	0.077	43%	0.425	C	S	.	.	H	α-helix	trans	-66	-42.6	171	-64.3	171.8	0	0	0	110.5	I296 M297 D303 K304 K368 L371 M372	I296-I300 HydrophobicContact CG2-CD1 4.39Å; I296-I300 WeakPolarHBondContact O-CG1 3.32Å; I296-I300 PolarHBondContact O-N 2.62Å; I296-I300 VanDerWaalsContact O-N 3.08Å; M297-I300 WeakPolarHBondContact O-CA 3.45Å; M297-I300 WeakPolarHBondContact O-CB 3.45Å; M297-I300 PolarHBondContact O-N 2.89Å; I300-D303 PolarHBondContact O-N 2.87Å; I300-K304 HydrophobicContact CG2-CD 4.43Å; I300-K304 WeakPolarHBondContact O-CG 3.17Å; I300-K304 PolarHBondContact O-N 2.9Å; I300-K368 HydrophobicContact CD1-CG 4.17Å; I300-K368 HydrophobicContact CG1-CD 4.44Å; I300-K368 HydrophobicContact CG1-CG 3.98Å; I300-L371 HydrophobicContact CD1-CD2 4.1Å; I300-L371 HydrophobicContact CD1-CG 4.48Å; I300-M372 HydrophobicContact CD1-CE 4.48Å; I300-M372 HydrophobicContact CD1-CG 4.1Å; I300-M372 HydrophobicContact CG1-CE 3.9Å; I300-M372 HydrophobicContact CG2-CE 4.28Å
301	E	55.5	Low	48.8	Very low	119 Å²	119	88.1 Å²	88.1	56%	0.556	46%	0.46	S	S	*	.	H	α-helix	trans	-66.1	-39.3	176.4	-68.3	179.2	159.9	0	0	112.2	M297 K304 N305	M297-E301 PolarHBondContact O-N 3.01Å; E301-K304 PolarHBondContact O-N 2.7Å; E301-N305 PolarHBondContact O-N 2.98Å
302	R	44.5	Very low	47.1	Very low	158 Å²	158	90 Å²	90	60%	0.596	47%	0.468	S	S	*	.	H	α-helix	trans	-63.4	-41.4	173	-77.8	179.8	-174.6	97.3	-11.3	112.3	S298 N305 A306	S298-R302 VanDerWaalsContact O-CG 3.27Å; S298-R302 WeakPolarHBondContact O-CG 3.39Å; S298-R302 PolarHBondContact O-N 3.27Å; S298-R302 PolarHBondContact O-NH1 2.93Å; S298-R302 PolarHBondContact OG-NH1 2.84Å; R302-N305 PolarHBondContact O-N 3.44Å; R302-A306 WeakPolarHBondContact O-CB 3.38Å; R302-A306 PolarHBondContact O-N 3.16Å
303	D	52.3	Low	45.7	Very low	79 Å²	79	88.6 Å²	88.6	42%	0.422	47%	0.472	S	S	.	.	H	α-helix	trans	-61	-46	173.3	-86.1	-37.3	0	0	0	112.1	L299 I300 N305 A306 T307 K368	L299-D303 PolarHBondContact O-N 3.47Å; I300-D303 PolarHBondContact O-N 2.87Å; D303-N305 VanDerWaalsContact C-N 3.27Å; D303-N305 PolarHBondContact O-N 3.35Å; D303-A306 PolarHBondContact O-N 3.25Å; D303-T307 PolarHBondContact O-N 2.8Å; D303-T307 VanDerWaalsContact O-N 3.1Å; D303-T307 PolarHBondContact O-OG1 2.86Å; D303-K368 IonicContact OD2-NZ 2.63Å; D303-K368 PolarHBondContact OD2-NZ 3.36Å
304	K	51.8	Low	44.3	Very low	128 Å²	128	97.9 Å²	97.9	56%	0.557	52%	0.515	S	S	*	.	H	α-helix	trans	-63	-29.7	178.8	-75.8	-178.2	176.2	-174.8	0	113.3	I300 E301 T307	I300-K304 HydrophobicContact CG2-CD 4.43Å; I300-K304 WeakPolarHBondContact O-CG 3.17Å; I300-K304 PolarHBondContact O-N 2.9Å; E301-K304 PolarHBondContact O-N 2.7Å; K304-T307 PolarHBondContact O-OG1 3.02Å
305	N	43.3	Very low	43.1	Very low	107 Å²	107	98.8 Å²	98.8	57%	0.572	53%	0.534	S	S	*	.	H	α-helix	trans	-88.9	-34.4	175.6	-74.3	-20.9	0	0	0	112.8	E301 R302 D303 T307 K308	E301-N305 PolarHBondContact O-N 2.98Å; R302-N305 PolarHBondContact O-N 3.44Å; D303-N305 VanDerWaalsContact C-N 3.27Å; D303-N305 PolarHBondContact O-N 3.35Å; N305-T307 VanDerWaalsContact C-N 3.3Å; N305-T307 PolarHBondContact O-N 3.12Å; N305-K308 PolarHBondContact O-N 2.96Å
306	A	38.9	Very low	41.9	Very low	57 Å²	57	99 Å²	99	47%	0.471	55%	0.549	S	S	.	.	H	α-helix	trans	-61.8	-38.1	175.5	0	0	0	0	0	112.1	R302 D303 K308 S309	R302-A306 WeakPolarHBondContact O-CB 3.38Å; R302-A306 PolarHBondContact O-N 3.16Å; D303-A306 PolarHBondContact O-N 3.25Å; A306-K308 PolarHBondContact O-N 2.88Å; A306-S309 PolarHBondContact O-N 3.05Å; A306-S309 PolarHBondContact O-OG 3.47Å
307	T	45.6	Very low	40.4	Very low	123 Å²	123	102.7 Å²	102.7	76%	0.755	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-12.9	174.9	40	0	0	0	0	114.4	D303 K304 N305	D303-T307 PolarHBondContact O-N 2.8Å; D303-T307 VanDerWaalsContact O-N 3.1Å; D303-T307 PolarHBondContact O-OG1 2.86Å; K304-T307 PolarHBondContact O-OG1 3.02Å; N305-T307 VanDerWaalsContact C-N 3.3Å; N305-T307 PolarHBondContact O-N 3.12Å
308	K	41.2	Very low	39	Very low	158 Å²	158	107.4 Å²	107.4	69%	0.687	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	-2.3	173.6	-69.8	-178	175.8	-176.4	0	114.1	N305 A306	N305-K308 PolarHBondContact O-N 2.96Å; A306-K308 PolarHBondContact O-N 2.88Å
309	S	27	Very low	38	Very low	75 Å²	75	112.1 Å²	112.1	52%	0.524	64%	0.643	S	S	.	*	S	Bend	trans	-109.9	105.2	178.2	60.1	0	0	0	0	111.7	A306 K311	A306-S309 PolarHBondContact O-N 3.05Å; A306-S309 PolarHBondContact O-OG 3.47Å; S309-K311 PolarHBondContact O-N 2.88Å
310	P	31.1	Very low	36.7	Very low	118 Å²	118	116.8 Å²	116.8	77%	0.766	67%	0.667	S	S	*	*			trans	-75.4	117	-176.3	28.9	-33.3	0	0	0	111.5	T312	P310-T312 PolarHBondContact O-N 2.73Å
311	K	31.1	Very low	35.7	Very low	200 Å²	200	123.1 Å²	123.1	87%	0.87	71%	0.707	S	S	*	*			trans	-76.8	99.6	170.1	-71.7	-176.9	178.3	178.3	0	110.5	S309 P313	S309-K311 PolarHBondContact O-N 2.88Å; K311-P313 WeakPolarHBondContact O-CD 3.36Å
312	T	22.6	Very low	34.4	Very low	133 Å²	133	125.2 Å²	125.2	82%	0.816	72%	0.717	S	S	*	*			trans	-69.7	140.7	163.7	-29.1	0	0	0	0	110.2	P310	P310-T312 PolarHBondContact O-N 2.73Å
313	P	30.9	Very low	33.9	Very low	103 Å²	103	124 Å²	124	67%	0.669	73%	0.727	S	S	*	*			trans	-136.7	135.4	140.2	33.3	-19.3	0	0	0	113.8	K311	K311-P313 WeakPolarHBondContact O-CD 3.36Å
314	E	29.7	Very low	32.9	Very low	196 Å²	196	125.6 Å²	125.6	92%	0.916	74%	0.739	S	S	*	*			trans	57.8	111.1	144.4	-59.5	176.3	-169	0	0	119.7
315	G	28.9	Very low	32.1	Very low	75 Å²	75	127.4 Å²	127.4	77%	0.773	76%	0.755	S	S	*	*			trans	-175.9	40.6	179.3	0	0	0	0	0	118.8
316	S	29.2	Very low	31.5	Very low	124 Å²	124	125.5 Å²	125.5	87%	0.867	76%	0.761	S	S	*	*			trans	37	115	160.4	-61.7	0	0	0	0	121.6
317	A	28.8	Very low	31.4	Very low	90 Å²	90	129.3 Å²	129.3	74%	0.744	77%	0.773	S	S	*	*				157.6	133.3	109.3	0	0	0	0	0	115
318	C	26.1	Very low	31.1	Very low	119 Å²	119	131.2 Å²	131.2	80%	0.804	77%	0.771	S	S	*	*			trans	62.6	140.4	153.8	-59.8	0	0	0	0	119.3
319	T	30.9	Very low	30.8	Very low	132 Å²	132	130.5 Å²	130.5	81%	0.81	78%	0.775	S	S	*	*			cis	-157.2	159.9	-9.3	0.2	0	0	0	0	110.4
320	N	25	Very low	31.3	Very low	143 Å²	143	135.4 Å²	135.4	77%	0.765	79%	0.787	S	S	*	*			trans	-76.3	150.4	-172.2	-50.1	1.9	0	0	0	115.3
321	V	35.5	Very low	31.5	Very low	149 Å²	149	133.7 Å²	133.7	90%	0.903	78%	0.778	S	S	*	*			trans	-141.9	143.2	139.4	-176.8	0	0	0	0	108.3
322	E	27.1	Very low	31.6	Very low	163 Å²	163	131.2 Å²	131.2	76%	0.762	77%	0.774	S	S	*	*			trans	-118.1	148.7	-176.5	-58.4	170.8	121.8	0	0	112.1
323	T	34.3	Very low	32.2	Very low	133 Å²	133	134.6 Å²	134.6	82%	0.816	78%	0.777	S	S	*	*			trans	172.7	121.6	148.3	25.9	0	0	0	0	107.1
324	T	31.6	Very low	32.3	Very low	111 Å²	111	137.5 Å²	137.5	68%	0.681	78%	0.779	S	S	*	*			cis	98.2	118.7	33.3	63.1	0	0	0	0	114.9
325	D	34.3	Very low	32.4	Very low	166 Å²	166	135.3 Å²	135.3	89%	0.888	77%	0.769	S	S	*	*			trans	65.8	146.4	160.4	-52.3	-35.3	0	0	0	120.3
326	G	31.1	Very low	32.8	Very low	67 Å²	67	136 Å²	136	69%	0.691	77%	0.767	S	S	*	*			cis	151.4	119.8	-14.3	0	0	0	0	0	115.8
327	D	38.2	Very low	32.9	Very low	138 Å²	138	139 Å²	139	74%	0.738	77%	0.768	S	S	*	*			trans	-168.9	-178.6	163.9	-125.7	12.1	0	0	0	112.3
328	K	38.4	Very low	33.2	Very low	162 Å²	162	143.9 Å²	143.9	70%	0.704	78%	0.775	S	S	*	*				-157	156.1	-85	-96.5	-175.6	-156.1	82.8	0	109.7
329	N	35.3	Very low	33.7	Very low	143 Å²	143	142.3 Å²	142.3	77%	0.765	77%	0.771	S	S	*	*			trans	67.7	163.9	157.7	-64	-37.3	0	0	0	120.2
330	K	37	Very low	34	Very low	178 Å²	178	142.4 Å²	142.4	77%	0.774	77%	0.771	S	S	*	*			cis	-172.7	150.5	-42	-152.1	174.3	-179.7	175.9	0	112.4
331	S	34.7	Very low	34.4	Very low	83 Å²	83	143.7 Å²	143.7	58%	0.58	77%	0.772	S	S	*	*			trans	62.3	113.7	147.8	55	0	0	0	0	123.9
332	D	32.9	Very low	34.3	Very low	147 Å²	147	142.6 Å²	142.6	79%	0.786	77%	0.766	S	S	*	*				56.6	116.7	116.8	-40.4	-38.9	0	0	0	123.6
333	K	35.2	Very low	34.6	Very low	204 Å²	204	139.1 Å²	139.1	89%	0.887	77%	0.766	S	S	*	*			trans	156.1	164.1	131.6	-85.6	156.9	-174.7	175.2	0	111.9
334	K	32.9	Very low	34.4	Very low	164 Å²	164	138.3 Å²	138.3	71%	0.713	77%	0.765	S	S	*	*			cis	177.3	158.2	-34.6	-162.7	168.6	175.2	-85	0	107.9
335	E	33.7	Very low	34.5	Very low	150 Å²	150	139 Å²	139	70%	0.701	77%	0.774	S	S	*	*			trans	80.5	157.9	163.4	-77.7	136.4	-134.9	0	0	121.2
336	A	35.4	Very low	34.1	Very low	89 Å²	89	134.8 Å²	134.8	74%	0.736	77%	0.771	S	S	*	*			trans	72	121.1	-172	0	0	0	0	0	115.2
337	E	32.1	Very low	34.3	Very low	187 Å²	187	140.6 Å²	140.6	87%	0.874	78%	0.78	S	S	*	*			cis	64	129.9	21.5	-49.9	-179.9	145.4	0	0	113.1
338	E	35.1	Very low	33.9	Very low	193 Å²	193	140 Å²	140	90%	0.902	78%	0.781	S	S	*	*			cis	-136.4	162.3	9.5	-71.6	-175.2	83.5	0	0	108.8
339	A	36.2	Very low	33.6	Very low	86 Å²	86	140.2 Å²	140.2	71%	0.711	79%	0.79	S	S	*	*			cis	-151.1	-140.2	-9.2	0	0	0	0	0	106.8
340	V	37.8	Very low	33.4	Very low	134 Å²	134	142.2 Å²	142.2	81%	0.812	79%	0.792	S	S	*	*			cis	-147.7	166.9	10.3	-176.9	0	0	0	0	109.5
341	E	33	Very low	33.2	Very low	170 Å²	170	142.9 Å²	142.9	79%	0.794	80%	0.798	S	S	*	*			trans	-72.8	167.5	-178.5	-54.9	175.3	128.3	0	0	113.9
342	T	34.5	Very low	33.2	Very low	126 Å²	126	145.4 Å²	145.4	77%	0.773	80%	0.804	S	S	*	*			cis	-163.8	142.3	42.5	-36.9	0	0	0	0	114.5
343	A	33.6	Very low	33.1	Very low	91 Å²	91	147.4 Å²	147.4	75%	0.752	81%	0.808	S	S	*	*			trans	38.9	135.8	157.6	0	0	0	0	0	122.5
344	S	30.2	Very low	33.1	Very low	116 Å²	116	143.9 Å²	143.9	81%	0.811	80%	0.798	S	S	*	*			cis	106.9	89.8	14.1	180	0	0	0	0	116.5
345	S	32.9	Very low	33.1	Very low	124 Å²	124	141.3 Å²	141.3	87%	0.867	80%	0.798	S	S	*	*			trans	-179.9	133.6	135.3	55.8	0	0	0	0	111.3
346	G	26.4	Very low	33.1	Very low	79 Å²	79	139.1 Å²	139.1	81%	0.814	81%	0.805	S	S	*	*			cis	143.4	67.4	-10.3	0	0	0	0	0	114.8
347	E	34.2	Very low	33.1	Very low	188 Å²	188	142.2 Å²	142.2	88%	0.879	81%	0.81	S	S	*	*			trans	-139.1	97.4	175.6	-135.4	166.7	-138.5	0	0	113.7
348	T	30.3	Very low	33.5	Very low	126 Å²	126	141.6 Å²	141.6	77%	0.773	81%	0.807	S	S	*	*			trans	33.9	101.2	158.2	57.5	0	0	0	0	120.2	K350	T348-K350 PolarHBondContact O-N 2.76Å
349	N	32.1	Very low	34	Very low	167 Å²	167	138.7 Å²	138.7	89%	0.893	80%	0.802	S	S	*	*			trans	-61	132.1	146.9	-84.1	-9	0	0	0	109.9
350	K	32.4	Very low	34.6	Very low	184 Å²	184	137.1 Å²	137.1	80%	0.8	78%	0.782	S	S	*	*			trans	-112.3	122	150.1	-83.3	-174.9	176.3	178.4	0	107.6	T348 I352	T348-K350 PolarHBondContact O-N 2.76Å; K350-I352 PolarHBondContact O-N 3.44Å
351	E	31.8	Very low	35.5	Very low	192 Å²	192	133.3 Å²	133.3	90%	0.897	76%	0.761	S	S	*	*			trans	-65	123.7	164.5	-66.9	167.1	143.8	0	0	107.9
352	I	34.5	Very low	37.1	Very low	137 Å²	137	133.2 Å²	133.2	70%	0.703	76%	0.761	S	S	*	*			trans	-113.6	104.4	166.7	-60.7	179.7	0	0	0	105.5	K350 I354	K350-I352 PolarHBondContact O-N 3.44Å; I352-I354 HydrophobicContact CG2-CG1 3.96Å; I352-I354 PolarHBondContact O-N 3.13Å
353	E	31.6	Very low	38.7	Very low	188 Å²	188	132.8 Å²	132.8	88%	0.879	75%	0.748	S	S	*	*			trans	-63.6	103.8	163.1	-63.3	-179.3	130.6	0	0	107.6	P355	E353-P355 WeakPolarHBondContact O-CD 3.44Å
354	I	35.4	Very low	40.4	Very low	130 Å²	130	131 Å²	131	67%	0.667	73%	0.726	S	S	*	*			trans	-83.4	116.2	172.2	-59.4	179.3	0	0	0	107.2	I352	I352-I354 HydrophobicContact CG2-CG1 3.96Å; I352-I354 PolarHBondContact O-N 3.13Å
355	P	31.6	Very low	42.4	Very low	110 Å²	110	130.8 Å²	130.8	71%	0.714	71%	0.71	S	S	*	*			trans	-65.9	147.2	-176.9	-21.9	34.8	0	0	0	112.5	E353 D357	E353-P355 WeakPolarHBondContact O-CD 3.44Å; P355-D357 VanDerWaalsContact C-N 3.31Å; P355-D357 PolarHBondContact O-N 3.49Å
356	A	34.2	Very low	44.4	Very low	104 Å²	104	127.7 Å²	127.7	86%	0.86	68%	0.682	S	S	*	*	S	Bend	trans	-79.8	72.5	178.1	0	0	0	0	0	112.2
357	D	36	Very low	46.8	Very low	155 Å²	155	124.4 Å²	124.4	83%	0.829	65%	0.646	S	S	*	*			trans	-166.3	73.6	160	-109.2	-21.2	0	0	0	111.7	P355	P355-D357 VanDerWaalsContact C-N 3.31Å; P355-D357 PolarHBondContact O-N 3.49Å
358	E	39.3	Very low	48.8	Very low	173 Å²	173	117 Å²	117	81%	0.808	61%	0.611	S	S	*	*			trans	-114.4	110.3	164.4	-76	-160.9	147.3	0	0	110.9	L360	E358-L360 PolarHBondContact O-N 3.3Å
359	T	45.8	Very low	51.2	Low	133 Å²	133	113.4 Å²	113.4	82%	0.816	59%	0.59	S	S	*	*			trans	-79.3	107.4	176.5	54.8	0	0	0	0	110.6
360	L	49.7	Very low	53.5	Low	53 Å²	53	106.1 Å²	106.1	28%	0.277	55%	0.551	S	S	.	*			trans	-38.5	136.1	174.6	-72.6	167.2	0	0	0	113.2	L299 E358 D364 K365	L299-L360 HydrophobicContact CD1-CD1 4.26Å; L299-L360 HydrophobicContact CD1-CD2 3.96Å; E358-L360 PolarHBondContact O-N 3.3Å; L360-D364 HydrophobicContact CD2-CB 4.16Å; L360-K365 HydrophobicContact CB-CG 4.24Å; L360-K365 WeakPolarHBondContact O-CE 3.49Å; L360-K365 PolarHBondContact O-NZ 2.93Å
361	S	56.9	Low	55.9	Low	53 Å²	53	97.4 Å²	97.4	37%	0.371	51%	0.513	S	S	.	.			trans	-67.1	162.8	177.8	82.5	0	0	0	0	111.7	F363 D364 K365	S361-F363 PolarHBondContact O-N 3.25Å; S361-F363 PolarHBondContact OG-N 3.32Å; S361-D364 WeakPolarHBondContact CB-OD2 3.37Å; S361-D364 PolarHBondContact N-OD2 3.38Å; S361-D364 VanDerWaalsContact N-OD2 3.16Å; S361-D364 PolarHBondContact O-N 3.04Å; S361-D364 PolarHBondContact OG-N 3.25Å; S361-D364 PolarHBondContact OG-OD2 3.08Å; S361-K365 WeakPolarHBondContact O-CD 3.25Å; S361-K365 WeakPolarHBondContact O-CG 3.33Å; S361-K365 PolarHBondContact O-N 2.81Å; S361-K365 VanDerWaalsContact O-N 3.08Å
362	E	65.6	Low	58.3	Low	169 Å²	169	92 Å²	92	79%	0.79	49%	0.488	S	S	*	.	H	α-helix	trans	-63.8	-31.5	176.1	-61.3	-172.9	147.4	0	0	112	K365 E366	E362-K365 PolarHBondContact O-N 2.77Å; E362-E366 PolarHBondContact O-N 2.94Å
363	F	67.6	Low	60.7	Low	117 Å²	117	87.7 Å²	87.7	51%	0.513	47%	0.465	S	S	.	.	H	α-helix	trans	-68	-44.8	175.8	-171.2	-111.4	0	0	0	111.7	S361 K365 E366 I367	S361-F363 PolarHBondContact O-N 3.25Å; S361-F363 PolarHBondContact OG-N 3.32Å; F363-K365 VanDerWaalsContact C-N 3.28Å; F363-K365 PolarHBondContact O-N 3.27Å; F363-E366 PolarHBondContact O-N 3.43Å; F363-I367 HydrophobicContact CD1-CD1 3.76Å; F363-I367 HydrophobicContact CE1-CD1 3.41Å; F363-I367 VanDerWaalsContact CE1-CD1 3.41Å; F363-I367 HydrophobicContact CE2-CD1 4.43Å; F363-I367 HydrophobicContact CG-CD1 4.42Å; F363-I367 HydrophobicContact CZ-CD1 3.79Å; F363-I367 WeakPolarHBondContact O-CG1 3.29Å; F363-I367 PolarHBondContact O-N 3.37Å
364	D	69.4	Low	63.2	Low	54 Å²	54	78.8 Å²	78.8	29%	0.289	42%	0.423	S	S	.	.	H	α-helix	trans	-64.7	-34.7	176.4	-52.7	-50.8	0	0	0	111.6	L360 S361 K368	L360-D364 HydrophobicContact CD2-CB 4.16Å; S361-D364 WeakPolarHBondContact CB-OD2 3.37Å; S361-D364 PolarHBondContact N-OD2 3.38Å; S361-D364 VanDerWaalsContact N-OD2 3.16Å; S361-D364 PolarHBondContact O-N 3.04Å; S361-D364 PolarHBondContact OG-N 3.25Å; S361-D364 PolarHBondContact OG-OD2 3.08Å; D364-K368 VanDerWaalsContact O-CB 3.28Å; D364-K368 WeakPolarHBondContact O-CB 3.4Å; D364-K368 PolarHBondContact O-N 3Å
365	K	72.7	Confident	65.6	Low	111 Å²	111	74.5 Å²	74.5	48%	0.483	40%	0.403	S	S	.	.	H	α-helix	trans	-66.8	-41.8	173.9	-72.7	162.3	178.2	148.9	0	111.9	L360 S361 E362 F363 K368 S369	L360-K365 HydrophobicContact CB-CG 4.24Å; L360-K365 WeakPolarHBondContact O-CE 3.49Å; L360-K365 PolarHBondContact O-NZ 2.93Å; S361-K365 WeakPolarHBondContact O-CD 3.25Å; S361-K365 WeakPolarHBondContact O-CG 3.33Å; S361-K365 PolarHBondContact O-N 2.81Å; S361-K365 VanDerWaalsContact O-N 3.08Å; E362-K365 PolarHBondContact O-N 2.77Å; F363-K365 VanDerWaalsContact C-N 3.28Å; F363-K365 PolarHBondContact O-N 3.27Å; K365-K368 PolarHBondContact O-N 3.03Å; K365-S369 PolarHBondContact O-N 2.8Å
366	E	75.8	Confident	68.2	Low	58 Å²	58	70.7 Å²	70.7	27%	0.271	38%	0.379	S	S	.	.	H	α-helix	trans	-67.2	-41.8	175	-149.3	-156.2	158.9	0	0	111.2	E362 F363 K368 S369 R370 K844	E362-E366 PolarHBondContact O-N 2.94Å; F363-E366 PolarHBondContact O-N 3.43Å; E366-K368 PolarHBondContact O-N 3.44Å; E366-S369 WeakPolarHBondContact O-CB 3.48Å; E366-S369 PolarHBondContact O-N 2.7Å; E366-R370 VanDerWaalsContact O-CG 3.3Å; E366-R370 WeakPolarHBondContact O-CG 3.49Å; E366-R370 PolarHBondContact O-N 3.41Å; E366-R370 IonicContact OE1-CZ 2.76Å; E366-R370 IonicContact OE1-NE 2.93Å; E366-R370 PolarHBondContact OE1-NE 3.27Å; E366-R370 VanDerWaalsContact OE1-NE 3.08Å; E366-R370 IonicContact OE1-NH2 3.86Å; E366-R370 PolarHBondContact OE1-NH2 3.35Å; E366-R370 VanDerWaalsContact OE1-NH2 3.07Å; E366-R370 IonicContact OE2-CZ 2.89Å; E366-R370 IonicContact OE2-NE 3.07Å; E366-R370 IonicContact OE2-NH2 3.51Å; E366-R370 PolarHBondContact OE2-NH2 2.92Å; E366-K844 IonicContact OE1-NZ 2.73Å; E366-K844 PolarHBondContact OE1-NZ 2.86Å
367	I	76.3	Confident	70.7	Confident	10 Å²	10	65.7 Å²	65.7	5%	0.051	34%	0.338	C	S	.	.	H	α-helix	trans	-62.3	-42.4	174.5	-68.1	173	0	0	0	111.1	L255 L293 I296 F363 S369 R370 L371	L255-I367 HydrophobicContact CD2-CD1 4.1Å; L293-I367 HydrophobicContact CD2-CG2 4.24Å; I296-I367 HydrophobicContact CD1-CB 4.2Å; I296-I367 HydrophobicContact CD1-CG2 3.6Å; F363-I367 HydrophobicContact CD1-CD1 3.76Å; F363-I367 HydrophobicContact CE1-CD1 3.41Å; F363-I367 VanDerWaalsContact CE1-CD1 3.41Å; F363-I367 HydrophobicContact CE2-CD1 4.43Å; F363-I367 HydrophobicContact CG-CD1 4.42Å; F363-I367 HydrophobicContact CZ-CD1 3.79Å; F363-I367 WeakPolarHBondContact O-CG1 3.29Å; F363-I367 PolarHBondContact O-N 3.37Å; I367-S369 VanDerWaalsContact C-N 3.3Å; I367-S369 PolarHBondContact O-N 3.39Å; I367-R370 PolarHBondContact O-N 3.35Å; I367-L371 WeakPolarHBondContact O-CB 3.42Å; I367-L371 PolarHBondContact O-N 2.67Å
368	K	76.8	Confident	73	Confident	34 Å²	34	58.6 Å²	58.6	15%	0.148	30%	0.3	C	S	.	.	H	α-helix	trans	-58	-42.2	174.4	-170.1	-179.8	-178.2	-173.4	0	111.6	I296 I300 D303 D364 K365 E366 M372	I296-K368 HydrophobicContact CG2-CB 3.73Å; I296-K368 HydrophobicContact CG2-CG 3.84Å; I300-K368 HydrophobicContact CD1-CG 4.17Å; I300-K368 HydrophobicContact CG1-CD 4.44Å; I300-K368 HydrophobicContact CG1-CG 3.98Å; D303-K368 IonicContact OD2-NZ 2.63Å; D303-K368 PolarHBondContact OD2-NZ 3.36Å; D364-K368 VanDerWaalsContact O-CB 3.28Å; D364-K368 WeakPolarHBondContact O-CB 3.4Å; D364-K368 PolarHBondContact O-N 3Å; K365-K368 PolarHBondContact O-N 3.03Å; E366-K368 PolarHBondContact O-N 3.44Å; K368-M372 HydrophobicContact CD-CE 4.49Å; K368-M372 HydrophobicContact CG-CE 4.26Å; K368-M372 WeakPolarHBondContact O-CG 3.18Å; K368-M372 PolarHBondContact O-N 3.06Å
369	S	79.8	Confident	75.1	Confident	49 Å²	49	52.4 Å²	52.4	34%	0.343	28%	0.276	S	S	.	.	H	α-helix	trans	-64.3	-50.9	174.8	-178.5	0	0	0	0	112.1	K365 E366 I367 L371 M372 H373	K365-S369 PolarHBondContact O-N 2.8Å; E366-S369 WeakPolarHBondContact O-CB 3.48Å; E366-S369 PolarHBondContact O-N 2.7Å; I367-S369 VanDerWaalsContact C-N 3.3Å; I367-S369 PolarHBondContact O-N 3.39Å; S369-L371 VanDerWaalsContact C-N 3.27Å; S369-L371 PolarHBondContact O-N 3.28Å; S369-M372 PolarHBondContact O-N 2.94Å; S369-H373 PolarHBondContact O-CD2 2.88Å; S369-H373 PolarHBondContact O-N 2.97Å
370	R	81.2	Confident	76.9	Confident	15 Å²	15	46.1 Å²	46.1	6%	0.057	24%	0.237	C	C	.	.	H	α-helix	trans	-58	-39.6	177.3	-65.8	170.5	-174.2	-174.3	7.7	112.3	L254 A261 Y265 E366 I367 H373 L374	L254-R370 HydrophobicContact CD2-CB 4.09Å; L254-R370 PolarHBondContact O-NH1 3.12Å; L254-R370 VanDerWaalsContact O-NH1 3.13Å; A261-R370 HydrophobicContact CB-CG 4.36Å; Y265-R370 WeakPolarHBondContact OH-CA 3.31Å; E366-R370 VanDerWaalsContact O-CG 3.3Å; E366-R370 WeakPolarHBondContact O-CG 3.49Å; E366-R370 PolarHBondContact O-N 3.41Å; E366-R370 IonicContact OE1-CZ 2.76Å; E366-R370 IonicContact OE1-NE 2.93Å; E366-R370 PolarHBondContact OE1-NE 3.27Å; E366-R370 VanDerWaalsContact OE1-NE 3.08Å; E366-R370 IonicContact OE1-NH2 3.86Å; E366-R370 PolarHBondContact OE1-NH2 3.35Å; E366-R370 VanDerWaalsContact OE1-NH2 3.07Å; E366-R370 IonicContact OE2-CZ 2.89Å; E366-R370 IonicContact OE2-NE 3.07Å; E366-R370 IonicContact OE2-NH2 3.51Å; E366-R370 PolarHBondContact OE2-NH2 2.92Å; I367-R370 PolarHBondContact O-N 3.35Å; R370-H373 PolarHBondContact O-N 3.22Å; R370-L374 PolarHBondContact O-N 3Å
371	L	81.7	Confident	78.6	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-69.3	-42.3	177.8	-171.1	63.6	0	0	0	111.9	L254 L287 L293 I296 M297 I300 I367 S369 H373 L374 V375	L254-L371 HydrophobicContact CD1-CD1 4.08Å; L287-L371 HydrophobicContact CD2-CD1 3.76Å; L287-L371 HydrophobicContact CG-CD1 4.12Å; L293-L371 HydrophobicContact CB-CD2 4.46Å; L293-L371 HydrophobicContact CD1-CD1 4.04Å; L293-L371 HydrophobicContact CD2-CD2 4.36Å; I296-L371 HydrophobicContact CG2-CD2 4.17Å; M297-L371 HydrophobicContact CE-CD1 3.88Å; M297-L371 HydrophobicContact CE-CD2 3.82Å; M297-L371 HydrophobicContact CE-CG 4.01Å; M297-L371 HydrophobicContact CG-CD2 4.05Å; M297-L371 HydrophobicContact SD-CD2 3.98Å; I300-L371 HydrophobicContact CD1-CD2 4.1Å; I300-L371 HydrophobicContact CD1-CG 4.48Å; I367-L371 WeakPolarHBondContact O-CB 3.42Å; I367-L371 PolarHBondContact O-N 2.67Å; S369-L371 VanDerWaalsContact C-N 3.27Å; S369-L371 PolarHBondContact O-N 3.28Å; L371-H373 VanDerWaalsContact C-N 3.32Å; L371-H373 PolarHBondContact O-N 3.38Å; L371-L374 PolarHBondContact O-N 2.89Å; L371-V375 WeakPolarHBondContact O-CB 3.32Å; L371-V375 VanDerWaalsContact O-CG2 3.27Å; L371-V375 WeakPolarHBondContact O-CG2 3.49Å; L371-V375 PolarHBondContact O-N 2.67Å
372	M	83.1	Confident	80	Confident	78 Å²	78	47.5 Å²	47.5	38%	0.384	24%	0.238	S	C	.	.	H	α-helix	trans	-59.4	-42.7	171.3	-76.7	-175.3	-178.2	0	0	111.8	I300 K368 S369 V375 S376	I300-M372 HydrophobicContact CD1-CE 4.48Å; I300-M372 HydrophobicContact CD1-CG 4.1Å; I300-M372 HydrophobicContact CG1-CE 3.9Å; I300-M372 HydrophobicContact CG2-CE 4.28Å; K368-M372 HydrophobicContact CD-CE 4.49Å; K368-M372 HydrophobicContact CG-CE 4.26Å; K368-M372 WeakPolarHBondContact O-CG 3.18Å; K368-M372 PolarHBondContact O-N 3.06Å; S369-M372 PolarHBondContact O-N 2.94Å; M372-V375 PolarHBondContact O-N 3.4Å; M372-S376 VanDerWaalsContact O-CB 3.25Å; M372-S376 WeakPolarHBondContact O-CB 3.27Å; M372-S376 PolarHBondContact O-N 3.06Å
373	H	83.6	Confident	81.1	Confident	47 Å²	47	39.7 Å²	39.7	22%	0.218	20%	0.202	C	C	.	.	H	α-helix	trans	-62.6	-48.2	178.1	-72.7	-166.9	0	0	0	111.4	Y265 S369 R370 L371 S376 I377 L846	Y265-H373 HydrophobicContact CE1-CB 3.73Å; S369-H373 PolarHBondContact O-CD2 2.88Å; S369-H373 PolarHBondContact O-N 2.97Å; R370-H373 PolarHBondContact O-N 3.22Å; L371-H373 VanDerWaalsContact C-N 3.32Å; L371-H373 PolarHBondContact O-N 3.38Å; H373-S376 PolarHBondContact O-N 3.12Å; H373-I377 WeakPolarHBondContact O-CG1 3.4Å; H373-I377 PolarHBondContact O-N 3.39Å; H373-I377 VanDerWaalsContact O-N 3.15Å; H373-L846 HydrophobicContact CB-CD1 3.93Å
374	L	84.9	Confident	82.1	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63.9	-44	177.2	-175.8	64.6	0	0	0	112.2	L250 L254 A264 Y265 L287 R370 L371 S376 I377 L378	L250-L374 HydrophobicContact CB-CD2 4.33Å; L250-L374 HydrophobicContact CD1-CD2 4.4Å; L250-L374 HydrophobicContact CD2-CD1 4.48Å; L250-L374 HydrophobicContact CD2-CD2 4.21Å; L254-L374 HydrophobicContact CD1-CD2 3.78Å; L254-L374 HydrophobicContact CD2-CD2 4.41Å; L254-L374 HydrophobicContact CG-CD2 4.29Å; A264-L374 WeakPolarHBondContact O-CD1 3.39Å; Y265-L374 HydrophobicContact CD1-CB 4.39Å; Y265-L374 HydrophobicContact CD1-CD1 4.5Å; Y265-L374 HydrophobicContact CE1-CB 4.4Å; L287-L374 HydrophobicContact CD2-CD2 4.11Å; R370-L374 PolarHBondContact O-N 3Å; L371-L374 PolarHBondContact O-N 2.89Å; L374-S376 VanDerWaalsContact C-N 3.3Å; L374-S376 PolarHBondContact O-N 2.9Å; L374-I377 PolarHBondContact O-N 3.49Å; L374-I377 VanDerWaalsContact O-N 3.12Å; L374-L378 HydrophobicContact CD1-CD1 4.39Å; L374-L378 HydrophobicContact CD1-CG 4.34Å; L374-L378 HydrophobicContact CD2-CD1 4.44Å; L374-L378 HydrophobicContact CG-CD1 3.98Å; L374-L378 HydrophobicContact CG-CG 4.34Å; L374-L378 WeakPolarHBondContact O-CG 3.43Å; L374-L378 PolarHBondContact O-N 3.48Å
375	V	85.7	Confident	82.9	Confident	40 Å²	40	34.6 Å²	34.6	24%	0.242	18%	0.178	C	C	.	.	H	α-helix	trans	-61.2	-39.7	177.1	169.8	0	0	0	0	111.2	M297 L371 M372 I377 L378 S379	M297-V375 HydrophobicContact CE-CG2 4.28Å; L371-V375 WeakPolarHBondContact O-CB 3.32Å; L371-V375 VanDerWaalsContact O-CG2 3.27Å; L371-V375 WeakPolarHBondContact O-CG2 3.49Å; L371-V375 PolarHBondContact O-N 2.67Å; M372-V375 PolarHBondContact O-N 3.4Å; V375-I377 PolarHBondContact O-N 3.29Å; V375-L378 PolarHBondContact O-N 3.07Å; V375-S379 WeakPolarHBondContact O-CB 3.5Å; V375-S379 PolarHBondContact O-N 2.94Å; V375-S379 PolarHBondContact O-OG 3.16Å; V375-S379 VanDerWaalsContact O-OG 3.09Å
376	S	85.3	Confident	83.8	Confident	30 Å²	30	29.8 Å²	29.8	21%	0.21	16%	0.158	C	C	.	.	H	α-helix	trans	-72.8	-12	177.4	-169.8	0	0	0	0	114.5	M372 H373 L374 S379 K382	M372-S376 VanDerWaalsContact O-CB 3.25Å; M372-S376 WeakPolarHBondContact O-CB 3.27Å; M372-S376 PolarHBondContact O-N 3.06Å; H373-S376 PolarHBondContact O-N 3.12Å; L374-S376 VanDerWaalsContact C-N 3.3Å; L374-S376 PolarHBondContact O-N 2.9Å; S376-S379 WeakPolarHBondContact CA-OG 3Å; S376-K382 WeakPolarHBondContact O-CB 3.36Å; S376-K382 PolarHBondContact O-N 3.02Å; S376-K382 WeakPolarHBondContact OG-CG 3.3Å
377	I	87.5	Confident	84.5	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-88.7	-47.5	168.8	-66.1	163.4	0	0	0	109.5	Y265 G268 F269 H373 L374 V375 S379 G380 L846	Y265-I377 HydrophobicContact CD1-CD1 4.03Å; Y265-I377 HydrophobicContact CG-CD1 4.03Å; G268-I377 VanDerWaalsContact C-CG2 3.41Å; F269-I377 HydrophobicContact CD1-CG2 3.67Å; F269-I377 HydrophobicContact CD2-CD1 4.29Å; F269-I377 HydrophobicContact CD2-CG2 4.26Å; F269-I377 HydrophobicContact CE1-CB 4.48Å; F269-I377 HydrophobicContact CE1-CD1 4.45Å; F269-I377 HydrophobicContact CE1-CG1 3.98Å; F269-I377 HydrophobicContact CE1-CG2 3.81Å; F269-I377 HydrophobicContact CE2-CD1 3.63Å; F269-I377 HydrophobicContact CE2-CG1 4.07Å; F269-I377 HydrophobicContact CE2-CG2 4.37Å; F269-I377 HydrophobicContact CG-CG2 3.9Å; F269-I377 HydrophobicContact CZ-CD1 3.73Å; F269-I377 HydrophobicContact CZ-CG1 3.65Å; F269-I377 HydrophobicContact CZ-CG2 4.16Å; H373-I377 WeakPolarHBondContact O-CG1 3.4Å; H373-I377 PolarHBondContact O-N 3.39Å; H373-I377 VanDerWaalsContact O-N 3.15Å; L374-I377 PolarHBondContact O-N 3.49Å; L374-I377 VanDerWaalsContact O-N 3.12Å; V375-I377 PolarHBondContact O-N 3.29Å; I377-S379 VanDerWaalsContact C-N 3.26Å; I377-S379 PolarHBondContact O-N 3.5Å; I377-G380 PolarHBondContact O-N 3.26Å; I377-L846 HydrophobicContact CD1-CD1 3.98Å; I377-L846 HydrophobicContact CD1-CD2 4Å; I377-L846 HydrophobicContact CG1-CD1 4.14Å
378	L	84.7	Confident	85.1	Confident	6 Å²	6	29.1 Å²	29.1	3%	0.031	16%	0.155	C	C	.	.	H	α-helix	trans	-65.4	-25.5	179.8	-68.2	174.6	0	0	0	113.4	L271 L280 V283 L374 V375	L271-L378 HydrophobicContact CB-CD2 4.33Å; L271-L378 HydrophobicContact CD1-CD2 4.16Å; L280-L378 HydrophobicContact CD2-CD2 4.16Å; V283-L378 HydrophobicContact CG1-CD1 4.46Å; L374-L378 HydrophobicContact CD1-CD1 4.39Å; L374-L378 HydrophobicContact CD1-CG 4.34Å; L374-L378 HydrophobicContact CD2-CD1 4.44Å; L374-L378 HydrophobicContact CG-CD1 3.98Å; L374-L378 HydrophobicContact CG-CG 4.34Å; L374-L378 WeakPolarHBondContact O-CG 3.43Å; L374-L378 PolarHBondContact O-N 3.48Å; V375-L378 PolarHBondContact O-N 3.07Å
379	S	83.1	Confident	85.6	Confident	43 Å²	43	28.3 Å²	28.3	30%	0.301	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-13.9	173.1	62.8	0	0	0	0	114.2	V375 S376 I377 D381 H504	V375-S379 WeakPolarHBondContact O-CB 3.5Å; V375-S379 PolarHBondContact O-N 2.94Å; V375-S379 PolarHBondContact O-OG 3.16Å; V375-S379 VanDerWaalsContact O-OG 3.09Å; S376-S379 WeakPolarHBondContact CA-OG 3Å; I377-S379 VanDerWaalsContact C-N 3.26Å; I377-S379 PolarHBondContact O-N 3.5Å; S379-D381 WeakPolarHBondContact CB-OD1 3.3Å; S379-D381 PolarHBondContact OG-OD1 3.15Å; S379-H504 PolarHBondContact O-CD2 2.9Å; S379-H504 VanDerWaalsContact O-CD2 3.25Å
380	G	83.6	Confident	86.1	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.135	C	C	.	.	S	Bend	trans	90.5	-20.4	178.5	0	0	0	0	0	116.2	I377 K382 V383 I384	I377-G380 PolarHBondContact O-N 3.26Å; G380-K382 PolarHBondContact O-N 3.35Å; G380-V383 WeakPolarHBondContact O-CA 3.34Å; G380-V383 WeakPolarHBondContact O-CB 3.46Å; G380-V383 PolarHBondContact O-N 3.06Å; G380-I384 PolarHBondContact O-N 3.28Å
381	D	84.7	Confident	86.5	Confident	75 Å²	75	25.7 Å²	25.7	40%	0.401	14%	0.135	S	C	.	.	H	α-helix	trans	-44.3	-46.8	-177.3	-53.6	40	0	0	0	112.5	S379 E385	S379-D381 WeakPolarHBondContact CB-OD1 3.3Å; S379-D381 PolarHBondContact OG-OD1 3.15Å; D381-E385 WeakPolarHBondContact O-CB 3.35Å; D381-E385 PolarHBondContact O-N 2.92Å
382	K	85.9	Confident	86.9	Confident	61 Å²	61	26.9 Å²	26.9	27%	0.265	14%	0.141	S	C	.	.	H	α-helix	trans	-74.3	-32.5	-178.7	-77.2	-75	163.5	-166.1	0	113.4	S376 G380 E385 L386	S376-K382 WeakPolarHBondContact O-CB 3.36Å; S376-K382 PolarHBondContact O-N 3.02Å; S376-K382 WeakPolarHBondContact OG-CG 3.3Å; G380-K382 PolarHBondContact O-N 3.35Å; K382-E385 IonicContact NZ-OE2 2.72Å; K382-E385 PolarHBondContact NZ-OE2 3.13Å; K382-L386 WeakPolarHBondContact O-CB 3.3Å; K382-L386 WeakPolarHBondContact O-CD1 3.24Å; K382-L386 WeakPolarHBondContact O-CG 3.35Å; K382-L386 PolarHBondContact O-N 3.2Å
383	V	88.9	Confident	87	Confident	5 Å²	5	25.9 Å²	25.9	3%	0.03	13%	0.133	C	C	.	.	H	α-helix	trans	-69.3	-44.1	177.2	-174.2	0	0	0	0	109.9	F269 Y272 G380 L386 H387 I990	F269-V383 HydrophobicContact CD1-CG2 3.72Å; F269-V383 HydrophobicContact CE1-CG2 3.8Å; Y272-V383 HydrophobicContact CD1-CB 4.04Å; Y272-V383 HydrophobicContact CD1-CG1 3.84Å; Y272-V383 HydrophobicContact CD1-CG2 3.73Å; Y272-V383 HydrophobicContact CE1-CB 3.78Å; Y272-V383 HydrophobicContact CE1-CG1 3.48Å; Y272-V383 VanDerWaalsContact CE1-CG1 3.48Å; Y272-V383 HydrophobicContact CE1-CG2 4Å; Y272-V383 HydrophobicContact CG-CG2 4.11Å; G380-V383 WeakPolarHBondContact O-CA 3.34Å; G380-V383 WeakPolarHBondContact O-CB 3.46Å; G380-V383 PolarHBondContact O-N 3.06Å; V383-L386 PolarHBondContact O-N 3.09Å; V383-H387 WeakPolarHBondContact O-CB 3.42Å; V383-H387 PolarHBondContact O-CD2 3.34Å; V383-H387 PolarHBondContact O-N 3.21Å; V383-I990 HydrophobicContact CB-CD1 4.43Å; V383-I990 HydrophobicContact CG1-CD1 3.93Å; V383-I990 HydrophobicContact CG2-CD1 4.36Å
384	I	88.6	Confident	87.1	Confident	22 Å²	22	25.3 Å²	25.3	11%	0.113	13%	0.132	C	C	.	.	H	α-helix	trans	-60.7	-51.7	173.3	-70	-178.7	0	0	0	110.8	G380 L386 H387 L388 G463 E465 H504	G380-I384 PolarHBondContact O-N 3.28Å; I384-L386 VanDerWaalsContact C-N 3.27Å; I384-L386 PolarHBondContact O-N 3Å; I384-H387 PolarHBondContact O-N 3.15Å; I384-L388 VanDerWaalsContact O-CB 3.25Å; I384-L388 WeakPolarHBondContact O-CB 3.39Å; I384-L388 PolarHBondContact O-N 2.93Å; I384-G463 VanDerWaalsContact CG2-CA 3.4Å; I384-G463 WeakPolarHBondContact CG2-O 3.44Å; I384-E465 WeakPolarHBondContact CD1-OE1 3.35Å; I384-H504 HydrophobicContact CD1-CB 4.27Å; I384-H504 VanDerWaalsContact CD1-CD2 3.43Å; I384-H504 WeakPolarHBondContact CD1-CD2 3.38Å; I384-H504 VanDerWaalsContact CD1-CG 3.45Å
385	E	87.7	Confident	87.2	Confident	41 Å²	41	27.3 Å²	27.3	19%	0.192	14%	0.142	C	C	.	.	H	α-helix	trans	-55.3	-43.7	179.5	-176.5	165.6	-114.2	0	0	111.1	D381 K382 Q389 K466	D381-E385 WeakPolarHBondContact O-CB 3.35Å; D381-E385 PolarHBondContact O-N 2.92Å; K382-E385 IonicContact NZ-OE2 2.72Å; K382-E385 PolarHBondContact NZ-OE2 3.13Å; E385-Q389 HydrophobicContact CG-CG 4.49Å; E385-Q389 WeakPolarHBondContact O-CB 3.19Å; E385-Q389 WeakPolarHBondContact O-CG 3.09Å; E385-Q389 PolarHBondContact O-N 3.25Å; E385-K466 IonicContact OE1-NZ 3.37Å; E385-K466 PolarHBondContact OE1-NZ 3.08Å
386	L	90.1	Very high	87.1	Confident	10 Å²	10	31 Å²	31	5%	0.052	16%	0.155	C	C	.	.	H	α-helix	trans	-70	-38.4	178.7	-69.8	168	0	0	0	113.8	K382 V383 I384 F390 I840 L842 M848 I990	K382-L386 WeakPolarHBondContact O-CB 3.3Å; K382-L386 WeakPolarHBondContact O-CD1 3.24Å; K382-L386 WeakPolarHBondContact O-CG 3.35Å; K382-L386 PolarHBondContact O-N 3.2Å; V383-L386 PolarHBondContact O-N 3.09Å; I384-L386 VanDerWaalsContact C-N 3.27Å; I384-L386 PolarHBondContact O-N 3Å; L386-F390 PolarHBondContact O-N 3.35Å; L386-I840 HydrophobicContact CB-CD1 4.09Å; L386-I840 HydrophobicContact CD2-CG2 4.36Å; L386-L842 HydrophobicContact CD1-CD1 3.61Å; L386-L842 HydrophobicContact CD1-CD2 3.77Å; L386-L842 HydrophobicContact CD1-CG 4.21Å; L386-L842 HydrophobicContact CD2-CD2 3.8Å; L386-L842 HydrophobicContact CG-CD2 4.47Å; L386-M848 HydrophobicContact CD2-CE 4.14Å; L386-M848 HydrophobicContact CD2-CG 3.93Å; L386-M848 HydrophobicContact CD2-SD 3.94Å; L386-I990 HydrophobicContact CD1-CD1 4.06Å
387	H	90.7	Very high	86.9	Confident	39 Å²	39	30.3 Å²	30.3	18%	0.181	15%	0.151	C	C	.	.	H	α-helix	trans	-68.7	-42.1	175.4	-74.1	-31.6	0	0	0	112.4	V383 I384 F390 L391 P836	V383-H387 WeakPolarHBondContact O-CB 3.42Å; V383-H387 PolarHBondContact O-CD2 3.34Å; V383-H387 PolarHBondContact O-N 3.21Å; I384-H387 PolarHBondContact O-N 3.15Å; H387-F390 WeakPolarHBondContact O-CB 3.41Å; H387-F390 PolarHBondContact O-N 2.85Å; H387-L391 WeakPolarHBondContact O-CG 3.49Å; H387-L391 PolarHBondContact O-N 3.09Å; H387-P836 HydrophobicContact CB-CG 4.33Å
388	L	89.9	Confident	86.6	Confident	16 Å²	16	31.2 Å²	31.2	8%	0.084	16%	0.156	C	C	.	.	H	α-helix	trans	-59.3	-47.5	172.6	179.1	63.8	0	0	0	110.9	I384 F390 L391 I392 G428 T430 H464	I384-L388 VanDerWaalsContact O-CB 3.25Å; I384-L388 WeakPolarHBondContact O-CB 3.39Å; I384-L388 PolarHBondContact O-N 2.93Å; L388-F390 VanDerWaalsContact C-N 3.28Å; L388-F390 PolarHBondContact O-N 2.96Å; L388-L391 PolarHBondContact O-N 2.89Å; L388-I392 HydrophobicContact CD1-CD1 3.8Å; L388-I392 HydrophobicContact CD1-CG1 4.22Å; L388-I392 HydrophobicContact CG-CD1 3.73Å; L388-I392 WeakPolarHBondContact O-CD1 3.45Å; L388-I392 VanDerWaalsContact O-CG1 3.29Å; L388-I392 WeakPolarHBondContact O-CG1 3.41Å; L388-I392 PolarHBondContact O-N 3.06Å; L388-G428 WeakPolarHBondContact CD1-O 3.48Å; L388-T430 HydrophobicContact CD1-CG2 3.87Å; L388-H464 HydrophobicContact CD2-CB 4.16Å
389	Q	86.6	Confident	86.5	Confident	17 Å²	17	33.6 Å²	33.6	8%	0.079	17%	0.168	C	C	.	.	H	α-helix	trans	-58.3	-36.2	174.6	-78.2	-63.4	-48.2	0	0	112.8	E385 R393 M848 N1007 V1008	E385-Q389 HydrophobicContact CG-CG 4.49Å; E385-Q389 WeakPolarHBondContact O-CB 3.19Å; E385-Q389 WeakPolarHBondContact O-CG 3.09Å; E385-Q389 PolarHBondContact O-N 3.25Å; Q389-R393 VanDerWaalsContact C-NH1 3.33Å; Q389-R393 VanDerWaalsContact CB-NH1 3.35Å; Q389-R393 PolarHBondContact O-N 3.01Å; Q389-R393 PolarHBondContact O-NH1 2.83Å; Q389-R393 VanDerWaalsContact OE1-CZ 3.26Å; Q389-M848 HydrophobicContact CB-CE 4.31Å; Q389-N1007 PolarHBondContact OE1-OD1 3.06Å; Q389-V1008 PolarHBondContact NE2-O 2.89Å
390	F	90.3	Very high	86.5	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-69.2	-48.7	173.4	163.1	-101.6	0	0	0	112.4	L386 H387 L388 R393 N394 N794 P836 A838 I840 P960 R962	L386-F390 PolarHBondContact O-N 3.35Å; H387-F390 WeakPolarHBondContact O-CB 3.41Å; H387-F390 PolarHBondContact O-N 2.85Å; L388-F390 VanDerWaalsContact C-N 3.28Å; L388-F390 PolarHBondContact O-N 2.96Å; F390-R393 PolarHBondContact O-N 3.3Å; F390-N394 WeakPolarHBondContact CD2-ND2 3.29Å; F390-N394 HydrophobicContact CE2-CB 4.38Å; F390-N394 WeakPolarHBondContact CE2-ND2 3.33Å; F390-N394 WeakPolarHBondContact O-CB 3.04Å; F390-N394 PolarHBondContact O-N 2.96Å; F390-N794 HydrophobicContact CE1-CB 3.78Å; F390-N794 HydrophobicContact CZ-CB 3.95Å; F390-P836 HydrophobicContact CD1-CB 4.17Å; F390-P836 HydrophobicContact CE1-CB 4.04Å; F390-A838 HydrophobicContact CD1-CB 3.77Å; F390-A838 HydrophobicContact CD2-CB 3.93Å; F390-A838 HydrophobicContact CE1-CB 3.76Å; F390-A838 HydrophobicContact CE2-CB 3.94Å; F390-A838 HydrophobicContact CG-CB 3.85Å; F390-A838 HydrophobicContact CZ-CB 3.85Å; F390-I840 HydrophobicContact CB-CD1 4.22Å; F390-P960 HydrophobicContact CB-CB 4.44Å; F390-P960 HydrophobicContact CB-CG 4.42Å; F390-P960 HydrophobicContact CD2-CB 4.1Å; F390-P960 HydrophobicContact CD2-CG 4.38Å; F390-R962 HydrophobicContact CE2-CB 4.32Å; F390-R962 HydrophobicContact CZ-CB 4.19Å
391	L	90.9	Very high	86.6	Confident	8 Å²	8	37.3 Å²	37.3	4%	0.042	18%	0.177	C	C	.	.	H	α-helix	trans	-65.2	-40.5	-177.5	-69.2	175.9	0	0	0	112.7	H387 L388 N395 G428 T429 N794 M795	H387-L391 WeakPolarHBondContact O-CG 3.49Å; H387-L391 PolarHBondContact O-N 3.09Å; L388-L391 PolarHBondContact O-N 2.89Å; L391-N395 PolarHBondContact O-N 2.89Å; L391-N395 VanDerWaalsContact O-N 3.1Å; L391-G428 WeakPolarHBondContact CB-O 3.35Å; L391-T429 HydrophobicContact CB-CG2 4.46Å; L391-N794 HydrophobicContact CD2-CB 3.84Å; L391-M795 HydrophobicContact CD1-CE 4.16Å; L391-M795 HydrophobicContact CD1-SD 4.11Å; L391-M795 HydrophobicContact CD2-CG 4Å; L391-M795 HydrophobicContact CD2-SD 4.41Å
392	I	88.9	Confident	86.7	Confident	26 Å²	26	33.8 Å²	33.8	13%	0.133	16%	0.158	C	C	.	.	H	α-helix	trans	-60.5	-47.7	175.9	-68	161.5	0	0	0	111	L388 V1008	L388-I392 HydrophobicContact CD1-CD1 3.8Å; L388-I392 HydrophobicContact CD1-CG1 4.22Å; L388-I392 HydrophobicContact CG-CD1 3.73Å; L388-I392 WeakPolarHBondContact O-CD1 3.45Å; L388-I392 VanDerWaalsContact O-CG1 3.29Å; L388-I392 WeakPolarHBondContact O-CG1 3.41Å; L388-I392 PolarHBondContact O-N 3.06Å; I392-V1008 HydrophobicContact CG2-CB 4.4Å; I392-V1008 HydrophobicContact CG2-CG1 3.81Å
393	R	86.3	Confident	86.8	Confident	57 Å²	57	35 Å²	35	22%	0.215	17%	0.165	C	C	.	.	H	α-helix	trans	-68.5	-38.3	-179	-75.4	-176.4	-169.8	74.9	-7	113.1	Q389 F390 E1006 V1008	Q389-R393 VanDerWaalsContact C-NH1 3.33Å; Q389-R393 VanDerWaalsContact CB-NH1 3.35Å; Q389-R393 PolarHBondContact O-N 3.01Å; Q389-R393 PolarHBondContact O-NH1 2.83Å; Q389-R393 VanDerWaalsContact OE1-CZ 3.26Å; F390-R393 PolarHBondContact O-N 3.3Å; R393-E1006 PolarHBondContact NH2-O 3.17Å; R393-V1008 HydrophobicContact CG-CG2 4.04Å
394	N	85.8	Confident	86.7	Confident	36 Å²	36	38.5 Å²	38.5	19%	0.193	18%	0.177	C	C	.	.	H	α-helix	trans	-100.8	12	-170.5	-71	-42.2	0	0	0	114.1	F390 K396 N794 P960	F390-N394 WeakPolarHBondContact CD2-ND2 3.29Å; F390-N394 HydrophobicContact CE2-CB 4.38Å; F390-N394 WeakPolarHBondContact CE2-ND2 3.33Å; F390-N394 WeakPolarHBondContact O-CB 3.04Å; F390-N394 PolarHBondContact O-N 2.96Å; N394-K396 WeakPolarHBondContact O-CG 3.21Å; N394-K396 PolarHBondContact O-N 3.09Å; N394-K396 VanDerWaalsContact O-N 3.16Å; N394-N794 PolarHBondContact O-ND2 3.13Å; N394-P960 PolarHBondContact ND2-O 3.12Å
395	N	85.1	Confident	86.6	Confident	42 Å²	42	37.5 Å²	37.5	23%	0.225	17%	0.172	C	C	.	.			trans	-53.3	122.2	175.8	-175.4	5.6	0	0	0	111.5	L391 A397 T429	L391-N395 PolarHBondContact O-N 2.89Å; L391-N395 VanDerWaalsContact O-N 3.1Å; N395-A397 WeakPolarHBondContact OD1-CB 3.46Å; N395-A397 PolarHBondContact OD1-N 3.21Å; N395-T429 HydrophobicContact CB-CG2 4.43Å
396	K	85	Confident	86.7	Confident	117 Å²	117	37.9 Å²	37.9	51%	0.509	17%	0.172	S	C	.	.			trans	-130.9	20.7	174.8	-60.6	-70.4	159	-98.5	0	112.3	N394 D398 G792 Y864	N394-K396 WeakPolarHBondContact O-CG 3.21Å; N394-K396 PolarHBondContact O-N 3.09Å; N394-K396 VanDerWaalsContact O-N 3.16Å; K396-D398 PolarHBondContact O-N 3.39Å; K396-G792 PolarHBondContact N-O 2.63Å; K396-Y864 HydrophobicContact CB-CD1 4.39Å; K396-Y864 HydrophobicContact CG-CD1 4.31Å; K396-Y864 HydrophobicContact CG-CE1 4.17Å
397	A	81.1	Confident	86.5	Confident	15 Å²	15	42.4 Å²	42.4	12%	0.124	20%	0.196	C	C	.	.			trans	-61.3	131.8	172.9	0	0	0	0	0	110.3	N395 L399 M425 H426	N395-A397 WeakPolarHBondContact OD1-CB 3.46Å; N395-A397 PolarHBondContact OD1-N 3.21Å; A397-L399 PolarHBondContact O-N 3.48Å; A397-M425 HydrophobicContact CB-CB 4.49Å; A397-M425 HydrophobicContact CB-CE 4.41Å; A397-H426 VanDerWaalsContact CB-CE1 3.49Å; A397-H426 WeakPolarHBondContact CB-CE1 3.45Å
398	D	81	Confident	86.3	Confident	20 Å²	20	43.3 Å²	43.3	11%	0.107	20%	0.2	C	C	.	.			trans	-88	99.6	179.6	-166.1	0.1	0	0	0	110.8	K396 R400 L401 L868	K396-D398 PolarHBondContact O-N 3.39Å; D398-R400 PolarHBondContact O-N 2.96Å; D398-R400 VanDerWaalsContact O-N 3.07Å; D398-R400 WeakPolarHBondContact OD1-CB 3.48Å; D398-R400 WeakPolarHBondContact OD1-CG 3.38Å; D398-R400 PolarHBondContact OD1-N 3.2Å; D398-R400 VanDerWaalsContact OD1-N 3.13Å; D398-R400 IonicContact OD1-NH1 3.66Å; D398-L401 HydrophobicContact CB-CB 4.38Å; D398-L401 VanDerWaalsContact O-CB 3.29Å; D398-L401 WeakPolarHBondContact O-CB 3.37Å; D398-L401 PolarHBondContact O-N 3.47Å; D398-L868 PolarHBondContact OD2-N 2.8Å
399	L	83	Confident	85.9	Confident	56 Å²	56	43.5 Å²	43.5	29%	0.293	20%	0.202	S	C	.	.	H	α-helix	trans	-52.7	-28.7	174.6	-72.5	154.6	0	0	0	112.4	A397 L401 L402 E403 F434	A397-L399 PolarHBondContact O-N 3.48Å; L399-L401 VanDerWaalsContact C-N 3.3Å; L399-L401 PolarHBondContact O-N 3.45Å; L399-L402 PolarHBondContact O-N 3.36Å; L399-E403 WeakPolarHBondContact O-CG 3.43Å; L399-E403 PolarHBondContact O-N 3.28Å; L399-F434 HydrophobicContact CD2-CB 4.12Å
400	R	83.2	Confident	85.7	Confident	108 Å²	108	51.8 Å²	51.8	41%	0.408	23%	0.232	S	C	.	.	H	α-helix	trans	-70.3	-25.1	178.8	-54.6	-175.7	-169.4	91.3	3.5	113.3	D398 R404	D398-R400 PolarHBondContact O-N 2.96Å; D398-R400 VanDerWaalsContact O-N 3.07Å; D398-R400 WeakPolarHBondContact OD1-CB 3.48Å; D398-R400 WeakPolarHBondContact OD1-CG 3.38Å; D398-R400 PolarHBondContact OD1-N 3.2Å; D398-R400 VanDerWaalsContact OD1-N 3.13Å; D398-R400 IonicContact OD1-NH1 3.66Å; R400-R404 WeakPolarHBondContact O-CB 3.29Å; R400-R404 PolarHBondContact O-N 3.34Å; R400-R404 VanDerWaalsContact O-N 3.09Å
401	L	85.2	Confident	85.4	Confident	13 Å²	13	56.7 Å²	56.7	7%	0.068	26%	0.255	C	S	.	.	H	α-helix	trans	-66.8	-43.8	172.1	179.5	58.9	0	0	0	109.9	D398 L399 R404 I405 M425 L765 C785 D789	D398-L401 HydrophobicContact CB-CB 4.38Å; D398-L401 VanDerWaalsContact O-CB 3.29Å; D398-L401 WeakPolarHBondContact O-CB 3.37Å; D398-L401 PolarHBondContact O-N 3.47Å; L399-L401 VanDerWaalsContact C-N 3.3Å; L399-L401 PolarHBondContact O-N 3.45Å; L401-R404 PolarHBondContact O-N 3.16Å; L401-I405 HydrophobicContact CD1-CD1 4.03Å; L401-I405 HydrophobicContact CD1-CG1 4.43Å; L401-I405 HydrophobicContact CG-CD1 3.98Å; L401-I405 VanDerWaalsContact O-CG1 3.27Å; L401-I405 WeakPolarHBondContact O-CG1 3.28Å; L401-I405 PolarHBondContact O-N 2.85Å; L401-M425 HydrophobicContact CB-CE 4.48Å; L401-M425 HydrophobicContact CD2-CE 4.1Å; L401-L765 HydrophobicContact CD1-CD2 3.68Å; L401-L765 HydrophobicContact CD1-CG 4.45Å; L401-C785 HydrophobicContact CD2-CB 4.49Å; L401-D789 WeakPolarHBondContact CD2-OD2 3.46Å
402	L	86.5	Confident	85.1	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-68	-41.4	177	-68.5	171.8	0	0	0	112.4	L399 R404 I405 R406 N422 M425 F434	L399-L402 PolarHBondContact O-N 3.36Å; L402-R404 VanDerWaalsContact C-N 3.33Å; L402-R404 PolarHBondContact O-N 2.92Å; L402-I405 PolarHBondContact O-N 2.7Å; L402-R406 WeakPolarHBondContact O-CB 3.32Å; L402-R406 PolarHBondContact O-N 3.06Å; L402-N422 HydrophobicContact CD1-CB 4.04Å; L402-N422 WeakPolarHBondContact CD1-OD1 3.47Å; L402-N422 HydrophobicContact CD2-CB 3.98Å; L402-M425 HydrophobicContact CD1-CE 4.29Å; L402-M425 HydrophobicContact CD1-SD 4.14Å; L402-M425 HydrophobicContact CD2-SD 3.6Å; L402-M425 VanDerWaalsContact CD2-SD 3.6Å; L402-M425 HydrophobicContact CG-CE 4.06Å; L402-M425 HydrophobicContact CG-SD 3.78Å; L402-F434 HydrophobicContact CB-CD2 3.8Å; L402-F434 HydrophobicContact CB-CE2 3.64Å; L402-F434 HydrophobicContact CB-CG 4.45Å; L402-F434 HydrophobicContact CB-CZ 4.15Å; L402-F434 HydrophobicContact CD1-CD2 4.36Å; L402-F434 HydrophobicContact CD1-CG 4.24Å
403	E	87.4	Confident	85	Confident	88 Å²	88	61.6 Å²	61.6	41%	0.411	29%	0.29	S	S	.	.	H	α-helix	trans	-55.5	-46.5	171.4	-71.2	177.1	149	0	0	111.7	L399 R406 D407	L399-E403 WeakPolarHBondContact O-CG 3.43Å; L399-E403 PolarHBondContact O-N 3.28Å; E403-R406 WeakPolarHBondContact O-CB 3.47Å; E403-R406 PolarHBondContact O-N 3.37Å; E403-D407 PolarHBondContact O-N 3.21Å
404	R	87	Confident	85.1	Confident	77 Å²	77	59 Å²	59	29%	0.291	28%	0.281	S	S	.	.	H	α-helix	trans	-66	-45	179.1	-179.2	173.9	173.4	-147.5	-21.6	112.3	R400 L401 L402 R406 D407 E408 L765	R400-R404 WeakPolarHBondContact O-CB 3.29Å; R400-R404 PolarHBondContact O-N 3.34Å; R400-R404 VanDerWaalsContact O-N 3.09Å; L401-R404 PolarHBondContact O-N 3.16Å; L402-R404 VanDerWaalsContact C-N 3.33Å; L402-R404 PolarHBondContact O-N 2.92Å; R404-R406 VanDerWaalsContact C-N 3.32Å; R404-R406 PolarHBondContact O-N 3.5Å; R404-D407 PolarHBondContact O-N 3.35Å; R404-E408 IonicContact CZ-OE1 3.2Å; R404-E408 IonicContact NE-OE1 3.85Å; R404-E408 PolarHBondContact NE-OE1 3.47Å; R404-E408 IonicContact NE-OE2 2.61Å; R404-E408 IonicContact NH2-OE1 2.81Å; R404-E408 PolarHBondContact NH2-OE1 2.94Å; R404-E408 IonicContact NH2-OE2 3.45Å; R404-E408 PolarHBondContact O-N 3.34Å; R404-L765 PolarHBondContact NH2-O 3.06Å
405	I	88.1	Confident	85.4	Confident	1 Å²	1	58 Å²	58	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-61.2	-43.1	178.1	-68.7	168	0	0	0	110.1	L401 L402 D407 E408 V409 T418 I768 I782 C785	L401-I405 HydrophobicContact CD1-CD1 4.03Å; L401-I405 HydrophobicContact CD1-CG1 4.43Å; L401-I405 HydrophobicContact CG-CD1 3.98Å; L401-I405 VanDerWaalsContact O-CG1 3.27Å; L401-I405 WeakPolarHBondContact O-CG1 3.28Å; L401-I405 PolarHBondContact O-N 2.85Å; L402-I405 PolarHBondContact O-N 2.7Å; I405-D407 VanDerWaalsContact C-N 3.29Å; I405-D407 PolarHBondContact O-N 2.92Å; I405-E408 PolarHBondContact O-N 2.89Å; I405-V409 HydrophobicContact CG2-CG2 4.13Å; I405-V409 WeakPolarHBondContact O-CB 3.34Å; I405-V409 WeakPolarHBondContact O-CG2 3.42Å; I405-V409 PolarHBondContact O-N 2.92Å; I405-V409 VanDerWaalsContact O-N 3.13Å; I405-T418 HydrophobicContact CG2-CG2 3.91Å; I405-I768 HydrophobicContact CD1-CD1 4.28Å; I405-I768 HydrophobicContact CG1-CD1 4.13Å; I405-I768 HydrophobicContact CG2-CG2 4.48Å; I405-I782 HydrophobicContact CG2-CD1 4.27Å; I405-I782 HydrophobicContact CG2-CG1 3.99Å; I405-I782 HydrophobicContact CG2-CG2 4.19Å; I405-C785 HydrophobicContact CD1-CB 4.12Å
406	R	88.1	Confident	85.6	Confident	49 Å²	49	56.6 Å²	56.6	19%	0.185	27%	0.267	C	S	.	.	H	α-helix	trans	-54.2	-42.9	175.3	-178.6	-153.7	69	-151.7	-4	112.5	L402 E403 R404 V409 F434 H438 W441	L402-R406 WeakPolarHBondContact O-CB 3.32Å; L402-R406 PolarHBondContact O-N 3.06Å; E403-R406 WeakPolarHBondContact O-CB 3.47Å; E403-R406 PolarHBondContact O-N 3.37Å; R404-R406 VanDerWaalsContact C-N 3.32Å; R404-R406 PolarHBondContact O-N 3.5Å; R406-V409 PolarHBondContact O-N 2.93Å; R406-F434 HydrophobicContact CB-CZ 4.42Å; R406-H438 PolarHBondContact NH1-CD2 2.93Å; R406-H438 VanDerWaalsContact NH1-CD2 3.29Å; R406-H438 PolarHBondContact NH1-NE2 3.44Å; R406-W441 HydrophobicContact CG-CD2 4.23Å; R406-W441 HydrophobicContact CG-CG 4.34Å; R406-W441 HydrophobicContact CG-CZ2 4.31Å
407	D	87.7	Confident	86	Confident	106 Å²	106	51 Å²	51	57%	0.567	24%	0.243	S	C	*	.	H	α-helix	trans	-76.8	-24.2	-176.1	-71	-12.7	0	0	0	113.8	E403 R404 I405	E403-D407 PolarHBondContact O-N 3.21Å; R404-D407 PolarHBondContact O-N 3.35Å; I405-D407 VanDerWaalsContact C-N 3.29Å; I405-D407 PolarHBondContact O-N 2.92Å
408	E	84.9	Confident	86.5	Confident	58 Å²	58	50.3 Å²	50.3	27%	0.271	24%	0.237	S	C	.	.	H	α-helix	trans	-81.8	-19.8	173.3	-68.5	173.1	178.4	0	0	111.9	R404 I405 I768 G769	R404-E408 IonicContact CZ-OE1 3.2Å; R404-E408 IonicContact NE-OE1 3.85Å; R404-E408 PolarHBondContact NE-OE1 3.47Å; R404-E408 IonicContact NE-OE2 2.61Å; R404-E408 IonicContact NH2-OE1 2.81Å; R404-E408 PolarHBondContact NH2-OE1 2.94Å; R404-E408 IonicContact NH2-OE2 3.45Å; R404-E408 PolarHBondContact O-N 3.34Å; I405-E408 PolarHBondContact O-N 2.89Å; E408-I768 HydrophobicContact CB-CG2 4.05Å; E408-I768 WeakPolarHBondContact OE2-CG2 3.28Å; E408-G769 WeakPolarHBondContact OE2-CA 3.38Å; E408-G769 PolarHBondContact OE2-N 3.44Å
409	V	82.9	Confident	87	Confident	19 Å²	19	49.4 Å²	49.4	12%	0.115	23%	0.232	C	C	.	.			trans	-91.1	128.8	-171.6	159.8	0	0	0	0	114.1	I405 R406 T414 H415 I782	I405-V409 HydrophobicContact CG2-CG2 4.13Å; I405-V409 WeakPolarHBondContact O-CB 3.34Å; I405-V409 WeakPolarHBondContact O-CG2 3.42Å; I405-V409 PolarHBondContact O-N 2.92Å; I405-V409 VanDerWaalsContact O-N 3.13Å; R406-V409 PolarHBondContact O-N 2.93Å; V409-T414 VanDerWaalsContact CG1-C 3.48Å; V409-H415 HydrophobicContact CG1-CB 4.37Å; V409-I782 HydrophobicContact CG2-CD1 3.8Å
410	R	81.3	Confident	87.5	Confident	191 Å²	191	46.8 Å²	46.8	72%	0.721	22%	0.218	S	C	*	.			trans	-128.5	-18.4	-176.1	-63.3	-175.8	175.3	-144.7	-8.7	116.3
411	H	84.9	Confident	87.9	Confident	104 Å²	104	41.7 Å²	41.7	48%	0.481	20%	0.199	S	C	.	.	S	Bend	trans	-109	152.7	-171.3	-55.8	-89.4	0	0	0	111.3	V413 T414 H415 L775	H411-V413 VanDerWaalsContact C-N 3.31Å; H411-V413 PolarHBondContact O-N 3.1Å; H411-T414 PolarHBondContact N-OG1 3.49Å; H411-T414 PolarHBondContact O-N 2.95Å; H411-T414 VanDerWaalsContact O-N 3.1Å; H411-T414 PolarHBondContact O-OG1 3.16Å; H411-H415 WeakPolarHBondContact O-CB 3.42Å; H411-H415 PolarHBondContact O-N 2.84Å; H411-L775 HydrophobicContact CB-CD2 4Å
412	S	83.9	Confident	88.3	Confident	79 Å²	79	41 Å²	41	55%	0.552	20%	0.196	S	C	*	.	H	α-helix	trans	-57.1	-40.4	-177.5	-172	0	0	0	0	113.3	T414 H415 N416	S412-T414 PolarHBondContact O-N 2.71Å; S412-H415 WeakPolarHBondContact O-CB 3.25Å; S412-H415 PolarHBondContact O-N 2.89Å; S412-N416 WeakPolarHBondContact O-CB 3.5Å; S412-N416 PolarHBondContact O-N 2.66Å
413	V	87.7	Confident	88.5	Confident	57 Å²	57	41.1 Å²	41.1	35%	0.345	20%	0.197	S	C	.	.	H	α-helix	trans	-62	-42.2	176.8	176.2	0	0	0	0	112	H411 A417 F779	H411-V413 VanDerWaalsContact C-N 3.31Å; H411-V413 PolarHBondContact O-N 3.1Å; V413-A417 PolarHBondContact O-N 3.1Å; V413-F779 HydrophobicContact CG1-CB 4.48Å; V413-F779 HydrophobicContact CG1-CD2 3.77Å
414	T	88.5	Confident	88.8	Confident	4 Å²	4	37 Å²	37	3%	0.025	18%	0.178	C	C	.	.	H	α-helix	trans	-82.3	-23.7	180	50.2	0	0	0	0	113.1	V409 H411 S412 T418 K778 I782	V409-T414 VanDerWaalsContact CG1-C 3.48Å; H411-T414 PolarHBondContact N-OG1 3.49Å; H411-T414 PolarHBondContact O-N 2.95Å; H411-T414 VanDerWaalsContact O-N 3.1Å; H411-T414 PolarHBondContact O-OG1 3.16Å; S412-T414 PolarHBondContact O-N 2.71Å; T414-T418 WeakPolarHBondContact O-CB 3.21Å; T414-T418 PolarHBondContact O-N 3.01Å; T414-T418 PolarHBondContact O-OG1 3.43Å; T414-K778 HydrophobicContact CG2-CB 3.9Å; T414-I782 HydrophobicContact CG2-CD1 4.03Å
415	H	90.5	Very high	89.1	Confident	14 Å²	14	33.4 Å²	33.4	7%	0.065	16%	0.164	C	C	.	.	H	α-helix	trans	-61.3	-52.9	165.3	177.7	-73.4	0	0	0	110.1	V409 H411 S412 A417 T418 V419 W441	V409-H415 HydrophobicContact CG1-CB 4.37Å; H411-H415 WeakPolarHBondContact O-CB 3.42Å; H411-H415 PolarHBondContact O-N 2.84Å; S412-H415 WeakPolarHBondContact O-CB 3.25Å; S412-H415 PolarHBondContact O-N 2.89Å; H415-A417 VanDerWaalsContact C-N 3.34Å; H415-A417 PolarHBondContact O-N 3.09Å; H415-T418 WeakPolarHBondContact O-CB 3Å; H415-T418 PolarHBondContact O-N 3.37Å; H415-V419 PolarHBondContact O-N 3.15Å; H415-W441 AromaticContact CD2-CD2 3.95Å; H415-W441 AromaticContact CD2-CE2 3.43Å; H415-W441 VanDerWaalsContact CD2-CE2 3.43Å; H415-W441 AromaticContact CD2-CH2 3.99Å; H415-W441 AromaticContact CD2-CZ2 3.46Å; H415-W441 VanDerWaalsContact CD2-CZ2 3.46Å; H415-W441 WeakPolarHBondContact CD2-CZ2 3.44Å; H415-W441 AromaticContact CD2-NE1 3.77Å; H415-W441 AromaticContact CG-CZ2 3.97Å; H415-W441 AromaticContact NE2-CD2 3.72Å; H415-W441 AromaticContact NE2-CE2 3.69Å; H415-W441 AromaticContact NE2-CE3 3.87Å; H415-W441 AromaticContact NE2-CH2 3.96Å; H415-W441 AromaticContact NE2-CZ2 3.83Å; H415-W441 AromaticContact NE2-CZ3 3.99Å; H415-W441 PolarHBondContact NE2-O 3.33Å
416	N	90.9	Very high	89.3	Confident	13 Å²	13	33.4 Å²	33.4	7%	0.07	16%	0.164	C	C	.	.	H	α-helix	trans	-58.6	-44.6	176.8	-165.6	23.9	0	0	0	111.7	S412 T418 V419 I420 T452	S412-N416 WeakPolarHBondContact O-CB 3.5Å; S412-N416 PolarHBondContact O-N 2.66Å; N416-T418 VanDerWaalsContact C-N 3.29Å; N416-T418 PolarHBondContact O-N 3.26Å; N416-V419 PolarHBondContact O-N 3.13Å; N416-I420 VanDerWaalsContact O-CG1 3.31Å; N416-I420 WeakPolarHBondContact O-CG1 3.31Å; N416-I420 PolarHBondContact O-N 3.48Å; N416-T452 WeakPolarHBondContact OD1-CB 3.38Å; N416-T452 VanDerWaalsContact OD1-CG2 3.27Å; N416-T452 WeakPolarHBondContact OD1-CG2 3.33Å
417	A	91.7	Very high	89.4	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-56.6	-40.9	173.7	0	0	0	0	0	112.8	V413 H415 I420 A421 F779 I782	V413-A417 PolarHBondContact O-N 3.1Å; H415-A417 VanDerWaalsContact C-N 3.34Å; H415-A417 PolarHBondContact O-N 3.09Å; A417-I420 PolarHBondContact O-N 2.7Å; A417-A421 VanDerWaalsContact O-CB 3.28Å; A417-A421 WeakPolarHBondContact O-CB 3.49Å; A417-A421 PolarHBondContact O-N 3.2Å; A417-F779 HydrophobicContact CB-CD2 3.6Å; A417-F779 HydrophobicContact CB-CE2 3.94Å; A417-F779 HydrophobicContact CB-CG 4.18Å; A417-I782 VanDerWaalsContact C-CG2 3.49Å; A417-I782 HydrophobicContact CB-CB 4.06Å; A417-I782 HydrophobicContact CB-CD1 4.2Å; A417-I782 HydrophobicContact CB-CG2 3.84Å; A417-I782 WeakPolarHBondContact O-CG2 3.41Å
418	T	92.1	Very high	89.5	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-66.7	-39.9	178.6	-55.4	0	0	0	0	111.6	I405 T414 H415 N416 A421 N422 W441	I405-T418 HydrophobicContact CG2-CG2 3.91Å; T414-T418 WeakPolarHBondContact O-CB 3.21Å; T414-T418 PolarHBondContact O-N 3.01Å; T414-T418 PolarHBondContact O-OG1 3.43Å; H415-T418 WeakPolarHBondContact O-CB 3Å; H415-T418 PolarHBondContact O-N 3.37Å; N416-T418 VanDerWaalsContact C-N 3.29Å; N416-T418 PolarHBondContact O-N 3.26Å; T418-A421 PolarHBondContact O-N 3.11Å; T418-N422 WeakPolarHBondContact O-CB 3.48Å; T418-N422 PolarHBondContact O-N 2.81Å; T418-W441 HydrophobicContact CG2-CH2 3.81Å; T418-W441 HydrophobicContact CG2-CZ2 4.06Å
419	V	92.3	Very high	89.6	Confident	1 Å²	1	23.8 Å²	23.8	1%	0.006	12%	0.119	C	C	.	.	H	α-helix	trans	-64.6	-46.3	175.4	179.4	0	0	0	0	110.8	H415 N416 N422 G423 W441 L442 A453 T456	H415-V419 PolarHBondContact O-N 3.15Å; N416-V419 PolarHBondContact O-N 3.13Å; V419-N422 WeakPolarHBondContact O-CB 3.49Å; V419-N422 PolarHBondContact O-N 3.29Å; V419-G423 PolarHBondContact O-N 3.07Å; V419-W441 HydrophobicContact CG2-CH2 3.72Å; V419-W441 HydrophobicContact CG2-CZ3 3.74Å; V419-L442 HydrophobicContact CG1-CD1 4.39Å; V419-L442 HydrophobicContact CG2-CD1 3.93Å; V419-A453 HydrophobicContact CG1-CB 3.95Å; V419-T456 HydrophobicContact CG1-CG2 4.02Å; V419-T456 VanDerWaalsContact O-CG2 3.25Å; V419-T456 WeakPolarHBondContact O-CG2 3.47Å
420	I	92.9	Very high	89.8	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-61.2	-46	176	-62.4	162.4	0	0	0	110.9	N416 A417 N422 G423 I424 T452 I783 T827	N416-I420 VanDerWaalsContact O-CG1 3.31Å; N416-I420 WeakPolarHBondContact O-CG1 3.31Å; N416-I420 PolarHBondContact O-N 3.48Å; A417-I420 PolarHBondContact O-N 2.7Å; I420-N422 PolarHBondContact O-N 3.27Å; I420-G423 WeakPolarHBondContact O-CA 3.45Å; I420-G423 PolarHBondContact O-N 2.88Å; I420-I424 HydrophobicContact CG2-CD1 3.93Å; I420-I424 HydrophobicContact CG2-CG1 4.43Å; I420-I424 WeakPolarHBondContact O-CG1 3.28Å; I420-I424 PolarHBondContact O-N 2.63Å; I420-T452 HydrophobicContact CD1-CG2 3.94Å; I420-T452 HydrophobicContact CG1-CG2 3.74Å; I420-I783 HydrophobicContact CB-CD1 3.9Å; I420-I783 HydrophobicContact CG2-CD1 3.63Å; I420-T827 HydrophobicContact CD1-CG2 4.5Å; I420-T827 HydrophobicContact CG2-CG2 3.79Å
421	A	92.5	Very high	90	Very high	1 Å²	1	14.6 Å²	14.6	1%	0.008	9%	0.085	C	C	.	.	H	α-helix	trans	-61.7	-41.9	179.3	0	0	0	0	0	112.3	A417 T418 G423 I424 M425 I782	A417-A421 VanDerWaalsContact O-CB 3.28Å; A417-A421 WeakPolarHBondContact O-CB 3.49Å; A417-A421 PolarHBondContact O-N 3.2Å; T418-A421 PolarHBondContact O-N 3.11Å; A421-G423 VanDerWaalsContact C-N 3.32Å; A421-G423 PolarHBondContact O-N 3.03Å; A421-I424 PolarHBondContact O-N 3.19Å; A421-M425 WeakPolarHBondContact O-CG 3.47Å; A421-M425 PolarHBondContact O-N 3.48Å; A421-I782 HydrophobicContact CB-CG2 3.76Å; A421-I782 WeakPolarHBondContact CB-O 3.5Å
422	N	92.9	Very high	90	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-56.3	-44.7	170.1	165.6	77.3	0	0	0	111.8	L402 T418 V419 I420 I424 M425 H426 F434	L402-N422 HydrophobicContact CD1-CB 4.04Å; L402-N422 WeakPolarHBondContact CD1-OD1 3.47Å; L402-N422 HydrophobicContact CD2-CB 3.98Å; T418-N422 WeakPolarHBondContact O-CB 3.48Å; T418-N422 PolarHBondContact O-N 2.81Å; V419-N422 WeakPolarHBondContact O-CB 3.49Å; V419-N422 PolarHBondContact O-N 3.29Å; I420-N422 PolarHBondContact O-N 3.27Å; N422-I424 PolarHBondContact O-N 2.82Å; N422-M425 PolarHBondContact O-N 3.11Å; N422-H426 WeakPolarHBondContact O-CB 3.45Å; N422-H426 PolarHBondContact O-CD2 3.35Å; N422-H426 PolarHBondContact O-N 3.21Å; N422-H426 PolarHBondContact OD1-CD2 3.06Å; N422-F434 HydrophobicContact CB-CD1 4.04Å; N422-F434 HydrophobicContact CB-CE1 4.27Å; N422-F434 WeakPolarHBondContact OD1-CB 3.31Å; N422-F434 VanDerWaalsContact OD1-CD1 3.31Å; N422-F434 WeakPolarHBondContact OD1-CD1 3.42Å
423	G	91.2	Very high	90.1	Very high	1 Å²	1	11.1 Å²	11.1	1%	0.01	6%	0.061	C	C	.	.	H	α-helix	trans	-60.6	-40.8	174.8	0	0	0	0	0	113.9	V419 I420 A421 H426 C427 V459	V419-G423 PolarHBondContact O-N 3.07Å; I420-G423 WeakPolarHBondContact O-CA 3.45Å; I420-G423 PolarHBondContact O-N 2.88Å; A421-G423 VanDerWaalsContact C-N 3.32Å; A421-G423 PolarHBondContact O-N 3.03Å; G423-H426 CarbonylContact O-C 3.51Å; G423-C427 VanDerWaalsContact O-CA 3.29Å; G423-C427 WeakPolarHBondContact O-CA 3.5Å; G423-C427 WeakPolarHBondContact O-CB 3.25Å; G423-C427 PolarHBondContact O-N 3.12Å; G423-V459 WeakPolarHBondContact O-CG1 3.46Å
424	I	93.3	Very high	90	Very high	3 Å²	3	8.5 Å²	8.5	2%	0.015	5%	0.045	C	C	.	.	H	α-helix	trans	-66.9	-48.1	177.1	-67.3	170.1	0	0	0	110.9	I420 A421 N422 H426 C427 G786 I787 A790 G791 I830 F834	I420-I424 HydrophobicContact CG2-CD1 3.93Å; I420-I424 HydrophobicContact CG2-CG1 4.43Å; I420-I424 WeakPolarHBondContact O-CG1 3.28Å; I420-I424 PolarHBondContact O-N 2.63Å; A421-I424 PolarHBondContact O-N 3.19Å; N422-I424 PolarHBondContact O-N 2.82Å; I424-H426 VanDerWaalsContact C-N 3.32Å; I424-H426 PolarHBondContact O-N 2.96Å; I424-C427 VanDerWaalsContact O-CB 3.29Å; I424-C427 WeakPolarHBondContact O-CB 3.42Å; I424-C427 PolarHBondContact O-N 3.16Å; I424-G786 VanDerWaalsContact CG2-C 3.44Å; I424-G786 VanDerWaalsContact CG2-O 3.3Å; I424-G786 WeakPolarHBondContact CG2-O 3.39Å; I424-I787 HydrophobicContact CG2-CG1 4.48Å; I424-A790 HydrophobicContact CG2-CB 3.9Å; I424-A790 WeakPolarHBondContact O-CA 3.49Å; I424-G791 PolarHBondContact O-N 3.29Å; I424-I830 HydrophobicContact CD1-CG2 4Å; I424-I830 HydrophobicContact CG1-CG2 4.1Å; I424-F834 HydrophobicContact CB-CE2 4.39Å; I424-F834 HydrophobicContact CG1-CE2 4.27Å; I424-F834 HydrophobicContact CG2-CE2 3.67Å; I424-F834 HydrophobicContact CG2-CZ 3.49Å; I424-F834 VanDerWaalsContact CG2-CZ 3.49Å
425	M	92.2	Very high	89.9	Confident	1 Å²	1	8.8 Å²	8.8	1%	0.005	5%	0.046	C	C	.	.	H	α-helix	trans	-59	-42.9	178.2	-70.8	177	65.6	0	0	111.8	A397 L401 L402 A421 N422 D789 G791 G792	A397-M425 HydrophobicContact CB-CB 4.49Å; A397-M425 HydrophobicContact CB-CE 4.41Å; L401-M425 HydrophobicContact CB-CE 4.48Å; L401-M425 HydrophobicContact CD2-CE 4.1Å; L402-M425 HydrophobicContact CD1-CE 4.29Å; L402-M425 HydrophobicContact CD1-SD 4.14Å; L402-M425 HydrophobicContact CD2-SD 3.6Å; L402-M425 VanDerWaalsContact CD2-SD 3.6Å; L402-M425 HydrophobicContact CG-CE 4.06Å; L402-M425 HydrophobicContact CG-SD 3.78Å; A421-M425 WeakPolarHBondContact O-CG 3.47Å; A421-M425 PolarHBondContact O-N 3.48Å; N422-M425 PolarHBondContact O-N 3.11Å; M425-D789 HydrophobicContact CE-CB 4.06Å; M425-D789 HydrophobicContact CG-CB 4.09Å; M425-G791 CarbonylContact O-C 3.54Å; M425-G791 WeakPolarHBondContact O-CA 3.22Å; M425-G791 PolarHBondContact O-N 2.84Å; M425-G792 PolarHBondContact O-N 2.9Å
426	H	92.3	Very high	89.6	Confident	1 Å²	1	14.5 Å²	14.5	1%	0.005	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	10.2	-178.2	-69.2	-69.8	0	0	0	114.5	A397 N422 G423 I424 G428 T429 S431 I460	A397-H426 VanDerWaalsContact CB-CE1 3.49Å; A397-H426 WeakPolarHBondContact CB-CE1 3.45Å; N422-H426 WeakPolarHBondContact O-CB 3.45Å; N422-H426 PolarHBondContact O-CD2 3.35Å; N422-H426 PolarHBondContact O-N 3.21Å; N422-H426 PolarHBondContact OD1-CD2 3.06Å; G423-H426 CarbonylContact O-C 3.51Å; I424-H426 VanDerWaalsContact C-N 3.32Å; I424-H426 PolarHBondContact O-N 2.96Å; H426-G428 PolarHBondContact O-N 3.16Å; H426-T429 WeakPolarHBondContact CA-OG1 3.49Å; H426-T429 WeakPolarHBondContact CB-OG1 3.08Å; H426-T429 WeakPolarHBondContact O-CB 3.34Å; H426-T429 PolarHBondContact O-N 3.02Å; H426-T429 PolarHBondContact O-OG1 2.88Å; H426-S431 PolarHBondContact ND1-OG 2.87Å; H426-I460 HydrophobicContact CB-CG1 4.21Å; H426-I460 HydrophobicContact CB-CG2 4.35Å
427	C	92	Very high	89.5	Confident	2 Å²	2	18.4 Å²	18.4	1%	0.014	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	124.8	-177.9	-176.7	0	0	0	0	111.8	G423 I424 T429 V459 M795	G423-C427 VanDerWaalsContact O-CA 3.29Å; G423-C427 WeakPolarHBondContact O-CA 3.5Å; G423-C427 WeakPolarHBondContact O-CB 3.25Å; G423-C427 PolarHBondContact O-N 3.12Å; I424-C427 VanDerWaalsContact O-CB 3.29Å; I424-C427 WeakPolarHBondContact O-CB 3.42Å; I424-C427 PolarHBondContact O-N 3.16Å; C427-T429 PolarHBondContact O-N 2.98Å; C427-T429 VanDerWaalsContact O-N 3.1Å; C427-V459 WeakPolarHBondContact CA-O 3.23Å; C427-V459 HydrophobicContact CB-CG1 3.74Å; C427-V459 VanDerWaalsContact SG-CG1 3.51Å; C427-M795 HydrophobicContact CB-CE 3.56Å; C427-M795 WeakPolarHBondContact O-CE 3.45Å
428	G	87.9	Confident	89.2	Confident	4 Å²	4	20.1 Å²	20.1	4%	0.041	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	9.5	-177.5	0	0	0	0	0	116.2	L388 L391 H426 V459 I460	L388-G428 WeakPolarHBondContact CD1-O 3.48Å; L391-G428 WeakPolarHBondContact CB-O 3.35Å; H426-G428 PolarHBondContact O-N 3.16Å; G428-V459 PolarHBondContact N-O 2.94Å; G428-I460 PolarHBondContact N-O 2.8Å
429	T	88	Confident	89	Confident	4 Å²	4	25.2 Å²	25.2	3%	0.025	12%	0.123	C	C	.	.	S	Bend	trans	-91.8	-9.2	178.9	69.8	0	0	0	0	113.4	L391 N395 H426 C427 S431 I460	L391-T429 HydrophobicContact CB-CG2 4.46Å; N395-T429 HydrophobicContact CB-CG2 4.43Å; H426-T429 WeakPolarHBondContact CA-OG1 3.49Å; H426-T429 WeakPolarHBondContact CB-OG1 3.08Å; H426-T429 WeakPolarHBondContact O-CB 3.34Å; H426-T429 PolarHBondContact O-N 3.02Å; H426-T429 PolarHBondContact O-OG1 2.88Å; C427-T429 PolarHBondContact O-N 2.98Å; C427-T429 VanDerWaalsContact O-N 3.1Å; T429-S431 PolarHBondContact O-N 2.74Å; T429-S431 WeakPolarHBondContact OG1-CB 3.46Å; T429-S431 PolarHBondContact OG1-N 3.28Å; T429-I460 PolarHBondContact N-O 3.2Å
430	T	87.7	Confident	88.7	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.006	16%	0.161	C	C	.	.			trans	61.4	-4.7	-169.9	63.7	0	0	0	0	116.3	L388 D432 I460 H461 H464 H1011	L388-T430 HydrophobicContact CD1-CG2 3.87Å; T430-D432 PolarHBondContact O-N 2.67Å; T430-I460 PolarHBondContact N-O 3.19Å; T430-H461 PolarHBondContact O-CE1 2.97Å; T430-H461 VanDerWaalsContact O-CE1 3.26Å; T430-H464 HydrophobicContact CG2-CB 4.26Å; T430-H1011 WeakPolarHBondContact CB-O 3.47Å; T430-H1011 PolarHBondContact OG1-N 3.36Å; T430-H1011 PolarHBondContact OG1-O 3.04Å
431	S	84.7	Confident	88.5	Confident	17 Å²	17	34.1 Å²	34.1	12%	0.119	17%	0.168	C	C	.	.			trans	-72.5	87.8	-175	174.4	0	0	0	0	112.9	H426 T429 Q433	H426-S431 PolarHBondContact ND1-OG 2.87Å; T429-S431 PolarHBondContact O-N 2.74Å; T429-S431 WeakPolarHBondContact OG1-CB 3.46Å; T429-S431 PolarHBondContact OG1-N 3.28Å; S431-Q433 VanDerWaalsContact C-N 3.34Å
432	D	84.5	Confident	88.1	Confident	15 Å²	15	35.6 Å²	35.6	8%	0.08	18%	0.175	C	C	.	.			trans	-87.3	3.3	176.6	68.9	1.1	0	0	0	114.6	T430 F434 L435 R436 H461	T430-D432 PolarHBondContact O-N 2.67Å; D432-F434 VanDerWaalsContact C-N 3.34Å; D432-F434 PolarHBondContact O-N 3.12Å; D432-L435 WeakPolarHBondContact O-CB 3.48Å; D432-L435 PolarHBondContact O-N 2.78Å; D432-R436 PolarHBondContact O-N 2.86Å; D432-R436 WeakPolarHBondContact OD1-CD 3.29Å; D432-R436 IonicContact OD1-CZ 2.73Å; D432-R436 IonicContact OD1-NE 3.83Å; D432-R436 PolarHBondContact OD1-NE 2.93Å; D432-R436 IonicContact OD2-CZ 2.71Å; D432-R436 IonicContact OD2-NE 3.47Å; D432-R436 PolarHBondContact OD2-NE 3.15Å; D432-R436 IonicContact OD2-NH2 2.7Å; D432-R436 PolarHBondContact OD2-NH2 3.19Å; D432-H461 IonicContact OD2-NE2 2.96Å
433	Q	85.6	Confident	87.6	Confident	94 Å²	94	38.4 Å²	38.4	44%	0.439	20%	0.204	S	C	.	.	H	α-helix	trans	-47.9	-48.8	-174.4	178.2	175.8	-1.8	0	0	113.6	S431 L435 R436 D437	S431-Q433 VanDerWaalsContact C-N 3.34Å; Q433-L435 PolarHBondContact O-N 2.99Å; Q433-L435 VanDerWaalsContact O-N 3.14Å; Q433-R436 WeakPolarHBondContact O-CB 3.43Å; Q433-R436 PolarHBondContact O-N 3.19Å; Q433-D437 WeakPolarHBondContact CG-OD2 3.19Å; Q433-D437 PolarHBondContact NE2-OD2 2.74Å; Q433-D437 PolarHBondContact O-N 3.34Å
434	F	86.3	Confident	87.4	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.009	24%	0.236	C	C	.	.	H	α-helix	trans	-58	-31.1	-178.5	175.4	-95.5	0	0	0	113.2	L399 L402 R406 N422 D432 H438 W441	L399-F434 HydrophobicContact CD2-CB 4.12Å; L402-F434 HydrophobicContact CB-CD2 3.8Å; L402-F434 HydrophobicContact CB-CE2 3.64Å; L402-F434 HydrophobicContact CB-CG 4.45Å; L402-F434 HydrophobicContact CB-CZ 4.15Å; L402-F434 HydrophobicContact CD1-CD2 4.36Å; L402-F434 HydrophobicContact CD1-CG 4.24Å; R406-F434 HydrophobicContact CB-CZ 4.42Å; N422-F434 HydrophobicContact CB-CD1 4.04Å; N422-F434 HydrophobicContact CB-CE1 4.27Å; N422-F434 WeakPolarHBondContact OD1-CB 3.31Å; N422-F434 VanDerWaalsContact OD1-CD1 3.31Å; N422-F434 WeakPolarHBondContact OD1-CD1 3.42Å; D432-F434 VanDerWaalsContact C-N 3.34Å; D432-F434 PolarHBondContact O-N 3.12Å; F434-H438 AromaticContact CD2-CE1 3.84Å; F434-H438 AromaticContact CD2-ND1 3.51Å; F434-H438 AromaticContact CE2-CE1 3.95Å; F434-H438 AromaticContact CE2-ND1 3.58Å; F434-H438 WeakPolarHBondContact O-CB 3.41Å; F434-H438 PolarHBondContact O-N 2.96Å; F434-H438 PolarHBondContact O-ND1 3.31Å; F434-W441 HydrophobicContact CE1-CZ3 4.16Å
435	L	85.8	Confident	87.1	Confident	10 Å²	10	45.9 Å²	45.9	5%	0.052	24%	0.237	C	C	.	.	H	α-helix	trans	-80.7	-31.4	177.7	-60.8	175.1	0	0	0	111.9	D432 Q433 L439 L442 L457 I460	D432-L435 WeakPolarHBondContact O-CB 3.48Å; D432-L435 PolarHBondContact O-N 2.78Å; Q433-L435 PolarHBondContact O-N 2.99Å; Q433-L435 VanDerWaalsContact O-N 3.14Å; L435-L439 PolarHBondContact O-N 2.78Å; L435-L442 HydrophobicContact CB-CD2 4.47Å; L435-L442 HydrophobicContact CD2-CD1 4.06Å; L435-L442 HydrophobicContact CD2-CD2 4.27Å; L435-L457 HydrophobicContact CD1-CD2 3.57Å; L435-I460 HydrophobicContact CD1-CD1 3.74Å
436	R	85.1	Confident	86.9	Confident	134 Å²	134	50 Å²	50	51%	0.506	26%	0.262	S	S	.	.	H	α-helix	trans	-68.1	-48.9	174.4	-64	-175.9	174.5	-70.4	-21.8	111.5	D432 Q433 H438	D432-R436 PolarHBondContact O-N 2.86Å; D432-R436 WeakPolarHBondContact OD1-CD 3.29Å; D432-R436 IonicContact OD1-CZ 2.73Å; D432-R436 IonicContact OD1-NE 3.83Å; D432-R436 PolarHBondContact OD1-NE 2.93Å; D432-R436 IonicContact OD2-CZ 2.71Å; D432-R436 IonicContact OD2-NE 3.47Å; D432-R436 PolarHBondContact OD2-NE 3.15Å; D432-R436 IonicContact OD2-NH2 2.7Å; D432-R436 PolarHBondContact OD2-NH2 3.19Å; Q433-R436 WeakPolarHBondContact O-CB 3.43Å; Q433-R436 PolarHBondContact O-N 3.19Å; R436-H438 PolarHBondContact O-N 3.39Å
437	D	88	Confident	86.8	Confident	96 Å²	96	53.9 Å²	53.9	51%	0.513	28%	0.283	S	S	.	.	H	α-helix	trans	-65.9	-20.7	-177.6	-64.9	-9.4	0	0	0	112	Q433	Q433-D437 WeakPolarHBondContact CG-OD2 3.19Å; Q433-D437 PolarHBondContact NE2-OD2 2.74Å; Q433-D437 PolarHBondContact O-N 3.34Å
438	H	86.8	Confident	86.7	Confident	35 Å²	35	56.5 Å²	56.5	16%	0.162	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.6	30	-174.2	-52.8	109.5	0	0	0	114.4	R406 F434 R436 N440 W441 L442	R406-H438 PolarHBondContact NH1-CD2 2.93Å; R406-H438 VanDerWaalsContact NH1-CD2 3.29Å; R406-H438 PolarHBondContact NH1-NE2 3.44Å; F434-H438 AromaticContact CD2-CE1 3.84Å; F434-H438 AromaticContact CD2-ND1 3.51Å; F434-H438 AromaticContact CE2-CE1 3.95Å; F434-H438 AromaticContact CE2-ND1 3.58Å; F434-H438 WeakPolarHBondContact O-CB 3.41Å; F434-H438 PolarHBondContact O-N 2.96Å; F434-H438 PolarHBondContact O-ND1 3.31Å; R436-H438 PolarHBondContact O-N 3.39Å; H438-N440 VanDerWaalsContact C-N 3.25Å; H438-N440 PolarHBondContact O-N 2.95Å; H438-N440 VanDerWaalsContact O-N 3.16Å; H438-W441 HydrophobicContact CB-CB 4.3Å; H438-W441 WeakPolarHBondContact O-CA 3.45Å; H438-W441 WeakPolarHBondContact O-CB 3.41Å; H438-W441 PolarHBondContact O-N 3.24Å; H438-L442 PolarHBondContact O-N 3.24Å
439	L	86.7	Confident	86.8	Confident	108 Å²	108	56.8 Å²	56.8	57%	0.565	30%	0.295	S	S	*	.	H	α-helix	trans	-53.2	-38.7	-177.8	-171.8	62.9	0	0	0	113.4	L435 W441 L442 G443	L435-L439 PolarHBondContact O-N 2.78Å; L439-W441 VanDerWaalsContact C-N 3.3Å; L439-W441 PolarHBondContact O-N 3.48Å; L439-L442 HydrophobicContact CD1-CD2 4.46Å; L439-L442 WeakPolarHBondContact O-CB 3.2Å; L439-L442 PolarHBondContact O-N 2.73Å; L439-G443 PolarHBondContact O-N 2.99Å
440	N	86.4	Confident	87	Confident	152 Å²	152	60.2 Å²	60.2	81%	0.813	31%	0.309	S	S	*	.	H	α-helix	trans	-67.9	-26	177.2	-66.5	1.6	0	0	0	113.5	H438	H438-N440 VanDerWaalsContact C-N 3.25Å; H438-N440 PolarHBondContact O-N 2.95Å; H438-N440 VanDerWaalsContact O-N 3.16Å
441	W	87.8	Confident	87.3	Confident	36 Å²	36	60.2 Å²	60.2	14%	0.136	31%	0.309	C	S	.	.	H	α-helix	trans	-82.2	-35.1	172.4	171	96.4	0	0	0	110.8	R406 H415 T418 V419 F434 H438 L439 G443 K444	R406-W441 HydrophobicContact CG-CD2 4.23Å; R406-W441 HydrophobicContact CG-CG 4.34Å; R406-W441 HydrophobicContact CG-CZ2 4.31Å; H415-W441 AromaticContact CD2-CD2 3.95Å; H415-W441 AromaticContact CD2-CE2 3.43Å; H415-W441 VanDerWaalsContact CD2-CE2 3.43Å; H415-W441 AromaticContact CD2-CH2 3.99Å; H415-W441 AromaticContact CD2-CZ2 3.46Å; H415-W441 VanDerWaalsContact CD2-CZ2 3.46Å; H415-W441 WeakPolarHBondContact CD2-CZ2 3.44Å; H415-W441 AromaticContact CD2-NE1 3.77Å; H415-W441 AromaticContact CG-CZ2 3.97Å; H415-W441 AromaticContact NE2-CD2 3.72Å; H415-W441 AromaticContact NE2-CE2 3.69Å; H415-W441 AromaticContact NE2-CE3 3.87Å; H415-W441 AromaticContact NE2-CH2 3.96Å; H415-W441 AromaticContact NE2-CZ2 3.83Å; H415-W441 AromaticContact NE2-CZ3 3.99Å; H415-W441 PolarHBondContact NE2-O 3.33Å; T418-W441 HydrophobicContact CG2-CH2 3.81Å; T418-W441 HydrophobicContact CG2-CZ2 4.06Å; V419-W441 HydrophobicContact CG2-CH2 3.72Å; V419-W441 HydrophobicContact CG2-CZ3 3.74Å; F434-W441 HydrophobicContact CE1-CZ3 4.16Å; H438-W441 HydrophobicContact CB-CB 4.3Å; H438-W441 WeakPolarHBondContact O-CA 3.45Å; H438-W441 WeakPolarHBondContact O-CB 3.41Å; H438-W441 PolarHBondContact O-N 3.24Å; L439-W441 VanDerWaalsContact C-N 3.3Å; L439-W441 PolarHBondContact O-N 3.48Å; W441-G443 VanDerWaalsContact C-N 3.33Å; W441-K444 WeakPolarHBondContact O-CB 3.38Å; W441-K444 PolarHBondContact O-N 2.97Å
442	L	84.6	Confident	87.6	Confident	32 Å²	32	59.4 Å²	59.4	17%	0.168	30%	0.304	C	S	.	.	H	α-helix	trans	-64.4	-38	173.5	-167.1	65.4	0	0	0	111.7	V419 L435 H438 L439 K444 A445 A453	V419-L442 HydrophobicContact CG1-CD1 4.39Å; V419-L442 HydrophobicContact CG2-CD1 3.93Å; L435-L442 HydrophobicContact CB-CD2 4.47Å; L435-L442 HydrophobicContact CD2-CD1 4.06Å; L435-L442 HydrophobicContact CD2-CD2 4.27Å; H438-L442 PolarHBondContact O-N 3.24Å; L439-L442 HydrophobicContact CD1-CD2 4.46Å; L439-L442 WeakPolarHBondContact O-CB 3.2Å; L439-L442 PolarHBondContact O-N 2.73Å; L442-K444 PolarHBondContact O-N 3Å; L442-K444 VanDerWaalsContact O-N 3.07Å; L442-A445 VanDerWaalsContact O-CB 3.3Å; L442-A445 WeakPolarHBondContact O-CB 3.46Å; L442-A445 PolarHBondContact O-N 3.43Å; L442-A453 HydrophobicContact CD1-CB 4Å
443	G	83.6	Confident	88	Confident	59 Å²	59	59.2 Å²	59.2	61%	0.608	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-13.6	176	0	0	0	0	0	115.3	L439 W441 A445	L439-G443 PolarHBondContact O-N 2.99Å; W441-G443 VanDerWaalsContact C-N 3.33Å; G443-A445 VanDerWaalsContact C-N 3.26Å; G443-A445 PolarHBondContact O-N 2.8Å
444	K	86.4	Confident	88.2	Confident	156 Å²	156	55 Å²	55	68%	0.678	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-9.2	172.1	-59.3	-171	175.7	-169	0	113.8	W441 L442	W441-K444 WeakPolarHBondContact O-CB 3.38Å; W441-K444 PolarHBondContact O-N 2.97Å; L442-K444 PolarHBondContact O-N 3Å; L442-K444 VanDerWaalsContact O-N 3.07Å
445	A	86.2	Confident	88.5	Confident	4 Å²	4	55 Å²	55	3%	0.033	28%	0.284	C	S	.	.			trans	-65.8	140.1	173.4	0	0	0	0	0	110.9	L442 G443 A449 K450	L442-A445 VanDerWaalsContact O-CB 3.3Å; L442-A445 WeakPolarHBondContact O-CB 3.46Å; L442-A445 PolarHBondContact O-N 3.43Å; G443-A445 VanDerWaalsContact C-N 3.26Å; G443-A445 PolarHBondContact O-N 2.8Å; A445-A449 HydrophobicContact CB-CB 3.86Å; A445-K450 HydrophobicContact CB-CG 4.02Å; A445-K450 WeakPolarHBondContact O-CE 3.31Å; A445-K450 VanDerWaalsContact O-CG 3.23Å; A445-K450 WeakPolarHBondContact O-CG 3.48Å
446	V	88	Confident	88.8	Confident	88 Å²	88	54.5 Å²	54.5	53%	0.533	28%	0.282	S	S	.	.			trans	-126.2	146.2	178.8	-177.5	0	0	0	0	109.8	W448 A449	V446-W448 PolarHBondContact O-N 3.21Å; V446-A449 VanDerWaalsContact O-CB 3.31Å; V446-A449 WeakPolarHBondContact O-CB 3.4Å; V446-A449 PolarHBondContact O-N 3.08Å
447	N	90.2	Very high	89.1	Confident	83 Å²	83	48.9 Å²	48.9	44%	0.444	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.4	-116.4	177.1	-58.1	-6	0	0	0	113.5	A449 K450 F451 Y488	N447-A449 PolarHBondContact O-N 2.85Å; N447-A449 VanDerWaalsContact O-N 3.15Å; N447-K450 WeakPolarHBondContact O-CA 3.33Å; N447-K450 WeakPolarHBondContact O-CB 3.34Å; N447-K450 PolarHBondContact O-N 3.3Å; N447-F451 PolarHBondContact O-N 3.39Å; N447-Y488 HydrophobicContact CB-CD2 4.32Å; N447-Y488 HydrophobicContact CB-CE1 4.37Å; N447-Y488 HydrophobicContact CB-CE2 3.86Å
448	W	91	Very high	89.2	Confident	57 Å²	57	44.3 Å²	44.3	22%	0.216	24%	0.238	C	C	.	.	H	α-helix	trans	-63.6	-17.8	-178.8	-67.1	108.6	0	0	0	115	V446 F451 T452 Y488 P523 I558 W823	V446-W448 PolarHBondContact O-N 3.21Å; W448-F451 HydrophobicContact CE3-CB 3.75Å; W448-F451 HydrophobicContact CE3-CD1 4.01Å; W448-F451 HydrophobicContact CE3-CD2 4.09Å; W448-F451 AromaticContact CE3-CG 3.69Å; W448-F451 HydrophobicContact CE3-CG 3.69Å; W448-F451 HydrophobicContact CZ3-CB 4.2Å; W448-F451 HydrophobicContact CZ3-CD1 4.09Å; W448-F451 AromaticContact CZ3-CD2 3.63Å; W448-F451 HydrophobicContact CZ3-CD2 3.63Å; W448-F451 HydrophobicContact CZ3-CE1 4.4Å; W448-F451 AromaticContact CZ3-CE2 3.96Å; W448-F451 HydrophobicContact CZ3-CE2 3.96Å; W448-F451 AromaticContact CZ3-CG 3.72Å; W448-F451 HydrophobicContact CZ3-CG 3.72Å; W448-F451 HydrophobicContact CZ3-CZ 4.36Å; W448-T452 WeakPolarHBondContact O-CB 3.24Å; W448-T452 PolarHBondContact O-N 3.49Å; W448-T452 PolarHBondContact O-OG1 2.85Å; W448-Y488 HydrophobicContact CD2-CD1 4.14Å; W448-Y488 AromaticContact CD2-CE1 3.98Å; W448-Y488 HydrophobicContact CD2-CE1 3.98Å; W448-Y488 AromaticContact CE2-CE1 3.63Å; W448-Y488 HydrophobicContact CE3-CD1 4.23Å; W448-Y488 HydrophobicContact CE3-CE1 4.45Å; W448-Y488 HydrophobicContact CG-CE1 4.42Å; W448-Y488 HydrophobicContact CH2-CD1 4.45Å; W448-Y488 HydrophobicContact CH2-CE1 4.3Å; W448-Y488 HydrophobicContact CZ2-CD1 4.37Å; W448-Y488 AromaticContact CZ2-CE1 3.8Å; W448-Y488 HydrophobicContact CZ2-CE1 3.8Å; W448-Y488 HydrophobicContact CZ3-CD1 4.38Å; W448-Y488 AromaticContact NE1-CE1 3.92Å; W448-P523 HydrophobicContact CH2-CB 4Å; W448-P523 HydrophobicContact CH2-CG 4.36Å; W448-P523 HydrophobicContact CZ2-CG 4.49Å; W448-I558 HydrophobicContact CH2-CG2 3.86Å; W448-I558 HydrophobicContact CZ2-CD1 3.84Å; W448-I558 HydrophobicContact CZ2-CG2 3.98Å; W448-W823 AromaticContact CD2-CH2 3.69Å; W448-W823 HydrophobicContact CD2-CH2 3.69Å; W448-W823 AromaticContact CD2-CZ2 3.83Å; W448-W823 HydrophobicContact CD2-CZ2 3.83Å; W448-W823 AromaticContact CE2-CH2 3.47Å; W448-W823 VanDerWaalsContact CE2-CH2 3.47Å; W448-W823 AromaticContact CE2-CZ2 3.88Å; W448-W823 HydrophobicContact CE3-CH2 4.05Å; W448-W823 AromaticContact CE3-CZ2 3.67Å; W448-W823 HydrophobicContact CE3-CZ2 3.67Å; W448-W823 HydrophobicContact CG-CH2 4.25Å; W448-W823 HydrophobicContact CH2-CH2 4.06Å; W448-W823 AromaticContact CH2-CZ2 3.7Å; W448-W823 HydrophobicContact CH2-CZ2 3.7Å; W448-W823 AromaticContact CZ2-CH2 3.68Å; W448-W823 HydrophobicContact CZ2-CH2 3.68Å; W448-W823 AromaticContact CZ2-CZ2 3.84Å; W448-W823 HydrophobicContact CZ2-CZ2 3.84Å; W448-W823 HydrophobicContact CZ3-CH2 4.22Å; W448-W823 AromaticContact CZ3-CZ2 3.61Å; W448-W823 HydrophobicContact CZ3-CZ2 3.61Å; W448-W823 AromaticContact NE1-CH2 3.83Å
449	A	90.2	Very high	89.5	Confident	10 Å²	10	42.8 Å²	42.8	8%	0.083	23%	0.231	C	C	.	.	H	α-helix	trans	-71.7	-33	168.1	0	0	0	0	0	111.8	A445 V446 N447 A453	A445-A449 HydrophobicContact CB-CB 3.86Å; V446-A449 VanDerWaalsContact O-CB 3.31Å; V446-A449 WeakPolarHBondContact O-CB 3.4Å; V446-A449 PolarHBondContact O-N 3.08Å; N447-A449 PolarHBondContact O-N 2.85Å; N447-A449 VanDerWaalsContact O-N 3.15Å; A449-A453 WeakPolarHBondContact O-CB 3.42Å; A449-A453 PolarHBondContact O-N 2.85Å
450	K	91.5	Very high	89.7	Confident	76 Å²	76	37.7 Å²	37.7	33%	0.33	20%	0.204	S	C	.	.	H	α-helix	trans	-68.3	-40.1	171.6	-62.5	-172.9	178.9	-179	0	111.5	A445 N447 T454 T489	A445-K450 HydrophobicContact CB-CG 4.02Å; A445-K450 WeakPolarHBondContact O-CE 3.31Å; A445-K450 VanDerWaalsContact O-CG 3.23Å; A445-K450 WeakPolarHBondContact O-CG 3.48Å; N447-K450 WeakPolarHBondContact O-CA 3.33Å; N447-K450 WeakPolarHBondContact O-CB 3.34Å; N447-K450 PolarHBondContact O-N 3.3Å; K450-T454 PolarHBondContact O-N 3.09Å; K450-T454 VanDerWaalsContact O-N 3.07Å; K450-T454 PolarHBondContact O-OG1 3.24Å; K450-T489 HydrophobicContact CB-CG2 4.01Å
451	F	93.1	Very high	89.9	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-59	-52.5	172.6	-176.6	-82.5	0	0	0	110.8	N447 W448 A453 T454 A455 Y488 G492 F495 H526 P825	N447-F451 PolarHBondContact O-N 3.39Å; W448-F451 HydrophobicContact CE3-CB 3.75Å; W448-F451 HydrophobicContact CE3-CD1 4.01Å; W448-F451 HydrophobicContact CE3-CD2 4.09Å; W448-F451 AromaticContact CE3-CG 3.69Å; W448-F451 HydrophobicContact CE3-CG 3.69Å; W448-F451 HydrophobicContact CZ3-CB 4.2Å; W448-F451 HydrophobicContact CZ3-CD1 4.09Å; W448-F451 AromaticContact CZ3-CD2 3.63Å; W448-F451 HydrophobicContact CZ3-CD2 3.63Å; W448-F451 HydrophobicContact CZ3-CE1 4.4Å; W448-F451 AromaticContact CZ3-CE2 3.96Å; W448-F451 HydrophobicContact CZ3-CE2 3.96Å; W448-F451 AromaticContact CZ3-CG 3.72Å; W448-F451 HydrophobicContact CZ3-CG 3.72Å; W448-F451 HydrophobicContact CZ3-CZ 4.36Å; F451-A453 PolarHBondContact O-N 2.92Å; F451-T454 PolarHBondContact O-N 2.76Å; F451-A455 WeakPolarHBondContact O-CB 3.46Å; F451-A455 PolarHBondContact O-N 3.17Å; F451-Y488 VanDerWaalsContact CA-O 3.28Å; F451-Y488 WeakPolarHBondContact CA-O 3.26Å; F451-Y488 HydrophobicContact CB-CD1 4.48Å; F451-Y488 WeakPolarHBondContact CD2-O 3.34Å; F451-G492 VanDerWaalsContact CD2-N 3.34Å; F451-F495 AromaticContact CE1-CD1 3.67Å; F451-F495 HydrophobicContact CE1-CD1 3.67Å; F451-F495 HydrophobicContact CE1-CE1 4.3Å; F451-F495 HydrophobicContact CE1-CG 4.5Å; F451-F495 HydrophobicContact CZ-CB 4.13Å; F451-F495 HydrophobicContact CZ-CD1 4.01Å; F451-F495 HydrophobicContact CZ-CG 4.41Å; F451-H526 AromaticContact CZ-CD2 3.62Å; F451-P825 HydrophobicContact CD1-CB 4.07Å; F451-P825 HydrophobicContact CD1-CG 4.08Å; F451-P825 HydrophobicContact CE1-CB 3.92Å; F451-P825 HydrophobicContact CE1-CG 4.32Å
452	T	92.3	Very high	90	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.006	17%	0.17	C	C	.	.	H	α-helix	trans	-62.4	-44.2	-179.3	-51.8	0	0	0	0	111.4	N416 I420 W448 T454 A455 T456	N416-T452 WeakPolarHBondContact OD1-CB 3.38Å; N416-T452 VanDerWaalsContact OD1-CG2 3.27Å; N416-T452 WeakPolarHBondContact OD1-CG2 3.33Å; I420-T452 HydrophobicContact CD1-CG2 3.94Å; I420-T452 HydrophobicContact CG1-CG2 3.74Å; W448-T452 WeakPolarHBondContact O-CB 3.24Å; W448-T452 PolarHBondContact O-N 3.49Å; W448-T452 PolarHBondContact O-OG1 2.85Å; T452-T454 VanDerWaalsContact C-N 3.28Å; T452-T454 PolarHBondContact O-N 2.97Å; T452-A455 WeakPolarHBondContact O-CB 3.44Å; T452-A455 PolarHBondContact O-N 2.72Å; T452-T456 PolarHBondContact O-N 3.01Å; T452-T456 PolarHBondContact O-OG1 2.87Å
453	A	91.4	Very high	89.9	Confident	10 Å²	10	30.3 Å²	30.3	8%	0.083	17%	0.167	C	C	.	.	H	α-helix	trans	-60.4	-35.5	176.9	0	0	0	0	0	113.5	V419 L442 A449 F451	V419-A453 HydrophobicContact CG1-CB 3.95Å; L442-A453 HydrophobicContact CD1-CB 4Å; A449-A453 WeakPolarHBondContact O-CB 3.42Å; A449-A453 PolarHBondContact O-N 2.85Å; F451-A453 PolarHBondContact O-N 2.92Å
454	T	91.7	Very high	89.9	Confident	7 Å²	7	28.6 Å²	28.6	4%	0.043	14%	0.143	C	C	.	.	H	α-helix	trans	-74.9	-41.2	175.5	-45	0	0	0	0	110.9	K450 F451 T452 T456 L457 M472 Y475 T489	K450-T454 PolarHBondContact O-N 3.09Å; K450-T454 VanDerWaalsContact O-N 3.07Å; K450-T454 PolarHBondContact O-OG1 3.24Å; F451-T454 PolarHBondContact O-N 2.76Å; T452-T454 VanDerWaalsContact C-N 3.28Å; T452-T454 PolarHBondContact O-N 2.97Å; T454-T456 VanDerWaalsContact C-N 3.28Å; T454-T456 PolarHBondContact O-N 2.68Å; T454-L457 HydrophobicContact CG2-CD1 4.45Å; T454-L457 WeakPolarHBondContact O-CB 3.39Å; T454-L457 PolarHBondContact O-N 3.48Å; T454-L457 VanDerWaalsContact O-N 3.1Å; T454-M472 HydrophobicContact CG2-CE 4.28Å; T454-Y475 HydrophobicContact CG2-CD1 4.2Å; T454-Y475 HydrophobicContact CG2-CG 3.98Å; T454-T489 WeakPolarHBondContact CG2-O 3.4Å
455	A	92.3	Very high	89.5	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-58	-38.5	174.6	0	0	0	0	0	112.8	F451 T452 L457 G458 F495	F451-A455 WeakPolarHBondContact O-CB 3.46Å; F451-A455 PolarHBondContact O-N 3.17Å; T452-A455 WeakPolarHBondContact O-CB 3.44Å; T452-A455 PolarHBondContact O-N 2.72Å; A455-L457 PolarHBondContact O-N 2.99Å; A455-G458 PolarHBondContact O-N 3.43Å; A455-F495 HydrophobicContact CB-CD1 3.44Å; A455-F495 VanDerWaalsContact CB-CD1 3.44Å; A455-F495 HydrophobicContact CB-CE1 3.82Å; A455-F495 HydrophobicContact CB-CG 4.4Å
456	T	91.6	Very high	89.2	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-56.6	-31.7	175.3	-63.7	0	0	0	0	113	V419 T452 T454 G458 V459 I460	V419-T456 HydrophobicContact CG1-CG2 4.02Å; V419-T456 VanDerWaalsContact O-CG2 3.25Å; V419-T456 WeakPolarHBondContact O-CG2 3.47Å; T452-T456 PolarHBondContact O-N 3.01Å; T452-T456 PolarHBondContact O-OG1 2.87Å; T454-T456 VanDerWaalsContact C-N 3.28Å; T454-T456 PolarHBondContact O-N 2.68Å; T456-G458 VanDerWaalsContact C-N 3.25Å; T456-G458 PolarHBondContact O-N 3.2Å; T456-V459 WeakPolarHBondContact O-CB 3.45Å; T456-V459 PolarHBondContact O-N 3.27Å; T456-I460 HydrophobicContact CG2-CD1 4.33Å; T456-I460 PolarHBondContact O-N 3.49Å; T456-I460 VanDerWaalsContact O-N 3.15Å
457	L	91.2	Very high	88.8	Confident	17 Å²	17	28.8 Å²	28.8	9%	0.089	14%	0.138	C	C	.	.	H	α-helix	trans	-61.5	-35.4	174.3	-63.7	171.6	0	0	0	111.9	L435 T454 A455 V459 I460 H461 M472 Y475	L435-L457 HydrophobicContact CD1-CD2 3.57Å; T454-L457 HydrophobicContact CG2-CD1 4.45Å; T454-L457 WeakPolarHBondContact O-CB 3.39Å; T454-L457 PolarHBondContact O-N 3.48Å; T454-L457 VanDerWaalsContact O-N 3.1Å; A455-L457 PolarHBondContact O-N 2.99Å; L457-V459 PolarHBondContact O-N 3.12Å; L457-I460 PolarHBondContact O-N 3.38Å; L457-H461 PolarHBondContact O-CD2 3.23Å; L457-H461 VanDerWaalsContact O-CD2 3.31Å; L457-H461 PolarHBondContact O-N 3.46Å; L457-M472 HydrophobicContact CB-SD 4.3Å; L457-Y475 HydrophobicContact CD1-CD2 3.94Å; L457-Y475 HydrophobicContact CD1-CE2 3.5Å; L457-Y475 VanDerWaalsContact CD1-CE2 3.5Å
458	G	89.7	Confident	88.3	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-65.5	-26.2	175.3	0	0	0	0	0	113.7	A455 T456 K462 I500	A455-G458 PolarHBondContact O-N 3.43Å; T456-G458 VanDerWaalsContact C-N 3.25Å; T456-G458 PolarHBondContact O-N 3.2Å; G458-K462 WeakPolarHBondContact O-CA 3.44Å; G458-K462 PolarHBondContact O-N 3.05Å; G458-I500 WeakPolarHBondContact O-CG1 3.38Å
459	V	92.7	Very high	87.9	Confident	3 Å²	3	25.8 Å²	25.8	2%	0.018	13%	0.125	C	C	.	.	H	α-helix	trans	-75.5	-44.4	172.8	-174.5	0	0	0	0	110.5	G423 C427 G428 T456 L457 K462 L499 N828	G423-V459 WeakPolarHBondContact O-CG1 3.46Å; C427-V459 WeakPolarHBondContact CA-O 3.23Å; C427-V459 HydrophobicContact CB-CG1 3.74Å; C427-V459 VanDerWaalsContact SG-CG1 3.51Å; G428-V459 PolarHBondContact N-O 2.94Å; T456-V459 WeakPolarHBondContact O-CB 3.45Å; T456-V459 PolarHBondContact O-N 3.27Å; L457-V459 PolarHBondContact O-N 3.12Å; V459-K462 VanDerWaalsContact O-CB 3.29Å; V459-K462 WeakPolarHBondContact O-CB 3.32Å; V459-K462 PolarHBondContact O-N 2.84Å; V459-L499 HydrophobicContact CG2-CD1 4.19Å; V459-N828 HydrophobicContact CG2-CB 4.08Å
460	I	92.9	Very high	87.7	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-64.8	-43.9	179.9	-63.1	170.2	0	0	0	111.8	H426 G428 T429 T430 L435 T456 L457 K462	H426-I460 HydrophobicContact CB-CG1 4.21Å; H426-I460 HydrophobicContact CB-CG2 4.35Å; G428-I460 PolarHBondContact N-O 2.8Å; T429-I460 PolarHBondContact N-O 3.2Å; T430-I460 PolarHBondContact N-O 3.19Å; L435-I460 HydrophobicContact CD1-CD1 3.74Å; T456-I460 HydrophobicContact CG2-CD1 4.33Å; T456-I460 PolarHBondContact O-N 3.49Å; T456-I460 VanDerWaalsContact O-N 3.15Å; L457-I460 PolarHBondContact O-N 3.38Å; I460-K462 VanDerWaalsContact C-N 3.33Å
461	H	90.4	Very high	87.2	Confident	6 Å²	6	27.6 Å²	27.6	3%	0.028	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	16	180	-61.3	-68.5	0	0	0	113.8	T430 D432 L457 G463 H464 I500	T430-H461 PolarHBondContact O-CE1 2.97Å; T430-H461 VanDerWaalsContact O-CE1 3.26Å; D432-H461 IonicContact OD2-NE2 2.96Å; L457-H461 PolarHBondContact O-CD2 3.23Å; L457-H461 VanDerWaalsContact O-CD2 3.31Å; L457-H461 PolarHBondContact O-N 3.46Å; H461-G463 PolarHBondContact O-N 3.27Å; H461-H464 WeakPolarHBondContact O-CB 3.41Å; H461-H464 PolarHBondContact O-N 2.96Å; H461-I500 HydrophobicContact CB-CD1 4.18Å
462	K	88.5	Confident	86.7	Confident	49 Å²	49	27.8 Å²	27.8	21%	0.213	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	127.1	-180	-175.7	165.6	-174.2	167.8	0	111.7	G458 V459 I460 S831	G458-K462 WeakPolarHBondContact O-CA 3.44Å; G458-K462 PolarHBondContact O-N 3.05Å; V459-K462 VanDerWaalsContact O-CB 3.29Å; V459-K462 WeakPolarHBondContact O-CB 3.32Å; V459-K462 PolarHBondContact O-N 2.84Å; I460-K462 VanDerWaalsContact C-N 3.33Å; K462-S831 VanDerWaalsContact NZ-C 3.28Å; K462-S831 PolarHBondContact NZ-O 3.41Å
463	G	82.7	Confident	86.2	Confident	10 Å²	10	30.4 Å²	30.4	10%	0.103	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.8	-2.8	-176.7	0	0	0	0	0	116.4	I384 H461 E465	I384-G463 VanDerWaalsContact CG2-CA 3.4Å; I384-G463 WeakPolarHBondContact CG2-O 3.44Å; H461-G463 PolarHBondContact O-N 3.27Å; G463-E465 PolarHBondContact O-N 3.02Å
464	H	83.9	Confident	85.8	Confident	24 Å²	24	33.3 Å²	33.3	11%	0.111	17%	0.173	C	C	.	.			trans	-85	47.9	178.5	-164.3	42.7	0	0	0	112.9	L388 T430 H461 K466 E467 A468	L388-H464 HydrophobicContact CD2-CB 4.16Å; T430-H464 HydrophobicContact CG2-CB 4.26Å; H461-H464 WeakPolarHBondContact O-CB 3.41Å; H461-H464 PolarHBondContact O-N 2.96Å; H464-K466 VanDerWaalsContact C-N 3.31Å; H464-K466 PolarHBondContact O-N 3.23Å; H464-K466 VanDerWaalsContact O-N 3.16Å; H464-E467 IonicContact CE1-OE2 3.95Å; H464-E467 WeakPolarHBondContact NE2-CB 3.12Å; H464-E467 VanDerWaalsContact NE2-CD 3.33Å; H464-E467 WeakPolarHBondContact NE2-CG 3.35Å; H464-E467 IonicContact NE2-OE2 3.75Å; H464-E467 PolarHBondContact NE2-OE2 3.31Å; H464-E467 PolarHBondContact O-N 3.38Å; H464-E467 VanDerWaalsContact O-N 3.16Å; H464-A468 PolarHBondContact O-N 2.87Å
465	E	78.3	Confident	85.5	Confident	39 Å²	39	37.3 Å²	37.3	18%	0.182	19%	0.188	C	C	.	.	H	α-helix	trans	-48	-47.2	-169.2	-56.1	176.3	142.3	0	0	113.5	I384 G463 E467 A468 H504	I384-E465 WeakPolarHBondContact CD1-OE1 3.35Å; G463-E465 PolarHBondContact O-N 3.02Å; E465-E467 PolarHBondContact O-N 3.47Å; E465-E467 VanDerWaalsContact O-N 3.12Å; E465-A468 WeakPolarHBondContact O-CB 3.46Å; E465-A468 PolarHBondContact O-N 3.14Å; E465-H504 WeakPolarHBondContact OE1-CB 3.39Å; E465-H504 IonicContact OE1-CG 2.65Å
466	K	79	Confident	85.1	Confident	160 Å²	160	37.8 Å²	37.8	70%	0.696	19%	0.19	S	C	*	.	H	α-helix	trans	-60.6	-25.6	-173.5	-64.7	173.8	-174.9	174.1	0	114	E385 H464	E385-K466 IonicContact OE1-NZ 3.37Å; E385-K466 PolarHBondContact OE1-NZ 3.08Å; H464-K466 VanDerWaalsContact C-N 3.31Å; H464-K466 PolarHBondContact O-N 3.23Å; H464-K466 VanDerWaalsContact O-N 3.16Å
467	E	79.5	Confident	84.3	Confident	53 Å²	53	39.2 Å²	39.2	25%	0.248	20%	0.199	C	C	.	.	H	α-helix	trans	-122.1	0.8	177.1	-49.1	-171.8	165.9	0	0	113.4	H464 E465 L469 R470 L471	H464-E467 IonicContact CE1-OE2 3.95Å; H464-E467 WeakPolarHBondContact NE2-CB 3.12Å; H464-E467 VanDerWaalsContact NE2-CD 3.33Å; H464-E467 WeakPolarHBondContact NE2-CG 3.35Å; H464-E467 IonicContact NE2-OE2 3.75Å; H464-E467 PolarHBondContact NE2-OE2 3.31Å; H464-E467 PolarHBondContact O-N 3.38Å; H464-E467 VanDerWaalsContact O-N 3.16Å; E465-E467 PolarHBondContact O-N 3.47Å; E465-E467 VanDerWaalsContact O-N 3.12Å; E467-L469 VanDerWaalsContact C-N 3.29Å; E467-L469 PolarHBondContact O-N 3.17Å; E467-R470 HydrophobicContact CB-CB 4.37Å; E467-R470 CarbonylContact O-C 3.56Å; E467-R470 WeakPolarHBondContact O-CA 3.38Å; E467-R470 VanDerWaalsContact O-CB 3.28Å; E467-R470 WeakPolarHBondContact O-CB 3.48Å; E467-R470 PolarHBondContact O-N 3.11Å; E467-R470 IonicContact OE1-NH2 2.71Å; E467-R470 IonicContact OE2-CZ 2.96Å; E467-R470 IonicContact OE2-NE 3.54Å; E467-R470 IonicContact OE2-NH2 3.62Å; E467-R470 PolarHBondContact OE2-NH2 2.77Å; E467-L471 WeakPolarHBondContact O-CG 3.16Å; E467-L471 PolarHBondContact O-N 3.29Å
468	A	81	Confident	83.3	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-51.7	-48.2	-179.4	0	0	0	0	0	111.8	H464 E465 R470 L471 M472 L497 I500	H464-A468 PolarHBondContact O-N 2.87Å; E465-A468 WeakPolarHBondContact O-CB 3.46Å; E465-A468 PolarHBondContact O-N 3.14Å; A468-R470 VanDerWaalsContact C-N 3.32Å; A468-R470 PolarHBondContact O-N 3.47Å; A468-L471 PolarHBondContact O-N 3Å; A468-M472 VanDerWaalsContact O-CB 3.32Å; A468-M472 WeakPolarHBondContact O-CB 3.3Å; A468-M472 VanDerWaalsContact O-CG 3.28Å; A468-M472 WeakPolarHBondContact O-CG 3.39Å; A468-M472 PolarHBondContact O-N 3.16Å; A468-L497 HydrophobicContact CB-CD1 4.3Å; A468-I500 HydrophobicContact CB-CD1 3.99Å; A468-I500 HydrophobicContact CB-CG2 3.84Å
469	L	83	Confident	81.6	Confident	76 Å²	76	52.3 Å²	52.3	40%	0.398	26%	0.263	S	S	.	.	H	α-helix	trans	-63.6	-35.7	176.2	-168.1	69.5	0	0	0	112.4	E467 S473 L476	E467-L469 VanDerWaalsContact C-N 3.29Å; E467-L469 PolarHBondContact O-N 3.17Å; L469-S473 VanDerWaalsContact O-CB 3.28Å; L469-S473 WeakPolarHBondContact O-CB 3.44Å; L469-S473 PolarHBondContact O-N 3.3Å; L469-L476 HydrophobicContact CD1-CD1 3.8Å
470	R	85	Confident	79.4	Confident	103 Å²	103	57.5 Å²	57.5	39%	0.389	31%	0.305	S	S	.	.	H	α-helix	trans	-65.7	-47.7	176.9	-176	-177.4	76.2	89.7	-6.9	111.1	E467 A468 S473 P1013	E467-R470 HydrophobicContact CB-CB 4.37Å; E467-R470 CarbonylContact O-C 3.56Å; E467-R470 WeakPolarHBondContact O-CA 3.38Å; E467-R470 VanDerWaalsContact O-CB 3.28Å; E467-R470 WeakPolarHBondContact O-CB 3.48Å; E467-R470 PolarHBondContact O-N 3.11Å; E467-R470 IonicContact OE1-NH2 2.71Å; E467-R470 IonicContact OE2-CZ 2.96Å; E467-R470 IonicContact OE2-NE 3.54Å; E467-R470 IonicContact OE2-NH2 3.62Å; E467-R470 PolarHBondContact OE2-NH2 2.77Å; A468-R470 VanDerWaalsContact C-N 3.32Å; A468-R470 PolarHBondContact O-N 3.47Å; R470-S473 PolarHBondContact O-OG 3.45Å; R470-P1013 PolarHBondContact NH1-O 3.28Å; R470-P1013 PolarHBondContact NH2-O 2.77Å
471	L	82	Confident	76.7	Confident	22 Å²	22	62.1 Å²	62.1	12%	0.115	34%	0.338	C	S	.	.	H	α-helix	trans	-68.9	-44	-179.9	-63.7	178.4	0	0	0	111.8	E467 A468 S473 P1013	E467-L471 WeakPolarHBondContact O-CG 3.16Å; E467-L471 PolarHBondContact O-N 3.29Å; A468-L471 PolarHBondContact O-N 3Å; L471-S473 VanDerWaalsContact C-N 3.31Å; L471-S473 PolarHBondContact O-N 3.2Å; L471-P1013 HydrophobicContact CD2-CG 3.78Å
472	M	81.9	Confident	74.4	Confident	3 Å²	3	66.4 Å²	66.4	2%	0.015	38%	0.384	C	S	.	.	H	α-helix	trans	-78.1	-10.7	-178.9	-60.4	-53.2	-58.7	0	0	113.5	T454 L457 A468 A474 Y475 L476 A496 I500	T454-M472 HydrophobicContact CG2-CE 4.28Å; L457-M472 HydrophobicContact CB-SD 4.3Å; A468-M472 VanDerWaalsContact O-CB 3.32Å; A468-M472 WeakPolarHBondContact O-CB 3.3Å; A468-M472 VanDerWaalsContact O-CG 3.28Å; A468-M472 WeakPolarHBondContact O-CG 3.39Å; A468-M472 PolarHBondContact O-N 3.16Å; M472-A474 PolarHBondContact O-N 3.07Å; M472-Y475 HydrophobicContact CE-CD2 4.05Å; M472-Y475 HydrophobicContact CE-CG 4.5Å; M472-Y475 CarbonylContact O-C 3.36Å; M472-Y475 PolarHBondContact O-N 3.27Å; M472-L476 HydrophobicContact CB-CD1 3.91Å; M472-L476 HydrophobicContact CB-CG 4.09Å; M472-L476 WeakPolarHBondContact O-CG 3.33Å; M472-L476 PolarHBondContact O-N 2.94Å; M472-A496 HydrophobicContact CE-CB 3.61Å; M472-A496 HydrophobicContact SD-CB 4.38Å; M472-I500 HydrophobicContact CG-CD1 4.31Å
473	S	81.4	Confident	72.4	Confident	57 Å²	57	67.9 Å²	67.9	40%	0.399	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-9.1	177.5	69.7	0	0	0	0	115.7	L469 R470 L471 K478	L469-S473 VanDerWaalsContact O-CB 3.28Å; L469-S473 WeakPolarHBondContact O-CB 3.44Å; L469-S473 PolarHBondContact O-N 3.3Å; R470-S473 PolarHBondContact O-OG 3.45Å; L471-S473 VanDerWaalsContact C-N 3.31Å; L471-S473 PolarHBondContact O-N 3.2Å; S473-K478 WeakPolarHBondContact O-CE 3.31Å; S473-K478 PolarHBondContact O-NZ 3.46Å
474	A	83.3	Confident	71	Confident	71 Å²	71	70.8 Å²	70.8	59%	0.587	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-19.9	169.4	0	0	0	0	0	113.8	M472	M472-A474 PolarHBondContact O-N 3.07Å
475	Y	85.1	Confident	70	Confident	90 Å²	90	71.7 Å²	71.7	35%	0.353	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.4	-2.4	-173.1	-51.3	-74.3	0	0	0	113.9	T454 L457 M472 E490	T454-Y475 HydrophobicContact CG2-CD1 4.2Å; T454-Y475 HydrophobicContact CG2-CG 3.98Å; L457-Y475 HydrophobicContact CD1-CD2 3.94Å; L457-Y475 HydrophobicContact CD1-CE2 3.5Å; L457-Y475 VanDerWaalsContact CD1-CE2 3.5Å; M472-Y475 HydrophobicContact CE-CD2 4.05Å; M472-Y475 HydrophobicContact CE-CG 4.5Å; M472-Y475 CarbonylContact O-C 3.36Å; M472-Y475 PolarHBondContact O-N 3.27Å; Y475-E490 WeakPolarHBondContact O-CA 3.38Å
476	L	83.9	Confident	70.2	Confident	11 Å²	11	71.6 Å²	71.6	6%	0.058	44%	0.439	C	S	.	.	S	Bend	trans	-86.1	150.7	174	-72.6	166.9	0	0	0	110.6	L469 M472 L494 L497 Y511	L469-L476 HydrophobicContact CD1-CD1 3.8Å; M472-L476 HydrophobicContact CB-CD1 3.91Å; M472-L476 HydrophobicContact CB-CG 4.09Å; M472-L476 WeakPolarHBondContact O-CG 3.33Å; M472-L476 PolarHBondContact O-N 2.94Å; L476-L494 HydrophobicContact CD2-CD2 3.66Å; L476-L494 HydrophobicContact CD2-CG 4.28Å; L476-L497 HydrophobicContact CD2-CD2 4.36Å; L476-Y511 HydrophobicContact CD2-CE1 4.5Å
477	P	76.1	Confident	70.8	Confident	29 Å²	29	66.8 Å²	66.8	19%	0.188	42%	0.422	C	S	.	.			trans	-50.6	147.4	168	-24.1	32.6	0	0	0	112.1	E490 L494 V524	P477-E490 HydrophobicContact CG-CB 4.21Å; P477-L494 HydrophobicContact CG-CD1 4.38Å; P477-V524 HydrophobicContact CG-CG1 4.32Å
478	K	69.2	Low	71.3	Confident	152 Å²	152	66.9 Å²	66.9	66%	0.661	42%	0.421	S	S	*	.			trans	-130.5	133.9	175.5	-72.1	174.8	-176.8	160	0	110.3	S473 A480	S473-K478 WeakPolarHBondContact O-CE 3.31Å; S473-K478 PolarHBondContact O-NZ 3.46Å; K478-A480 PolarHBondContact O-N 3.21Å
479	D	54.4	Low	71.8	Confident	141 Å²	141	68.2 Å²	68.2	75%	0.754	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	123.5	-175.2	-56.5	-44.4	0	0	0	112.3	S481	D479-S481 PolarHBondContact O-N 2.92Å; D479-S481 VanDerWaalsContact O-N 3.14Å
480	A	46.1	Very low	72.1	Confident	111 Å²	111	67 Å²	67	92%	0.917	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	27.5	155.8	0	0	0	0	0	119.1	K478	K478-A480 PolarHBondContact O-N 3.21Å
481	S	36.8	Very low	72.4	Confident	97 Å²	97	62.1 Å²	62.1	68%	0.678	40%	0.403	S	S	*	.			trans	-143.8	50.5	175.1	-170.8	0	0	0	0	116.6	D479 S483	D479-S481 PolarHBondContact O-N 2.92Å; D479-S481 VanDerWaalsContact O-N 3.14Å; S481-S483 VanDerWaalsContact C-N 3.32Å; S481-S483 WeakPolarHBondContact O-CB 3.44Å; S481-S483 PolarHBondContact O-N 3.25Å
482	G	41	Very low	72.9	Confident	96 Å²	96	61.1 Å²	61.1	99%	0.99	40%	0.398	S	S	*	.			trans	44.7	35.9	145.9	0	0	0	0	0	119.7
483	S	47.4	Very low	73.3	Confident	81 Å²	81	61 Å²	61	57%	0.566	40%	0.397	S	S	*	.			trans	-126	104.4	-171.4	-175.3	0	0	0	0	113	S481 G485	S481-S483 VanDerWaalsContact C-N 3.32Å; S481-S483 WeakPolarHBondContact O-CB 3.44Å; S481-S483 PolarHBondContact O-N 3.25Å; S483-G485 VanDerWaalsContact C-N 3.3Å; S483-G485 PolarHBondContact O-N 3.16Å
484	S	52.7	Low	73.9	Confident	70 Å²	70	58.2 Å²	58.2	49%	0.49	38%	0.378	S	S	.	.	S	Bend	trans	72.8	-6.1	137	-49.1	0	0	0	0	119.7	S1053	S484-S1053 VanDerWaalsContact CB-CB 3.4Å; S484-S1053 VanDerWaalsContact CB-OG 3.23Å; S484-S1053 WeakPolarHBondContact CB-OG 3.46Å; S484-S1053 VanDerWaalsContact OG-CB 3.24Å; S484-S1053 WeakPolarHBondContact OG-CB 3.48Å; S484-S1053 PolarHBondContact OG-OG 3.36Å
485	G	63	Low	74.4	Confident	43 Å²	43	54.9 Å²	54.9	44%	0.443	35%	0.35	S	S	.	.			trans	-72.1	150.1	169.8	0	0	0	0	0	112.5	S483	S483-G485 VanDerWaalsContact C-N 3.3Å; S483-G485 PolarHBondContact O-N 3.16Å
486	S	83.2	Confident	74.8	Confident	38 Å²	38	50.6 Å²	50.6	27%	0.266	33%	0.333	S	S	.	.			trans	-93.5	138.7	156.6	-177.5	0	0	0	0	108.4	Y488 T489 E490	S486-Y488 PolarHBondContact O-N 2.91Å; S486-Y488 VanDerWaalsContact O-N 3.08Å; S486-T489 PolarHBondContact N-OG1 2.75Å; S486-T489 VanDerWaalsContact N-OG1 3.07Å; S486-T489 WeakPolarHBondContact O-CA 3.09Å; S486-T489 PolarHBondContact O-N 2.97Å; S486-T489 PolarHBondContact O-OG1 2.82Å; S486-E490 PolarHBondContact O-N 2.96Å
487	V	90	Very high	75.1	Confident	59 Å²	59	50 Å²	50	36%	0.358	33%	0.33	S	S	.	.	H	α-helix	trans	-52.4	-35.8	178.7	-172.2	0	0	0	0	111.8	E490 G491 A521 P523 V524	V487-E490 PolarHBondContact O-N 2.98Å; V487-G491 PolarHBondContact O-N 3.09Å; V487-A521 HydrophobicContact CG1-CB 3.57Å; V487-P523 HydrophobicContact CG1-CB 4.14Å; V487-P523 HydrophobicContact CG1-CG 3.99Å; V487-V524 HydrophobicContact CG1-CG2 3.75Å
488	Y	91.2	Very high	75.8	Confident	55 Å²	55	48.7 Å²	48.7	22%	0.216	32%	0.321	C	S	.	.	H	α-helix	trans	-67.7	-37.4	173.8	-64.7	-72.1	0	0	0	113.8	N447 W448 F451 S486 G492 P523	N447-Y488 HydrophobicContact CB-CD2 4.32Å; N447-Y488 HydrophobicContact CB-CE1 4.37Å; N447-Y488 HydrophobicContact CB-CE2 3.86Å; W448-Y488 HydrophobicContact CD2-CD1 4.14Å; W448-Y488 AromaticContact CD2-CE1 3.98Å; W448-Y488 HydrophobicContact CD2-CE1 3.98Å; W448-Y488 AromaticContact CE2-CE1 3.63Å; W448-Y488 HydrophobicContact CE3-CD1 4.23Å; W448-Y488 HydrophobicContact CE3-CE1 4.45Å; W448-Y488 HydrophobicContact CG-CE1 4.42Å; W448-Y488 HydrophobicContact CH2-CD1 4.45Å; W448-Y488 HydrophobicContact CH2-CE1 4.3Å; W448-Y488 HydrophobicContact CZ2-CD1 4.37Å; W448-Y488 AromaticContact CZ2-CE1 3.8Å; W448-Y488 HydrophobicContact CZ2-CE1 3.8Å; W448-Y488 HydrophobicContact CZ3-CD1 4.38Å; W448-Y488 AromaticContact NE1-CE1 3.92Å; F451-Y488 VanDerWaalsContact CA-O 3.28Å; F451-Y488 WeakPolarHBondContact CA-O 3.26Å; F451-Y488 HydrophobicContact CB-CD1 4.48Å; F451-Y488 WeakPolarHBondContact CD2-O 3.34Å; S486-Y488 PolarHBondContact O-N 2.91Å; S486-Y488 VanDerWaalsContact O-N 3.08Å; Y488-G492 PolarHBondContact O-N 3.22Å; Y488-P523 HydrophobicContact CD1-CB 3.99Å; Y488-P523 HydrophobicContact CD1-CG 4.08Å; Y488-P523 HydrophobicContact CE1-CB 4.21Å; Y488-P523 HydrophobicContact CE1-CG 3.82Å
489	T	90.9	Very high	76.9	Confident	28 Å²	28	41.4 Å²	41.4	17%	0.172	29%	0.29	C	S	.	.	H	α-helix	trans	-71.4	-35	174.9	52	0	0	0	0	111.5	K450 T454 S486 G492 G493	K450-T489 HydrophobicContact CB-CG2 4.01Å; T454-T489 WeakPolarHBondContact CG2-O 3.4Å; S486-T489 PolarHBondContact N-OG1 2.75Å; S486-T489 VanDerWaalsContact N-OG1 3.07Å; S486-T489 WeakPolarHBondContact O-CA 3.09Å; S486-T489 PolarHBondContact O-N 2.97Å; S486-T489 PolarHBondContact O-OG1 2.82Å; T489-G492 PolarHBondContact O-N 3.42Å; T489-G493 PolarHBondContact O-N 3.47Å
490	E	90.2	Very high	78.7	Confident	51 Å²	51	34.9 Å²	34.9	24%	0.238	26%	0.255	C	S	.	.	H	α-helix	trans	-66.1	-48.4	177.1	-71.8	173.6	177.1	0	0	112.1	Y475 P477 S486 V487 G492 G493 L494 V524	Y475-E490 WeakPolarHBondContact O-CA 3.38Å; P477-E490 HydrophobicContact CG-CB 4.21Å; S486-E490 PolarHBondContact O-N 2.96Å; V487-E490 PolarHBondContact O-N 2.98Å; E490-G492 PolarHBondContact O-N 3.35Å; E490-G493 PolarHBondContact O-N 2.91Å; E490-L494 PolarHBondContact O-N 2.96Å; E490-L494 VanDerWaalsContact O-N 3.15Å; E490-V524 HydrophobicContact CB-CG2 4.15Å
491	G	91.1	Very high	80.8	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.2	-42.4	172.1	0	0	0	0	0	112.9	V487 G493 L494 F495 P523 G527	V487-G491 PolarHBondContact O-N 3.09Å; G491-G493 PolarHBondContact O-N 2.86Å; G491-L494 PolarHBondContact O-N 3.27Å; G491-F495 PolarHBondContact O-N 3.4Å; G491-P523 WeakPolarHBondContact CA-O 3.43Å; G491-G527 WeakPolarHBondContact O-CA 3.4Å
492	G	91.4	Very high	83.2	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63.4	-30.5	175.1	0	0	0	0	0	113	F451 Y488 T489 E490 A496	F451-G492 VanDerWaalsContact CD2-N 3.34Å; Y488-G492 PolarHBondContact O-N 3.22Å; T489-G492 PolarHBondContact O-N 3.42Å; E490-G492 PolarHBondContact O-N 3.35Å; G492-A496 VanDerWaalsContact O-CB 3.26Å; G492-A496 WeakPolarHBondContact O-CB 3.45Å; G492-A496 PolarHBondContact O-N 3.25Å
493	G	91.8	Very high	85.2	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-68.4	-41.1	174.3	0	0	0	0	0	113.4	T489 E490 G491 A496 L497	T489-G493 PolarHBondContact O-N 3.47Å; E490-G493 PolarHBondContact O-N 2.91Å; G491-G493 PolarHBondContact O-N 2.86Å; G493-A496 PolarHBondContact O-N 2.89Å; G493-L497 PolarHBondContact O-N 3.02Å
494	L	92.9	Very high	86.6	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-67	-42.2	173.9	-65.9	173.5	0	0	0	111.8	L476 P477 E490 G491 L497 G498 Y511 L512 Q515 V524 A528	L476-L494 HydrophobicContact CD2-CD2 3.66Å; L476-L494 HydrophobicContact CD2-CG 4.28Å; P477-L494 HydrophobicContact CG-CD1 4.38Å; E490-L494 PolarHBondContact O-N 2.96Å; E490-L494 VanDerWaalsContact O-N 3.15Å; G491-L494 PolarHBondContact O-N 3.27Å; L494-L497 PolarHBondContact O-N 3.05Å; L494-G498 PolarHBondContact O-N 3.32Å; L494-G498 VanDerWaalsContact O-N 3.15Å; L494-Y511 HydrophobicContact CD2-CE1 4.37Å; L494-L512 HydrophobicContact CB-CD2 4.38Å; L494-L512 HydrophobicContact CD2-CD2 4.02Å; L494-Q515 HydrophobicContact CD2-CB 4.25Å; L494-Q515 HydrophobicContact CD2-CG 4.37Å; L494-V524 HydrophobicContact CD1-CG1 3.58Å; L494-A528 HydrophobicContact CD1-CB 4.02Å
495	F	94	Very high	87.3	Confident	0 Å²	0	17.1 Å²	17.1	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-64.3	-42	175.1	179.6	-144.8	0	0	0	111.8	F451 A455 G491 L497 G498 L499 G527 L530 L534 N828 F829	F451-F495 AromaticContact CE1-CD1 3.67Å; F451-F495 HydrophobicContact CE1-CD1 3.67Å; F451-F495 HydrophobicContact CE1-CE1 4.3Å; F451-F495 HydrophobicContact CE1-CG 4.5Å; F451-F495 HydrophobicContact CZ-CB 4.13Å; F451-F495 HydrophobicContact CZ-CD1 4.01Å; F451-F495 HydrophobicContact CZ-CG 4.41Å; A455-F495 HydrophobicContact CB-CD1 3.44Å; A455-F495 VanDerWaalsContact CB-CD1 3.44Å; A455-F495 HydrophobicContact CB-CE1 3.82Å; A455-F495 HydrophobicContact CB-CG 4.4Å; G491-F495 PolarHBondContact O-N 3.4Å; F495-L497 PolarHBondContact O-N 3.32Å; F495-G498 PolarHBondContact O-N 3.3Å; F495-L499 HydrophobicContact CD1-CD1 4.39Å; F495-L499 HydrophobicContact CD2-CD1 4.25Å; F495-L499 HydrophobicContact CD2-CG 4.24Å; F495-L499 HydrophobicContact CE1-CD1 4.16Å; F495-L499 HydrophobicContact CE2-CD1 4.02Å; F495-L499 HydrophobicContact CE2-CD2 4.24Å; F495-L499 HydrophobicContact CE2-CG 3.98Å; F495-L499 HydrophobicContact CG-CD1 4.42Å; F495-L499 HydrophobicContact CZ-CD1 3.96Å; F495-L499 HydrophobicContact CZ-CD2 4.47Å; F495-L499 HydrophobicContact CZ-CG 4.35Å; F495-L499 WeakPolarHBondContact O-CG 3.37Å; F495-L499 PolarHBondContact O-N 3.08Å; F495-G527 PolarHBondContact N-O 3.44Å; F495-L530 HydrophobicContact CD2-CB 3.59Å; F495-L530 HydrophobicContact CD2-CD1 4.19Å; F495-L530 HydrophobicContact CE1-CD1 4.42Å; F495-L530 HydrophobicContact CE2-CB 3.88Å; F495-L530 HydrophobicContact CE2-CD1 4.06Å; F495-L530 HydrophobicContact CG-CB 4.31Å; F495-L530 HydrophobicContact CG-CD1 4.43Å; F495-L530 HydrophobicContact CZ-CD1 4.2Å; F495-L534 HydrophobicContact CD2-CD1 4.04Å; F495-L534 HydrophobicContact CE2-CD1 3.67Å; F495-N828 HydrophobicContact CE1-CB 4.36Å; F495-N828 HydrophobicContact CZ-CB 4.32Å; F495-F829 HydrophobicContact CE2-CD2 4.44Å; F495-F829 AromaticContact CE2-CE2 3.63Å; F495-F829 HydrophobicContact CE2-CE2 3.63Å; F495-F829 AromaticContact CE2-CZ 3.88Å; F495-F829 HydrophobicContact CE2-CZ 3.88Å; F495-F829 HydrophobicContact CZ-CD2 4.02Å; F495-F829 AromaticContact CZ-CE2 3.5Å; F495-F829 HydrophobicContact CZ-CE2 3.5Å; F495-F829 VanDerWaalsContact CZ-CE2 3.5Å; F495-F829 HydrophobicContact CZ-CZ 4.23Å
496	A	92.7	Very high	87.8	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-58.9	-42.1	172	0	0	0	0	0	112.8	M472 G492 G493 G498 L499 I500	M472-A496 HydrophobicContact CE-CB 3.61Å; M472-A496 HydrophobicContact SD-CB 4.38Å; G492-A496 VanDerWaalsContact O-CB 3.26Å; G492-A496 WeakPolarHBondContact O-CB 3.45Å; G492-A496 PolarHBondContact O-N 3.25Å; G493-A496 PolarHBondContact O-N 2.89Å; A496-G498 VanDerWaalsContact C-N 3.3Å; A496-G498 PolarHBondContact O-N 2.97Å; A496-L499 PolarHBondContact O-N 3.42Å; A496-I500 WeakPolarHBondContact O-CG1 3.33Å; A496-I500 PolarHBondContact O-N 3.13Å
497	L	91.6	Very high	87.7	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62.3	-37.6	177.9	-173.1	65.2	0	0	0	112	A468 L476 G493 L494 F495 H501 Y511 L512	A468-L497 HydrophobicContact CB-CD1 4.3Å; L476-L497 HydrophobicContact CD2-CD2 4.36Å; G493-L497 PolarHBondContact O-N 3.02Å; L494-L497 PolarHBondContact O-N 3.05Å; F495-L497 PolarHBondContact O-N 3.32Å; L497-H501 PolarHBondContact O-N 3.25Å; L497-H501 PolarHBondContact O-ND1 2.73Å; L497-Y511 HydrophobicContact CD2-CD1 3.71Å; L497-Y511 HydrophobicContact CD2-CE1 3.7Å; L497-L512 HydrophobicContact CD2-CD2 4.25Å; L497-L512 HydrophobicContact CD2-CG 4.47Å
498	G	91.3	Very high	87.3	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-70.4	-36.9	172.8	0	0	0	0	0	114	L494 F495 A496 I500 H501 A502 G531	L494-G498 PolarHBondContact O-N 3.32Å; L494-G498 VanDerWaalsContact O-N 3.15Å; F495-G498 PolarHBondContact O-N 3.3Å; A496-G498 VanDerWaalsContact C-N 3.3Å; A496-G498 PolarHBondContact O-N 2.97Å; G498-I500 VanDerWaalsContact C-N 3.29Å; G498-I500 PolarHBondContact O-N 3.4Å; G498-H501 CarbonylContact O-C 3.57Å; G498-H501 PolarHBondContact O-N 3.18Å; G498-A502 WeakPolarHBondContact O-CA 3.24Å; G498-A502 PolarHBondContact O-N 3.15Å; G498-G531 WeakPolarHBondContact CA-O 3.19Å
499	L	92.1	Very high	87	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-63.3	-33.7	173.6	-75.5	166.1	0	0	0	112.6	V459 F495 A496 L534 N828	V459-L499 HydrophobicContact CG2-CD1 4.19Å; F495-L499 HydrophobicContact CD1-CD1 4.39Å; F495-L499 HydrophobicContact CD2-CD1 4.25Å; F495-L499 HydrophobicContact CD2-CG 4.24Å; F495-L499 HydrophobicContact CE1-CD1 4.16Å; F495-L499 HydrophobicContact CE2-CD1 4.02Å; F495-L499 HydrophobicContact CE2-CD2 4.24Å; F495-L499 HydrophobicContact CE2-CG 3.98Å; F495-L499 HydrophobicContact CG-CD1 4.42Å; F495-L499 HydrophobicContact CZ-CD1 3.96Å; F495-L499 HydrophobicContact CZ-CD2 4.47Å; F495-L499 HydrophobicContact CZ-CG 4.35Å; F495-L499 WeakPolarHBondContact O-CG 3.37Å; F495-L499 PolarHBondContact O-N 3.08Å; A496-L499 PolarHBondContact O-N 3.42Å; L499-L534 HydrophobicContact CD2-CD1 3.59Å; L499-L534 HydrophobicContact CG-CD1 3.75Å; L499-N828 HydrophobicContact CD1-CB 3.98Å
500	I	91.7	Very high	86.9	Confident	4 Å²	4	20.4 Å²	20.4	2%	0.021	12%	0.122	C	C	.	.	H	α-helix	trans	-69.9	-43.5	175.4	-64.4	166.1	0	0	0	111.4	G458 H461 A468 M472 A496 G498	G458-I500 WeakPolarHBondContact O-CG1 3.38Å; H461-I500 HydrophobicContact CB-CD1 4.18Å; A468-I500 HydrophobicContact CB-CD1 3.99Å; A468-I500 HydrophobicContact CB-CG2 3.84Å; M472-I500 HydrophobicContact CG-CD1 4.31Å; A496-I500 WeakPolarHBondContact O-CG1 3.33Å; A496-I500 PolarHBondContact O-N 3.13Å; G498-I500 VanDerWaalsContact C-N 3.29Å; G498-I500 PolarHBondContact O-N 3.4Å
501	H	89.4	Confident	86.8	Confident	5 Å²	5	21.1 Å²	21.1	2%	0.023	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	24.6	-175.6	-57.4	93.6	0	0	0	113.7	L497 G498 N503 H504 G505	L497-H501 PolarHBondContact O-N 3.25Å; L497-H501 PolarHBondContact O-ND1 2.73Å; G498-H501 CarbonylContact O-C 3.57Å; G498-H501 PolarHBondContact O-N 3.18Å; H501-N503 PolarHBondContact O-N 3.21Å; H501-H504 CarbonylContact O-C 3.48Å; H501-H504 WeakPolarHBondContact O-CA 3.48Å; H501-H504 PolarHBondContact O-N 2.89Å; H501-G505 PolarHBondContact O-N 3.1Å
502	A	86.7	Confident	86.8	Confident	8 Å²	8	21.1 Å²	21.1	7%	0.066	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	131.6	-178.1	0	0	0	0	0	111.3	G498 H504 L534 L832	G498-A502 WeakPolarHBondContact O-CA 3.24Å; G498-A502 PolarHBondContact O-N 3.15Å; A502-H504 PolarHBondContact O-N 3.15Å; A502-H504 VanDerWaalsContact O-N 3.09Å; A502-H504 PolarHBondContact O-ND1 3.45Å; A502-L534 WeakPolarHBondContact CA-O 3.16Å; A502-L534 HydrophobicContact CB-CB 4.45Å; A502-L534 HydrophobicContact CB-CD2 4.28Å; A502-L832 HydrophobicContact CB-CD2 3.72Å
503	N	83	Confident	86.8	Confident	29 Å²	29	21.8 Å²	21.8	16%	0.155	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.6	-18.9	-163.7	-60	-38.3	0	0	0	116.3	Q277 H501 G505 L534 M537	Q277-N503 PolarHBondContact NE2-O 3.14Å; H501-N503 PolarHBondContact O-N 3.21Å; N503-G505 PolarHBondContact O-N 3.3Å; N503-L534 PolarHBondContact N-O 3.13Å; N503-L534 VanDerWaalsContact N-O 3.1Å; N503-M537 WeakPolarHBondContact OD1-CE 3.32Å
504	H	78.2	Confident	86.7	Confident	24 Å²	24	25.5 Å²	25.5	11%	0.111	15%	0.146	C	C	.	.			trans	-103.8	30.2	-169.4	-62.9	73.6	0	0	0	111.9	Y272 S379 I384 E465 H501 A502 G506	Y272-H504 AromaticContact CE2-CE1 4Å; Y272-H504 AromaticContact CE2-NE2 3.48Å; Y272-H504 WeakPolarHBondContact CE2-NE2 3.45Å; Y272-H504 AromaticContact CZ-CE1 3.99Å; Y272-H504 AromaticContact CZ-NE2 3.76Å; Y272-H504 PolarHBondContact OH-CE1 2.93Å; Y272-H504 PolarHBondContact OH-NE2 3.32Å; S379-H504 PolarHBondContact O-CD2 2.9Å; S379-H504 VanDerWaalsContact O-CD2 3.25Å; I384-H504 HydrophobicContact CD1-CB 4.27Å; I384-H504 VanDerWaalsContact CD1-CD2 3.43Å; I384-H504 WeakPolarHBondContact CD1-CD2 3.38Å; I384-H504 VanDerWaalsContact CD1-CG 3.45Å; E465-H504 WeakPolarHBondContact OE1-CB 3.39Å; E465-H504 IonicContact OE1-CG 2.65Å; H501-H504 CarbonylContact O-C 3.48Å; H501-H504 WeakPolarHBondContact O-CA 3.48Å; H501-H504 PolarHBondContact O-N 2.89Å; A502-H504 PolarHBondContact O-N 3.15Å; A502-H504 VanDerWaalsContact O-N 3.09Å; A502-H504 PolarHBondContact O-ND1 3.45Å; H504-G506 PolarHBondContact O-N 3.26Å
505	G	66.4	Low	86.5	Confident	16 Å²	16	26.3 Å²	26.3	17%	0.165	15%	0.15	C	C	.	.			trans	-70.3	68.2	178.5	0	0	0	0	0	114.3	H501 N503 T509 A535	H501-G505 PolarHBondContact O-N 3.1Å; N503-G505 PolarHBondContact O-N 3.3Å; G505-T509 WeakPolarHBondContact O-CG2 3.48Å; G505-T509 PolarHBondContact O-OG1 3.46Å; G505-A535 WeakPolarHBondContact CA-O 3.46Å; G505-A535 PolarHBondContact N-O 3.15Å; G505-A535 VanDerWaalsContact N-O 3.1Å
506	G	75	Confident	86.2	Confident	48 Å²	48	26.5 Å²	26.5	50%	0.495	15%	0.151	S	C	.	.	S	Bend	trans	-70.9	-123.8	161.8	0	0	0	0	0	110.9	H504 M508 T509	H504-G506 PolarHBondContact O-N 3.26Å; G506-M508 PolarHBondContact O-N 3.14Å; G506-T509 PolarHBondContact O-N 2.81Å; G506-T509 PolarHBondContact O-OG1 3.48Å
507	T	79.4	Confident	86	Confident	89 Å²	89	31.7 Å²	31.7	55%	0.546	17%	0.174	S	C	.	.	H	α-helix	trans	-52.9	-26.8	178	49	0	0	0	0	114.4	T509 E510 Y511	T507-T509 VanDerWaalsContact C-N 3.27Å; T507-T509 PolarHBondContact O-N 3.01Å; T507-E510 WeakPolarHBondContact O-CB 3.04Å; T507-E510 PolarHBondContact O-N 2.97Å; T507-E510 VanDerWaalsContact O-N 3.16Å; T507-Y511 PolarHBondContact O-N 3.33Å
508	M	83.1	Confident	85.8	Confident	33 Å²	33	37.1 Å²	37.1	16%	0.163	20%	0.199	C	C	.	.	H	α-helix	trans	-69.1	-21.2	177.4	-60.5	-59.7	161.9	0	0	113.4	G506 L512	G506-M508 PolarHBondContact O-N 3.14Å; M508-L512 WeakPolarHBondContact O-CB 3.48Å; M508-L512 WeakPolarHBondContact O-CD1 3.39Å; M508-L512 VanDerWaalsContact O-CG 3.28Å; M508-L512 WeakPolarHBondContact O-CG 3.42Å; M508-L512 PolarHBondContact O-N 2.9Å
509	T	85.2	Confident	85.5	Confident	4 Å²	4	37.9 Å²	37.9	3%	0.025	21%	0.206	C	C	.	.	H	α-helix	trans	-69.2	-38.8	169.3	54.7	0	0	0	0	111.6	G505 G506 T507 L512 L513 A535 A536 R541	G505-T509 WeakPolarHBondContact O-CG2 3.48Å; G505-T509 PolarHBondContact O-OG1 3.46Å; G506-T509 PolarHBondContact O-N 2.81Å; G506-T509 PolarHBondContact O-OG1 3.48Å; T507-T509 VanDerWaalsContact C-N 3.27Å; T507-T509 PolarHBondContact O-N 3.01Å; T509-L512 PolarHBondContact O-N 3.26Å; T509-L513 WeakPolarHBondContact O-CB 2.95Å; T509-L513 PolarHBondContact O-N 3.15Å; T509-A535 HydrophobicContact CG2-CB 3.83Å; T509-A536 HydrophobicContact CG2-CB 4.03Å; T509-R541 PolarHBondContact OG1-NH1 3.04Å
510	E	87.8	Confident	85.1	Confident	117 Å²	117	43.9 Å²	43.9	55%	0.547	24%	0.242	S	C	.	.	H	α-helix	trans	-64.6	-42.1	176.9	-57.9	175.1	157.8	0	0	110.8	T507 L513 N514	T507-E510 WeakPolarHBondContact O-CB 3.04Å; T507-E510 PolarHBondContact O-N 2.97Å; T507-E510 VanDerWaalsContact O-N 3.16Å; E510-L513 PolarHBondContact O-N 3.4Å; E510-N514 PolarHBondContact O-N 3.34Å; E510-N514 VanDerWaalsContact O-N 3.07Å
511	Y	89.2	Confident	85	Confident	67 Å²	67	45.3 Å²	45.3	26%	0.263	25%	0.254	S	S	.	.	H	α-helix	trans	-61.5	-52.4	173.8	179.3	-99	0	0	0	112.2	L476 L494 L497 T507 L513 N514 Q515	L476-Y511 HydrophobicContact CD2-CE1 4.5Å; L494-Y511 HydrophobicContact CD2-CE1 4.37Å; L497-Y511 HydrophobicContact CD2-CD1 3.71Å; L497-Y511 HydrophobicContact CD2-CE1 3.7Å; T507-Y511 PolarHBondContact O-N 3.33Å; Y511-L513 VanDerWaalsContact C-N 3.3Å; Y511-L513 PolarHBondContact O-N 2.99Å; Y511-N514 PolarHBondContact O-N 3.43Å; Y511-Q515 HydrophobicContact CD1-CG 4.38Å; Y511-Q515 HydrophobicContact CE1-CG 3.95Å; Y511-Q515 HydrophobicContact CE2-CG 4.22Å; Y511-Q515 WeakPolarHBondContact O-CG 3.15Å; Y511-Q515 PolarHBondContact O-N 3.01Å
512	L	90.2	Very high	85	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-64.6	-32.9	179	-72.5	166.3	0	0	0	112.2	L494 L497 M508 T509 C516 L532 A535	L494-L512 HydrophobicContact CB-CD2 4.38Å; L494-L512 HydrophobicContact CD2-CD2 4.02Å; L497-L512 HydrophobicContact CD2-CD2 4.25Å; L497-L512 HydrophobicContact CD2-CG 4.47Å; M508-L512 WeakPolarHBondContact O-CB 3.48Å; M508-L512 WeakPolarHBondContact O-CD1 3.39Å; M508-L512 VanDerWaalsContact O-CG 3.28Å; M508-L512 WeakPolarHBondContact O-CG 3.42Å; M508-L512 PolarHBondContact O-N 2.9Å; T509-L512 PolarHBondContact O-N 3.26Å; L512-C516 WeakPolarHBondContact O-CB 3.28Å; L512-C516 PolarHBondContact O-N 3.33Å; L512-L532 HydrophobicContact CB-CB 4.2Å; L512-L532 HydrophobicContact CB-CD1 3.96Å; L512-A535 HydrophobicContact CD1-CB 3.89Å
513	L	90.4	Very high	85.2	Confident	13 Å²	13	48.6 Å²	48.6	7%	0.068	27%	0.27	C	S	.	.	H	α-helix	trans	-69.5	-33.9	176.9	-172	70.1	0	0	0	112.4	T509 E510 Y511 K517 L532 V544 Q547	T509-L513 WeakPolarHBondContact O-CB 2.95Å; T509-L513 PolarHBondContact O-N 3.15Å; E510-L513 PolarHBondContact O-N 3.4Å; Y511-L513 VanDerWaalsContact C-N 3.3Å; Y511-L513 PolarHBondContact O-N 2.99Å; L513-K517 WeakPolarHBondContact O-CD 3.36Å; L513-K517 WeakPolarHBondContact O-CG 3.41Å; L513-K517 PolarHBondContact O-N 3.31Å; L513-L532 HydrophobicContact CB-CD1 4.29Å; L513-L532 HydrophobicContact CD1-CD2 3.92Å; L513-V544 HydrophobicContact CD1-CG2 4.42Å; L513-Q547 HydrophobicContact CD1-CB 3.86Å; L513-Q547 HydrophobicContact CD1-CG 3.77Å
514	N	90.4	Very high	85.7	Confident	78 Å²	78	47.8 Å²	47.8	42%	0.417	27%	0.266	S	S	.	.	H	α-helix	trans	-72.7	-48.5	173.2	-69.1	-12.3	0	0	0	110.7	E510 Y511 C516 K517 E518	E510-N514 PolarHBondContact O-N 3.34Å; E510-N514 VanDerWaalsContact O-N 3.07Å; Y511-N514 PolarHBondContact O-N 3.43Å; N514-C516 PolarHBondContact O-N 3.16Å; N514-K517 WeakPolarHBondContact O-CA 3.32Å; N514-K517 WeakPolarHBondContact O-CB 3.36Å; N514-K517 PolarHBondContact O-N 3.39Å; N514-E518 WeakPolarHBondContact O-CG 3.38Å; N514-E518 PolarHBondContact O-N 3.17Å
515	Q	88	Confident	86.4	Confident	18 Å²	18	48.1 Å²	48.1	8%	0.084	27%	0.266	C	S	.	.	H	α-helix	trans	-59.7	-33.5	176	-67	-77.5	-85.3	0	0	112.5	L494 Y511 K517 E518 A519	L494-Q515 HydrophobicContact CD2-CB 4.25Å; L494-Q515 HydrophobicContact CD2-CG 4.37Å; Y511-Q515 HydrophobicContact CD1-CG 4.38Å; Y511-Q515 HydrophobicContact CE1-CG 3.95Å; Y511-Q515 HydrophobicContact CE2-CG 4.22Å; Y511-Q515 WeakPolarHBondContact O-CG 3.15Å; Y511-Q515 PolarHBondContact O-N 3.01Å; Q515-K517 VanDerWaalsContact C-N 3.29Å; Q515-K517 PolarHBondContact O-N 2.98Å; Q515-E518 PolarHBondContact NE2-OE2 2.76Å; Q515-E518 PolarHBondContact O-N 3.4Å; Q515-A519 WeakPolarHBondContact O-CB 3.28Å; Q515-A519 PolarHBondContact O-N 3.37Å
516	C	87.8	Confident	87.6	Confident	4 Å²	4	47.4 Å²	47.4	3%	0.027	26%	0.258	C	S	.	.	H	α-helix	trans	-67.3	-24.6	174.2	-166.1	0	0	0	0	113.7	L512 N514 A528 L532 N551	L512-C516 WeakPolarHBondContact O-CB 3.28Å; L512-C516 PolarHBondContact O-N 3.33Å; N514-C516 PolarHBondContact O-N 3.16Å; C516-A528 HydrophobicContact CB-CB 4.06Å; C516-L532 HydrophobicContact CB-CD2 4.04Å; C516-N551 PolarHBondContact SG-ND2 2.89Å
517	K	88.9	Confident	88.5	Confident	109 Å²	109	45.1 Å²	45.1	47%	0.474	24%	0.235	S	C	.	.	H	α-helix	trans	-87.4	-29.9	173.1	-65.7	161.5	-174	164.7	0	112.9	L513 N514 Q515	L513-K517 WeakPolarHBondContact O-CD 3.36Å; L513-K517 WeakPolarHBondContact O-CG 3.41Å; L513-K517 PolarHBondContact O-N 3.31Å; N514-K517 WeakPolarHBondContact O-CA 3.32Å; N514-K517 WeakPolarHBondContact O-CB 3.36Å; N514-K517 PolarHBondContact O-N 3.39Å; Q515-K517 VanDerWaalsContact C-N 3.29Å; Q515-K517 PolarHBondContact O-N 2.98Å
518	E	88.3	Confident	89.1	Confident	113 Å²	113	40.9 Å²	40.9	53%	0.528	21%	0.209	S	C	.	.	H	α-helix	trans	-87	-25.7	-176.5	-68.8	158.1	168.3	0	0	112.4	N514 Q515 T520	N514-E518 WeakPolarHBondContact O-CG 3.38Å; N514-E518 PolarHBondContact O-N 3.17Å; Q515-E518 PolarHBondContact NE2-OE2 2.76Å; Q515-E518 PolarHBondContact O-N 3.4Å; E518-T520 PolarHBondContact O-N 2.87Å
519	A	85.1	Confident	89.7	Confident	17 Å²	17	39.3 Å²	39.3	14%	0.14	20%	0.201	C	C	.	.			trans	-67.1	115.1	-178.6	0	0	0	0	0	112.4	Q515 V524 R525	Q515-A519 WeakPolarHBondContact O-CB 3.28Å; Q515-A519 PolarHBondContact O-N 3.37Å; A519-V524 HydrophobicContact CB-CB 4.18Å; A519-V524 HydrophobicContact CB-CG1 3.72Å; A519-R525 HydrophobicContact CB-CG 3.74Å; A519-R525 WeakPolarHBondContact O-CD 3.2Å; A519-R525 WeakPolarHBondContact O-CG 3.29Å
520	T	83.9	Confident	90.1	Very high	125 Å²	125	39.1 Å²	39.1	77%	0.767	20%	0.2	S	C	*	.			trans	-87.5	-45.1	173.1	52.9	0	0	0	0	112	E518 R525	E518-T520 PolarHBondContact O-N 2.87Å; T520-R525 PolarHBondContact O-NE 2.87Å; T520-R525 PolarHBondContact O-NH2 3.27Å
521	A	89	Confident	90.3	Very high	34 Å²	34	33.6 Å²	33.6	28%	0.281	17%	0.174	S	C	.	.	S	Bend	trans	-72.2	135.9	-174.8	0	0	0	0	0	113.1	V487 V524 R525	V487-A521 HydrophobicContact CG1-CB 3.57Å; A521-V524 HydrophobicContact CB-CB 4.49Å; A521-V524 HydrophobicContact CB-CG2 4.13Å; A521-V524 WeakPolarHBondContact O-CB 3.49Å; A521-V524 PolarHBondContact O-N 3.02Å; A521-V524 VanDerWaalsContact O-N 3.07Å; A521-R525 PolarHBondContact O-N 3.05Å
522	E	89.6	Confident	90.5	Very high	71 Å²	71	30.4 Å²	30.4	33%	0.332	16%	0.162	S	C	.	.	H	α-helix	trans	-53.3	-49.8	-178.5	163.3	-169.5	-154.8	0	0	113.8	V524 R525 H526 I558	E522-V524 PolarHBondContact O-N 3.43Å; E522-R525 PolarHBondContact O-N 2.74Å; E522-H526 WeakPolarHBondContact O-CB 3.38Å; E522-H526 PolarHBondContact O-N 2.88Å; E522-I558 HydrophobicContact CG-CB 4.12Å; E522-I558 WeakPolarHBondContact OE1-CB 3.48Å; E522-I558 VanDerWaalsContact OE1-CD1 3.31Å; E522-I558 WeakPolarHBondContact OE1-CD1 3.43Å; E522-I558 WeakPolarHBondContact OE1-CG1 3.38Å
523	P	91.4	Very high	90.6	Very high	12 Å²	12	30.4 Å²	30.4	8%	0.078	16%	0.162	C	C	.	.	H	α-helix	trans	-63.7	-27	178.6	-21.9	32.9	0	0	0	113.5	W448 V487 Y488 G491 G527	W448-P523 HydrophobicContact CH2-CB 4Å; W448-P523 HydrophobicContact CH2-CG 4.36Å; W448-P523 HydrophobicContact CZ2-CG 4.49Å; V487-P523 HydrophobicContact CG1-CB 4.14Å; V487-P523 HydrophobicContact CG1-CG 3.99Å; Y488-P523 HydrophobicContact CD1-CB 3.99Å; Y488-P523 HydrophobicContact CD1-CG 4.08Å; Y488-P523 HydrophobicContact CE1-CB 4.21Å; Y488-P523 HydrophobicContact CE1-CG 3.82Å; G491-P523 WeakPolarHBondContact CA-O 3.43Å; P523-G527 PolarHBondContact O-N 3.38Å
524	V	92.3	Very high	90.7	Very high	12 Å²	12	29.8 Å²	29.8	7%	0.073	16%	0.158	C	C	.	.	H	α-helix	trans	-78	-43.1	176.3	-172.3	0	0	0	0	110.3	P477 V487 E490 L494 A519 A521 E522 G527 A528	P477-V524 HydrophobicContact CG-CG1 4.32Å; V487-V524 HydrophobicContact CG1-CG2 3.75Å; E490-V524 HydrophobicContact CB-CG2 4.15Å; L494-V524 HydrophobicContact CD1-CG1 3.58Å; A519-V524 HydrophobicContact CB-CB 4.18Å; A519-V524 HydrophobicContact CB-CG1 3.72Å; A521-V524 HydrophobicContact CB-CB 4.49Å; A521-V524 HydrophobicContact CB-CG2 4.13Å; A521-V524 WeakPolarHBondContact O-CB 3.49Å; A521-V524 PolarHBondContact O-N 3.02Å; A521-V524 VanDerWaalsContact O-N 3.07Å; E522-V524 PolarHBondContact O-N 3.43Å; V524-G527 PolarHBondContact O-N 3.41Å; V524-A528 VanDerWaalsContact O-CB 3.27Å; V524-A528 WeakPolarHBondContact O-CB 3.29Å; V524-A528 PolarHBondContact O-N 3.27Å
525	R	92.3	Very high	90.7	Very high	30 Å²	30	26 Å²	26	11%	0.113	14%	0.138	C	C	.	.	H	α-helix	trans	-61	-44.8	172.1	-76.6	-172.7	-78.9	111	18	111.8	A519 T520 A521 E522 A528 C529 D556 T559	A519-R525 HydrophobicContact CB-CG 3.74Å; A519-R525 WeakPolarHBondContact O-CD 3.2Å; A519-R525 WeakPolarHBondContact O-CG 3.29Å; T520-R525 PolarHBondContact O-NE 2.87Å; T520-R525 PolarHBondContact O-NH2 3.27Å; A521-R525 PolarHBondContact O-N 3.05Å; E522-R525 PolarHBondContact O-N 2.74Å; R525-A528 PolarHBondContact O-N 3.21Å; R525-C529 WeakPolarHBondContact O-CB 3.39Å; R525-C529 PolarHBondContact O-N 2.83Å; R525-C529 PolarHBondContact O-SG 2.93Å; R525-C529 VanDerWaalsContact O-SG 3.39Å; R525-D556 IonicContact CZ-OD2 3.51Å; R525-D556 IonicContact NH1-OD2 3.71Å; R525-D556 PolarHBondContact NH1-OD2 3.44Å; R525-D556 IonicContact NH2-OD2 2.69Å; R525-D556 PolarHBondContact NH2-OD2 3.38Å; R525-T559 HydrophobicContact CB-CG2 3.75Å; R525-T559 PolarHBondContact NH1-OG1 2.73Å
526	H	93.5	Very high	90.8	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-56.7	-50.4	172.8	178.5	91.5	0	0	0	112	F451 E522 A528 C529 L530 I558 A562 W823	F451-H526 AromaticContact CZ-CD2 3.62Å; E522-H526 WeakPolarHBondContact O-CB 3.38Å; E522-H526 PolarHBondContact O-N 2.88Å; H526-A528 PolarHBondContact O-N 2.93Å; H526-C529 PolarHBondContact O-N 2.98Å; H526-L530 PolarHBondContact O-N 2.85Å; H526-L530 VanDerWaalsContact O-N 3.12Å; H526-I558 HydrophobicContact CB-CG2 4.23Å; H526-I558 VanDerWaalsContact ND1-CG2 3.35Å; H526-I558 WeakPolarHBondContact ND1-CG2 3.42Å; H526-I558 PolarHBondContact ND1-O 2.88Å; H526-A562 HydrophobicContact CB-CB 4.4Å; H526-A562 WeakPolarHBondContact ND1-CB 3.48Å; H526-W823 AromaticContact CE1-CD1 3.97Å; H526-W823 AromaticContact CE1-CE2 3.7Å; H526-W823 AromaticContact CE1-CZ2 3.92Å; H526-W823 AromaticContact CE1-NE1 3.12Å; H526-W823 PolarHBondContact CE1-NE1 3.26Å; H526-W823 AromaticContact NE2-CD1 4Å; H526-W823 AromaticContact NE2-CE2 3.71Å; H526-W823 AromaticContact NE2-CZ2 3.9Å; H526-W823 AromaticContact NE2-NE1 2.97Å; H526-W823 PolarHBondContact NE2-NE1 3.03Å
527	G	93	Very high	91	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-62.6	-38.6	176.8	0	0	0	0	0	113.8	G491 F495 P523 V524 G531	G491-G527 WeakPolarHBondContact O-CA 3.4Å; F495-G527 PolarHBondContact N-O 3.44Å; P523-G527 PolarHBondContact O-N 3.38Å; V524-G527 PolarHBondContact O-N 3.41Å; G527-G531 PolarHBondContact O-N 3.49Å
528	A	92.9	Very high	90.8	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-65.5	-47.5	175.5	0	0	0	0	0	111.8	L494 C516 V524 R525 H526 G531 L532	L494-A528 HydrophobicContact CD1-CB 4.02Å; C516-A528 HydrophobicContact CB-CB 4.06Å; V524-A528 VanDerWaalsContact O-CB 3.27Å; V524-A528 WeakPolarHBondContact O-CB 3.29Å; V524-A528 PolarHBondContact O-N 3.27Å; R525-A528 PolarHBondContact O-N 3.21Å; H526-A528 PolarHBondContact O-N 2.93Å; A528-G531 PolarHBondContact O-N 3.39Å; A528-L532 WeakPolarHBondContact O-CB 3.46Å; A528-L532 PolarHBondContact O-N 3.1Å
529	C	94.2	Very high	90.7	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-60.3	-47	178.4	-75.3	0	0	0	0	112.2	R525 H526 G533 A562	R525-C529 WeakPolarHBondContact O-CB 3.39Å; R525-C529 PolarHBondContact O-N 2.83Å; R525-C529 PolarHBondContact O-SG 2.93Å; R525-C529 VanDerWaalsContact O-SG 3.39Å; H526-C529 PolarHBondContact O-N 2.98Å; C529-G533 PolarHBondContact O-N 3.39Å; C529-A562 HydrophobicContact CB-CB 3.84Å
530	L	94	Very high	90.6	Very high	1 Å²	1	15.4 Å²	15.4	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-64.9	-43.7	175.9	-65.9	-177.1	0	0	0	112.1	F495 H526 L534 A562 I565 F829	F495-L530 HydrophobicContact CD2-CB 3.59Å; F495-L530 HydrophobicContact CD2-CD1 4.19Å; F495-L530 HydrophobicContact CE1-CD1 4.42Å; F495-L530 HydrophobicContact CE2-CB 3.88Å; F495-L530 HydrophobicContact CE2-CD1 4.06Å; F495-L530 HydrophobicContact CG-CB 4.31Å; F495-L530 HydrophobicContact CG-CD1 4.43Å; F495-L530 HydrophobicContact CZ-CD1 4.2Å; H526-L530 PolarHBondContact O-N 2.85Å; H526-L530 VanDerWaalsContact O-N 3.12Å; L530-L534 WeakPolarHBondContact O-CB 3.42Å; L530-L534 WeakPolarHBondContact O-CG 3.19Å; L530-L534 PolarHBondContact O-N 2.84Å; L530-A562 HydrophobicContact CD2-CB 3.73Å; L530-A562 HydrophobicContact CG-CB 3.69Å; L530-I565 HydrophobicContact CD2-CB 4.33Å; L530-I565 HydrophobicContact CD2-CG2 4.16Å; L530-F829 HydrophobicContact CD2-CZ 4.27Å
531	G	92.6	Very high	90.8	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-65.4	-43.2	-179.7	0	0	0	0	0	112.9	G498 G527 A528 L534 A535	G498-G531 WeakPolarHBondContact CA-O 3.19Å; G527-G531 PolarHBondContact O-N 3.49Å; A528-G531 PolarHBondContact O-N 3.39Å; G531-L534 PolarHBondContact O-N 3.18Å; G531-A535 WeakPolarHBondContact O-CB 2.99Å; G531-A535 PolarHBondContact O-N 3.04Å
532	L	93.4	Very high	90.8	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-66.8	-43.3	177.2	-179.3	58.4	0	0	0	111.5	L512 L513 C516 A528 L534 A535 A536 V544 I548	L512-L532 HydrophobicContact CB-CB 4.2Å; L512-L532 HydrophobicContact CB-CD1 3.96Å; L513-L532 HydrophobicContact CB-CD1 4.29Å; L513-L532 HydrophobicContact CD1-CD2 3.92Å; C516-L532 HydrophobicContact CB-CD2 4.04Å; A528-L532 WeakPolarHBondContact O-CB 3.46Å; A528-L532 PolarHBondContact O-N 3.1Å; L532-L534 PolarHBondContact O-N 2.94Å; L532-A535 PolarHBondContact O-N 3.03Å; L532-A536 WeakPolarHBondContact O-CB 3.16Å; L532-A536 PolarHBondContact O-N 2.85Å; L532-V544 HydrophobicContact CD1-CG1 3.94Å; L532-V544 HydrophobicContact CD2-CG1 3.95Å; L532-V544 HydrophobicContact CG-CG1 3.69Å; L532-I548 HydrophobicContact CD2-CD1 4.21Å; L532-I548 HydrophobicContact CD2-CG1 4.07Å; L532-I548 HydrophobicContact CG-CD1 4.31Å
533	G	92.4	Very high	90.8	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-60.4	-41.1	174.6	0	0	0	0	0	113	C529 M537 L569	C529-G533 PolarHBondContact O-N 3.39Å; G533-M537 WeakPolarHBondContact O-CA 3.49Å; G533-M537 PolarHBondContact O-N 3.03Å; G533-L569 WeakPolarHBondContact O-CB 3.28Å
534	L	92.2	Very high	90.8	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-65.5	-45.3	173.9	-81.1	170.6	0	0	0	113	F495 L499 A502 N503 L530 G531 L532 M537 L569 F829 L832	F495-L534 HydrophobicContact CD2-CD1 4.04Å; F495-L534 HydrophobicContact CE2-CD1 3.67Å; L499-L534 HydrophobicContact CD2-CD1 3.59Å; L499-L534 HydrophobicContact CG-CD1 3.75Å; A502-L534 WeakPolarHBondContact CA-O 3.16Å; A502-L534 HydrophobicContact CB-CB 4.45Å; A502-L534 HydrophobicContact CB-CD2 4.28Å; N503-L534 PolarHBondContact N-O 3.13Å; N503-L534 VanDerWaalsContact N-O 3.1Å; L530-L534 WeakPolarHBondContact O-CB 3.42Å; L530-L534 WeakPolarHBondContact O-CG 3.19Å; L530-L534 PolarHBondContact O-N 2.84Å; G531-L534 PolarHBondContact O-N 3.18Å; L532-L534 PolarHBondContact O-N 2.94Å; L534-M537 VanDerWaalsContact O-CB 3.32Å; L534-M537 WeakPolarHBondContact O-CB 3.49Å; L534-M537 PolarHBondContact O-N 2.88Å; L534-L569 HydrophobicContact CG-CD1 4.42Å; L534-F829 HydrophobicContact CD1-CE1 4.13Å; L534-F829 HydrophobicContact CD1-CZ 4.17Å; L534-F829 HydrophobicContact CD2-CD1 4.05Å; L534-F829 HydrophobicContact CD2-CE1 3.59Å; L534-F829 HydrophobicContact CD2-CZ 4.42Å; L534-F829 HydrophobicContact CG-CE1 3.89Å; L534-F829 HydrophobicContact CG-CZ 4.27Å; L534-L832 HydrophobicContact CD2-CD1 3.88Å; L534-L832 HydrophobicContact CD2-CD2 4.27Å
535	A	90.9	Very high	90.9	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-64.9	-42.7	-179.7	0	0	0	0	0	111.6	G505 T509 L512 G531 L532 M537	G505-A535 WeakPolarHBondContact CA-O 3.46Å; G505-A535 PolarHBondContact N-O 3.15Å; G505-A535 VanDerWaalsContact N-O 3.1Å; T509-A535 HydrophobicContact CG2-CB 3.83Å; L512-A535 HydrophobicContact CD1-CB 3.89Å; G531-A535 WeakPolarHBondContact O-CB 2.99Å; G531-A535 PolarHBondContact O-N 3.04Å; L532-A535 PolarHBondContact O-N 3.03Å; A535-M537 VanDerWaalsContact C-N 3.33Å; A535-M537 PolarHBondContact O-N 3.22Å
536	A	90	Very high	90.9	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	16.6	178.8	0	0	0	0	0	114	T509 L532 G538 T539 V544 V570	T509-A536 HydrophobicContact CG2-CB 4.03Å; L532-A536 WeakPolarHBondContact O-CB 3.16Å; L532-A536 PolarHBondContact O-N 2.85Å; A536-G538 PolarHBondContact O-N 3.39Å; A536-T539 WeakPolarHBondContact O-CB 3.49Å; A536-T539 WeakPolarHBondContact O-CG2 3.45Å; A536-T539 PolarHBondContact O-N 2.89Å; A536-T539 PolarHBondContact O-OG1 2.86Å; A536-V544 HydrophobicContact CB-CG1 4.14Å; A536-V544 HydrophobicContact CB-CG2 4.41Å; A536-V570 HydrophobicContact CB-CG2 4Å
537	M	90.6	Very high	90.8	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	128.1	-175.3	-176.8	165	72.9	0	0	112.1	N503 G533 L534 A535 T539 L569 L572 A809 V812 L832	N503-M537 WeakPolarHBondContact OD1-CE 3.32Å; G533-M537 WeakPolarHBondContact O-CA 3.49Å; G533-M537 PolarHBondContact O-N 3.03Å; L534-M537 VanDerWaalsContact O-CB 3.32Å; L534-M537 WeakPolarHBondContact O-CB 3.49Å; L534-M537 PolarHBondContact O-N 2.88Å; A535-M537 VanDerWaalsContact C-N 3.33Å; A535-M537 PolarHBondContact O-N 3.22Å; M537-T539 VanDerWaalsContact C-N 3.25Å; M537-T539 PolarHBondContact O-N 2.94Å; M537-L569 CarbonylContact C-O 3.52Å; M537-L569 WeakPolarHBondContact CA-O 3.48Å; M537-L569 HydrophobicContact CG-CB 4.46Å; M537-L569 HydrophobicContact CG-CD2 4.26Å; M537-L569 HydrophobicContact SD-CD2 3.64Å; M537-L572 HydrophobicContact CG-CD2 3.56Å; M537-L572 HydrophobicContact SD-CD2 4Å; M537-A809 HydrophobicContact CE-CB 4.15Å; M537-V812 HydrophobicContact SD-CG1 4.04Å; M537-L832 HydrophobicContact CE-CD1 4.27Å; M537-L832 HydrophobicContact CE-CD2 4.26Å; M537-L832 HydrophobicContact SD-CD1 4.46Å
538	G	85.7	Confident	90.7	Very high	3 Å²	3	20 Å²	20	3%	0.031	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.8	20.7	178.5	0	0	0	0	0	115.3	N278 A536 L569	N278-G538 WeakPolarHBondContact CB-O 3.38Å; N278-G538 PolarHBondContact N-O 3.45Å; N278-G538 VanDerWaalsContact N-O 3.07Å; A536-G538 PolarHBondContact O-N 3.39Å; G538-L569 PolarHBondContact N-O 3.14Å
539	T	85.7	Confident	90.7	Very high	12 Å²	12	21.3 Å²	21.3	7%	0.074	11%	0.108	C	C	.	.			trans	-90.8	-25.4	179.7	62.5	0	0	0	0	114	Q277 A536 M537 R541 V570	Q277-T539 HydrophobicContact CG-CG2 4.39Å; A536-T539 WeakPolarHBondContact O-CB 3.49Å; A536-T539 WeakPolarHBondContact O-CG2 3.45Å; A536-T539 PolarHBondContact O-N 2.89Å; A536-T539 PolarHBondContact O-OG1 2.86Å; M537-T539 VanDerWaalsContact C-N 3.25Å; M537-T539 PolarHBondContact O-N 2.94Å; T539-R541 VanDerWaalsContact C-N 3.31Å; T539-R541 PolarHBondContact O-N 3.29Å; T539-V570 PolarHBondContact N-O 3.33Å
540	G	84	Confident	90.6	Very high	22 Å²	22	26 Å²	26	23%	0.227	13%	0.132	C	C	.	.			trans	66.7	26.9	-177	0	0	0	0	0	114.5	E542 V570	G540-E542 PolarHBondContact O-N 2.9Å; G540-V570 PolarHBondContact N-O 2.96Å
541	R	87.7	Confident	90.4	Very high	66 Å²	66	26.5 Å²	26.5	25%	0.249	14%	0.135	C	C	.	.			trans	-74.8	109.8	-179.9	-88.6	-179.4	67.4	179.3	-1.1	112.6	T509 T539 D543 V544 Y545	T509-R541 PolarHBondContact OG1-NH1 3.04Å; T539-R541 VanDerWaalsContact C-N 3.31Å; T539-R541 PolarHBondContact O-N 3.29Å; R541-D543 VanDerWaalsContact C-N 3.28Å; R541-D543 WeakPolarHBondContact CB-OD1 3.39Å; R541-D543 IonicContact CZ-OD1 3.86Å; R541-D543 IonicContact CZ-OD2 3.85Å; R541-D543 IonicContact NE-OD1 3.2Å; R541-D543 PolarHBondContact NE-OD1 3.46Å; R541-D543 IonicContact NE-OD2 3.52Å; R541-D543 IonicContact NH2-OD1 2.79Å; R541-D543 PolarHBondContact NH2-OD1 3.14Å; R541-D543 IonicContact NH2-OD2 2.85Å; R541-D543 PolarHBondContact NH2-OD2 3.3Å; R541-D543 PolarHBondContact O-N 3.14Å; R541-V544 HydrophobicContact CB-CB 4.16Å; R541-V544 HydrophobicContact CB-CG2 3.95Å; R541-V544 PolarHBondContact O-N 3.25Å; R541-Y545 PolarHBondContact O-N 3.41Å
542	E	88	Confident	90.3	Very high	118 Å²	118	26.6 Å²	26.6	55%	0.551	14%	0.136	S	C	*	.	H	α-helix	trans	-59.6	-35.5	175.9	-63.6	-164.2	122.3	0	0	112.9	G540 V544 Y545 D546 R578	G540-E542 PolarHBondContact O-N 2.9Å; E542-V544 VanDerWaalsContact C-N 3.32Å; E542-V544 PolarHBondContact O-N 3.4Å; E542-Y545 WeakPolarHBondContact O-CB 3.27Å; E542-Y545 PolarHBondContact O-N 3.16Å; E542-D546 PolarHBondContact O-N 3.42Å; E542-R578 IonicContact OE1-NH1 2.77Å; E542-R578 PolarHBondContact OE1-NH1 3.04Å
543	D	90.7	Very high	90.2	Very high	74 Å²	74	31.9 Å²	31.9	40%	0.396	16%	0.157	S	C	.	.	H	α-helix	trans	-70	-27.7	-178.8	74.7	-52.2	0	0	0	113.4	R541 Q547	R541-D543 VanDerWaalsContact C-N 3.28Å; R541-D543 WeakPolarHBondContact CB-OD1 3.39Å; R541-D543 IonicContact CZ-OD1 3.86Å; R541-D543 IonicContact CZ-OD2 3.85Å; R541-D543 IonicContact NE-OD1 3.2Å; R541-D543 PolarHBondContact NE-OD1 3.46Å; R541-D543 IonicContact NE-OD2 3.52Å; R541-D543 IonicContact NH2-OD1 2.79Å; R541-D543 PolarHBondContact NH2-OD1 3.14Å; R541-D543 IonicContact NH2-OD2 2.85Å; R541-D543 PolarHBondContact NH2-OD2 3.3Å; R541-D543 PolarHBondContact O-N 3.14Å; D543-Q547 VanDerWaalsContact O-CG 3.3Å; D543-Q547 WeakPolarHBondContact O-CG 3.46Å
544	V	91.8	Very high	90	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-79.4	-43.7	171.1	-180	0	0	0	0	110	L513 L532 A536 R541 E542 Q547 I548 V570	L513-V544 HydrophobicContact CD1-CG2 4.42Å; L532-V544 HydrophobicContact CD1-CG1 3.94Å; L532-V544 HydrophobicContact CD2-CG1 3.95Å; L532-V544 HydrophobicContact CG-CG1 3.69Å; A536-V544 HydrophobicContact CB-CG1 4.14Å; A536-V544 HydrophobicContact CB-CG2 4.41Å; R541-V544 HydrophobicContact CB-CB 4.16Å; R541-V544 HydrophobicContact CB-CG2 3.95Å; R541-V544 PolarHBondContact O-N 3.25Å; E542-V544 VanDerWaalsContact C-N 3.32Å; E542-V544 PolarHBondContact O-N 3.4Å; V544-Q547 PolarHBondContact O-N 3.09Å; V544-I548 HydrophobicContact CG1-CD1 3.91Å; V544-I548 HydrophobicContact CG1-CG1 4.48Å; V544-I548 WeakPolarHBondContact O-CG1 3.39Å; V544-I548 PolarHBondContact O-N 2.93Å; V544-I548 VanDerWaalsContact O-N 3.08Å; V544-V570 HydrophobicContact CB-CG1 4.45Å; V544-V570 HydrophobicContact CG1-CG2 3.75Å
545	Y	92.8	Very high	89.9	Confident	8 Å²	8	39.1 Å²	39.1	3%	0.031	19%	0.192	C	C	.	.	H	α-helix	trans	-55.5	-51.5	176.8	168.8	-89.3	0	0	0	112.1	R541 E542 Q547 I548 K549 I567 M571 A579 D582	R541-Y545 PolarHBondContact O-N 3.41Å; E542-Y545 WeakPolarHBondContact O-CB 3.27Å; E542-Y545 PolarHBondContact O-N 3.16Å; Y545-Q547 VanDerWaalsContact C-N 3.28Å; Y545-Q547 PolarHBondContact O-N 3.42Å; Y545-I548 PolarHBondContact O-N 3.27Å; Y545-K549 HydrophobicContact CE1-CD 3.84Å; Y545-K549 WeakPolarHBondContact O-CB 3.29Å; Y545-K549 PolarHBondContact O-N 3.08Å; Y545-I567 HydrophobicContact CD2-CG1 4.21Å; Y545-I567 HydrophobicContact CD2-CG2 3.81Å; Y545-I567 HydrophobicContact CE2-CG1 4.33Å; Y545-I567 HydrophobicContact CE2-CG2 3.59Å; Y545-M571 HydrophobicContact CD2-CG 3.8Å; Y545-M571 HydrophobicContact CD2-SD 4.47Å; Y545-M571 HydrophobicContact CE2-CG 4.44Å; Y545-A579 HydrophobicContact CE2-CB 3.99Å; Y545-D582 WeakPolarHBondContact OH-CB 3.43Å; Y545-D582 PolarHBondContact OH-OD2 3.01Å
546	D	92.7	Very high	89.9	Confident	61 Å²	61	40.3 Å²	40.3	33%	0.326	20%	0.199	S	C	.	.	H	α-helix	trans	-64.5	-30.4	-177.3	-76.9	-25.7	0	0	0	112.2	E542 L550 R578	E542-D546 PolarHBondContact O-N 3.42Å; D546-L550 WeakPolarHBondContact O-CG 3.4Å; D546-L550 PolarHBondContact O-N 2.81Å; D546-L550 VanDerWaalsContact O-N 3.17Å; D546-R578 IonicContact OD1-NH2 3.21Å; D546-R578 PolarHBondContact OD1-NH2 3.17Å; D546-R578 IonicContact OD2-NH2 2.69Å
547	Q	90.9	Very high	89.9	Confident	54 Å²	54	41.6 Å²	41.6	25%	0.252	21%	0.209	S	C	.	.	H	α-helix	trans	-74.7	-40.7	175.1	-64.1	-60.4	-71.4	0	0	112.6	L513 D543 V544 Y545 K549 L550 N551	L513-Q547 HydrophobicContact CD1-CB 3.86Å; L513-Q547 HydrophobicContact CD1-CG 3.77Å; D543-Q547 VanDerWaalsContact O-CG 3.3Å; D543-Q547 WeakPolarHBondContact O-CG 3.46Å; V544-Q547 PolarHBondContact O-N 3.09Å; Y545-Q547 VanDerWaalsContact C-N 3.28Å; Y545-Q547 PolarHBondContact O-N 3.42Å; Q547-K549 VanDerWaalsContact C-N 3.28Å; Q547-K549 PolarHBondContact O-N 3.18Å; Q547-L550 PolarHBondContact O-N 3.25Å; Q547-N551 PolarHBondContact O-N 3.35Å
548	I	92.5	Very high	89.9	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-67.5	-34	174.6	-58.9	173.1	0	0	0	110.3	L532 V544 Y545 L550 N551 L552 A563 I567 V570	L532-I548 HydrophobicContact CD2-CD1 4.21Å; L532-I548 HydrophobicContact CD2-CG1 4.07Å; L532-I548 HydrophobicContact CG-CD1 4.31Å; V544-I548 HydrophobicContact CG1-CD1 3.91Å; V544-I548 HydrophobicContact CG1-CG1 4.48Å; V544-I548 WeakPolarHBondContact O-CG1 3.39Å; V544-I548 PolarHBondContact O-N 2.93Å; V544-I548 VanDerWaalsContact O-N 3.08Å; Y545-I548 PolarHBondContact O-N 3.27Å; I548-L550 PolarHBondContact O-N 3.07Å; I548-N551 PolarHBondContact O-N 3.45Å; I548-N551 VanDerWaalsContact O-N 3.07Å; I548-L552 PolarHBondContact O-N 2.85Å; I548-A563 VanDerWaalsContact CG2-CA 3.49Å; I548-A563 HydrophobicContact CG2-CB 3.72Å; I548-A563 VanDerWaalsContact CG2-O 3.28Å; I548-A563 WeakPolarHBondContact CG2-O 3.48Å; I548-I567 HydrophobicContact CB-CG1 4.08Å; I548-I567 HydrophobicContact CG2-CD1 4.2Å; I548-I567 HydrophobicContact CG2-CG1 3.77Å; I548-V570 HydrophobicContact CD1-CG2 4.17Å
549	K	92.2	Very high	90.3	Very high	29 Å²	29	42.3 Å²	42.3	13%	0.126	21%	0.212	C	C	.	.	H	α-helix	trans	-61.1	-38.4	173.3	-170.9	177.5	-176.1	-177.8	0	112.9	Y545 Q547 N551 L552 Y553 I567 D582	Y545-K549 HydrophobicContact CE1-CD 3.84Å; Y545-K549 WeakPolarHBondContact O-CB 3.29Å; Y545-K549 PolarHBondContact O-N 3.08Å; Q547-K549 VanDerWaalsContact C-N 3.28Å; Q547-K549 PolarHBondContact O-N 3.18Å; K549-N551 VanDerWaalsContact C-N 3.27Å; K549-N551 PolarHBondContact O-N 3.46Å; K549-L552 WeakPolarHBondContact O-CB 3.38Å; K549-L552 PolarHBondContact O-N 2.83Å; K549-Y553 HydrophobicContact CD-CE2 4.26Å; K549-Y553 VanDerWaalsContact CE-CZ 3.41Å; K549-Y553 WeakPolarHBondContact CE-OH 3.25Å; K549-Y553 HydrophobicContact CG-CD2 4.3Å; K549-Y553 HydrophobicContact CG-CE2 3.93Å; K549-Y553 PolarHBondContact O-N 2.98Å; K549-I567 HydrophobicContact CB-CD1 4.5Å; K549-D582 IonicContact NZ-OD1 2.91Å; K549-D582 PolarHBondContact NZ-OD1 3.47Å; K549-D582 IonicContact NZ-OD2 3.58Å; K549-D582 PolarHBondContact NZ-OD2 2.94Å
550	L	92	Very high	90.5	Very high	97 Å²	97	41.7 Å²	41.7	51%	0.508	21%	0.208	S	C	.	.	H	α-helix	trans	-64.1	-29.7	172.3	-71.9	170.8	0	0	0	113.2	D546 Q547 I548 Q554	D546-L550 WeakPolarHBondContact O-CG 3.4Å; D546-L550 PolarHBondContact O-N 2.81Å; D546-L550 VanDerWaalsContact O-N 3.17Å; Q547-L550 PolarHBondContact O-N 3.25Å; I548-L550 PolarHBondContact O-N 3.07Å; L550-Q554 PolarHBondContact O-NE2 2.86Å; L550-Q554 VanDerWaalsContact O-NE2 3.14Å
551	N	89.5	Confident	90.9	Very high	12 Å²	12	41.1 Å²	41.1	6%	0.064	20%	0.2	C	C	.	.	H	α-helix	trans	-80.9	-27.9	174.2	-73.8	-8.6	0	0	0	112.8	C516 Q547 I548 K549 Q554 T559	C516-N551 PolarHBondContact SG-ND2 2.89Å; Q547-N551 PolarHBondContact O-N 3.35Å; I548-N551 PolarHBondContact O-N 3.45Å; I548-N551 VanDerWaalsContact O-N 3.07Å; K549-N551 VanDerWaalsContact C-N 3.27Å; K549-N551 PolarHBondContact O-N 3.46Å; N551-Q554 PolarHBondContact OD1-NE2 3.41Å; N551-T559 HydrophobicContact CB-CG2 4.1Å
552	L	90.3	Very high	91.2	Very high	3 Å²	3	38 Å²	38	2%	0.016	19%	0.188	C	C	.	.	H	α-helix	trans	-65.5	-47	170.2	-177.1	62.2	0	0	0	110.9	I548 K549 Q554 D555 A563 I567 L583 Y586 I595 V599	I548-L552 PolarHBondContact O-N 2.85Å; K549-L552 WeakPolarHBondContact O-CB 3.38Å; K549-L552 PolarHBondContact O-N 2.83Å; L552-Q554 PolarHBondContact O-N 3.21Å; L552-D555 PolarHBondContact O-N 3.43Å; L552-D555 VanDerWaalsContact O-N 3.12Å; L552-A563 HydrophobicContact CB-CB 3.94Å; L552-A563 HydrophobicContact CD1-CB 4.3Å; L552-I567 HydrophobicContact CD2-CD1 4.02Å; L552-L583 HydrophobicContact CD2-CD2 4.02Å; L552-Y586 HydrophobicContact CD1-CD1 3.88Å; L552-Y586 HydrophobicContact CD1-CE1 3.79Å; L552-Y586 HydrophobicContact CD2-CD1 3.9Å; L552-Y586 HydrophobicContact CD2-CE1 4.45Å; L552-Y586 HydrophobicContact CG-CD1 3.63Å; L552-Y586 HydrophobicContact CG-CE1 3.67Å; L552-Y586 PolarHBondContact O-OH 3.3Å; L552-Y586 VanDerWaalsContact O-OH 3.14Å; L552-I595 HydrophobicContact CD1-CG2 3.54Å; L552-V599 HydrophobicContact CD1-CG2 4.21Å; L552-V599 HydrophobicContact CD2-CG2 4.43Å
553	Y	91.1	Very high	91.5	Very high	111 Å²	111	32.3 Å²	32.3	44%	0.435	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	7.5	178.5	-66	-19.7	0	0	0	115.4	K549 D555 Y586	K549-Y553 HydrophobicContact CD-CE2 4.26Å; K549-Y553 VanDerWaalsContact CE-CZ 3.41Å; K549-Y553 WeakPolarHBondContact CE-OH 3.25Å; K549-Y553 HydrophobicContact CG-CD2 4.3Å; K549-Y553 HydrophobicContact CG-CE2 3.93Å; K549-Y553 PolarHBondContact O-N 2.98Å; Y553-D555 VanDerWaalsContact C-N 3.3Å; Y553-Y586 AromaticContact CD1-CD2 3.71Å; Y553-Y586 HydrophobicContact CD1-CD2 3.71Å; Y553-Y586 AromaticContact CD1-CE2 3.67Å; Y553-Y586 HydrophobicContact CD1-CE2 3.67Å; Y553-Y586 HydrophobicContact CD1-CG 4.2Å; Y553-Y586 AromaticContact CE1-CD2 3.64Å; Y553-Y586 HydrophobicContact CE1-CD2 3.64Å; Y553-Y586 HydrophobicContact CE1-CE2 4.09Å; Y553-Y586 AromaticContact CE1-CG 4Å; Y553-Y586 HydrophobicContact CE1-CG 4Å
554	Q	89.5	Confident	91.7	Very high	91 Å²	91	28.8 Å²	28.8	43%	0.425	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-9.9	166	-72.8	159	28.9	0	0	112.3	L550 N551 L552 D556	L550-Q554 PolarHBondContact O-NE2 2.86Å; L550-Q554 VanDerWaalsContact O-NE2 3.14Å; N551-Q554 PolarHBondContact OD1-NE2 3.41Å; L552-Q554 PolarHBondContact O-N 3.21Å; Q554-D556 HydrophobicContact CB-CB 4.46Å; Q554-D556 PolarHBondContact O-N 2.99Å; Q554-D556 VanDerWaalsContact O-N 3.08Å
555	D	88.7	Confident	91.8	Very high	61 Å²	61	28.9 Å²	28.9	33%	0.326	14%	0.143	S	C	.	.			trans	52.7	23	-176.8	-145.9	25.5	0	0	0	114.5	L552 Y553 A557 Y586 T590 H592 I595	L552-D555 PolarHBondContact O-N 3.43Å; L552-D555 VanDerWaalsContact O-N 3.12Å; Y553-D555 VanDerWaalsContact C-N 3.3Å; D555-A557 PolarHBondContact O-N 2.58Å; D555-Y586 WeakPolarHBondContact CA-OH 3.45Å; D555-Y586 VanDerWaalsContact CB-OH 3.31Å; D555-Y586 WeakPolarHBondContact CB-OH 3.42Å; D555-Y586 PolarHBondContact OD1-OH 3.13Å; D555-Y586 VanDerWaalsContact OD1-OH 3.06Å; D555-T590 WeakPolarHBondContact OD1-CB 3.48Å; D555-T590 PolarHBondContact OD1-OG1 3.15Å; D555-H592 PolarHBondContact O-CD2 3.46Å; D555-H592 IonicContact OD1-CD2 2.75Å; D555-H592 IonicContact OD2-CD2 3.18Å; D555-I595 WeakPolarHBondContact OD1-CD1 3.36Å
556	D	90.8	Very high	91.8	Very high	25 Å²	25	28.5 Å²	28.5	13%	0.134	14%	0.141	C	C	.	.			trans	-74.4	120.1	175.6	170	-39.1	0	0	0	109.4	R525 Q554 I558 T559 G560	R525-D556 IonicContact CZ-OD2 3.51Å; R525-D556 IonicContact NH1-OD2 3.71Å; R525-D556 PolarHBondContact NH1-OD2 3.44Å; R525-D556 IonicContact NH2-OD2 2.69Å; R525-D556 PolarHBondContact NH2-OD2 3.38Å; Q554-D556 HydrophobicContact CB-CB 4.46Å; Q554-D556 PolarHBondContact O-N 2.99Å; Q554-D556 VanDerWaalsContact O-N 3.08Å; D556-I558 PolarHBondContact O-N 3.26Å; D556-I558 PolarHBondContact OD1-N 2.87Å; D556-T559 PolarHBondContact O-N 3.39Å; D556-T559 WeakPolarHBondContact OD1-CB 3.46Å; D556-T559 PolarHBondContact OD1-N 3.3Å; D556-T559 PolarHBondContact OD1-OG1 3.27Å; D556-T559 PolarHBondContact OD2-OG1 2.84Å; D556-G560 WeakPolarHBondContact O-CA 3.27Å; D556-G560 PolarHBondContact O-N 3.14Å
557	A	90.2	Very high	91.9	Very high	26 Å²	26	25.6 Å²	25.6	22%	0.215	13%	0.126	C	C	.	.	H	α-helix	trans	-63.5	-32.4	-165.8	0	0	0	0	0	114.9	D555 H592 K594	D555-A557 PolarHBondContact O-N 2.58Å; A557-H592 HydrophobicContact CB-CB 4.41Å; A557-K594 VanDerWaalsContact O-CB 3.24Å; A557-K594 WeakPolarHBondContact O-CB 3.23Å
558	I	91.7	Very high	92	Very high	18 Å²	18	23 Å²	23	9%	0.092	11%	0.114	C	C	.	.	H	α-helix	trans	-95.5	-36.3	-179.9	-55.6	-179.8	0	0	0	110.5	W448 E522 H526 D556 G560 K594 W823	W448-I558 HydrophobicContact CH2-CG2 3.86Å; W448-I558 HydrophobicContact CZ2-CD1 3.84Å; W448-I558 HydrophobicContact CZ2-CG2 3.98Å; E522-I558 HydrophobicContact CG-CB 4.12Å; E522-I558 WeakPolarHBondContact OE1-CB 3.48Å; E522-I558 VanDerWaalsContact OE1-CD1 3.31Å; E522-I558 WeakPolarHBondContact OE1-CD1 3.43Å; E522-I558 WeakPolarHBondContact OE1-CG1 3.38Å; H526-I558 HydrophobicContact CB-CG2 4.23Å; H526-I558 VanDerWaalsContact ND1-CG2 3.35Å; H526-I558 WeakPolarHBondContact ND1-CG2 3.42Å; H526-I558 PolarHBondContact ND1-O 2.88Å; D556-I558 PolarHBondContact O-N 3.26Å; D556-I558 PolarHBondContact OD1-N 2.87Å; I558-G560 VanDerWaalsContact C-N 3.34Å; I558-K594 HydrophobicContact CG1-CD 4.32Å; I558-W823 HydrophobicContact CD1-CH2 4.09Å; I558-W823 HydrophobicContact CG2-CH2 3.87Å; I558-W823 HydrophobicContact CG2-CZ2 3.67Å
559	T	92.7	Very high	92	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-64.8	-39.7	173.7	-59.5	0	0	0	0	111.4	R525 N551 D556 A562 A563	R525-T559 HydrophobicContact CB-CG2 3.75Å; R525-T559 PolarHBondContact NH1-OG1 2.73Å; N551-T559 HydrophobicContact CB-CG2 4.1Å; D556-T559 PolarHBondContact O-N 3.39Å; D556-T559 WeakPolarHBondContact OD1-CB 3.46Å; D556-T559 PolarHBondContact OD1-N 3.3Å; D556-T559 PolarHBondContact OD1-OG1 3.27Å; D556-T559 PolarHBondContact OD2-OG1 2.84Å; T559-A562 PolarHBondContact O-N 2.92Å; T559-A563 WeakPolarHBondContact O-CB 3.28Å; T559-A563 PolarHBondContact O-N 3.18Å
560	G	91.8	Very high	92	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-67.7	-35.2	-178.8	0	0	0	0	0	114.1	D556 I558 A563 G564	D556-G560 WeakPolarHBondContact O-CA 3.27Å; D556-G560 PolarHBondContact O-N 3.14Å; I558-G560 VanDerWaalsContact C-N 3.34Å; G560-A563 PolarHBondContact O-N 3.46Å; G560-G564 PolarHBondContact O-N 3.18Å
561	E	92.3	Very high	92	Very high	9 Å²	9	17.9 Å²	17.9	4%	0.042	9%	0.088	C	C	.	.	H	α-helix	trans	-59.8	-48	171.3	-176.1	176.6	175.8	0	0	110.8	A563 I565 K594	E561-A563 VanDerWaalsContact C-N 3.33Å; E561-A563 PolarHBondContact O-N 3.28Å; E561-I565 HydrophobicContact CG-CD1 4.34Å; E561-I565 WeakPolarHBondContact O-CG1 3.45Å; E561-I565 PolarHBondContact O-N 3.21Å; E561-K594 HydrophobicContact CB-CB 4.25Å; E561-K594 WeakPolarHBondContact CB-O 3.12Å
562	A	93.9	Very high	92.1	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-67.3	-31.1	175.3	0	0	0	0	0	113.3	H526 C529 L530 T559 G566	H526-A562 HydrophobicContact CB-CB 4.4Å; H526-A562 WeakPolarHBondContact ND1-CB 3.48Å; C529-A562 HydrophobicContact CB-CB 3.84Å; L530-A562 HydrophobicContact CD2-CB 3.73Å; L530-A562 HydrophobicContact CG-CB 3.69Å; T559-A562 PolarHBondContact O-N 2.92Å; A562-G566 WeakPolarHBondContact O-CA 3.19Å; A562-G566 PolarHBondContact O-N 3.29Å
563	A	94.2	Very high	91.9	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-70.6	-43.9	177.2	0	0	0	0	0	111.8	I548 L552 T559 G560 E561 G566 I567	I548-A563 VanDerWaalsContact CG2-CA 3.49Å; I548-A563 HydrophobicContact CG2-CB 3.72Å; I548-A563 VanDerWaalsContact CG2-O 3.28Å; I548-A563 WeakPolarHBondContact CG2-O 3.48Å; L552-A563 HydrophobicContact CB-CB 3.94Å; L552-A563 HydrophobicContact CD1-CB 4.3Å; T559-A563 WeakPolarHBondContact O-CB 3.28Å; T559-A563 PolarHBondContact O-N 3.18Å; G560-A563 PolarHBondContact O-N 3.46Å; E561-A563 VanDerWaalsContact C-N 3.33Å; E561-A563 PolarHBondContact O-N 3.28Å; A563-G566 PolarHBondContact O-N 3.33Å; A563-I567 WeakPolarHBondContact O-CG1 3.2Å; A563-I567 PolarHBondContact O-N 3.05Å
564	G	93.6	Very high	91.7	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-60.6	-46.7	174.7	0	0	0	0	0	112.5	G560 G568 G598 G602	G560-G564 PolarHBondContact O-N 3.18Å; G564-G568 PolarHBondContact O-N 3.43Å; G564-G568 VanDerWaalsContact O-N 3.14Å; G564-G598 CarbonylContact C-O 3.55Å; G564-G598 VanDerWaalsContact C-O 3.23Å; G564-G602 WeakPolarHBondContact O-CA 3.32Å
565	I	94.6	Very high	91.4	Very high	1 Å²	1	11.5 Å²	11.5	1%	0.005	8%	0.075	C	C	.	.	H	α-helix	trans	-62.7	-45	174	-65	170.1	0	0	0	110.4	L530 E561 I567 G568 L569 G598 L601 I816 L826	L530-I565 HydrophobicContact CD2-CB 4.33Å; L530-I565 HydrophobicContact CD2-CG2 4.16Å; E561-I565 HydrophobicContact CG-CD1 4.34Å; E561-I565 WeakPolarHBondContact O-CG1 3.45Å; E561-I565 PolarHBondContact O-N 3.21Å; I565-I567 PolarHBondContact O-N 2.84Å; I565-G568 PolarHBondContact O-N 3.32Å; I565-L569 HydrophobicContact CG2-CD1 3.93Å; I565-L569 HydrophobicContact CG2-CG 4.29Å; I565-L569 VanDerWaalsContact O-CG 3.32Å; I565-L569 WeakPolarHBondContact O-CG 3.42Å; I565-L569 PolarHBondContact O-N 2.84Å; I565-G598 PolarHBondContact N-O 2.99Å; I565-L601 HydrophobicContact CD1-CD1 4.11Å; I565-L601 HydrophobicContact CG1-CB 4.29Å; I565-L601 HydrophobicContact CG1-CD1 4.19Å; I565-I816 HydrophobicContact CG2-CD1 4.02Å; I565-L826 HydrophobicContact CD1-CD1 4.33Å; I565-L826 HydrophobicContact CD1-CD2 4.06Å
566	G	93.2	Very high	91.3	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-59.4	-44.3	179.7	0	0	0	0	0	113.3	A562 A563 L569 V570	A562-G566 WeakPolarHBondContact O-CA 3.19Å; A562-G566 PolarHBondContact O-N 3.29Å; A563-G566 PolarHBondContact O-N 3.33Å; G566-L569 PolarHBondContact O-N 3.24Å; G566-V570 WeakPolarHBondContact O-CG2 3.38Å; G566-V570 PolarHBondContact O-N 3.34Å
567	I	94.1	Very high	91.2	Very high	1 Å²	1	13.6 Å²	13.6	1%	0.005	9%	0.092	C	C	.	.	H	α-helix	trans	-59.3	-47.5	173.3	-75.3	163.3	0	0	0	110.8	Y545 I548 K549 L552 A563 I565 L569 V570 M571 L583	Y545-I567 HydrophobicContact CD2-CG1 4.21Å; Y545-I567 HydrophobicContact CD2-CG2 3.81Å; Y545-I567 HydrophobicContact CE2-CG1 4.33Å; Y545-I567 HydrophobicContact CE2-CG2 3.59Å; I548-I567 HydrophobicContact CB-CG1 4.08Å; I548-I567 HydrophobicContact CG2-CD1 4.2Å; I548-I567 HydrophobicContact CG2-CG1 3.77Å; K549-I567 HydrophobicContact CB-CD1 4.5Å; L552-I567 HydrophobicContact CD2-CD1 4.02Å; A563-I567 WeakPolarHBondContact O-CG1 3.2Å; A563-I567 PolarHBondContact O-N 3.05Å; I565-I567 PolarHBondContact O-N 2.84Å; I567-L569 VanDerWaalsContact C-N 3.31Å; I567-L569 PolarHBondContact O-N 3.46Å; I567-V570 PolarHBondContact O-N 2.82Å; I567-M571 WeakPolarHBondContact O-CB 3.43Å; I567-M571 PolarHBondContact O-N 3.12Å; I567-L583 HydrophobicContact CD1-CD2 4.19Å; I567-L583 HydrophobicContact CG2-CD1 3.89Å; I567-L583 HydrophobicContact CG2-CD2 4.16Å; I567-L583 HydrophobicContact CG2-CG 4.26Å
568	G	92.3	Very high	91.2	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-60.5	-38	177.8	0	0	0	0	0	113.6	G564 I565 L572 G602 L605	G564-G568 PolarHBondContact O-N 3.43Å; G564-G568 VanDerWaalsContact O-N 3.14Å; I565-G568 PolarHBondContact O-N 3.32Å; G568-L572 VanDerWaalsContact O-CA 3.3Å; G568-L572 WeakPolarHBondContact O-CA 3.41Å; G568-L572 WeakPolarHBondContact O-CB 3.27Å; G568-L572 PolarHBondContact O-N 3.42Å; G568-G602 WeakPolarHBondContact CA-O 3.38Å; G568-L605 WeakPolarHBondContact O-CB 3.43Å
569	L	93.3	Very high	91.1	Very high	0 Å²	0	16 Å²	16	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-67.2	-43.8	175.5	-67.8	169.4	0	0	0	111.9	G533 L534 M537 G538 I565 G566 I567 L572 L605 V812 I816 F829	G533-L569 WeakPolarHBondContact O-CB 3.28Å; L534-L569 HydrophobicContact CG-CD1 4.42Å; M537-L569 CarbonylContact C-O 3.52Å; M537-L569 WeakPolarHBondContact CA-O 3.48Å; M537-L569 HydrophobicContact CG-CB 4.46Å; M537-L569 HydrophobicContact CG-CD2 4.26Å; M537-L569 HydrophobicContact SD-CD2 3.64Å; G538-L569 PolarHBondContact N-O 3.14Å; I565-L569 HydrophobicContact CG2-CD1 3.93Å; I565-L569 HydrophobicContact CG2-CG 4.29Å; I565-L569 VanDerWaalsContact O-CG 3.32Å; I565-L569 WeakPolarHBondContact O-CG 3.42Å; I565-L569 PolarHBondContact O-N 2.84Å; G566-L569 PolarHBondContact O-N 3.24Å; I567-L569 VanDerWaalsContact C-N 3.31Å; I567-L569 PolarHBondContact O-N 3.46Å; L569-L572 VanDerWaalsContact O-CB 3.24Å; L569-L572 WeakPolarHBondContact O-CB 3.28Å; L569-L605 HydrophobicContact CD2-CD1 4.32Å; L569-L605 HydrophobicContact CG-CD1 4.37Å; L569-V812 HydrophobicContact CD2-CG1 3.57Å; L569-I816 HydrophobicContact CD2-CD1 3.88Å; L569-I816 HydrophobicContact CG-CD1 4.5Å; L569-F829 HydrophobicContact CD1-CE1 4.01Å; L569-F829 HydrophobicContact CD1-CZ 4.47Å
570	V	92.8	Very high	91	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-65.4	-43.5	178.8	174.1	0	0	0	0	111.6	A536 T539 G540 V544 I548 G566 I567	A536-V570 HydrophobicContact CB-CG2 4Å; T539-V570 PolarHBondContact N-O 3.33Å; G540-V570 PolarHBondContact N-O 2.96Å; V544-V570 HydrophobicContact CB-CG1 4.45Å; V544-V570 HydrophobicContact CG1-CG2 3.75Å; I548-V570 HydrophobicContact CD1-CG2 4.17Å; G566-V570 WeakPolarHBondContact O-CG2 3.38Å; G566-V570 PolarHBondContact O-N 3.34Å; I567-V570 PolarHBondContact O-N 2.82Å
571	M	91	Very high	91	Very high	17 Å²	17	23.1 Å²	23.1	8%	0.084	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	13	-175.7	-61.5	-59.8	-74.3	0	0	113.6	Y545 I567 G573 T574 A579 V606	Y545-M571 HydrophobicContact CD2-CG 3.8Å; Y545-M571 HydrophobicContact CD2-SD 4.47Å; Y545-M571 HydrophobicContact CE2-CG 4.44Å; I567-M571 WeakPolarHBondContact O-CB 3.43Å; I567-M571 PolarHBondContact O-N 3.12Å; M571-G573 PolarHBondContact O-N 3.48Å; M571-T574 HydrophobicContact CE-CG2 4.37Å; M571-T574 WeakPolarHBondContact O-CB 3.41Å; M571-T574 VanDerWaalsContact O-CG2 3.29Å; M571-T574 WeakPolarHBondContact O-CG2 3.46Å; M571-T574 PolarHBondContact O-N 2.96Å; M571-T574 PolarHBondContact O-OG1 3.36Å; M571-A579 HydrophobicContact CE-CB 4.36Å; M571-A579 HydrophobicContact CG-CB 4.43Å; M571-V606 HydrophobicContact CB-CG2 3.86Å
572	L	92.2	Very high	91	Very high	8 Å²	8	24.6 Å²	24.6	4%	0.042	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48	122	179.8	172.5	60.7	0	0	0	112.9	M537 G568 L569 T574 L605 Y608 M808 V812	M537-L572 HydrophobicContact CG-CD2 3.56Å; M537-L572 HydrophobicContact SD-CD2 4Å; G568-L572 VanDerWaalsContact O-CA 3.3Å; G568-L572 WeakPolarHBondContact O-CA 3.41Å; G568-L572 WeakPolarHBondContact O-CB 3.27Å; G568-L572 PolarHBondContact O-N 3.42Å; L569-L572 VanDerWaalsContact O-CB 3.24Å; L569-L572 WeakPolarHBondContact O-CB 3.28Å; L572-T574 PolarHBondContact O-N 3.47Å; L572-T574 VanDerWaalsContact O-N 3.16Å; L572-L605 HydrophobicContact CD1-CB 4.34Å; L572-L605 HydrophobicContact CD1-CD2 4.21Å; L572-L605 WeakPolarHBondContact CD1-O 3.41Å; L572-Y608 HydrophobicContact CD1-CG 4.24Å; L572-M808 HydrophobicContact CD1-CG 4.36Å; L572-M808 HydrophobicContact CD2-CE 3.75Å; L572-M808 HydrophobicContact CD2-CG 3.85Å; L572-M808 HydrophobicContact CD2-SD 3.67Å; L572-M808 HydrophobicContact CG-CE 4.44Å; L572-M808 HydrophobicContact CG-CG 4.19Å; L572-M808 HydrophobicContact CG-SD 3.8Å; L572-V812 HydrophobicContact CD1-CG2 3.58Å; L572-V812 HydrophobicContact CD2-CG2 3.86Å; L572-V812 HydrophobicContact CG-CG2 4.4Å
573	G	86	Confident	90.8	Very high	16 Å²	16	24.7 Å²	24.7	17%	0.165	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.4	3.9	179.2	0	0	0	0	0	116.2	M571 G575 L605 V606 R610	M571-G573 PolarHBondContact O-N 3.48Å; G573-G575 VanDerWaalsContact C-N 3.34Å; G573-G575 PolarHBondContact O-N 3.06Å; G573-L605 PolarHBondContact N-O 3.45Å; G573-L605 VanDerWaalsContact N-O 3.08Å; G573-V606 CarbonylContact C-O 3.56Å; G573-V606 VanDerWaalsContact CA-O 3.31Å; G573-V606 WeakPolarHBondContact CA-O 3.35Å; G573-V606 PolarHBondContact N-O 3.42Å; G573-R610 PolarHBondContact O-NE 3Å; G573-R610 VanDerWaalsContact O-NE 3.15Å; G573-R610 PolarHBondContact O-NH2 2.93Å
574	T	85.8	Confident	90.6	Very high	36 Å²	36	26.2 Å²	26.2	22%	0.221	15%	0.145	C	C	.	.			trans	-71	-26.9	-177.8	61.2	0	0	0	0	113.6	M571 L572 S576 V606	M571-T574 HydrophobicContact CE-CG2 4.37Å; M571-T574 WeakPolarHBondContact O-CB 3.41Å; M571-T574 VanDerWaalsContact O-CG2 3.29Å; M571-T574 WeakPolarHBondContact O-CG2 3.46Å; M571-T574 PolarHBondContact O-N 2.96Å; M571-T574 PolarHBondContact O-OG1 3.36Å; L572-T574 PolarHBondContact O-N 3.47Å; L572-T574 VanDerWaalsContact O-N 3.16Å; T574-S576 PolarHBondContact O-N 2.75Å; T574-S576 PolarHBondContact OG1-N 2.96Å; T574-V606 PolarHBondContact N-O 3.28Å
575	G	84	Confident	90.5	Very high	23 Å²	23	27.9 Å²	27.9	24%	0.237	16%	0.163	C	C	.	.			trans	62.7	23.9	-172.6	0	0	0	0	0	114.1	G573 T577 V606	G573-G575 VanDerWaalsContact C-N 3.34Å; G573-G575 PolarHBondContact O-N 3.06Å; G575-T577 PolarHBondContact O-N 2.86Å; G575-V606 PolarHBondContact N-O 3.26Å; G575-V606 VanDerWaalsContact N-O 3.14Å
576	S	87.4	Confident	90.4	Very high	36 Å²	36	28.8 Å²	28.8	25%	0.252	17%	0.166	S	C	.	.			trans	-71	110.9	-174.8	-175.3	0	0	0	0	112	T574 R578 A579 I580	T574-S576 PolarHBondContact O-N 2.75Å; T574-S576 PolarHBondContact OG1-N 2.96Å; S576-R578 VanDerWaalsContact C-N 3.33Å; S576-R578 PolarHBondContact O-N 3.28Å; S576-A579 PolarHBondContact O-N 3.49Å; S576-A579 VanDerWaalsContact O-N 3.12Å; S576-I580 WeakPolarHBondContact O-CD1 3.39Å; S576-I580 WeakPolarHBondContact O-CG1 3.45Å; S576-I580 PolarHBondContact O-N 3.46Å
577	T	88.6	Confident	90.2	Very high	94 Å²	94	29 Å²	29	58%	0.577	17%	0.168	S	C	*	.	H	α-helix	trans	-57.3	-43.8	178.3	61	0	0	0	0	112.2	G575 A579 I580 E581	G575-T577 PolarHBondContact O-N 2.86Å; T577-A579 VanDerWaalsContact C-N 3.3Å; T577-A579 PolarHBondContact O-N 2.91Å; T577-I580 CarbonylContact O-C 3.59Å; T577-I580 PolarHBondContact O-N 2.96Å; T577-E581 WeakPolarHBondContact O-CB 3.28Å; T577-E581 WeakPolarHBondContact O-CG 3.4Å; T577-E581 PolarHBondContact O-N 3.15Å
578	R	90.4	Very high	90	Very high	95 Å²	95	34.5 Å²	34.5	36%	0.358	19%	0.192	S	C	.	.	H	α-helix	trans	-49	-49.9	173.4	174.5	-177.2	167.8	-161	-4.3	111.9	E542 D546 S576 I580 E581 D582	E542-R578 IonicContact OE1-NH1 2.77Å; E542-R578 PolarHBondContact OE1-NH1 3.04Å; D546-R578 IonicContact OD1-NH2 3.21Å; D546-R578 PolarHBondContact OD1-NH2 3.17Å; D546-R578 IonicContact OD2-NH2 2.69Å; S576-R578 VanDerWaalsContact C-N 3.33Å; S576-R578 PolarHBondContact O-N 3.28Å; R578-I580 VanDerWaalsContact C-N 3.31Å; R578-I580 PolarHBondContact O-N 3.06Å; R578-E581 PolarHBondContact O-N 2.98Å; R578-D582 IonicContact NE-OD2 3.74Å; R578-D582 VanDerWaalsContact O-CB 3.24Å; R578-D582 WeakPolarHBondContact O-CB 3.4Å; R578-D582 PolarHBondContact O-N 3.49Å
579	A	89.1	Confident	89.9	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.008	23%	0.226	C	C	.	.	H	α-helix	trans	-66.6	-34	-178.5	0	0	0	0	0	112.3	Y545 M571 S576 T577 L583	Y545-A579 HydrophobicContact CE2-CB 3.99Å; M571-A579 HydrophobicContact CE-CB 4.36Å; M571-A579 HydrophobicContact CG-CB 4.43Å; S576-A579 PolarHBondContact O-N 3.49Å; S576-A579 VanDerWaalsContact O-N 3.12Å; T577-A579 VanDerWaalsContact C-N 3.3Å; T577-A579 PolarHBondContact O-N 2.91Å; A579-L583 VanDerWaalsContact O-CB 3.28Å; A579-L583 WeakPolarHBondContact O-CB 3.18Å; A579-L583 WeakPolarHBondContact O-CD1 3.47Å; A579-L583 WeakPolarHBondContact O-CG 3.38Å; A579-L583 PolarHBondContact O-N 3.28Å; A579-L583 VanDerWaalsContact O-N 3.16Å
580	I	90.8	Very high	89.8	Confident	17 Å²	17	42.4 Å²	42.4	9%	0.087	23%	0.229	C	C	.	.	H	α-helix	trans	-74.1	-44.1	178.6	-62.2	158.4	0	0	0	110.8	S576 T577 R578 L583 L584 V606 M607 L617	S576-I580 WeakPolarHBondContact O-CD1 3.39Å; S576-I580 WeakPolarHBondContact O-CG1 3.45Å; S576-I580 PolarHBondContact O-N 3.46Å; T577-I580 CarbonylContact O-C 3.59Å; T577-I580 PolarHBondContact O-N 2.96Å; R578-I580 VanDerWaalsContact C-N 3.31Å; R578-I580 PolarHBondContact O-N 3.06Å; I580-L583 PolarHBondContact O-N 3.41Å; I580-L584 WeakPolarHBondContact O-CB 3.35Å; I580-L584 PolarHBondContact O-N 3.26Å; I580-V606 HydrophobicContact CD1-CG1 4.01Å; I580-V606 HydrophobicContact CG1-CB 4.44Å; I580-V606 HydrophobicContact CG1-CG1 3.92Å; I580-M607 HydrophobicContact CD1-CE 4.47Å; I580-M607 HydrophobicContact CD1-CG 4.26Å; I580-M607 HydrophobicContact CD1-SD 3.45Å; I580-M607 WeakPolarHBondContact CD1-SD 3.47Å; I580-L617 HydrophobicContact CD1-CD2 4.29Å; I580-L617 HydrophobicContact CG2-CD1 3.63Å; I580-L617 HydrophobicContact CG2-CD2 3.73Å; I580-L617 HydrophobicContact CG2-CG 4.33Å
581	E	91.8	Very high	89.6	Confident	131 Å²	131	46.6 Å²	46.6	61%	0.612	26%	0.264	S	S	*	.	H	α-helix	trans	-62.1	-47.5	175.9	-71.8	166.8	-145	0	0	111.3	T577 R578 L583 G585	T577-E581 WeakPolarHBondContact O-CB 3.28Å; T577-E581 WeakPolarHBondContact O-CG 3.4Å; T577-E581 PolarHBondContact O-N 3.15Å; R578-E581 PolarHBondContact O-N 2.98Å; E581-L583 VanDerWaalsContact C-N 3.33Å; E581-L583 PolarHBondContact O-N 3.22Å; E581-G585 PolarHBondContact O-N 2.89Å
582	D	91	Very high	89.6	Confident	41 Å²	41	49.7 Å²	49.7	22%	0.219	28%	0.278	C	S	.	.	H	α-helix	trans	-60.3	-40.1	176.8	-83.4	-47	0	0	0	112.3	Y545 K549 R578 Y586	Y545-D582 WeakPolarHBondContact OH-CB 3.43Å; Y545-D582 PolarHBondContact OH-OD2 3.01Å; K549-D582 IonicContact NZ-OD1 2.91Å; K549-D582 PolarHBondContact NZ-OD1 3.47Å; K549-D582 IonicContact NZ-OD2 3.58Å; K549-D582 PolarHBondContact NZ-OD2 2.94Å; R578-D582 IonicContact NE-OD2 3.74Å; R578-D582 VanDerWaalsContact O-CB 3.24Å; R578-D582 WeakPolarHBondContact O-CB 3.4Å; R578-D582 PolarHBondContact O-N 3.49Å; D582-Y586 PolarHBondContact O-N 2.98Å
583	L	91	Very high	89.5	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-74.2	-49	178.1	-78.3	176.3	0	0	0	112.5	L552 I567 A579 I580 E581 G585 Y586 A587 V599 I603	L552-L583 HydrophobicContact CD2-CD2 4.02Å; I567-L583 HydrophobicContact CD1-CD2 4.19Å; I567-L583 HydrophobicContact CG2-CD1 3.89Å; I567-L583 HydrophobicContact CG2-CD2 4.16Å; I567-L583 HydrophobicContact CG2-CG 4.26Å; A579-L583 VanDerWaalsContact O-CB 3.28Å; A579-L583 WeakPolarHBondContact O-CB 3.18Å; A579-L583 WeakPolarHBondContact O-CD1 3.47Å; A579-L583 WeakPolarHBondContact O-CG 3.38Å; A579-L583 PolarHBondContact O-N 3.28Å; A579-L583 VanDerWaalsContact O-N 3.16Å; I580-L583 PolarHBondContact O-N 3.41Å; E581-L583 VanDerWaalsContact C-N 3.33Å; E581-L583 PolarHBondContact O-N 3.22Å; L583-G585 VanDerWaalsContact C-N 3.32Å; L583-G585 PolarHBondContact O-N 2.93Å; L583-Y586 PolarHBondContact O-N 2.82Å; L583-A587 WeakPolarHBondContact O-CB 3.27Å; L583-A587 PolarHBondContact O-N 2.97Å; L583-V599 HydrophobicContact CB-CG1 3.83Å; L583-V599 HydrophobicContact CD2-CB 4.46Å; L583-V599 HydrophobicContact CD2-CG1 3.95Å; L583-V599 HydrophobicContact CD2-CG2 4.02Å; L583-V599 HydrophobicContact CG-CG1 4.37Å; L583-I603 HydrophobicContact CB-CD1 4.28Å; L583-I603 HydrophobicContact CB-CG1 3.98Å; L583-I603 HydrophobicContact CD1-CG1 3.99Å
584	L	90.6	Very high	89.8	Confident	32 Å²	32	57 Å²	57	17%	0.168	31%	0.307	C	S	.	.	H	α-helix	trans	-69.8	-29.2	-177	-177.1	60.6	0	0	0	112.2	I580 K588 I603 L617 L621 L629	I580-L584 WeakPolarHBondContact O-CB 3.35Å; I580-L584 PolarHBondContact O-N 3.26Å; L584-K588 WeakPolarHBondContact O-CG 3.44Å; L584-I603 HydrophobicContact CB-CD1 4.34Å; L584-L617 HydrophobicContact CD2-CD1 4.24Å; L584-L621 HydrophobicContact CD1-CD2 3.92Å; L584-L629 HydrophobicContact CD1-CD1 4.43Å; L584-L629 HydrophobicContact CD1-CD2 4.12Å
585	G	90.7	Very high	90.2	Very high	36 Å²	36	55.3 Å²	55.3	37%	0.371	30%	0.296	S	S	.	.	H	α-helix	trans	-61.8	-56.7	167.4	0	0	0	0	0	110.8	E581 L583 A587 K588 E589	E581-G585 PolarHBondContact O-N 2.89Å; L583-G585 VanDerWaalsContact C-N 3.32Å; L583-G585 PolarHBondContact O-N 2.93Å; G585-A587 VanDerWaalsContact C-N 3.32Å; G585-A587 PolarHBondContact O-N 3.45Å; G585-K588 PolarHBondContact O-N 2.86Å; G585-E589 PolarHBondContact O-N 3.19Å
586	Y	91.5	Very high	90.6	Very high	20 Å²	20	55 Å²	55	8%	0.078	29%	0.289	C	S	.	.	H	α-helix	trans	-63.2	-35.8	-176.4	-163.1	-112.5	0	0	0	113.5	L552 Y553 D555 D582 L583 K588 E589 T590 I595	L552-Y586 HydrophobicContact CD1-CD1 3.88Å; L552-Y586 HydrophobicContact CD1-CE1 3.79Å; L552-Y586 HydrophobicContact CD2-CD1 3.9Å; L552-Y586 HydrophobicContact CD2-CE1 4.45Å; L552-Y586 HydrophobicContact CG-CD1 3.63Å; L552-Y586 HydrophobicContact CG-CE1 3.67Å; L552-Y586 PolarHBondContact O-OH 3.3Å; L552-Y586 VanDerWaalsContact O-OH 3.14Å; Y553-Y586 AromaticContact CD1-CD2 3.71Å; Y553-Y586 HydrophobicContact CD1-CD2 3.71Å; Y553-Y586 AromaticContact CD1-CE2 3.67Å; Y553-Y586 HydrophobicContact CD1-CE2 3.67Å; Y553-Y586 HydrophobicContact CD1-CG 4.2Å; Y553-Y586 AromaticContact CE1-CD2 3.64Å; Y553-Y586 HydrophobicContact CE1-CD2 3.64Å; Y553-Y586 HydrophobicContact CE1-CE2 4.09Å; Y553-Y586 AromaticContact CE1-CG 4Å; Y553-Y586 HydrophobicContact CE1-CG 4Å; D555-Y586 WeakPolarHBondContact CA-OH 3.45Å; D555-Y586 VanDerWaalsContact CB-OH 3.31Å; D555-Y586 WeakPolarHBondContact CB-OH 3.42Å; D555-Y586 PolarHBondContact OD1-OH 3.13Å; D555-Y586 VanDerWaalsContact OD1-OH 3.06Å; D582-Y586 PolarHBondContact O-N 2.98Å; L583-Y586 PolarHBondContact O-N 2.82Å; Y586-K588 PolarHBondContact O-N 2.96Å; Y586-K588 VanDerWaalsContact O-N 3.14Å; Y586-E589 PolarHBondContact O-N 2.81Å; Y586-T590 PolarHBondContact O-N 3.05Å; Y586-I595 HydrophobicContact CD1-CG2 4.35Å; Y586-I595 HydrophobicContact CE1-CG2 4.05Å
587	A	90	Very high	90.8	Very high	4 Å²	4	54.9 Å²	54.9	3%	0.033	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-19.3	174.9	0	0	0	0	0	114.3	L583 G585 V599 L629	L583-A587 WeakPolarHBondContact O-CB 3.27Å; L583-A587 PolarHBondContact O-N 2.97Å; G585-A587 VanDerWaalsContact C-N 3.32Å; G585-A587 PolarHBondContact O-N 3.45Å; A587-V599 HydrophobicContact CB-CG1 3.87Å; A587-L629 HydrophobicContact CB-CD2 4.15Å
588	K	89.3	Confident	91	Very high	117 Å²	117	50.4 Å²	50.4	51%	0.509	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-3.5	175.9	-60.4	-174.5	-166.6	-154.7	0	113.3	L584 G585 Y586 D624 L629	L584-K588 WeakPolarHBondContact O-CG 3.44Å; G585-K588 PolarHBondContact O-N 2.86Å; Y586-K588 PolarHBondContact O-N 2.96Å; Y586-K588 VanDerWaalsContact O-N 3.14Å; K588-D624 WeakPolarHBondContact CE-OD2 3.37Å; K588-D624 IonicContact NZ-OD2 3.22Å; K588-D624 PolarHBondContact NZ-OD2 3.12Å; K588-L629 HydrophobicContact CG-CD1 4.14Å
589	E	90.8	Very high	91.1	Very high	155 Å²	155	45.9 Å²	45.9	72%	0.724	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.1	-39.7	177.5	-68	-177.9	159.1	0	0	112.3	G585 Y586	G585-E589 PolarHBondContact O-N 3.19Å; Y586-E589 PolarHBondContact O-N 2.81Å
590	T	90.6	Very high	91.3	Very high	10 Å²	10	45.9 Å²	45.9	6%	0.061	24%	0.238	C	C	.	.			trans	-74.9	146.1	177.9	-172.4	0	0	0	0	112.5	D555 Y586 H592 I595 I596	D555-T590 WeakPolarHBondContact OD1-CB 3.48Å; D555-T590 PolarHBondContact OD1-OG1 3.15Å; Y586-T590 PolarHBondContact O-N 3.05Å; T590-H592 PolarHBondContact OG1-N 3.42Å; T590-I595 HydrophobicContact CG2-CB 4.17Å; T590-I595 HydrophobicContact CG2-CG2 4.08Å; T590-I596 HydrophobicContact CG2-CG1 3.78Å
591	A	88.4	Confident	91.4	Very high	89 Å²	89	45.2 Å²	45.2	74%	0.736	24%	0.235	S	C	*	.			trans	-94.4	-7.3	171.8	0	0	0	0	0	113.1	E593	A591-E593 PolarHBondContact O-N 2.92Å
592	H	91.9	Very high	91.4	Very high	82 Å²	82	39 Å²	39	38%	0.38	21%	0.206	S	C	.	.			trans	-85.5	103.1	-172.1	-70.6	-63.8	0	0	0	111.9	D555 A557 T590 K594 I595 I596	D555-H592 PolarHBondContact O-CD2 3.46Å; D555-H592 IonicContact OD1-CD2 2.75Å; D555-H592 IonicContact OD2-CD2 3.18Å; A557-H592 HydrophobicContact CB-CB 4.41Å; T590-H592 PolarHBondContact OG1-N 3.42Å; H592-K594 PolarHBondContact O-N 3.06Å; H592-I595 HydrophobicContact CB-CB 4.27Å; H592-I595 HydrophobicContact CB-CD1 3.82Å; H592-I595 HydrophobicContact CB-CG1 3.77Å; H592-I595 WeakPolarHBondContact O-CA 3.35Å; H592-I595 WeakPolarHBondContact O-CB 3.34Å; H592-I595 PolarHBondContact O-N 3.31Å; H592-I596 PolarHBondContact O-N 2.85Å; H592-I596 VanDerWaalsContact O-N 3.12Å
593	E	90.4	Very high	91.6	Very high	111 Å²	111	37 Å²	37	52%	0.519	20%	0.195	S	C	.	.	H	α-helix	trans	-51.2	-33.6	-178.5	-56.7	-172	159	0	0	114.3	A591 I595 I596 R597 I628	A591-E593 PolarHBondContact O-N 2.92Å; E593-I595 VanDerWaalsContact C-N 3.33Å; E593-I596 PolarHBondContact O-N 3.25Å; E593-R597 WeakPolarHBondContact O-CB 3.31Å; E593-R597 VanDerWaalsContact O-CG 3.28Å; E593-R597 WeakPolarHBondContact O-CG 3.38Å; E593-R597 PolarHBondContact O-N 3.15Å; E593-R597 IonicContact OE2-CZ 2.72Å; E593-R597 IonicContact OE2-NH1 2.65Å; E593-R597 PolarHBondContact OE2-NH1 2.91Å; E593-R597 IonicContact OE2-NH2 2.72Å; E593-R597 PolarHBondContact OE2-NH2 2.97Å; E593-I628 HydrophobicContact CB-CD1 4Å; E593-I628 HydrophobicContact CG-CD1 4.26Å
594	K	91.6	Very high	91.7	Very high	67 Å²	67	37 Å²	37	29%	0.291	20%	0.195	S	C	.	.	H	α-helix	trans	-61.4	-41.7	176	-69.9	-174.1	-175.9	172.6	0	111.9	A557 I558 E561 H592 R597 G598	A557-K594 VanDerWaalsContact O-CB 3.24Å; A557-K594 WeakPolarHBondContact O-CB 3.23Å; I558-K594 HydrophobicContact CG1-CD 4.32Å; E561-K594 HydrophobicContact CB-CB 4.25Å; E561-K594 WeakPolarHBondContact CB-O 3.12Å; H592-K594 PolarHBondContact O-N 3.06Å; K594-R597 PolarHBondContact O-N 3.36Å; K594-G598 PolarHBondContact O-N 3.35Å
595	I	93.7	Very high	91.8	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-67.2	-47.4	176.3	-53.7	-172.9	0	0	0	109.3	L552 D555 Y586 T590 H592 E593 R597 G598 V599	L552-I595 HydrophobicContact CD1-CG2 3.54Å; D555-I595 WeakPolarHBondContact OD1-CD1 3.36Å; Y586-I595 HydrophobicContact CD1-CG2 4.35Å; Y586-I595 HydrophobicContact CE1-CG2 4.05Å; T590-I595 HydrophobicContact CG2-CB 4.17Å; T590-I595 HydrophobicContact CG2-CG2 4.08Å; H592-I595 HydrophobicContact CB-CB 4.27Å; H592-I595 HydrophobicContact CB-CD1 3.82Å; H592-I595 HydrophobicContact CB-CG1 3.77Å; H592-I595 WeakPolarHBondContact O-CA 3.35Å; H592-I595 WeakPolarHBondContact O-CB 3.34Å; H592-I595 PolarHBondContact O-N 3.31Å; E593-I595 VanDerWaalsContact C-N 3.33Å; I595-R597 VanDerWaalsContact C-N 3.29Å; I595-R597 PolarHBondContact O-N 3.07Å; I595-G598 PolarHBondContact O-N 2.94Å; I595-G598 VanDerWaalsContact O-N 3.16Å; I595-V599 HydrophobicContact CG2-CG2 4.24Å; I595-V599 WeakPolarHBondContact O-CB 3.5Å; I595-V599 VanDerWaalsContact O-CG2 3.27Å; I595-V599 WeakPolarHBondContact O-CG2 3.29Å; I595-V599 PolarHBondContact O-N 2.82Å
596	I	93.4	Very high	91.9	Very high	15 Å²	15	33.7 Å²	33.7	8%	0.077	17%	0.169	C	C	.	.	H	α-helix	trans	-58.2	-41.4	176.5	-50.5	176	0	0	0	110.7	T590 H592 E593 V599 A600 D626 I628	T590-I596 HydrophobicContact CG2-CG1 3.78Å; H592-I596 PolarHBondContact O-N 2.85Å; H592-I596 VanDerWaalsContact O-N 3.12Å; E593-I596 PolarHBondContact O-N 3.25Å; I596-V599 PolarHBondContact O-N 2.67Å; I596-A600 VanDerWaalsContact O-CB 3.29Å; I596-A600 WeakPolarHBondContact O-CB 3.39Å; I596-A600 PolarHBondContact O-N 3.29Å; I596-D626 WeakPolarHBondContact CG2-OD2 3.38Å; I596-I628 HydrophobicContact CB-CD1 4.34Å; I596-I628 HydrophobicContact CB-CG2 4.24Å; I596-I628 HydrophobicContact CG2-CB 3.9Å; I596-I628 HydrophobicContact CG2-CD1 4.38Å; I596-I628 HydrophobicContact CG2-CG2 3.67Å
597	R	92.1	Very high	91.9	Very high	35 Å²	35	33.1 Å²	33.1	13%	0.132	17%	0.167	C	C	.	.	H	α-helix	trans	-64.9	-44.1	175.4	-73.4	178.5	-173.9	103	7.1	112.9	E593 K594 I595 V599 A600 L601 I628 W631	E593-R597 WeakPolarHBondContact O-CB 3.31Å; E593-R597 VanDerWaalsContact O-CG 3.28Å; E593-R597 WeakPolarHBondContact O-CG 3.38Å; E593-R597 PolarHBondContact O-N 3.15Å; E593-R597 IonicContact OE2-CZ 2.72Å; E593-R597 IonicContact OE2-NH1 2.65Å; E593-R597 PolarHBondContact OE2-NH1 2.91Å; E593-R597 IonicContact OE2-NH2 2.72Å; E593-R597 PolarHBondContact OE2-NH2 2.97Å; K594-R597 PolarHBondContact O-N 3.36Å; I595-R597 VanDerWaalsContact C-N 3.29Å; I595-R597 PolarHBondContact O-N 3.07Å; R597-V599 VanDerWaalsContact C-N 3.33Å; R597-V599 PolarHBondContact O-N 3.26Å; R597-A600 PolarHBondContact O-N 2.94Å; R597-L601 WeakPolarHBondContact O-CG 3.39Å; R597-L601 PolarHBondContact O-N 3.1Å; R597-L601 VanDerWaalsContact O-N 3.15Å; R597-I628 HydrophobicContact CB-CG2 4.48Å; R597-I628 HydrophobicContact CG-CD1 4.32Å; R597-I628 HydrophobicContact CG-CG2 3.79Å; R597-W631 HydrophobicContact CB-CZ3 4.07Å; R597-W631 HydrophobicContact CG-CZ3 3.97Å
598	G	91.7	Very high	91.9	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-63.5	-38.5	175.6	0	0	0	0	0	112.7	G564 I565 K594 I595 G602	G564-G598 CarbonylContact C-O 3.55Å; G564-G598 VanDerWaalsContact C-O 3.23Å; I565-G598 PolarHBondContact N-O 2.99Å; K594-G598 PolarHBondContact O-N 3.35Å; I595-G598 PolarHBondContact O-N 2.94Å; I595-G598 VanDerWaalsContact O-N 3.16Å; G598-G602 PolarHBondContact O-N 3.37Å
599	V	93.4	Very high	91.7	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-70	-40.5	175.5	171.1	0	0	0	0	112	L552 L583 A587 I595 I596 R597 L601 G602 I603	L552-V599 HydrophobicContact CD1-CG2 4.21Å; L552-V599 HydrophobicContact CD2-CG2 4.43Å; L583-V599 HydrophobicContact CB-CG1 3.83Å; L583-V599 HydrophobicContact CD2-CB 4.46Å; L583-V599 HydrophobicContact CD2-CG1 3.95Å; L583-V599 HydrophobicContact CD2-CG2 4.02Å; L583-V599 HydrophobicContact CG-CG1 4.37Å; A587-V599 HydrophobicContact CB-CG1 3.87Å; I595-V599 HydrophobicContact CG2-CG2 4.24Å; I595-V599 WeakPolarHBondContact O-CB 3.5Å; I595-V599 VanDerWaalsContact O-CG2 3.27Å; I595-V599 WeakPolarHBondContact O-CG2 3.29Å; I595-V599 PolarHBondContact O-N 2.82Å; I596-V599 PolarHBondContact O-N 2.67Å; R597-V599 VanDerWaalsContact C-N 3.33Å; R597-V599 PolarHBondContact O-N 3.26Å; V599-L601 VanDerWaalsContact C-N 3.32Å; V599-L601 PolarHBondContact O-N 2.94Å; V599-G602 CarbonylContact O-C 3.4Å; V599-G602 VanDerWaalsContact O-CA 3.32Å; V599-G602 WeakPolarHBondContact O-CA 3.09Å; V599-G602 PolarHBondContact O-N 3.4Å; V599-I603 HydrophobicContact CG1-CD1 3.99Å; V599-I603 HydrophobicContact CG1-CG1 4.36Å; V599-I603 WeakPolarHBondContact O-CG1 3.38Å; V599-I603 PolarHBondContact O-N 2.94Å
600	A	92.7	Very high	91.4	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-58.2	-43.1	174.9	0	0	0	0	0	112.1	I596 R597 A604 I628 W631 S632	I596-A600 VanDerWaalsContact O-CB 3.29Å; I596-A600 WeakPolarHBondContact O-CB 3.39Å; I596-A600 PolarHBondContact O-N 3.29Å; R597-A600 PolarHBondContact O-N 2.94Å; A600-A604 PolarHBondContact O-N 2.91Å; A600-I628 HydrophobicContact CB-CG2 4.29Å; A600-W631 HydrophobicContact CB-CE3 3.95Å; A600-W631 HydrophobicContact CB-CZ3 3.75Å; A600-S632 WeakPolarHBondContact CA-OG 3.41Å; A600-S632 PolarHBondContact O-OG 3.34Å; A600-S632 VanDerWaalsContact O-OG 3.07Å
601	L	92.9	Very high	91.2	Very high	3 Å²	3	27.8 Å²	27.8	2%	0.016	15%	0.152	C	C	.	.	H	α-helix	trans	-65.6	-40.7	170.4	-65.6	173.9	0	0	0	111.7	I565 R597 V599 I603 A604 L605 W631 L815 N819	I565-L601 HydrophobicContact CD1-CD1 4.11Å; I565-L601 HydrophobicContact CG1-CB 4.29Å; I565-L601 HydrophobicContact CG1-CD1 4.19Å; R597-L601 WeakPolarHBondContact O-CG 3.39Å; R597-L601 PolarHBondContact O-N 3.1Å; R597-L601 VanDerWaalsContact O-N 3.15Å; V599-L601 VanDerWaalsContact C-N 3.32Å; V599-L601 PolarHBondContact O-N 2.94Å; L601-I603 PolarHBondContact O-N 3.26Å; L601-A604 PolarHBondContact O-N 3.29Å; L601-L605 WeakPolarHBondContact O-CD1 3.29Å; L601-L605 WeakPolarHBondContact O-CG 3.38Å; L601-L605 PolarHBondContact O-N 2.69Å; L601-W631 HydrophobicContact CD1-CH2 4.38Å; L601-W631 HydrophobicContact CD2-CH2 3.81Å; L601-W631 HydrophobicContact CD2-CZ2 3.74Å; L601-W631 HydrophobicContact CG-CH2 3.83Å; L601-W631 HydrophobicContact CG-CZ2 4.29Å; L601-L815 HydrophobicContact CD2-CD2 4.44Å; L601-L815 HydrophobicContact CD2-CG 4.42Å; L601-N819 HydrophobicContact CD1-CB 4.32Å; L601-N819 WeakPolarHBondContact CD2-ND2 3.42Å
602	G	92.8	Very high	90.9	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-53.3	-50.5	175.4	0	0	0	0	0	113.1	G564 G568 G598 V599 L605 V606	G564-G602 WeakPolarHBondContact O-CA 3.32Å; G568-G602 WeakPolarHBondContact CA-O 3.38Å; G598-G602 PolarHBondContact O-N 3.37Å; V599-G602 CarbonylContact O-C 3.4Å; V599-G602 VanDerWaalsContact O-CA 3.32Å; V599-G602 WeakPolarHBondContact O-CA 3.09Å; V599-G602 PolarHBondContact O-N 3.4Å; G602-L605 PolarHBondContact O-N 3.05Å; G602-V606 WeakPolarHBondContact O-CG2 3.45Å; G602-V606 PolarHBondContact O-N 3.33Å
603	I	93.6	Very high	90.6	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-62.1	-46.8	179.1	-66.7	168.9	0	0	0	111.1	L583 L584 V599 L601 L605 V606 M607 L617 L621	L583-I603 HydrophobicContact CB-CD1 4.28Å; L583-I603 HydrophobicContact CB-CG1 3.98Å; L583-I603 HydrophobicContact CD1-CG1 3.99Å; L584-I603 HydrophobicContact CB-CD1 4.34Å; V599-I603 HydrophobicContact CG1-CD1 3.99Å; V599-I603 HydrophobicContact CG1-CG1 4.36Å; V599-I603 WeakPolarHBondContact O-CG1 3.38Å; V599-I603 PolarHBondContact O-N 2.94Å; L601-I603 PolarHBondContact O-N 3.26Å; I603-L605 VanDerWaalsContact C-N 3.26Å; I603-L605 PolarHBondContact O-N 3.3Å; I603-V606 PolarHBondContact O-N 3.24Å; I603-M607 PolarHBondContact O-N 2.85Å; I603-L617 HydrophobicContact CG2-CD2 3.77Å; I603-L621 HydrophobicContact CG2-CD1 4.27Å
604	A	93.3	Very high	90.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-61.1	-32.6	178.4	0	0	0	0	0	113	A600 L601 A635 M639 L815	A600-A604 PolarHBondContact O-N 2.91Å; L601-A604 PolarHBondContact O-N 3.29Å; A604-A635 HydrophobicContact CB-CB 3.81Å; A604-M639 WeakPolarHBondContact O-CB 3.44Å; A604-L815 HydrophobicContact CB-CD2 4.44Å
605	L	93.4	Very high	90.5	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-71.8	-40.1	175.9	-67.8	166	0	0	0	112.5	G568 L569 L572 G573 L601 G602 I603 M607 Y608 M639 V812 L815 I816	G568-L605 WeakPolarHBondContact O-CB 3.43Å; L569-L605 HydrophobicContact CD2-CD1 4.32Å; L569-L605 HydrophobicContact CG-CD1 4.37Å; L572-L605 HydrophobicContact CD1-CB 4.34Å; L572-L605 HydrophobicContact CD1-CD2 4.21Å; L572-L605 WeakPolarHBondContact CD1-O 3.41Å; G573-L605 PolarHBondContact N-O 3.45Å; G573-L605 VanDerWaalsContact N-O 3.08Å; L601-L605 WeakPolarHBondContact O-CD1 3.29Å; L601-L605 WeakPolarHBondContact O-CG 3.38Å; L601-L605 PolarHBondContact O-N 2.69Å; G602-L605 PolarHBondContact O-N 3.05Å; I603-L605 VanDerWaalsContact C-N 3.26Å; I603-L605 PolarHBondContact O-N 3.3Å; L605-M607 PolarHBondContact O-N 3.24Å; L605-Y608 WeakPolarHBondContact O-CB 3.4Å; L605-Y608 PolarHBondContact O-N 3.42Å; L605-M639 HydrophobicContact CD2-CE 3.93Å; L605-V812 HydrophobicContact CD2-CB 4.16Å; L605-V812 HydrophobicContact CD2-CG1 3.77Å; L605-V812 HydrophobicContact CD2-CG2 3.64Å; L605-L815 HydrophobicContact CD2-CD2 4.03Å; L605-L815 HydrophobicContact CG-CD2 4.34Å; L605-I816 HydrophobicContact CD1-CD1 4.36Å
606	V	93.1	Very high	90.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60.1	-33.9	178.9	175.4	0	0	0	0	111.9	M571 G573 T574 G575 I580 G602 I603	M571-V606 HydrophobicContact CB-CG2 3.86Å; G573-V606 CarbonylContact C-O 3.56Å; G573-V606 VanDerWaalsContact CA-O 3.31Å; G573-V606 WeakPolarHBondContact CA-O 3.35Å; G573-V606 PolarHBondContact N-O 3.42Å; T574-V606 PolarHBondContact N-O 3.28Å; G575-V606 PolarHBondContact N-O 3.26Å; G575-V606 VanDerWaalsContact N-O 3.14Å; I580-V606 HydrophobicContact CD1-CG1 4.01Å; I580-V606 HydrophobicContact CG1-CB 4.44Å; I580-V606 HydrophobicContact CG1-CG1 3.92Å; G602-V606 WeakPolarHBondContact O-CG2 3.45Å; G602-V606 PolarHBondContact O-N 3.33Å; I603-V606 PolarHBondContact O-N 3.24Å
607	M	90.4	Very high	90.2	Very high	8 Å²	8	30.1 Å²	30.1	4%	0.039	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	12.7	-177.5	-60.3	-53.7	-84.9	0	0	115.2	I580 I603 L605 G609 R610 E613 A614 L617 T636 A640	I580-M607 HydrophobicContact CD1-CE 4.47Å; I580-M607 HydrophobicContact CD1-CG 4.26Å; I580-M607 HydrophobicContact CD1-SD 3.45Å; I580-M607 WeakPolarHBondContact CD1-SD 3.47Å; I603-M607 PolarHBondContact O-N 2.85Å; L605-M607 PolarHBondContact O-N 3.24Å; M607-G609 PolarHBondContact O-N 3.39Å; M607-R610 HydrophobicContact CB-CB 4.5Å; M607-R610 HydrophobicContact CE-CB 4.1Å; M607-R610 HydrophobicContact CE-CG 4.34Å; M607-R610 WeakPolarHBondContact O-CB 3.46Å; M607-R610 PolarHBondContact O-N 2.85Å; M607-R610 VanDerWaalsContact O-N 3.15Å; M607-R610 HydrophobicContact SD-CG 4.31Å; M607-E613 VanDerWaalsContact CE-O 3.23Å; M607-E613 WeakPolarHBondContact CE-O 3.46Å; M607-A614 HydrophobicContact CB-CB 4.42Å; M607-A614 HydrophobicContact CE-CB 3.81Å; M607-L617 HydrophobicContact CG-CD2 3.84Å; M607-T636 HydrophobicContact CB-CG2 4.01Å; M607-T636 HydrophobicContact CG-CG2 4.21Å; M607-A640 WeakPolarHBondContact O-CA 3.35Å
608	Y	90.6	Very high	90.2	Very high	27 Å²	27	28.5 Å²	28.5	11%	0.106	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	122.6	178	-177.3	-103.3	0	0	0	112.7	L572 L605 R610 M639 C642 A806 M808 A811	L572-Y608 HydrophobicContact CD1-CG 4.24Å; L605-Y608 WeakPolarHBondContact O-CB 3.4Å; L605-Y608 PolarHBondContact O-N 3.42Å; Y608-R610 VanDerWaalsContact C-N 3.3Å; Y608-R610 PolarHBondContact O-N 3.47Å; Y608-M639 HydrophobicContact CD2-CB 4.2Å; Y608-M639 HydrophobicContact CD2-CE 3.52Å; Y608-M639 HydrophobicContact CD2-SD 3.96Å; Y608-M639 HydrophobicContact CE2-CE 4.09Å; Y608-M639 HydrophobicContact CE2-SD 4.34Å; Y608-M639 HydrophobicContact CG-CE 4.37Å; Y608-C642 HydrophobicContact CD2-CB 4.48Å; Y608-C642 HydrophobicContact CE2-CB 3.89Å; Y608-A806 WeakPolarHBondContact OH-CB 3.41Å; Y608-M808 HydrophobicContact CD1-CB 4.48Å; Y608-M808 HydrophobicContact CD1-CG 3.86Å; Y608-M808 HydrophobicContact CD1-SD 4.36Å; Y608-M808 HydrophobicContact CE1-CB 3.76Å; Y608-M808 HydrophobicContact CE1-CG 3.63Å; Y608-M808 HydrophobicContact CE1-SD 4.45Å; Y608-A811 HydrophobicContact CE2-CB 3.76Å
609	G	84.5	Confident	90.3	Very high	45 Å²	45	31.8 Å²	31.8	46%	0.464	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.7	10.8	178.1	0	0	0	0	0	116.2	M607 M639	M607-G609 PolarHBondContact O-N 3.39Å; G609-M639 PolarHBondContact N-O 3.4Å
610	R	84.3	Confident	90.2	Very high	81 Å²	81	36.5 Å²	36.5	31%	0.306	19%	0.186	S	C	.	.			trans	-81.4	-14.4	-174	-71.5	-75	156.6	-170.4	-4	115.5	G573 M607 Y608 E612 E613	G573-R610 PolarHBondContact O-NE 3Å; G573-R610 VanDerWaalsContact O-NE 3.15Å; G573-R610 PolarHBondContact O-NH2 2.93Å; M607-R610 HydrophobicContact CB-CB 4.5Å; M607-R610 HydrophobicContact CE-CB 4.1Å; M607-R610 HydrophobicContact CE-CG 4.34Å; M607-R610 WeakPolarHBondContact O-CB 3.46Å; M607-R610 PolarHBondContact O-N 2.85Å; M607-R610 VanDerWaalsContact O-N 3.15Å; M607-R610 HydrophobicContact SD-CG 4.31Å; Y608-R610 VanDerWaalsContact C-N 3.3Å; Y608-R610 PolarHBondContact O-N 3.47Å; R610-E612 PolarHBondContact O-N 3.01Å; R610-E613 HydrophobicContact CB-CB 4.22Å; R610-E613 WeakPolarHBondContact CD-OE2 3.41Å; R610-E613 IonicContact CZ-OE2 3.94Å; R610-E613 IonicContact NE-OE2 2.69Å; R610-E613 IonicContact NH1-OE2 2.83Å; R610-E613 PolarHBondContact NH1-OE2 3.36Å; R610-E613 WeakPolarHBondContact O-CB 3.31Å; R610-E613 PolarHBondContact O-N 3.36Å; R610-E613 VanDerWaalsContact O-N 3.11Å
611	V	86.1	Confident	90.2	Very high	20 Å²	20	36.6 Å²	36.6	12%	0.121	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	48.3	-119.8	176.1	-160.6	0	0	0	0	111.5	V207 E613 A614 A640 Y641 T644	V207-V611 HydrophobicContact CG2-CG2 4.47Å; V611-E613 PolarHBondContact O-N 3.06Å; V611-E613 VanDerWaalsContact O-N 3.17Å; V611-A614 WeakPolarHBondContact O-CB 3.28Å; V611-A614 PolarHBondContact O-N 3.12Å; V611-A640 PolarHBondContact N-O 2.83Å; V611-A640 VanDerWaalsContact N-O 3.13Å; V611-Y641 HydrophobicContact CB-CE1 4.43Å; V611-Y641 HydrophobicContact CG1-CD1 3.85Å; V611-Y641 HydrophobicContact CG1-CE1 3.39Å; V611-T644 HydrophobicContact CG2-CG2 4.22Å
612	E	83.9	Confident	90.1	Very high	95 Å²	95	38.9 Å²	38.9	44%	0.444	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-57.5	-28.8	-177.1	-62.7	165.8	-165.2	0	0	113.4	R610 A614 D615	R610-E612 PolarHBondContact O-N 3.01Å; E612-A614 PolarHBondContact O-N 3.2Å; E612-A614 VanDerWaalsContact O-N 3.16Å; E612-D615 PolarHBondContact O-N 3.42Å
613	E	85.4	Confident	90	Very high	114 Å²	114	45.3 Å²	45.3	53%	0.533	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-67.5	-11.5	177.3	-60.5	177.8	168.5	0	0	112.6	M607 R610 V611	M607-E613 VanDerWaalsContact CE-O 3.23Å; M607-E613 WeakPolarHBondContact CE-O 3.46Å; R610-E613 HydrophobicContact CB-CB 4.22Å; R610-E613 WeakPolarHBondContact CD-OE2 3.41Å; R610-E613 IonicContact CZ-OE2 3.94Å; R610-E613 IonicContact NE-OE2 2.69Å; R610-E613 IonicContact NH1-OE2 2.83Å; R610-E613 PolarHBondContact NH1-OE2 3.36Å; R610-E613 WeakPolarHBondContact O-CB 3.31Å; R610-E613 PolarHBondContact O-N 3.36Å; R610-E613 VanDerWaalsContact O-N 3.11Å; V611-E613 PolarHBondContact O-N 3.06Å; V611-E613 VanDerWaalsContact O-N 3.17Å
614	A	89.1	Confident	89.9	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-94.7	-15.9	177.2	0	0	0	0	0	114.5	M607 V611 E612 E616 L617 I618 T636 A640	M607-A614 HydrophobicContact CB-CB 4.42Å; M607-A614 HydrophobicContact CE-CB 3.81Å; V611-A614 WeakPolarHBondContact O-CB 3.28Å; V611-A614 PolarHBondContact O-N 3.12Å; E612-A614 PolarHBondContact O-N 3.2Å; E612-A614 VanDerWaalsContact O-N 3.16Å; A614-E616 PolarHBondContact O-N 3.11Å; A614-L617 WeakPolarHBondContact O-CB 3.2Å; A614-L617 PolarHBondContact O-N 3.41Å; A614-L617 VanDerWaalsContact O-N 3.09Å; A614-I618 HydrophobicContact CB-CD1 3.72Å; A614-I618 HydrophobicContact CB-CG1 4.4Å; A614-I618 WeakPolarHBondContact O-CD1 3.32Å; A614-I618 VanDerWaalsContact O-CG1 3.29Å; A614-I618 WeakPolarHBondContact O-CG1 3.29Å; A614-I618 PolarHBondContact O-N 3.29Å; A614-T636 HydrophobicContact CB-CG2 4.43Å; A614-A640 HydrophobicContact CB-CB 3.51Å
615	D	90.1	Very high	89.7	Confident	27 Å²	27	53.9 Å²	53.9	14%	0.144	28%	0.278	C	S	.	.	H	α-helix	trans	-64.4	-38.5	-167.6	-88.5	-1.6	0	0	0	113.2	E612 L617 I618 D619 Y641 R652	E612-D615 PolarHBondContact O-N 3.42Å; D615-L617 VanDerWaalsContact C-N 3.33Å; D615-L617 PolarHBondContact O-N 3.16Å; D615-I618 PolarHBondContact O-N 3.48Å; D615-D619 PolarHBondContact O-N 3.27Å; D615-Y641 PolarHBondContact OD1-OH 3.16Å; D615-Y641 PolarHBondContact OD2-OH 2.96Å; D615-R652 IonicContact OD1-CZ 3.5Å; D615-R652 IonicContact OD1-NH2 3.84Å; D615-R652 IonicContact OD2-CZ 2.67Å; D615-R652 IonicContact OD2-NH2 2.81Å; D615-R652 PolarHBondContact OD2-NH2 3.01Å
616	E	90.6	Very high	89.6	Confident	158 Å²	158	55.8 Å²	55.8	74%	0.738	29%	0.288	S	S	*	.	H	α-helix	trans	-61.2	-40.1	174.3	-178.9	174.3	-171.8	0	0	112	A614 N620	A614-E616 PolarHBondContact O-N 3.11Å; E616-N620 WeakPolarHBondContact O-CB 3.43Å; E616-N620 PolarHBondContact O-N 3.2Å; E616-N620 PolarHBondContact O-ND2 2.79Å
617	L	91.4	Very high	89.5	Confident	20 Å²	20	57.7 Å²	57.7	11%	0.105	30%	0.3	C	S	.	.	H	α-helix	trans	-70.9	-40	176.6	-179.6	63.2	0	0	0	111.5	I580 L584 I603 M607 A614 D615 N620 L621 T636	I580-L617 HydrophobicContact CD1-CD2 4.29Å; I580-L617 HydrophobicContact CG2-CD1 3.63Å; I580-L617 HydrophobicContact CG2-CD2 3.73Å; I580-L617 HydrophobicContact CG2-CG 4.33Å; L584-L617 HydrophobicContact CD2-CD1 4.24Å; I603-L617 HydrophobicContact CG2-CD2 3.77Å; M607-L617 HydrophobicContact CG-CD2 3.84Å; A614-L617 WeakPolarHBondContact O-CB 3.2Å; A614-L617 PolarHBondContact O-N 3.41Å; A614-L617 VanDerWaalsContact O-N 3.09Å; D615-L617 VanDerWaalsContact C-N 3.33Å; D615-L617 PolarHBondContact O-N 3.16Å; L617-N620 PolarHBondContact O-N 2.82Å; L617-L621 HydrophobicContact CD1-CD1 4.26Å; L617-L621 HydrophobicContact CD1-CG 4.31Å; L617-L621 HydrophobicContact CG-CD1 3.97Å; L617-L621 HydrophobicContact CG-CG 4.45Å; L617-L621 WeakPolarHBondContact O-CB 3.41Å; L617-L621 VanDerWaalsContact O-CG 3.29Å; L617-L621 WeakPolarHBondContact O-CG 3.27Å; L617-L621 PolarHBondContact O-N 3.27Å; L617-T636 HydrophobicContact CD2-CG2 4.47Å
618	I	92.1	Very high	89.6	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61.1	-46.2	178	-72.4	160.3	0	0	0	110.5	A614 D615 L621 I622 T636 I637 Y641	A614-I618 HydrophobicContact CB-CD1 3.72Å; A614-I618 HydrophobicContact CB-CG1 4.4Å; A614-I618 WeakPolarHBondContact O-CD1 3.32Å; A614-I618 VanDerWaalsContact O-CG1 3.29Å; A614-I618 WeakPolarHBondContact O-CG1 3.29Å; A614-I618 PolarHBondContact O-N 3.29Å; D615-I618 PolarHBondContact O-N 3.48Å; I618-L621 PolarHBondContact O-N 3.39Å; I618-I622 HydrophobicContact CG2-CD1 3.6Å; I618-I622 HydrophobicContact CG2-CG1 4.4Å; I618-I622 WeakPolarHBondContact O-CB 3.4Å; I618-I622 VanDerWaalsContact O-CG1 3.27Å; I618-I622 WeakPolarHBondContact O-CG1 3.33Å; I618-I622 PolarHBondContact O-N 3.46Å; I618-T636 HydrophobicContact CD1-CG2 4.3Å; I618-T636 HydrophobicContact CG1-CG2 3.83Å; I618-I637 HydrophobicContact CD1-CG1 3.7Å; I618-I637 HydrophobicContact CG1-CG1 4Å; I618-I637 HydrophobicContact CG2-CD1 3.82Å; I618-I637 HydrophobicContact CG2-CG1 3.68Å; I618-Y641 HydrophobicContact CD1-CE2 4.33Å
619	D	92.5	Very high	89.7	Confident	70 Å²	70	57 Å²	57	37%	0.374	30%	0.298	S	S	.	.	H	α-helix	trans	-67.7	-37.8	179.1	-73.1	-38.4	0	0	0	112.2	D615 L621 I623 R652	D615-D619 PolarHBondContact O-N 3.27Å; D619-L621 PolarHBondContact O-N 3.44Å; D619-I623 WeakPolarHBondContact O-CD1 3.36Å; D619-I623 VanDerWaalsContact O-CG1 3.28Å; D619-I623 WeakPolarHBondContact O-CG1 3.27Å; D619-I623 PolarHBondContact O-N 3.26Å; D619-R652 IonicContact OD1-CZ 3.19Å; D619-R652 IonicContact OD1-NH1 2.63Å; D619-R652 PolarHBondContact OD1-NH1 3.19Å; D619-R652 IonicContact OD2-CZ 2.72Å; D619-R652 IonicContact OD2-NH1 3.82Å; D619-R652 PolarHBondContact OD2-NH1 3.3Å; D619-R652 IonicContact OD2-NH2 3.34Å
620	N	91.9	Very high	90.2	Very high	98 Å²	98	56.4 Å²	56.4	52%	0.524	28%	0.282	S	S	.	.	H	α-helix	trans	-63.8	-36.1	171.6	-80.8	-62.9	0	0	0	113.2	E616 L617	E616-N620 WeakPolarHBondContact O-CB 3.43Å; E616-N620 PolarHBondContact O-N 3.2Å; E616-N620 PolarHBondContact O-ND2 2.79Å; L617-N620 PolarHBondContact O-N 2.82Å
621	L	92.1	Very high	90.6	Very high	2 Å²	2	52.9 Å²	52.9	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-75.2	-37.9	178.2	-74.7	171.2	0	0	0	112.8	L584 I603 L617 I618 D619 I623 D624 L629 R630	L584-L621 HydrophobicContact CD1-CD2 3.92Å; I603-L621 HydrophobicContact CG2-CD1 4.27Å; L617-L621 HydrophobicContact CD1-CD1 4.26Å; L617-L621 HydrophobicContact CD1-CG 4.31Å; L617-L621 HydrophobicContact CG-CD1 3.97Å; L617-L621 HydrophobicContact CG-CG 4.45Å; L617-L621 WeakPolarHBondContact O-CB 3.41Å; L617-L621 VanDerWaalsContact O-CG 3.29Å; L617-L621 WeakPolarHBondContact O-CG 3.27Å; L617-L621 PolarHBondContact O-N 3.27Å; I618-L621 PolarHBondContact O-N 3.39Å; D619-L621 PolarHBondContact O-N 3.44Å; L621-I623 VanDerWaalsContact C-N 3.31Å; L621-I623 PolarHBondContact O-N 3.03Å; L621-D624 PolarHBondContact O-N 3.32Å; L621-L629 HydrophobicContact CD2-CB 4.28Å; L621-L629 HydrophobicContact CD2-CD2 4.14Å; L621-R630 WeakPolarHBondContact O-CA 3.46Å; L621-R630 WeakPolarHBondContact O-CG 3.43Å
622	I	91.1	Very high	90.9	Very high	52 Å²	52	51.9 Å²	51.9	27%	0.267	26%	0.263	S	S	.	.	H	α-helix	trans	-69.9	-28.4	-179.1	-72.2	172.5	0	0	0	112.3	I618 D624 R630 M634 I637	I618-I622 HydrophobicContact CG2-CD1 3.6Å; I618-I622 HydrophobicContact CG2-CG1 4.4Å; I618-I622 WeakPolarHBondContact O-CB 3.4Å; I618-I622 VanDerWaalsContact O-CG1 3.27Å; I618-I622 WeakPolarHBondContact O-CG1 3.33Å; I618-I622 PolarHBondContact O-N 3.46Å; I622-D624 VanDerWaalsContact C-N 3.32Å; I622-R630 WeakPolarHBondContact O-CD 3.48Å; I622-R630 WeakPolarHBondContact O-CG 3.36Å; I622-M634 HydrophobicContact CD1-CE 3.65Å; I622-M634 HydrophobicContact CG1-CE 3.62Å; I622-I637 HydrophobicContact CD1-CD1 4.29Å
623	I	91.6	Very high	91.3	Very high	135 Å²	135	47.4 Å²	47.4	69%	0.692	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-11.8	-179.8	-67.8	169.5	0	0	0	112.3	D619 L621	D619-I623 WeakPolarHBondContact O-CD1 3.36Å; D619-I623 VanDerWaalsContact O-CG1 3.28Å; D619-I623 WeakPolarHBondContact O-CG1 3.27Å; D619-I623 PolarHBondContact O-N 3.26Å; L621-I623 VanDerWaalsContact C-N 3.31Å; L621-I623 PolarHBondContact O-N 3.03Å
624	D	90.7	Very high	91.7	Very high	32 Å²	32	42 Å²	42	17%	0.171	22%	0.217	C	C	.	.			trans	-72	151.3	-174.9	-146.4	-63.4	0	0	0	113.9	K588 L621 I622 D626 L629 R630	K588-D624 WeakPolarHBondContact CE-OD2 3.37Å; K588-D624 IonicContact NZ-OD2 3.22Å; K588-D624 PolarHBondContact NZ-OD2 3.12Å; L621-D624 PolarHBondContact O-N 3.32Å; I622-D624 VanDerWaalsContact C-N 3.32Å; D624-D626 PolarHBondContact OD1-N 2.77Å; D624-L629 HydrophobicContact CB-CB 4.14Å; D624-L629 HydrophobicContact CB-CD1 4.27Å; D624-R630 VanDerWaalsContact O-CD 3.24Å; D624-R630 WeakPolarHBondContact O-CD 3.49Å; D624-R630 VanDerWaalsContact O-CG 3.23Å; D624-R630 WeakPolarHBondContact O-CG 3.39Å; D624-R630 PolarHBondContact O-NH1 3.38Å
625	N	89.5	Confident	92	Very high	148 Å²	148	42 Å²	42	79%	0.791	22%	0.217	S	C	*	.	S	Bend	trans	-72.5	-33	-179	-61.7	-75.2	0	0	0	111.7	P627 R630	N625-P627 WeakPolarHBondContact O-CD 3.5Å; N625-R630 VanDerWaalsContact C-NH1 3.32Å; N625-R630 PolarHBondContact O-NH1 3.31Å
626	D	90.9	Very high	92.2	Very high	40 Å²	40	40.8 Å²	40.8	21%	0.214	21%	0.21	C	C	.	.			trans	-70.3	120.2	178.2	175.9	18	0	0	0	111.5	I596 D624 I628 L629 R630	I596-D626 WeakPolarHBondContact CG2-OD2 3.38Å; D624-D626 PolarHBondContact OD1-N 2.77Å; D626-I628 PolarHBondContact O-N 3.08Å; D626-I628 WeakPolarHBondContact OD1-CB 3.22Å; D626-I628 WeakPolarHBondContact OD1-CG1 3.25Å; D626-I628 PolarHBondContact OD1-N 3.06Å; D626-I628 WeakPolarHBondContact OD2-CB 3.4Å; D626-L629 HydrophobicContact CB-CB 4.24Å; D626-L629 HydrophobicContact CB-CD1 4.24Å; D626-L629 HydrophobicContact CB-CG 4.18Å; D626-L629 PolarHBondContact O-N 3.05Å; D626-L629 PolarHBondContact OD2-N 2.92Å; D626-R630 PolarHBondContact O-N 3.14Å
627	P	91.8	Very high	92.4	Very high	40 Å²	40	33.2 Å²	33.2	26%	0.26	18%	0.175	S	C	.	.	H	α-helix	trans	-59.2	-27.8	173.7	-21.4	33.3	0	0	0	114.3	N625 R630 W631 N662 V665	N625-P627 WeakPolarHBondContact O-CD 3.5Å; P627-R630 PolarHBondContact O-N 2.92Å; P627-W631 VanDerWaalsContact O-CB 3.3Å; P627-W631 WeakPolarHBondContact O-CB 3.3Å; P627-W631 PolarHBondContact O-N 2.69Å; P627-N662 HydrophobicContact CB-CB 3.88Å; P627-N662 WeakPolarHBondContact CB-ND2 3.31Å; P627-N662 HydrophobicContact CG-CB 4.31Å; P627-V665 HydrophobicContact CB-CG2 4.34Å; P627-V665 WeakPolarHBondContact O-CG2 3.31Å
628	I	92.3	Very high	92.4	Very high	18 Å²	18	32.3 Å²	32.3	9%	0.092	17%	0.17	C	C	.	.	H	α-helix	trans	-70.5	-37.9	178.8	-50.8	175.8	0	0	0	110	E593 I596 R597 A600 D626 W631 S632	E593-I628 HydrophobicContact CB-CD1 4Å; E593-I628 HydrophobicContact CG-CD1 4.26Å; I596-I628 HydrophobicContact CB-CD1 4.34Å; I596-I628 HydrophobicContact CB-CG2 4.24Å; I596-I628 HydrophobicContact CG2-CB 3.9Å; I596-I628 HydrophobicContact CG2-CD1 4.38Å; I596-I628 HydrophobicContact CG2-CG2 3.67Å; R597-I628 HydrophobicContact CB-CG2 4.48Å; R597-I628 HydrophobicContact CG-CD1 4.32Å; R597-I628 HydrophobicContact CG-CG2 3.79Å; A600-I628 HydrophobicContact CB-CG2 4.29Å; D626-I628 PolarHBondContact O-N 3.08Å; D626-I628 WeakPolarHBondContact OD1-CB 3.22Å; D626-I628 WeakPolarHBondContact OD1-CG1 3.25Å; D626-I628 PolarHBondContact OD1-N 3.06Å; D626-I628 WeakPolarHBondContact OD2-CB 3.4Å; I628-W631 HydrophobicContact CG2-CE3 3.74Å; I628-W631 HydrophobicContact CG2-CZ3 4.01Å; I628-W631 WeakPolarHBondContact O-CB 3.38Å; I628-W631 PolarHBondContact O-N 3.14Å; I628-S632 PolarHBondContact O-N 3.48Å
629	L	92.4	Very high	92.5	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.01	17%	0.17	C	C	.	.	H	α-helix	trans	-69.7	-40.3	171.1	-68.1	-179.7	0	0	0	113	L584 A587 K588 L621 D624 D626 W631 S632 G633	L584-L629 HydrophobicContact CD1-CD1 4.43Å; L584-L629 HydrophobicContact CD1-CD2 4.12Å; A587-L629 HydrophobicContact CB-CD2 4.15Å; K588-L629 HydrophobicContact CG-CD1 4.14Å; L621-L629 HydrophobicContact CD2-CB 4.28Å; L621-L629 HydrophobicContact CD2-CD2 4.14Å; D624-L629 HydrophobicContact CB-CB 4.14Å; D624-L629 HydrophobicContact CB-CD1 4.27Å; D626-L629 HydrophobicContact CB-CB 4.24Å; D626-L629 HydrophobicContact CB-CD1 4.24Å; D626-L629 HydrophobicContact CB-CG 4.18Å; D626-L629 PolarHBondContact O-N 3.05Å; D626-L629 PolarHBondContact OD2-N 2.92Å; L629-W631 VanDerWaalsContact C-N 3.3Å; L629-W631 PolarHBondContact O-N 2.76Å; L629-S632 WeakPolarHBondContact O-CA 3.26Å; L629-S632 WeakPolarHBondContact O-CB 3.47Å; L629-S632 PolarHBondContact O-N 2.75Å; L629-G633 PolarHBondContact O-N 2.91Å
630	R	93.7	Very high	92.4	Very high	32 Å²	32	29 Å²	29	12%	0.121	15%	0.152	C	C	.	.	H	α-helix	trans	-63.8	-36.7	173.3	-65.5	-159.6	-55.2	-74.2	-1.1	112.3	L621 I622 D624 N625 D626 P627 G633 M634 D660 V665	L621-R630 WeakPolarHBondContact O-CA 3.46Å; L621-R630 WeakPolarHBondContact O-CG 3.43Å; I622-R630 WeakPolarHBondContact O-CD 3.48Å; I622-R630 WeakPolarHBondContact O-CG 3.36Å; D624-R630 VanDerWaalsContact O-CD 3.24Å; D624-R630 WeakPolarHBondContact O-CD 3.49Å; D624-R630 VanDerWaalsContact O-CG 3.23Å; D624-R630 WeakPolarHBondContact O-CG 3.39Å; D624-R630 PolarHBondContact O-NH1 3.38Å; N625-R630 VanDerWaalsContact C-NH1 3.32Å; N625-R630 PolarHBondContact O-NH1 3.31Å; D626-R630 PolarHBondContact O-N 3.14Å; P627-R630 PolarHBondContact O-N 2.92Å; R630-G633 PolarHBondContact O-N 2.76Å; R630-M634 PolarHBondContact O-N 3.25Å; R630-D660 IonicContact CZ-OD1 2.77Å; R630-D660 IonicContact CZ-OD2 3.89Å; R630-D660 IonicContact NE-OD1 3.37Å; R630-D660 IonicContact NE-OD2 2.74Å; R630-D660 PolarHBondContact NE-OD2 2.82Å; R630-D660 IonicContact NH2-OD1 3.68Å; R630-D660 PolarHBondContact NH2-OD1 2.83Å; R630-D660 IonicContact NH2-OD2 3.17Å; R630-D660 PolarHBondContact NH2-OD2 3.08Å; R630-V665 HydrophobicContact CB-CG2 4.09Å
631	W	92.7	Very high	92.4	Very high	7 Å²	7	24.5 Å²	24.5	3%	0.027	13%	0.128	C	C	.	.	H	α-helix	trans	-61.2	-44.4	168.6	162.5	50.7	0	0	0	111.9	R597 A600 L601 P627 I628 L629 G633 M634 A635 V665 W668 N819	R597-W631 HydrophobicContact CB-CZ3 4.07Å; R597-W631 HydrophobicContact CG-CZ3 3.97Å; A600-W631 HydrophobicContact CB-CE3 3.95Å; A600-W631 HydrophobicContact CB-CZ3 3.75Å; L601-W631 HydrophobicContact CD1-CH2 4.38Å; L601-W631 HydrophobicContact CD2-CH2 3.81Å; L601-W631 HydrophobicContact CD2-CZ2 3.74Å; L601-W631 HydrophobicContact CG-CH2 3.83Å; L601-W631 HydrophobicContact CG-CZ2 4.29Å; P627-W631 VanDerWaalsContact O-CB 3.3Å; P627-W631 WeakPolarHBondContact O-CB 3.3Å; P627-W631 PolarHBondContact O-N 2.69Å; I628-W631 HydrophobicContact CG2-CE3 3.74Å; I628-W631 HydrophobicContact CG2-CZ3 4.01Å; I628-W631 WeakPolarHBondContact O-CB 3.38Å; I628-W631 PolarHBondContact O-N 3.14Å; L629-W631 VanDerWaalsContact C-N 3.3Å; L629-W631 PolarHBondContact O-N 2.76Å; W631-G633 PolarHBondContact O-N 2.9Å; W631-M634 WeakPolarHBondContact O-CA 3.39Å; W631-M634 WeakPolarHBondContact O-CB 3.42Å; W631-M634 PolarHBondContact O-N 3.25Å; W631-A635 PolarHBondContact O-N 3.4Å; W631-V665 HydrophobicContact CB-CG2 4.26Å; W631-W668 AromaticContact CD1-CD1 3.39Å; W631-W668 AromaticContact CD1-CD2 3.82Å; W631-W668 AromaticContact CD1-CG 3.24Å; W631-W668 AromaticContact CD1-NE1 4Å; W631-W668 AromaticContact CE2-CD1 3.89Å; W631-W668 AromaticContact CE2-CE2 3.78Å; W631-W668 AromaticContact CE2-NE1 3.67Å; W631-W668 HydrophobicContact CG-CG 4.39Å; W631-W668 AromaticContact CZ2-CE2 3.85Å; W631-W668 AromaticContact CZ2-CZ2 3.87Å; W631-W668 HydrophobicContact CZ2-CZ2 3.87Å; W631-W668 AromaticContact CZ2-NE1 3.93Å; W631-W668 AromaticContact NE1-CD1 3.16Å; W631-W668 AromaticContact NE1-CD2 3.1Å; W631-W668 AromaticContact NE1-CE2 3.26Å; W631-W668 VanDerWaalsContact NE1-CE2 3.26Å; W631-W668 AromaticContact NE1-CE3 3.75Å; W631-W668 AromaticContact NE1-CG 3.02Å; W631-W668 AromaticContact NE1-NE1 3.29Å; W631-N819 WeakPolarHBondContact CH2-OD1 3.39Å; W631-N819 VanDerWaalsContact CZ2-OD1 3.26Å; W631-N819 WeakPolarHBondContact CZ2-OD1 3.43Å
632	S	92.7	Very high	92.2	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-53.2	-37.9	172.8	-165.3	0	0	0	0	111.7	A600 I628 L629 A635 T636	A600-S632 WeakPolarHBondContact CA-OG 3.41Å; A600-S632 PolarHBondContact O-OG 3.34Å; A600-S632 VanDerWaalsContact O-OG 3.07Å; I628-S632 PolarHBondContact O-N 3.48Å; L629-S632 WeakPolarHBondContact O-CA 3.26Å; L629-S632 WeakPolarHBondContact O-CB 3.47Å; L629-S632 PolarHBondContact O-N 2.75Å; S632-A635 PolarHBondContact O-N 2.83Å; S632-T636 VanDerWaalsContact O-CB 3.25Å; S632-T636 WeakPolarHBondContact O-CB 3.45Å; S632-T636 PolarHBondContact O-N 3.4Å; S632-T636 PolarHBondContact O-OG1 3.2Å
633	G	93	Very high	91.8	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-57.8	-48	171.8	0	0	0	0	0	112.9	L629 R630 W631 T636 I637	L629-G633 PolarHBondContact O-N 2.91Å; R630-G633 PolarHBondContact O-N 2.76Å; W631-G633 PolarHBondContact O-N 2.9Å; G633-T636 PolarHBondContact O-N 2.99Å; G633-I637 WeakPolarHBondContact O-CG1 3.42Å; G633-I637 PolarHBondContact O-N 2.9Å
634	M	94.7	Very high	91.4	Very high	2 Å²	2	18.5 Å²	18.5	1%	0.01	10%	0.1	C	C	.	.	H	α-helix	trans	-63.3	-41.8	176.8	-56.4	-57.3	123.9	0	0	112.7	I622 R630 W631 T636 I637 A638 L653 A656 V665 A669	I622-M634 HydrophobicContact CD1-CE 3.65Å; I622-M634 HydrophobicContact CG1-CE 3.62Å; R630-M634 PolarHBondContact O-N 3.25Å; W631-M634 WeakPolarHBondContact O-CA 3.39Å; W631-M634 WeakPolarHBondContact O-CB 3.42Å; W631-M634 PolarHBondContact O-N 3.25Å; M634-T636 VanDerWaalsContact C-N 3.34Å; M634-I637 HydrophobicContact CE-CD1 4.49Å; M634-I637 PolarHBondContact O-N 3.19Å; M634-I637 HydrophobicContact SD-CD1 4.35Å; M634-A638 PolarHBondContact O-N 3.23Å; M634-A638 VanDerWaalsContact O-N 3.11Å; M634-L653 HydrophobicContact CB-CD2 4.32Å; M634-L653 HydrophobicContact SD-CD2 3.73Å; M634-A656 HydrophobicContact CE-CB 3.51Å; M634-A656 HydrophobicContact SD-CB 3.48Å; M634-A656 WeakPolarHBondContact SD-CB 3.33Å; M634-V665 HydrophobicContact CG-CG1 3.91Å; M634-A669 HydrophobicContact CG-CB 4.12Å; M634-A669 HydrophobicContact SD-CB 3.9Å
635	A	93.7	Very high	91	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-67.1	-35.3	175.5	0	0	0	0	0	112.1	A604 W631 S632 A638 M639	A604-A635 HydrophobicContact CB-CB 3.81Å; W631-A635 PolarHBondContact O-N 3.4Å; S632-A635 PolarHBondContact O-N 2.83Å; A635-A638 WeakPolarHBondContact O-CB 3.28Å; A635-A638 PolarHBondContact O-N 3.5Å; A635-M639 PolarHBondContact O-N 2.82Å; A635-M639 VanDerWaalsContact O-N 3.15Å
636	T	94.4	Very high	90.9	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-68	-41.9	176.1	-58.3	0	0	0	0	111	M607 A614 L617 I618 S632 G633 M634 A638 M639 A640	M607-T636 HydrophobicContact CB-CG2 4.01Å; M607-T636 HydrophobicContact CG-CG2 4.21Å; A614-T636 HydrophobicContact CB-CG2 4.43Å; L617-T636 HydrophobicContact CD2-CG2 4.47Å; I618-T636 HydrophobicContact CD1-CG2 4.3Å; I618-T636 HydrophobicContact CG1-CG2 3.83Å; S632-T636 VanDerWaalsContact O-CB 3.25Å; S632-T636 WeakPolarHBondContact O-CB 3.45Å; S632-T636 PolarHBondContact O-N 3.4Å; S632-T636 PolarHBondContact O-OG1 3.2Å; G633-T636 PolarHBondContact O-N 2.99Å; M634-T636 VanDerWaalsContact C-N 3.34Å; T636-A638 VanDerWaalsContact C-N 3.32Å; T636-A638 PolarHBondContact O-N 3.42Å; T636-M639 PolarHBondContact O-N 3.07Å; T636-A640 WeakPolarHBondContact O-CB 3.39Å; T636-A640 PolarHBondContact O-N 3.07Å
637	I	94.6	Very high	90.8	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-56.6	-47.4	170.3	-65.2	161.7	0	0	0	110.4	I618 I622 G633 M634 M639 A640 Y641 A649 R652 L653	I618-I637 HydrophobicContact CD1-CG1 3.7Å; I618-I637 HydrophobicContact CG1-CG1 4Å; I618-I637 HydrophobicContact CG2-CD1 3.82Å; I618-I637 HydrophobicContact CG2-CG1 3.68Å; I622-I637 HydrophobicContact CD1-CD1 4.29Å; G633-I637 WeakPolarHBondContact O-CG1 3.42Å; G633-I637 PolarHBondContact O-N 2.9Å; M634-I637 HydrophobicContact CE-CD1 4.49Å; M634-I637 PolarHBondContact O-N 3.19Å; M634-I637 HydrophobicContact SD-CD1 4.35Å; I637-M639 VanDerWaalsContact C-N 3.28Å; I637-M639 PolarHBondContact O-N 2.82Å; I637-A640 PolarHBondContact O-N 2.84Å; I637-Y641 HydrophobicContact CG2-CD2 4.18Å; I637-Y641 WeakPolarHBondContact O-CB 3.15Å; I637-Y641 PolarHBondContact O-N 3.3Å; I637-A649 HydrophobicContact CG2-CB 3.86Å; I637-R652 HydrophobicContact CD1-CB 4.21Å; I637-L653 HydrophobicContact CB-CD2 4.11Å; I637-L653 HydrophobicContact CD1-CD2 3.9Å; I637-L653 HydrophobicContact CD1-CG 4.39Å; I637-L653 HydrophobicContact CG2-CD1 3.92Å; I637-L653 HydrophobicContact CG2-CD2 3.99Å; I637-L653 HydrophobicContact CG2-CG 3.87Å
638	A	92.9	Very high	90.7	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-57.3	-38.3	-178.5	0	0	0	0	0	113.3	M634 A635 T636 C642 A672 F675	M634-A638 PolarHBondContact O-N 3.23Å; M634-A638 VanDerWaalsContact O-N 3.11Å; A635-A638 WeakPolarHBondContact O-CB 3.28Å; A635-A638 PolarHBondContact O-N 3.5Å; T636-A638 VanDerWaalsContact C-N 3.32Å; T636-A638 PolarHBondContact O-N 3.42Å; A638-C642 WeakPolarHBondContact O-CA 3.48Å; A638-C642 WeakPolarHBondContact O-CB 3.23Å; A638-C642 PolarHBondContact O-N 3.32Å; A638-A672 HydrophobicContact CB-CB 3.73Å; A638-F675 HydrophobicContact CB-CB 4Å; A638-F675 HydrophobicContact CB-CD2 4.22Å; A638-F675 HydrophobicContact CB-CG 4.34Å
639	M	92.6	Very high	90.6	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-88.9	-35.8	-178.4	-66.1	-59.4	-92.5	0	0	113.2	A604 L605 Y608 G609 A635 T636 I637 C642 A811 V812 L815	A604-M639 WeakPolarHBondContact O-CB 3.44Å; L605-M639 HydrophobicContact CD2-CE 3.93Å; Y608-M639 HydrophobicContact CD2-CB 4.2Å; Y608-M639 HydrophobicContact CD2-CE 3.52Å; Y608-M639 HydrophobicContact CD2-SD 3.96Å; Y608-M639 HydrophobicContact CE2-CE 4.09Å; Y608-M639 HydrophobicContact CE2-SD 4.34Å; Y608-M639 HydrophobicContact CG-CE 4.37Å; G609-M639 PolarHBondContact N-O 3.4Å; A635-M639 PolarHBondContact O-N 2.82Å; A635-M639 VanDerWaalsContact O-N 3.15Å; T636-M639 PolarHBondContact O-N 3.07Å; I637-M639 VanDerWaalsContact C-N 3.28Å; I637-M639 PolarHBondContact O-N 2.82Å; M639-C642 WeakPolarHBondContact O-CB 3.24Å; M639-A811 HydrophobicContact CE-CB 4.4Å; M639-A811 HydrophobicContact SD-CB 4.48Å; M639-V812 HydrophobicContact CE-CG2 3.77Å; M639-L815 HydrophobicContact CE-CD2 4Å; M639-L815 HydrophobicContact CG-CD1 4.3Å; M639-L815 HydrophobicContact CG-CD2 3.83Å; M639-L815 HydrophobicContact SD-CB 4.4Å; M639-L815 HydrophobicContact SD-CD1 4.37Å; M639-L815 HydrophobicContact SD-CD2 4.05Å
640	A	91.8	Very high	90.6	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-69.3	-40.6	176.7	0	0	0	0	0	112.3	M607 V611 A614 T636 I637	M607-A640 WeakPolarHBondContact O-CA 3.35Å; V611-A640 PolarHBondContact N-O 2.83Å; V611-A640 VanDerWaalsContact N-O 3.13Å; A614-A640 HydrophobicContact CB-CB 3.51Å; T636-A640 WeakPolarHBondContact O-CB 3.39Å; T636-A640 PolarHBondContact O-N 3.07Å; I637-A640 PolarHBondContact O-N 2.84Å
641	Y	90.7	Very high	90.6	Very high	4 Å²	4	26.8 Å²	26.8	2%	0.016	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	17.4	-179.7	-71	-87.3	0	0	0	113.5	V611 D615 I618 I637 G643 T644 N646 A649	V611-Y641 HydrophobicContact CB-CE1 4.43Å; V611-Y641 HydrophobicContact CG1-CD1 3.85Å; V611-Y641 HydrophobicContact CG1-CE1 3.39Å; D615-Y641 PolarHBondContact OD1-OH 3.16Å; D615-Y641 PolarHBondContact OD2-OH 2.96Å; I618-Y641 HydrophobicContact CD1-CE2 4.33Å; I637-Y641 HydrophobicContact CG2-CD2 4.18Å; I637-Y641 WeakPolarHBondContact O-CB 3.15Å; I637-Y641 PolarHBondContact O-N 3.3Å; Y641-G643 PolarHBondContact O-N 3.47Å; Y641-T644 WeakPolarHBondContact CB-OG1 3.15Å; Y641-T644 HydrophobicContact CD1-CG2 4.43Å; Y641-T644 WeakPolarHBondContact O-CB 3.47Å; Y641-T644 WeakPolarHBondContact O-CG2 3.43Å; Y641-T644 PolarHBondContact O-N 3.18Å; Y641-T644 PolarHBondContact O-OG1 3.15Å; Y641-N646 HydrophobicContact CD1-CB 3.8Å; Y641-N646 HydrophobicContact CE1-CB 4.08Å; Y641-A649 HydrophobicContact CD1-CB 3.87Å; Y641-A649 HydrophobicContact CD2-CB 3.91Å; Y641-A649 HydrophobicContact CE1-CB 4.39Å; Y641-A649 HydrophobicContact CE2-CB 4.44Å; Y641-A649 HydrophobicContact CG-CB 3.6Å
642	C	88.1	Confident	90.5	Very high	14 Å²	14	29.3 Å²	29.3	10%	0.095	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	109.9	-174.6	-159.9	0	0	0	0	112.2	Y608 A638 M639 T644 F675	Y608-C642 HydrophobicContact CD2-CB 4.48Å; Y608-C642 HydrophobicContact CE2-CB 3.89Å; A638-C642 WeakPolarHBondContact O-CA 3.48Å; A638-C642 WeakPolarHBondContact O-CB 3.23Å; A638-C642 PolarHBondContact O-N 3.32Å; M639-C642 WeakPolarHBondContact O-CB 3.24Å; C642-T644 VanDerWaalsContact C-N 3.31Å; C642-T644 PolarHBondContact O-N 2.95Å; C642-F675 CarbonylContact C-O 3.57Å; C642-F675 WeakPolarHBondContact CA-O 3.32Å
643	G	83	Confident	90.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.9	28.1	-178.3	0	0	0	0	0	114.5	Y641 F675 V676 F678 K679	Y641-G643 PolarHBondContact O-N 3.47Å; G643-F675 PolarHBondContact N-O 3.32Å; G643-V676 WeakPolarHBondContact CA-O 3.46Å; G643-F678 VanDerWaalsContact N-CE1 3.27Å; G643-K679 WeakPolarHBondContact O-CD 3.33Å; G643-K679 WeakPolarHBondContact O-CE 3.39Å; G643-K679 PolarHBondContact O-NZ 3.04Å
644	T	82.9	Confident	90.5	Very high	49 Å²	49	31.8 Å²	31.8	30%	0.301	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-36.1	172.7	59.3	0	0	0	0	112.6	V611 Y641 C642 N646	V611-T644 HydrophobicContact CG2-CG2 4.22Å; Y641-T644 WeakPolarHBondContact CB-OG1 3.15Å; Y641-T644 HydrophobicContact CD1-CG2 4.43Å; Y641-T644 WeakPolarHBondContact O-CB 3.47Å; Y641-T644 WeakPolarHBondContact O-CG2 3.43Å; Y641-T644 PolarHBondContact O-N 3.18Å; Y641-T644 PolarHBondContact O-OG1 3.15Å; C642-T644 VanDerWaalsContact C-N 3.31Å; C642-T644 PolarHBondContact O-N 2.95Å; T644-N646 VanDerWaalsContact C-N 3.29Å; T644-N646 PolarHBondContact OG1-N 2.68Å
645	G	82.9	Confident	90.5	Very high	23 Å²	23	38 Å²	38	24%	0.237	19%	0.191	C	C	.	.			trans	72.6	14.3	-170.2	0	0	0	0	0	115.1	N647 V676	G645-N647 PolarHBondContact O-N 2.82Å; G645-V676 PolarHBondContact N-O 3.01Å
646	N	87.1	Confident	90.4	Very high	33 Å²	33	38.4 Å²	38.4	18%	0.176	20%	0.195	C	C	.	.			trans	-65.5	120.8	-175.7	-173.5	-27	0	0	0	112.3	Y641 T644 Q648 A649 V650	Y641-N646 HydrophobicContact CD1-CB 3.8Å; Y641-N646 HydrophobicContact CE1-CB 4.08Å; T644-N646 VanDerWaalsContact C-N 3.29Å; T644-N646 PolarHBondContact OG1-N 2.68Å; N646-Q648 PolarHBondContact O-N 3.15Å; N646-Q648 WeakPolarHBondContact OD1-CB 3.38Å; N646-Q648 PolarHBondContact OD1-N 3.25Å; N646-A649 PolarHBondContact O-N 3.47Å; N646-A649 VanDerWaalsContact O-N 3.14Å; N646-V650 PolarHBondContact O-N 3.31Å
647	N	89	Confident	90.3	Very high	134 Å²	134	38.5 Å²	38.5	72%	0.717	20%	0.195	S	C	*	.	H	α-helix	trans	-56.9	-31.3	178.8	-69	-40.2	0	0	0	113.9	G645 K651	G645-N647 PolarHBondContact O-N 2.82Å; N647-K651 VanDerWaalsContact O-CB 3.3Å; N647-K651 WeakPolarHBondContact O-CB 3.36Å; N647-K651 PolarHBondContact O-N 3.3Å
648	Q	88.7	Confident	90.1	Very high	117 Å²	117	43.5 Å²	43.5	55%	0.547	23%	0.225	S	C	.	.	H	α-helix	trans	-66.9	-44.2	177.3	-60.3	-170.9	11.7	0	0	111.5	N646 K651 R652	N646-Q648 PolarHBondContact O-N 3.15Å; N646-Q648 WeakPolarHBondContact OD1-CB 3.38Å; N646-Q648 PolarHBondContact OD1-N 3.25Å; Q648-K651 PolarHBondContact O-N 3.41Å; Q648-R652 WeakPolarHBondContact O-CG 3.42Å; Q648-R652 PolarHBondContact O-N 2.95Å
649	A	90.9	Very high	90.1	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.008	25%	0.248	C	C	.	.	H	α-helix	trans	-62.9	-45.2	175.9	0	0	0	0	0	111.1	I637 Y641 N646 K651 R652 L653 V676	I637-A649 HydrophobicContact CG2-CB 3.86Å; Y641-A649 HydrophobicContact CD1-CB 3.87Å; Y641-A649 HydrophobicContact CD2-CB 3.91Å; Y641-A649 HydrophobicContact CE1-CB 4.39Å; Y641-A649 HydrophobicContact CE2-CB 4.44Å; Y641-A649 HydrophobicContact CG-CB 3.6Å; N646-A649 PolarHBondContact O-N 3.47Å; N646-A649 VanDerWaalsContact O-N 3.14Å; A649-K651 VanDerWaalsContact C-N 3.33Å; A649-K651 PolarHBondContact O-N 2.94Å; A649-R652 PolarHBondContact O-N 3.11Å; A649-L653 VanDerWaalsContact O-CG 3.31Å; A649-L653 WeakPolarHBondContact O-CG 3.25Å; A649-L653 PolarHBondContact O-N 3Å; A649-V676 HydrophobicContact CB-CG1 4.49Å
650	V	92.2	Very high	90.1	Very high	17 Å²	17	47.6 Å²	47.6	10%	0.103	25%	0.253	C	S	.	.	H	α-helix	trans	-58.7	-43.3	174.3	174.6	0	0	0	0	111.3	N646 L653 L654 L673 V676 L677 L687	N646-V650 PolarHBondContact O-N 3.31Å; V650-L653 PolarHBondContact O-N 3.27Å; V650-L654 HydrophobicContact CG1-CD1 3.7Å; V650-L654 HydrophobicContact CG1-CG 4.26Å; V650-L654 WeakPolarHBondContact O-CB 3.44Å; V650-L654 VanDerWaalsContact O-CG 3.3Å; V650-L654 WeakPolarHBondContact O-CG 3.5Å; V650-L654 PolarHBondContact O-N 2.88Å; V650-L673 HydrophobicContact CB-CD2 4.47Å; V650-L673 HydrophobicContact CG1-CD2 4.05Å; V650-L673 HydrophobicContact CG2-CD2 4.42Å; V650-V676 HydrophobicContact CG2-CG1 4.03Å; V650-L677 HydrophobicContact CG2-CD1 4.33Å; V650-L677 HydrophobicContact CG2-CD2 4.2Å; V650-L677 HydrophobicContact CG2-CG 4.34Å; V650-L687 HydrophobicContact CG1-CD2 4.14Å
651	K	93.2	Very high	90.1	Very high	161 Å²	161	53.6 Å²	53.6	70%	0.7	29%	0.289	S	S	*	.	H	α-helix	trans	-64.3	-43.5	177.1	-174.5	174.4	-179	174.2	0	112.7	N647 Q648 A649 H655	N647-K651 VanDerWaalsContact O-CB 3.3Å; N647-K651 WeakPolarHBondContact O-CB 3.36Å; N647-K651 PolarHBondContact O-N 3.3Å; Q648-K651 PolarHBondContact O-N 3.41Å; A649-K651 VanDerWaalsContact C-N 3.33Å; A649-K651 PolarHBondContact O-N 2.94Å; K651-H655 WeakPolarHBondContact O-CB 3.44Å; K651-H655 PolarHBondContact O-N 3.42Å
652	R	91.9	Very high	90.2	Very high	60 Å²	60	55.5 Å²	55.5	23%	0.226	30%	0.3	C	S	.	.	H	α-helix	trans	-59.6	-46.4	174.9	-69.2	-174.8	-162.3	-134.4	14.3	110.8	D615 D619 I637 Q648 A649 H655 A656	D615-R652 IonicContact OD1-CZ 3.5Å; D615-R652 IonicContact OD1-NH2 3.84Å; D615-R652 IonicContact OD2-CZ 2.67Å; D615-R652 IonicContact OD2-NH2 2.81Å; D615-R652 PolarHBondContact OD2-NH2 3.01Å; D619-R652 IonicContact OD1-CZ 3.19Å; D619-R652 IonicContact OD1-NH1 2.63Å; D619-R652 PolarHBondContact OD1-NH1 3.19Å; D619-R652 IonicContact OD2-CZ 2.72Å; D619-R652 IonicContact OD2-NH1 3.82Å; D619-R652 PolarHBondContact OD2-NH1 3.3Å; D619-R652 IonicContact OD2-NH2 3.34Å; I637-R652 HydrophobicContact CD1-CB 4.21Å; Q648-R652 WeakPolarHBondContact O-CG 3.42Å; Q648-R652 PolarHBondContact O-N 2.95Å; A649-R652 PolarHBondContact O-N 3.11Å; R652-H655 PolarHBondContact O-N 3.14Å; R652-A656 PolarHBondContact O-N 2.92Å; R652-A656 VanDerWaalsContact O-N 3.07Å
653	L	93.4	Very high	90.5	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-64	-48.6	178.7	-69.2	174.5	0	0	0	112.8	M634 I637 A649 V650 H655 A656 A657 A672 L673 V676	M634-L653 HydrophobicContact CB-CD2 4.32Å; M634-L653 HydrophobicContact SD-CD2 3.73Å; I637-L653 HydrophobicContact CB-CD2 4.11Å; I637-L653 HydrophobicContact CD1-CD2 3.9Å; I637-L653 HydrophobicContact CD1-CG 4.39Å; I637-L653 HydrophobicContact CG2-CD1 3.92Å; I637-L653 HydrophobicContact CG2-CD2 3.99Å; I637-L653 HydrophobicContact CG2-CG 3.87Å; A649-L653 VanDerWaalsContact O-CG 3.31Å; A649-L653 WeakPolarHBondContact O-CG 3.25Å; A649-L653 PolarHBondContact O-N 3Å; V650-L653 PolarHBondContact O-N 3.27Å; L653-H655 VanDerWaalsContact C-N 3.32Å; L653-H655 PolarHBondContact O-N 3.22Å; L653-A656 PolarHBondContact O-N 3.07Å; L653-A657 WeakPolarHBondContact O-CB 3.04Å; L653-A657 PolarHBondContact O-N 3.21Å; L653-A672 HydrophobicContact CD1-CB 3.66Å; L653-A672 HydrophobicContact CD2-CB 3.62Å; L653-A672 HydrophobicContact CG-CB 4.28Å; L653-L673 HydrophobicContact CB-CD2 3.98Å; L653-L673 HydrophobicContact CD1-CD2 3.89Å; L653-L673 HydrophobicContact CD1-CG 4.42Å; L653-V676 HydrophobicContact CD1-CG2 3.99Å
654	L	92.9	Very high	90.9	Very high	53 Å²	53	59.4 Å²	59.4	28%	0.277	32%	0.32	S	S	.	.	H	α-helix	trans	-64.4	-36.1	179.4	-70.3	171.6	0	0	0	112.4	V650 L673 L687 L691	V650-L654 HydrophobicContact CG1-CD1 3.7Å; V650-L654 HydrophobicContact CG1-CG 4.26Å; V650-L654 WeakPolarHBondContact O-CB 3.44Å; V650-L654 VanDerWaalsContact O-CG 3.3Å; V650-L654 WeakPolarHBondContact O-CG 3.5Å; V650-L654 PolarHBondContact O-N 2.88Å; L654-L673 HydrophobicContact CD2-CD1 3.83Å; L654-L673 HydrophobicContact CG-CD2 4.43Å; L654-L687 HydrophobicContact CD1-CD1 4.06Å; L654-L691 HydrophobicContact CD2-CD1 4.46Å
655	H	93.4	Very high	91.4	Very high	133 Å²	133	57.1 Å²	57.1	62%	0.616	31%	0.306	S	S	*	.	H	α-helix	trans	-61.3	-54.1	172.5	-177.2	-83.5	0	0	0	110.7	K651 R652 L653 A657 V658 S659	K651-H655 WeakPolarHBondContact O-CB 3.44Å; K651-H655 PolarHBondContact O-N 3.42Å; R652-H655 PolarHBondContact O-N 3.14Å; L653-H655 VanDerWaalsContact C-N 3.32Å; L653-H655 PolarHBondContact O-N 3.22Å; H655-A657 VanDerWaalsContact C-N 3.28Å; H655-A657 PolarHBondContact O-N 3.09Å; H655-V658 PolarHBondContact O-N 3.45Å; H655-S659 PolarHBondContact CE1-OG 2.95Å; H655-S659 PolarHBondContact ND1-OG 3.38Å; H655-S659 VanDerWaalsContact ND1-OG 3.17Å; H655-S659 WeakPolarHBondContact O-CB 3.45Å; H655-S659 PolarHBondContact O-N 3.06Å; H655-S659 PolarHBondContact O-OG 3.17Å; H655-S659 VanDerWaalsContact O-OG 3.07Å
656	A	91.8	Very high	92	Very high	8 Å²	8	57.5 Å²	57.5	7%	0.066	30%	0.3	C	S	.	.	H	α-helix	trans	-58.2	-37.2	-179.7	0	0	0	0	0	113.5	M634 R652 L653 V658 S659 D660 A669	M634-A656 HydrophobicContact CE-CB 3.51Å; M634-A656 HydrophobicContact SD-CB 3.48Å; M634-A656 WeakPolarHBondContact SD-CB 3.33Å; R652-A656 PolarHBondContact O-N 2.92Å; R652-A656 VanDerWaalsContact O-N 3.07Å; L653-A656 PolarHBondContact O-N 3.07Å; A656-V658 PolarHBondContact O-N 2.97Å; A656-S659 PolarHBondContact O-N 3.12Å; A656-D660 PolarHBondContact O-N 2.96Å; A656-D660 VanDerWaalsContact O-N 3.15Å; A656-A669 HydrophobicContact CB-CB 4.25Å
657	A	92	Very high	92.3	Very high	1 Å²	1	56 Å²	56	1%	0.008	29%	0.292	C	S	.	.	H	α-helix	trans	-62.1	-23.2	176.6	0	0	0	0	0	114.1	L653 H655 A669 V670 L699	L653-A657 WeakPolarHBondContact O-CB 3.04Å; L653-A657 PolarHBondContact O-N 3.21Å; H655-A657 VanDerWaalsContact C-N 3.28Å; H655-A657 PolarHBondContact O-N 3.09Å; A657-A669 HydrophobicContact CB-CB 3.86Å; A657-V670 HydrophobicContact CB-CG2 3.93Å; A657-L699 HydrophobicContact CB-CD2 4.19Å
658	V	91.3	Very high	92.5	Very high	105 Å²	105	49.9 Å²	49.9	64%	0.636	26%	0.259	S	S	*	.	H	α-helix	trans	-102.7	-37.7	177.2	-179.6	0	0	0	0	111.6	H655 A656 R666	H655-V658 PolarHBondContact O-N 3.45Å; A656-V658 PolarHBondContact O-N 2.97Å; V658-R666 PolarHBondContact O-NH2 3.01Å; V658-R666 VanDerWaalsContact O-NH2 3.14Å
659	S	91.7	Very high	92.8	Very high	68 Å²	68	44.3 Å²	44.3	48%	0.476	23%	0.233	S	C	.	.	H	α-helix	trans	-86	-32.7	-169.1	69.1	0	0	0	0	115.3	H655 A656	H655-S659 PolarHBondContact CE1-OG 2.95Å; H655-S659 PolarHBondContact ND1-OG 3.38Å; H655-S659 VanDerWaalsContact ND1-OG 3.17Å; H655-S659 WeakPolarHBondContact O-CB 3.45Å; H655-S659 PolarHBondContact O-N 3.06Å; H655-S659 PolarHBondContact O-OG 3.17Å; H655-S659 VanDerWaalsContact O-OG 3.07Å; A656-S659 PolarHBondContact O-N 3.12Å
660	D	93.2	Very high	93	Very high	19 Å²	19	44.2 Å²	44.2	10%	0.102	23%	0.232	C	C	.	.			trans	-69.2	154.2	178.8	-152.1	-61.6	0	0	0	110.6	R630 A656 N662 V665 R666	R630-D660 IonicContact CZ-OD1 2.77Å; R630-D660 IonicContact CZ-OD2 3.89Å; R630-D660 IonicContact NE-OD1 3.37Å; R630-D660 IonicContact NE-OD2 2.74Å; R630-D660 PolarHBondContact NE-OD2 2.82Å; R630-D660 IonicContact NH2-OD1 3.68Å; R630-D660 PolarHBondContact NH2-OD1 2.83Å; R630-D660 IonicContact NH2-OD2 3.17Å; R630-D660 PolarHBondContact NH2-OD2 3.08Å; A656-D660 PolarHBondContact O-N 2.96Å; A656-D660 VanDerWaalsContact O-N 3.15Å; D660-N662 WeakPolarHBondContact OD1-CB 3.48Å; D660-N662 PolarHBondContact OD1-N 3.35Å; D660-V665 HydrophobicContact CB-CB 4.18Å; D660-V665 HydrophobicContact CB-CG1 4.04Å; D660-R666 PolarHBondContact O-NE 2.7Å; D660-R666 PolarHBondContact O-NH2 3.07Å
661	T	92	Very high	93.1	Very high	125 Å²	125	43.5 Å²	43.5	77%	0.767	23%	0.228	S	C	*	.	S	Bend	trans	-92.8	-18	174.3	52.5	0	0	0	0	112.7
662	N	93.8	Very high	93.1	Very high	44 Å²	44	35.9 Å²	35.9	24%	0.235	19%	0.194	C	C	.	.			trans	-88.9	130.3	-175	179.9	-80	0	0	0	112.9	P627 D660 D664 V665 R666	P627-N662 HydrophobicContact CB-CB 3.88Å; P627-N662 WeakPolarHBondContact CB-ND2 3.31Å; P627-N662 HydrophobicContact CG-CB 4.31Å; D660-N662 WeakPolarHBondContact OD1-CB 3.48Å; D660-N662 PolarHBondContact OD1-N 3.35Å; N662-D664 VanDerWaalsContact C-N 3.35Å; N662-D664 PolarHBondContact O-N 2.84Å; N662-D664 WeakPolarHBondContact OD1-CA 3.41Å; N662-D664 VanDerWaalsContact OD1-CB 3.3Å; N662-D664 WeakPolarHBondContact OD1-CB 3.46Å; N662-D664 PolarHBondContact OD1-N 3.4Å; N662-V665 HydrophobicContact CB-CG2 4.08Å; N662-V665 PolarHBondContact O-N 3.18Å; N662-V665 PolarHBondContact OD1-N 3Å; N662-R666 VanDerWaalsContact O-CG 3.32Å; N662-R666 WeakPolarHBondContact O-CG 3.4Å; N662-R666 PolarHBondContact O-N 3.05Å; N662-R666 VanDerWaalsContact O-N 3.09Å
663	D	93.3	Very high	93.2	Very high	58 Å²	58	33 Å²	33	31%	0.31	18%	0.184	S	C	.	.	H	α-helix	trans	-68.1	-24.8	-176.4	-88.4	-54.4	0	0	0	114.7	R667 H696 H698	D663-R667 WeakPolarHBondContact O-CB 3.28Å; D663-R667 PolarHBondContact O-N 3.04Å; D663-H696 IonicContact OD1-ND1 2.67Å; D663-H698 HydrophobicContact CB-CB 4.06Å; D663-H698 WeakPolarHBondContact OD1-CB 3.31Å; D663-H698 IonicContact OD1-CD2 3.47Å; D663-H698 PolarHBondContact OD1-CD2 2.89Å; D663-H698 IonicContact OD1-CG 3.41Å
664	D	91.7	Very high	93.1	Very high	39 Å²	39	33 Å²	33	21%	0.209	18%	0.184	C	C	.	.	H	α-helix	trans	-72.6	-45.5	173.2	-79.2	-36.8	0	0	0	111.8	N662 R666 R667 W668	N662-D664 VanDerWaalsContact C-N 3.35Å; N662-D664 PolarHBondContact O-N 2.84Å; N662-D664 WeakPolarHBondContact OD1-CA 3.41Å; N662-D664 VanDerWaalsContact OD1-CB 3.3Å; N662-D664 WeakPolarHBondContact OD1-CB 3.46Å; N662-D664 PolarHBondContact OD1-N 3.4Å; D664-R666 VanDerWaalsContact C-N 3.3Å; D664-R666 PolarHBondContact O-N 3.01Å; D664-R667 PolarHBondContact O-N 3.23Å; D664-R667 IonicContact OD1-CZ 3.12Å; D664-R667 IonicContact OD1-NE 3.6Å; D664-R667 PolarHBondContact OD1-NE 3.41Å; D664-R667 IonicContact OD1-NH2 2.71Å; D664-R667 PolarHBondContact OD1-NH2 3.27Å; D664-W668 WeakPolarHBondContact O-CB 3.3Å; D664-W668 PolarHBondContact O-N 3.3Å
665	V	93.9	Very high	93.1	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-59.4	-45.5	175.1	-172.5	0	0	0	0	109.8	P627 R630 W631 M634 D660 N662 W668 A669	P627-V665 HydrophobicContact CB-CG2 4.34Å; P627-V665 WeakPolarHBondContact O-CG2 3.31Å; R630-V665 HydrophobicContact CB-CG2 4.09Å; W631-V665 HydrophobicContact CB-CG2 4.26Å; M634-V665 HydrophobicContact CG-CG1 3.91Å; D660-V665 HydrophobicContact CB-CB 4.18Å; D660-V665 HydrophobicContact CB-CG1 4.04Å; N662-V665 HydrophobicContact CB-CG2 4.08Å; N662-V665 PolarHBondContact O-N 3.18Å; N662-V665 PolarHBondContact OD1-N 3Å; V665-W668 PolarHBondContact O-N 3.07Å; V665-A669 VanDerWaalsContact O-CB 3.25Å; V665-A669 WeakPolarHBondContact O-CB 3.49Å; V665-A669 PolarHBondContact O-N 3.3Å
666	R	94.3	Very high	93.1	Very high	32 Å²	32	24.2 Å²	24.2	12%	0.121	14%	0.141	C	C	.	.	H	α-helix	trans	-58.3	-51.8	175.6	-73.2	173	170	-124.3	-9.9	112.9	V658 D660 N662 D664 W668 A669 V670 H696 L699	V658-R666 PolarHBondContact O-NH2 3.01Å; V658-R666 VanDerWaalsContact O-NH2 3.14Å; D660-R666 PolarHBondContact O-NE 2.7Å; D660-R666 PolarHBondContact O-NH2 3.07Å; N662-R666 VanDerWaalsContact O-CG 3.32Å; N662-R666 WeakPolarHBondContact O-CG 3.4Å; N662-R666 PolarHBondContact O-N 3.05Å; N662-R666 VanDerWaalsContact O-N 3.09Å; D664-R666 VanDerWaalsContact C-N 3.3Å; D664-R666 PolarHBondContact O-N 3.01Å; R666-W668 VanDerWaalsContact C-N 3.27Å; R666-W668 PolarHBondContact O-N 2.96Å; R666-A669 PolarHBondContact O-N 3.1Å; R666-V670 PolarHBondContact O-N 3.33Å; R666-H696 PolarHBondContact NH1-CD2 3.41Å; R666-H696 VanDerWaalsContact NH1-CD2 3.33Å; R666-H696 PolarHBondContact NH1-CE1 3.44Å; R666-H696 PolarHBondContact NH1-NE2 3.48Å; R666-L699 HydrophobicContact CB-CD2 3.86Å; R666-L699 HydrophobicContact CG-CD2 4.5Å
667	R	93.7	Very high	93	Very high	2 Å²	2	24.4 Å²	24.4	1%	0.008	14%	0.141	C	C	.	.	H	α-helix	trans	-53.4	-45	176.7	172.9	172.2	66.7	139.8	4.4	111.7	D663 D664 T671 H698 Y701 W821	D663-R667 WeakPolarHBondContact O-CB 3.28Å; D663-R667 PolarHBondContact O-N 3.04Å; D664-R667 PolarHBondContact O-N 3.23Å; D664-R667 IonicContact OD1-CZ 3.12Å; D664-R667 IonicContact OD1-NE 3.6Å; D664-R667 PolarHBondContact OD1-NE 3.41Å; D664-R667 IonicContact OD1-NH2 2.71Å; D664-R667 PolarHBondContact OD1-NH2 3.27Å; R667-T671 WeakPolarHBondContact O-CB 3.47Å; R667-T671 PolarHBondContact O-N 3.01Å; R667-T671 VanDerWaalsContact O-N 3.13Å; R667-T671 PolarHBondContact O-OG1 3.31Å; R667-H698 HydrophobicContact CB-CB 4.27Å; R667-Y701 HydrophobicContact CG-CD1 3.88Å; R667-Y701 HydrophobicContact CG-CE1 4.41Å; R667-W821 VanDerWaalsContact NH1-CE3 3.33Å; R667-W821 VanDerWaalsContact NH1-CG 3.29Å
668	W	94	Very high	92.9	Very high	4 Å²	4	24.7 Å²	24.7	2%	0.015	14%	0.142	C	C	.	.	H	α-helix	trans	-81.5	-33.6	-175.2	-86.7	102.1	0	0	0	114.4	W631 D664 V665 R666 V670 T671 A672 L815 Q818 N819	W631-W668 AromaticContact CD1-CD1 3.39Å; W631-W668 AromaticContact CD1-CD2 3.82Å; W631-W668 AromaticContact CD1-CG 3.24Å; W631-W668 AromaticContact CD1-NE1 4Å; W631-W668 AromaticContact CE2-CD1 3.89Å; W631-W668 AromaticContact CE2-CE2 3.78Å; W631-W668 AromaticContact CE2-NE1 3.67Å; W631-W668 HydrophobicContact CG-CG 4.39Å; W631-W668 AromaticContact CZ2-CE2 3.85Å; W631-W668 AromaticContact CZ2-CZ2 3.87Å; W631-W668 HydrophobicContact CZ2-CZ2 3.87Å; W631-W668 AromaticContact CZ2-NE1 3.93Å; W631-W668 AromaticContact NE1-CD1 3.16Å; W631-W668 AromaticContact NE1-CD2 3.1Å; W631-W668 AromaticContact NE1-CE2 3.26Å; W631-W668 VanDerWaalsContact NE1-CE2 3.26Å; W631-W668 AromaticContact NE1-CE3 3.75Å; W631-W668 AromaticContact NE1-CG 3.02Å; W631-W668 AromaticContact NE1-NE1 3.29Å; D664-W668 WeakPolarHBondContact O-CB 3.3Å; D664-W668 PolarHBondContact O-N 3.3Å; V665-W668 PolarHBondContact O-N 3.07Å; R666-W668 VanDerWaalsContact C-N 3.27Å; R666-W668 PolarHBondContact O-N 2.96Å; W668-V670 VanDerWaalsContact C-N 3.26Å; W668-V670 PolarHBondContact O-N 2.75Å; W668-T671 HydrophobicContact CE3-CG2 4.34Å; W668-T671 HydrophobicContact CZ3-CG2 4.47Å; W668-T671 PolarHBondContact O-N 2.8Å; W668-A672 VanDerWaalsContact O-CB 3.26Å; W668-A672 WeakPolarHBondContact O-CB 3.18Å; W668-A672 PolarHBondContact O-N 3.07Å; W668-L815 HydrophobicContact CH2-CD1 4.12Å; W668-L815 HydrophobicContact CZ3-CD1 3.8Å; W668-Q818 HydrophobicContact CH2-CB 3.5Å; W668-Q818 HydrophobicContact CH2-CG 4.28Å; W668-Q818 HydrophobicContact CZ2-CB 3.72Å; W668-Q818 HydrophobicContact CZ3-CB 4.36Å; W668-N819 WeakPolarHBondContact CZ2-ND2 3.36Å; W668-N819 WeakPolarHBondContact CZ2-OD1 3.39Å
669	A	94.8	Very high	92.7	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-57.5	-40.6	173	0	0	0	0	0	111.5	M634 A656 A657 V665 R666	M634-A669 HydrophobicContact CG-CB 4.12Å; M634-A669 HydrophobicContact SD-CB 3.9Å; A656-A669 HydrophobicContact CB-CB 4.25Å; A657-A669 HydrophobicContact CB-CB 3.86Å; V665-A669 VanDerWaalsContact O-CB 3.25Å; V665-A669 WeakPolarHBondContact O-CB 3.49Å; V665-A669 PolarHBondContact O-N 3.3Å; R666-A669 PolarHBondContact O-N 3.1Å
670	V	94.8	Very high	92.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-72.2	-45.2	172.7	-173.7	0	0	0	0	111.7	A657 R666 W668 A672 L673 L691 L699 A703 A706	A657-V670 HydrophobicContact CB-CG2 3.93Å; R666-V670 PolarHBondContact O-N 3.33Å; W668-V670 VanDerWaalsContact C-N 3.26Å; W668-V670 PolarHBondContact O-N 2.75Å; V670-A672 PolarHBondContact O-N 3.33Å; V670-L673 HydrophobicContact CG1-CD1 4.4Å; V670-L673 VanDerWaalsContact O-CB 3.31Å; V670-L673 WeakPolarHBondContact O-CB 3.46Å; V670-L673 PolarHBondContact O-N 2.99Å; V670-L673 VanDerWaalsContact O-N 3.11Å; V670-L691 HydrophobicContact CG1-CD1 3.76Å; V670-L691 HydrophobicContact CG2-CD1 3.92Å; V670-L699 HydrophobicContact CG2-CD2 3.59Å; V670-A703 HydrophobicContact CG1-CB 4.29Å; V670-A706 WeakPolarHBondContact O-CB 3.35Å
671	T	94.3	Very high	92.1	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.012	13%	0.131	C	C	.	.	H	α-helix	trans	-57.8	-37.5	179.4	-56.2	0	0	0	0	112.1	R667 W668 L673 G674 G702 M705 I709 Q818	R667-T671 WeakPolarHBondContact O-CB 3.47Å; R667-T671 PolarHBondContact O-N 3.01Å; R667-T671 VanDerWaalsContact O-N 3.13Å; R667-T671 PolarHBondContact O-OG1 3.31Å; W668-T671 HydrophobicContact CE3-CG2 4.34Å; W668-T671 HydrophobicContact CZ3-CG2 4.47Å; W668-T671 PolarHBondContact O-N 2.8Å; T671-L673 VanDerWaalsContact C-N 3.27Å; T671-L673 PolarHBondContact O-N 2.92Å; T671-G674 PolarHBondContact O-N 3.18Å; T671-G674 VanDerWaalsContact O-N 3.14Å; T671-G702 WeakPolarHBondContact OG1-CA 3.37Å; T671-M705 HydrophobicContact CG2-CB 4.28Å; T671-I709 HydrophobicContact CG2-CD1 4.05Å; T671-Q818 HydrophobicContact CG2-CG 4.3Å
672	A	93.6	Very high	91.9	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-60.1	-30.7	178.3	0	0	0	0	0	113.6	A638 L653 W668 V670 G674 F675 V676	A638-A672 HydrophobicContact CB-CB 3.73Å; L653-A672 HydrophobicContact CD1-CB 3.66Å; L653-A672 HydrophobicContact CD2-CB 3.62Å; L653-A672 HydrophobicContact CG-CB 4.28Å; W668-A672 VanDerWaalsContact O-CB 3.26Å; W668-A672 WeakPolarHBondContact O-CB 3.18Å; W668-A672 PolarHBondContact O-N 3.07Å; V670-A672 PolarHBondContact O-N 3.33Å; A672-G674 PolarHBondContact O-N 3.22Å; A672-F675 PolarHBondContact O-N 2.91Å; A672-V676 PolarHBondContact O-N 3.25Å; A672-V676 VanDerWaalsContact O-N 3.09Å
673	L	93.5	Very high	91.7	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-56.9	-35.1	175.7	-62.2	170.6	0	0	0	111.6	V650 L653 L654 V670 T671 F675 V676 L677 L687	V650-L673 HydrophobicContact CB-CD2 4.47Å; V650-L673 HydrophobicContact CG1-CD2 4.05Å; V650-L673 HydrophobicContact CG2-CD2 4.42Å; L653-L673 HydrophobicContact CB-CD2 3.98Å; L653-L673 HydrophobicContact CD1-CD2 3.89Å; L653-L673 HydrophobicContact CD1-CG 4.42Å; L654-L673 HydrophobicContact CD2-CD1 3.83Å; L654-L673 HydrophobicContact CG-CD2 4.43Å; V670-L673 HydrophobicContact CG1-CD1 4.4Å; V670-L673 VanDerWaalsContact O-CB 3.31Å; V670-L673 WeakPolarHBondContact O-CB 3.46Å; V670-L673 PolarHBondContact O-N 2.99Å; V670-L673 VanDerWaalsContact O-N 3.11Å; T671-L673 VanDerWaalsContact C-N 3.27Å; T671-L673 PolarHBondContact O-N 2.92Å; L673-F675 VanDerWaalsContact C-N 3.31Å; L673-F675 PolarHBondContact O-N 3.28Å; L673-V676 PolarHBondContact O-N 3.25Å; L673-L677 WeakPolarHBondContact O-CB 3.44Å; L673-L677 PolarHBondContact O-N 2.99Å; L673-L687 HydrophobicContact CD1-CD2 4.27Å; L673-L687 HydrophobicContact CD2-CD2 4.43Å
674	G	91.5	Very high	91.5	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-61.9	-36.3	176.2	0	0	0	0	0	113.3	T671 A672 F678	T671-G674 PolarHBondContact O-N 3.18Å; T671-G674 VanDerWaalsContact O-N 3.14Å; A672-G674 PolarHBondContact O-N 3.22Å; G674-F678 WeakPolarHBondContact O-CB 3.5Å; G674-F678 PolarHBondContact O-N 3.46Å
675	F	93.8	Very high	91.5	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-79.5	-30.1	176.7	-68.7	-83.5	0	0	0	113.1	A638 C642 G643 A672 L673 F678 I709 L799 L814 L815	A638-F675 HydrophobicContact CB-CB 4Å; A638-F675 HydrophobicContact CB-CD2 4.22Å; A638-F675 HydrophobicContact CB-CG 4.34Å; C642-F675 CarbonylContact C-O 3.57Å; C642-F675 WeakPolarHBondContact CA-O 3.32Å; G643-F675 PolarHBondContact N-O 3.32Å; A672-F675 PolarHBondContact O-N 2.91Å; L673-F675 VanDerWaalsContact C-N 3.31Å; L673-F675 PolarHBondContact O-N 3.28Å; F675-F678 WeakPolarHBondContact O-CD1 3.21Å; F675-F678 WeakPolarHBondContact O-CE1 3.37Å; F675-I709 HydrophobicContact CD1-CG2 4.32Å; F675-I709 HydrophobicContact CD2-CD1 4.48Å; F675-I709 HydrophobicContact CD2-CG2 4.47Å; F675-I709 HydrophobicContact CE1-CG2 4.26Å; F675-I709 HydrophobicContact CE2-CD1 3.72Å; F675-I709 HydrophobicContact CE2-CG2 4.42Å; F675-I709 HydrophobicContact CG-CG2 4.43Å; F675-I709 HydrophobicContact CZ-CD1 3.94Å; F675-I709 HydrophobicContact CZ-CG2 4.32Å; F675-L799 HydrophobicContact CD1-CD2 3.8Å; F675-L799 HydrophobicContact CE1-CD2 4.12Å; F675-L814 HydrophobicContact CE1-CB 3.99Å; F675-L814 HydrophobicContact CZ-CB 3.93Å; F675-L815 HydrophobicContact CE2-CD1 4.49Å; F675-L815 HydrophobicContact CZ-CB 4.34Å
676	V	92.3	Very high	91.3	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-74.4	-36.7	175.5	179.4	0	0	0	0	111.3	G643 G645 A649 V650 L653 A672 L673	G643-V676 WeakPolarHBondContact CA-O 3.46Å; G645-V676 PolarHBondContact N-O 3.01Å; A649-V676 HydrophobicContact CB-CG1 4.49Å; V650-V676 HydrophobicContact CG2-CG1 4.03Å; L653-V676 HydrophobicContact CD1-CG2 3.99Å; A672-V676 PolarHBondContact O-N 3.25Å; A672-V676 VanDerWaalsContact O-N 3.09Å; L673-V676 PolarHBondContact O-N 3.25Å
677	L	90.3	Very high	91	Very high	12 Å²	12	28.9 Å²	28.9	6%	0.063	15%	0.148	C	C	.	.	H	α-helix	trans	-106.9	2.3	-167.3	-64.3	170.4	0	0	0	116.3	V650 L673 K679 N680 V684 L687	V650-L677 HydrophobicContact CG2-CD1 4.33Å; V650-L677 HydrophobicContact CG2-CD2 4.2Å; V650-L677 HydrophobicContact CG2-CG 4.34Å; L673-L677 WeakPolarHBondContact O-CB 3.44Å; L673-L677 PolarHBondContact O-N 2.99Å; L677-K679 PolarHBondContact O-N 3.43Å; L677-N680 CarbonylContact O-C 3.59Å; L677-N680 PolarHBondContact O-N 3.15Å; L677-V684 HydrophobicContact CB-CG2 3.51Å; L677-V684 HydrophobicContact CD1-CG2 4.07Å; L677-V684 HydrophobicContact CG-CG2 4.44Å; L677-L687 HydrophobicContact CD1-CD2 3.94Å
678	F	89.8	Confident	90.7	Very high	7 Å²	7	28.8 Å²	28.8	3%	0.031	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-10.3	-177.7	74.9	-96.1	0	0	0	116.1	G643 G674 F675 L799 Q800 A806	G643-F678 VanDerWaalsContact N-CE1 3.27Å; G674-F678 WeakPolarHBondContact O-CB 3.5Å; G674-F678 PolarHBondContact O-N 3.46Å; F675-F678 WeakPolarHBondContact O-CD1 3.21Å; F675-F678 WeakPolarHBondContact O-CE1 3.37Å; F678-L799 HydrophobicContact CB-CD2 4.45Å; F678-L799 HydrophobicContact CD1-CB 4.05Å; F678-L799 HydrophobicContact CD1-CD2 3.74Å; F678-L799 HydrophobicContact CD2-CB 3.59Å; F678-L799 HydrophobicContact CE1-CB 4.12Å; F678-L799 HydrophobicContact CE1-CD2 4.12Å; F678-L799 HydrophobicContact CE2-CB 3.68Å; F678-L799 WeakPolarHBondContact CE2-O 3.49Å; F678-L799 HydrophobicContact CG-CB 3.81Å; F678-L799 HydrophobicContact CG-CD2 4.06Å; F678-L799 HydrophobicContact CG-CG 4.44Å; F678-L799 HydrophobicContact CZ-CB 3.95Å; F678-Q800 HydrophobicContact CD2-CG 3.8Å; F678-Q800 HydrophobicContact CE2-CG 3.64Å; F678-Q800 PolarHBondContact O-NE2 2.88Å; F678-A806 HydrophobicContact CZ-CB 3.96Å
679	K	86.1	Confident	90.6	Very high	99 Å²	99	30.6 Å²	30.6	43%	0.43	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-32	168.8	-76.3	-167.4	-173.9	151.1	0	112.7	G643 L677 P681	G643-K679 WeakPolarHBondContact O-CD 3.33Å; G643-K679 WeakPolarHBondContact O-CE 3.39Å; G643-K679 PolarHBondContact O-NZ 3.04Å; L677-K679 PolarHBondContact O-N 3.43Å; K679-P681 VanDerWaalsContact O-CD 3.23Å; K679-P681 WeakPolarHBondContact O-CD 3.46Å
680	N	86.7	Confident	90.3	Very high	76 Å²	76	37 Å²	37	41%	0.406	20%	0.195	S	C	.	.	S	Bend	trans	-117.9	64.4	-178.8	-59.8	-7.2	0	0	0	110	L677 E682 Q683	L677-N680 CarbonylContact O-C 3.59Å; L677-N680 PolarHBondContact O-N 3.15Å; N680-E682 PolarHBondContact O-N 2.92Å; N680-Q683 HydrophobicContact CB-CB 4.44Å; N680-Q683 HydrophobicContact CB-CG 4.19Å; N680-Q683 VanDerWaalsContact CB-OE1 3.23Å; N680-Q683 PolarHBondContact ND2-OE1 3.2Å; N680-Q683 PolarHBondContact O-N 3.18Å
681	P	85.7	Confident	90.1	Very high	22 Å²	22	38.2 Å²	38.2	14%	0.143	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-21.4	-172	26.7	-36.6	0	0	0	113.8	K679 Q683 V684 P685 C711 T714 L716	K679-P681 VanDerWaalsContact O-CD 3.23Å; K679-P681 WeakPolarHBondContact O-CD 3.46Å; P681-Q683 VanDerWaalsContact C-N 3.28Å; P681-Q683 PolarHBondContact O-N 3.46Å; P681-V684 PolarHBondContact O-N 3.09Å; P681-P685 WeakPolarHBondContact O-CD 3.35Å; P681-C711 PolarHBondContact O-SG 3.46Å; P681-T714 HydrophobicContact CB-CG2 4.38Å; P681-T714 HydrophobicContact CG-CG2 4.22Å; P681-L716 HydrophobicContact CB-CD1 4.16Å
682	E	89	Confident	89.9	Confident	142 Å²	142	38.7 Å²	38.7	66%	0.664	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-24	176	-65.3	166.5	-173.9	0	0	112.9	N680 L716	N680-E682 PolarHBondContact O-N 2.92Å; E682-L716 HydrophobicContact CG-CD1 4.14Å; E682-L716 HydrophobicContact CG-CD2 4.24Å
683	Q	89.1	Confident	89.7	Confident	103 Å²	103	46.3 Å²	46.3	48%	0.481	24%	0.239	S	C	.	.	H	α-helix	trans	-84.4	-15.4	179.5	-66	176.8	-28.4	0	0	113.3	N680 P681 S686 L687	N680-Q683 HydrophobicContact CB-CB 4.44Å; N680-Q683 HydrophobicContact CB-CG 4.19Å; N680-Q683 VanDerWaalsContact CB-OE1 3.23Å; N680-Q683 PolarHBondContact ND2-OE1 3.2Å; N680-Q683 PolarHBondContact O-N 3.18Å; P681-Q683 VanDerWaalsContact C-N 3.28Å; P681-Q683 PolarHBondContact O-N 3.46Å; Q683-S686 PolarHBondContact O-OG 3.49Å; Q683-L687 WeakPolarHBondContact O-CB 3.06Å; Q683-L687 PolarHBondContact O-N 3.44Å
684	V	89.8	Confident	89.5	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-77.5	-47	-175.9	-178.1	0	0	0	0	112.4	L677 P681 S686 L687 V688 V707 A710	L677-V684 HydrophobicContact CB-CG2 3.51Å; L677-V684 HydrophobicContact CD1-CG2 4.07Å; L677-V684 HydrophobicContact CG-CG2 4.44Å; P681-V684 PolarHBondContact O-N 3.09Å; V684-S686 VanDerWaalsContact C-N 3.34Å; V684-S686 PolarHBondContact O-N 3.17Å; V684-L687 PolarHBondContact O-N 3Å; V684-V688 HydrophobicContact CG1-CG2 3.88Å; V684-V688 WeakPolarHBondContact O-CB 3.4Å; V684-V688 WeakPolarHBondContact O-CG2 3.46Å; V684-V688 PolarHBondContact O-N 2.92Å; V684-V707 HydrophobicContact CG1-CG2 4.26Å; V684-A710 HydrophobicContact CB-CB 4.08Å; V684-A710 HydrophobicContact CG1-CB 4.11Å; V684-A710 HydrophobicContact CG2-CB 3.7Å
685	P	90.3	Very high	89.4	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.013	28%	0.282	C	S	.	.	H	α-helix	trans	-54.9	-44.4	175.7	-29	36.8	0	0	0	113.7	P681 V688 S689 E718 A719 L722	P681-P685 WeakPolarHBondContact O-CD 3.35Å; P685-V688 PolarHBondContact O-N 3.38Å; P685-S689 WeakPolarHBondContact O-CB 3.5Å; P685-S689 PolarHBondContact O-N 3.02Å; P685-E718 HydrophobicContact CB-CB 4.18Å; P685-A719 HydrophobicContact CG-CB 4.11Å; P685-L722 HydrophobicContact CB-CD1 3.85Å; P685-L722 WeakPolarHBondContact O-CD1 3.5Å
686	S	89.2	Confident	89.4	Confident	78 Å²	78	58 Å²	58	55%	0.545	29%	0.29	S	S	.	.	H	α-helix	trans	-68.8	-42.9	-178.2	49	0	0	0	0	112.6	Q683 V684	Q683-S686 PolarHBondContact O-OG 3.49Å; V684-S686 VanDerWaalsContact C-N 3.34Å; V684-S686 PolarHBondContact O-N 3.17Å
687	L	88.7	Confident	89.4	Confident	57 Å²	57	59.8 Å²	59.8	30%	0.298	30%	0.301	S	S	.	.	H	α-helix	trans	-64.5	-39.9	174.1	-176.7	63.6	0	0	0	112.5	V650 L654 L673 L677 Q683 V684	V650-L687 HydrophobicContact CG1-CD2 4.14Å; L654-L687 HydrophobicContact CD1-CD1 4.06Å; L673-L687 HydrophobicContact CD1-CD2 4.27Å; L673-L687 HydrophobicContact CD2-CD2 4.43Å; L677-L687 HydrophobicContact CD1-CD2 3.94Å; Q683-L687 WeakPolarHBondContact O-CB 3.06Å; Q683-L687 PolarHBondContact O-N 3.44Å; V684-L687 PolarHBondContact O-N 3Å
688	V	88.6	Confident	89.5	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-85.4	-18.4	-172	174.6	0	0	0	0	112.8	V684 P685 L690 L691 V692 A703 V707	V684-V688 HydrophobicContact CG1-CG2 3.88Å; V684-V688 WeakPolarHBondContact O-CB 3.4Å; V684-V688 WeakPolarHBondContact O-CG2 3.46Å; V684-V688 PolarHBondContact O-N 2.92Å; P685-V688 PolarHBondContact O-N 3.38Å; V688-L690 VanDerWaalsContact C-N 3.26Å; V688-L690 PolarHBondContact O-N 2.9Å; V688-L690 VanDerWaalsContact O-N 3.17Å; V688-L691 WeakPolarHBondContact O-CA 3.21Å; V688-L691 WeakPolarHBondContact O-CB 3.39Å; V688-L691 PolarHBondContact O-N 2.95Å; V688-V692 HydrophobicContact CG1-CG2 4.17Å; V688-V692 PolarHBondContact O-N 3.25Å; V688-A703 HydrophobicContact CG1-CB 3.34Å; V688-V707 HydrophobicContact CB-CG2 4.33Å; V688-V707 HydrophobicContact CG1-CG2 4.07Å
689	S	90.6	Very high	89.7	Confident	41 Å²	41	61.1 Å²	61.1	29%	0.287	31%	0.307	S	S	.	.	H	α-helix	trans	-52.9	-39.6	-179.7	-164.8	0	0	0	0	113.5	P685 L691 V692	P685-S689 WeakPolarHBondContact O-CB 3.5Å; P685-S689 PolarHBondContact O-N 3.02Å; S689-L691 VanDerWaalsContact C-N 3.27Å; S689-L691 PolarHBondContact O-N 3.14Å; S689-V692 WeakPolarHBondContact O-CB 3.29Å; S689-V692 PolarHBondContact O-N 3.43Å
690	L	88.9	Confident	90.1	Very high	136 Å²	136	58.6 Å²	58.6	71%	0.712	30%	0.295	S	S	*	.	H	α-helix	trans	-67	-26.8	177	-67	166.8	0	0	0	113	V688	V688-L690 VanDerWaalsContact C-N 3.26Å; V688-L690 PolarHBondContact O-N 2.9Å; V688-L690 VanDerWaalsContact O-N 3.17Å
691	L	89.6	Confident	90.4	Very high	24 Å²	24	55 Å²	55	13%	0.126	28%	0.276	C	S	.	.	H	α-helix	trans	-84.5	-26.3	178.3	-56.3	174.3	0	0	0	111.8	L654 V670 V688 S689 E693 S694 A703	L654-L691 HydrophobicContact CD2-CD1 4.46Å; V670-L691 HydrophobicContact CG1-CD1 3.76Å; V670-L691 HydrophobicContact CG2-CD1 3.92Å; V688-L691 WeakPolarHBondContact O-CA 3.21Å; V688-L691 WeakPolarHBondContact O-CB 3.39Å; V688-L691 PolarHBondContact O-N 2.95Å; S689-L691 VanDerWaalsContact C-N 3.27Å; S689-L691 PolarHBondContact O-N 3.14Å; L691-E693 VanDerWaalsContact C-N 3.27Å; L691-E693 PolarHBondContact O-N 3.19Å; L691-S694 WeakPolarHBondContact O-CB 3.46Å; L691-S694 PolarHBondContact O-N 2.98Å; L691-S694 PolarHBondContact O-OG 3.4Å; L691-A703 HydrophobicContact CB-CB 4.36Å
692	V	90	Very high	90.8	Very high	12 Å²	12	54 Å²	54	7%	0.073	27%	0.269	C	S	.	.	H	α-helix	trans	-63	-33.5	172.6	172.1	0	0	0	0	111.7	V688 S689 S694 R700 A703 L726	V688-V692 HydrophobicContact CG1-CG2 4.17Å; V688-V692 PolarHBondContact O-N 3.25Å; S689-V692 WeakPolarHBondContact O-CB 3.29Å; S689-V692 PolarHBondContact O-N 3.43Å; V692-S694 VanDerWaalsContact C-N 3.34Å; V692-R700 WeakPolarHBondContact O-CD 3.24Å; V692-R700 WeakPolarHBondContact O-CG 3.2Å; V692-A703 HydrophobicContact CG2-CB 4.02Å; V692-L726 HydrophobicContact CG1-CD1 4.27Å; V692-L726 HydrophobicContact CG1-CD2 3.91Å; V692-L726 HydrophobicContact CG1-CG 3.92Å; V692-L726 HydrophobicContact CG2-CD1 4.23Å
693	E	89.4	Confident	91	Very high	160 Å²	160	47.2 Å²	47.2	75%	0.748	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-6.6	178	-62.4	-175.3	163.6	0	0	113.6	L691	L691-E693 VanDerWaalsContact C-N 3.27Å; L691-E693 PolarHBondContact O-N 3.19Å
694	S	90.2	Very high	91.3	Very high	23 Å²	23	42.3 Å²	42.3	16%	0.161	22%	0.215	C	C	.	.			trans	-67.4	143.7	-176.2	71.7	0	0	0	0	113.2	L691 V692 H696 L699 R700	L691-S694 WeakPolarHBondContact O-CB 3.46Å; L691-S694 PolarHBondContact O-N 2.98Å; L691-S694 PolarHBondContact O-OG 3.4Å; V692-S694 VanDerWaalsContact C-N 3.34Å; S694-H696 VanDerWaalsContact C-N 3.35Å; S694-H696 PolarHBondContact O-N 2.89Å; S694-L699 WeakPolarHBondContact OG-CB 3.2Å; S694-R700 WeakPolarHBondContact O-CD 3.47Å; S694-R700 WeakPolarHBondContact O-CG 3.35Å; S694-R700 PolarHBondContact O-NE 2.95Å
695	Y	90.3	Very high	91.5	Very high	187 Å²	187	42.3 Å²	42.3	73%	0.733	22%	0.215	S	C	*	.	S	Bend	trans	-64.2	-38.9	-178.4	67.3	-88.7	0	0	0	112.5	P697 R700	Y695-P697 VanDerWaalsContact O-CD 3.28Å; Y695-P697 WeakPolarHBondContact O-CD 3.42Å; Y695-R700 PolarHBondContact O-NH2 3.41Å
696	H	91.9	Very high	91.7	Very high	37 Å²	37	42.2 Å²	42.2	17%	0.171	21%	0.214	C	C	.	.			trans	-57.2	116.3	178.1	-77.1	-83.3	0	0	0	112.3	D663 R666 S694 H698 L699 R700	D663-H696 IonicContact OD1-ND1 2.67Å; R666-H696 PolarHBondContact NH1-CD2 3.41Å; R666-H696 VanDerWaalsContact NH1-CD2 3.33Å; R666-H696 PolarHBondContact NH1-CE1 3.44Å; R666-H696 PolarHBondContact NH1-NE2 3.48Å; S694-H696 VanDerWaalsContact C-N 3.35Å; S694-H696 PolarHBondContact O-N 2.89Å; H696-H698 VanDerWaalsContact C-N 3.25Å; H696-H698 PolarHBondContact O-N 3.41Å; H696-L699 HydrophobicContact CB-CB 4.17Å; H696-L699 HydrophobicContact CB-CD1 4Å; H696-L699 HydrophobicContact CB-CG 3.98Å; H696-L699 PolarHBondContact O-N 3.34Å; H696-R700 PolarHBondContact O-N 3.07Å
697	P	92.7	Very high	91.9	Very high	37 Å²	37	38.6 Å²	38.6	24%	0.24	19%	0.189	C	C	.	.	H	α-helix	trans	-63.9	-29.3	178.2	-23	35	0	0	0	113.5	Y695 R700 Y701 V731 F733 V734	Y695-P697 VanDerWaalsContact O-CD 3.28Å; Y695-P697 WeakPolarHBondContact O-CD 3.42Å; P697-R700 PolarHBondContact O-N 3.48Å; P697-Y701 PolarHBondContact O-N 3.2Å; P697-V731 HydrophobicContact CB-CB 4.46Å; P697-V731 HydrophobicContact CB-CG1 4.03Å; P697-V731 HydrophobicContact CB-CG2 4.21Å; P697-V731 HydrophobicContact CG-CG2 4.11Å; P697-F733 HydrophobicContact CB-CE2 3.82Å; P697-F733 HydrophobicContact CB-CZ 3.64Å; P697-V734 HydrophobicContact CB-CG2 3.89Å; P697-V734 WeakPolarHBondContact O-CG2 3.16Å
698	H	93.6	Very high	92.1	Very high	36 Å²	36	35.9 Å²	35.9	17%	0.167	17%	0.174	C	C	.	.	H	α-helix	trans	-69.1	-37.7	179.7	-70.9	-98	0	0	0	112.7	D663 R667 H696 Y701 G702 F733	D663-H698 HydrophobicContact CB-CB 4.06Å; D663-H698 WeakPolarHBondContact OD1-CB 3.31Å; D663-H698 IonicContact OD1-CD2 3.47Å; D663-H698 PolarHBondContact OD1-CD2 2.89Å; D663-H698 IonicContact OD1-CG 3.41Å; R667-H698 HydrophobicContact CB-CB 4.27Å; H696-H698 VanDerWaalsContact C-N 3.25Å; H696-H698 PolarHBondContact O-N 3.41Å; H698-Y701 PolarHBondContact O-N 3.44Å; H698-G702 PolarHBondContact O-N 3.42Å; H698-F733 AromaticContact NE2-CZ 3.67Å
699	L	93.4	Very high	92.3	Very high	11 Å²	11	35.9 Å²	35.9	6%	0.058	18%	0.175	C	C	.	.	H	α-helix	trans	-65.6	-42.9	170.5	-67.6	-179.8	0	0	0	111.1	A657 R666 V670 S694 H696 Y701 G702 A703	A657-L699 HydrophobicContact CB-CD2 4.19Å; R666-L699 HydrophobicContact CB-CD2 3.86Å; R666-L699 HydrophobicContact CG-CD2 4.5Å; V670-L699 HydrophobicContact CG2-CD2 3.59Å; S694-L699 WeakPolarHBondContact OG-CB 3.2Å; H696-L699 HydrophobicContact CB-CB 4.17Å; H696-L699 HydrophobicContact CB-CD1 4Å; H696-L699 HydrophobicContact CB-CG 3.98Å; H696-L699 PolarHBondContact O-N 3.34Å; L699-Y701 PolarHBondContact O-N 3.31Å; L699-G702 PolarHBondContact O-N 3.02Å; L699-A703 VanDerWaalsContact O-CB 3.28Å; L699-A703 WeakPolarHBondContact O-CB 3.43Å; L699-A703 PolarHBondContact O-N 2.7Å
700	R	93.8	Very high	92.4	Very high	46 Å²	46	34.2 Å²	34.2	17%	0.174	16%	0.163	C	C	.	.	H	α-helix	trans	-64.2	-35.4	176	-72	-172.5	-78.8	155.8	-7.6	113.7	V692 S694 Y695 H696 P697 A704 L726 V734	V692-R700 WeakPolarHBondContact O-CD 3.24Å; V692-R700 WeakPolarHBondContact O-CG 3.2Å; S694-R700 WeakPolarHBondContact O-CD 3.47Å; S694-R700 WeakPolarHBondContact O-CG 3.35Å; S694-R700 PolarHBondContact O-NE 2.95Å; Y695-R700 PolarHBondContact O-NH2 3.41Å; H696-R700 PolarHBondContact O-N 3.07Å; P697-R700 PolarHBondContact O-N 3.48Å; R700-A704 PolarHBondContact O-N 2.98Å; R700-A704 VanDerWaalsContact O-N 3.11Å; R700-L726 HydrophobicContact CB-CD2 4.08Å; R700-L726 HydrophobicContact CG-CD2 4.36Å; R700-V734 HydrophobicContact CB-CG1 4.06Å; R700-V734 HydrophobicContact CB-CG2 4.49Å
701	Y	94.5	Very high	92.4	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.008	13%	0.129	C	C	.	.	H	α-helix	trans	-67.9	-46.7	170.9	178.1	-88.9	0	0	0	111.8	R667 P697 H698 L699 A703 A704 M705 F733 G737 F820 W821	R667-Y701 HydrophobicContact CG-CD1 3.88Å; R667-Y701 HydrophobicContact CG-CE1 4.41Å; P697-Y701 PolarHBondContact O-N 3.2Å; H698-Y701 PolarHBondContact O-N 3.44Å; L699-Y701 PolarHBondContact O-N 3.31Å; Y701-A703 VanDerWaalsContact C-N 3.25Å; Y701-A703 PolarHBondContact O-N 2.92Å; Y701-A704 WeakPolarHBondContact O-CB 3.45Å; Y701-A704 PolarHBondContact O-N 3.01Å; Y701-M705 HydrophobicContact CD1-CG 4.16Å; Y701-M705 HydrophobicContact CE1-CG 3.61Å; Y701-M705 HydrophobicContact CE2-CG 4.16Å; Y701-M705 HydrophobicContact CE2-SD 4.46Å; Y701-M705 PolarHBondContact O-N 3.21Å; Y701-F733 HydrophobicContact CD2-CD2 4.44Å; Y701-F733 VanDerWaalsContact CD2-O 3.24Å; Y701-F733 WeakPolarHBondContact CD2-O 3.26Å; Y701-G737 VanDerWaalsContact CE2-CA 3.41Å; Y701-F820 WeakPolarHBondContact OH-CZ 3.37Å; Y701-W821 AromaticContact CD1-CZ2 3.79Å; Y701-W821 HydrophobicContact CD1-CZ2 3.79Å; Y701-W821 AromaticContact CD2-CZ2 3.75Å; Y701-W821 HydrophobicContact CD2-CZ2 3.75Å; Y701-W821 AromaticContact CE1-CE2 3.99Å; Y701-W821 AromaticContact CE1-CZ2 3.73Å; Y701-W821 HydrophobicContact CE1-CZ2 3.73Å; Y701-W821 AromaticContact CE1-NE1 3.75Å; Y701-W821 AromaticContact CE2-CZ2 3.66Å; Y701-W821 HydrophobicContact CE2-CZ2 3.66Å; Y701-W821 AromaticContact CE2-NE1 3.82Å; Y701-W821 AromaticContact CG-CZ2 3.81Å; Y701-W821 HydrophobicContact CG-CZ2 3.81Å; Y701-W821 AromaticContact CZ-CE2 3.75Å; Y701-W821 AromaticContact CZ-CZ2 3.66Å; Y701-W821 AromaticContact CZ-NE1 3.25Å; Y701-W821 VanDerWaalsContact CZ-NE1 3.25Å; Y701-W821 PolarHBondContact OH-NE1 3.08Å
702	G	93.4	Very high	92.4	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-58.9	-38.8	176.3	0	0	0	0	0	112.2	T671 H698 L699 M705 A706	T671-G702 WeakPolarHBondContact OG1-CA 3.37Å; H698-G702 PolarHBondContact O-N 3.42Å; L699-G702 PolarHBondContact O-N 3.02Å; G702-M705 PolarHBondContact O-N 3.15Å; G702-A706 VanDerWaalsContact O-CB 3.31Å; G702-A706 WeakPolarHBondContact O-CB 3.45Å; G702-A706 PolarHBondContact O-N 3.47Å
703	A	93.9	Very high	92.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.1	-48.9	173.4	0	0	0	0	0	112.4	V670 V688 L691 V692 L699 Y701 M705 A706 V707	V670-A703 HydrophobicContact CG1-CB 4.29Å; V688-A703 HydrophobicContact CG1-CB 3.34Å; L691-A703 HydrophobicContact CB-CB 4.36Å; V692-A703 HydrophobicContact CG2-CB 4.02Å; L699-A703 VanDerWaalsContact O-CB 3.28Å; L699-A703 WeakPolarHBondContact O-CB 3.43Å; L699-A703 PolarHBondContact O-N 2.7Å; Y701-A703 VanDerWaalsContact C-N 3.25Å; Y701-A703 PolarHBondContact O-N 2.92Å; A703-M705 VanDerWaalsContact C-N 3.33Å; A703-M705 PolarHBondContact O-N 3.45Å; A703-A706 PolarHBondContact O-N 3.34Å; A703-V707 WeakPolarHBondContact O-CG2 3.47Å; A703-V707 PolarHBondContact O-N 3.03Å; A703-V707 VanDerWaalsContact O-N 3.16Å
704	A	94.7	Very high	91.8	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-55.7	-48.3	175.3	0	0	0	0	0	111.6	R700 Y701 V707 G708 L723 L726 A741	R700-A704 PolarHBondContact O-N 2.98Å; R700-A704 VanDerWaalsContact O-N 3.11Å; Y701-A704 WeakPolarHBondContact O-CB 3.45Å; Y701-A704 PolarHBondContact O-N 3.01Å; A704-V707 PolarHBondContact O-N 3.18Å; A704-G708 PolarHBondContact O-N 3.01Å; A704-L723 HydrophobicContact CB-CD2 3.96Å; A704-L726 HydrophobicContact CB-CD1 3.86Å; A704-A741 HydrophobicContact CB-CB 4.5Å; A704-A741 WeakPolarHBondContact O-CB 3.48Å
705	M	94.2	Very high	91.4	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-73.9	-34	-175.6	-61.1	-49.4	-60.9	0	0	113.1	T671 Y701 G702 A703 V707 G708 I709 I740 A741 M744 F817	T671-M705 HydrophobicContact CG2-CB 4.28Å; Y701-M705 HydrophobicContact CD1-CG 4.16Å; Y701-M705 HydrophobicContact CE1-CG 3.61Å; Y701-M705 HydrophobicContact CE2-CG 4.16Å; Y701-M705 HydrophobicContact CE2-SD 4.46Å; Y701-M705 PolarHBondContact O-N 3.21Å; G702-M705 PolarHBondContact O-N 3.15Å; A703-M705 VanDerWaalsContact C-N 3.33Å; A703-M705 PolarHBondContact O-N 3.45Å; M705-V707 VanDerWaalsContact C-N 3.35Å; M705-V707 PolarHBondContact O-N 3.28Å; M705-G708 PolarHBondContact O-N 3.26Å; M705-I709 WeakPolarHBondContact O-CB 3.48Å; M705-I709 WeakPolarHBondContact O-CD1 3.44Å; M705-I709 VanDerWaalsContact O-CG1 3.25Å; M705-I709 WeakPolarHBondContact O-CG1 3.5Å; M705-I709 PolarHBondContact O-N 2.96Å; M705-I740 HydrophobicContact CE-CG2 3.99Å; M705-A741 HydrophobicContact SD-CB 4.2Å; M705-M744 HydrophobicContact CE-CE 4.42Å; M705-M744 HydrophobicContact CE-SD 4.47Å; M705-F817 HydrophobicContact CE-CE1 4.44Å
706	A	94.2	Very high	91.2	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-59.6	-45.2	172.3	0	0	0	0	0	111.6	V670 G702 A703 A710	V670-A706 WeakPolarHBondContact O-CB 3.35Å; G702-A706 VanDerWaalsContact O-CB 3.31Å; G702-A706 WeakPolarHBondContact O-CB 3.45Å; G702-A706 PolarHBondContact O-N 3.47Å; A703-A706 PolarHBondContact O-N 3.34Å; A706-A710 WeakPolarHBondContact O-CB 3.26Å; A706-A710 PolarHBondContact O-N 3.01Å
707	V	93.9	Very high	91.1	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.006	12%	0.124	C	C	.	.	H	α-helix	trans	-65.6	-43.2	174.5	174.8	0	0	0	0	111	V684 V688 A703 A704 M705 I709 C711 A719 L723	V684-V707 HydrophobicContact CG1-CG2 4.26Å; V688-V707 HydrophobicContact CB-CG2 4.33Å; V688-V707 HydrophobicContact CG1-CG2 4.07Å; A703-V707 WeakPolarHBondContact O-CG2 3.47Å; A703-V707 PolarHBondContact O-N 3.03Å; A703-V707 VanDerWaalsContact O-N 3.16Å; A704-V707 PolarHBondContact O-N 3.18Å; M705-V707 VanDerWaalsContact C-N 3.35Å; M705-V707 PolarHBondContact O-N 3.28Å; V707-I709 PolarHBondContact O-N 2.57Å; V707-C711 WeakPolarHBondContact O-CB 3.3Å; V707-C711 PolarHBondContact O-N 2.8Å; V707-A719 HydrophobicContact CG1-CB 3.54Å; V707-L723 HydrophobicContact CG1-CD1 4.02Å; V707-L723 HydrophobicContact CG1-CG 4.23Å
708	G	92.5	Very high	90.9	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.2	-40.1	177.6	0	0	0	0	0	114.1	A704 M705 A712 M744	A704-G708 PolarHBondContact O-N 3.01Å; M705-G708 PolarHBondContact O-N 3.26Å; G708-A712 PolarHBondContact O-N 3.4Å; G708-M744 WeakPolarHBondContact O-CB 3.22Å
709	I	93.2	Very high	90.8	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-75.3	-47.6	-180	-69.7	165.8	0	0	0	111.1	T671 F675 M705 V707 L799 L814 Q818	T671-I709 HydrophobicContact CG2-CD1 4.05Å; F675-I709 HydrophobicContact CD1-CG2 4.32Å; F675-I709 HydrophobicContact CD2-CD1 4.48Å; F675-I709 HydrophobicContact CD2-CG2 4.47Å; F675-I709 HydrophobicContact CE1-CG2 4.26Å; F675-I709 HydrophobicContact CE2-CD1 3.72Å; F675-I709 HydrophobicContact CE2-CG2 4.42Å; F675-I709 HydrophobicContact CG-CG2 4.43Å; F675-I709 HydrophobicContact CZ-CD1 3.94Å; F675-I709 HydrophobicContact CZ-CG2 4.32Å; M705-I709 WeakPolarHBondContact O-CB 3.48Å; M705-I709 WeakPolarHBondContact O-CD1 3.44Å; M705-I709 VanDerWaalsContact O-CG1 3.25Å; M705-I709 WeakPolarHBondContact O-CG1 3.5Å; M705-I709 PolarHBondContact O-N 2.96Å; V707-I709 PolarHBondContact O-N 2.57Å; I709-L799 HydrophobicContact CG2-CD1 4.16Å; I709-L799 HydrophobicContact CG2-CD2 3.97Å; I709-L799 WeakPolarHBondContact O-CD1 3.28Å; I709-L814 HydrophobicContact CG2-CD1 4.35Å; I709-Q818 HydrophobicContact CD1-CG 4.18Å
710	A	91.5	Very high	90.7	Very high	6 Å²	6	25.1 Å²	25.1	5%	0.05	13%	0.131	C	C	.	.	H	α-helix	trans	-70.4	-42.3	-178.6	0	0	0	0	0	112.9	V684 A706 A712	V684-A710 HydrophobicContact CB-CB 4.08Å; V684-A710 HydrophobicContact CG1-CB 4.11Å; V684-A710 HydrophobicContact CG2-CB 3.7Å; A706-A710 WeakPolarHBondContact O-CB 3.26Å; A706-A710 PolarHBondContact O-N 3.01Å; A710-A712 VanDerWaalsContact C-N 3.32Å; A710-A712 PolarHBondContact O-N 3.49Å
711	C	90.4	Very high	90.5	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	17.2	-175	-58.6	0	0	0	0	113.3	P681 V707 G713 T714 A719 V745	P681-C711 PolarHBondContact O-SG 3.46Å; V707-C711 WeakPolarHBondContact O-CB 3.3Å; V707-C711 PolarHBondContact O-N 2.8Å; C711-G713 PolarHBondContact O-N 3.03Å; C711-T714 PolarHBondContact O-N 3Å; C711-T714 VanDerWaalsContact O-N 3.09Å; C711-T714 PolarHBondContact O-OG1 2.62Å; C711-A719 HydrophobicContact CB-CB 4.12Å; C711-V745 HydrophobicContact CB-CG2 3.85Å
712	A	89.6	Confident	90.4	Very high	11 Å²	11	27 Å²	27	9%	0.091	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	119.6	179.9	0	0	0	0	0	111.8	G708 A710 T714 M744 I797	G708-A712 PolarHBondContact O-N 3.4Å; A710-A712 VanDerWaalsContact C-N 3.32Å; A710-A712 PolarHBondContact O-N 3.49Å; A712-T714 PolarHBondContact O-N 2.63Å; A712-M744 WeakPolarHBondContact CA-O 3.45Å; A712-I797 HydrophobicContact CB-CB 4.15Å; A712-I797 HydrophobicContact CB-CG2 3.79Å
713	G	82.1	Confident	90.3	Very high	24 Å²	24	27 Å²	27	25%	0.247	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.4	3.1	-178.6	0	0	0	0	0	116.8	C711 M744 Q749	C711-G713 PolarHBondContact O-N 3.03Å; G713-M744 PolarHBondContact N-O 2.93Å; G713-Q749 PolarHBondContact O-NE2 3.21Å
714	T	83.4	Confident	90.1	Very high	60 Å²	60	28.6 Å²	28.6	37%	0.368	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-24	-179.8	68.9	0	0	0	0	113.4	P681 C711 A712 L716	P681-T714 HydrophobicContact CB-CG2 4.38Å; P681-T714 HydrophobicContact CG-CG2 4.22Å; C711-T714 PolarHBondContact O-N 3Å; C711-T714 VanDerWaalsContact O-N 3.09Å; C711-T714 PolarHBondContact O-OG1 2.62Å; A712-T714 PolarHBondContact O-N 2.63Å; T714-L716 VanDerWaalsContact C-N 3.26Å; T714-L716 PolarHBondContact O-N 3.36Å
715	A	82	Confident	89.8	Confident	21 Å²	21	32.9 Å²	32.9	17%	0.174	18%	0.183	C	C	.	.			trans	55.4	31.6	-177.6	0	0	0	0	0	115.4	K717 V745 Q749	A715-K717 PolarHBondContact O-N 2.98Å; A715-V745 PolarHBondContact N-O 3.4Å; A715-Q749 HydrophobicContact CB-CG 3.84Å
716	L	87.3	Confident	89.6	Confident	42 Å²	42	33.2 Å²	33.2	22%	0.22	19%	0.185	C	C	.	.			trans	-57.2	128.4	175.7	-73.3	172.8	0	0	0	111.7	P681 E682 T714 E718 A719 V720	P681-L716 HydrophobicContact CB-CD1 4.16Å; E682-L716 HydrophobicContact CG-CD1 4.14Å; E682-L716 HydrophobicContact CG-CD2 4.24Å; T714-L716 VanDerWaalsContact C-N 3.26Å; T714-L716 PolarHBondContact O-N 3.36Å; L716-E718 VanDerWaalsContact C-N 3.33Å; L716-E718 PolarHBondContact O-N 3.47Å; L716-A719 HydrophobicContact CB-CB 4.04Å; L716-A719 PolarHBondContact O-N 3.46Å; L716-V720 WeakPolarHBondContact O-CG2 3.4Å; L716-V720 PolarHBondContact O-N 2.93Å; L716-V720 VanDerWaalsContact O-N 3.14Å
717	K	88.5	Confident	89.2	Confident	183 Å²	183	34.3 Å²	34.3	80%	0.796	19%	0.19	S	C	*	.	H	α-helix	trans	-62.2	-39	-174.8	-66.5	178.6	-178.6	174.1	0	112.9	A715 V720 S721	A715-K717 PolarHBondContact O-N 2.98Å; K717-V720 PolarHBondContact O-N 3.12Å; K717-S721 WeakPolarHBondContact O-CB 3.32Å; K717-S721 PolarHBondContact O-N 2.82Å
718	E	89.1	Confident	88.8	Confident	126 Å²	126	41.7 Å²	41.7	59%	0.589	22%	0.224	S	C	*	.	H	α-helix	trans	-64.6	-48.8	178.3	-67.6	163.9	-159.5	0	0	111.3	P685 L716 V720 S721 L722	P685-E718 HydrophobicContact CB-CB 4.18Å; L716-E718 VanDerWaalsContact C-N 3.33Å; L716-E718 PolarHBondContact O-N 3.47Å; E718-V720 VanDerWaalsContact C-N 3.33Å; E718-V720 PolarHBondContact O-N 2.85Å; E718-S721 WeakPolarHBondContact O-CA 3.33Å; E718-S721 WeakPolarHBondContact O-CB 3.2Å; E718-S721 PolarHBondContact O-N 3.27Å; E718-L722 PolarHBondContact O-N 3.02Å
719	A	90.5	Very high	88.4	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-54.8	-47.2	175.2	0	0	0	0	0	111.8	P685 V707 C711 L716 S721 L722 L723	P685-A719 HydrophobicContact CG-CB 4.11Å; V707-A719 HydrophobicContact CG1-CB 3.54Å; C711-A719 HydrophobicContact CB-CB 4.12Å; L716-A719 HydrophobicContact CB-CB 4.04Å; L716-A719 PolarHBondContact O-N 3.46Å; A719-S721 VanDerWaalsContact C-N 3.33Å; A719-S721 PolarHBondContact O-N 3.27Å; A719-L722 PolarHBondContact O-N 2.86Å; A719-L723 WeakPolarHBondContact O-CB 3.48Å; A719-L723 VanDerWaalsContact O-CG 3.25Å; A719-L723 WeakPolarHBondContact O-CG 3.4Å; A719-L723 PolarHBondContact O-N 3.01Å; A719-L723 VanDerWaalsContact O-N 3.08Å
720	V	91	Very high	88.2	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.024	27%	0.27	C	S	.	.	H	α-helix	trans	-63.9	-38.3	175.7	178.7	0	0	0	0	111.2	L716 K717 E718 L723 E724 V745 L746 K756	L716-V720 WeakPolarHBondContact O-CG2 3.4Å; L716-V720 PolarHBondContact O-N 2.93Å; L716-V720 VanDerWaalsContact O-N 3.14Å; K717-V720 PolarHBondContact O-N 3.12Å; E718-V720 VanDerWaalsContact C-N 3.33Å; E718-V720 PolarHBondContact O-N 2.85Å; V720-L723 PolarHBondContact O-N 3.38Å; V720-E724 HydrophobicContact CG1-CG 4.48Å; V720-E724 WeakPolarHBondContact O-CG 3.46Å; V720-E724 PolarHBondContact O-N 3.32Å; V720-V745 HydrophobicContact CG2-CG1 3.81Å; V720-L746 HydrophobicContact CG2-CD2 3.97Å; V720-L746 HydrophobicContact CG2-CG 4.37Å; V720-K756 HydrophobicContact CG1-CD 3.66Å
721	S	90.9	Very high	88.2	Confident	61 Å²	61	49.5 Å²	49.5	43%	0.427	28%	0.275	S	S	.	.	H	α-helix	trans	-65.3	-43.3	178.8	-152.3	0	0	0	0	112.9	K717 E718 A719 E724 T725	K717-S721 WeakPolarHBondContact O-CB 3.32Å; K717-S721 PolarHBondContact O-N 2.82Å; E718-S721 WeakPolarHBondContact O-CA 3.33Å; E718-S721 WeakPolarHBondContact O-CB 3.2Å; E718-S721 PolarHBondContact O-N 3.27Å; A719-S721 VanDerWaalsContact C-N 3.33Å; A719-S721 PolarHBondContact O-N 3.27Å; S721-E724 PolarHBondContact O-N 3.16Å; S721-T725 PolarHBondContact O-N 3.5Å; S721-T725 PolarHBondContact O-OG1 3.01Å
722	L	91.2	Very high	88.3	Confident	26 Å²	26	51.4 Å²	51.4	14%	0.136	29%	0.287	C	S	.	.	H	α-helix	trans	-64.3	-41	175.7	-67.3	173.1	0	0	0	111.7	P685 E718 A719 E724 T725 L726	P685-L722 HydrophobicContact CB-CD1 3.85Å; P685-L722 WeakPolarHBondContact O-CD1 3.5Å; E718-L722 PolarHBondContact O-N 3.02Å; A719-L722 PolarHBondContact O-N 2.86Å; L722-E724 VanDerWaalsContact C-N 3.3Å; L722-E724 PolarHBondContact O-N 3.42Å; L722-T725 PolarHBondContact O-N 3.2Å; L722-L726 PolarHBondContact O-N 3.21Å
723	L	91.9	Very high	88.5	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-68.7	-27	176.7	-69.1	171.8	0	0	0	112.8	A704 V707 A719 V720 L726 H727 A741 N742 V745	A704-L723 HydrophobicContact CB-CD2 3.96Å; V707-L723 HydrophobicContact CG1-CD1 4.02Å; V707-L723 HydrophobicContact CG1-CG 4.23Å; A719-L723 WeakPolarHBondContact O-CB 3.48Å; A719-L723 VanDerWaalsContact O-CG 3.25Å; A719-L723 WeakPolarHBondContact O-CG 3.4Å; A719-L723 PolarHBondContact O-N 3.01Å; A719-L723 VanDerWaalsContact O-N 3.08Å; V720-L723 PolarHBondContact O-N 3.38Å; L723-L726 PolarHBondContact O-N 3.07Å; L723-H727 PolarHBondContact O-N 3.3Å; L723-A741 HydrophobicContact CD1-CB 4.1Å; L723-A741 HydrophobicContact CD2-CB 3.7Å; L723-N742 HydrophobicContact CB-CB 4.3Å; L723-N742 HydrophobicContact CD1-CB 4.15Å; L723-V745 HydrophobicContact CD1-CG2 4Å
724	E	89.7	Confident	89.1	Confident	33 Å²	33	51.7 Å²	51.7	15%	0.154	28%	0.28	C	S	.	.	H	α-helix	trans	-70.7	-42	171.1	-74.8	-170.5	120.5	0	0	112.2	V720 S721 L722 L726 H727 K756 K763	V720-E724 HydrophobicContact CG1-CG 4.48Å; V720-E724 WeakPolarHBondContact O-CG 3.46Å; V720-E724 PolarHBondContact O-N 3.32Å; S721-E724 PolarHBondContact O-N 3.16Å; L722-E724 VanDerWaalsContact C-N 3.3Å; L722-E724 PolarHBondContact O-N 3.42Å; E724-L726 PolarHBondContact O-N 3.42Å; E724-H727 PolarHBondContact O-CE1 2.92Å; E724-H727 VanDerWaalsContact O-CE1 3.24Å; E724-H727 VanDerWaalsContact O-CG 3.26Å; E724-H727 PolarHBondContact O-N 3.46Å; E724-H727 PolarHBondContact O-ND1 2.79Å; E724-H727 IonicContact OE1-NE2 3.53Å; E724-K756 WeakPolarHBondContact OE2-CD 3.29Å; E724-K756 VanDerWaalsContact OE2-CE 3.27Å; E724-K756 WeakPolarHBondContact OE2-CE 3.38Å; E724-K756 IonicContact OE2-NZ 2.93Å; E724-K756 PolarHBondContact OE2-NZ 2.91Å; E724-K763 IonicContact OE1-NZ 2.82Å; E724-K763 PolarHBondContact OE1-NZ 3.21Å
725	T	89.2	Confident	89.6	Confident	90 Å²	90	50.5 Å²	50.5	55%	0.552	27%	0.269	S	S	*	.	H	α-helix	trans	-57.8	-35	171.9	-52.4	0	0	0	0	112.1	S721 L722	S721-T725 PolarHBondContact O-N 3.5Å; S721-T725 PolarHBondContact O-OG1 3.01Å; L722-T725 PolarHBondContact O-N 3.2Å
726	L	89.8	Confident	90.1	Very high	7 Å²	7	49.9 Å²	49.9	4%	0.037	26%	0.262	C	S	.	.	H	α-helix	trans	-77.6	-25	178.5	-70.7	176.2	0	0	0	114.7	V692 R700 A704 L722 L723 E724 E728 G729 V734 A738	V692-L726 HydrophobicContact CG1-CD1 4.27Å; V692-L726 HydrophobicContact CG1-CD2 3.91Å; V692-L726 HydrophobicContact CG1-CG 3.92Å; V692-L726 HydrophobicContact CG2-CD1 4.23Å; R700-L726 HydrophobicContact CB-CD2 4.08Å; R700-L726 HydrophobicContact CG-CD2 4.36Å; A704-L726 HydrophobicContact CB-CD1 3.86Å; L722-L726 PolarHBondContact O-N 3.21Å; L723-L726 PolarHBondContact O-N 3.07Å; E724-L726 PolarHBondContact O-N 3.42Å; L726-E728 VanDerWaalsContact C-N 3.32Å; L726-G729 PolarHBondContact O-N 2.87Å; L726-V734 HydrophobicContact CD2-CG1 4.01Å; L726-A738 HydrophobicContact CB-CB 3.74Å
727	H	84.5	Confident	90.4	Very high	24 Å²	24	47.9 Å²	47.9	11%	0.111	25%	0.252	C	S	.	.	H	α-helix	trans	-74.9	-23.7	176.9	75.6	33.5	0	0	0	113.2	L723 E724 G729 R735 A738 L739 K763	L723-H727 PolarHBondContact O-N 3.3Å; E724-H727 PolarHBondContact O-CE1 2.92Å; E724-H727 VanDerWaalsContact O-CE1 3.24Å; E724-H727 VanDerWaalsContact O-CG 3.26Å; E724-H727 PolarHBondContact O-N 3.46Å; E724-H727 PolarHBondContact O-ND1 2.79Å; E724-H727 IonicContact OE1-NE2 3.53Å; H727-G729 VanDerWaalsContact C-N 3.32Å; H727-R735 PolarHBondContact O-NE 2.92Å; H727-A738 HydrophobicContact CB-CB 4.47Å; H727-L739 HydrophobicContact CB-CD2 4.48Å; H727-K763 PolarHBondContact NE2-NZ 2.94Å
728	E	85.9	Confident	90.7	Very high	155 Å²	155	39.2 Å²	39.2	72%	0.724	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-4.7	173.7	-89.7	161.4	-147.3	0	0	112.9	L726	L726-E728 VanDerWaalsContact C-N 3.32Å
729	G	85	Confident	91	Very high	17 Å²	17	33.4 Å²	33.4	18%	0.175	19%	0.187	C	C	.	.	S	Bend	trans	-66.7	152.3	174.9	0	0	0	0	0	113.3	L726 H727 V731 R735	L726-G729 PolarHBondContact O-N 2.87Å; H727-G729 VanDerWaalsContact C-N 3.32Å; G729-V731 PolarHBondContact O-N 2.91Å; G729-R735 WeakPolarHBondContact O-CD 3.37Å; G729-R735 WeakPolarHBondContact O-CG 3.27Å
730	T	87.8	Confident	91.2	Very high	128 Å²	128	33.4 Å²	33.4	79%	0.785	19%	0.187	S	C	*	.	S	Bend	trans	-77	-11.5	-175.2	51.4	0	0	0	0	115.6
731	V	93.3	Very high	91.3	Very high	27 Å²	27	33.2 Å²	33.2	16%	0.164	19%	0.186	C	C	.	.			trans	-97.3	117.8	-169.5	-176.7	0	0	0	0	111.1	P697 G729 F733 V734 R735	P697-V731 HydrophobicContact CB-CB 4.46Å; P697-V731 HydrophobicContact CB-CG1 4.03Å; P697-V731 HydrophobicContact CB-CG2 4.21Å; P697-V731 HydrophobicContact CG-CG2 4.11Å; G729-V731 PolarHBondContact O-N 2.91Å; V731-F733 HydrophobicContact CG1-CD1 3.73Å; V731-F733 HydrophobicContact CG1-CD2 4.33Å; V731-F733 HydrophobicContact CG1-CE1 3.52Å; V731-F733 HydrophobicContact CG1-CE2 4.14Å; V731-F733 HydrophobicContact CG1-CG 4.16Å; V731-F733 HydrophobicContact CG1-CZ 3.76Å; V731-F733 PolarHBondContact O-N 3.39Å; V731-V734 HydrophobicContact CB-CB 4.15Å; V731-V734 HydrophobicContact CB-CG2 3.83Å; V731-V734 HydrophobicContact CG1-CG2 3.9Å; V731-V734 WeakPolarHBondContact O-CB 3.4Å; V731-V734 PolarHBondContact O-N 3.07Å; V731-R735 WeakPolarHBondContact O-CG 3.31Å; V731-R735 PolarHBondContact O-N 3.02Å; V731-R735 VanDerWaalsContact O-N 3.09Å
732	P	91.9	Very high	91.4	Very high	39 Å²	39	30.4 Å²	30.4	25%	0.253	17%	0.166	S	C	.	.	H	α-helix	trans	-57.1	-41	-168.7	-29.4	36.2	0	0	0	115.5	R735 Q736 D774 L776	P732-R735 WeakPolarHBondContact O-CB 3.31Å; P732-R735 PolarHBondContact O-N 3.03Å; P732-Q736 PolarHBondContact O-N 3.36Å; P732-D774 HydrophobicContact CB-CB 3.87Å; P732-D774 HydrophobicContact CG-CB 4.2Å; P732-D774 VanDerWaalsContact CG-CG 3.5Å; P732-D774 WeakPolarHBondContact CG-OD1 3.3Å; P732-L776 HydrophobicContact CB-CB 4.16Å; P732-L776 HydrophobicContact CB-CD1 4.3Å
733	F	93.6	Very high	91.5	Very high	41 Å²	41	29.2 Å²	29.2	18%	0.18	16%	0.16	C	C	.	.	H	α-helix	trans	-73.7	-29.3	178.8	62.7	-103.6	0	0	0	113.1	P697 H698 Y701 V731 Q736 G737 L776 W821	P697-F733 HydrophobicContact CB-CE2 3.82Å; P697-F733 HydrophobicContact CB-CZ 3.64Å; H698-F733 AromaticContact NE2-CZ 3.67Å; Y701-F733 HydrophobicContact CD2-CD2 4.44Å; Y701-F733 VanDerWaalsContact CD2-O 3.24Å; Y701-F733 WeakPolarHBondContact CD2-O 3.26Å; V731-F733 HydrophobicContact CG1-CD1 3.73Å; V731-F733 HydrophobicContact CG1-CD2 4.33Å; V731-F733 HydrophobicContact CG1-CE1 3.52Å; V731-F733 HydrophobicContact CG1-CE2 4.14Å; V731-F733 HydrophobicContact CG1-CG 4.16Å; V731-F733 HydrophobicContact CG1-CZ 3.76Å; V731-F733 PolarHBondContact O-N 3.39Å; F733-Q736 WeakPolarHBondContact O-CB 3.31Å; F733-Q736 PolarHBondContact O-N 3.18Å; F733-G737 PolarHBondContact O-N 3.24Å; F733-L776 HydrophobicContact CB-CD1 4.41Å; F733-W821 HydrophobicContact CB-CH2 4.06Å; F733-W821 HydrophobicContact CB-CZ2 4.19Å; F733-W821 AromaticContact CD2-CH2 3.47Å; F733-W821 HydrophobicContact CD2-CH2 3.47Å; F733-W821 VanDerWaalsContact CD2-CH2 3.47Å; F733-W821 AromaticContact CD2-CZ2 3.98Å; F733-W821 HydrophobicContact CD2-CZ2 3.98Å; F733-W821 HydrophobicContact CD2-CZ3 4.46Å; F733-W821 AromaticContact CE2-CH2 3.91Å; F733-W821 HydrophobicContact CE2-CH2 3.91Å; F733-W821 AromaticContact CG-CH2 3.81Å; F733-W821 HydrophobicContact CG-CH2 3.81Å; F733-W821 HydrophobicContact CG-CZ2 4.35Å
734	V	94.3	Very high	91.6	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.006	16%	0.16	C	C	.	.	H	α-helix	trans	-66.8	-42.2	173	-178.9	0	0	0	0	109.7	P697 R700 L726 V731 G737 A738	P697-V734 HydrophobicContact CB-CG2 3.89Å; P697-V734 WeakPolarHBondContact O-CG2 3.16Å; R700-V734 HydrophobicContact CB-CG1 4.06Å; R700-V734 HydrophobicContact CB-CG2 4.49Å; L726-V734 HydrophobicContact CD2-CG1 4.01Å; V731-V734 HydrophobicContact CB-CB 4.15Å; V731-V734 HydrophobicContact CB-CG2 3.83Å; V731-V734 HydrophobicContact CG1-CG2 3.9Å; V731-V734 WeakPolarHBondContact O-CB 3.4Å; V731-V734 PolarHBondContact O-N 3.07Å; V734-G737 PolarHBondContact O-N 3.02Å; V734-A738 WeakPolarHBondContact O-CB 3.17Å; V734-A738 PolarHBondContact O-N 3.5Å
735	R	93.9	Very high	91.7	Very high	34 Å²	34	27.6 Å²	27.6	13%	0.128	15%	0.152	C	C	.	.	H	α-helix	trans	-60	-47.4	172.5	-57.3	170.8	78.2	-148.4	-2	111.1	H727 G729 V731 P732 G737 A738 L739 E773 D774	H727-R735 PolarHBondContact O-NE 2.92Å; G729-R735 WeakPolarHBondContact O-CD 3.37Å; G729-R735 WeakPolarHBondContact O-CG 3.27Å; V731-R735 WeakPolarHBondContact O-CG 3.31Å; V731-R735 PolarHBondContact O-N 3.02Å; V731-R735 VanDerWaalsContact O-N 3.09Å; P732-R735 WeakPolarHBondContact O-CB 3.31Å; P732-R735 PolarHBondContact O-N 3.03Å; R735-G737 VanDerWaalsContact C-N 3.34Å; R735-G737 PolarHBondContact O-N 3.24Å; R735-A738 PolarHBondContact O-N 3.07Å; R735-L739 VanDerWaalsContact O-CG 3.28Å; R735-L739 WeakPolarHBondContact O-CG 3.4Å; R735-L739 PolarHBondContact O-N 2.65Å; R735-E773 IonicContact CZ-OE2 3.33Å; R735-E773 IonicContact NH1-OE2 2.62Å; R735-E773 PolarHBondContact NH1-OE2 3.28Å; R735-E773 VanDerWaalsContact NH2-CD 3.26Å; R735-E773 IonicContact NH2-OE1 3.8Å; R735-E773 PolarHBondContact NH2-OE1 2.82Å; R735-E773 IonicContact NH2-OE2 2.63Å; R735-E773 PolarHBondContact NH2-OE2 3.25Å; R735-D774 IonicContact NH1-OD2 2.68Å; R735-D774 PolarHBondContact NH1-OD2 2.95Å
736	Q	93.7	Very high	91.7	Very high	9 Å²	9	23.4 Å²	23.4	4%	0.042	13%	0.127	C	C	.	.	H	α-helix	trans	-53.8	-47.3	175.1	-179	-176.5	6.5	0	0	112.1	P732 F733 I740 L776 F779	P732-Q736 PolarHBondContact O-N 3.36Å; F733-Q736 WeakPolarHBondContact O-CB 3.31Å; F733-Q736 PolarHBondContact O-N 3.18Å; Q736-I740 HydrophobicContact CG-CD1 4.24Å; Q736-I740 WeakPolarHBondContact O-CG1 3.42Å; Q736-I740 PolarHBondContact O-N 3.03Å; Q736-I740 VanDerWaalsContact O-N 3.17Å; Q736-L776 WeakPolarHBondContact CB-O 3.25Å; Q736-L776 WeakPolarHBondContact CG-O 3.2Å; Q736-F779 VanDerWaalsContact NE2-CD1 3.27Å
737	G	93.3	Very high	91.7	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.9	-47.2	175.4	0	0	0	0	0	113.1	Y701 F733 V734 R735 L739 I740 A741	Y701-G737 VanDerWaalsContact CE2-CA 3.41Å; F733-G737 PolarHBondContact O-N 3.24Å; V734-G737 PolarHBondContact O-N 3.02Å; R735-G737 VanDerWaalsContact C-N 3.34Å; R735-G737 PolarHBondContact O-N 3.24Å; G737-L739 VanDerWaalsContact C-N 3.34Å; G737-L739 PolarHBondContact O-N 2.74Å; G737-I740 PolarHBondContact O-N 2.92Å; G737-A741 VanDerWaalsContact O-CB 3.28Å; G737-A741 WeakPolarHBondContact O-CB 3.48Å; G737-A741 PolarHBondContact O-N 3.14Å
738	A	94.3	Very high	91.8	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.008	12%	0.122	C	C	.	.	H	α-helix	trans	-60.5	-40.2	178.9	0	0	0	0	0	112.8	L726 H727 V734 R735 N742	L726-A738 HydrophobicContact CB-CB 3.74Å; H727-A738 HydrophobicContact CB-CB 4.47Å; V734-A738 WeakPolarHBondContact O-CB 3.17Å; V734-A738 PolarHBondContact O-N 3.5Å; R735-A738 PolarHBondContact O-N 3.07Å; A738-N742 VanDerWaalsContact O-CB 3.26Å; A738-N742 WeakPolarHBondContact O-CB 3.48Å; A738-N742 PolarHBondContact O-N 3.31Å
739	L	94.8	Very high	91.6	Very high	4 Å²	4	15.8 Å²	15.8	2%	0.021	9%	0.091	C	C	.	.	H	α-helix	trans	-65.1	-45.7	176	-66.7	175.6	0	0	0	111.9	H727 R735 G737 A743 F760 L764 I767 A781 A784	H727-L739 HydrophobicContact CB-CD2 4.48Å; R735-L739 VanDerWaalsContact O-CG 3.28Å; R735-L739 WeakPolarHBondContact O-CG 3.4Å; R735-L739 PolarHBondContact O-N 2.65Å; G737-L739 VanDerWaalsContact C-N 3.34Å; G737-L739 PolarHBondContact O-N 2.74Å; L739-A743 PolarHBondContact O-N 3.06Å; L739-A743 VanDerWaalsContact O-N 3.12Å; L739-F760 HydrophobicContact CD2-CE2 3.8Å; L739-F760 HydrophobicContact CD2-CZ 4.33Å; L739-F760 WeakPolarHBondContact O-CZ 3.48Å; L739-L764 HydrophobicContact CD2-CD2 4.03Å; L739-I767 HydrophobicContact CD1-CD1 4.11Å; L739-I767 HydrophobicContact CD2-CD1 4.07Å; L739-A781 HydrophobicContact CD1-CB 4.09Å; L739-A784 HydrophobicContact CB-CB 4.45Å
740	I	94.4	Very high	91.4	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-64.3	-47.8	177.7	-68.6	170.2	0	0	0	110.4	M705 Q736 G737 N742 A743 M744 I783 I787 F817 F820	M705-I740 HydrophobicContact CE-CG2 3.99Å; Q736-I740 HydrophobicContact CG-CD1 4.24Å; Q736-I740 WeakPolarHBondContact O-CG1 3.42Å; Q736-I740 PolarHBondContact O-N 3.03Å; Q736-I740 VanDerWaalsContact O-N 3.17Å; G737-I740 PolarHBondContact O-N 2.92Å; I740-N742 PolarHBondContact O-N 3.07Å; I740-A743 WeakPolarHBondContact O-CB 3.44Å; I740-A743 PolarHBondContact O-N 3.27Å; I740-M744 HydrophobicContact CG2-CE 3.97Å; I740-M744 WeakPolarHBondContact O-CG 3.44Å; I740-M744 PolarHBondContact O-N 3.11Å; I740-I783 HydrophobicContact CD1-CG2 4.35Å; I740-I783 HydrophobicContact CG1-CG2 4.27Å; I740-I787 HydrophobicContact CG2-CD1 4.04Å; I740-F817 HydrophobicContact CG2-CE1 4.14Å; I740-F817 HydrophobicContact CG2-CZ 3.93Å; I740-F820 HydrophobicContact CD1-CE1 4.16Å; I740-F820 HydrophobicContact CD1-CZ 4.03Å
741	A	93.9	Very high	90.9	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-60.5	-42.6	178.4	0	0	0	0	0	112.5	A704 M705 L723 G737 A743 M744 V745	A704-A741 HydrophobicContact CB-CB 4.5Å; A704-A741 WeakPolarHBondContact O-CB 3.48Å; M705-A741 HydrophobicContact SD-CB 4.2Å; L723-A741 HydrophobicContact CD1-CB 4.1Å; L723-A741 HydrophobicContact CD2-CB 3.7Å; G737-A741 VanDerWaalsContact O-CB 3.28Å; G737-A741 WeakPolarHBondContact O-CB 3.48Å; G737-A741 PolarHBondContact O-N 3.14Å; A741-A743 VanDerWaalsContact C-N 3.31Å; A741-A743 PolarHBondContact O-N 2.96Å; A741-M744 WeakPolarHBondContact O-CB 3.31Å; A741-M744 PolarHBondContact O-N 2.87Å; A741-M744 VanDerWaalsContact O-N 3.1Å; A741-V745 WeakPolarHBondContact O-CG2 3.45Å; A741-V745 PolarHBondContact O-N 3.14Å
742	N	93.4	Very high	90.1	Very high	2 Å²	2	14.9 Å²	14.9	1%	0.011	9%	0.087	C	C	.	.	H	α-helix	trans	-67.5	-32.4	178.6	-161.3	21.5	0	0	0	111.8	L723 A738 I740 V745 L746 F760	L723-N742 HydrophobicContact CB-CB 4.3Å; L723-N742 HydrophobicContact CD1-CB 4.15Å; A738-N742 VanDerWaalsContact O-CB 3.26Å; A738-N742 WeakPolarHBondContact O-CB 3.48Å; A738-N742 PolarHBondContact O-N 3.31Å; I740-N742 PolarHBondContact O-N 3.07Å; N742-V745 PolarHBondContact O-N 2.89Å; N742-L746 VanDerWaalsContact O-CB 3.29Å; N742-L746 WeakPolarHBondContact O-CB 3.44Å; N742-L746 WeakPolarHBondContact O-CG 3.44Å; N742-L746 PolarHBondContact O-N 3.43Å; N742-L746 VanDerWaalsContact OD1-CD1 3.3Å; N742-L746 WeakPolarHBondContact OD1-CD1 3.44Å; N742-F760 HydrophobicContact CB-CE1 4.14Å; N742-F760 HydrophobicContact CB-CE2 4.06Å; N742-F760 HydrophobicContact CB-CZ 3.75Å; N742-F760 VanDerWaalsContact ND2-CD2 3.3Å; N742-F760 WeakPolarHBondContact ND2-CD2 3.29Å; N742-F760 WeakPolarHBondContact ND2-CE2 3.48Å
743	A	93	Very high	89.4	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-65.6	-36.5	169.6	0	0	0	0	0	113.1	L739 I740 A741 I747 F760 A784 I787 L788	L739-A743 PolarHBondContact O-N 3.06Å; L739-A743 VanDerWaalsContact O-N 3.12Å; I740-A743 WeakPolarHBondContact O-CB 3.44Å; I740-A743 PolarHBondContact O-N 3.27Å; A741-A743 VanDerWaalsContact C-N 3.31Å; A741-A743 PolarHBondContact O-N 2.96Å; A743-I747 PolarHBondContact O-N 3.27Å; A743-F760 HydrophobicContact CB-CE1 4.26Å; A743-A784 HydrophobicContact CB-CB 3.75Å; A743-A784 WeakPolarHBondContact CB-O 3.35Å; A743-I787 HydrophobicContact CB-CB 4.12Å; A743-I787 HydrophobicContact CB-CG2 4.04Å; A743-L788 HydrophobicContact CB-CD2 4.24Å; A743-L788 HydrophobicContact CB-CG 3.94Å
744	M	93	Very high	88.5	Confident	0 Å²	0	14.5 Å²	14.5	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-65.9	-40.4	173.4	-63.2	-178.1	169.1	0	0	112.1	M705 G708 A712 G713 I740 A741 I747 I787 I797 L814 F817 I830	M705-M744 HydrophobicContact CE-CE 4.42Å; M705-M744 HydrophobicContact CE-SD 4.47Å; G708-M744 WeakPolarHBondContact O-CB 3.22Å; A712-M744 WeakPolarHBondContact CA-O 3.45Å; G713-M744 PolarHBondContact N-O 2.93Å; I740-M744 HydrophobicContact CG2-CE 3.97Å; I740-M744 WeakPolarHBondContact O-CG 3.44Å; I740-M744 PolarHBondContact O-N 3.11Å; A741-M744 WeakPolarHBondContact O-CB 3.31Å; A741-M744 PolarHBondContact O-N 2.87Å; A741-M744 VanDerWaalsContact O-N 3.1Å; M744-I747 VanDerWaalsContact O-CG2 3.28Å; M744-I747 WeakPolarHBondContact O-CG2 3.41Å; M744-I787 HydrophobicContact CE-CD1 4.39Å; M744-I787 HydrophobicContact CG-CG2 4.41Å; M744-I797 HydrophobicContact CB-CD1 4.28Å; M744-I797 HydrophobicContact CE-CD1 4.25Å; M744-I797 HydrophobicContact CG-CD1 3.72Å; M744-I797 HydrophobicContact SD-CD1 4.37Å; M744-L814 HydrophobicContact CE-CD2 4Å; M744-F817 HydrophobicContact CE-CD1 4.11Å; M744-F817 HydrophobicContact CE-CE1 3.5Å; M744-F817 HydrophobicContact CE-CZ 4.08Å; M744-I830 HydrophobicContact CE-CD1 4.26Å
745	V	91.9	Very high	87.9	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-70.7	-38.6	178.3	176.4	0	0	0	0	112.3	C711 A715 V720 L723 A741 N742	C711-V745 HydrophobicContact CB-CG2 3.85Å; A715-V745 PolarHBondContact N-O 3.4Å; V720-V745 HydrophobicContact CG2-CG1 3.81Å; L723-V745 HydrophobicContact CD1-CG2 4Å; A741-V745 WeakPolarHBondContact O-CG2 3.45Å; A741-V745 PolarHBondContact O-N 3.14Å; N742-V745 PolarHBondContact O-N 2.89Å
746	L	90.5	Very high	87.3	Confident	3 Å²	3	20.2 Å²	20.2	2%	0.016	12%	0.123	C	C	.	.	S	Bend	trans	-93.2	5	-176.6	-64.3	173.6	0	0	0	114.5	V720 N742 Q748 Q749 F760 L788	V720-L746 HydrophobicContact CG2-CD2 3.97Å; V720-L746 HydrophobicContact CG2-CG 4.37Å; N742-L746 VanDerWaalsContact O-CB 3.29Å; N742-L746 WeakPolarHBondContact O-CB 3.44Å; N742-L746 WeakPolarHBondContact O-CG 3.44Å; N742-L746 PolarHBondContact O-N 3.43Å; N742-L746 VanDerWaalsContact OD1-CD1 3.3Å; N742-L746 WeakPolarHBondContact OD1-CD1 3.44Å; L746-Q748 PolarHBondContact O-N 2.91Å; L746-Q749 WeakPolarHBondContact O-CB 3.33Å; L746-Q749 WeakPolarHBondContact O-CG 3.43Å; L746-Q749 PolarHBondContact O-N 3.49Å; L746-Q749 VanDerWaalsContact O-N 3.15Å; L746-F760 HydrophobicContact CD1-CB 4.12Å; L746-F760 HydrophobicContact CD1-CD1 3.76Å; L746-F760 HydrophobicContact CD1-CE1 4.49Å; L746-F760 HydrophobicContact CD1-CG 4.1Å; L746-L788 HydrophobicContact CB-CD2 4.11Å
747	I	90.2	Very high	86.8	Confident	2 Å²	2	20.2 Å²	20.2	1%	0.01	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	138.1	178.7	-163.9	165.1	0	0	0	111.5	A743 M744 Q749 I787 I797 F834	A743-I747 PolarHBondContact O-N 3.27Å; M744-I747 VanDerWaalsContact O-CG2 3.28Å; M744-I747 WeakPolarHBondContact O-CG2 3.41Å; I747-Q749 PolarHBondContact O-N 3.44Å; I747-I787 HydrophobicContact CD1-CG2 4.14Å; I747-I787 VanDerWaalsContact CD1-O 3.31Å; I747-I787 WeakPolarHBondContact CD1-O 3.31Å; I747-I797 HydrophobicContact CD1-CG1 4.26Å; I747-F834 HydrophobicContact CD1-CE1 4.5Å
748	Q	85.2	Confident	86.3	Confident	6 Å²	6	23 Å²	23	3%	0.028	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	61	-3.2	-175.2	-68.5	-152.9	17.7	0	0	118.1	L746 N794 M795 T837 R962 M964	L746-Q748 PolarHBondContact O-N 2.91Å; Q748-N794 PolarHBondContact NE2-O 3.46Å; Q748-M795 WeakPolarHBondContact CG-O 3.3Å; Q748-M795 VanDerWaalsContact NE2-N 3.2Å; Q748-M795 PolarHBondContact NE2-O 2.92Å; Q748-T837 PolarHBondContact NE2-OG1 3.29Å; Q748-T837 PolarHBondContact OE1-OG1 3.43Å; Q748-R962 PolarHBondContact O-NH2 3.3Å; Q748-R962 VanDerWaalsContact OE1-NE 3.15Å; Q748-M964 HydrophobicContact CB-CE 3.9Å; Q748-M964 WeakPolarHBondContact O-CE 3.38Å
749	Q	82.6	Confident	86	Confident	17 Å²	17	26.7 Å²	26.7	8%	0.079	16%	0.16	C	C	.	.			trans	-75	161.1	-179	-57.2	-59.9	-21.6	0	0	112.7	G713 A715 L746 I747 T753	G713-Q749 PolarHBondContact O-NE2 3.21Å; A715-Q749 HydrophobicContact CB-CG 3.84Å; L746-Q749 WeakPolarHBondContact O-CB 3.33Å; L746-Q749 WeakPolarHBondContact O-CG 3.43Å; L746-Q749 PolarHBondContact O-N 3.49Å; L746-Q749 VanDerWaalsContact O-N 3.15Å; I747-Q749 PolarHBondContact O-N 3.44Å; Q749-T753 VanDerWaalsContact OE1-CB 3.32Å; Q749-T753 PolarHBondContact OE1-OG1 3.16Å
750	N	80.4	Confident	85.7	Confident	9 Å²	9	26.7 Å²	26.7	5%	0.048	16%	0.16	C	C	.	.			trans	-133.2	176.7	179.8	67.4	35.7	0	0	0	111.7	V752 T753 S754 S757 T861 A863	N750-V752 PolarHBondContact O-N 3.19Å; N750-V752 VanDerWaalsContact O-N 3.11Å; N750-V752 WeakPolarHBondContact OD1-CA 3.35Å; N750-V752 WeakPolarHBondContact OD1-CB 3.49Å; N750-V752 PolarHBondContact OD1-N 2.94Å; N750-T753 PolarHBondContact N-OG1 3.45Å; N750-T753 PolarHBondContact O-N 3.41Å; N750-T753 PolarHBondContact O-OG1 3.43Å; N750-T753 PolarHBondContact OD1-N 3.35Å; N750-S754 CarbonylContact O-C 3.54Å; N750-S754 PolarHBondContact O-N 3.33Å; N750-S757 VanDerWaalsContact C-OG 3.29Å; N750-S757 PolarHBondContact O-OG 3.45Å; N750-T861 PolarHBondContact ND2-O 3.46Å; N750-A863 PolarHBondContact ND2-O 2.69Å
751	A	76.8	Confident	85.4	Confident	56 Å²	56	29.3 Å²	29.3	46%	0.463	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-24.8	-177.9	0	0	0	0	0	114.6	V758	A751-V758 HydrophobicContact CB-CG2 3.59Å
752	V	77.2	Confident	85.1	Confident	88 Å²	88	35.2 Å²	35.2	53%	0.533	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-37.8	-178.2	-177.1	0	0	0	0	111.3	N750 S860	N750-V752 PolarHBondContact O-N 3.19Å; N750-V752 VanDerWaalsContact O-N 3.11Å; N750-V752 WeakPolarHBondContact OD1-CA 3.35Å; N750-V752 WeakPolarHBondContact OD1-CB 3.49Å; N750-V752 PolarHBondContact OD1-N 2.94Å; V752-S860 WeakPolarHBondContact CG2-O 3.39Å
753	T	76.3	Confident	84.9	Confident	55 Å²	55	38.3 Å²	38.3	34%	0.337	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-35.8	176.3	60.7	0	0	0	0	112.4	Q749 N750	Q749-T753 VanDerWaalsContact OE1-CB 3.32Å; Q749-T753 PolarHBondContact OE1-OG1 3.16Å; N750-T753 PolarHBondContact N-OG1 3.45Å; N750-T753 PolarHBondContact O-N 3.41Å; N750-T753 PolarHBondContact O-OG1 3.43Å; N750-T753 PolarHBondContact OD1-N 3.35Å
754	S	75.5	Confident	84.8	Confident	17 Å²	17	38.3 Å²	38.3	12%	0.119	21%	0.211	C	C	.	.			trans	-151.4	108.5	173.5	-178.6	0	0	0	0	110.7	N750 K756 S757	N750-S754 CarbonylContact O-C 3.54Å; N750-S754 PolarHBondContact O-N 3.33Å; S754-K756 PolarHBondContact O-N 2.76Å; S754-S757 VanDerWaalsContact O-CB 3.29Å; S754-S757 WeakPolarHBondContact O-CB 3.49Å; S754-S757 PolarHBondContact O-N 2.85Å; S754-S757 PolarHBondContact O-OG 3.06Å
755	P	81.2	Confident	84.5	Confident	88 Å²	88	39.4 Å²	39.4	57%	0.571	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-33.2	178.3	23.4	-32.9	0	0	0	112	S757 V758	P755-S757 PolarHBondContact O-N 3.46Å; P755-V758 PolarHBondContact O-N 3.44Å
756	K	82.5	Confident	84.4	Confident	68 Å²	68	46.1 Å²	46.1	30%	0.296	25%	0.246	S	C	.	.	H	α-helix	trans	-54.1	-22.3	173.8	-67	-168.7	175.5	-168.7	0	113.5	V720 E724 S754 V758 D759 F760	V720-K756 HydrophobicContact CG1-CD 3.66Å; E724-K756 WeakPolarHBondContact OE2-CD 3.29Å; E724-K756 VanDerWaalsContact OE2-CE 3.27Å; E724-K756 WeakPolarHBondContact OE2-CE 3.38Å; E724-K756 IonicContact OE2-NZ 2.93Å; E724-K756 PolarHBondContact OE2-NZ 2.91Å; S754-K756 PolarHBondContact O-N 2.76Å; K756-V758 VanDerWaalsContact C-N 3.31Å; K756-V758 PolarHBondContact O-N 3.38Å; K756-D759 PolarHBondContact O-N 3.06Å; K756-F760 WeakPolarHBondContact O-CB 3.29Å; K756-F760 PolarHBondContact O-N 3.16Å
757	S	82.2	Confident	84.4	Confident	8 Å²	8	46.9 Å²	46.9	6%	0.056	25%	0.25	C	C	.	.	H	α-helix	trans	-64	-33.9	175	67.2	0	0	0	0	113.2	N750 S754 P755 R761	N750-S757 VanDerWaalsContact C-OG 3.29Å; N750-S757 PolarHBondContact O-OG 3.45Å; S754-S757 VanDerWaalsContact O-CB 3.29Å; S754-S757 WeakPolarHBondContact O-CB 3.49Å; S754-S757 PolarHBondContact O-N 2.85Å; S754-S757 PolarHBondContact O-OG 3.06Å; P755-S757 PolarHBondContact O-N 3.46Å; S757-R761 WeakPolarHBondContact O-CG 3.34Å; S757-R761 PolarHBondContact O-N 3Å
758	V	84.2	Confident	84.3	Confident	58 Å²	58	47.1 Å²	47.1	35%	0.352	25%	0.251	S	S	.	.	H	α-helix	trans	-75.1	-45.5	176.8	178.6	0	0	0	0	110.1	A751 P755 K756 F760 R761 Q762	A751-V758 HydrophobicContact CB-CG2 3.59Å; P755-V758 PolarHBondContact O-N 3.44Å; K756-V758 VanDerWaalsContact C-N 3.31Å; K756-V758 PolarHBondContact O-N 3.38Å; V758-F760 VanDerWaalsContact C-N 3.3Å; V758-F760 PolarHBondContact O-N 3.1Å; V758-R761 PolarHBondContact O-N 3.42Å; V758-Q762 WeakPolarHBondContact O-CG 3.46Å; V758-Q762 PolarHBondContact O-N 2.97Å
759	D	86.2	Confident	84.4	Confident	80 Å²	80	48.6 Å²	48.6	43%	0.428	27%	0.268	S	S	.	.	H	α-helix	trans	-60.8	-41.8	177.1	-55.4	-39.5	0	0	0	110.9	K756 Q762 K763	K756-D759 PolarHBondContact O-N 3.06Å; D759-Q762 PolarHBondContact O-N 2.92Å; D759-K763 WeakPolarHBondContact O-CG 3.48Å; D759-K763 PolarHBondContact O-N 3.44Å
760	F	89.6	Confident	84.7	Confident	3 Å²	3	50.3 Å²	50.3	1%	0.013	28%	0.278	C	S	.	.	H	α-helix	trans	-63.9	-43.8	176.8	-176.5	-123.1	0	0	0	112.5	L739 N742 A743 L746 K756 V758 Q762 K763 L764 L788	L739-F760 HydrophobicContact CD2-CE2 3.8Å; L739-F760 HydrophobicContact CD2-CZ 4.33Å; L739-F760 WeakPolarHBondContact O-CZ 3.48Å; N742-F760 HydrophobicContact CB-CE1 4.14Å; N742-F760 HydrophobicContact CB-CE2 4.06Å; N742-F760 HydrophobicContact CB-CZ 3.75Å; N742-F760 VanDerWaalsContact ND2-CD2 3.3Å; N742-F760 WeakPolarHBondContact ND2-CD2 3.29Å; N742-F760 WeakPolarHBondContact ND2-CE2 3.48Å; A743-F760 HydrophobicContact CB-CE1 4.26Å; L746-F760 HydrophobicContact CD1-CB 4.12Å; L746-F760 HydrophobicContact CD1-CD1 3.76Å; L746-F760 HydrophobicContact CD1-CE1 4.49Å; L746-F760 HydrophobicContact CD1-CG 4.1Å; K756-F760 WeakPolarHBondContact O-CB 3.29Å; K756-F760 PolarHBondContact O-N 3.16Å; V758-F760 VanDerWaalsContact C-N 3.3Å; V758-F760 PolarHBondContact O-N 3.1Å; F760-Q762 VanDerWaalsContact C-N 3.27Å; F760-Q762 PolarHBondContact O-N 3.05Å; F760-K763 WeakPolarHBondContact O-CB 3.33Å; F760-K763 PolarHBondContact O-N 3.21Å; F760-L764 HydrophobicContact CD1-CD1 4.06Å; F760-L764 HydrophobicContact CD2-CG 4.44Å; F760-L764 HydrophobicContact CE1-CD1 3.71Å; F760-L764 HydrophobicContact CE1-CG 4.26Å; F760-L764 HydrophobicContact CE2-CD1 4.44Å; F760-L764 HydrophobicContact CE2-CD2 4.12Å; F760-L764 HydrophobicContact CE2-CG 4.1Å; F760-L764 HydrophobicContact CZ-CD1 3.9Å; F760-L764 HydrophobicContact CZ-CD2 3.92Å; F760-L764 HydrophobicContact CZ-CG 3.99Å; F760-L764 WeakPolarHBondContact O-CG 3.5Å; F760-L764 PolarHBondContact O-N 3.28Å; F760-L788 HydrophobicContact CD1-CD1 4.04Å; F760-L788 HydrophobicContact CE1-CD1 4Å
761	R	88.3	Confident	84.9	Confident	55 Å²	55	59.1 Å²	59.1	21%	0.208	31%	0.311	C	S	.	.	H	α-helix	trans	-60.8	-35.5	173	-75.8	177.4	-180	-102.1	6	112.5	S757 V758 L765 L788 D789	S757-R761 WeakPolarHBondContact O-CG 3.34Å; S757-R761 PolarHBondContact O-N 3Å; V758-R761 PolarHBondContact O-N 3.42Å; R761-L765 WeakPolarHBondContact O-CB 3.48Å; R761-L765 WeakPolarHBondContact O-CG 3.49Å; R761-L765 PolarHBondContact O-N 3.37Å; R761-L765 VanDerWaalsContact O-N 3.16Å; R761-L788 HydrophobicContact CG-CD1 3.91Å; R761-L788 PolarHBondContact NH2-O 2.97Å; R761-D789 IonicContact CZ-OD1 3.5Å; R761-D789 IonicContact CZ-OD2 2.72Å; R761-D789 IonicContact NH1-OD1 3.97Å; R761-D789 PolarHBondContact NH1-OD1 3.35Å; R761-D789 IonicContact NH1-OD2 2.96Å; R761-D789 PolarHBondContact NH1-OD2 3.09Å; R761-D789 IonicContact NH2-OD1 3.98Å; R761-D789 PolarHBondContact NH2-OD1 3.44Å
762	Q	87.3	Confident	85.4	Confident	125 Å²	125	64.9 Å²	64.9	58%	0.584	33%	0.327	S	S	*	.	H	α-helix	trans	-70.6	-40.3	173.3	-67.7	-177.3	46.2	0	0	112.5	V758 D759 F760 L765 K766	V758-Q762 WeakPolarHBondContact O-CG 3.46Å; V758-Q762 PolarHBondContact O-N 2.97Å; D759-Q762 PolarHBondContact O-N 2.92Å; F760-Q762 VanDerWaalsContact C-N 3.27Å; F760-Q762 PolarHBondContact O-N 3.05Å; Q762-L765 PolarHBondContact O-N 3.28Å; Q762-K766 PolarHBondContact O-N 3.43Å
763	K	89	Confident	85.9	Confident	66 Å²	66	62.7 Å²	62.7	29%	0.287	31%	0.311	S	S	.	.	H	α-helix	trans	-57.9	-49	172.8	-72.8	173.6	178.3	-175.6	0	110.9	E724 H727 D759 F760 L765 K766 I767	E724-K763 IonicContact OE1-NZ 2.82Å; E724-K763 PolarHBondContact OE1-NZ 3.21Å; H727-K763 PolarHBondContact NE2-NZ 2.94Å; D759-K763 WeakPolarHBondContact O-CG 3.48Å; D759-K763 PolarHBondContact O-N 3.44Å; F760-K763 WeakPolarHBondContact O-CB 3.33Å; F760-K763 PolarHBondContact O-N 3.21Å; K763-L765 PolarHBondContact O-N 3.4Å; K763-K766 WeakPolarHBondContact O-CB 3.43Å; K763-K766 PolarHBondContact O-N 3.44Å; K763-I767 WeakPolarHBondContact O-CG1 3.23Å; K763-I767 PolarHBondContact O-N 3.39Å
764	L	90.2	Very high	86.5	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-56.2	-50.7	176.7	-70.4	172.7	0	0	0	112	L739 F760 K766 I767 I768 A781 A784 L788	L739-L764 HydrophobicContact CD2-CD2 4.03Å; F760-L764 HydrophobicContact CD1-CD1 4.06Å; F760-L764 HydrophobicContact CD2-CG 4.44Å; F760-L764 HydrophobicContact CE1-CD1 3.71Å; F760-L764 HydrophobicContact CE1-CG 4.26Å; F760-L764 HydrophobicContact CE2-CD1 4.44Å; F760-L764 HydrophobicContact CE2-CD2 4.12Å; F760-L764 HydrophobicContact CE2-CG 4.1Å; F760-L764 HydrophobicContact CZ-CD1 3.9Å; F760-L764 HydrophobicContact CZ-CD2 3.92Å; F760-L764 HydrophobicContact CZ-CG 3.99Å; F760-L764 WeakPolarHBondContact O-CG 3.5Å; F760-L764 PolarHBondContact O-N 3.28Å; L764-K766 PolarHBondContact O-N 3.39Å; L764-I767 PolarHBondContact O-N 2.97Å; L764-I767 VanDerWaalsContact O-N 3.13Å; L764-I768 WeakPolarHBondContact O-CG1 3.24Å; L764-I768 PolarHBondContact O-N 3.46Å; L764-I768 VanDerWaalsContact O-N 3.12Å; L764-A781 HydrophobicContact CD2-CB 3.87Å; L764-A784 HydrophobicContact CD1-CB 4.11Å; L764-A784 HydrophobicContact CD2-CB 3.72Å; L764-L788 HydrophobicContact CD1-CD1 3.61Å
765	L	88.2	Confident	87.2	Confident	24 Å²	24	66.1 Å²	66.1	13%	0.126	33%	0.326	C	S	.	.	H	α-helix	trans	-67	-11.8	177.4	-76.8	174.8	0	0	0	114.7	L401 R404 R761 Q762 K763 L868	L401-L765 HydrophobicContact CD1-CD2 3.68Å; L401-L765 HydrophobicContact CD1-CG 4.45Å; R404-L765 PolarHBondContact NH2-O 3.06Å; R761-L765 WeakPolarHBondContact O-CB 3.48Å; R761-L765 WeakPolarHBondContact O-CG 3.49Å; R761-L765 PolarHBondContact O-N 3.37Å; R761-L765 VanDerWaalsContact O-N 3.16Å; Q762-L765 PolarHBondContact O-N 3.28Å; K763-L765 PolarHBondContact O-N 3.4Å; L765-L868 HydrophobicContact CD1-CD1 4.38Å
766	K	89.9	Confident	87.7	Confident	141 Å²	141	65.4 Å²	65.4	61%	0.613	32%	0.317	S	S	*	.	H	α-helix	trans	-85.1	-45.7	168.3	-171.2	-164.3	171.2	-157.3	0	110.7	Q762 K763 L764 I768 G769 D770	Q762-K766 PolarHBondContact O-N 3.43Å; K763-K766 WeakPolarHBondContact O-CB 3.43Å; K763-K766 PolarHBondContact O-N 3.44Å; L764-K766 PolarHBondContact O-N 3.39Å; K766-I768 VanDerWaalsContact C-N 3.31Å; K766-I768 PolarHBondContact O-N 3.03Å; K766-G769 PolarHBondContact O-N 2.94Å; K766-D770 WeakPolarHBondContact O-CB 3.36Å; K766-D770 PolarHBondContact O-N 3.41Å
767	I	89.2	Confident	88	Confident	18 Å²	18	62.2 Å²	62.2	9%	0.092	30%	0.303	C	S	.	.	H	α-helix	trans	-62.8	-37	-177.4	-65.4	164.3	0	0	0	111.8	L739 K763 L764 E773 A777 A781	L739-I767 HydrophobicContact CD1-CD1 4.11Å; L739-I767 HydrophobicContact CD2-CD1 4.07Å; K763-I767 WeakPolarHBondContact O-CG1 3.23Å; K763-I767 PolarHBondContact O-N 3.39Å; L764-I767 PolarHBondContact O-N 2.97Å; L764-I767 VanDerWaalsContact O-N 3.13Å; I767-E773 HydrophobicContact CG2-CB 4.34Å; I767-E773 HydrophobicContact CG2-CG 4.27Å; I767-A777 HydrophobicContact CG2-CB 4.36Å; I767-A781 HydrophobicContact CB-CB 4.29Å; I767-A781 HydrophobicContact CG2-CB 3.97Å
768	I	89.2	Confident	88.5	Confident	7 Å²	7	62.9 Å²	62.9	4%	0.036	31%	0.305	C	S	.	.	H	α-helix	trans	-69.7	-42.6	178.4	-59.5	169.8	0	0	0	111.1	I405 E408 L764 K766 A781 I782	I405-I768 HydrophobicContact CD1-CD1 4.28Å; I405-I768 HydrophobicContact CG1-CD1 4.13Å; I405-I768 HydrophobicContact CG2-CG2 4.48Å; E408-I768 HydrophobicContact CB-CG2 4.05Å; E408-I768 WeakPolarHBondContact OE2-CG2 3.28Å; L764-I768 WeakPolarHBondContact O-CG1 3.24Å; L764-I768 PolarHBondContact O-N 3.46Å; L764-I768 VanDerWaalsContact O-N 3.12Å; K766-I768 VanDerWaalsContact C-N 3.31Å; K766-I768 PolarHBondContact O-N 3.03Å; I768-A781 HydrophobicContact CD1-CB 4.15Å; I768-A781 HydrophobicContact CG1-CB 3.69Å; I768-I782 HydrophobicContact CD1-CG1 3.85Å; I768-I782 HydrophobicContact CG1-CG1 4Å; I768-I782 HydrophobicContact CG2-CG1 4.31Å
769	G	87.5	Confident	88.9	Confident	38 Å²	38	60.3 Å²	60.3	39%	0.392	29%	0.289	S	S	.	.	H	α-helix	trans	-82.1	-16.7	-177	0	0	0	0	0	115.9	E408 K766	E408-G769 WeakPolarHBondContact OE2-CA 3.38Å; E408-G769 PolarHBondContact OE2-N 3.44Å; K766-G769 PolarHBondContact O-N 2.94Å
770	D	88.8	Confident	89.2	Confident	53 Å²	53	56.5 Å²	56.5	28%	0.283	27%	0.269	S	S	.	.			trans	-75.3	134.9	176.1	-160.9	-38.5	0	0	0	110.9	K766 H772 E773 K778	K766-D770 WeakPolarHBondContact O-CB 3.36Å; K766-D770 PolarHBondContact O-N 3.41Å; D770-H772 IonicContact OD1-CD2 3.43Å; D770-H772 PolarHBondContact OD1-CD2 3.36Å; D770-H772 IonicContact OD1-CG 3.89Å; D770-H772 PolarHBondContact OD1-N 3.37Å; D770-E773 HydrophobicContact CB-CB 4.38Å; D770-E773 HydrophobicContact CB-CG 3.79Å; D770-K778 WeakPolarHBondContact O-CE 3.43Å; D770-K778 PolarHBondContact O-NZ 2.81Å
771	R	84.7	Confident	89.4	Confident	194 Å²	194	56.4 Å²	56.4	73%	0.732	27%	0.268	S	S	*	.	S	Bend	trans	-76.1	-30.9	178	-67.5	-172.3	-177.7	-179.8	3.8	112.6	E773 K778	R771-E773 VanDerWaalsContact C-N 3.34Å; R771-E773 PolarHBondContact O-N 3.14Å; R771-K778 PolarHBondContact O-NZ 3.41Å; R771-K778 VanDerWaalsContact O-NZ 3.12Å
772	H	86.3	Confident	89.6	Confident	177 Å²	177	53.8 Å²	53.8	82%	0.819	26%	0.258	S	S	*	.	S	Bend	trans	-83.1	-10.4	-171.8	-57.1	-77.6	0	0	0	113.8	D770	D770-H772 IonicContact OD1-CD2 3.43Å; D770-H772 PolarHBondContact OD1-CD2 3.36Å; D770-H772 IonicContact OD1-CG 3.89Å; D770-H772 PolarHBondContact OD1-N 3.37Å
773	E	87.1	Confident	89.9	Confident	41 Å²	41	47.9 Å²	47.9	19%	0.192	23%	0.231	C	C	.	.	S	Bend	trans	-73.6	146.1	177.9	-76	-77.4	-154.4	0	0	113.5	R735 I767 D770 R771 K778	R735-E773 IonicContact CZ-OE2 3.33Å; R735-E773 IonicContact NH1-OE2 2.62Å; R735-E773 PolarHBondContact NH1-OE2 3.28Å; R735-E773 VanDerWaalsContact NH2-CD 3.26Å; R735-E773 IonicContact NH2-OE1 3.8Å; R735-E773 PolarHBondContact NH2-OE1 2.82Å; R735-E773 IonicContact NH2-OE2 2.63Å; R735-E773 PolarHBondContact NH2-OE2 3.25Å; I767-E773 HydrophobicContact CG2-CB 4.34Å; I767-E773 HydrophobicContact CG2-CG 4.27Å; D770-E773 HydrophobicContact CB-CB 4.38Å; D770-E773 HydrophobicContact CB-CG 3.79Å; R771-E773 VanDerWaalsContact C-N 3.34Å; R771-E773 PolarHBondContact O-N 3.14Å; E773-K778 HydrophobicContact CB-CG 4.5Å; E773-K778 WeakPolarHBondContact O-CE 3.41Å; E773-K778 PolarHBondContact O-NZ 3.2Å
774	D	89.5	Confident	90.1	Very high	60 Å²	60	44.8 Å²	44.8	32%	0.321	22%	0.217	S	C	.	.			trans	-60.9	147.3	-175.7	-53.8	-72.1	0	0	0	113.6	P732 R735 L776 A777 K778	P732-D774 HydrophobicContact CB-CB 3.87Å; P732-D774 HydrophobicContact CG-CB 4.2Å; P732-D774 VanDerWaalsContact CG-CG 3.5Å; P732-D774 WeakPolarHBondContact CG-OD1 3.3Å; R735-D774 IonicContact NH1-OD2 2.68Å; R735-D774 PolarHBondContact NH1-OD2 2.95Å; D774-L776 VanDerWaalsContact C-N 3.26Å; D774-L776 PolarHBondContact O-N 2.81Å; D774-A777 HydrophobicContact CB-CB 3.92Å; D774-A777 PolarHBondContact O-N 3.5Å; D774-K778 WeakPolarHBondContact O-CB 3.4Å; D774-K778 WeakPolarHBondContact O-CG 3.4Å; D774-K778 PolarHBondContact O-N 2.91Å
775	L	90.9	Very high	90.2	Very high	85 Å²	85	45 Å²	45	45%	0.445	22%	0.219	S	C	.	.	H	α-helix	trans	-57	-38.3	172.7	-72.1	166.2	0	0	0	112.6	H411 F779	H411-L775 HydrophobicContact CB-CD2 4Å; L775-F779 PolarHBondContact O-N 3.13Å
776	L	90.8	Very high	90.3	Very high	73 Å²	73	43.9 Å²	43.9	38%	0.382	21%	0.213	S	C	.	.	H	α-helix	trans	-72.1	-39.8	177.3	-65.8	179.8	0	0	0	112.5	P732 F733 Q736 D774 K778 F779 G780	P732-L776 HydrophobicContact CB-CB 4.16Å; P732-L776 HydrophobicContact CB-CD1 4.3Å; F733-L776 HydrophobicContact CB-CD1 4.41Å; Q736-L776 WeakPolarHBondContact CB-O 3.25Å; Q736-L776 WeakPolarHBondContact CG-O 3.2Å; D774-L776 VanDerWaalsContact C-N 3.26Å; D774-L776 PolarHBondContact O-N 2.81Å; L776-K778 VanDerWaalsContact C-N 3.34Å; L776-F779 PolarHBondContact O-N 3.07Å; L776-G780 PolarHBondContact O-N 2.66Å
777	A	90.1	Very high	90.5	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-64	-40.4	174	0	0	0	0	0	111.1	I767 D774 G780 A781	I767-A777 HydrophobicContact CG2-CB 4.36Å; D774-A777 HydrophobicContact CB-CB 3.92Å; D774-A777 PolarHBondContact O-N 3.5Å; A777-G780 PolarHBondContact O-N 3.25Å; A777-A781 WeakPolarHBondContact O-CB 3.47Å; A777-A781 PolarHBondContact O-N 2.93Å
778	K	92.2	Very high	90.6	Very high	23 Å²	23	36.6 Å²	36.6	10%	0.1	18%	0.181	C	C	.	.	H	α-helix	trans	-63.3	-45.1	172.8	-76.9	163.9	170.6	150.4	0	112.9	T414 D770 R771 E773 D774 L776 G780 A781 I782	T414-K778 HydrophobicContact CG2-CB 3.9Å; D770-K778 WeakPolarHBondContact O-CE 3.43Å; D770-K778 PolarHBondContact O-NZ 2.81Å; R771-K778 PolarHBondContact O-NZ 3.41Å; R771-K778 VanDerWaalsContact O-NZ 3.12Å; E773-K778 HydrophobicContact CB-CG 4.5Å; E773-K778 WeakPolarHBondContact O-CE 3.41Å; E773-K778 PolarHBondContact O-NZ 3.2Å; D774-K778 WeakPolarHBondContact O-CB 3.4Å; D774-K778 WeakPolarHBondContact O-CG 3.4Å; D774-K778 PolarHBondContact O-N 2.91Å; L776-K778 VanDerWaalsContact C-N 3.34Å; K778-G780 VanDerWaalsContact C-N 3.34Å; K778-G780 PolarHBondContact O-N 3.26Å; K778-A781 PolarHBondContact O-N 3.11Å; K778-I782 VanDerWaalsContact O-CG1 3.26Å; K778-I782 WeakPolarHBondContact O-CG1 3.3Å; K778-I782 PolarHBondContact O-N 2.67Å
779	F	91.9	Very high	90.6	Very high	4 Å²	4	36.7 Å²	36.7	2%	0.018	18%	0.182	C	C	.	.	H	α-helix	trans	-56.7	-49.2	173	-178	-77.9	0	0	0	110.7	V413 A417 Q736 L775 L776 A781 I782 I783 F820	V413-F779 HydrophobicContact CG1-CB 4.48Å; V413-F779 HydrophobicContact CG1-CD2 3.77Å; A417-F779 HydrophobicContact CB-CD2 3.6Å; A417-F779 HydrophobicContact CB-CE2 3.94Å; A417-F779 HydrophobicContact CB-CG 4.18Å; Q736-F779 VanDerWaalsContact NE2-CD1 3.27Å; L775-F779 PolarHBondContact O-N 3.13Å; L776-F779 PolarHBondContact O-N 3.07Å; F779-A781 VanDerWaalsContact C-N 3.33Å; F779-A781 PolarHBondContact O-N 2.97Å; F779-I782 PolarHBondContact O-N 2.8Å; F779-I783 HydrophobicContact CD1-CG1 4.02Å; F779-I783 HydrophobicContact CE1-CG1 3.7Å; F779-I783 HydrophobicContact CZ-CD1 4.5Å; F779-I783 HydrophobicContact CZ-CG1 4.11Å; F779-I783 WeakPolarHBondContact O-CG1 3.49Å; F779-I783 PolarHBondContact O-N 2.96Å; F779-F820 HydrophobicContact CE1-CD2 4.49Å
780	G	92.6	Very high	90.8	Very high	0 Å²	0	35 Å²	35	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-58.2	-42.3	176.2	0	0	0	0	0	112.9	L776 A777 K778 A784	L776-G780 PolarHBondContact O-N 2.66Å; A777-G780 PolarHBondContact O-N 3.25Å; K778-G780 VanDerWaalsContact C-N 3.34Å; K778-G780 PolarHBondContact O-N 3.26Å; G780-A784 WeakPolarHBondContact O-CB 3.25Å; G780-A784 PolarHBondContact O-N 3.39Å
781	A	93.1	Very high	90.6	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-66.3	-40.6	178.3	0	0	0	0	0	113.1	L739 L764 I767 I768 A777 K778 F779 A784 C785	L739-A781 HydrophobicContact CD1-CB 4.09Å; L764-A781 HydrophobicContact CD2-CB 3.87Å; I767-A781 HydrophobicContact CB-CB 4.29Å; I767-A781 HydrophobicContact CG2-CB 3.97Å; I768-A781 HydrophobicContact CD1-CB 4.15Å; I768-A781 HydrophobicContact CG1-CB 3.69Å; A777-A781 WeakPolarHBondContact O-CB 3.47Å; A777-A781 PolarHBondContact O-N 2.93Å; K778-A781 PolarHBondContact O-N 3.11Å; F779-A781 VanDerWaalsContact C-N 3.33Å; F779-A781 PolarHBondContact O-N 2.97Å; A781-A784 PolarHBondContact O-N 2.86Å; A781-C785 PolarHBondContact O-N 2.91Å; A781-C785 PolarHBondContact O-SG 3.12Å
782	I	93.6	Very high	90.6	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.005	12%	0.115	C	C	.	.	H	α-helix	trans	-67.5	-45.1	178.3	-66.4	164.4	0	0	0	110.7	I405 V409 T414 A417 A421 I768 K778 F779 A784 C785 G786	I405-I782 HydrophobicContact CG2-CD1 4.27Å; I405-I782 HydrophobicContact CG2-CG1 3.99Å; I405-I782 HydrophobicContact CG2-CG2 4.19Å; V409-I782 HydrophobicContact CG2-CD1 3.8Å; T414-I782 HydrophobicContact CG2-CD1 4.03Å; A417-I782 VanDerWaalsContact C-CG2 3.49Å; A417-I782 HydrophobicContact CB-CB 4.06Å; A417-I782 HydrophobicContact CB-CD1 4.2Å; A417-I782 HydrophobicContact CB-CG2 3.84Å; A417-I782 WeakPolarHBondContact O-CG2 3.41Å; A421-I782 HydrophobicContact CB-CG2 3.76Å; A421-I782 WeakPolarHBondContact CB-O 3.5Å; I768-I782 HydrophobicContact CD1-CG1 3.85Å; I768-I782 HydrophobicContact CG1-CG1 4Å; I768-I782 HydrophobicContact CG2-CG1 4.31Å; K778-I782 VanDerWaalsContact O-CG1 3.26Å; K778-I782 WeakPolarHBondContact O-CG1 3.3Å; K778-I782 PolarHBondContact O-N 2.67Å; F779-I782 PolarHBondContact O-N 2.8Å; I782-A784 VanDerWaalsContact C-N 3.34Å; I782-A784 PolarHBondContact O-N 2.84Å; I782-C785 WeakPolarHBondContact O-CB 3.46Å; I782-C785 PolarHBondContact O-N 3.07Å; I782-G786 PolarHBondContact O-N 2.72Å
783	I	93.6	Very high	90.7	Very high	1 Å²	1	15.1 Å²	15.1	1%	0.005	8%	0.078	C	C	.	.	H	α-helix	trans	-65.5	-37.5	175.4	-62.9	-60.5	0	0	0	111.3	I420 I740 F779 G786 I787 T827	I420-I783 HydrophobicContact CB-CD1 3.9Å; I420-I783 HydrophobicContact CG2-CD1 3.63Å; I740-I783 HydrophobicContact CD1-CG2 4.35Å; I740-I783 HydrophobicContact CG1-CG2 4.27Å; F779-I783 HydrophobicContact CD1-CG1 4.02Å; F779-I783 HydrophobicContact CE1-CG1 3.7Å; F779-I783 HydrophobicContact CZ-CD1 4.5Å; F779-I783 HydrophobicContact CZ-CG1 4.11Å; F779-I783 WeakPolarHBondContact O-CG1 3.49Å; F779-I783 PolarHBondContact O-N 2.96Å; I783-G786 WeakPolarHBondContact O-CA 3.48Å; I783-G786 PolarHBondContact O-N 2.73Å; I783-G786 VanDerWaalsContact O-N 3.16Å; I783-I787 HydrophobicContact CG2-CD1 3.89Å; I783-I787 HydrophobicContact CG2-CG1 4.4Å; I783-I787 WeakPolarHBondContact O-CG1 3.15Å; I783-I787 PolarHBondContact O-N 3.31Å; I783-T827 HydrophobicContact CD1-CG2 4.47Å
784	A	93.3	Very high	90.9	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-61.8	-44	173.9	0	0	0	0	0	112.6	L739 A743 L764 G780 A781 I782 G786 I787 L788	L739-A784 HydrophobicContact CB-CB 4.45Å; A743-A784 HydrophobicContact CB-CB 3.75Å; A743-A784 WeakPolarHBondContact CB-O 3.35Å; L764-A784 HydrophobicContact CD1-CB 4.11Å; L764-A784 HydrophobicContact CD2-CB 3.72Å; G780-A784 WeakPolarHBondContact O-CB 3.25Å; G780-A784 PolarHBondContact O-N 3.39Å; A781-A784 PolarHBondContact O-N 2.86Å; I782-A784 VanDerWaalsContact C-N 3.34Å; I782-A784 PolarHBondContact O-N 2.84Å; A784-G786 VanDerWaalsContact C-N 3.29Å; A784-G786 PolarHBondContact O-N 3.34Å; A784-I787 PolarHBondContact O-N 3.17Å; A784-L788 WeakPolarHBondContact O-CG 3.32Å; A784-L788 PolarHBondContact O-N 3.37Å
785	C	91.6	Very high	90.9	Very high	6 Å²	6	10.7 Å²	10.7	4%	0.041	6%	0.056	C	C	.	.	H	α-helix	trans	-56.7	-43.9	170.3	-74.9	0	0	0	0	111.5	L401 I405 A781 I782 L788 D789	L401-C785 HydrophobicContact CD2-CB 4.49Å; I405-C785 HydrophobicContact CD1-CB 4.12Å; A781-C785 PolarHBondContact O-N 2.91Å; A781-C785 PolarHBondContact O-SG 3.12Å; I782-C785 WeakPolarHBondContact O-CB 3.46Å; I782-C785 PolarHBondContact O-N 3.07Å; C785-L788 PolarHBondContact O-N 3.26Å; C785-D789 PolarHBondContact O-N 3.22Å
786	G	91.4	Very high	91	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-57.1	-53.6	175.8	0	0	0	0	0	112.8	I424 I782 I783 A784 L788 D789 A790	I424-G786 VanDerWaalsContact CG2-C 3.44Å; I424-G786 VanDerWaalsContact CG2-O 3.3Å; I424-G786 WeakPolarHBondContact CG2-O 3.39Å; I782-G786 PolarHBondContact O-N 2.72Å; I783-G786 WeakPolarHBondContact O-CA 3.48Å; I783-G786 PolarHBondContact O-N 2.73Å; I783-G786 VanDerWaalsContact O-N 3.16Å; A784-G786 VanDerWaalsContact C-N 3.29Å; A784-G786 PolarHBondContact O-N 3.34Å; G786-L788 VanDerWaalsContact C-N 3.34Å; G786-L788 PolarHBondContact O-N 3.07Å; G786-D789 PolarHBondContact O-N 3.34Å; G786-A790 PolarHBondContact O-N 2.82Å
787	I	93.5	Very high	91	Very high	0 Å²	0	4.4 Å²	4.4	0%	0	2%	0.024	C	C	.	.	H	α-helix	trans	-60.6	-40	-178.7	-68.8	169	0	0	0	111.9	I424 I740 A743 M744 I747 I783 A784 D789 A790 I797 I830	I424-I787 HydrophobicContact CG2-CG1 4.48Å; I740-I787 HydrophobicContact CG2-CD1 4.04Å; A743-I787 HydrophobicContact CB-CB 4.12Å; A743-I787 HydrophobicContact CB-CG2 4.04Å; M744-I787 HydrophobicContact CE-CD1 4.39Å; M744-I787 HydrophobicContact CG-CG2 4.41Å; I747-I787 HydrophobicContact CD1-CG2 4.14Å; I747-I787 VanDerWaalsContact CD1-O 3.31Å; I747-I787 WeakPolarHBondContact CD1-O 3.31Å; I783-I787 HydrophobicContact CG2-CD1 3.89Å; I783-I787 HydrophobicContact CG2-CG1 4.4Å; I783-I787 WeakPolarHBondContact O-CG1 3.15Å; I783-I787 PolarHBondContact O-N 3.31Å; A784-I787 PolarHBondContact O-N 3.17Å; I787-D789 VanDerWaalsContact C-N 3.28Å; I787-D789 PolarHBondContact O-N 3.23Å; I787-A790 WeakPolarHBondContact O-CB 3.28Å; I787-A790 PolarHBondContact O-N 3.33Å; I787-I797 HydrophobicContact CG2-CD1 4.13Å; I787-I830 HydrophobicContact CD1-CD1 3.71Å; I787-I830 HydrophobicContact CG1-CD1 3.87Å
788	L	91.1	Very high	90.9	Very high	6 Å²	6	5.4 Å²	5.4	3%	0.031	3%	0.031	C	C	.	.	H	α-helix	trans	-62.6	-32	-179.8	-78.2	176.2	0	0	0	113.8	A743 L746 F760 R761 L764 A784 C785 G786	A743-L788 HydrophobicContact CB-CD2 4.24Å; A743-L788 HydrophobicContact CB-CG 3.94Å; L746-L788 HydrophobicContact CB-CD2 4.11Å; F760-L788 HydrophobicContact CD1-CD1 4.04Å; F760-L788 HydrophobicContact CE1-CD1 4Å; R761-L788 HydrophobicContact CG-CD1 3.91Å; R761-L788 PolarHBondContact NH2-O 2.97Å; L764-L788 HydrophobicContact CD1-CD1 3.61Å; A784-L788 WeakPolarHBondContact O-CG 3.32Å; A784-L788 PolarHBondContact O-N 3.37Å; C785-L788 PolarHBondContact O-N 3.26Å; G786-L788 VanDerWaalsContact C-N 3.34Å; G786-L788 PolarHBondContact O-N 3.07Å
789	D	90.3	Very high	90.6	Very high	9 Å²	9	4.6 Å²	4.6	5%	0.048	3%	0.028	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.7	15.5	-176.8	-68.4	-28.9	0	0	0	113.3	L401 M425 R761 C785 G786 I787 G791 G792 C793	L401-D789 WeakPolarHBondContact CD2-OD2 3.46Å; M425-D789 HydrophobicContact CE-CB 4.06Å; M425-D789 HydrophobicContact CG-CB 4.09Å; R761-D789 IonicContact CZ-OD1 3.5Å; R761-D789 IonicContact CZ-OD2 2.72Å; R761-D789 IonicContact NH1-OD1 3.97Å; R761-D789 PolarHBondContact NH1-OD1 3.35Å; R761-D789 IonicContact NH1-OD2 2.96Å; R761-D789 PolarHBondContact NH1-OD2 3.09Å; R761-D789 IonicContact NH2-OD1 3.98Å; R761-D789 PolarHBondContact NH2-OD1 3.44Å; C785-D789 PolarHBondContact O-N 3.22Å; G786-D789 PolarHBondContact O-N 3.34Å; I787-D789 VanDerWaalsContact C-N 3.28Å; I787-D789 PolarHBondContact O-N 3.23Å; D789-G791 PolarHBondContact O-N 3.02Å; D789-G792 WeakPolarHBondContact O-CA 3.23Å; D789-G792 PolarHBondContact O-N 3.29Å; D789-C793 PolarHBondContact O-N 3.22Å; D789-C793 PolarHBondContact OD1-SG 3.36Å
790	A	91.5	Very high	90.4	Very high	1 Å²	1	6.1 Å²	6.1	1%	0.008	4%	0.035	C	C	.	.	H	α-helix	trans	-53.4	130.9	-174	0	0	0	0	0	114.5	I424 G786 I787 G792 C793 N794 M795 F834	I424-A790 HydrophobicContact CG2-CB 3.9Å; I424-A790 WeakPolarHBondContact O-CA 3.49Å; G786-A790 PolarHBondContact O-N 2.82Å; I787-A790 WeakPolarHBondContact O-CB 3.28Å; I787-A790 PolarHBondContact O-N 3.33Å; A790-G792 VanDerWaalsContact C-N 3.27Å; A790-G792 PolarHBondContact O-N 3.27Å; A790-C793 PolarHBondContact O-N 2.97Å; A790-N794 PolarHBondContact O-N 3.48Å; A790-M795 PolarHBondContact O-N 3.23Å; A790-F834 HydrophobicContact CB-CD1 4.16Å; A790-F834 HydrophobicContact CB-CE1 3.88Å; A790-F834 HydrophobicContact CB-CE2 4.42Å; A790-F834 HydrophobicContact CB-CZ 4.04Å
791	G	84.3	Confident	89.8	Confident	0 Å²	0	6.4 Å²	6.4	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	62.3	30.7	-175.5	0	0	0	0	0	113.8	I424 M425 D789 N794	I424-G791 PolarHBondContact O-N 3.29Å; M425-G791 CarbonylContact O-C 3.54Å; M425-G791 WeakPolarHBondContact O-CA 3.22Å; M425-G791 PolarHBondContact O-N 2.84Å; D789-G791 PolarHBondContact O-N 3.02Å; G791-N794 WeakPolarHBondContact O-CB 2.84Å; G791-N794 PolarHBondContact O-N 3.42Å; G791-N794 PolarHBondContact O-ND2 2.73Å
792	G	84.5	Confident	89	Confident	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	61.5	46.3	-170.8	0	0	0	0	0	112.9	K396 M425 D789 A790 N794	K396-G792 PolarHBondContact N-O 2.63Å; M425-G792 PolarHBondContact O-N 2.9Å; D789-G792 WeakPolarHBondContact O-CA 3.23Å; D789-G792 PolarHBondContact O-N 3.29Å; A790-G792 VanDerWaalsContact C-N 3.27Å; A790-G792 PolarHBondContact O-N 3.27Å; G792-N794 VanDerWaalsContact C-N 3.26Å; G792-N794 PolarHBondContact O-N 3.33Å; G792-N794 PolarHBondContact O-ND2 2.95Å
793	C	88	Confident	88	Confident	7 Å²	7	11.8 Å²	11.8	5%	0.047	6%	0.062	C	C	.	.	H	α-helix	trans	65.8	15.7	-175.7	-55.5	0	0	0	0	115.7	D789 A790 Y864 R962	D789-C793 PolarHBondContact O-N 3.22Å; D789-C793 PolarHBondContact OD1-SG 3.36Å; A790-C793 PolarHBondContact O-N 2.97Å; C793-Y864 HydrophobicContact CB-CD1 3.89Å; C793-Y864 HydrophobicContact CB-CE1 4.27Å; C793-R962 PolarHBondContact O-NE 2.99Å; C793-R962 VanDerWaalsContact O-NE 3.12Å
794	N	90.3	Very high	87.1	Confident	0 Å²	0	13 Å²	13	0%	0	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-6.9	-177.1	-61.1	-68.4	0	0	0	114.8	F390 L391 N394 Q748 A790 G791 G792 T837 Y864	F390-N794 HydrophobicContact CE1-CB 3.78Å; F390-N794 HydrophobicContact CZ-CB 3.95Å; L391-N794 HydrophobicContact CD2-CB 3.84Å; N394-N794 PolarHBondContact O-ND2 3.13Å; Q748-N794 PolarHBondContact NE2-O 3.46Å; A790-N794 PolarHBondContact O-N 3.48Å; G791-N794 WeakPolarHBondContact O-CB 2.84Å; G791-N794 PolarHBondContact O-N 3.42Å; G791-N794 PolarHBondContact O-ND2 2.73Å; G792-N794 VanDerWaalsContact C-N 3.26Å; G792-N794 PolarHBondContact O-N 3.33Å; G792-N794 PolarHBondContact O-ND2 2.95Å; N794-T837 PolarHBondContact O-N 3.38Å; N794-T837 PolarHBondContact O-OG1 2.84Å; N794-Y864 PolarHBondContact OD1-OH 3.15Å
795	M	91	Very high	86.4	Confident	8 Å²	8	14.6 Å²	14.6	4%	0.039	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	151.2	177.6	-62.8	-159.8	-87	0	0	112.4	L391 C427 Q748 A790 F834 T835 P836	L391-M795 HydrophobicContact CD1-CE 4.16Å; L391-M795 HydrophobicContact CD1-SD 4.11Å; L391-M795 HydrophobicContact CD2-CG 4Å; L391-M795 HydrophobicContact CD2-SD 4.41Å; C427-M795 HydrophobicContact CB-CE 3.56Å; C427-M795 WeakPolarHBondContact O-CE 3.45Å; Q748-M795 WeakPolarHBondContact CG-O 3.3Å; Q748-M795 VanDerWaalsContact NE2-N 3.2Å; Q748-M795 PolarHBondContact NE2-O 2.92Å; A790-M795 PolarHBondContact O-N 3.23Å; M795-F834 HydrophobicContact CB-CB 3.99Å; M795-F834 HydrophobicContact CE-CB 4.21Å; M795-F834 HydrophobicContact SD-CB 3.76Å; M795-T835 WeakPolarHBondContact CA-O 3.43Å; M795-P836 HydrophobicContact CG-CB 4.39Å; M795-P836 HydrophobicContact CG-CG 4.19Å; M795-P836 HydrophobicContact SD-CG 3.98Å
796	T	91.9	Very high	86.1	Confident	26 Å²	26	15.9 Å²	15.9	16%	0.16	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	152	173.7	-169	0	0	0	0	108.9	F834 T835 T837	T796-F834 WeakPolarHBondContact O-CA 3.27Å; T796-T835 PolarHBondContact N-O 2.97Å; T796-T835 PolarHBondContact O-N 3.44Å; T796-T837 HydrophobicContact CG2-CG2 3.53Å
797	I	92.1	Very high	85.8	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	134.8	161	-65.6	167.1	0	0	0	107	A712 M744 I747 I787 L814 I830 A833 F834	A712-I797 HydrophobicContact CB-CB 4.15Å; A712-I797 HydrophobicContact CB-CG2 3.79Å; M744-I797 HydrophobicContact CB-CD1 4.28Å; M744-I797 HydrophobicContact CE-CD1 4.25Å; M744-I797 HydrophobicContact CG-CD1 3.72Å; M744-I797 HydrophobicContact SD-CD1 4.37Å; I747-I797 HydrophobicContact CD1-CG1 4.26Å; I787-I797 HydrophobicContact CG2-CD1 4.13Å; I797-L814 HydrophobicContact CG2-CD1 3.98Å; I797-L814 HydrophobicContact CG2-CD2 4.33Å; I797-I830 HydrophobicContact CD1-CD1 4.39Å; I797-A833 HydrophobicContact CG2-CB 4.39Å; I797-F834 HydrophobicContact CD1-CE1 4.01Å; I797-F834 HydrophobicContact CG1-CD1 3.79Å; I797-F834 HydrophobicContact CG1-CE1 3.72Å
798	S	86.5	Confident	85.5	Confident	22 Å²	22	18.4 Å²	18.4	15%	0.154	11%	0.108	C	C	.	.			trans	-158.1	126.3	166.6	-146.5	0	0	0	0	112.3	Q800 A810	S798-Q800 PolarHBondContact O-N 3.21Å; S798-A810 VanDerWaalsContact O-CB 3.31Å; S798-A810 WeakPolarHBondContact O-CB 3.14Å
799	L	86.9	Confident	85.4	Confident	5 Å²	5	18.9 Å²	18.9	3%	0.026	11%	0.112	C	C	.	.	S	Bend	trans	-78.7	-3.4	171.3	-62.6	83.3	0	0	0	111.9	F675 F678 I709 A806 N807 L814	F675-L799 HydrophobicContact CD1-CD2 3.8Å; F675-L799 HydrophobicContact CE1-CD2 4.12Å; F678-L799 HydrophobicContact CB-CD2 4.45Å; F678-L799 HydrophobicContact CD1-CB 4.05Å; F678-L799 HydrophobicContact CD1-CD2 3.74Å; F678-L799 HydrophobicContact CD2-CB 3.59Å; F678-L799 HydrophobicContact CE1-CB 4.12Å; F678-L799 HydrophobicContact CE1-CD2 4.12Å; F678-L799 HydrophobicContact CE2-CB 3.68Å; F678-L799 WeakPolarHBondContact CE2-O 3.49Å; F678-L799 HydrophobicContact CG-CB 3.81Å; F678-L799 HydrophobicContact CG-CD2 4.06Å; F678-L799 HydrophobicContact CG-CG 4.44Å; F678-L799 HydrophobicContact CZ-CB 3.95Å; I709-L799 HydrophobicContact CG2-CD1 4.16Å; I709-L799 HydrophobicContact CG2-CD2 3.97Å; I709-L799 WeakPolarHBondContact O-CD1 3.28Å; L799-A806 CarbonylContact O-C 3.56Å; L799-A806 WeakPolarHBondContact O-CA 3.41Å; L799-N807 PolarHBondContact O-N 3.28Å; L799-L814 HydrophobicContact CD1-CD1 3.52Å; L799-L814 HydrophobicContact CD2-CD1 4.26Å; L799-L814 HydrophobicContact CG-CD1 3.91Å
800	Q	86.5	Confident	85.4	Confident	36 Å²	36	18.4 Å²	18.4	17%	0.168	11%	0.11	C	C	.	.	B	Isolated β-bridge	trans	-107.8	130.4	174.6	-63.9	176.4	15.6	0	0	110.4	F678 S798 R965	F678-Q800 HydrophobicContact CD2-CG 3.8Å; F678-Q800 HydrophobicContact CE2-CG 3.64Å; F678-Q800 PolarHBondContact O-NE2 2.88Å; S798-Q800 PolarHBondContact O-N 3.21Å; Q800-R965 VanDerWaalsContact OE1-CZ 3.28Å
801	T	81.8	Confident	85.4	Confident	7 Å²	7	18.4 Å²	18.4	4%	0.043	11%	0.11	C	C	.	.			trans	-62.8	166.7	158.8	60.6	0	0	0	0	110.5	E273 N274 T803 G804 N805 N807	E273-T801 HydrophobicContact CG-CG2 4.2Å; E273-T801 VanDerWaalsContact O-CG2 3.31Å; E273-T801 WeakPolarHBondContact O-CG2 3.43Å; N274-T801 WeakPolarHBondContact OD1-CB 3.16Å; N274-T801 PolarHBondContact OD1-OG1 2.83Å; T801-T803 PolarHBondContact O-N 2.82Å; T801-T803 VanDerWaalsContact O-N 3.15Å; T801-T803 PolarHBondContact OG1-OG1 2.86Å; T801-G804 PolarHBondContact O-N 3.26Å; T801-G804 VanDerWaalsContact O-N 3.12Å; T801-G804 PolarHBondContact OG1-N 2.99Å; T801-N805 HydrophobicContact CG2-CB 4.43Å; T801-N805 WeakPolarHBondContact CG2-O 3.45Å; T801-N805 PolarHBondContact N-O 2.85Å; T801-N805 WeakPolarHBondContact OG1-CA 3.46Å; T801-N805 WeakPolarHBondContact OG1-CB 3.4Å; T801-N805 PolarHBondContact OG1-N 2.96Å; T801-N805 PolarHBondContact OG1-O 3.07Å; T801-N807 HydrophobicContact CG2-CB 4.22Å
802	R	76.1	Confident	85.8	Confident	66 Å²	66	18.4 Å²	18.4	25%	0.249	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-9.7	178	-69.8	178.5	-93.7	81.8	13.9	113.8	E273 Q987 G988 G989	E273-R802 WeakPolarHBondContact OE1-CB 3.39Å; E273-R802 IonicContact OE1-CZ 2.75Å; E273-R802 PolarHBondContact OE1-N 3.46Å; E273-R802 IonicContact OE1-NE 3.88Å; E273-R802 IonicContact OE1-NH1 2.62Å; E273-R802 PolarHBondContact OE1-NH1 3.02Å; E273-R802 IonicContact OE1-NH2 3.71Å; E273-R802 PolarHBondContact OE1-NH2 3.19Å; E273-R802 IonicContact OE2-CZ 3.18Å; E273-R802 IonicContact OE2-NH1 2.76Å; E273-R802 PolarHBondContact OE2-NH1 3.29Å; E273-R802 IonicContact OE2-NH2 2.69Å; E273-R802 PolarHBondContact OE2-NH2 3.35Å; R802-Q987 WeakPolarHBondContact CB-O 3.47Å; R802-Q987 WeakPolarHBondContact CD-O 3.41Å; R802-G988 PolarHBondContact NH1-O 3.25Å; R802-G989 VanDerWaalsContact CZ-CA 3.48Å
803	T	72	Confident	86.1	Confident	47 Å²	47	18.4 Å²	18.4	29%	0.288	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-21.3	171.9	68.3	0	0	0	0	113.7	N274 T801 N805	N274-T803 VanDerWaalsContact ND2-CG2 3.26Å; N274-T803 WeakPolarHBondContact ND2-CG2 3.39Å; N274-T803 VanDerWaalsContact OD1-CG2 3.31Å; N274-T803 WeakPolarHBondContact OD1-CG2 3.49Å; N274-T803 PolarHBondContact OD1-OG1 3.38Å; T801-T803 PolarHBondContact O-N 2.82Å; T801-T803 VanDerWaalsContact O-N 3.15Å; T801-T803 PolarHBondContact OG1-OG1 2.86Å; T803-N805 PolarHBondContact OG1-N 3.4Å
804	G	74.1	Confident	86.4	Confident	26 Å²	26	18.1 Å²	18.1	27%	0.268	11%	0.108	S	C	.	.	S	Bend	trans	104.5	-6.5	-172.4	0	0	0	0	0	114.8	T801	T801-G804 PolarHBondContact O-N 3.26Å; T801-G804 VanDerWaalsContact O-N 3.12Å; T801-G804 PolarHBondContact OG1-N 2.99Å
805	N	79.3	Confident	86.5	Confident	34 Å²	34	18.1 Å²	18.1	18%	0.182	11%	0.108	C	C	.	.			trans	-66.5	152.1	169.2	-71.3	-4.6	0	0	0	111.2	T801 T803	T801-N805 HydrophobicContact CG2-CB 4.43Å; T801-N805 WeakPolarHBondContact CG2-O 3.45Å; T801-N805 PolarHBondContact N-O 2.85Å; T801-N805 WeakPolarHBondContact OG1-CA 3.46Å; T801-N805 WeakPolarHBondContact OG1-CB 3.4Å; T801-N805 PolarHBondContact OG1-N 2.96Å; T801-N805 PolarHBondContact OG1-O 3.07Å; T803-N805 PolarHBondContact OG1-N 3.4Å
806	A	84.1	Confident	86.6	Confident	34 Å²	34	17.7 Å²	17.7	28%	0.281	11%	0.106	S	C	.	.	B	Isolated β-bridge	trans	-68.2	131.8	176.4	0	0	0	0	0	111.1	Y608 F678 L799 M808	Y608-A806 WeakPolarHBondContact OH-CB 3.41Å; F678-A806 HydrophobicContact CZ-CB 3.96Å; L799-A806 CarbonylContact O-C 3.56Å; L799-A806 WeakPolarHBondContact O-CA 3.41Å; A806-M808 PolarHBondContact O-N 3.17Å
807	N	86.3	Confident	86.7	Confident	30 Å²	30	16.5 Å²	16.5	16%	0.16	10%	0.098	C	C	.	.			trans	-83.3	101.5	174.1	178.7	-8.5	0	0	0	109.4	L799 T801 A809 A810 A811	L799-N807 PolarHBondContact O-N 3.28Å; T801-N807 HydrophobicContact CG2-CB 4.22Å; N807-A809 PolarHBondContact O-N 3.29Å; N807-A809 PolarHBondContact OD1-N 3.47Å; N807-A809 VanDerWaalsContact OD1-N 3.16Å; N807-A810 HydrophobicContact CB-CB 3.96Å; N807-A810 PolarHBondContact O-N 3.4Å; N807-A810 VanDerWaalsContact O-N 3.17Å; N807-A810 PolarHBondContact OD1-N 3.07Å; N807-A811 PolarHBondContact O-N 3.11Å
808	M	86.8	Confident	86.7	Confident	23 Å²	23	16.6 Å²	16.6	11%	0.113	10%	0.099	C	C	.	.	H	α-helix	trans	-53	-48.2	179.8	-176.6	-179.4	77.2	0	0	112.6	T276 L572 Y608 A806 A810 A811 V812	T276-M808 HydrophobicContact CG2-SD 4.13Å; L572-M808 HydrophobicContact CD1-CG 4.36Å; L572-M808 HydrophobicContact CD2-CE 3.75Å; L572-M808 HydrophobicContact CD2-CG 3.85Å; L572-M808 HydrophobicContact CD2-SD 3.67Å; L572-M808 HydrophobicContact CG-CE 4.44Å; L572-M808 HydrophobicContact CG-CG 4.19Å; L572-M808 HydrophobicContact CG-SD 3.8Å; Y608-M808 HydrophobicContact CD1-CB 4.48Å; Y608-M808 HydrophobicContact CD1-CG 3.86Å; Y608-M808 HydrophobicContact CD1-SD 4.36Å; Y608-M808 HydrophobicContact CE1-CB 3.76Å; Y608-M808 HydrophobicContact CE1-CG 3.63Å; Y608-M808 HydrophobicContact CE1-SD 4.45Å; A806-M808 PolarHBondContact O-N 3.17Å; M808-A810 VanDerWaalsContact C-N 3.3Å; M808-A810 PolarHBondContact O-N 2.94Å; M808-A811 PolarHBondContact O-N 3.44Å; M808-V812 WeakPolarHBondContact O-CB 3.28Å; M808-V812 VanDerWaalsContact O-CG2 3.28Å; M808-V812 WeakPolarHBondContact O-CG2 3.26Å; M808-V812 PolarHBondContact O-N 3.07Å
809	A	89.4	Confident	87	Confident	15 Å²	15	15.7 Å²	15.7	12%	0.124	9%	0.092	C	C	.	.	H	α-helix	trans	-64.5	-35.3	-178.7	0	0	0	0	0	112.1	M537 N807 G813 L832	M537-A809 HydrophobicContact CE-CB 4.15Å; N807-A809 PolarHBondContact O-N 3.29Å; N807-A809 PolarHBondContact OD1-N 3.47Å; N807-A809 VanDerWaalsContact OD1-N 3.16Å; A809-G813 PolarHBondContact O-N 3.03Å; A809-L832 VanDerWaalsContact O-CB 3.28Å; A809-L832 WeakPolarHBondContact O-CB 3.4Å
810	A	90.6	Very high	87.1	Confident	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-73.8	-39	176.9	0	0	0	0	0	113.3	S798 N807 M808 G813 L814 A833	S798-A810 VanDerWaalsContact O-CB 3.31Å; S798-A810 WeakPolarHBondContact O-CB 3.14Å; N807-A810 HydrophobicContact CB-CB 3.96Å; N807-A810 PolarHBondContact O-N 3.4Å; N807-A810 VanDerWaalsContact O-N 3.17Å; N807-A810 PolarHBondContact OD1-N 3.07Å; M808-A810 VanDerWaalsContact C-N 3.3Å; M808-A810 PolarHBondContact O-N 2.94Å; A810-G813 PolarHBondContact O-N 3.38Å; A810-L814 WeakPolarHBondContact O-CB 3.35Å; A810-L814 WeakPolarHBondContact O-CG 3.48Å; A810-L814 PolarHBondContact O-N 3.33Å; A810-A833 HydrophobicContact CB-CB 4.24Å
811	A	91.3	Very high	87.3	Confident	1 Å²	1	17.2 Å²	17.2	1%	0.008	10%	0.096	C	C	.	.	H	α-helix	trans	-61.6	-48	174.2	0	0	0	0	0	111.2	Y608 M639 N807 M808 L814 L815	Y608-A811 HydrophobicContact CE2-CB 3.76Å; M639-A811 HydrophobicContact CE-CB 4.4Å; M639-A811 HydrophobicContact SD-CB 4.48Å; N807-A811 PolarHBondContact O-N 3.11Å; M808-A811 PolarHBondContact O-N 3.44Å; A811-L814 PolarHBondContact O-N 2.88Å; A811-L815 WeakPolarHBondContact O-CB 3.49Å; A811-L815 PolarHBondContact O-N 3.01Å
812	V	92.4	Very high	87.6	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-61.7	-46.1	175.7	171.5	0	0	0	0	111.9	M537 L569 L572 L605 M639 M808 L814 L815 I816	M537-V812 HydrophobicContact SD-CG1 4.04Å; L569-V812 HydrophobicContact CD2-CG1 3.57Å; L572-V812 HydrophobicContact CD1-CG2 3.58Å; L572-V812 HydrophobicContact CD2-CG2 3.86Å; L572-V812 HydrophobicContact CG-CG2 4.4Å; L605-V812 HydrophobicContact CD2-CB 4.16Å; L605-V812 HydrophobicContact CD2-CG1 3.77Å; L605-V812 HydrophobicContact CD2-CG2 3.64Å; M639-V812 HydrophobicContact CE-CG2 3.77Å; M808-V812 WeakPolarHBondContact O-CB 3.28Å; M808-V812 VanDerWaalsContact O-CG2 3.28Å; M808-V812 WeakPolarHBondContact O-CG2 3.26Å; M808-V812 PolarHBondContact O-N 3.07Å; V812-L814 VanDerWaalsContact C-N 3.34Å; V812-L814 PolarHBondContact O-N 2.86Å; V812-L815 PolarHBondContact O-N 3.02Å; V812-I816 HydrophobicContact CG1-CD1 3.85Å; V812-I816 PolarHBondContact O-N 3.2Å
813	G	91.7	Very high	88.3	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-59.3	-42	179	0	0	0	0	0	113.3	A809 A810 F817 F829	A809-G813 PolarHBondContact O-N 3.03Å; A810-G813 PolarHBondContact O-N 3.38Å; G813-F817 WeakPolarHBondContact O-CB 3.45Å; G813-F817 PolarHBondContact O-N 2.88Å; G813-F829 WeakPolarHBondContact CA-O 3.25Å
814	L	92.8	Very high	89.2	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-71.7	-42.3	175.2	-69.6	172.6	0	0	0	112.1	F675 I709 M744 I797 L799 A810 A811 V812 I816 F817 Q818 A833	F675-L814 HydrophobicContact CE1-CB 3.99Å; F675-L814 HydrophobicContact CZ-CB 3.93Å; I709-L814 HydrophobicContact CG2-CD1 4.35Å; M744-L814 HydrophobicContact CE-CD2 4Å; I797-L814 HydrophobicContact CG2-CD1 3.98Å; I797-L814 HydrophobicContact CG2-CD2 4.33Å; L799-L814 HydrophobicContact CD1-CD1 3.52Å; L799-L814 HydrophobicContact CD2-CD1 4.26Å; L799-L814 HydrophobicContact CG-CD1 3.91Å; A810-L814 WeakPolarHBondContact O-CB 3.35Å; A810-L814 WeakPolarHBondContact O-CG 3.48Å; A810-L814 PolarHBondContact O-N 3.33Å; A811-L814 PolarHBondContact O-N 2.88Å; V812-L814 VanDerWaalsContact C-N 3.34Å; V812-L814 PolarHBondContact O-N 2.86Å; L814-I816 VanDerWaalsContact C-N 3.35Å; L814-I816 PolarHBondContact O-N 3.02Å; L814-F817 PolarHBondContact O-N 3.5Å; L814-Q818 WeakPolarHBondContact O-CG 3.43Å; L814-Q818 PolarHBondContact O-N 2.99Å; L814-A833 HydrophobicContact CD1-CB 4.49Å; L814-A833 HydrophobicContact CD2-CB 4.02Å; L814-A833 HydrophobicContact CG-CB 3.84Å
815	L	93.1	Very high	90	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-56.7	-48.6	177.9	-173.9	79.6	0	0	0	111.3	L601 A604 L605 M639 W668 F675 A811 V812 Q818 N819	L601-L815 HydrophobicContact CD2-CD2 4.44Å; L601-L815 HydrophobicContact CD2-CG 4.42Å; A604-L815 HydrophobicContact CB-CD2 4.44Å; L605-L815 HydrophobicContact CD2-CD2 4.03Å; L605-L815 HydrophobicContact CG-CD2 4.34Å; M639-L815 HydrophobicContact CE-CD2 4Å; M639-L815 HydrophobicContact CG-CD1 4.3Å; M639-L815 HydrophobicContact CG-CD2 3.83Å; M639-L815 HydrophobicContact SD-CB 4.4Å; M639-L815 HydrophobicContact SD-CD1 4.37Å; M639-L815 HydrophobicContact SD-CD2 4.05Å; W668-L815 HydrophobicContact CH2-CD1 4.12Å; W668-L815 HydrophobicContact CZ3-CD1 3.8Å; F675-L815 HydrophobicContact CE2-CD1 4.49Å; F675-L815 HydrophobicContact CZ-CB 4.34Å; A811-L815 WeakPolarHBondContact O-CB 3.49Å; A811-L815 PolarHBondContact O-N 3.01Å; V812-L815 PolarHBondContact O-N 3.02Å; L815-Q818 PolarHBondContact O-N 3.03Å; L815-N819 PolarHBondContact O-ND2 3.48Å
816	I	93.7	Very high	90.6	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-70.3	-41	-179.8	-63.4	171.3	0	0	0	110.5	I565 L569 L605 V812 L814 Q818 N819 L826 F829	I565-I816 HydrophobicContact CG2-CD1 4.02Å; L569-I816 HydrophobicContact CD2-CD1 3.88Å; L569-I816 HydrophobicContact CG-CD1 4.5Å; L605-I816 HydrophobicContact CD1-CD1 4.36Å; V812-I816 HydrophobicContact CG1-CD1 3.85Å; V812-I816 PolarHBondContact O-N 3.2Å; L814-I816 VanDerWaalsContact C-N 3.35Å; L814-I816 PolarHBondContact O-N 3.02Å; I816-Q818 VanDerWaalsContact C-N 3.29Å; I816-Q818 PolarHBondContact O-N 3.4Å; I816-N819 WeakPolarHBondContact O-CB 3.48Å; I816-N819 PolarHBondContact O-N 3.3Å; I816-L826 HydrophobicContact CG2-CB 4.06Å; I816-L826 HydrophobicContact CG2-CD1 4.29Å; I816-L826 HydrophobicContact CG2-CD2 3.9Å; I816-L826 HydrophobicContact CG2-CG 4.29Å; I816-F829 HydrophobicContact CB-CB 4.01Å; I816-F829 HydrophobicContact CB-CD1 4.12Å; I816-F829 HydrophobicContact CB-CG 3.98Å; I816-F829 HydrophobicContact CD1-CD1 3.65Å; I816-F829 HydrophobicContact CD1-CE1 3.72Å; I816-F829 HydrophobicContact CD1-CG 4.37Å; I816-F829 HydrophobicContact CD1-CZ 4.49Å; I816-F829 HydrophobicContact CG1-CD1 4.49Å; I816-F829 HydrophobicContact CG2-CB 3.85Å; I816-F829 HydrophobicContact CG2-CD1 3.85Å; I816-F829 HydrophobicContact CG2-CD2 3.54Å; I816-F829 HydrophobicContact CG2-CE1 4.25Å; I816-F829 HydrophobicContact CG2-CE2 3.96Å; I816-F829 HydrophobicContact CG2-CG 3.47Å; I816-F829 VanDerWaalsContact CG2-CG 3.47Å; I816-F829 HydrophobicContact CG2-CZ 4.31Å
817	F	93.5	Very high	91	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-54.1	-41	175.3	167.5	-94.9	0	0	0	112.8	M705 I740 M744 G813 L814 N819 F820 T827 I830	M705-F817 HydrophobicContact CE-CE1 4.44Å; I740-F817 HydrophobicContact CG2-CE1 4.14Å; I740-F817 HydrophobicContact CG2-CZ 3.93Å; M744-F817 HydrophobicContact CE-CD1 4.11Å; M744-F817 HydrophobicContact CE-CE1 3.5Å; M744-F817 HydrophobicContact CE-CZ 4.08Å; G813-F817 WeakPolarHBondContact O-CB 3.45Å; G813-F817 PolarHBondContact O-N 2.88Å; L814-F817 PolarHBondContact O-N 3.5Å; F817-N819 PolarHBondContact O-N 3.42Å; F817-F820 HydrophobicContact CE1-CD1 4.27Å; F817-F820 HydrophobicContact CE1-CE1 4.26Å; F817-F820 HydrophobicContact CE2-CD1 4.36Å; F817-F820 HydrophobicContact CZ-CD1 4.16Å; F817-F820 HydrophobicContact CZ-CE1 4.25Å; F817-F820 WeakPolarHBondContact O-CB 3.47Å; F817-F820 WeakPolarHBondContact O-CD1 3.45Å; F817-F820 PolarHBondContact O-N 3.46Å; F817-T827 HydrophobicContact CD2-CG2 3.99Å; F817-T827 HydrophobicContact CE2-CG2 3.7Å; F817-I830 HydrophobicContact CB-CB 4.45Å; F817-I830 HydrophobicContact CD2-CB 3.72Å; F817-I830 HydrophobicContact CD2-CD1 4.04Å; F817-I830 HydrophobicContact CD2-CG1 4.23Å; F817-I830 HydrophobicContact CD2-CG2 4.41Å; F817-I830 HydrophobicContact CE2-CB 4.25Å; F817-I830 HydrophobicContact CE2-CD1 3.77Å; F817-I830 HydrophobicContact CE2-CG1 4.46Å; F817-I830 HydrophobicContact CG-CB 4.22Å; F817-I830 HydrophobicContact CZ-CD1 4.06Å
818	Q	92.6	Very high	91.3	Very high	3 Å²	3	13.8 Å²	13.8	1%	0.014	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-16.5	179.5	-70.9	-54.3	103.3	0	0	114.6	W668 T671 I709 L814 L815 I816 F820	W668-Q818 HydrophobicContact CH2-CB 3.5Å; W668-Q818 HydrophobicContact CH2-CG 4.28Å; W668-Q818 HydrophobicContact CZ2-CB 3.72Å; W668-Q818 HydrophobicContact CZ3-CB 4.36Å; T671-Q818 HydrophobicContact CG2-CG 4.3Å; I709-Q818 HydrophobicContact CD1-CG 4.18Å; L814-Q818 WeakPolarHBondContact O-CG 3.43Å; L814-Q818 PolarHBondContact O-N 2.99Å; L815-Q818 PolarHBondContact O-N 3.03Å; I816-Q818 VanDerWaalsContact C-N 3.29Å; I816-Q818 PolarHBondContact O-N 3.4Å; Q818-F820 VanDerWaalsContact C-N 3.32Å
819	N	91.3	Very high	91.6	Very high	3 Å²	3	12.7 Å²	12.7	2%	0.016	6%	0.058	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	8.9	178.3	-65.7	-81.2	0	0	0	113.9	L601 W631 W668 L815 I816 F817 W821 F822 W823 L826	L601-N819 HydrophobicContact CD1-CB 4.32Å; L601-N819 WeakPolarHBondContact CD2-ND2 3.42Å; W631-N819 WeakPolarHBondContact CH2-OD1 3.39Å; W631-N819 VanDerWaalsContact CZ2-OD1 3.26Å; W631-N819 WeakPolarHBondContact CZ2-OD1 3.43Å; W668-N819 WeakPolarHBondContact CZ2-ND2 3.36Å; W668-N819 WeakPolarHBondContact CZ2-OD1 3.39Å; L815-N819 PolarHBondContact O-ND2 3.48Å; I816-N819 WeakPolarHBondContact O-CB 3.48Å; I816-N819 PolarHBondContact O-N 3.3Å; F817-N819 PolarHBondContact O-N 3.42Å; N819-W821 PolarHBondContact O-N 3.17Å; N819-F822 PolarHBondContact O-N 2.94Å; N819-W823 PolarHBondContact O-N 3.12Å; N819-L826 HydrophobicContact CB-CD1 3.78Å
820	F	90	Very high	91.7	Very high	4 Å²	4	12 Å²	12	2%	0.018	5%	0.052	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-20	177.1	72.1	-112.2	0	0	0	114.4	Y701 I740 F779 F817 Q818 H824	Y701-F820 WeakPolarHBondContact OH-CZ 3.37Å; I740-F820 HydrophobicContact CD1-CE1 4.16Å; I740-F820 HydrophobicContact CD1-CZ 4.03Å; F779-F820 HydrophobicContact CE1-CD2 4.49Å; F817-F820 HydrophobicContact CE1-CD1 4.27Å; F817-F820 HydrophobicContact CE1-CE1 4.26Å; F817-F820 HydrophobicContact CE2-CD1 4.36Å; F817-F820 HydrophobicContact CZ-CD1 4.16Å; F817-F820 HydrophobicContact CZ-CE1 4.25Å; F817-F820 WeakPolarHBondContact O-CB 3.47Å; F817-F820 WeakPolarHBondContact O-CD1 3.45Å; F817-F820 PolarHBondContact O-N 3.46Å; Q818-F820 VanDerWaalsContact C-N 3.32Å; F820-H824 PolarHBondContact O-ND1 3.01Å
821	W	89.7	Confident	91.8	Very high	68 Å²	68	12.1 Å²	12.1	26%	0.258	5%	0.053	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-43.8	175.5	-74.7	53.7	0	0	0	112.5	R667 Y701 F733 N819	R667-W821 VanDerWaalsContact NH1-CE3 3.33Å; R667-W821 VanDerWaalsContact NH1-CG 3.29Å; Y701-W821 AromaticContact CD1-CZ2 3.79Å; Y701-W821 HydrophobicContact CD1-CZ2 3.79Å; Y701-W821 AromaticContact CD2-CZ2 3.75Å; Y701-W821 HydrophobicContact CD2-CZ2 3.75Å; Y701-W821 AromaticContact CE1-CE2 3.99Å; Y701-W821 AromaticContact CE1-CZ2 3.73Å; Y701-W821 HydrophobicContact CE1-CZ2 3.73Å; Y701-W821 AromaticContact CE1-NE1 3.75Å; Y701-W821 AromaticContact CE2-CZ2 3.66Å; Y701-W821 HydrophobicContact CE2-CZ2 3.66Å; Y701-W821 AromaticContact CE2-NE1 3.82Å; Y701-W821 AromaticContact CG-CZ2 3.81Å; Y701-W821 HydrophobicContact CG-CZ2 3.81Å; Y701-W821 AromaticContact CZ-CE2 3.75Å; Y701-W821 AromaticContact CZ-CZ2 3.66Å; Y701-W821 AromaticContact CZ-NE1 3.25Å; Y701-W821 VanDerWaalsContact CZ-NE1 3.25Å; Y701-W821 PolarHBondContact OH-NE1 3.08Å; F733-W821 HydrophobicContact CB-CH2 4.06Å; F733-W821 HydrophobicContact CB-CZ2 4.19Å; F733-W821 AromaticContact CD2-CH2 3.47Å; F733-W821 HydrophobicContact CD2-CH2 3.47Å; F733-W821 VanDerWaalsContact CD2-CH2 3.47Å; F733-W821 AromaticContact CD2-CZ2 3.98Å; F733-W821 HydrophobicContact CD2-CZ2 3.98Å; F733-W821 HydrophobicContact CD2-CZ3 4.46Å; F733-W821 AromaticContact CE2-CH2 3.91Å; F733-W821 HydrophobicContact CE2-CH2 3.91Å; F733-W821 AromaticContact CG-CH2 3.81Å; F733-W821 HydrophobicContact CG-CH2 3.81Å; F733-W821 HydrophobicContact CG-CZ2 4.35Å; N819-W821 PolarHBondContact O-N 3.17Å
822	F	89.6	Confident	91.8	Very high	69 Å²	69	12.5 Å²	12.5	30%	0.303	6%	0.055	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-37.7	-178	-56.4	-62.8	0	0	0	111.1	N819	N819-F822 PolarHBondContact O-N 2.94Å
823	W	91.2	Very high	91.8	Very high	23 Å²	23	12.5 Å²	12.5	9%	0.087	6%	0.055	C	C	.	.			trans	-139.2	98.7	-177.6	-159.8	-123.6	0	0	0	112.3	W448 H526 I558 N819 P825 L826	W448-W823 AromaticContact CD2-CH2 3.69Å; W448-W823 HydrophobicContact CD2-CH2 3.69Å; W448-W823 AromaticContact CD2-CZ2 3.83Å; W448-W823 HydrophobicContact CD2-CZ2 3.83Å; W448-W823 AromaticContact CE2-CH2 3.47Å; W448-W823 VanDerWaalsContact CE2-CH2 3.47Å; W448-W823 AromaticContact CE2-CZ2 3.88Å; W448-W823 HydrophobicContact CE3-CH2 4.05Å; W448-W823 AromaticContact CE3-CZ2 3.67Å; W448-W823 HydrophobicContact CE3-CZ2 3.67Å; W448-W823 HydrophobicContact CG-CH2 4.25Å; W448-W823 HydrophobicContact CH2-CH2 4.06Å; W448-W823 AromaticContact CH2-CZ2 3.7Å; W448-W823 HydrophobicContact CH2-CZ2 3.7Å; W448-W823 AromaticContact CZ2-CH2 3.68Å; W448-W823 HydrophobicContact CZ2-CH2 3.68Å; W448-W823 AromaticContact CZ2-CZ2 3.84Å; W448-W823 HydrophobicContact CZ2-CZ2 3.84Å; W448-W823 HydrophobicContact CZ3-CH2 4.22Å; W448-W823 AromaticContact CZ3-CZ2 3.61Å; W448-W823 HydrophobicContact CZ3-CZ2 3.61Å; W448-W823 AromaticContact NE1-CH2 3.83Å; H526-W823 AromaticContact CE1-CD1 3.97Å; H526-W823 AromaticContact CE1-CE2 3.7Å; H526-W823 AromaticContact CE1-CZ2 3.92Å; H526-W823 AromaticContact CE1-NE1 3.12Å; H526-W823 PolarHBondContact CE1-NE1 3.26Å; H526-W823 AromaticContact NE2-CD1 4Å; H526-W823 AromaticContact NE2-CE2 3.71Å; H526-W823 AromaticContact NE2-CZ2 3.9Å; H526-W823 AromaticContact NE2-NE1 2.97Å; H526-W823 PolarHBondContact NE2-NE1 3.03Å; I558-W823 HydrophobicContact CD1-CH2 4.09Å; I558-W823 HydrophobicContact CG2-CH2 3.87Å; I558-W823 HydrophobicContact CG2-CZ2 3.67Å; N819-W823 PolarHBondContact O-N 3.12Å; W823-P825 VanDerWaalsContact C-N 3.35Å; W823-P825 HydrophobicContact CD2-CG 4.41Å; W823-P825 HydrophobicContact CG-CG 4.44Å; W823-P825 HydrophobicContact CZ2-CG 4.48Å; W823-L826 HydrophobicContact CB-CD1 3.96Å; W823-L826 HydrophobicContact CB-CG 3.96Å; W823-L826 HydrophobicContact CG-CG 4.33Å; W823-L826 WeakPolarHBondContact O-CB 3.3Å; W823-L826 WeakPolarHBondContact O-CG 3.38Å; W823-L826 PolarHBondContact O-N 2.97Å; W823-L826 VanDerWaalsContact O-N 3.07Å
824	H	90.2	Very high	91.8	Very high	71 Å²	71	13.2 Å²	13.2	33%	0.329	6%	0.058	S	C	.	.	G	3₁₀ helix	trans	-54.6	-35	-178.6	-65	-14.3	0	0	0	115.3	F820 L826 T827	F820-H824 PolarHBondContact O-ND1 3.01Å; H824-L826 PolarHBondContact O-N 3.35Å; H824-L826 VanDerWaalsContact O-N 3.14Å; H824-T827 WeakPolarHBondContact O-CB 3.3Å; H824-T827 PolarHBondContact O-N 3.34Å; H824-T827 PolarHBondContact O-OG1 2.94Å
825	P	90.5	Very high	91.6	Very high	4 Å²	4	15 Å²	15	3%	0.026	7%	0.069	C	C	.	.	G	3₁₀ helix	trans	-57.7	-24.9	175.6	-27.6	36.3	0	0	0	114.8	F451 W823 T827 N828	F451-P825 HydrophobicContact CD1-CB 4.07Å; F451-P825 HydrophobicContact CD1-CG 4.08Å; F451-P825 HydrophobicContact CE1-CB 3.92Å; F451-P825 HydrophobicContact CE1-CG 4.32Å; W823-P825 VanDerWaalsContact C-N 3.35Å; W823-P825 HydrophobicContact CD2-CG 4.41Å; W823-P825 HydrophobicContact CG-CG 4.44Å; W823-P825 HydrophobicContact CZ2-CG 4.48Å; P825-T827 PolarHBondContact O-N 3.38Å; P825-N828 PolarHBondContact O-N 2.9Å; P825-N828 PolarHBondContact O-ND2 3.16Å
826	L	92.2	Very high	91.5	Very high	1 Å²	1	16 Å²	16	1%	0.005	8%	0.075	C	C	.	.	G	3₁₀ helix	trans	-63.5	-18.1	176.4	-59.8	-177.3	0	0	0	113.2	I565 I816 N819 W823 H824 N828 F829	I565-L826 HydrophobicContact CD1-CD1 4.33Å; I565-L826 HydrophobicContact CD1-CD2 4.06Å; I816-L826 HydrophobicContact CG2-CB 4.06Å; I816-L826 HydrophobicContact CG2-CD1 4.29Å; I816-L826 HydrophobicContact CG2-CD2 3.9Å; I816-L826 HydrophobicContact CG2-CG 4.29Å; N819-L826 HydrophobicContact CB-CD1 3.78Å; W823-L826 HydrophobicContact CB-CD1 3.96Å; W823-L826 HydrophobicContact CB-CG 3.96Å; W823-L826 HydrophobicContact CG-CG 4.33Å; W823-L826 WeakPolarHBondContact O-CB 3.3Å; W823-L826 WeakPolarHBondContact O-CG 3.38Å; W823-L826 PolarHBondContact O-N 2.97Å; W823-L826 VanDerWaalsContact O-N 3.07Å; H824-L826 PolarHBondContact O-N 3.35Å; H824-L826 VanDerWaalsContact O-N 3.14Å; L826-N828 PolarHBondContact O-N 2.96Å; L826-N828 VanDerWaalsContact O-N 3.07Å; L826-F829 HydrophobicContact CB-CD2 4.5Å; L826-F829 HydrophobicContact CD2-CD2 4.21Å; L826-F829 HydrophobicContact CD2-CE2 3.86Å; L826-F829 WeakPolarHBondContact O-CB 3.5Å; L826-F829 WeakPolarHBondContact O-CD2 3.46Å; L826-F829 PolarHBondContact O-N 3.42Å
827	T	91.4	Very high	91.2	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.081	C	C	.	.	G	3₁₀ helix	trans	-55.2	-29.6	176.3	-43.9	0	0	0	0	112	I420 I783 F817 H824 P825 F829 I830	I420-T827 HydrophobicContact CD1-CG2 4.5Å; I420-T827 HydrophobicContact CG2-CG2 3.79Å; I783-T827 HydrophobicContact CD1-CG2 4.47Å; F817-T827 HydrophobicContact CD2-CG2 3.99Å; F817-T827 HydrophobicContact CE2-CG2 3.7Å; H824-T827 WeakPolarHBondContact O-CB 3.3Å; H824-T827 PolarHBondContact O-N 3.34Å; H824-T827 PolarHBondContact O-OG1 2.94Å; P825-T827 PolarHBondContact O-N 3.38Å; T827-F829 PolarHBondContact O-N 2.95Å; T827-I830 WeakPolarHBondContact O-CG2 3.27Å; T827-I830 PolarHBondContact O-N 2.97Å
828	N	92.5	Very high	90.9	Very high	4 Å²	4	17.1 Å²	17.1	2%	0.021	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-67.5	-16.7	178.7	-67.5	-60.1	0	0	0	114.4	V459 F495 L499 P825 L826 I830 S831	V459-N828 HydrophobicContact CG2-CB 4.08Å; F495-N828 HydrophobicContact CE1-CB 4.36Å; F495-N828 HydrophobicContact CZ-CB 4.32Å; L499-N828 HydrophobicContact CD1-CB 3.98Å; P825-N828 PolarHBondContact O-N 2.9Å; P825-N828 PolarHBondContact O-ND2 3.16Å; L826-N828 PolarHBondContact O-N 2.96Å; L826-N828 VanDerWaalsContact O-N 3.07Å; N828-I830 PolarHBondContact O-N 3.49Å; N828-S831 VanDerWaalsContact O-CB 3.27Å; N828-S831 WeakPolarHBondContact O-CB 3.42Å; N828-S831 PolarHBondContact O-N 3.45Å; N828-S831 VanDerWaalsContact O-N 3.15Å; N828-S831 PolarHBondContact O-OG 3.46Å
829	F	93.4	Very high	90.7	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-67.9	-17.3	176.1	-77.9	-100.1	0	0	0	113.3	F495 L530 L534 L569 G813 I816 L826 T827 S831 L832	F495-F829 HydrophobicContact CE2-CD2 4.44Å; F495-F829 AromaticContact CE2-CE2 3.63Å; F495-F829 HydrophobicContact CE2-CE2 3.63Å; F495-F829 AromaticContact CE2-CZ 3.88Å; F495-F829 HydrophobicContact CE2-CZ 3.88Å; F495-F829 HydrophobicContact CZ-CD2 4.02Å; F495-F829 AromaticContact CZ-CE2 3.5Å; F495-F829 HydrophobicContact CZ-CE2 3.5Å; F495-F829 VanDerWaalsContact CZ-CE2 3.5Å; F495-F829 HydrophobicContact CZ-CZ 4.23Å; L530-F829 HydrophobicContact CD2-CZ 4.27Å; L534-F829 HydrophobicContact CD1-CE1 4.13Å; L534-F829 HydrophobicContact CD1-CZ 4.17Å; L534-F829 HydrophobicContact CD2-CD1 4.05Å; L534-F829 HydrophobicContact CD2-CE1 3.59Å; L534-F829 HydrophobicContact CD2-CZ 4.42Å; L534-F829 HydrophobicContact CG-CE1 3.89Å; L534-F829 HydrophobicContact CG-CZ 4.27Å; L569-F829 HydrophobicContact CD1-CE1 4.01Å; L569-F829 HydrophobicContact CD1-CZ 4.47Å; G813-F829 WeakPolarHBondContact CA-O 3.25Å; I816-F829 HydrophobicContact CB-CB 4.01Å; I816-F829 HydrophobicContact CB-CD1 4.12Å; I816-F829 HydrophobicContact CB-CG 3.98Å; I816-F829 HydrophobicContact CD1-CD1 3.65Å; I816-F829 HydrophobicContact CD1-CE1 3.72Å; I816-F829 HydrophobicContact CD1-CG 4.37Å; I816-F829 HydrophobicContact CD1-CZ 4.49Å; I816-F829 HydrophobicContact CG1-CD1 4.49Å; I816-F829 HydrophobicContact CG2-CB 3.85Å; I816-F829 HydrophobicContact CG2-CD1 3.85Å; I816-F829 HydrophobicContact CG2-CD2 3.54Å; I816-F829 HydrophobicContact CG2-CE1 4.25Å; I816-F829 HydrophobicContact CG2-CE2 3.96Å; I816-F829 HydrophobicContact CG2-CG 3.47Å; I816-F829 VanDerWaalsContact CG2-CG 3.47Å; I816-F829 HydrophobicContact CG2-CZ 4.31Å; L826-F829 HydrophobicContact CB-CD2 4.5Å; L826-F829 HydrophobicContact CD2-CD2 4.21Å; L826-F829 HydrophobicContact CD2-CE2 3.86Å; L826-F829 WeakPolarHBondContact O-CB 3.5Å; L826-F829 WeakPolarHBondContact O-CD2 3.46Å; L826-F829 PolarHBondContact O-N 3.42Å; T827-F829 PolarHBondContact O-N 2.95Å; F829-S831 PolarHBondContact O-N 2.92Å; F829-L832 HydrophobicContact CD1-CD1 3.93Å; F829-L832 WeakPolarHBondContact O-CB 3.18Å; F829-L832 PolarHBondContact O-N 3.22Å
830	I	92.7	Very high	90.7	Very high	1 Å²	1	16.9 Å²	16.9	1%	0.005	8%	0.081	C	C	.	.	G	3₁₀ helix	trans	-56.5	-23.5	170	-160.4	173.4	0	0	0	112.4	I424 M744 I787 I797 F817 T827 N828 L832 A833 F834	I424-I830 HydrophobicContact CD1-CG2 4Å; I424-I830 HydrophobicContact CG1-CG2 4.1Å; M744-I830 HydrophobicContact CE-CD1 4.26Å; I787-I830 HydrophobicContact CD1-CD1 3.71Å; I787-I830 HydrophobicContact CG1-CD1 3.87Å; I797-I830 HydrophobicContact CD1-CD1 4.39Å; F817-I830 HydrophobicContact CB-CB 4.45Å; F817-I830 HydrophobicContact CD2-CB 3.72Å; F817-I830 HydrophobicContact CD2-CD1 4.04Å; F817-I830 HydrophobicContact CD2-CG1 4.23Å; F817-I830 HydrophobicContact CD2-CG2 4.41Å; F817-I830 HydrophobicContact CE2-CB 4.25Å; F817-I830 HydrophobicContact CE2-CD1 3.77Å; F817-I830 HydrophobicContact CE2-CG1 4.46Å; F817-I830 HydrophobicContact CG-CB 4.22Å; F817-I830 HydrophobicContact CZ-CD1 4.06Å; T827-I830 WeakPolarHBondContact O-CG2 3.27Å; T827-I830 PolarHBondContact O-N 2.97Å; N828-I830 PolarHBondContact O-N 3.49Å; I830-L832 PolarHBondContact O-N 2.97Å; I830-L832 VanDerWaalsContact O-N 3.13Å; I830-A833 WeakPolarHBondContact O-CB 3.34Å; I830-A833 PolarHBondContact O-N 2.81Å; I830-F834 HydrophobicContact CB-CZ 4.44Å; I830-F834 HydrophobicContact CD1-CE1 4.28Å; I830-F834 HydrophobicContact CD1-CZ 3.82Å; I830-F834 HydrophobicContact CG1-CE1 4.17Å; I830-F834 HydrophobicContact CG1-CE2 4.22Å; I830-F834 HydrophobicContact CG1-CZ 3.73Å; I830-F834 HydrophobicContact CG2-CE2 3.84Å; I830-F834 HydrophobicContact CG2-CZ 4Å; I830-F834 PolarHBondContact O-N 3.29Å
831	S	92.2	Very high	90.6	Very high	3 Å²	3	16.7 Å²	16.7	2%	0.021	8%	0.081	C	C	.	.	G	3₁₀ helix	trans	-58.7	-22.1	173.5	70.6	0	0	0	0	114	K462 N828 F829	K462-S831 VanDerWaalsContact NZ-C 3.28Å; K462-S831 PolarHBondContact NZ-O 3.41Å; N828-S831 VanDerWaalsContact O-CB 3.27Å; N828-S831 WeakPolarHBondContact O-CB 3.42Å; N828-S831 PolarHBondContact O-N 3.45Å; N828-S831 VanDerWaalsContact O-N 3.15Å; N828-S831 PolarHBondContact O-OG 3.46Å; F829-S831 PolarHBondContact O-N 2.92Å
832	L	91.2	Very high	90.5	Very high	9 Å²	9	13.5 Å²	13.5	5%	0.047	7%	0.068	C	C	.	.	G	3₁₀ helix	trans	-79.4	-23.1	173.8	-57.2	172.2	0	0	0	112.7	A502 L534 M537 A809 F829 I830	A502-L832 HydrophobicContact CB-CD2 3.72Å; L534-L832 HydrophobicContact CD2-CD1 3.88Å; L534-L832 HydrophobicContact CD2-CD2 4.27Å; M537-L832 HydrophobicContact CE-CD1 4.27Å; M537-L832 HydrophobicContact CE-CD2 4.26Å; M537-L832 HydrophobicContact SD-CD1 4.46Å; A809-L832 VanDerWaalsContact O-CB 3.28Å; A809-L832 WeakPolarHBondContact O-CB 3.4Å; F829-L832 HydrophobicContact CD1-CD1 3.93Å; F829-L832 WeakPolarHBondContact O-CB 3.18Å; F829-L832 PolarHBondContact O-N 3.22Å; I830-L832 PolarHBondContact O-N 2.97Å; I830-L832 VanDerWaalsContact O-N 3.13Å
833	A	92.1	Very high	90.3	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	6%	0.055	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-20.2	179.4	0	0	0	0	0	113.6	I797 A810 L814 I830 T835	I797-A833 HydrophobicContact CG2-CB 4.39Å; A810-A833 HydrophobicContact CB-CB 4.24Å; L814-A833 HydrophobicContact CD1-CB 4.49Å; L814-A833 HydrophobicContact CD2-CB 4.02Å; L814-A833 HydrophobicContact CG-CB 3.84Å; I830-A833 WeakPolarHBondContact O-CB 3.34Å; I830-A833 PolarHBondContact O-N 2.81Å; A833-T835 PolarHBondContact O-N 3.38Å
834	F	92.4	Very high	89.8	Confident	14 Å²	14	12.3 Å²	12.3	6%	0.061	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	115.8	176.3	-61.7	-42.6	0	0	0	112.1	I424 I747 A790 M795 T796 I797 I830	I424-F834 HydrophobicContact CB-CE2 4.39Å; I424-F834 HydrophobicContact CG1-CE2 4.27Å; I424-F834 HydrophobicContact CG2-CE2 3.67Å; I424-F834 HydrophobicContact CG2-CZ 3.49Å; I424-F834 VanDerWaalsContact CG2-CZ 3.49Å; I747-F834 HydrophobicContact CD1-CE1 4.5Å; A790-F834 HydrophobicContact CB-CD1 4.16Å; A790-F834 HydrophobicContact CB-CE1 3.88Å; A790-F834 HydrophobicContact CB-CE2 4.42Å; A790-F834 HydrophobicContact CB-CZ 4.04Å; M795-F834 HydrophobicContact CB-CB 3.99Å; M795-F834 HydrophobicContact CE-CB 4.21Å; M795-F834 HydrophobicContact SD-CB 3.76Å; T796-F834 WeakPolarHBondContact O-CA 3.27Å; I797-F834 HydrophobicContact CD1-CE1 4.01Å; I797-F834 HydrophobicContact CG1-CD1 3.79Å; I797-F834 HydrophobicContact CG1-CE1 3.72Å; I830-F834 HydrophobicContact CB-CZ 4.44Å; I830-F834 HydrophobicContact CD1-CE1 4.28Å; I830-F834 HydrophobicContact CD1-CZ 3.82Å; I830-F834 HydrophobicContact CG1-CE1 4.17Å; I830-F834 HydrophobicContact CG1-CE2 4.22Å; I830-F834 HydrophobicContact CG1-CZ 3.73Å; I830-F834 HydrophobicContact CG2-CE2 3.84Å; I830-F834 HydrophobicContact CG2-CZ 4Å; I830-F834 PolarHBondContact O-N 3.29Å
835	T	89	Confident	89.3	Confident	39 Å²	39	13 Å²	13	24%	0.239	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	126	174.5	-57.3	0	0	0	0	109.7	M795 T796 A833 T837	M795-T835 WeakPolarHBondContact CA-O 3.43Å; T796-T835 PolarHBondContact N-O 2.97Å; T796-T835 PolarHBondContact O-N 3.44Å; A833-T835 PolarHBondContact O-N 3.38Å; T835-T837 PolarHBondContact O-N 3.19Å
836	P	90.6	Very high	89	Confident	20 Å²	20	13.4 Å²	13.4	13%	0.13	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	128.1	175.2	-23.8	34.2	0	0	0	113.4	H387 F390 M795 A838	H387-P836 HydrophobicContact CB-CG 4.33Å; F390-P836 HydrophobicContact CD1-CB 4.17Å; F390-P836 HydrophobicContact CE1-CB 4.04Å; M795-P836 HydrophobicContact CG-CB 4.39Å; M795-P836 HydrophobicContact CG-CG 4.19Å; M795-P836 HydrophobicContact SD-CG 3.98Å; P836-A838 PolarHBondContact O-N 3.21Å
837	T	87.2	Confident	88.6	Confident	19 Å²	19	16.6 Å²	16.6	12%	0.117	9%	0.089	C	C	.	.			trans	-84.4	57	176	57.3	0	0	0	0	111.2	Q748 N794 T796 T835 R962 V963	Q748-T837 PolarHBondContact NE2-OG1 3.29Å; Q748-T837 PolarHBondContact OE1-OG1 3.43Å; N794-T837 PolarHBondContact O-N 3.38Å; N794-T837 PolarHBondContact O-OG1 2.84Å; T796-T837 HydrophobicContact CG2-CG2 3.53Å; T835-T837 PolarHBondContact O-N 3.19Å; T837-R962 CarbonylContact O-C 3.38Å; T837-R962 WeakPolarHBondContact O-CA 3.46Å; T837-V963 PolarHBondContact O-N 3.18Å
838	A	87.4	Confident	88.3	Confident	4 Å²	4	16.9 Å²	16.9	3%	0.033	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	148.7	-175.1	0	0	0	0	0	113.3	F390 P836 I840 A961 G989	F390-A838 HydrophobicContact CD1-CB 3.77Å; F390-A838 HydrophobicContact CD2-CB 3.93Å; F390-A838 HydrophobicContact CE1-CB 3.76Å; F390-A838 HydrophobicContact CE2-CB 3.94Å; F390-A838 HydrophobicContact CG-CB 3.85Å; F390-A838 HydrophobicContact CZ-CB 3.85Å; P836-A838 PolarHBondContact O-N 3.21Å; A838-I840 HydrophobicContact CB-CD1 4.14Å; A838-I840 HydrophobicContact CB-CG1 3.97Å; A838-A961 CarbonylContact C-O 3.58Å; A838-A961 WeakPolarHBondContact CA-O 3.37Å; A838-G989 WeakPolarHBondContact O-CA 3.49Å; A838-G989 PolarHBondContact O-N 2.96Å
839	L	88.7	Confident	87.9	Confident	2 Å²	2	16.7 Å²	16.7	1%	0.01	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	112	161.7	180	65.5	0	0	0	107.8	F853 A961 V963 V971 I985 G989 L991	L839-F853 HydrophobicContact CD2-CB 4.42Å; L839-F853 HydrophobicContact CD2-CD1 3.83Å; L839-F853 HydrophobicContact CD2-CD2 3.71Å; L839-F853 HydrophobicContact CD2-CE1 3.9Å; L839-F853 HydrophobicContact CD2-CE2 3.78Å; L839-F853 HydrophobicContact CD2-CG 3.73Å; L839-F853 HydrophobicContact CD2-CZ 3.86Å; L839-F853 HydrophobicContact CG-CD2 4.34Å; L839-F853 HydrophobicContact CG-CE1 4.28Å; L839-F853 HydrophobicContact CG-CE2 3.9Å; L839-F853 HydrophobicContact CG-CZ 3.87Å; L839-A961 HydrophobicContact CB-CB 4.48Å; L839-A961 PolarHBondContact N-O 3.04Å; L839-A961 PolarHBondContact O-N 2.99Å; L839-V963 HydrophobicContact CB-CB 4.29Å; L839-V963 HydrophobicContact CB-CG2 3.63Å; L839-V963 HydrophobicContact CD2-CG2 3.96Å; L839-V963 HydrophobicContact CG-CG2 4.45Å; L839-V971 HydrophobicContact CD2-CG1 4.2Å; L839-I985 HydrophobicContact CD1-CG2 4.48Å; L839-I985 HydrophobicContact CD2-CG2 4.15Å; L839-G989 WeakPolarHBondContact CA-O 3.22Å; L839-L991 HydrophobicContact CD1-CD1 3.64Å; L839-L991 HydrophobicContact CD1-CG 4.13Å
840	I	90.1	Very high	87.5	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	116.1	-174.4	-51	-176.2	0	0	0	108.3	L386 F390 A838 L842 M848 N959 P960 G989 I990 L991	L386-I840 HydrophobicContact CB-CD1 4.09Å; L386-I840 HydrophobicContact CD2-CG2 4.36Å; F390-I840 HydrophobicContact CB-CD1 4.22Å; A838-I840 HydrophobicContact CB-CD1 4.14Å; A838-I840 HydrophobicContact CB-CG1 3.97Å; I840-L842 HydrophobicContact CG2-CD2 4.16Å; I840-M848 HydrophobicContact CG2-CG 4.13Å; I840-M848 HydrophobicContact CG2-SD 4.22Å; I840-N959 WeakPolarHBondContact CA-OD1 3.46Å; I840-P960 HydrophobicContact CG1-CB 3.91Å; I840-P960 HydrophobicContact CG2-CB 4.48Å; I840-G989 PolarHBondContact N-O 3.01Å; I840-I990 HydrophobicContact CB-CG1 4.34Å; I840-I990 WeakPolarHBondContact O-CA 3.27Å; I840-L991 PolarHBondContact O-N 3.47Å
841	A	88.5	Confident	87.1	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	139.4	170.4	0	0	0	0	0	111.1	I851 F853 N959 L991 V993	A841-I851 HydrophobicContact CB-CD1 3.93Å; A841-F853 HydrophobicContact CB-CZ 3.89Å; A841-N959 PolarHBondContact N-OD1 3.46Å; A841-N959 PolarHBondContact O-ND2 3.46Å; A841-L991 WeakPolarHBondContact CA-O 3.47Å; A841-V993 HydrophobicContact CB-CG2 3.67Å
842	L	88	Confident	86.8	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	144.2	176	-59	178.7	0	0	0	112.1	F269 L386 I840 L846 N847 M848 I990 L991 M992 V993	F269-L842 HydrophobicContact CE1-CD1 4.41Å; F269-L842 HydrophobicContact CE2-CD1 3.81Å; F269-L842 HydrophobicContact CZ-CD1 3.53Å; L386-L842 HydrophobicContact CD1-CD1 3.61Å; L386-L842 HydrophobicContact CD1-CD2 3.77Å; L386-L842 HydrophobicContact CD1-CG 4.21Å; L386-L842 HydrophobicContact CD2-CD2 3.8Å; L386-L842 HydrophobicContact CG-CD2 4.47Å; I840-L842 HydrophobicContact CG2-CD2 4.16Å; L842-L846 HydrophobicContact CD1-CD2 4.34Å; L842-N847 WeakPolarHBondContact CA-O 3.38Å; L842-M848 HydrophobicContact CD2-CG 3.91Å; L842-I990 HydrophobicContact CD1-CG2 3.53Å; L842-I990 HydrophobicContact CG-CG2 4.04Å; L842-L991 PolarHBondContact N-O 3.09Å; L842-M992 HydrophobicContact CB-CE 4.22Å; L842-M992 HydrophobicContact CB-SD 3.9Å; L842-M992 HydrophobicContact CD1-SD 4.09Å; L842-V993 WeakPolarHBondContact O-CB 3.39Å; L842-V993 PolarHBondContact O-N 2.71Å
843	N	85	Confident	86.5	Confident	5 Å²	5	26.7 Å²	26.7	3%	0.027	13%	0.134	C	C	.	.			trans	-81.4	-177.9	171.1	76.9	-7.4	0	0	0	112.1	D845 L846 N847 M992 E1002	N843-D845 PolarHBondContact O-N 3.49Å; N843-D845 VanDerWaalsContact O-N 3.1Å; N843-D845 WeakPolarHBondContact OD1-CA 3.43Å; N843-D845 PolarHBondContact OD1-N 2.94Å; N843-L846 PolarHBondContact O-N 2.95Å; N843-L846 PolarHBondContact OD1-N 2.77Å; N843-N847 PolarHBondContact N-O 3.04Å; N843-N847 PolarHBondContact OD1-N 2.96Å; N843-N847 PolarHBondContact OD1-O 3.42Å; N843-M992 WeakPolarHBondContact O-CE 3.29Å; N843-E1002 WeakPolarHBondContact CB-OE2 3.32Å; N843-E1002 PolarHBondContact ND2-OE2 3.43Å
844	K	81.5	Confident	86.2	Confident	62 Å²	62	31.7 Å²	31.7	27%	0.27	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-37.1	175.9	-174.7	-164.2	170.3	-177.6	0	112.7	Q258 V262 E366	Q258-K844 HydrophobicContact CG-CD 4.18Å; V262-K844 HydrophobicContact CG2-CG 4.28Å; E366-K844 IonicContact OE1-NZ 2.73Å; E366-K844 PolarHBondContact OE1-NZ 2.86Å
845	D	79.7	Confident	85.9	Confident	86 Å²	86	31 Å²	31	46%	0.46	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	17.7	-169.5	-51.2	-39.6	0	0	0	112.9	N843 N847	N843-D845 PolarHBondContact O-N 3.49Å; N843-D845 VanDerWaalsContact O-N 3.1Å; N843-D845 WeakPolarHBondContact OD1-CA 3.43Å; N843-D845 PolarHBondContact OD1-N 2.94Å; D845-N847 PolarHBondContact O-N 3.05Å; D845-N847 PolarHBondContact O-ND2 2.75Å; D845-N847 VanDerWaalsContact O-ND2 3.12Å
846	L	82.5	Confident	85.8	Confident	13 Å²	13	31.6 Å²	31.6	7%	0.068	15%	0.152	C	C	.	.	S	Bend	trans	60.2	23.2	179.6	-51.1	-178.8	0	0	0	114.9	Y265 F269 H373 I377 L842 N843 M992	Y265-L846 HydrophobicContact CD2-CD2 4.13Å; Y265-L846 HydrophobicContact CG-CD2 4.48Å; F269-L846 HydrophobicContact CE2-CD2 4.21Å; F269-L846 HydrophobicContact CZ-CD2 4.3Å; H373-L846 HydrophobicContact CB-CD1 3.93Å; I377-L846 HydrophobicContact CD1-CD1 3.98Å; I377-L846 HydrophobicContact CD1-CD2 4Å; I377-L846 HydrophobicContact CG1-CD1 4.14Å; L842-L846 HydrophobicContact CD1-CD2 4.34Å; N843-L846 PolarHBondContact O-N 2.95Å; N843-L846 PolarHBondContact OD1-N 2.77Å; L846-M992 HydrophobicContact CD2-CE 4.01Å; L846-M992 HydrophobicContact CD2-SD 4.15Å
847	N	84.7	Confident	85.4	Confident	68 Å²	68	31.3 Å²	31.3	36%	0.364	15%	0.151	S	C	.	.			trans	-96.9	157.2	172.4	-65.8	-72	0	0	0	111	L842 N843 D845 P849 L1004	L842-N847 WeakPolarHBondContact CA-O 3.38Å; N843-N847 PolarHBondContact N-O 3.04Å; N843-N847 PolarHBondContact OD1-N 2.96Å; N843-N847 PolarHBondContact OD1-O 3.42Å; D845-N847 PolarHBondContact O-N 3.05Å; D845-N847 PolarHBondContact O-ND2 2.75Å; D845-N847 VanDerWaalsContact O-ND2 3.12Å; N847-P849 WeakPolarHBondContact O-CD 3.24Å; N847-L1004 HydrophobicContact CB-CD1 3.89Å; N847-L1004 HydrophobicContact CB-CD2 3.86Å; N847-L1004 HydrophobicContact CB-CG 4.46Å
848	M	85.2	Confident	85.3	Confident	5 Å²	5	35.6 Å²	35.6	3%	0.025	17%	0.168	C	C	.	.			trans	-88.1	106.5	178.8	-69.9	176.1	-75.4	0	0	111.4	L386 Q389 I840 L842 P960 L1004 V1005 N1007	L386-M848 HydrophobicContact CD2-CE 4.14Å; L386-M848 HydrophobicContact CD2-CG 3.93Å; L386-M848 HydrophobicContact CD2-SD 3.94Å; Q389-M848 HydrophobicContact CB-CE 4.31Å; I840-M848 HydrophobicContact CG2-CG 4.13Å; I840-M848 HydrophobicContact CG2-SD 4.22Å; L842-M848 HydrophobicContact CD2-CG 3.91Å; M848-P960 HydrophobicContact SD-CG 4.25Å; M848-L1004 CarbonylContact O-C 3.54Å; M848-L1004 WeakPolarHBondContact O-CA 3.38Å; M848-V1005 HydrophobicContact CB-CB 4.11Å; M848-V1005 HydrophobicContact CB-CG2 4.26Å; M848-V1005 PolarHBondContact O-N 3.21Å; M848-N1007 WeakPolarHBondContact CE-OD1 3.22Å
849	P	84.8	Confident	85	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-72.2	150.1	169.6	29.7	-36.7	0	0	0	111.8	N847 I851 N959 Y979	N847-P849 WeakPolarHBondContact O-CD 3.24Å; P849-I851 HydrophobicContact CB-CD1 4.33Å; P849-I851 HydrophobicContact CB-CG1 4.18Å; P849-I851 HydrophobicContact CG-CD1 3.66Å; P849-I851 HydrophobicContact CG-CG1 3.97Å; P849-I851 PolarHBondContact O-N 2.72Å; P849-N959 PolarHBondContact O-ND2 2.96Å; P849-Y979 HydrophobicContact CB-CE1 4.26Å; P849-Y979 HydrophobicContact CB-CE2 4.22Å; P849-Y979 WeakPolarHBondContact CB-OH 3.36Å; P849-Y979 HydrophobicContact CG-CE1 4.45Å
850	K	83.6	Confident	84.7	Confident	119 Å²	119	39.9 Å²	39.9	52%	0.517	20%	0.197	S	C	.	.			trans	-72.1	87.9	172	-73.1	176	-177.8	142.8	0	110.8	V1003 L1004 V1005	K850-V1003 WeakPolarHBondContact CB-O 3.42Å; K850-V1003 HydrophobicContact CD-CB 4.39Å; K850-V1003 HydrophobicContact CD-CG1 3.74Å; K850-V1003 WeakPolarHBondContact CG-O 3.48Å; K850-V1003 PolarHBondContact N-O 2.93Å; K850-L1004 WeakPolarHBondContact CE-O 3.45Å; K850-L1004 PolarHBondContact NZ-O 3.06Å; K850-V1005 HydrophobicContact CG-CG2 3.71Å
851	I	84.6	Confident	84.3	Confident	6 Å²	6	41.9 Å²	41.9	3%	0.031	21%	0.209	C	C	.	.			trans	-106.5	147.5	176.5	-65.6	-179.7	0	0	0	110.2	A841 P849 F853 N959 L973 Y979 V993	A841-I851 HydrophobicContact CB-CD1 3.93Å; P849-I851 HydrophobicContact CB-CD1 4.33Å; P849-I851 HydrophobicContact CB-CG1 4.18Å; P849-I851 HydrophobicContact CG-CD1 3.66Å; P849-I851 HydrophobicContact CG-CG1 3.97Å; P849-I851 PolarHBondContact O-N 2.72Å; I851-F853 HydrophobicContact CG2-CD1 4.39Å; I851-F853 HydrophobicContact CG2-CE1 4.09Å; I851-F853 HydrophobicContact CG2-CZ 4.22Å; I851-N959 HydrophobicContact CB-CB 4.29Å; I851-N959 PolarHBondContact O-N 3.39Å; I851-L973 HydrophobicContact CG2-CD1 4.01Å; I851-Y979 HydrophobicContact CD1-CD1 4.2Å; I851-Y979 HydrophobicContact CD1-CD2 3.51Å; I851-Y979 HydrophobicContact CD1-CE2 3.99Å; I851-Y979 HydrophobicContact CD1-CG 3.61Å; I851-Y979 HydrophobicContact CG1-CD2 3.52Å; I851-Y979 HydrophobicContact CG1-CE2 3.73Å; I851-Y979 HydrophobicContact CG1-CG 4.18Å; I851-V993 HydrophobicContact CD1-CG1 3.97Å
852	Q	85.4	Confident	83.9	Confident	97 Å²	97	43.1 Å²	43.1	45%	0.453	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	124.2	170.3	-70.2	-174.9	-17.8	0	0	110.8	L957 N958 P974	Q852-L957 CarbonylContact C-O 3.57Å; Q852-L957 WeakPolarHBondContact CA-O 3.35Å; Q852-N958 WeakPolarHBondContact CG-OD1 3.5Å; Q852-N958 PolarHBondContact NE2-OD1 3.12Å; Q852-N958 VanDerWaalsContact NE2-OD1 3.08Å; Q852-P974 VanDerWaalsContact O-CD 3.29Å; Q852-P974 WeakPolarHBondContact O-CD 3.39Å
853	F	85.4	Confident	83.5	Confident	1 Å²	1	45 Å²	45	0%	0.004	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	144.6	171.8	-50.9	-78.8	0	0	0	110	L839 A841 I851 L956 L957 N959 A961 V971 L973	L839-F853 HydrophobicContact CD2-CB 4.42Å; L839-F853 HydrophobicContact CD2-CD1 3.83Å; L839-F853 HydrophobicContact CD2-CD2 3.71Å; L839-F853 HydrophobicContact CD2-CE1 3.9Å; L839-F853 HydrophobicContact CD2-CE2 3.78Å; L839-F853 HydrophobicContact CD2-CG 3.73Å; L839-F853 HydrophobicContact CD2-CZ 3.86Å; L839-F853 HydrophobicContact CG-CD2 4.34Å; L839-F853 HydrophobicContact CG-CE1 4.28Å; L839-F853 HydrophobicContact CG-CE2 3.9Å; L839-F853 HydrophobicContact CG-CZ 3.87Å; A841-F853 HydrophobicContact CB-CZ 3.89Å; I851-F853 HydrophobicContact CG2-CD1 4.39Å; I851-F853 HydrophobicContact CG2-CE1 4.09Å; I851-F853 HydrophobicContact CG2-CZ 4.22Å; F853-L956 WeakPolarHBondContact O-CA 3.43Å; F853-L957 HydrophobicContact CB-CB 4.46Å; F853-L957 PolarHBondContact N-O 2.9Å; F853-L957 PolarHBondContact O-N 2.74Å; F853-N959 HydrophobicContact CE2-CB 4.18Å; F853-A961 HydrophobicContact CD2-CB 4.36Å; F853-V971 HydrophobicContact CB-CG1 3.75Å; F853-V971 HydrophobicContact CG-CG1 4.47Å; F853-L973 HydrophobicContact CD1-CD1 4.19Å; F853-L973 HydrophobicContact CE1-CD1 4.49Å
854	R	87	Confident	83.5	Confident	105 Å²	105	48.4 Å²	48.4	40%	0.396	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	108.3	178.5	176.8	176.8	159.3	170.9	-6.3	109.9	N856 F954 L956 V971 T972 P974	R854-N856 PolarHBondContact NE-OD1 3.37Å; R854-N856 PolarHBondContact NH2-OD1 2.87Å; R854-N856 VanDerWaalsContact NH2-OD1 3.09Å; R854-N856 PolarHBondContact O-ND2 2.75Å; R854-F954 HydrophobicContact CG-CB 4.24Å; R854-F954 HydrophobicContact CG-CD2 4.45Å; R854-L956 HydrophobicContact CB-CD2 4.19Å; R854-V971 WeakPolarHBondContact O-CA 3.23Å; R854-T972 PolarHBondContact N-O 2.69Å; R854-T972 PolarHBondContact O-N 2.87Å; R854-P974 HydrophobicContact CB-CG 4.35Å
855	S	85.9	Confident	83.3	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	110.2	171.9	171.1	0	0	0	0	108.9	A857 F954 S955 Q967	S855-A857 PolarHBondContact O-N 2.76Å; S855-F954 CarbonylContact O-C 3.51Å; S855-F954 WeakPolarHBondContact O-CA 3.5Å; S855-S955 WeakPolarHBondContact CB-OG 3.43Å; S855-S955 PolarHBondContact N-O 3.33Å; S855-S955 PolarHBondContact O-N 3.15Å; S855-Q967 PolarHBondContact OG-NE2 3.36Å; S855-Q967 VanDerWaalsContact OG-NE2 3.14Å
856	N	86.1	Confident	83	Confident	52 Å²	52	51.2 Å²	51.2	28%	0.278	26%	0.257	S	S	.	.			trans	-81.5	53.9	-177	-61.4	-77.7	0	0	0	112.2	R854 N953 Y970 T972	R854-N856 PolarHBondContact NE-OD1 3.37Å; R854-N856 PolarHBondContact NH2-OD1 2.87Å; R854-N856 VanDerWaalsContact NH2-OD1 3.09Å; R854-N856 PolarHBondContact O-ND2 2.75Å; N856-N953 CarbonylContact C-O 3.56Å; N856-Y970 WeakPolarHBondContact CB-O 3.38Å; N856-Y970 PolarHBondContact N-O 3.44Å; N856-Y970 PolarHBondContact ND2-O 2.82Å; N856-T972 PolarHBondContact ND2-OG1 2.67Å
857	A	83.1	Confident	82.5	Confident	14 Å²	14	54.7 Å²	54.7	12%	0.116	28%	0.28	C	S	.	.	S	Bend	trans	-148.1	158.3	176.9	0	0	0	0	0	110	S855 F862 N953 Y970	S855-A857 PolarHBondContact O-N 2.76Å; A857-F862 HydrophobicContact CB-CD2 4.07Å; A857-F862 HydrophobicContact CB-CE2 3.64Å; A857-N953 CarbonylContact C-O 3.59Å; A857-N953 PolarHBondContact N-O 3.39Å; A857-Y970 HydrophobicContact CB-CG 4.4Å
858	K	84.6	Confident	81.8	Confident	109 Å²	109	54.5 Å²	54.5	47%	0.474	28%	0.279	S	S	.	.			trans	-58.7	135.6	175.4	-69.9	-173.1	179.3	-175.6	0	111.2	S860 T861	K858-S860 VanDerWaalsContact C-N 3.29Å; K858-S860 PolarHBondContact O-N 3.14Å; K858-T861 WeakPolarHBondContact O-CB 3.43Å; K858-T861 PolarHBondContact O-N 3.31Å; K858-T861 VanDerWaalsContact O-N 3.16Å
859	P	81	Confident	80.8	Confident	49 Å²	49	59.8 Å²	59.8	32%	0.318	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-50.2	-44.3	176.9	-28.9	33.3	0	0	0	113.8	T861 F862 A863 P952	P859-T861 PolarHBondContact O-N 3.35Å; P859-F862 CarbonylContact O-C 3.51Å; P859-F862 PolarHBondContact O-N 2.86Å; P859-F862 VanDerWaalsContact O-N 3.11Å; P859-A863 PolarHBondContact O-N 3.25Å; P859-P952 WeakPolarHBondContact CD-O 3.49Å; P859-P952 HydrophobicContact CG-CG 4.04Å
860	S	81.5	Confident	79.4	Confident	47 Å²	47	63.8 Å²	63.8	33%	0.329	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-66.1	-21.4	-176	-67.7	0	0	0	0	114.2	V752 K858 F862 E951	V752-S860 WeakPolarHBondContact CG2-O 3.39Å; K858-S860 VanDerWaalsContact C-N 3.29Å; K858-S860 PolarHBondContact O-N 3.14Å; S860-F862 VanDerWaalsContact C-N 3.28Å; S860-F862 PolarHBondContact O-N 3.49Å; S860-E951 WeakPolarHBondContact CB-OE1 3.22Å; S860-E951 WeakPolarHBondContact CB-OE2 3.34Å; S860-E951 PolarHBondContact N-OE2 2.93Å; S860-E951 VanDerWaalsContact OG-CD 3.24Å; S860-E951 PolarHBondContact OG-OE1 2.81Å; S860-E951 PolarHBondContact OG-OE2 2.8Å
861	T	81.8	Confident	78.1	Confident	42 Å²	42	63.8 Å²	63.8	26%	0.258	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-65.5	-31.7	174.1	-54.9	0	0	0	0	112.2	N750 K858 P859	N750-T861 PolarHBondContact ND2-O 3.46Å; K858-T861 WeakPolarHBondContact O-CB 3.43Å; K858-T861 PolarHBondContact O-N 3.31Å; K858-T861 VanDerWaalsContact O-N 3.16Å; P859-T861 PolarHBondContact O-N 3.35Å
862	F	80.9	Confident	76.5	Confident	26 Å²	26	70.6 Å²	70.6	11%	0.114	35%	0.353	C	S	.	.	S	Bend	trans	-121	16.4	-177.7	-60	-66	0	0	0	113.4	A857 P859 S860 M964 Q967 Y970	A857-F862 HydrophobicContact CB-CD2 4.07Å; A857-F862 HydrophobicContact CB-CE2 3.64Å; P859-F862 CarbonylContact O-C 3.51Å; P859-F862 PolarHBondContact O-N 2.86Å; P859-F862 VanDerWaalsContact O-N 3.11Å; S860-F862 VanDerWaalsContact C-N 3.28Å; S860-F862 PolarHBondContact O-N 3.49Å; F862-M964 HydrophobicContact CD1-SD 4.1Å; F862-Q967 HydrophobicContact CD1-CB 3.82Å; F862-Q967 HydrophobicContact CD1-CG 4.11Å; F862-Q967 HydrophobicContact CD2-CB 4.22Å; F862-Q967 HydrophobicContact CD2-CG 3.67Å; F862-Q967 HydrophobicContact CE1-CB 3.64Å; F862-Q967 HydrophobicContact CE1-CG 4.2Å; F862-Q967 HydrophobicContact CE2-CB 4.04Å; F862-Q967 HydrophobicContact CE2-CG 3.75Å; F862-Q967 HydrophobicContact CG-CB 4.1Å; F862-Q967 HydrophobicContact CG-CG 3.85Å; F862-Q967 HydrophobicContact CZ-CB 3.76Å; F862-Q967 HydrophobicContact CZ-CG 4.02Å; F862-Y970 HydrophobicContact CE2-CD2 4.45Å; F862-Y970 HydrophobicContact CZ-CD2 4.34Å
863	A	80.3	Confident	75.3	Confident	40 Å²	40	71.2 Å²	71.2	33%	0.331	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-62.2	152	175	0	0	0	0	0	111.8	N750 P859	N750-A863 PolarHBondContact ND2-O 2.69Å; P859-A863 PolarHBondContact O-N 3.25Å
864	Y	83.5	Confident	74.1	Confident	76 Å²	76	75.6 Å²	75.6	30%	0.298	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-64.9	154.2	167.3	-67.3	-88.7	0	0	0	110.6	K396 C793 N794 R962	K396-Y864 HydrophobicContact CB-CD1 4.39Å; K396-Y864 HydrophobicContact CG-CD1 4.31Å; K396-Y864 HydrophobicContact CG-CE1 4.17Å; C793-Y864 HydrophobicContact CB-CD1 3.89Å; C793-Y864 HydrophobicContact CB-CE1 4.27Å; N794-Y864 PolarHBondContact OD1-OH 3.15Å; Y864-R962 VanDerWaalsContact CE1-CD 3.42Å; Y864-R962 WeakPolarHBondContact OH-CD 3.26Å
865	P	78.5	Confident	73	Confident	30 Å²	30	76 Å²	76	20%	0.195	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-51	142	164	-24.4	34.4	0	0	0	111.2
866	Q	73.5	Confident	72.3	Confident	176 Å²	176	84.1 Å²	84.1	82%	0.822	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-71.4	130.7	175.5	-66.7	-175.3	0.4	0	0	109.8
867	P	72.3	Confident	71.6	Confident	86 Å²	86	87.7 Å²	87.7	56%	0.558	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-58.7	157.1	173.6	-24.8	34.9	0	0	0	112.5	Q869	P867-Q869 PolarHBondContact O-N 3.23Å; P867-Q869 VanDerWaalsContact O-N 3.12Å
868	L	69.9	Low	71.4	Confident	64 Å²	64	94.2 Å²	94.2	34%	0.335	45%	0.451	S	S	.	.			trans	-70	111.8	-177.6	-165.2	70.2	0	0	0	110.3	D398 L765	D398-L868 PolarHBondContact OD2-N 2.8Å; L765-L868 HydrophobicContact CD1-CD1 4.38Å
869	Q	63	Low	71.2	Confident	116 Å²	116	93 Å²	93	54%	0.542	45%	0.453	S	S	.	.			trans	-54.1	138.3	173.4	-70.8	174.1	-14.7	0	0	110.9	P867 E871	P867-Q869 PolarHBondContact O-N 3.23Å; P867-Q869 VanDerWaalsContact O-N 3.12Å; Q869-E871 PolarHBondContact O-N 3.46Å
870	Q	55.8	Low	71.3	Confident	84 Å²	84	96.3 Å²	96.3	39%	0.393	46%	0.464	S	S	.	.			trans	-64.1	135.9	-172.4	-64.1	-171.2	23.1	0	0	111.2	K872 E873 K874	Q870-K872 HydrophobicContact CB-CB 4.34Å; Q870-K872 PolarHBondContact O-N 3.37Å; Q870-E873 PolarHBondContact O-N 2.86Å; Q870-K874 PolarHBondContact O-N 3.27Å
871	E	57.1	Low	71.6	Confident	119 Å²	119	98.2 Å²	98.2	56%	0.556	47%	0.474	S	S	*	.	H	α-helix	trans	-55.6	-26.3	169	-74.7	-141.9	125.8	0	0	112.7	Q869 E873 K874 K875	Q869-E871 PolarHBondContact O-N 3.46Å; E871-E873 PolarHBondContact O-N 2.95Å; E871-K874 PolarHBondContact O-N 3.45Å; E871-K875 HydrophobicContact CB-CD 4.25Å; E871-K875 WeakPolarHBondContact O-CB 3.49Å; E871-K875 WeakPolarHBondContact O-CD 3.45Å; E871-K875 WeakPolarHBondContact O-CG 3.43Å; E871-K875 PolarHBondContact O-N 3.38Å; E871-K875 WeakPolarHBondContact OE2-CE 3.49Å; E871-K875 IonicContact OE2-NZ 2.8Å; E871-K875 PolarHBondContact OE2-NZ 3.37Å
872	K	51	Low	71.8	Confident	150 Å²	150	98.3 Å²	98.3	65%	0.652	48%	0.479	S	S	*	.	H	α-helix	trans	-61	-30.7	175.5	-69.7	177.6	179.9	171.2	0	112.5	Q870 R876	Q870-K872 HydrophobicContact CB-CB 4.34Å; Q870-K872 PolarHBondContact O-N 3.37Å; K872-R876 WeakPolarHBondContact O-CB 3.28Å; K872-R876 VanDerWaalsContact O-CG 3.22Å; K872-R876 WeakPolarHBondContact O-CG 3.39Å; K872-R876 PolarHBondContact O-N 3.39Å
873	E	58.7	Low	72.1	Confident	110 Å²	110	101.5 Å²	101.5	51%	0.514	50%	0.496	S	S	.	.	H	α-helix	trans	-77.3	-47.8	175.4	-65	177.1	133.4	0	0	110.7	Q870 E871 K875 R876 E877	Q870-E873 PolarHBondContact O-N 2.86Å; E871-E873 PolarHBondContact O-N 2.95Å; E873-K875 PolarHBondContact O-N 3.32Å; E873-R876 WeakPolarHBondContact O-CA 3.38Å; E873-R876 WeakPolarHBondContact O-CB 3.33Å; E873-R876 PolarHBondContact O-N 2.95Å; E873-E877 PolarHBondContact O-N 2.9Å
874	K	60.5	Low	72.4	Confident	92 Å²	92	105.3 Å²	105.3	40%	0.4	51%	0.51	S	S	.	.	H	α-helix	trans	-61.9	-30.6	174.4	-65.8	179.4	178.6	175.1	0	113	Q870 E871 K878	Q870-K874 PolarHBondContact O-N 3.27Å; E871-K874 PolarHBondContact O-N 3.45Å; K874-K878 WeakPolarHBondContact O-CB 3.47Å; K874-K878 VanDerWaalsContact O-CG 3.22Å; K874-K878 WeakPolarHBondContact O-CG 3.26Å; K874-K878 PolarHBondContact O-N 2.95Å
875	K	63.5	Low	72.5	Confident	113 Å²	113	105 Å²	105	49%	0.491	52%	0.519	S	S	.	.	H	α-helix	trans	-75.2	-38.3	173.1	-74.3	165.8	175.8	167.5	0	111.2	E871 E873 V879	E871-K875 HydrophobicContact CB-CD 4.25Å; E871-K875 WeakPolarHBondContact O-CB 3.49Å; E871-K875 WeakPolarHBondContact O-CD 3.45Å; E871-K875 WeakPolarHBondContact O-CG 3.43Å; E871-K875 PolarHBondContact O-N 3.38Å; E871-K875 WeakPolarHBondContact OE2-CE 3.49Å; E871-K875 IonicContact OE2-NZ 2.8Å; E871-K875 PolarHBondContact OE2-NZ 3.37Å; E873-K875 PolarHBondContact O-N 3.32Å; K875-V879 WeakPolarHBondContact O-CB 3.39Å; K875-V879 WeakPolarHBondContact O-CG2 3.47Å; K875-V879 PolarHBondContact O-N 3.1Å
876	R	71.5	Confident	73.1	Confident	171 Å²	171	108.4 Å²	108.4	65%	0.645	54%	0.535	S	S	*	.	H	α-helix	trans	-60.9	-50.8	170.5	-80.6	169.7	176.4	-171.9	-2.3	111.9	K872 E873 K878 V879 E880	K872-R876 WeakPolarHBondContact O-CB 3.28Å; K872-R876 VanDerWaalsContact O-CG 3.22Å; K872-R876 WeakPolarHBondContact O-CG 3.39Å; K872-R876 PolarHBondContact O-N 3.39Å; E873-R876 WeakPolarHBondContact O-CA 3.38Å; E873-R876 WeakPolarHBondContact O-CB 3.33Å; E873-R876 PolarHBondContact O-N 2.95Å; R876-K878 VanDerWaalsContact C-N 3.33Å; R876-K878 PolarHBondContact O-N 3.09Å; R876-V879 CarbonylContact O-C 3.18Å; R876-V879 WeakPolarHBondContact O-CA 3.46Å; R876-V879 PolarHBondContact O-N 3.5Å; R876-E880 WeakPolarHBondContact O-CB 3.41Å; R876-E880 WeakPolarHBondContact O-CG 3.16Å; R876-E880 PolarHBondContact O-N 3.42Å
877	E	72.4	Confident	73.8	Confident	127 Å²	127	102.7 Å²	102.7	59%	0.593	51%	0.512	S	S	*	.	H	α-helix	trans	-58.2	-43.1	178.6	-175.6	-177.5	-153.7	0	0	112.1	E873 E880 T881	E873-E877 PolarHBondContact O-N 2.9Å; E877-E880 PolarHBondContact O-N 3.03Å; E877-T881 WeakPolarHBondContact O-CB 3.43Å; E877-T881 PolarHBondContact O-N 3.31Å; E877-T881 PolarHBondContact O-OG1 2.85Å
878	K	78.4	Confident	74.5	Confident	152 Å²	152	101.4 Å²	101.4	66%	0.661	51%	0.509	S	S	*	.	H	α-helix	trans	-63.4	-40.6	172.7	-75.7	174.4	-179.5	-176.8	0	112.7	K874 R876 A882	K874-K878 WeakPolarHBondContact O-CB 3.47Å; K874-K878 VanDerWaalsContact O-CG 3.22Å; K874-K878 WeakPolarHBondContact O-CG 3.26Å; K874-K878 PolarHBondContact O-N 2.95Å; R876-K878 VanDerWaalsContact C-N 3.33Å; R876-K878 PolarHBondContact O-N 3.09Å; K878-A882 WeakPolarHBondContact O-CB 3.44Å; K878-A882 PolarHBondContact O-N 3.19Å
879	V	80.9	Confident	75.4	Confident	83 Å²	83	106.4 Å²	106.4	50%	0.503	53%	0.528	S	S	.	.	H	α-helix	trans	-68.6	-42	177.2	164.5	0	0	0	0	111.5	K875 R876 A882 I883	K875-V879 WeakPolarHBondContact O-CB 3.39Å; K875-V879 WeakPolarHBondContact O-CG2 3.47Å; K875-V879 PolarHBondContact O-N 3.1Å; R876-V879 CarbonylContact O-C 3.18Å; R876-V879 WeakPolarHBondContact O-CA 3.46Å; R876-V879 PolarHBondContact O-N 3.5Å; V879-A882 WeakPolarHBondContact O-CB 3.19Å; V879-A882 PolarHBondContact O-N 2.93Å; V879-I883 HydrophobicContact CG1-CD1 3.66Å; V879-I883 HydrophobicContact CG1-CG1 4.37Å; V879-I883 WeakPolarHBondContact O-CB 3.22Å; V879-I883 VanDerWaalsContact O-CG1 3.23Å; V879-I883 WeakPolarHBondContact O-CG1 3.41Å; V879-I883 PolarHBondContact O-N 2.93Å
880	E	83.2	Confident	76.4	Confident	118 Å²	118	106.2 Å²	106.2	55%	0.551	53%	0.527	S	S	*	.	H	α-helix	trans	-62.9	-43.9	174.3	-73.4	172.8	-156.6	0	0	111	R876 E877 A882 I883 L884	R876-E880 WeakPolarHBondContact O-CB 3.41Å; R876-E880 WeakPolarHBondContact O-CG 3.16Å; R876-E880 PolarHBondContact O-N 3.42Å; E877-E880 PolarHBondContact O-N 3.03Å; E880-A882 VanDerWaalsContact C-N 3.34Å; E880-A882 PolarHBondContact O-N 2.73Å; E880-I883 PolarHBondContact O-N 3.24Å; E880-L884 WeakPolarHBondContact O-CB 3.36Å; E880-L884 VanDerWaalsContact O-CG 3.26Å; E880-L884 WeakPolarHBondContact O-CG 3.34Å; E880-L884 PolarHBondContact O-N 2.85Å
881	T	87	Confident	77.8	Confident	88 Å²	88	111 Å²	111	54%	0.54	54%	0.541	S	S	.	.	H	α-helix	trans	-60	-42.7	173.1	-58	0	0	0	0	111.8	E877 L884 S885	E877-T881 WeakPolarHBondContact O-CB 3.43Å; E877-T881 PolarHBondContact O-N 3.31Å; E877-T881 PolarHBondContact O-OG1 2.85Å; T881-L884 PolarHBondContact O-N 3.47Å; T881-S885 WeakPolarHBondContact O-CB 3.5Å; T881-S885 PolarHBondContact O-N 3.36Å
882	A	86	Confident	79.1	Confident	44 Å²	44	112.1 Å²	112.1	36%	0.364	55%	0.545	S	S	.	.	H	α-helix	trans	-63.5	-47.6	175.2	0	0	0	0	0	111.7	K878 V879 E880 L884 S885 I886	K878-A882 WeakPolarHBondContact O-CB 3.44Å; K878-A882 PolarHBondContact O-N 3.19Å; V879-A882 WeakPolarHBondContact O-CB 3.19Å; V879-A882 PolarHBondContact O-N 2.93Å; E880-A882 VanDerWaalsContact C-N 3.34Å; E880-A882 PolarHBondContact O-N 2.73Å; A882-L884 VanDerWaalsContact C-N 3.34Å; A882-L884 PolarHBondContact O-N 3.37Å; A882-S885 PolarHBondContact O-N 2.93Å; A882-S885 VanDerWaalsContact O-N 3.16Å; A882-S885 PolarHBondContact O-OG 2.94Å; A882-I886 VanDerWaalsContact O-CG1 3.32Å; A882-I886 WeakPolarHBondContact O-CG1 3.17Å; A882-I886 PolarHBondContact O-N 2.89Å
883	I	87.3	Confident	80.7	Confident	92 Å²	92	111.8 Å²	111.8	47%	0.472	54%	0.543	S	S	.	.	H	α-helix	trans	-59.7	-42.9	176.8	-70.8	164.7	0	0	0	111	V879 E880 I886 T887	V879-I883 HydrophobicContact CG1-CD1 3.66Å; V879-I883 HydrophobicContact CG1-CG1 4.37Å; V879-I883 WeakPolarHBondContact O-CB 3.22Å; V879-I883 VanDerWaalsContact O-CG1 3.23Å; V879-I883 WeakPolarHBondContact O-CG1 3.41Å; V879-I883 PolarHBondContact O-N 2.93Å; E880-I883 PolarHBondContact O-N 3.24Å; I883-I886 PolarHBondContact O-N 3.22Å; I883-T887 VanDerWaalsContact O-CB 3.22Å; I883-T887 WeakPolarHBondContact O-CB 3.4Å; I883-T887 PolarHBondContact O-N 3.17Å; I883-T887 PolarHBondContact O-OG1 3.42Å
884	L	85.8	Confident	81.7	Confident	120 Å²	120	111.1 Å²	111.1	63%	0.628	54%	0.54	S	S	*	.	H	α-helix	trans	-62	-44.2	175	-74.4	168.8	0	0	0	111.3	E880 T881 A882 I886 T887 A888	E880-L884 WeakPolarHBondContact O-CB 3.36Å; E880-L884 VanDerWaalsContact O-CG 3.26Å; E880-L884 WeakPolarHBondContact O-CG 3.34Å; E880-L884 PolarHBondContact O-N 2.85Å; T881-L884 PolarHBondContact O-N 3.47Å; A882-L884 VanDerWaalsContact C-N 3.34Å; A882-L884 PolarHBondContact O-N 3.37Å; L884-I886 PolarHBondContact O-N 3.18Å; L884-T887 PolarHBondContact O-N 3.47Å; L884-A888 VanDerWaalsContact O-CB 3.27Å; L884-A888 WeakPolarHBondContact O-CB 3.42Å; L884-A888 PolarHBondContact O-N 3.24Å
885	S	86.1	Confident	82.7	Confident	70 Å²	70	109 Å²	109	49%	0.49	54%	0.539	S	S	.	.	H	α-helix	trans	-62.7	-42.5	177.3	82.5	0	0	0	0	112.4	T881 A882 K889	T881-S885 WeakPolarHBondContact O-CB 3.5Å; T881-S885 PolarHBondContact O-N 3.36Å; A882-S885 PolarHBondContact O-N 2.93Å; A882-S885 VanDerWaalsContact O-N 3.16Å; A882-S885 PolarHBondContact O-OG 2.94Å; S885-K889 WeakPolarHBondContact O-CB 3.49Å; S885-K889 PolarHBondContact O-N 3.46Å
886	I	90.7	Very high	83.4	Confident	101 Å²	101	107.4 Å²	107.4	52%	0.518	54%	0.536	S	S	.	.	H	α-helix	trans	-66.7	-46.9	177.5	-67.3	163.8	0	0	0	109.9	A882 I883 L884 A888 K889 Q890	A882-I886 VanDerWaalsContact O-CG1 3.32Å; A882-I886 WeakPolarHBondContact O-CG1 3.17Å; A882-I886 PolarHBondContact O-N 2.89Å; I883-I886 PolarHBondContact O-N 3.22Å; L884-I886 PolarHBondContact O-N 3.18Å; I886-A888 PolarHBondContact O-N 3.18Å; I886-K889 PolarHBondContact O-N 3.18Å; I886-Q890 VanDerWaalsContact O-CB 3.29Å; I886-Q890 WeakPolarHBondContact O-CB 3.33Å; I886-Q890 PolarHBondContact O-N 3.33Å
887	T	89.5	Confident	83.8	Confident	56 Å²	56	107.7 Å²	107.7	34%	0.344	54%	0.537	S	S	.	.	H	α-helix	trans	-63.2	-41.8	-179.9	-57.9	0	0	0	0	111.7	I883 L884 Q890 R891	I883-T887 VanDerWaalsContact O-CB 3.22Å; I883-T887 WeakPolarHBondContact O-CB 3.4Å; I883-T887 PolarHBondContact O-N 3.17Å; I883-T887 PolarHBondContact O-OG1 3.42Å; L884-T887 PolarHBondContact O-N 3.47Å; T887-Q890 PolarHBondContact O-N 3.38Å; T887-R891 WeakPolarHBondContact O-CB 3.11Å; T887-R891 WeakPolarHBondContact O-CG 3.49Å; T887-R891 PolarHBondContact O-N 3.26Å
888	A	87.4	Confident	83.8	Confident	60 Å²	60	107.7 Å²	107.7	50%	0.496	54%	0.535	S	S	.	.	H	α-helix	trans	-65.5	-44.8	175.1	0	0	0	0	0	111.7	L884 I886 Q890 R891 K892	L884-A888 VanDerWaalsContact O-CB 3.27Å; L884-A888 WeakPolarHBondContact O-CB 3.42Å; L884-A888 PolarHBondContact O-N 3.24Å; I886-A888 PolarHBondContact O-N 3.18Å; A888-Q890 VanDerWaalsContact C-N 3.31Å; A888-Q890 PolarHBondContact O-N 3.13Å; A888-R891 PolarHBondContact O-N 3.21Å; A888-K892 WeakPolarHBondContact O-CB 3.28Å; A888-K892 PolarHBondContact O-N 3.32Å
889	K	87.4	Confident	83.2	Confident	169 Å²	169	105.8 Å²	105.8	74%	0.735	53%	0.529	S	S	*	.	H	α-helix	trans	-63.4	-36.4	177	-165.2	172.6	-172.9	176.5	0	111.8	S885 I886 K893	S885-K889 WeakPolarHBondContact O-CB 3.49Å; S885-K889 PolarHBondContact O-N 3.46Å; I886-K889 PolarHBondContact O-N 3.18Å; K889-K893 WeakPolarHBondContact O-CB 3.5Å; K889-K893 PolarHBondContact O-N 3.32Å
890	Q	85.4	Confident	82.4	Confident	111 Å²	111	107.3 Å²	107.3	52%	0.519	53%	0.53	S	S	.	.	H	α-helix	trans	-71.6	-46.8	175.3	-175.4	165.6	-20	0	0	112.2	I886 T887 A888 K892 K893 E894	I886-Q890 VanDerWaalsContact O-CB 3.29Å; I886-Q890 WeakPolarHBondContact O-CB 3.33Å; I886-Q890 PolarHBondContact O-N 3.33Å; T887-Q890 PolarHBondContact O-N 3.38Å; A888-Q890 VanDerWaalsContact C-N 3.31Å; A888-Q890 PolarHBondContact O-N 3.13Å; Q890-K892 VanDerWaalsContact C-N 3.3Å; Q890-K892 PolarHBondContact O-N 2.89Å; Q890-K893 PolarHBondContact O-N 3.24Å; Q890-E894 PolarHBondContact O-N 3.29Å
891	R	84.7	Confident	81.5	Confident	184 Å²	184	108.8 Å²	108.8	69%	0.694	54%	0.535	S	S	*	.	H	α-helix	trans	-57.9	-40.6	173.6	-78.2	-177.9	177	-172.4	0.9	112.3	T887 A888 E894 A895	T887-R891 WeakPolarHBondContact O-CB 3.11Å; T887-R891 WeakPolarHBondContact O-CG 3.49Å; T887-R891 PolarHBondContact O-N 3.26Å; A888-R891 PolarHBondContact O-N 3.21Å; R891-E894 PolarHBondContact O-N 2.74Å; R891-A895 PolarHBondContact O-N 3.19Å
892	K	85	Confident	80.1	Confident	144 Å²	144	110.6 Å²	110.6	63%	0.626	54%	0.537	S	S	*	.	H	α-helix	trans	-62.3	-49.9	174.1	-170.6	173.3	-179.2	177.7	0	111.3	A888 Q890 E894 A895 D896	A888-K892 WeakPolarHBondContact O-CB 3.28Å; A888-K892 PolarHBondContact O-N 3.32Å; Q890-K892 VanDerWaalsContact C-N 3.3Å; Q890-K892 PolarHBondContact O-N 2.89Å; K892-E894 PolarHBondContact O-N 2.72Å; K892-A895 WeakPolarHBondContact O-CB 3.43Å; K892-A895 PolarHBondContact O-N 3.07Å; K892-D896 PolarHBondContact O-N 3.16Å
893	K	83.8	Confident	78.6	Confident	142 Å²	142	114.7 Å²	114.7	62%	0.617	55%	0.549	S	S	*	.	H	α-helix	trans	-59.5	-28.8	176.5	-169.5	175.2	-176.9	178.4	0	113.5	K889 Q890 R897	K889-K893 WeakPolarHBondContact O-CB 3.5Å; K889-K893 PolarHBondContact O-N 3.32Å; Q890-K893 PolarHBondContact O-N 3.24Å; K893-R897 VanDerWaalsContact O-CB 3.32Å; K893-R897 WeakPolarHBondContact O-CB 3.44Å; K893-R897 WeakPolarHBondContact O-CG 3.14Å; K893-R897 PolarHBondContact O-N 3.26Å
894	E	80.5	Confident	77	Confident	97 Å²	97	116.7 Å²	116.7	45%	0.453	56%	0.556	S	S	.	*	H	α-helix	trans	-77.1	-39.2	171.8	-76.2	-178	-164.1	0	0	113.4	Q890 R891 K892 R897 K898	Q890-E894 PolarHBondContact O-N 3.29Å; R891-E894 PolarHBondContact O-N 2.74Å; K892-E894 PolarHBondContact O-N 2.72Å; E894-R897 PolarHBondContact O-N 2.84Å; E894-K898 WeakPolarHBondContact O-CG 3.46Å; E894-K898 PolarHBondContact O-N 3.13Å
895	A	80.4	Confident	75.4	Confident	46 Å²	46	118.9 Å²	118.9	38%	0.38	56%	0.563	S	S	.	*	H	α-helix	trans	-63.4	-48	174	0	0	0	0	0	111.2	R891 K892 R897 K898 Q899	R891-A895 PolarHBondContact O-N 3.19Å; K892-A895 WeakPolarHBondContact O-CB 3.43Å; K892-A895 PolarHBondContact O-N 3.07Å; A895-R897 VanDerWaalsContact C-N 3.29Å; A895-R897 PolarHBondContact O-N 3.05Å; A895-K898 PolarHBondContact O-N 3.46Å; A895-Q899 PolarHBondContact O-N 3.41Å
896	D	79.1	Confident	73.5	Confident	80 Å²	80	120 Å²	120	43%	0.428	57%	0.571	S	S	.	*	H	α-helix	trans	-56.2	-45	174.8	-59	-25.1	0	0	0	110.3	K892 K898 Q899 H900	K892-D896 PolarHBondContact O-N 3.16Å; D896-K898 VanDerWaalsContact C-N 3.35Å; D896-K898 PolarHBondContact O-N 2.89Å; D896-Q899 PolarHBondContact O-N 3.04Å; D896-H900 WeakPolarHBondContact O-CB 3.16Å; D896-H900 PolarHBondContact O-N 3.17Å
897	R	78.8	Confident	71.2	Confident	178 Å²	178	120.3 Å²	120.3	67%	0.672	58%	0.577	S	S	*	*	H	α-helix	trans	-64	-30	175.3	-90.2	179.9	152.8	-168.4	-5.9	114.5	K893 E894 A895 K901	K893-R897 VanDerWaalsContact O-CB 3.32Å; K893-R897 WeakPolarHBondContact O-CB 3.44Å; K893-R897 WeakPolarHBondContact O-CG 3.14Å; K893-R897 PolarHBondContact O-N 3.26Å; E894-R897 PolarHBondContact O-N 2.84Å; A895-R897 VanDerWaalsContact C-N 3.29Å; A895-R897 PolarHBondContact O-N 3.05Å; R897-K901 WeakPolarHBondContact O-CG 3.41Å; R897-K901 PolarHBondContact O-N 2.65Å
898	K	73.5	Confident	68.7	Low	127 Å²	127	123.2 Å²	123.2	55%	0.552	60%	0.595	S	S	*	*	H	α-helix	trans	-74.3	-49.4	175.8	-77.2	175	179.7	176.1	0	110.6	E894 A895 D896 H900 K901 E902	E894-K898 WeakPolarHBondContact O-CG 3.46Å; E894-K898 PolarHBondContact O-N 3.13Å; A895-K898 PolarHBondContact O-N 3.46Å; D896-K898 VanDerWaalsContact C-N 3.35Å; D896-K898 PolarHBondContact O-N 2.89Å; K898-H900 VanDerWaalsContact C-N 3.27Å; K898-H900 PolarHBondContact O-N 2.82Å; K898-K901 PolarHBondContact O-N 2.61Å; K898-E902 PolarHBondContact O-N 3.35Å
899	Q	65.8	Low	66.3	Low	111 Å²	111	127.2 Å²	127.2	52%	0.519	61%	0.614	S	S	.	*	H	α-helix	trans	-57.1	-41.5	175.6	-67.1	-177.1	3	0	0	111.7	A895 D896 K901 E902 Q903	A895-Q899 PolarHBondContact O-N 3.41Å; D896-Q899 PolarHBondContact O-N 3.04Å; Q899-K901 VanDerWaalsContact C-N 3.28Å; Q899-K901 PolarHBondContact O-N 2.76Å; Q899-E902 PolarHBondContact O-N 3.21Å; Q899-Q903 WeakPolarHBondContact O-CB 3.21Å; Q899-Q903 WeakPolarHBondContact O-CG 2.91Å; Q899-Q903 PolarHBondContact O-N 2.72Å
900	H	63.9	Low	63.6	Low	116 Å²	116	122.9 Å²	122.9	54%	0.537	62%	0.617	S	S	.	*	H	α-helix	trans	-64.8	-27.7	177	-127.9	-64.5	0	0	0	114	D896 K898 Q904	D896-H900 WeakPolarHBondContact O-CB 3.16Å; D896-H900 PolarHBondContact O-N 3.17Å; K898-H900 VanDerWaalsContact C-N 3.27Å; K898-H900 PolarHBondContact O-N 2.82Å; H900-Q904 WeakPolarHBondContact O-CB 3.39Å; H900-Q904 WeakPolarHBondContact O-CG 3.48Å
901	K	62.9	Low	61	Low	148 Å²	148	121.6 Å²	121.6	64%	0.643	63%	0.634	S	S	*	*	H	α-helix	trans	-80.6	-41.5	174.4	-79.1	-176.2	172.2	-170.9	0	112.1	R897 K898 Q899 Q904 Q905	R897-K901 WeakPolarHBondContact O-CG 3.41Å; R897-K901 PolarHBondContact O-N 2.65Å; K898-K901 PolarHBondContact O-N 2.61Å; Q899-K901 VanDerWaalsContact C-N 3.28Å; Q899-K901 PolarHBondContact O-N 2.76Å; K901-Q904 PolarHBondContact O-N 3.35Å; K901-Q905 PolarHBondContact O-N 2.87Å; K901-Q905 VanDerWaalsContact O-N 3.11Å
902	E	58.1	Low	58.7	Low	127 Å²	127	117.7 Å²	117.7	59%	0.593	64%	0.641	S	S	*	*	H	α-helix	trans	-64.3	-44.1	178.9	-71.8	164.2	-179.7	0	0	110.8	K898 Q899 Q904 Q905 S906	K898-E902 PolarHBondContact O-N 3.35Å; Q899-E902 PolarHBondContact O-N 3.21Å; E902-Q904 VanDerWaalsContact C-N 3.26Å; E902-Q904 PolarHBondContact O-N 3.33Å; E902-Q905 PolarHBondContact O-N 3.06Å; E902-Q905 VanDerWaalsContact O-N 3.1Å; E902-S906 PolarHBondContact O-N 3.26Å; E902-S906 PolarHBondContact O-OG 2.84Å
903	Q	55.1	Low	56.6	Low	130 Å²	130	119.2 Å²	119.2	61%	0.607	65%	0.65	S	S	*	*	H	α-helix	trans	-65.1	-26	174.1	-69.8	-179.5	4.2	0	0	113.7	Q899 S906	Q899-Q903 WeakPolarHBondContact O-CB 3.21Å; Q899-Q903 WeakPolarHBondContact O-CG 2.91Å; Q899-Q903 PolarHBondContact O-N 2.72Å; Q903-S906 PolarHBondContact O-OG 3.47Å
904	Q	54.1	Low	54.2	Low	134 Å²	134	118.2 Å²	118.2	63%	0.626	66%	0.656	S	S	*	*	H	α-helix	trans	-84.2	-10.5	174.5	-75.7	177.3	-1.3	0	0	113.7	H900 K901 E902	H900-Q904 WeakPolarHBondContact O-CB 3.39Å; H900-Q904 WeakPolarHBondContact O-CG 3.48Å; K901-Q904 PolarHBondContact O-N 3.35Å; E902-Q904 VanDerWaalsContact C-N 3.26Å; E902-Q904 PolarHBondContact O-N 3.33Å
905	Q	52.1	Low	52.3	Low	166 Å²	166	120.1 Å²	120.1	78%	0.776	67%	0.669	S	S	*	*	H	α-helix	trans	-99.2	-15.7	173.3	-71.9	-174	-19.9	0	0	113.2	K901 E902 T907	K901-Q905 PolarHBondContact O-N 2.87Å; K901-Q905 VanDerWaalsContact O-N 3.11Å; E902-Q905 PolarHBondContact O-N 3.06Å; E902-Q905 VanDerWaalsContact O-N 3.1Å; Q905-T907 VanDerWaalsContact C-N 3.26Å; Q905-T907 PolarHBondContact O-N 3Å
906	S	46.4	Very low	50	Low	93 Å²	93	126.2 Å²	126.2	65%	0.65	69%	0.687	S	S	*	*	S	Bend	trans	-76.9	3.3	177.4	50.2	0	0	0	0	116	E902 Q903	E902-S906 PolarHBondContact O-N 3.26Å; E902-S906 PolarHBondContact O-OG 2.84Å; Q903-S906 PolarHBondContact O-OG 3.47Å
907	T	42	Very low	48	Very low	107 Å²	107	128.7 Å²	128.7	66%	0.656	70%	0.7	S	S	*	*	S	Bend	trans	-112.8	34.5	-173.7	45.5	0	0	0	0	114.2	Q905	Q905-T907 VanDerWaalsContact C-N 3.26Å; Q905-T907 PolarHBondContact O-N 3Å
908	T	37.2	Very low	45.8	Very low	117 Å²	117	123.8 Å²	123.8	72%	0.718	69%	0.693	S	S	*	*	S	Bend	trans	-146	129.8	166.1	-52.9	0	0	0	0	112.2
909	T	36	Very low	44.1	Very low	144 Å²	144	125.6 Å²	125.6	88%	0.883	70%	0.703	S	S	*	*			trans	67.6	121.6	179.1	-14.7	0	0	0	0	115.8
910	G	31.5	Very low	42.4	Very low	79 Å²	79	126.3 Å²	126.3	81%	0.814	72%	0.715	S	S	*	*			trans	-138.5	156.9	173.1	0	0	0	0	0	113.1
911	G	29.6	Very low	40.9	Very low	84 Å²	84	130.5 Å²	130.5	87%	0.866	73%	0.732	S	S	*	*			trans	101.5	104.1	158.7	0	0	0	0	0	117.9
912	A	36.6	Very low	39.7	Very low	102 Å²	102	132.6 Å²	132.6	84%	0.843	74%	0.744	S	S	*	*			trans	-166.7	65	151.9	0	0	0	0	0	113.6
913	Q	40.8	Very low	38.4	Very low	175 Å²	175	132.9 Å²	132.9	82%	0.818	75%	0.754	S	S	*	*			trans	25.8	124.9	143.2	-70.7	179.4	-41.8	0	0	123.4
914	T	33.3	Very low	37.3	Very low	121 Å²	121	132.1 Å²	132.1	74%	0.742	75%	0.749	S	S	*	*			trans	70.7	153.6	130.1	61.7	0	0	0	0	121.3
915	L	40.2	Very low	36.1	Very low	138 Å²	138	134.3 Å²	134.3	72%	0.723	76%	0.761	S	S	*	*			cis	-158.7	151.8	-1.6	-116.9	160.5	0	0	0	110.7
916	K	33.7	Very low	35.6	Very low	173 Å²	173	133.5 Å²	133.5	75%	0.752	76%	0.763	S	S	*	*			trans	15.8	155.6	148.2	-76.5	-178.9	-175	-175	0	122.4
917	D	35.4	Very low	35.1	Very low	132 Å²	132	136 Å²	136	71%	0.706	77%	0.767	S	S	*	*			cis	-166.1	159.5	45.6	-136.2	-43.1	0	0	0	118.2
918	S	34.3	Very low	34.7	Very low	75 Å²	75	135.7 Å²	135.7	52%	0.524	76%	0.761	S	S	.	*			trans	69.3	117	143.1	-77.1	0	0	0	0	127.4
919	Q	36.4	Very low	34.3	Very low	165 Å²	165	132.8 Å²	132.8	77%	0.771	75%	0.749	S	S	*	*				70.6	107.9	125.2	-63.7	174.1	56.5	0	0	120.4
920	T	31.1	Very low	34.4	Very low	126 Å²	126	131.8 Å²	131.8	77%	0.773	75%	0.745	S	S	*	*				91.7	107.8	52.3	59.1	0	0	0	0	116.5
921	K	32.6	Very low	34.2	Very low	204 Å²	204	136 Å²	136	89%	0.887	75%	0.748	S	S	*	*				177.5	72.9	120.1	-99.3	-174	176.8	-175.8	0	113.9
922	E	36.7	Very low	34.4	Very low	193 Å²	193	139.7 Å²	139.7	90%	0.902	74%	0.743	S	S	*	*			trans	-137.5	137.8	161.7	-69.1	-175.6	150	0	0	108.7
923	V	30.9	Very low	34.1	Very low	132 Å²	132	141.2 Å²	141.2	80%	0.8	74%	0.742	S	S	*	*			trans	-155.7	128.8	-176.2	-176	0	0	0	0	108.1
924	K	31.1	Very low	33.6	Very low	114 Å²	114	139.3 Å²	139.3	50%	0.496	74%	0.742	S	S	.	*			cis	-104.6	170.7	-2.8	-74.9	101.1	168.1	-81.9	0	111.9	D928 A929	K924-D928 WeakPolarHBondContact CG-OD1 3.22Å; K924-D928 IonicContact NZ-OD1 2.69Å; K924-D928 PolarHBondContact NZ-OD1 3.06Å; K924-D928 IonicContact NZ-OD2 2.67Å; K924-D928 PolarHBondContact NZ-OD2 2.84Å; K924-A929 HydrophobicContact CG-CB 3.81Å
925	M	30.4	Very low	33.3	Very low	180 Å²	180	142 Å²	142	89%	0.887	74%	0.743	S	S	*	*			trans	-78.3	123.1	148.2	-71.2	171.1	-83.2	0	0	107.9
926	D	40.9	Very low	32.7	Very low	150 Å²	150	144.3 Å²	144.3	80%	0.802	75%	0.751	S	S	*	*	S	Bend	trans	-65	124.6	-177.1	-68.2	-51.8	0	0	0	112.1
927	I	36.8	Very low	32.3	Very low	145 Å²	145	144.7 Å²	144.7	74%	0.744	76%	0.755	S	S	*	*	S	Bend	cis	-151.9	139.5	-9.6	-56.1	177.5	0	0	0	105.1
928	D	33.4	Very low	31.9	Very low	100 Å²	100	146.9 Å²	146.9	54%	0.535	76%	0.758	S	S	.	*			cis	-144	154.2	-14.6	-113.6	-9.9	0	0	0	105.7	K924	K924-D928 WeakPolarHBondContact CG-OD1 3.22Å; K924-D928 IonicContact NZ-OD1 2.69Å; K924-D928 PolarHBondContact NZ-OD1 3.06Å; K924-D928 IonicContact NZ-OD2 2.67Å; K924-D928 PolarHBondContact NZ-OD2 2.84Å
929	A	29	Very low	31.7	Very low	57 Å²	57	149.5 Å²	149.5	47%	0.471	77%	0.773	S	S	.	*			cis	90.1	124.9	39.2	0	0	0	0	0	114.3	K924	K924-A929 HydrophobicContact CG-CB 3.81Å
930	P	38.2	Very low	31.3	Very low	123 Å²	123	145.5 Å²	145.5	80%	0.799	76%	0.764	S	S	*	*			trans	-91.8	147.8	-165.7	35.4	-36.3	0	0	0	114.6
931	L	27.3	Very low	31.2	Very low	166 Å²	166	145 Å²	145	87%	0.869	76%	0.76	S	S	*	*				-171.2	171.7	120.3	-102.4	163.1	0	0	0	111.7
932	E	33.7	Very low	30.8	Very low	163 Å²	163	140.1 Å²	140.1	76%	0.762	75%	0.752	S	S	*	*			trans	-90	169.8	-163.8	-59.9	166.6	111	0	0	114.5
933	T	29.4	Very low	30.4	Very low	133 Å²	133	136.2 Å²	136.2	82%	0.816	74%	0.742	S	S	*	*			trans	64.3	102.8	166.8	65.7	0	0	0	0	117.8
934	V	30.1	Very low	30.3	Very low	135 Å²	135	135.4 Å²	135.4	82%	0.818	74%	0.737	S	S	*	*				-151.1	125	107.9	165.4	0	0	0	0	108.8
935	K	26.9	Very low	30.1	Very low	177 Å²	177	137.7 Å²	137.7	77%	0.77	75%	0.749	S	S	*	*			trans	27.5	139.6	156.2	-62.5	-177.5	176.8	-175.1	0	122.5	E937	K935-E937 PolarHBondContact O-N 3.34Å
936	E	28.5	Very low	30.1	Very low	188 Å²	188	135 Å²	135	88%	0.879	74%	0.743	S	S	*	*			trans	-53.2	126.5	149.8	-54	155.8	119.9	0	0	111.2
937	E	25.6	Very low	29.6	Very low	180 Å²	180	136.4 Å²	136.4	84%	0.841	74%	0.743	S	S	*	*			trans	-155.9	155.6	151.5	-117.3	158.4	-131.6	0	0	109.3	K935	K935-E937 PolarHBondContact O-N 3.34Å
938	K	26.3	Very low	29.7	Very low	179 Å²	179	137.8 Å²	137.8	78%	0.778	75%	0.746	S	S	*	*			trans	-73.4	144.8	-166.1	-59.9	168.9	-176.5	171.1	0	111.4	S940	K938-S940 PolarHBondContact O-N 3.44Å
939	P	31	Very low	30.1	Very low	130 Å²	130	142 Å²	142	84%	0.844	76%	0.762	S	S	*	*			trans	-72.9	64.9	150.8	33.9	-33.4	0	0	0	109.1	T941	P939-T941 PolarHBondContact O-N 3.13Å
940	S	27.6	Very low	31.4	Very low	81 Å²	81	149 Å²	149	57%	0.566	78%	0.782	S	S	*	*			trans	-65.3	130.1	163.9	46.1	0	0	0	0	108.4	K938 S942	K938-S940 PolarHBondContact O-N 3.44Å; S940-S942 PolarHBondContact O-N 2.89Å
941	T	27.8	Very low	32.8	Very low	114 Å²	114	146.6 Å²	146.6	70%	0.699	76%	0.76	S	S	*	*			trans	45.2	71.4	166.5	50	0	0	0	0	113.9	P939 T943	P939-T941 PolarHBondContact O-N 3.13Å; T941-T943 PolarHBondContact O-N 3.33Å
942	S	26	Very low	35.1	Very low	103 Å²	103	142.2 Å²	142.2	72%	0.72	74%	0.741	S	S	*	*			trans	-70.2	68.1	151.7	61.4	0	0	0	0	109.1	S940 T944	S940-S942 PolarHBondContact O-N 2.89Å; S942-T944 PolarHBondContact O-N 3.45Å
943	T	27.9	Very low	37.4	Very low	111 Å²	111	140.1 Å²	140.1	68%	0.681	74%	0.736	S	S	*	*			trans	-65.1	73.4	158.3	43.6	0	0	0	0	107.6	T941 E945	T941-T943 PolarHBondContact O-N 3.33Å; T943-E945 PolarHBondContact O-N 3.41Å
944	T	27.6	Very low	40	Very low	115 Å²	115	138 Å²	138	71%	0.706	72%	0.715	S	S	*	*			trans	-62.1	93.8	142.5	33.1	0	0	0	0	105.3	S942 T946	S942-T944 PolarHBondContact O-N 3.45Å; T944-T946 PolarHBondContact O-N 3.29Å
945	E	28.8	Very low	42.5	Very low	161 Å²	161	132.6 Å²	132.6	75%	0.752	68%	0.683	S	S	*	*			trans	-55.7	82.5	149	-67.8	179.5	-170.7	0	0	106.8	T943 K947	T943-E945 PolarHBondContact O-N 3.41Å; E945-K947 PolarHBondContact O-N 2.87Å
946	T	30.1	Very low	45.3	Very low	124 Å²	124	128.3 Å²	128.3	76%	0.761	67%	0.668	S	S	*	*			trans	-48.6	104.2	134.1	39.9	0	0	0	0	103.9	T944 E948	T944-T946 PolarHBondContact O-N 3.29Å; T946-E948 VanDerWaalsContact C-N 3.34Å; T946-E948 PolarHBondContact O-N 2.86Å
947	K	30.7	Very low	48	Very low	180 Å²	180	121 Å²	121	78%	0.783	64%	0.635	S	S	*	*			trans	-57.4	105.7	-178	-71.6	176.1	178.6	174	0	106	E945 E949	E945-K947 PolarHBondContact O-N 2.87Å; K947-E949 PolarHBondContact O-N 3.29Å
948	E	37.3	Very low	50.9	Low	173 Å²	173	117.4 Å²	117.4	81%	0.808	62%	0.622	S	S	*	*			trans	-49.4	118.4	168.1	-64.3	-176.7	150	0	0	105.5	T946 K950	T946-E948 VanDerWaalsContact C-N 3.34Å; T946-E948 PolarHBondContact O-N 2.86Å; E948-K950 PolarHBondContact O-N 3.22Å
949	E	41.6	Very low	53.7	Low	189 Å²	189	109.3 Å²	109.3	88%	0.883	59%	0.587	S	S	*	*			trans	-60.4	104.5	-172.4	-70.6	-163.4	134.3	0	0	107.1	K947 E951	K947-E949 PolarHBondContact O-N 3.29Å; E949-E951 PolarHBondContact O-N 3.2Å
950	K	57	Low	56.4	Low	204 Å²	204	103.6 Å²	103.6	89%	0.887	55%	0.55	S	S	*	.			trans	-52.4	107.3	-163.3	-77	-169.4	174	-172.2	0	109	E948	E948-K950 PolarHBondContact O-N 3.22Å
951	E	67.2	Low	59.2	Low	73 Å²	73	100 Å²	100	34%	0.341	53%	0.525	S	S	.	.			trans	-49.5	135.8	-169	-75.3	-171.4	-161.3	0	0	110.3	S860 E949 N953	S860-E951 WeakPolarHBondContact CB-OE1 3.22Å; S860-E951 WeakPolarHBondContact CB-OE2 3.34Å; S860-E951 PolarHBondContact N-OE2 2.93Å; S860-E951 VanDerWaalsContact OG-CD 3.24Å; S860-E951 PolarHBondContact OG-OE1 2.81Å; S860-E951 PolarHBondContact OG-OE2 2.8Å; E949-E951 PolarHBondContact O-N 3.2Å; E951-N953 PolarHBondContact O-N 2.67Å; E951-N953 VanDerWaalsContact O-N 3.14Å
952	P	76.4	Confident	62.2	Low	73 Å²	73	95.5 Å²	95.5	47%	0.474	50%	0.496	S	S	.	.			trans	-58.7	126.2	179	25.9	-34	0	0	0	108.5	P859 F954	P859-P952 WeakPolarHBondContact CD-O 3.49Å; P859-P952 HydrophobicContact CG-CG 4.04Å; P952-F954 PolarHBondContact O-N 3.5Å
953	N	81.8	Confident	65.1	Low	120 Å²	120	90.9 Å²	90.9	64%	0.642	46%	0.463	S	S	*	.	S	Bend	trans	-64.8	2	-179.1	-70.7	-32.3	0	0	0	113.6	N856 A857 E951	N856-N953 CarbonylContact C-O 3.56Å; A857-N953 CarbonylContact C-O 3.59Å; A857-N953 PolarHBondContact N-O 3.39Å; E951-N953 PolarHBondContact O-N 2.67Å; E951-N953 VanDerWaalsContact O-N 3.14Å
954	F	83.2	Confident	67.9	Low	89 Å²	89	86 Å²	86	39%	0.39	43%	0.433	S	S	.	.			trans	-140.2	152.1	172.7	66.7	-84.8	0	0	0	110.6	R854 S855 P952 L956	R854-F954 HydrophobicContact CG-CB 4.24Å; R854-F954 HydrophobicContact CG-CD2 4.45Å; S855-F954 CarbonylContact O-C 3.51Å; S855-F954 WeakPolarHBondContact O-CA 3.5Å; P952-F954 PolarHBondContact O-N 3.5Å; F954-L956 HydrophobicContact CD2-CD2 4.47Å; F954-L956 HydrophobicContact CD2-CG 4.44Å; F954-L956 HydrophobicContact CE2-CG 4.35Å
955	S	83.2	Confident	70.5	Confident	21 Å²	21	87.2 Å²	87.2	15%	0.147	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	144.7	170.6	31.9	0	0	0	0	110.1	S855	S855-S955 WeakPolarHBondContact CB-OG 3.43Å; S855-S955 PolarHBondContact N-O 3.33Å; S855-S955 PolarHBondContact O-N 3.15Å
956	L	85.1	Confident	73.1	Confident	86 Å²	86	82.2 Å²	82.2	45%	0.45	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	123.5	172.7	-64.7	176.4	0	0	0	109	F853 R854 F954	F853-L956 WeakPolarHBondContact O-CA 3.43Å; R854-L956 HydrophobicContact CB-CD2 4.19Å; F954-L956 HydrophobicContact CD2-CD2 4.47Å; F954-L956 HydrophobicContact CD2-CG 4.44Å; F954-L956 HydrophobicContact CE2-CG 4.35Å
957	L	85.3	Confident	75.7	Confident	35 Å²	35	76.7 Å²	76.7	18%	0.183	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	123.2	-176.3	-53.1	177.8	0	0	0	109.4	Q852 F853 A961 V963	Q852-L957 CarbonylContact C-O 3.57Å; Q852-L957 WeakPolarHBondContact CA-O 3.35Å; F853-L957 HydrophobicContact CB-CB 4.46Å; F853-L957 PolarHBondContact N-O 2.9Å; F853-L957 PolarHBondContact O-N 2.74Å; L957-A961 HydrophobicContact CB-CB 3.82Å; L957-A961 HydrophobicContact CD1-CB 4.46Å; L957-V963 HydrophobicContact CD1-CG2 4.13Å
958	N	86.7	Confident	78.2	Confident	104 Å²	104	69.3 Å²	69.3	56%	0.556	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	142.1	178.2	-60.7	-50.6	0	0	0	111.1	Q852 P960 A961	Q852-N958 WeakPolarHBondContact CG-OD1 3.5Å; Q852-N958 PolarHBondContact NE2-OD1 3.12Å; Q852-N958 VanDerWaalsContact NE2-OD1 3.08Å; N958-P960 CarbonylContact O-C 3.23Å; N958-A961 WeakPolarHBondContact O-CB 3.33Å; N958-A961 PolarHBondContact O-N 3.24Å
959	N	86.5	Confident	80.4	Confident	10 Å²	10	71.3 Å²	71.3	5%	0.053	34%	0.341	C	S	.	.	S	Bend	trans	-66.2	129.8	170.2	-171.3	34.6	0	0	0	111.3	I840 A841 P849 I851 F853	I840-N959 WeakPolarHBondContact CA-OD1 3.46Å; A841-N959 PolarHBondContact N-OD1 3.46Å; A841-N959 PolarHBondContact O-ND2 3.46Å; P849-N959 PolarHBondContact O-ND2 2.96Å; I851-N959 HydrophobicContact CB-CB 4.29Å; I851-N959 PolarHBondContact O-N 3.39Å; F853-N959 HydrophobicContact CE2-CB 4.18Å
960	P	87.2	Confident	82.5	Confident	9 Å²	9	67.9 Å²	67.9	6%	0.058	32%	0.321	C	S	.	.	S	Bend	cis	-84.1	132	-6.4	34.4	-34.3	0	0	0	113	F390 N394 I840 M848 N958	F390-P960 HydrophobicContact CB-CB 4.44Å; F390-P960 HydrophobicContact CB-CG 4.42Å; F390-P960 HydrophobicContact CD2-CB 4.1Å; F390-P960 HydrophobicContact CD2-CG 4.38Å; N394-P960 PolarHBondContact ND2-O 3.12Å; I840-P960 HydrophobicContact CG1-CB 3.91Å; I840-P960 HydrophobicContact CG2-CB 4.48Å; M848-P960 HydrophobicContact SD-CG 4.25Å; N958-P960 CarbonylContact O-C 3.23Å
961	A	86.8	Confident	83.9	Confident	7 Å²	7	58.5 Å²	58.5	6%	0.058	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	148	-172.1	0	0	0	0	0	112.9	A838 L839 F853 L957 N958 V963	A838-A961 CarbonylContact C-O 3.58Å; A838-A961 WeakPolarHBondContact CA-O 3.37Å; L839-A961 HydrophobicContact CB-CB 4.48Å; L839-A961 PolarHBondContact N-O 3.04Å; L839-A961 PolarHBondContact O-N 2.99Å; F853-A961 HydrophobicContact CD2-CB 4.36Å; L957-A961 HydrophobicContact CB-CB 3.82Å; L957-A961 HydrophobicContact CD1-CB 4.46Å; N958-A961 WeakPolarHBondContact O-CB 3.33Å; N958-A961 PolarHBondContact O-N 3.24Å; A961-V963 HydrophobicContact CB-CG2 4.25Å
962	R	90.1	Very high	84.7	Confident	19 Å²	19	58.2 Å²	58.2	7%	0.072	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	129.9	162.1	-179.9	-175.8	169.2	-129	-8.8	108.7	F390 Q748 C793 T837 Y864 M964	F390-R962 HydrophobicContact CE2-CB 4.32Å; F390-R962 HydrophobicContact CZ-CB 4.19Å; Q748-R962 PolarHBondContact O-NH2 3.3Å; Q748-R962 VanDerWaalsContact OE1-NE 3.15Å; C793-R962 PolarHBondContact O-NE 2.99Å; C793-R962 VanDerWaalsContact O-NE 3.12Å; T837-R962 CarbonylContact O-C 3.38Å; T837-R962 WeakPolarHBondContact O-CA 3.46Å; Y864-R962 VanDerWaalsContact CE1-CD 3.42Å; Y864-R962 WeakPolarHBondContact OH-CD 3.26Å; R962-M964 PolarHBondContact NH2-SD 3.04Å
963	V	87.5	Confident	84.9	Confident	6 Å²	6	56.6 Å²	56.6	4%	0.036	27%	0.271	C	S	.	.			trans	-142.2	116.2	177.8	-176.1	0	0	0	0	110.2	T837 L839 L957 A961 Q967 Q968 V971	T837-V963 PolarHBondContact O-N 3.18Å; L839-V963 HydrophobicContact CB-CB 4.29Å; L839-V963 HydrophobicContact CB-CG2 3.63Å; L839-V963 HydrophobicContact CD2-CG2 3.96Å; L839-V963 HydrophobicContact CG-CG2 4.45Å; L957-V963 HydrophobicContact CD1-CG2 4.13Å; A961-V963 HydrophobicContact CB-CG2 4.25Å; V963-Q967 HydrophobicContact CG1-CB 3.99Å; V963-Q967 HydrophobicContact CG1-CG 4.12Å; V963-Q968 HydrophobicContact CG1-CG 3.85Å; V963-V971 HydrophobicContact CG1-CG2 3.87Å
964	M	86.5	Confident	84.8	Confident	9 Å²	9	52.4 Å²	52.4	4%	0.044	25%	0.25	C	S	.	.			trans	-72.8	155.7	177.4	-64.7	178.4	71.3	0	0	112.2	Q748 F862 R962 S966 Q967 Q968	Q748-M964 HydrophobicContact CB-CE 3.9Å; Q748-M964 WeakPolarHBondContact O-CE 3.38Å; F862-M964 HydrophobicContact CD1-SD 4.1Å; R962-M964 PolarHBondContact NH2-SD 3.04Å; M964-S966 PolarHBondContact O-N 2.93Å; M964-Q967 HydrophobicContact CB-CB 4.14Å; M964-Q967 WeakPolarHBondContact O-CA 3.4Å; M964-Q967 VanDerWaalsContact O-CB 3.29Å; M964-Q967 WeakPolarHBondContact O-CB 3.47Å; M964-Q967 PolarHBondContact O-N 2.76Å; M964-Q968 PolarHBondContact O-N 2.77Å
965	R	80.9	Confident	84.2	Confident	139 Å²	139	57.3 Å²	57.3	53%	0.525	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-34.1	179.6	-164.8	177.9	-173.2	-175.6	2.3	113.3	Q800	Q800-R965 VanDerWaalsContact OE1-CZ 3.28Å
966	S	83.5	Confident	83.7	Confident	56 Å²	56	61.8 Å²	61.8	39%	0.392	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-34.8	171.3	46.7	0	0	0	0	113	M964	M964-S966 PolarHBondContact O-N 2.93Å
967	Q	86	Confident	83.1	Confident	9 Å²	9	58.7 Å²	58.7	4%	0.042	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-71.2	-31.5	179.3	-167.5	176.2	12.1	0	0	113	S855 F862 V963 M964 R969 Y970 V971	S855-Q967 PolarHBondContact OG-NE2 3.36Å; S855-Q967 VanDerWaalsContact OG-NE2 3.14Å; F862-Q967 HydrophobicContact CD1-CB 3.82Å; F862-Q967 HydrophobicContact CD1-CG 4.11Å; F862-Q967 HydrophobicContact CD2-CB 4.22Å; F862-Q967 HydrophobicContact CD2-CG 3.67Å; F862-Q967 HydrophobicContact CE1-CB 3.64Å; F862-Q967 HydrophobicContact CE1-CG 4.2Å; F862-Q967 HydrophobicContact CE2-CB 4.04Å; F862-Q967 HydrophobicContact CE2-CG 3.75Å; F862-Q967 HydrophobicContact CG-CB 4.1Å; F862-Q967 HydrophobicContact CG-CG 3.85Å; F862-Q967 HydrophobicContact CZ-CB 3.76Å; F862-Q967 HydrophobicContact CZ-CG 4.02Å; V963-Q967 HydrophobicContact CG1-CB 3.99Å; V963-Q967 HydrophobicContact CG1-CG 4.12Å; M964-Q967 HydrophobicContact CB-CB 4.14Å; M964-Q967 WeakPolarHBondContact O-CA 3.4Å; M964-Q967 VanDerWaalsContact O-CB 3.29Å; M964-Q967 WeakPolarHBondContact O-CB 3.47Å; M964-Q967 PolarHBondContact O-N 2.76Å; Q967-R969 PolarHBondContact O-N 3.49Å; Q967-Y970 PolarHBondContact O-N 3.29Å; Q967-V971 HydrophobicContact CG-CG2 4.23Å; Q967-V971 PolarHBondContact O-N 3.5Å
968	Q	83	Confident	82.9	Confident	25 Å²	25	59.6 Å²	59.6	12%	0.117	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-50.8	-29.5	-179.2	-74.3	170.3	-17.1	0	0	114	V963 M964 Y970	V963-Q968 HydrophobicContact CG1-CG 3.85Å; M964-Q968 PolarHBondContact O-N 2.77Å; Q968-Y970 VanDerWaalsContact C-N 3.29Å; Q968-Y970 PolarHBondContact O-N 2.91Å
969	R	84	Confident	82.7	Confident	214 Å²	214	55.5 Å²	55.5	81%	0.808	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-69.9	-21.5	176.8	-60.4	-175.5	-176.7	-174.8	1.5	113.9	Q967	Q967-R969 PolarHBondContact O-N 3.49Å
970	Y	84.5	Confident	82.4	Confident	118 Å²	118	58.8 Å²	58.8	46%	0.463	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-9.9	-175.9	-58.6	-84	0	0	0	113.6	N856 A857 F862 Q967 Q968	N856-Y970 WeakPolarHBondContact CB-O 3.38Å; N856-Y970 PolarHBondContact N-O 3.44Å; N856-Y970 PolarHBondContact ND2-O 2.82Å; A857-Y970 HydrophobicContact CB-CG 4.4Å; F862-Y970 HydrophobicContact CE2-CD2 4.45Å; F862-Y970 HydrophobicContact CZ-CD2 4.34Å; Q967-Y970 PolarHBondContact O-N 3.29Å; Q968-Y970 VanDerWaalsContact C-N 3.29Å; Q968-Y970 PolarHBondContact O-N 2.91Å
971	V	85.8	Confident	81.9	Confident	6 Å²	6	59.7 Å²	59.7	4%	0.036	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	120.8	-177.3	-172.4	0	0	0	0	110.8	L839 F853 R854 V963 Q967 I985	L839-V971 HydrophobicContact CD2-CG1 4.2Å; F853-V971 HydrophobicContact CB-CG1 3.75Å; F853-V971 HydrophobicContact CG-CG1 4.47Å; R854-V971 WeakPolarHBondContact O-CA 3.23Å; V963-V971 HydrophobicContact CG1-CG2 3.87Å; Q967-V971 HydrophobicContact CG-CG2 4.23Å; Q967-V971 PolarHBondContact O-N 3.5Å; V971-I985 HydrophobicContact CB-CG2 4.06Å; V971-I985 HydrophobicContact CG1-CG2 3.8Å
972	T	84.1	Confident	81.2	Confident	67 Å²	67	62.7 Å²	62.7	41%	0.411	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	158.4	171.7	63	0	0	0	0	111.2	R854 N856	R854-T972 PolarHBondContact N-O 2.69Å; R854-T972 PolarHBondContact O-N 2.87Å; N856-T972 PolarHBondContact ND2-OG1 2.67Å
973	L	81.9	Confident	80.4	Confident	39 Å²	39	62.5 Å²	62.5	20%	0.204	31%	0.306	C	S	.	.			trans	-84	138.2	168.2	-161.7	66.2	0	0	0	109.1	I851 F853 E975 Y979 I985	I851-L973 HydrophobicContact CG2-CD1 4.01Å; F853-L973 HydrophobicContact CD1-CD1 4.19Å; F853-L973 HydrophobicContact CE1-CD1 4.49Å; L973-E975 PolarHBondContact O-N 3.43Å; L973-Y979 WeakPolarHBondContact CD2-O 3.32Å; L973-I985 HydrophobicContact CB-CD1 3.85Å
974	P	79.3	Confident	79.8	Confident	33 Å²	33	66 Å²	66	21%	0.214	33%	0.329	C	S	.	.			trans	-61.1	134.4	168.4	-22.1	33.7	0	0	0	111	Q852 R854 S976 S977	Q852-P974 VanDerWaalsContact O-CD 3.29Å; Q852-P974 WeakPolarHBondContact O-CD 3.39Å; R854-P974 HydrophobicContact CB-CG 4.35Å; P974-S976 PolarHBondContact O-N 3.04Å; P974-S977 WeakPolarHBondContact O-CB 3.44Å; P974-S977 PolarHBondContact O-N 3.47Å
975	E	69.8	Low	79.3	Confident	191 Å²	191	66.3 Å²	66.3	89%	0.893	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-32.3	178.8	-64.9	174.9	-177.6	0	0	112.7	L973 S977	L973-E975 PolarHBondContact O-N 3.43Å; E975-S977 PolarHBondContact O-N 3.17Å
976	S	72.7	Confident	78.8	Confident	116 Å²	116	63.1 Å²	63.1	81%	0.811	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-1.7	173.9	54.7	0	0	0	0	114.6	P974 R978	P974-S976 PolarHBondContact O-N 3.04Å; S976-R978 PolarHBondContact O-N 3.42Å
977	S	73.8	Confident	78.1	Confident	20 Å²	20	63.6 Å²	63.6	14%	0.14	33%	0.326	C	S	.	.			trans	-64.5	134.1	177	-173.2	0	0	0	0	111.4	P974 E975 Y979 K996	P974-S977 WeakPolarHBondContact O-CB 3.44Å; P974-S977 PolarHBondContact O-N 3.47Å; E975-S977 PolarHBondContact O-N 3.17Å; S977-Y979 PolarHBondContact O-N 3.49Å; S977-Y979 VanDerWaalsContact O-N 3.13Å; S977-Y979 PolarHBondContact OG-N 2.9Å; S977-K996 PolarHBondContact O-NZ 3.1Å
978	R	80.8	Confident	77.6	Confident	55 Å²	55	63.3 Å²	63.3	21%	0.208	32%	0.324	C	S	.	.	S	Bend	trans	-56	-19.8	166.7	168.5	170.7	173.3	-178.8	-3.3	112.7	S976 D995 K996 S997 D1000 A1001	S976-R978 PolarHBondContact O-N 3.42Å; R978-D995 WeakPolarHBondContact CD-OD1 3.38Å; R978-D995 WeakPolarHBondContact CG-OD1 3.47Å; R978-D995 IonicContact CZ-OD1 3.64Å; R978-D995 IonicContact CZ-OD2 2.8Å; R978-D995 VanDerWaalsContact NE-CG 3.28Å; R978-D995 IonicContact NE-OD1 3.85Å; R978-D995 PolarHBondContact NE-OD1 2.87Å; R978-D995 IonicContact NE-OD2 3.78Å; R978-D995 PolarHBondContact NE-OD2 3.49Å; R978-D995 IonicContact NH2-OD1 2.7Å; R978-D995 IonicContact NH2-OD2 3.7Å; R978-D995 PolarHBondContact NH2-OD2 3.49Å; R978-K996 WeakPolarHBondContact O-CB 3.43Å; R978-K996 WeakPolarHBondContact O-CG 3.35Å; R978-K996 PolarHBondContact O-N 2.99Å; R978-S997 PolarHBondContact NH2-O 2.81Å; R978-S997 VanDerWaalsContact NH2-O 3.13Å; R978-D1000 PolarHBondContact NH1-O 2.99Å; R978-D1000 VanDerWaalsContact NH1-O 3.11Å; R978-D1000 PolarHBondContact NH2-O 2.88Å; R978-A1001 PolarHBondContact NH1-O 2.73Å
979	Y	82.1	Confident	77.5	Confident	17 Å²	17	62.2 Å²	62.2	7%	0.067	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	157.9	-166.1	-67.7	-72.1	0	0	0	113.6	P849 I851 L973 S977 V993 Q994 D995	P849-Y979 HydrophobicContact CB-CE1 4.26Å; P849-Y979 HydrophobicContact CB-CE2 4.22Å; P849-Y979 WeakPolarHBondContact CB-OH 3.36Å; P849-Y979 HydrophobicContact CG-CE1 4.45Å; I851-Y979 HydrophobicContact CD1-CD1 4.2Å; I851-Y979 HydrophobicContact CD1-CD2 3.51Å; I851-Y979 HydrophobicContact CD1-CE2 3.99Å; I851-Y979 HydrophobicContact CD1-CG 3.61Å; I851-Y979 HydrophobicContact CG1-CD2 3.52Å; I851-Y979 HydrophobicContact CG1-CE2 3.73Å; I851-Y979 HydrophobicContact CG1-CG 4.18Å; L973-Y979 WeakPolarHBondContact CD2-O 3.32Å; S977-Y979 PolarHBondContact O-N 3.49Å; S977-Y979 VanDerWaalsContact O-N 3.13Å; S977-Y979 PolarHBondContact OG-N 2.9Å; Y979-V993 VanDerWaalsContact CB-CG1 3.43Å; Y979-V993 HydrophobicContact CD1-CG1 3.69Å; Y979-V993 HydrophobicContact CG-CG1 3.84Å; Y979-Q994 CarbonylContact C-O 3.56Å; Y979-Q994 WeakPolarHBondContact CA-O 3.41Å; Y979-D995 HydrophobicContact CD1-CB 4.19Å; Y979-D995 HydrophobicContact CE1-CB 4.11Å
980	I	79.2	Confident	77.7	Confident	79 Å²	79	52.5 Å²	52.5	41%	0.405	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	130	173.8	-53.7	178.4	0	0	0	109.2	V993 Q994 K996	I980-V993 CarbonylContact O-C 3.52Å; I980-V993 WeakPolarHBondContact O-CA 3.2Å; I980-V993 WeakPolarHBondContact O-CG1 3.38Å; I980-Q994 PolarHBondContact N-O 3.4Å; I980-Q994 PolarHBondContact O-N 2.82Å; I980-K996 HydrophobicContact CD1-CD 4.41Å; I980-K996 HydrophobicContact CD1-CG 3.93Å; I980-K996 HydrophobicContact CG1-CD 4.25Å; I980-K996 HydrophobicContact CG1-CG 3.93Å
981	T	76.9	Confident	77.8	Confident	29 Å²	29	46.9 Å²	46.9	18%	0.178	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	127.3	171.4	49.8	0	0	0	0	110.5	K983 I985 L991 V993	T981-K983 VanDerWaalsContact C-N 3.3Å; T981-K983 WeakPolarHBondContact CB-O 3.49Å; T981-K983 PolarHBondContact O-N 2.91Å; T981-I985 HydrophobicContact CG2-CD1 4.11Å; T981-I985 HydrophobicContact CG2-CG1 3.94Å; T981-L991 HydrophobicContact CG2-CD1 4.27Å; T981-V993 HydrophobicContact CG2-CG2 4.14Å
982	L	72.1	Confident	77.8	Confident	70 Å²	70	46.6 Å²	46.6	37%	0.366	26%	0.26	S	S	.	.	S	Bend	trans	-68.4	-30.7	176.7	-65.3	-179	0	0	0	113	V262 M992	V262-L982 HydrophobicContact CB-CD1 4.23Å; V262-L982 HydrophobicContact CG1-CD1 3.64Å; L982-M992 HydrophobicContact CD1-CB 4.49Å; L982-M992 PolarHBondContact N-O 3.43Å
983	K	74.1	Confident	77.8	Confident	14 Å²	14	43.7 Å²	43.7	6%	0.061	24%	0.242	C	C	.	.	S	Bend	trans	-111.3	141.4	-177	-178.8	176.1	174.3	172.2	0	109.7	Q266 D270 T981 I985 Q987 L991	Q266-K983 HydrophobicContact CG-CB 4.33Å; Q266-K983 HydrophobicContact CG-CD 4.07Å; D270-K983 IonicContact OD1-NZ 2.85Å; D270-K983 PolarHBondContact OD1-NZ 3.11Å; D270-K983 IonicContact OD2-NZ 2.68Å; D270-K983 PolarHBondContact OD2-NZ 2.77Å; T981-K983 VanDerWaalsContact C-N 3.3Å; T981-K983 WeakPolarHBondContact CB-O 3.49Å; T981-K983 PolarHBondContact O-N 2.91Å; K983-I985 PolarHBondContact O-N 2.82Å; K983-Q987 VanDerWaalsContact CG-OE1 3.28Å; K983-L991 HydrophobicContact CB-CD2 4.16Å; K983-L991 HydrophobicContact CD-CD2 4.07Å; K983-L991 HydrophobicContact CG-CD2 4.22Å
984	P	74.9	Confident	77.7	Confident	81 Å²	81	45.1 Å²	45.1	53%	0.526	25%	0.248	S	C	.	.			trans	-63	129.9	-179.1	24.7	-34.4	0	0	0	111.7	S986 Q987	P984-S986 PolarHBondContact O-N 2.92Å; P984-Q987 PolarHBondContact O-N 3.43Å
985	I	76.3	Confident	77.8	Confident	15 Å²	15	44.9 Å²	44.9	8%	0.077	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-56.8	-26.8	-173.5	-64.8	170.1	0	0	0	112.8	L839 V971 L973 T981 K983 Q987 G988 L991	L839-I985 HydrophobicContact CD1-CG2 4.48Å; L839-I985 HydrophobicContact CD2-CG2 4.15Å; V971-I985 HydrophobicContact CB-CG2 4.06Å; V971-I985 HydrophobicContact CG1-CG2 3.8Å; L973-I985 HydrophobicContact CB-CD1 3.85Å; T981-I985 HydrophobicContact CG2-CD1 4.11Å; T981-I985 HydrophobicContact CG2-CG1 3.94Å; K983-I985 PolarHBondContact O-N 2.82Å; I985-Q987 PolarHBondContact O-N 2.73Å; I985-G988 PolarHBondContact O-N 3.16Å; I985-L991 HydrophobicContact CB-CD1 4.4Å; I985-L991 HydrophobicContact CG1-CD1 3.99Å
986	S	70.2	Confident	78.2	Confident	71 Å²	71	41 Å²	41	50%	0.497	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-58.7	-17	176.5	-47	0	0	0	0	114.9	P984	P984-S986 PolarHBondContact O-N 2.92Å
987	Q	68.8	Low	78.3	Confident	67 Å²	67	37.9 Å²	37.9	31%	0.313	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-87.3	-12.4	174.2	-69.3	176.2	-44.2	0	0	113.5	R802 K983 P984 I985	R802-Q987 WeakPolarHBondContact CB-O 3.47Å; R802-Q987 WeakPolarHBondContact CD-O 3.41Å; K983-Q987 VanDerWaalsContact CG-OE1 3.28Å; P984-Q987 PolarHBondContact O-N 3.43Å; I985-Q987 PolarHBondContact O-N 2.73Å
988	G	74.9	Confident	78.1	Confident	2 Å²	2	42 Å²	42	2%	0.021	23%	0.23	C	C	.	.			trans	61.4	-169.5	173.4	0	0	0	0	0	116.1	R802 I985	R802-G988 PolarHBondContact NH1-O 3.25Å; I985-G988 PolarHBondContact O-N 3.16Å
989	G	81.9	Confident	77.2	Confident	2 Å²	2	48.6 Å²	48.6	2%	0.021	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	80.3	-142.7	176.6	0	0	0	0	0	114.2	R802 A838 L839 I840	R802-G989 VanDerWaalsContact CZ-CA 3.48Å; A838-G989 WeakPolarHBondContact O-CA 3.49Å; A838-G989 PolarHBondContact O-N 2.96Å; L839-G989 WeakPolarHBondContact CA-O 3.22Å; I840-G989 PolarHBondContact N-O 3.01Å
990	I	88	Confident	76.8	Confident	10 Å²	10	52.8 Å²	52.8	5%	0.051	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	119.3	176	-59.6	175.7	0	0	0	108.8	Q266 F269 V383 L386 I840 L842	Q266-I990 PolarHBondContact NE2-O 3.47Å; Q266-I990 VanDerWaalsContact NE2-O 3.12Å; F269-I990 HydrophobicContact CD1-CB 4.17Å; F269-I990 HydrophobicContact CD1-CD1 3.77Å; F269-I990 HydrophobicContact CD1-CG2 3.88Å; F269-I990 HydrophobicContact CD2-CG2 3.89Å; F269-I990 HydrophobicContact CE1-CD1 3.8Å; F269-I990 HydrophobicContact CE1-CG2 3.89Å; F269-I990 HydrophobicContact CE2-CG2 3.91Å; F269-I990 HydrophobicContact CG-CB 4.26Å; F269-I990 HydrophobicContact CG-CG2 3.89Å; F269-I990 HydrophobicContact CZ-CG2 3.91Å; V383-I990 HydrophobicContact CB-CD1 4.43Å; V383-I990 HydrophobicContact CG1-CD1 3.93Å; V383-I990 HydrophobicContact CG2-CD1 4.36Å; L386-I990 HydrophobicContact CD1-CD1 4.06Å; I840-I990 HydrophobicContact CB-CG1 4.34Å; I840-I990 WeakPolarHBondContact O-CA 3.27Å; L842-I990 HydrophobicContact CD1-CG2 3.53Å; L842-I990 HydrophobicContact CG-CG2 4.04Å
991	L	86.5	Confident	76.4	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.005	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	127.3	179	-59.6	-177.9	0	0	0	110.4	L839 I840 A841 L842 T981 K983 I985	L839-L991 HydrophobicContact CD1-CD1 3.64Å; L839-L991 HydrophobicContact CD1-CG 4.13Å; I840-L991 PolarHBondContact O-N 3.47Å; A841-L991 WeakPolarHBondContact CA-O 3.47Å; L842-L991 PolarHBondContact N-O 3.09Å; T981-L991 HydrophobicContact CG2-CD1 4.27Å; K983-L991 HydrophobicContact CB-CD2 4.16Å; K983-L991 HydrophobicContact CD-CD2 4.07Å; K983-L991 HydrophobicContact CG-CD2 4.22Å; I985-L991 HydrophobicContact CB-CD1 4.4Å; I985-L991 HydrophobicContact CG1-CD1 3.99Å
992	M	85.8	Confident	76.1	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	135.9	169	-65.2	-52.6	-56.7	0	0	110.8	V262 Y265 Q266 F269 L842 N843 L846 L982	V262-M992 HydrophobicContact CG1-CB 3.8Å; V262-M992 HydrophobicContact CG1-CE 3.96Å; V262-M992 HydrophobicContact CG1-CG 4.38Å; Y265-M992 HydrophobicContact CD2-CE 4.02Å; Q266-M992 HydrophobicContact CB-CB 4.2Å; Q266-M992 HydrophobicContact CB-CG 3.89Å; F269-M992 HydrophobicContact CD2-CG 4.31Å; F269-M992 HydrophobicContact CD2-SD 4.06Å; F269-M992 HydrophobicContact CE2-CG 4.39Å; F269-M992 HydrophobicContact CE2-SD 3.57Å; F269-M992 VanDerWaalsContact CE2-SD 3.57Å; L842-M992 HydrophobicContact CB-CE 4.22Å; L842-M992 HydrophobicContact CB-SD 3.9Å; L842-M992 HydrophobicContact CD1-SD 4.09Å; N843-M992 WeakPolarHBondContact O-CE 3.29Å; L846-M992 HydrophobicContact CD2-CE 4.01Å; L846-M992 HydrophobicContact CD2-SD 4.15Å; L982-M992 HydrophobicContact CD1-CB 4.49Å; L982-M992 PolarHBondContact N-O 3.43Å
993	V	84	Confident	76.2	Confident	5 Å²	5	56 Å²	56	3%	0.03	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	126	-170.1	-177.7	0	0	0	0	110.5	A841 L842 I851 Y979 I980 T981	A841-V993 HydrophobicContact CB-CG2 3.67Å; L842-V993 WeakPolarHBondContact O-CB 3.39Å; L842-V993 PolarHBondContact O-N 2.71Å; I851-V993 HydrophobicContact CD1-CG1 3.97Å; Y979-V993 VanDerWaalsContact CB-CG1 3.43Å; Y979-V993 HydrophobicContact CD1-CG1 3.69Å; Y979-V993 HydrophobicContact CG-CG1 3.84Å; I980-V993 CarbonylContact O-C 3.52Å; I980-V993 WeakPolarHBondContact O-CA 3.2Å; I980-V993 WeakPolarHBondContact O-CG1 3.38Å; T981-V993 HydrophobicContact CG2-CG2 4.14Å
994	Q	79.2	Confident	76.2	Confident	70 Å²	70	58.3 Å²	58.3	33%	0.327	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	137.3	174	-174.1	170.1	6.2	0	0	110.3	E259 Y979 I980	E259-Q994 PolarHBondContact OE1-NE2 2.94Å; Y979-Q994 CarbonylContact C-O 3.56Å; Y979-Q994 WeakPolarHBondContact CA-O 3.41Å; I980-Q994 PolarHBondContact N-O 3.4Å; I980-Q994 PolarHBondContact O-N 2.82Å
995	D	81.7	Confident	76.2	Confident	27 Å²	27	55.7 Å²	55.7	14%	0.144	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	134.8	174.7	179	23.8	0	0	0	111.5	R978 Y979 S997 P998	R978-D995 WeakPolarHBondContact CD-OD1 3.38Å; R978-D995 WeakPolarHBondContact CG-OD1 3.47Å; R978-D995 IonicContact CZ-OD1 3.64Å; R978-D995 IonicContact CZ-OD2 2.8Å; R978-D995 VanDerWaalsContact NE-CG 3.28Å; R978-D995 IonicContact NE-OD1 3.85Å; R978-D995 PolarHBondContact NE-OD1 2.87Å; R978-D995 IonicContact NE-OD2 3.78Å; R978-D995 PolarHBondContact NE-OD2 3.49Å; R978-D995 IonicContact NH2-OD1 2.7Å; R978-D995 IonicContact NH2-OD2 3.7Å; R978-D995 PolarHBondContact NH2-OD2 3.49Å; Y979-D995 HydrophobicContact CD1-CB 4.19Å; Y979-D995 HydrophobicContact CE1-CB 4.11Å; D995-S997 PolarHBondContact OD1-N 3.4Å; D995-P998 WeakPolarHBondContact OD2-CA 3.32Å; D995-P998 VanDerWaalsContact OD2-N 3.09Å
996	K	77.7	Confident	76	Confident	110 Å²	110	62.7 Å²	62.7	48%	0.478	35%	0.345	S	S	.	.	S	Bend	trans	-80.3	-24	172.3	-59.9	169.3	-172.8	167.2	0	112.7	S977 R978 I980 P998	S977-K996 PolarHBondContact O-NZ 3.1Å; R978-K996 WeakPolarHBondContact O-CB 3.43Å; R978-K996 WeakPolarHBondContact O-CG 3.35Å; R978-K996 PolarHBondContact O-N 2.99Å; I980-K996 HydrophobicContact CD1-CD 4.41Å; I980-K996 HydrophobicContact CD1-CG 3.93Å; I980-K996 HydrophobicContact CG1-CD 4.25Å; I980-K996 HydrophobicContact CG1-CG 3.93Å; K996-P998 VanDerWaalsContact C-CD 3.43Å; K996-P998 WeakPolarHBondContact O-CD 3.49Å
997	S	74.7	Confident	76	Confident	51 Å²	51	63.6 Å²	63.6	36%	0.357	35%	0.345	S	S	.	.			trans	-127.5	59.6	-168.1	-61	0	0	0	0	113.5	R978 D995 Q999 D1000	R978-S997 PolarHBondContact NH2-O 2.81Å; R978-S997 VanDerWaalsContact NH2-O 3.13Å; D995-S997 PolarHBondContact OD1-N 3.4Å; S997-Q999 PolarHBondContact O-N 3.27Å; S997-D1000 PolarHBondContact O-N 3.46Å; S997-D1000 VanDerWaalsContact O-N 3.16Å
998	P	70.2	Confident	75.8	Confident	106 Å²	106	63.2 Å²	63.2	69%	0.688	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	8.5	-173.4	29.7	-38.3	0	0	0	115.7	D995 K996	D995-P998 WeakPolarHBondContact OD2-CA 3.32Å; D995-P998 VanDerWaalsContact OD2-N 3.09Å; K996-P998 VanDerWaalsContact C-CD 3.43Å; K996-P998 WeakPolarHBondContact O-CD 3.49Å
999	Q	62.9	Low	75.2	Confident	193 Å²	193	69.8 Å²	69.8	90%	0.902	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-23.7	174.3	-62.3	-176.4	4.3	0	0	112.6	S997	S997-Q999 PolarHBondContact O-N 3.27Å
1000	D	73	Confident	74.1	Confident	105 Å²	105	70.4 Å²	70.4	56%	0.561	39%	0.387	S	S	*	.	S	Bend	trans	-87.9	140.7	178.1	-71.6	-40.7	0	0	0	110.6	R978 S997 E1002	R978-D1000 PolarHBondContact NH1-O 2.99Å; R978-D1000 VanDerWaalsContact NH1-O 3.11Å; R978-D1000 PolarHBondContact NH2-O 2.88Å; S997-D1000 PolarHBondContact O-N 3.46Å; S997-D1000 VanDerWaalsContact O-N 3.16Å; D1000-E1002 PolarHBondContact O-N 3.4Å
1001	A	69.8	Low	72.6	Confident	93 Å²	93	77 Å²	77	77%	0.769	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-59.1	131.5	174.7	0	0	0	0	0	111.3	R978	R978-A1001 PolarHBondContact NH1-O 2.73Å
1002	E	71.2	Confident	70.7	Confident	60 Å²	60	78 Å²	78	28%	0.28	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-76.3	133.9	174.7	-71.2	-167.4	175.5	0	0	111	N843 D1000 L1004	N843-E1002 WeakPolarHBondContact CB-OE2 3.32Å; N843-E1002 PolarHBondContact ND2-OE2 3.43Å; D1000-E1002 PolarHBondContact O-N 3.4Å; E1002-L1004 HydrophobicContact CB-CD2 4.35Å; E1002-L1004 PolarHBondContact O-N 3.47Å
1003	V	73.7	Confident	68.2	Low	93 Å²	93	80.6 Å²	80.6	56%	0.564	44%	0.444	S	S	*	.			trans	-92.4	100.1	173.4	-163.8	0	0	0	0	109.2	K850	K850-V1003 WeakPolarHBondContact CB-O 3.42Å; K850-V1003 HydrophobicContact CD-CB 4.39Å; K850-V1003 HydrophobicContact CD-CG1 3.74Å; K850-V1003 WeakPolarHBondContact CG-O 3.48Å; K850-V1003 PolarHBondContact N-O 2.93Å
1004	L	75.6	Confident	65.8	Low	63 Å²	63	84.7 Å²	84.7	33%	0.33	47%	0.47	S	S	.	.	B	Isolated β-bridge	trans	-79.2	162.8	179.6	-58	178.4	0	0	0	112.6	N847 M848 K850 E1002	N847-L1004 HydrophobicContact CB-CD1 3.89Å; N847-L1004 HydrophobicContact CB-CD2 3.86Å; N847-L1004 HydrophobicContact CB-CG 4.46Å; M848-L1004 CarbonylContact O-C 3.54Å; M848-L1004 WeakPolarHBondContact O-CA 3.38Å; K850-L1004 WeakPolarHBondContact CE-O 3.45Å; K850-L1004 PolarHBondContact NZ-O 3.06Å; E1002-L1004 HydrophobicContact CB-CD2 4.35Å; E1002-L1004 PolarHBondContact O-N 3.47Å
1005	V	73.6	Confident	63.5	Low	26 Å²	26	89 Å²	89	16%	0.158	49%	0.494	C	S	.	.	P	Polyproline II helix	trans	-88.8	120.3	168.1	-177.6	0	0	0	0	108.6	M848 K850	M848-V1005 HydrophobicContact CB-CB 4.11Å; M848-V1005 HydrophobicContact CB-CG2 4.26Å; M848-V1005 PolarHBondContact O-N 3.21Å; K850-V1005 HydrophobicContact CG-CG2 3.71Å
1006	E	72	Confident	61	Low	162 Å²	162	95.1 Å²	95.1	76%	0.757	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-63.8	133.1	176.9	-70.4	162.4	-149.7	0	0	110.9	R393	R393-E1006 PolarHBondContact NH2-O 3.17Å
1007	N	70	Confident	58.6	Low	90 Å²	90	101.6 Å²	101.6	48%	0.481	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-71.6	128.6	178.8	-79.9	-18.1	0	0	0	111.5	Q389 M848	Q389-N1007 PolarHBondContact OE1-OD1 3.06Å; M848-N1007 WeakPolarHBondContact CE-OD1 3.22Å
1008	V	65.9	Low	56.5	Low	59 Å²	59	104.4 Å²	104.4	36%	0.358	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-91	125.8	-178	179	0	0	0	0	108.4	Q389 I392 R393	Q389-V1008 PolarHBondContact NE2-O 2.89Å; I392-V1008 HydrophobicContact CG2-CB 4.4Å; I392-V1008 HydrophobicContact CG2-CG1 3.81Å; R393-V1008 HydrophobicContact CG-CG2 4.04Å
1009	L	62.4	Low	54.5	Low	140 Å²	140	103.1 Å²	103.1	73%	0.733	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-67.5	138.9	171.6	-65.9	173.3	0	0	0	109.6
1010	G	58.6	Low	53	Low	14 Å²	14	101.4 Å²	101.4	14%	0.144	58%	0.576	C	S	.	*	P	Polyproline II helix	trans	-58.1	146.2	178.1	0	0	0	0	0	111.8	G1012	G1010-G1012 PolarHBondContact O-N 2.95Å
1011	H	55.9	Low	51	Low	149 Å²	149	100.1 Å²	100.1	69%	0.69	59%	0.588	S	S	*	*	S	Bend	trans	-73.9	129.4	171.5	-96.8	31.5	0	0	0	109.1	T430	T430-H1011 WeakPolarHBondContact CB-O 3.47Å; T430-H1011 PolarHBondContact OG1-N 3.36Å; T430-H1011 PolarHBondContact OG1-O 3.04Å
1012	G	45.7	Very low	49.1	Very low	23 Å²	23	99.9 Å²	99.9	24%	0.237	59%	0.594	C	S	.	*	S	Bend	trans	171.9	173.5	-174.7	0	0	0	0	0	109.2	G1010 T1014	G1010-G1012 PolarHBondContact O-N 2.95Å; G1012-T1014 PolarHBondContact O-N 3.39Å
1013	P	35.4	Very low	47.2	Very low	53 Å²	53	100.4 Å²	100.4	34%	0.344	62%	0.616	S	S	.	*			trans	-70.1	91.8	-174.7	27.4	-34.4	0	0	0	111.3	R470 L471	R470-P1013 PolarHBondContact NH1-O 3.28Å; R470-P1013 PolarHBondContact NH2-O 2.77Å; L471-P1013 HydrophobicContact CD2-CG 3.78Å
1014	T	32.4	Very low	45.2	Very low	91 Å²	91	103.2 Å²	103.2	56%	0.558	63%	0.633	S	S	*	*			trans	-86.9	101.4	166.5	50.7	0	0	0	0	109.2	G1012 D1016	G1012-T1014 PolarHBondContact O-N 3.39Å; T1014-D1016 PolarHBondContact O-N 2.98Å
1015	L	31.8	Very low	43.2	Very low	160 Å²	160	104 Å²	104	84%	0.838	66%	0.657	S	S	*	*			trans	-64.8	126.9	159.1	-76.7	162.5	0	0	0	107.7	R1017	L1015-R1017 PolarHBondContact O-N 3.2Å
1016	D	28	Very low	41.3	Very low	156 Å²	156	108.9 Å²	108.9	83%	0.834	69%	0.692	S	S	*	*			trans	-53.3	124.7	-166.2	-75.8	-60.5	0	0	0	113.6	T1014	T1014-D1016 PolarHBondContact O-N 2.98Å
1017	R	28	Very low	39.6	Very low	247 Å²	247	105.5 Å²	105.5	93%	0.932	69%	0.692	S	S	*	*			trans	-128.8	40.7	179.2	-152.4	-176.5	-179.8	-169.6	-0	113.5	L1015	L1015-R1017 PolarHBondContact O-N 3.2Å
1018	S	30.7	Very low	37.8	Very low	110 Å²	110	107.2 Å²	107.2	77%	0.769	71%	0.711	S	S	*	*			trans	-146.8	100	176.4	49.3	0	0	0	0	111.2
1019	G	28	Very low	36.3	Very low	79 Å²	79	108.2 Å²	108.2	81%	0.814	73%	0.733	S	S	*	*			trans	-167.1	37	-171.3	0	0	0	0	0	116.4
1020	V	31.4	Very low	35	Very low	156 Å²	156	108.1 Å²	108.1	95%	0.945	74%	0.739	S	S	*	*			trans	-133	108	178	-178.7	0	0	0	0	109.3
1021	G	30.3	Very low	33.7	Very low	79 Å²	79	112.6 Å²	112.6	81%	0.814	77%	0.768	S	S	*	*			trans	-177.3	0.5	-173.8	0	0	0	0	0	122.8
1022	G	30.3	Very low	32.6	Very low	87 Å²	87	110.9 Å²	110.9	90%	0.897	77%	0.772	S	S	*	*			trans	74.2	167.3	169.8	0	0	0	0	0	117.6
1023	G	31.7	Very low	32	Very low	71 Å²	71	114.3 Å²	114.3	73%	0.732	79%	0.793	S	S	*	*			trans	164.7	-11.7	173.5	0	0	0	0	0	123
1024	T	31	Very low	31.7	Very low	152 Å²	152	119 Å²	119	93%	0.933	82%	0.815	S	S	*	*			trans	46.2	116.2	166.8	55.2	0	0	0	0	121.2
1025	G	34.4	Very low	31.5	Very low	80 Å²	80	123.1 Å²	123.1	83%	0.825	83%	0.833	S	S	*	*			trans	-169	139.4	162.2	0	0	0	0	0	112.2
1026	S	32.8	Very low	31.3	Very low	128 Å²	128	120.2 Å²	120.2	90%	0.895	83%	0.832	S	S	*	*			trans	-126.4	138.7	-165.3	-62.7	0	0	0	0	115.6
1027	A	36	Very low	31.3	Very low	92 Å²	92	117.9 Å²	117.9	76%	0.76	83%	0.834	S	S	*	*			trans	165.7	96.8	141.3	0	0	0	0	0	109.9
1028	S	33	Very low	31.4	Very low	126 Å²	126	110.8 Å²	110.8	88%	0.881	83%	0.829	S	S	*	*				75.5	97.8	74.7	73.5	0	0	0	0	115.4
1029	G	34.2	Very low	31.3	Very low	80 Å²	80	114.3 Å²	114.3	83%	0.825	84%	0.838	S	S	*	*			trans	-172.1	97	175.6	0	0	0	0	0	114.5
1030	T	34.8	Very low	31.3	Very low	138 Å²	138	114.3 Å²	114.3	85%	0.847	84%	0.838	S	S	*	*			trans	-56.8	155.7	173.3	44.3	0	0	0	0	114.9
1031	S	32	Very low	31.4	Very low	107 Å²	107	113.1 Å²	113.1	75%	0.748	84%	0.837	S	S	*	*			cis	178.6	133.9	-5	48.4	0	0	0	0	112.6
1032	S	33.7	Very low	31.3	Very low	113 Å²	113	112.2 Å²	112.2	79%	0.79	83%	0.827	S	S	*	*			trans	177.6	140.1	146.7	51.5	0	0	0	0	113.3
1033	S	33.1	Very low	31.4	Very low	95 Å²	95	113.7 Å²	113.7	66%	0.664	82%	0.823	S	S	*	*			trans	44.2	97	157.4	59.3	0	0	0	0	120.3
1034	D	28.5	Very low	31.2	Very low	151 Å²	151	118.1 Å²	118.1	81%	0.807	83%	0.83	S	S	*	*				62.6	122.8	125.9	-49.4	-36.8	0	0	0	123.1
1035	L	27.5	Very low	31.2	Very low	178 Å²	178	116.3 Å²	116.3	93%	0.932	82%	0.824	S	S	*	*	S	Bend	trans	74.4	33.5	144.3	-82.7	151.8	0	0	0	121.6
1036	A	27.8	Very low	30.9	Very low	99 Å²	99	121.6 Å²	121.6	82%	0.818	82%	0.824	S	S	*	*			trans	-159.1	136.6	151.2	0	0	0	0	0	113.3
1037	A	28.5	Very low	30.8	Very low	107 Å²	107	121.8 Å²	121.8	88%	0.884	82%	0.82	S	S	*	*			trans	165.4	71.8	147.9	0	0	0	0	0	115.2
1038	A	29.1	Very low	30.7	Very low	99 Å²	99	124.2 Å²	124.2	82%	0.818	82%	0.816	S	S	*	*	S	Bend	trans	-166.8	126.6	154.8	0	0	0	0	0	108.9
1039	L	29.3	Very low	30.4	Very low	183 Å²	183	127 Å²	127	96%	0.958	82%	0.82	S	S	*	*	S	Bend	cis	-116	144.2	-2.5	-68.2	134.4	0	0	0	109.6
1040	G	28.4	Very low	30.2	Very low	79 Å²	79	128.9 Å²	128.9	81%	0.814	81%	0.81	S	S	*	*			trans	-156.6	104.8	179.3	0	0	0	0	0	113.9
1041	S	32	Very low	30	Very low	132 Å²	132	129.2 Å²	129.2	92%	0.923	80%	0.801	S	S	*	*			trans	-172.7	87.2	162.3	176.4	0	0	0	0	109.9
1042	G	29.1	Very low	30	Very low	59 Å²	59	128.8 Å²	128.8	61%	0.608	80%	0.804	S	S	*	*			cis	163.5	179	-4.2	0	0	0	0	0	112.6
1043	S	32.1	Very low	30	Very low	118 Å²	118	126 Å²	126	83%	0.825	79%	0.785	S	S	*	*			trans	66.7	137.1	168.7	72.6	0	0	0	0	118.6
1044	N	28.4	Very low	30.1	Very low	164 Å²	164	126.8 Å²	126.8	88%	0.877	79%	0.786	S	S	*	*			cis	-162.6	95.7	-26.4	-138.7	25.9	0	0	0	111.6
1045	S	31	Very low	30.3	Very low	114 Å²	114	127.6 Å²	127.6	80%	0.797	79%	0.789	S	S	*	*			trans	-162.5	148.1	160.6	46.5	0	0	0	0	110
1046	K	28.2	Very low	30.6	Very low	192 Å²	192	122.4 Å²	122.4	84%	0.835	78%	0.778	S	S	*	*			trans	-78.5	133	178.7	-63.7	179.5	178.5	-176.2	0	110
1047	T	31.2	Very low	30.9	Very low	132 Å²	132	121.8 Å²	121.8	81%	0.81	77%	0.773	S	S	*	*			trans	-136.1	109.7	156.2	-34.4	0	0	0	0	107.4
1048	E	32.2	Very low	31.4	Very low	143 Å²	143	126.4 Å²	126.4	67%	0.668	77%	0.769	S	S	*	*			trans	-78.2	141.5	177.1	-69.8	174.2	166.1	0	0	109.7	I1050	E1048-I1050 HydrophobicContact CB-CD1 4.38Å; E1048-I1050 HydrophobicContact CB-CG1 3.92Å; E1048-I1050 PolarHBondContact O-N 3.35Å
1049	L	28.5	Very low	31.8	Very low	184 Å²	184	128.4 Å²	128.4	96%	0.963	77%	0.765	S	S	*	*			trans	-79	68.7	177	-73.1	167.6	0	0	0	110	H1051	L1049-H1051 PolarHBondContact O-N 3.21Å
1050	I	29.6	Very low	32.3	Very low	120 Å²	120	125.4 Å²	125.4	62%	0.615	75%	0.75	S	S	*	*			trans	-74.2	119.9	-177.9	-58	179.3	0	0	0	109.8	E1048 A1052	E1048-I1050 HydrophobicContact CB-CD1 4.38Å; E1048-I1050 HydrophobicContact CB-CG1 3.92Å; E1048-I1050 PolarHBondContact O-N 3.35Å; I1050-A1052 PolarHBondContact O-N 2.88Å; I1050-A1052 VanDerWaalsContact O-N 3.15Å
1051	H	29.9	Very low	32.8	Very low	144 Å²	144	130 Å²	130	67%	0.667	75%	0.75	S	S	*	*			trans	-72.4	102.6	174.2	-137.7	-106.4	0	0	0	108.8	L1049 S1053	L1049-H1051 PolarHBondContact O-N 3.21Å; H1051-S1053 VanDerWaalsContact C-N 3.26Å; H1051-S1053 PolarHBondContact O-N 3.01Å
1052	A	32.1	Very low	33.2	Very low	99 Å²	99	130.8 Å²	130.8	82%	0.818	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	67.3	-168.5	0	0	0	0	0	113.9	I1050	I1050-A1052 PolarHBondContact O-N 2.88Å; I1050-A1052 VanDerWaalsContact O-N 3.15Å
1053	S	33.3	Very low	33.9	Very low	55 Å²	55	134.8 Å²	134.8	39%	0.385	75%	0.752	S	S	.	*	T	Hydrogen-bonded Turn	trans	-166.5	-1.8	175.9	53.2	0	0	0	0	116.5	S484 H1051	S484-S1053 VanDerWaalsContact CB-CB 3.4Å; S484-S1053 VanDerWaalsContact CB-OG 3.23Å; S484-S1053 WeakPolarHBondContact CB-OG 3.46Å; S484-S1053 VanDerWaalsContact OG-CB 3.24Å; S484-S1053 WeakPolarHBondContact OG-CB 3.48Å; S484-S1053 PolarHBondContact OG-OG 3.36Å; H1051-S1053 VanDerWaalsContact C-N 3.26Å; H1051-S1053 PolarHBondContact O-N 3.01Å
1054	T	34.8	Very low	34.4	Very low	111 Å²	111	137 Å²	137	68%	0.681	75%	0.754	S	S	*	*			trans	-129.1	36.2	-163.8	-33.1	0	0	0	0	114.4
1055	I	32.6	Very low	35.1	Very low	168 Å²	168	136.6 Å²	136.6	86%	0.862	75%	0.752	S	S	*	*			trans	-129.4	104.8	164	-58.1	-179.4	0	0	0	108.4
1056	G	34.6	Very low	35.8	Very low	68 Å²	68	138.2 Å²	138.2	70%	0.701	75%	0.752	S	S	*	*			trans	-140.9	132.1	165.7	0	0	0	0	0	108.5
1057	A	33.4	Very low	36.6	Very low	87 Å²	87	137.1 Å²	137.1	72%	0.719	76%	0.755	S	S	*	*	S	Bend	trans	66	158.1	178	0	0	0	0	0	118.1
1058	Y	38.9	Very low	37.1	Very low	203 Å²	203	139.9 Å²	139.9	80%	0.796	76%	0.759	S	S	*	*			trans	81.5	111	168.7	-66	-78.1	0	0	0	119.9
1059	L	39.3	Very low	37.7	Very low	141 Å²	141	141.8 Å²	141.8	74%	0.738	77%	0.768	S	S	*	*			trans	71.9	140.3	137.1	-53.6	172.2	0	0	0	117.1
1060	D	39.4	Very low	38.4	Very low	121 Å²	121	140.6 Å²	140.6	65%	0.647	76%	0.762	S	S	*	*			cis	-143.7	149.4	-7.1	-83.3	-34.8	0	0	0	106.5
1061	E	38.6	Very low	38.9	Very low	174 Å²	174	144 Å²	144	81%	0.813	78%	0.775	S	S	*	*				50.9	147	91	-67.8	-173	179.2	0	0	116.3
1062	D	41	Very low	39.6	Very low	149 Å²	149	145.1 Å²	145.1	80%	0.797	79%	0.787	S	S	*	*			trans	67.4	148.1	-171.7	-48.3	-12.9	0	0	0	115.8
1063	D	42.6	Very low	40.2	Very low	144 Å²	144	147.6 Å²	147.6	77%	0.77	79%	0.786	S	S	*	*			cis	-169.7	152.7	-32	-108.3	-6.2	0	0	0	107.4
1064	D	43.7	Very low	40.9	Very low	163 Å²	163	153.2 Å²	153.2	87%	0.872	81%	0.812	S	S	*	*			trans	153	136.9	150.1	-85.8	-22.8	0	0	0	111.5
1065	D	43	Very low	41.1	Very low	156 Å²	156	156.6 Å²	156.6	83%	0.834	82%	0.82	S	S	*	*			trans	-93.7	-162.5	-167.4	-62.1	-72.7	0	0	0	115.4
1066	D	44.8	Very low	41.7	Very low	149 Å²	149	156 Å²	156	80%	0.797	82%	0.818	S	S	*	*			trans	80.6	94.5	162.4	-60.5	-22.4	0	0	0	119
1067	D	46	Very low	42.1	Very low	168 Å²	168	158.8 Å²	158.8	90%	0.898	83%	0.827	S	S	*	*				178.9	120.7	106.5	-89.8	-22.4	0	0	0	111.3
1068	E	41.5	Very low	42.3	Very low	190 Å²	190	160.3 Å²	160.3	89%	0.888	83%	0.832	S	S	*	*			trans	-104.2	-175.9	170	-76	-168.5	151.2	0	0	111.4
1069	E	43.9	Very low	42.3	Very low	184 Å²	184	156.2 Å²	156.2	86%	0.86	83%	0.834	S	S	*	*			trans	74.3	130.3	-179.8	-50.3	-179	174	0	0	113.2
1070	D	44.1	Very low	42.3	Very low	159 Å²	159	156 Å²	156	85%	0.85	83%	0.833	S	S	*	*			cis	-131.8	155.4	25.5	-73.1	-57.2	0	0	0	114.2
1071	E	39.3	Very low	42.6	Very low	190 Å²	190	156.5 Å²	156.5	89%	0.888	83%	0.833	S	S	*	*			trans	-92.3	155.8	165.1	-59.3	175.5	134.8	0	0	111.2
1072	D	44.1	Very low	42.7	Very low	169 Å²	169	156.3 Å²	156.3	90%	0.904	83%	0.832	S	S	*	*			trans	-163.2	138.8	151.3	-116.5	-19.3	0	0	0	110.7
1073	D	44.4	Very low	42.5	Very low	150 Å²	150	157.9 Å²	157.9	80%	0.802	83%	0.834	S	S	*	*			trans	-75	158.7	-165.8	-61.3	-56	0	0	0	116.4
1074	D	48.2	Very low	42.4	Very low	173 Å²	173	160.2 Å²	160.2	93%	0.925	84%	0.841	S	S	*	*			trans	-170.3	98.7	133	-106.1	-21.3	0	0	0	111
1075	E	40.7	Very low	42.2	Very low	183 Å²	183	159.8 Å²	159.8	86%	0.855	84%	0.838	S	S	*	*			trans	-90.2	138.3	168.1	-67.5	-169.5	139.8	0	0	111.4
1076	D	44.4	Very low	42	Very low	155 Å²	155	161.1 Å²	161.1	83%	0.829	84%	0.84	S	S	*	*			trans	169.4	113.3	131.2	-108.3	-27.8	0	0	0	113
1077	S	42.1	Very low	41.7	Very low	127 Å²	127	161.6 Å²	161.6	89%	0.888	84%	0.842	S	S	*	*			trans	166.8	102.3	137.1	-78.2	0	0	0	0	111.5
1078	S	38	Very low	41.2	Very low	118 Å²	118	161.3 Å²	161.3	83%	0.825	84%	0.841	S	S	*	*			trans	-99.5	140	178.3	53.1	0	0	0	0	113.2
1079	S	39.2	Very low	41.1	Very low	118 Å²	118	160 Å²	160	83%	0.825	84%	0.84	S	S	*	*			trans	168.1	141.9	149.6	35.9	0	0	0	0	110.7
1080	D	39.5	Very low	40.7	Very low	135 Å²	135	160.5 Å²	160.5	72%	0.722	84%	0.842	S	S	*	*			cis	-165.3	170.8	-21.1	-157.6	-9	0	0	0	107.8
1081	M	45.9	Very low	40.3	Very low	133 Å²	133	161.2 Å²	161.2	66%	0.655	84%	0.84	S	S	*	*			trans	75	114.1	160.1	-59.7	-69	164.6	0	0	120.9
1082	H	40.5	Very low	40	Very low	170 Å²	170	160.9 Å²	160.9	79%	0.787	84%	0.839	S	S	*	*			trans	86.2	100	143.4	-64.8	-53.1	0	0	0	122
1083	E	35.9	Very low	39.5	Very low	181 Å²	181	161.9 Å²	161.9	85%	0.846	84%	0.836	S	S	*	*			trans	-69.8	143.9	145.6	-51.7	150.1	141	0	0	110.3
1084	E	40.9	Very low	39	Very low	193 Å²	193	161.5 Å²	161.5	90%	0.902	83%	0.833	S	S	*	*			trans	-143.8	142.8	144.9	-70.9	-162.9	143	0	0	107.8
1085	D	38.9	Very low	38.1	Very low	154 Å²	154	159.5 Å²	159.5	82%	0.824	83%	0.827	S	S	*	*			trans	-91.7	149.9	-175.5	-46.7	-89.3	0	0	0	112.8
1086	E	40.2	Very low	37.7	Very low	185 Å²	185	155.1 Å²	155.1	86%	0.864	82%	0.822	S	S	*	*			trans	177.5	105.8	152.8	-101.6	163.2	-155.5	0	0	106.2
1087	D	39	Very low	37	Very low	159 Å²	159	151.8 Å²	151.8	85%	0.85	82%	0.816	S	S	*	*				93.3	145.4	76.8	-90.7	-16	0	0	0	112.8
1088	D	35.5	Very low	36.5	Very low	162 Å²	162	151.1 Å²	151.1	87%	0.866	82%	0.818	S	S	*	*			trans	-76	135.3	-169.1	-62.3	-67.8	0	0	0	114
1089	D	38.7	Very low	36.1	Very low	163 Å²	163	151.2 Å²	151.2	87%	0.872	81%	0.814	S	S	*	*			trans	-152.2	145.3	157.1	-114.6	-34.1	0	0	0	112.7	E1091	D1089-E1091 PolarHBondContact O-N 3.05Å
1090	E	35.1	Very low	35.8	Very low	193 Å²	193	151.6 Å²	151.6	90%	0.902	81%	0.811	S	S	*	*			trans	-92.9	86.2	-174.3	-65.3	-173.1	135.8	0	0	112.2	E1092	E1090-E1092 PolarHBondContact O-N 3.46Å
1091	E	36.2	Very low	35.4	Very low	174 Å²	174	150.1 Å²	150.1	81%	0.813	81%	0.811	S	S	*	*			trans	-72	104	-177.3	-74.2	-152.3	142.7	0	0	115	D1089 F1093	D1089-E1091 PolarHBondContact O-N 3.05Å; E1091-F1093 PolarHBondContact O-N 2.98Å
1092	E	32.4	Very low	34.5	Very low	184 Å²	184	149.3 Å²	149.3	86%	0.86	81%	0.814	S	S	*	*			trans	-64.1	110.6	164.1	-177.3	167.9	-144.7	0	0	110.7	E1090 D1094	E1090-E1092 PolarHBondContact O-N 3.46Å; E1092-D1094 VanDerWaalsContact C-N 3.32Å; E1092-D1094 PolarHBondContact O-N 3.47Å
1093	F	34.1	Very low	34.1	Very low	190 Å²	190	147 Å²	147	83%	0.833	81%	0.812	S	S	*	*			trans	-76.9	75.4	-171.4	-125	-83.8	0	0	0	113.4	E1091	E1091-F1093 PolarHBondContact O-N 2.98Å
1094	D	33.2	Very low	33.7	Very low	142 Å²	142	146.7 Å²	146.7	76%	0.759	81%	0.81	S	S	*	*			trans	-71.1	152.5	177.9	-158	0.5	0	0	0	112.5	E1092 A1096	E1092-D1094 VanDerWaalsContact C-N 3.32Å; E1092-D1094 PolarHBondContact O-N 3.47Å; D1094-A1096 PolarHBondContact O-N 3.41Å
1095	V	30.4	Very low	33.4	Very low	131 Å²	131	144.7 Å²	144.7	79%	0.794	80%	0.804	S	S	*	*			trans	-104.7	80	-162	-170.5	0	0	0	0	111.6
1096	A	30.9	Very low	33.2	Very low	90 Å²	90	145.9 Å²	145.9	74%	0.744	81%	0.805	S	S	*	*			trans	-127.1	143.9	-176.6	0	0	0	0	0	115.2	D1094	D1094-A1096 PolarHBondContact O-N 3.41Å
1097	A	31.1	Very low	32.7	Very low	85 Å²	85	146.8 Å²	146.8	70%	0.702	81%	0.809	S	S	*	*			trans	46.5	85.5	156.7	0	0	0	0	0	119.3	T1099	A1097-T1099 PolarHBondContact O-N 2.99Å
1098	A	31.9	Very low	32.6	Very low	113 Å²	113	144.6 Å²	144.6	93%	0.934	81%	0.806	S	S	*	*			trans	-75	80.6	149.3	0	0	0	0	0	109.6	V1100	A1098-V1100 PolarHBondContact O-N 3.33Å
1099	T	29.9	Very low	32.4	Very low	121 Å²	121	144.6 Å²	144.6	74%	0.742	81%	0.806	S	S	*	*			trans	-61	131.9	-175.9	-38.7	0	0	0	0	111.6	A1097 S1101	A1097-T1099 PolarHBondContact O-N 2.99Å; T1099-S1101 PolarHBondContact O-N 3.39Å; T1099-S1101 VanDerWaalsContact O-N 3.17Å
1100	V	32.6	Very low	32.3	Very low	125 Å²	125	143.5 Å²	143.5	76%	0.758	80%	0.8	S	S	*	*			trans	-62.8	117.5	170.1	173.4	0	0	0	0	108.6	A1098 T1102	A1098-V1100 PolarHBondContact O-N 3.33Å; V1100-T1102 PolarHBondContact O-N 2.95Å
1101	S	29.5	Very low	32.4	Very low	104 Å²	104	141.3 Å²	141.3	73%	0.727	79%	0.79	S	S	*	*			trans	-68.6	98.9	175.1	58.3	0	0	0	0	110.1	T1099 V1103	T1099-S1101 PolarHBondContact O-N 3.39Å; T1099-S1101 VanDerWaalsContact O-N 3.17Å; S1101-V1103 PolarHBondContact O-N 3.29Å; S1101-V1103 VanDerWaalsContact O-N 3.1Å
1102	T	28.1	Very low	32.1	Very low	117 Å²	117	138.7 Å²	138.7	72%	0.718	79%	0.786	S	S	*	*			trans	-61.3	108	166.4	42.1	0	0	0	0	109.2	V1100 E1104	V1100-T1102 PolarHBondContact O-N 2.95Å; T1102-E1104 VanDerWaalsContact C-N 3.33Å; T1102-E1104 PolarHBondContact O-N 2.96Å
1103	V	31.3	Very low	32.2	Very low	122 Å²	122	135.9 Å²	135.9	74%	0.739	79%	0.787	S	S	*	*			trans	-75	93.7	166	-179.7	0	0	0	0	107.1	S1101 I1105	S1101-V1103 PolarHBondContact O-N 3.29Å; S1101-V1103 VanDerWaalsContact O-N 3.1Å; V1103-I1105 HydrophobicContact CG1-CG1 4.16Å; V1103-I1105 PolarHBondContact O-N 3.34Å
1104	E	28.7	Very low	32.2	Very low	173 Å²	173	135.7 Å²	135.7	81%	0.808	79%	0.785	S	S	*	*			trans	-65.2	112.4	166.7	-63.4	-172.7	143.8	0	0	108	T1102	T1102-E1104 VanDerWaalsContact C-N 3.33Å; T1102-E1104 PolarHBondContact O-N 2.96Å
1105	I	34.6	Very low	32.2	Very low	151 Å²	151	131.9 Å²	131.9	77%	0.774	78%	0.78	S	S	*	*			trans	-90.5	110.9	171.1	-61.8	179.5	0	0	0	106.3	V1103	V1103-I1105 HydrophobicContact CG1-CG1 4.16Å; V1103-I1105 PolarHBondContact O-N 3.34Å
1106	E	34.1	Very low	32.4	Very low	179 Å²	179	131.6 Å²	131.6	84%	0.836	77%	0.774	S	S	*	*			trans	-58.8	136.6	-177.4	-62.4	-179	123	0	0	112.1	S1108	E1106-S1108 PolarHBondContact O-N 3.11Å
1107	E	29.6	Very low	32.7	Very low	204 Å²	204	135 Å²	135	95%	0.953	78%	0.778	S	S	*	*			trans	-67.3	128.3	170.9	-64.6	-176.9	132.3	0	0	110.1
1108	S	36.3	Very low	32.8	Very low	113 Å²	113	138.8 Å²	138.8	79%	0.79	78%	0.781	S	S	*	*			trans	-138.6	106.8	165.5	45	0	0	0	0	110.5	E1106	E1106-S1108 PolarHBondContact O-N 3.11Å
1109	D	32	Very low	32.8	Very low	163 Å²	163	140.3 Å²	140.3	87%	0.872	77%	0.771	S	S	*	*			trans	-61.9	134.8	169	-75.5	-59.3	0	0	0	110.5
1110	D	36	Very low	33	Very low	139 Å²	139	139.9 Å²	139.9	74%	0.743	77%	0.773	S	S	*	*				-162.5	147.1	120.3	-127.8	-14.8	0	0	0	117.9
1111	H	36.8	Very low	32.9	Very low	147 Å²	147	142.1 Å²	142.1	68%	0.681	78%	0.775	S	S	*	*			trans	44.8	86	150	-78	-50	0	0	0	124.4
1112	T	30.3	Very low	33.1	Very low	119 Å²	119	143 Å²	143	73%	0.73	78%	0.781	S	S	*	*				44.7	116.9	115.5	57	0	0	0	0	122.2
1113	S	35.4	Very low	33.1	Very low	126 Å²	126	142.8 Å²	142.8	88%	0.881	78%	0.784	S	S	*	*				167.1	175.2	116.1	52.7	0	0	0	0	113.2
1114	K	32.7	Very low	33.3	Very low	185 Å²	185	143.9 Å²	143.9	80%	0.804	79%	0.791	S	S	*	*				-167.4	143.5	-68.3	-163.3	-173.4	178.7	-167.5	0	108.5
1115	G	35.1	Very low	33.3	Very low	63 Å²	63	143.2 Å²	143.2	65%	0.649	79%	0.788	S	S	*	*			trans	132.2	94.8	175.9	0	0	0	0	0	111.4
1116	D	34.5	Very low	33.3	Very low	125 Å²	125	141.2 Å²	141.2	67%	0.668	78%	0.783	S	S	*	*			cis	93.6	150.8	44.7	-61.7	-35.6	0	0	0	112.7
1117	I	36	Very low	33.3	Very low	162 Å²	162	139.7 Å²	139.7	83%	0.831	77%	0.774	S	S	*	*			trans	84.1	128.5	173.6	-50.1	171.9	0	0	0	116.5
1118	E	32.5	Very low	33.4	Very low	163 Å²	163	140 Å²	140	76%	0.762	77%	0.766	S	S	*	*			cis	-175.3	152	-35.5	-114.1	-174.3	160.7	0	0	110.4
1119	M	32.7	Very low	33.2	Very low	145 Å²	145	143 Å²	143	71%	0.714	77%	0.767	S	S	*	*			trans	44.3	139.9	144.3	-54.9	-63.1	-82.1	0	0	121.2
1120	S	33.7	Very low	33.2	Very low	113 Å²	113	145.1 Å²	145.1	79%	0.79	77%	0.769	S	S	*	*				-174.3	175.3	53.4	37.9	0	0	0	0	113.2
1121	E	31.2	Very low	33.2	Very low	171 Å²	171	144.4 Å²	144.4	80%	0.799	78%	0.775	S	S	*	*			trans	-96.4	167.4	-167.4	-47.4	152.5	113.5	0	0	114.8
1122	S	32.8	Very low	33	Very low	123 Å²	123	149 Å²	149	86%	0.86	79%	0.786	S	S	*	*				177.1	157.9	118.4	42.6	0	0	0	0	113.8
1123	S	29.5	Very low	33.3	Very low	112 Å²	112	146.8 Å²	146.8	78%	0.783	79%	0.788	S	S	*	*			trans	-119.5	164.1	-174.1	-34	0	0	0	0	112.5
1124	T	34.1	Very low	33.1	Very low	145 Å²	145	146.3 Å²	146.3	89%	0.89	78%	0.784	S	S	*	*			trans	-162	164	141.4	1.2	0	0	0	0	114.8
1125	E	30.5	Very low	33.3	Very low	159 Å²	159	143.6 Å²	143.6	74%	0.743	78%	0.783	S	S	*	*			trans	-72.7	177.7	-171.7	-43.8	168.7	93.7	0	0	113.6
1126	V	34.4	Very low	33.4	Very low	109 Å²	109	146.2 Å²	146.2	66%	0.661	79%	0.791	S	S	*	*				-171.5	120.5	73.8	162.1	0	0	0	0	113.1
1127	K	34.1	Very low	33.5	Very low	147 Å²	147	143.9 Å²	143.9	64%	0.639	80%	0.797	S	S	*	*			trans	53.1	121.4	141.8	-60.9	172.9	-165.2	126.7	0	123.4
1128	R	29.9	Very low	33.4	Very low	211 Å²	211	145.6 Å²	145.6	80%	0.796	79%	0.793	S	S	*	*				84	156.8	117.9	-77.4	-176.3	-175.5	-173.3	1.1	119.8
1129	E	33.9	Very low	33.5	Very low	175 Å²	175	148.2 Å²	148.2	82%	0.818	80%	0.796	S	S	*	*			cis	-122.1	-169.7	10.4	-78.1	-159.6	139.2	0	0	115.3
1130	K	32.2	Very low	33.6	Very low	209 Å²	209	144.9 Å²	144.9	91%	0.909	80%	0.799	S	S	*	*			trans	-141.9	139.4	-176.1	-75.2	-177.7	173.2	-179.3	0	113
1131	S	35.6	Very low	33.5	Very low	123 Å²	123	145 Å²	145	86%	0.86	80%	0.8	S	S	*	*			trans	-165.6	154.7	156.4	-169.2	0	0	0	0	113.1
1132	R	32.4	Very low	33.7	Very low	243 Å²	243	148.7 Å²	148.7	92%	0.917	81%	0.806	S	S	*	*				-166.3	134.5	-59.7	-138.8	175.6	175.2	163.7	-3.4	111.2
1133	G	35.7	Very low	33.8	Very low	74 Å²	74	148.2 Å²	148.2	76%	0.763	80%	0.803	S	S	*	*			trans	120.4	123.9	166.2	0	0	0	0	0	114.3
1134	S	31.7	Very low	33.9	Very low	116 Å²	116	151.6 Å²	151.6	81%	0.811	81%	0.806	S	S	*	*			cis	106.1	101.4	4.6	-172	0	0	0	0	117.3
1135	T	37.5	Very low	33.9	Very low	128 Å²	128	151 Å²	151	79%	0.785	80%	0.802	S	S	*	*			trans	178.4	110.2	135.1	22.4	0	0	0	0	109.4
1136	S	36	Very low	34	Very low	117 Å²	117	148.5 Å²	148.5	82%	0.818	80%	0.802	S	S	*	*				67	129.5	88.9	76.5	0	0	0	0	115.5
1137	G	36.8	Very low	33.9	Very low	77 Å²	77	147.1 Å²	147.1	79%	0.794	81%	0.81	S	S	*	*			cis	-169.5	-150.8	3.2	0	0	0	0	0	110.1
1138	R	34.2	Very low	33.8	Very low	197 Å²	197	145.6 Å²	145.6	74%	0.743	82%	0.818	S	S	*	*			cis	-175.8	125.9	10.7	172	-175.3	-174.5	-170.7	4.7	112.4
1139	R	34.3	Very low	34	Very low	219 Å²	219	144 Å²	144	83%	0.826	82%	0.819	S	S	*	*			trans	68.6	148.1	168.1	-63.1	165.5	172.9	-178.3	-7.2	116.8
1140	G	36.1	Very low	34.1	Very low	74 Å²	74	141.1 Å²	141.1	76%	0.763	82%	0.816	S	S	*	*			cis	140.2	167.2	-3.6	0	0	0	0	0	112.4
1141	S	31	Very low	34.4	Very low	117 Å²	117	138.3 Å²	138.3	82%	0.818	81%	0.811	S	S	*	*			cis	-179.2	125.8	-15.1	175.6	0	0	0	0	110.7
1142	R	34.3	Very low	34.5	Very low	247 Å²	247	137.9 Å²	137.9	93%	0.932	81%	0.805	S	S	*	*			trans	168.9	146.9	164.5	-99.6	163.2	179.3	-170.4	-2.3	108.3
1143	S	35.6	Very low	34.7	Very low	113 Å²	113	131.9 Å²	131.9	79%	0.79	80%	0.798	S	S	*	*			cis	-157	160.3	-8.6	31	0	0	0	0	110.9
1144	H	31.4	Very low	34.7	Very low	183 Å²	183	137.1 Å²	137.1	85%	0.847	80%	0.802	S	S	*	*			trans	-78.3	146.1	-170.4	-73.1	-103.1	0	0	0	116.8
1145	V	34.2	Very low	34.9	Very low	134 Å²	134	136.2 Å²	136.2	81%	0.812	79%	0.794	S	S	*	*				-155.3	90.6	124.7	179	0	0	0	0	106.4
1146	S	32.4	Very low	34.5	Very low	105 Å²	105	139.7 Å²	139.7	73%	0.734	80%	0.798	S	S	*	*				58.9	94.4	90.7	72	0	0	0	0	117
1147	G	32.8	Very low	34.3	Very low	81 Å²	81	141.2 Å²	141.2	84%	0.835	80%	0.796	S	S	*	*			trans	-169.2	129.6	163.2	0	0	0	0	0	108.4
1148	S	33	Very low	34	Very low	115 Å²	115	148.4 Å²	148.4	80%	0.804	80%	0.801	S	S	*	*			trans	-141.3	123.8	-163.5	56	0	0	0	0	113.7
1149	E	32.4	Very low	34	Very low	177 Å²	177	145.3 Å²	145.3	83%	0.827	80%	0.798	S	S	*	*			trans	51.8	139.7	151.5	-91.4	177.1	178.2	0	0	119.5
1150	P	37	Very low	34	Very low	115 Å²	115	144.1 Å²	144.1	75%	0.747	80%	0.802	S	S	*	*				-146.2	156.7	64.4	39.3	-21.3	0	0	0	117.8
1151	N	37.4	Very low	33.8	Very low	150 Å²	150	149.6 Å²	149.6	80%	0.802	81%	0.808	S	S	*	*			trans	-71.5	138.5	153.4	-72.5	-25.6	0	0	0	109.1
1152	P	39.5	Very low	34	Very low	114 Å²	114	147.3 Å²	147.3	74%	0.74	80%	0.803	S	S	*	*				-152.3	-169.9	96.5	43.6	-26.9	0	0	0	112.7
1153	P	36.4	Very low	33.9	Very low	117 Å²	117	141.6 Å²	141.6	76%	0.76	80%	0.795	S	S	*	*			cis	-126.4	164	-11.2	40.5	-26.5	0	0	0	114.8
1154	E	34.5	Very low	33.7	Very low	183 Å²	183	143.3 Å²	143.3	86%	0.855	80%	0.801	S	S	*	*			trans	-87.5	164.6	149	-72.3	-174.4	179.4	0	0	109.8
1155	P	36	Very low	33.6	Very low	98 Å²	98	139.8 Å²	139.8	64%	0.636	80%	0.797	S	S	*	*			cis	-129.8	176.3	0.7	41.5	-27.6	0	0	0	114.2
1156	F	29.1	Very low	33.6	Very low	201 Å²	201	142 Å²	142	88%	0.882	80%	0.798	S	S	*	*			trans	-153.9	102.8	131.5	-111.1	-71.5	0	0	0	110.2	Y1158	F1156-Y1158 PolarHBondContact O-N 3.1Å
1157	L	32.4	Very low	33.4	Very low	148 Å²	148	142.8 Å²	142.8	78%	0.775	80%	0.799	S	S	*	*			trans	-76.5	111.3	174.4	-83.1	160.3	0	0	0	109.8	I1159	L1157-I1159 HydrophobicContact CB-CG1 4.39Å; L1157-I1159 PolarHBondContact O-N 3.19Å
1158	Y	30.2	Very low	33.4	Very low	229 Å²	229	145.1 Å²	145.1	90%	0.898	80%	0.797	S	S	*	*			trans	-76.7	103.2	158	-102.9	-87.2	0	0	0	108.4	F1156	F1156-Y1158 PolarHBondContact O-N 3.1Å
1159	I	34.7	Very low	33.3	Very low	132 Å²	132	145.7 Å²	145.7	68%	0.677	80%	0.796	S	S	*	*			trans	-85.3	129.4	169.6	-62.6	176.3	0	0	0	107.5	L1157 E1161	L1157-I1159 HydrophobicContact CB-CG1 4.39Å; L1157-I1159 PolarHBondContact O-N 3.19Å; I1159-E1161 PolarHBondContact O-N 3.02Å
1160	E	32.7	Very low	33.4	Very low	193 Å²	193	142.6 Å²	142.6	90%	0.902	79%	0.789	S	S	*	*			trans	-77	100.8	173.2	-65.9	179.5	153.2	0	0	109.5	G1162	E1160-G1162 PolarHBondContact O-N 3.31Å
1161	E	33.6	Very low	33.2	Very low	190 Å²	190	143 Å²	143	89%	0.888	79%	0.79	S	S	*	*			trans	-76.6	87.7	174.2	-74.6	-160.6	151.4	0	0	111.8	I1159 T1163	I1159-E1161 PolarHBondContact O-N 3.02Å; E1161-T1163 PolarHBondContact O-N 3.48Å
1162	G	34.8	Very low	33.1	Very low	69 Å²	69	141.3 Å²	141.3	71%	0.711	79%	0.785	S	S	*	*			trans	-76.8	104.9	166	0	0	0	0	0	112.4	E1160	E1160-G1162 PolarHBondContact O-N 3.31Å
1163	T	31	Very low	32.9	Very low	127 Å²	127	141.6 Å²	141.6	78%	0.779	79%	0.785	S	S	*	*			trans	7.4	116.1	156.4	55.4	0	0	0	0	118.9	E1161	E1161-T1163 PolarHBondContact O-N 3.48Å
1164	T	31.8	Very low	32.9	Very low	149 Å²	149	141.4 Å²	141.4	91%	0.914	79%	0.786	S	S	*	*				-176	165.2	114	23.1	0	0	0	0	113
1165	S	30.4	Very low	32.9	Very low	109 Å²	109	137.1 Å²	137.1	76%	0.762	78%	0.777	S	S	*	*			trans	-90.1	143.5	-168.7	-48.5	0	0	0	0	114.2
1166	Q	33	Very low	32.8	Very low	179 Å²	179	140.1 Å²	140.1	84%	0.836	79%	0.787	S	S	*	*				158.2	125.2	119.1	-84.5	-170	69.7	0	0	114.1
1167	T	29.6	Very low	33.2	Very low	122 Å²	122	135.2 Å²	135.2	75%	0.748	78%	0.783	S	S	*	*			trans	41.1	114.2	134.4	-42.7	0	0	0	0	120.8
1168	T	31.8	Very low	33.4	Very low	130 Å²	130	131.5 Å²	131.5	80%	0.798	78%	0.781	S	S	*	*				-168.8	147.7	118.4	-78.6	0	0	0	0	112.4
1169	T	30.3	Very low	33.7	Very low	127 Å²	127	126.3 Å²	126.3	78%	0.779	78%	0.778	S	S	*	*			trans	-54.2	169	174.8	24.6	0	0	0	0	114.7
1170	V	34.8	Very low	33.7	Very low	112 Å²	112	124.8 Å²	124.8	68%	0.679	78%	0.779	S	S	*	*				-166.9	137.4	62.2	173.1	0	0	0	0	112.7
1171	T	33.5	Very low	33.8	Very low	124 Å²	124	120.6 Å²	120.6	76%	0.761	77%	0.771	S	S	*	*			trans	66.5	153.1	163	52.8	0	0	0	0	120.2
1172	T	34.9	Very low	33.8	Very low	115 Å²	115	117.3 Å²	117.3	71%	0.706	76%	0.764	S	S	*	*			cis	-148.6	158.3	11.3	-16.2	0	0	0	0	115.1
1173	T	35.2	Very low	33.9	Very low	119 Å²	119	119 Å²	119	73%	0.73	77%	0.765	S	S	*	*			trans	71.2	116.5	151.3	39.6	0	0	0	0	123.9
1174	S	36.7	Very low	34	Very low	113 Å²	113	117.4 Å²	117.4	79%	0.79	76%	0.76	S	S	*	*			trans	66.4	140.8	144.6	50.8	0	0	0	0	121.6
1175	S	35	Very low	34.2	Very low	94 Å²	94	119.7 Å²	119.7	66%	0.657	76%	0.757	S	S	*	*			cis	-173.1	152.7	-11.1	50.9	0	0	0	0	113.4
1176	N	33.5	Very low	34.4	Very low	161 Å²	161	118.5 Å²	118.5	86%	0.861	75%	0.749	S	S	*	*			trans	68.3	146	160.6	-66.2	-15.4	0	0	0	119.1
1177	A	36.8	Very low	34.5	Very low	97 Å²	97	117 Å²	117	80%	0.802	75%	0.746	S	S	*	*			cis	-170	158.1	-12.5	0	0	0	0	0	113.2
1178	G	37	Very low	34.6	Very low	70 Å²	70	115.9 Å²	115.9	72%	0.722	74%	0.744	S	S	*	*			trans	94.7	125.9	161.8	0	0	0	0	0	116.9
1179	S	35.5	Very low	34.7	Very low	120 Å²	120	115.2 Å²	115.2	84%	0.839	74%	0.74	S	S	*	*			cis	91.5	133.8	40	72.2	0	0	0	0	113.7
1180	S	35.3	Very low	34.9	Very low	100 Å²	100	115.8 Å²	115.8	70%	0.699	74%	0.743	S	S	*	*			cis	-174.3	152.7	8.3	45.7	0	0	0	0	115.3
1181	S	34.5	Very low	34.9	Very low	105 Å²	105	114.2 Å²	114.2	73%	0.734	74%	0.741	S	S	*	*			trans	65.4	159.8	147.7	60.8	0	0	0	0	120.4
1182	T	35.3	Very low	34.8	Very low	121 Å²	121	113.9 Å²	113.9	74%	0.742	74%	0.739	S	S	*	*			cis	-162.2	145.8	19.9	-20.5	0	0	0	0	114.2
1183	S	35.7	Very low	34.8	Very low	104 Å²	104	114.6 Å²	114.6	73%	0.727	74%	0.739	S	S	*	*			trans	36.4	153.5	143.6	61.7	0	0	0	0	125.1
1184	S	34.3	Very low	34.6	Very low	95 Å²	95	114.8 Å²	114.8	66%	0.664	74%	0.74	S	S	*	*			cis	175.4	156.8	-17.7	62.3	0	0	0	0	113.2
1185	K	35.3	Very low	34.3	Very low	196 Å²	196	114.2 Å²	114.2	85%	0.852	74%	0.736	S	S	*	*			trans	72.3	155.3	159.3	-66.6	178.6	-178.7	-179.2	0	119.3
1186	S	34.4	Very low	34.2	Very low	85 Å²	85	115.1 Å²	115.1	59%	0.594	74%	0.742	S	S	*	*			cis	-166.2	169.3	-20.6	53.2	0	0	0	0	112.5
1187	D	34.3	Very low	34.1	Very low	146 Å²	146	117.8 Å²	117.8	78%	0.781	74%	0.742	S	S	*	*			trans	84.9	-166.1	156.9	-44.6	-48	0	0	0	120.8
1188	S	32.9	Very low	34	Very low	100 Å²	100	120.1 Å²	120.1	70%	0.699	75%	0.746	S	S	*	*				-161.1	-175.3	-121	68.1	0	0	0	0	114.6
1189	T	34.6	Very low	33.8	Very low	116 Å²	116	124.8 Å²	124.8	71%	0.712	75%	0.754	S	S	*	*			cis	-169.4	160.7	9.1	-7.2	0	0	0	0	110.8
1190	V	34	Very low	33.7	Very low	139 Å²	139	124 Å²	124	84%	0.842	76%	0.755	S	S	*	*			trans	68.4	153.1	161.7	175.5	0	0	0	0	115.7
1191	A	34.6	Very low	33.5	Very low	78 Å²	78	128.9 Å²	128.9	65%	0.645	76%	0.764	S	S	*	*			cis	-128	178.3	3.1	0	0	0	0	0	110.4
1192	T	32.1	Very low	33.6	Very low	118 Å²	118	133.2 Å²	133.2	72%	0.724	77%	0.772	S	S	*	*			cis	98	134.3	29.1	86.8	0	0	0	0	119.1
1193	D	33.2	Very low	33.5	Very low	130 Å²	130	132.8 Å²	132.8	70%	0.695	77%	0.774	S	S	*	*			trans	93.9	108	152.1	-60.3	-55.4	0	0	0	124.2
1194	T	31	Very low	33.6	Very low	122 Å²	122	133.5 Å²	133.5	75%	0.748	78%	0.777	S	S	*	*				29	150.4	123.2	57	0	0	0	0	122.1
1195	S	31	Very low	33.6	Very low	101 Å²	101	134.7 Å²	134.7	71%	0.706	78%	0.782	S	S	*	*			cis	-175.5	176.9	-4.1	53.1	0	0	0	0	112.6
1196	S	33.3	Very low	33.2	Very low	113 Å²	113	132.1 Å²	132.1	79%	0.79	78%	0.783	S	S	*	*			trans	94.9	142.5	146.2	80.1	0	0	0	0	122.3
1197	Y	31.9	Very low	33.2	Very low	218 Å²	218	133.8 Å²	133.8	86%	0.855	80%	0.795	S	S	*	*			trans	-61.7	156.1	-176.9	-68.5	-108.5	0	0	0	116.6
1198	T	34.9	Very low	33	Very low	145 Å²	145	132.6 Å²	132.6	89%	0.89	80%	0.798	S	S	*	*				-179	161.9	105.8	27.6	0	0	0	0	115.2
1199	N	31.5	Very low	33	Very low	169 Å²	169	133.3 Å²	133.3	90%	0.904	80%	0.803	S	S	*	*			trans	-68.7	147.8	-175.2	-77.5	-60.5	0	0	0	116.5
1200	A	33.8	Very low	33	Very low	103 Å²	103	136.5 Å²	136.5	85%	0.851	81%	0.81	S	S	*	*			trans	-159.2	149.7	133.6	0	0	0	0	0	112.4
1201	K	31.4	Very low	33.1	Very low	202 Å²	202	136 Å²	136	88%	0.878	81%	0.809	S	S	*	*			trans	-91.9	146.3	-177.4	-58.3	169.9	176.8	177.7	0	112.6
1202	Q	35.4	Very low	33	Very low	196 Å²	196	141 Å²	141	92%	0.916	82%	0.822	S	S	*	*				-169.6	172.3	128.1	-105.6	165.1	13.7	0	0	113
1203	S	34.8	Very low	33	Very low	112 Å²	112	142.9 Å²	142.9	78%	0.783	83%	0.827	S	S	*	*			trans	-92.8	165.9	-155.4	-31.3	0	0	0	0	115.7
1204	P	37	Very low	33.1	Very low	120 Å²	120	143.4 Å²	143.4	78%	0.779	84%	0.835	S	S	*	*			trans	-102	176.7	-167.8	41	-37.1	0	0	0	115.2
1205	P	34.3	Very low	33.1	Very low	120 Å²	120	143.5 Å²	143.5	78%	0.779	84%	0.835	S	S	*	*			trans	-132.1	146.9	138.5	37.4	-26	0	0	0	115.2
1206	T	27.9	Very low	33.2	Very low	141 Å²	141	146.4 Å²	146.4	87%	0.865	84%	0.842	S	S	*	*			trans	-20.1	136.8	164.1	53	0	0	0	0	120.6
1207	S	34.5	Very low	33	Very low	121 Å²	121	150.3 Å²	150.3	85%	0.846	85%	0.848	S	S	*	*			trans	-150.3	148.3	143.1	64.6	0	0	0	0	111.7
1208	S	29.1	Very low	33.2	Very low	120 Å²	120	145.7 Å²	145.7	84%	0.839	84%	0.842	S	S	*	*			trans	-63.2	152.5	-175.4	46.8	0	0	0	0	116
1209	S	32.6	Very low	33.2	Very low	116 Å²	116	146.6 Å²	146.6	81%	0.811	84%	0.842	S	S	*	*			trans	-137	125.3	161.2	59.1	0	0	0	0	110.5
1210	E	34.2	Very low	33.2	Very low	183 Å²	183	148.5 Å²	148.5	86%	0.855	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-83.4	145.5	179.1	-62.1	158.7	131.7	0	0	111.1
1211	P	35.7	Very low	33.2	Very low	128 Å²	128	152.7 Å²	152.7	83%	0.831	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-79.3	132.5	165.8	32.4	-30.9	0	0	0	110
1212	M	34.4	Very low	33.4	Very low	184 Å²	184	147.7 Å²	147.7	91%	0.906	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-66.8	139.7	-173.3	-65.3	-179.5	-73.8	0	0	113.6
1213	D	31.8	Very low	33.3	Very low	156 Å²	156	147.8 Å²	147.8	83%	0.834	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-65.7	144.7	160.4	-89.1	-46.5	0	0	0	110.9	T1215	D1213-T1215 PolarHBondContact O-N 3.19Å
1214	V	33.8	Very low	33.2	Very low	142 Å²	142	151.9 Å²	151.9	86%	0.861	84%	0.844	S	S	*	*			trans	-83.4	106.1	169.4	178.4	0	0	0	0	108	L1216	V1214-L1216 PolarHBondContact O-N 3.29Å
1215	T	31.1	Very low	33.2	Very low	123 Å²	123	155.8 Å²	155.8	76%	0.755	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-69.9	121.7	178.9	49.4	0	0	0	0	111.3	D1213	D1213-T1215 PolarHBondContact O-N 3.19Å
1216	L	33.9	Very low	33.3	Very low	163 Å²	163	155.5 Å²	155.5	85%	0.853	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-63.3	141.4	162.5	-75.5	162.8	0	0	0	110.2	V1214	V1214-L1216 PolarHBondContact O-N 3.29Å
1217	E	28.4	Very low	33.7	Very low	195 Å²	195	155.8 Å²	155.8	91%	0.911	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-78.2	123.6	169.9	-62.2	-171.3	131	0	0	109.6
1218	T	36.6	Very low	33.7	Very low	120 Å²	120	154.8 Å²	154.8	74%	0.736	84%	0.839	S	S	*	*			trans	-140.8	138.1	166.4	57.6	0	0	0	0	110.1
1219	D	36.1	Very low	34.1	Very low	164 Å²	164	157.1 Å²	157.1	88%	0.877	84%	0.837	S	S	*	*			trans	-46	147.6	-168.3	-54.8	-73.9	0	0	0	117.1
1220	K	30.7	Very low	34.3	Very low	210 Å²	210	159.5 Å²	159.5	91%	0.913	84%	0.84	S	S	*	*			trans	-125.1	86.6	170.1	-76	-177.4	178.7	170.7	0	111.4
1221	E	33.4	Very low	34.5	Very low	190 Å²	190	157.6 Å²	157.6	89%	0.888	84%	0.835	S	S	*	*			trans	-124.2	160.6	157.5	-71.2	-142.9	126.8	0	0	111
1222	A	35.8	Very low	34.5	Very low	97 Å²	97	155 Å²	155	80%	0.802	82%	0.82	S	S	*	*			trans	56.1	92.3	178.6	0	0	0	0	0	117.2
1223	E	33.6	Very low	34.7	Very low	198 Å²	198	155.2 Å²	155.2	93%	0.925	82%	0.816	S	S	*	*				-168.1	153.5	93.8	-100	-172.9	169.8	0	0	112.2
1224	K	32.8	Very low	35.1	Very low	198 Å²	198	153.9 Å²	153.9	86%	0.861	82%	0.819	S	S	*	*			trans	-161.1	139.6	-177.9	-148.6	172.1	-170.3	172.2	0	111.7
1225	K	36.2	Very low	35.3	Very low	202 Å²	202	155.5 Å²	155.5	88%	0.878	81%	0.814	S	S	*	*			trans	78.4	139.5	-167.1	-50.5	165.2	-177.3	174.9	0	111.5
1226	S	36.3	Very low	35.8	Very low	115 Å²	115	156.7 Å²	156.7	80%	0.804	81%	0.811	S	S	*	*			cis	-139.2	144.6	25.8	54.2	0	0	0	0	116.1
1227	D	37.4	Very low	36.3	Very low	146 Å²	146	156.7 Å²	156.7	78%	0.781	81%	0.812	S	S	*	*			trans	-57.7	165.2	157.6	-50.7	-84.1	0	0	0	111.9
1228	S	34.2	Very low	36.9	Very low	100 Å²	100	153.7 Å²	153.7	70%	0.699	80%	0.802	S	S	*	*			cis	-167.3	-170.9	2.4	33.1	0	0	0	0	110.2
1229	E	37.4	Very low	37.4	Very low	169 Å²	169	154.4 Å²	154.4	79%	0.79	80%	0.802	S	S	*	*			trans	74.7	103.9	149.9	-88.3	-175.8	-178.9	0	0	119.6
1230	L	37.7	Very low	37.8	Very low	167 Å²	167	160.1 Å²	160.1	87%	0.874	82%	0.819	S	S	*	*				177.5	143.7	82.3	-103.5	159.9	0	0	0	114.9
1231	D	37.2	Very low	38.2	Very low	142 Å²	142	157.7 Å²	157.7	76%	0.759	81%	0.814	S	S	*	*			trans	-85.2	154.6	-159.4	179.9	26.2	0	0	0	117.1
1232	S	36.4	Very low	38.4	Very low	73 Å²	73	155.9 Å²	155.9	51%	0.51	81%	0.81	S	S	.	*			trans	105	133.8	137.2	85.5	0	0	0	0	123
1233	K	38.8	Very low	38.6	Very low	190 Å²	190	159.2 Å²	159.2	83%	0.826	81%	0.811	S	S	*	*			trans	67	108.6	148.9	-63.5	153.3	-172.1	155.5	0	120.2
1234	S	39.1	Very low	38.8	Very low	128 Å²	128	156.9 Å²	156.9	90%	0.895	80%	0.804	S	S	*	*				-165	169.8	90.5	27.6	0	0	0	0	111.4
1235	K	38.3	Very low	39.2	Very low	175 Å²	175	154.4 Å²	154.4	76%	0.761	80%	0.801	S	S	*	*			trans	-120.4	170.7	-172.2	-85.1	-166.5	177.2	-172.7	0	111.7
1236	E	40.8	Very low	39.4	Very low	148 Å²	148	151.2 Å²	151.2	69%	0.692	80%	0.795	S	S	*	*			trans	70.7	129.6	157.5	-70	140.2	-140.1	0	0	114.8
1237	N	45.7	Very low	39.6	Very low	163 Å²	163	153.8 Å²	153.8	87%	0.872	80%	0.795	S	S	*	*			cis	-141.7	-180	43.5	-92.3	-76.1	0	0	0	115.5
1238	N	40.9	Very low	39.8	Very low	132 Å²	132	154.4 Å²	154.4	71%	0.706	80%	0.796	S	S	*	*			trans	-108	173	-162	-147.5	46.7	0	0	0	113.9
1239	D	45.7	Very low	40.3	Very low	135 Å²	135	158.9 Å²	158.9	72%	0.722	80%	0.804	S	S	*	*			trans	64.2	90.3	157.5	-57.4	-49.8	0	0	0	120
1240	K	45.5	Very low	40.6	Very low	285 Å²	285	158 Å²	158	100%	1.239	81%	0.805	S	S	*	*				-159.6	0	111.3	-116.5	-179.8	-178	-178.2	0	114.2

Retrieved 1,240 of 1,240 residues in 1276.1 ms (Link to these results)

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