A0A5K4F0U2_SCHMA Loading...

Anion exchange protein

AlphaFold DB (A0A5K4F3N9), UniProt , Accession A0A5K4F0U2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,060 aa.

						>A0A5K4F0U2_SCHMA|A0A5K4F0U2
MPRDTILYVVEEEHSGGSDNREGYKLSFHTGSYPTQMFIELQELVPRVDGGLQFNESIFKMPVAAHFRVLWLETARWVNFEENFNEVEQRFTEAHVPPMKFSCINSFRDKLQQNLKIIQTDALTLGQALDEVAKYALSQNCIQGNEQYDVLRAILFAERWHPEVKGHISDAAEFDQYWAGTLPEGINPKPAFLQRASVAAIGAKKHISMTRASASTNDFKPKLSLGSREQGSSSLTKALSIHNECQHPYHRYNQPLTNCLSSGSEACTVICGLIEFLKSPILVLLRLNKTIQRSCISEVDIPVRFIFIYIGPQNDELNYAELARIFAVMMTNDTFRLCVYDSLSVDDIIKGIDNFMQDSFVMPLSRHYNANALAGMTRQIEAYRKETVCERDGDRRPKGSFAVRKLTEQSQNNLVNGSYVPSSLNLKQQTDNIIKPDSDKLPIPSNEIDTPKISKRKIFLRDFCPPFIELSRGIRPWIKRMPGDYKDAIRKENFSIVFGSVLFIYFVNLSPSITFAALLNTQVDPSYTVTLTLLAVGVFLIIFTVLSGQPLAIIGISAPMYIVESSLVSVSRSTGVDFKQLRFWSAFYCSIFGFIFVGCNISGIAKHIRRSVEEVYNSFIGFFFLLKALFTMFLLIPAKPKDNTPMSRMAYYQKLAVAGVTLFLAFIMLQFCLILAQLKRGNYFRRNIRKLLGALNVPLGMLLITGLERIFFRGYNLPTVNIPPSNQVNASTWVNPPDFSRLQDYSKAAPTLIHGTSIAIGVALAIIIFTEAALNGLTAMKNKAVKPNIFVMDLVLLQIIFPIISGITGWPFMSGTTVRTLSNLVALVKMDQSPAPGMPHKIVGTVEQRVSGVFVGILVALSIFLGSILSNIPLAALYGMFLYMGVMGLRDLTFVLRICSLMKRRKHWEDWECVRGLPSRHILVFSLIQAAVVLILVSLNIISDFTVANYVGLIFPIVILIYGLIREFALPKWEWLALYLHQLDRKYKLHPSVMRKPPSTVRNLSTIRKESVGSFASGGLTVTSQLKTNNFIEYIHDQETASYSDISEHEDGVVRRTWAT
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	24.2	Very low	33.7	Very low	230 Å²	230	84.5 Å²	84.5	100%	1.133	42%	0.421	S	S	*	.				0	140.4	0	-71.5	-171.1	169.7	0	0	108	R3	M1-R3 PolarHBondContact O-N 3.24Å
2	P	29	Very low	33.6	Very low	119 Å²	119	87.7 Å²	87.7	77%	0.773	43%	0.434	S	S	*	.			trans	-80.8	113	175.4	23.3	-12.3	0	0	0	111	D4	P2-D4 PolarHBondContact O-N 2.78Å
3	R	27.9	Very low	33.3	Very low	186 Å²	186	96.4 Å²	96.4	70%	0.702	47%	0.473	S	S	*	.	S	Bend	trans	35.1	3.7	145.6	-74.2	-171.5	179.9	-178.8	-2.2	126.4	M1	M1-R3 PolarHBondContact O-N 3.24Å
4	D	32.6	Very low	33.2	Very low	126 Å²	126	102.1 Å²	102.1	67%	0.674	50%	0.497	S	S	*	.			trans	-113	115	-178.8	-58.2	-15.8	0	0	0	112.8	P2 I6	P2-D4 PolarHBondContact O-N 2.78Å; D4-I6 PolarHBondContact O-N 3.3Å
5	T	31.7	Very low	32.8	Very low	32 Å²	32	104 Å²	104	20%	0.196	53%	0.525	C	S	.	.			trans	-77	109.9	179.9	-49.6	0	0	0	0	110.5	N79	T5-N79 WeakPolarHBondContact CG2-O 3.48Å
6	I	36	Very low	32.6	Very low	49 Å²	49	102.3 Å²	102.3	25%	0.251	54%	0.542	S	S	.	.			trans	-90.6	122.1	175.5	-58.7	173.8	0	0	0	108.6	D4 Y8 V96 T377 E381	D4-I6 PolarHBondContact O-N 3.3Å; I6-Y8 HydrophobicContact CG2-CE1 3.96Å; I6-V96 VanDerWaalsContact O-CG1 3.32Å; I6-V96 WeakPolarHBondContact O-CG1 3.44Å; I6-T377 HydrophobicContact CD1-CG2 3.6Å; I6-E381 HydrophobicContact CD1-CG 4.34Å
7	L	38.8	Very low	32.3	Very low	7 Å²	7	100.7 Å²	100.7	4%	0.037	56%	0.555	C	S	.	*			trans	-114.6	131.5	-178.1	-123.9	143.9	0	0	0	110.6	P97 M99 V328 T331 F355 F360	L7-P97 HydrophobicContact CD2-CG 4.12Å; L7-P97 HydrophobicContact CG-CG 4.28Å; L7-M99 HydrophobicContact CD2-CE 3.37Å; L7-V328 HydrophobicContact CD1-CG1 3.65Å; L7-V328 HydrophobicContact CD2-CG1 3.3Å; L7-V328 HydrophobicContact CG-CG1 3.96Å; L7-T331 WeakPolarHBondContact CD1-OG1 3.34Å; L7-F355 HydrophobicContact CB-CE2 4.5Å; L7-F355 HydrophobicContact CB-CZ 4.43Å; L7-F355 HydrophobicContact CD1-CE2 4.06Å; L7-F355 HydrophobicContact CD1-CZ 4.31Å; L7-F355 HydrophobicContact CD2-CZ 3.98Å; L7-F355 HydrophobicContact CG-CZ 4.46Å; L7-F360 PolarHBondContact O-N 3.2Å
8	Y	44.3	Very low	32.2	Very low	24 Å²	24	101.3 Å²	101.3	9%	0.094	57%	0.567	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.1	126.4	-174.1	-60.7	-68.2	0	0	0	111.7	I6 V96 F360 M362 T377	I6-Y8 HydrophobicContact CG2-CE1 3.96Å; Y8-V96 HydrophobicContact CD2-CB 4.04Å; Y8-V96 HydrophobicContact CD2-CG1 3.4Å; Y8-V96 VanDerWaalsContact CD2-CG1 3.4Å; Y8-V96 HydrophobicContact CE2-CB 4.1Å; Y8-V96 HydrophobicContact CE2-CG1 3.74Å; Y8-V96 HydrophobicContact CE2-CG2 4.13Å; Y8-V96 HydrophobicContact CG-CG1 4.46Å; Y8-F360 CarbonylContact C-O 3.56Å; Y8-F360 VanDerWaalsContact CA-O 3.31Å; Y8-F360 WeakPolarHBondContact CA-O 3.5Å; Y8-F360 HydrophobicContact CD1-CB 4.16Å; Y8-F360 AromaticContact CD1-CD1 3.87Å; Y8-F360 HydrophobicContact CD1-CD1 3.87Å; Y8-F360 HydrophobicContact CD1-CG 4.48Å; Y8-F360 AromaticContact CE1-CD1 3.98Å; Y8-F360 HydrophobicContact CE1-CD1 3.98Å; Y8-M362 HydrophobicContact CD1-CE 3.55Å; Y8-M362 HydrophobicContact CD1-CG 3.7Å; Y8-M362 HydrophobicContact CD1-SD 3.73Å; Y8-M362 HydrophobicContact CD2-CE 3.83Å; Y8-M362 HydrophobicContact CE1-CE 3.94Å; Y8-M362 HydrophobicContact CE1-CG 4.21Å; Y8-M362 HydrophobicContact CE1-SD 3.78Å; Y8-M362 HydrophobicContact CE2-CE 4.24Å; Y8-M362 HydrophobicContact CG-CE 3.49Å; Y8-M362 VanDerWaalsContact CG-CE 3.49Å; Y8-M362 HydrophobicContact CG-CG 4.4Å; Y8-M362 HydrophobicContact CG-SD 4.31Å; Y8-T377 VanDerWaalsContact OH-CG2 3.32Å; Y8-T377 WeakPolarHBondContact OH-CG2 3.49Å; Y8-T377 PolarHBondContact OH-OG1 3.23Å; Y8-T377 VanDerWaalsContact OH-OG1 3.05Å
9	V	38.6	Very low	32	Very low	0 Å²	0	103.6 Å²	103.6	0%	0	58%	0.578	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.5	137.1	170.2	-179.4	0	0	0	0	108.9	F101 I104 M356 S359 F360 V361 M362	V9-F101 HydrophobicContact CG1-CB 3.8Å; V9-F101 HydrophobicContact CG1-CD2 3.91Å; V9-F101 HydrophobicContact CG1-CG 4.37Å; V9-I104 HydrophobicContact CG1-CD1 4.26Å; V9-I104 HydrophobicContact CG2-CD1 4.01Å; V9-M356 HydrophobicContact CG1-CE 4.25Å; V9-M356 HydrophobicContact CG2-CE 4.47Å; V9-M356 HydrophobicContact CG2-SD 4.38Å; V9-S359 WeakPolarHBondContact CG2-OG 3.32Å; V9-F360 PolarHBondContact N-O 3.25Å; V9-V361 HydrophobicContact CB-CG2 4.35Å; V9-V361 CarbonylContact O-C 3.52Å; V9-V361 VanDerWaalsContact O-CA 3.22Å; V9-V361 WeakPolarHBondContact O-CA 3.33Å; V9-M362 PolarHBondContact O-N 3.47Å
10	V	35.5	Very low	32	Very low	29 Å²	29	106.7 Å²	106.7	18%	0.176	59%	0.594	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.7	128.6	-174.5	-174.9	0	0	0	0	110	M99 F101 L364	V10-M99 PolarHBondContact N-O 3.25Å; V10-F101 PolarHBondContact O-N 3.06Å; V10-L364 HydrophobicContact CG1-CD1 3.43Å; V10-L364 VanDerWaalsContact CG1-CD1 3.43Å; V10-L364 HydrophobicContact CG1-CD2 3.57Å; V10-L364 HydrophobicContact CG1-CG 3.35Å
11	E	32.4	Very low	31.6	Very low	128 Å²	128	113.5 Å²	113.5	60%	0.598	61%	0.61	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-103.2	131.7	177.9	-165	173	-161.9	0	0	110.8	V361	E11-V361 HydrophobicContact CB-CG1 3.89Å
12	E	32.7	Very low	31.8	Very low	122 Å²	122	109.8 Å²	109.8	57%	0.57	59%	0.59	S	S	*	*			trans	-95.3	128.7	172.9	-100.2	175.5	169.7	0	0	109.8	H14 L364	E12-H14 PolarHBondContact O-N 3.3Å; E12-H14 VanDerWaalsContact O-N 3.09Å; E12-L364 HydrophobicContact CG-CD1 4.42Å
13	E	29.7	Very low	31.5	Very low	201 Å²	201	107.8 Å²	107.8	94%	0.939	59%	0.591	S	S	*	*			trans	-69.3	102.5	173.8	-82.1	-175.6	158.8	0	0	110.6
14	H	31.6	Very low	31.4	Very low	177 Å²	177	108.3 Å²	108.3	82%	0.819	59%	0.594	S	S	*	*			trans	-94.3	124.3	154.5	-82.1	-36.3	0	0	0	110	E12 G16	E12-H14 PolarHBondContact O-N 3.3Å; E12-H14 VanDerWaalsContact O-N 3.09Å; H14-G16 PolarHBondContact O-N 3.46Å
15	S	27.3	Very low	30.9	Very low	130 Å²	130	112.2 Å²	112.2	91%	0.909	61%	0.605	S	S	*	*			trans	-67	111.8	-179	51.1	0	0	0	0	112.1
16	G	29	Very low	30.7	Very low	77 Å²	77	115 Å²	115	79%	0.794	62%	0.619	S	S	*	*			trans	146.6	122.2	156.8	0	0	0	0	0	116.1	H14	H14-G16 PolarHBondContact O-N 3.46Å
17	G	28.1	Very low	30.1	Very low	75 Å²	75	117.6 Å²	117.6	77%	0.773	64%	0.641	S	S	*	*			trans	106	97.4	143.2	0	0	0	0	0	119.1
18	S	29.7	Very low	29.5	Very low	111 Å²	111	123.2 Å²	123.2	78%	0.776	67%	0.665	S	S	*	*			trans	33.4	124.6	144.5	69.5	0	0	0	0	123.2
19	D	28.4	Very low	28.7	Very low	145 Å²	145	131.2 Å²	131.2	78%	0.775	70%	0.703	S	S	*	*			trans	39.7	114.6	132.8	-75.7	-24.3	0	0	0	120.3
20	N	31.8	Very low	28	Very low	165 Å²	165	138.2 Å²	138.2	88%	0.882	75%	0.746	S	S	*	*				-169.5	120.6	115.2	-92.7	-27.4	0	0	0	111
21	R	25.4	Very low	27.7	Very low	251 Å²	251	140.1 Å²	140.1	95%	0.947	77%	0.772	S	S	*	*			trans	-93.5	116.4	172.2	-76.3	179.1	175.7	175.5	-0.8	109.3
22	E	28.4	Very low	27.6	Very low	152 Å²	152	139 Å²	139	71%	0.71	78%	0.778	S	S	*	*			trans	-127.1	126	157.1	-72.3	-163.6	155.7	0	0	109.7	Y24	E22-Y24 HydrophobicContact CB-CE2 3.87Å; E22-Y24 PolarHBondContact OE2-OH 3.32Å; E22-Y24 VanDerWaalsContact OE2-OH 3.04Å
23	G	22.3	Very low	28	Very low	76 Å²	76	143 Å²	143	78%	0.784	79%	0.789	S	S	*	*			trans	-85.2	139	-179	0	0	0	0	0	111.6
24	Y	25.9	Very low	29.1	Very low	198 Å²	198	137.7 Å²	137.7	78%	0.776	77%	0.772	S	S	*	*			trans	-132.9	147.1	172.9	-67.3	-77.8	0	0	0	112.4	E22	E22-Y24 HydrophobicContact CB-CE2 3.87Å; E22-Y24 PolarHBondContact OE2-OH 3.32Å; E22-Y24 VanDerWaalsContact OE2-OH 3.04Å
25	K	22.3	Very low	30.6	Very low	207 Å²	207	132.2 Å²	132.2	90%	0.9	75%	0.751	S	S	*	*			trans	-102.9	121.1	-163.4	-165.3	-177.6	-170.7	-179	0	108.3
26	L	25.9	Very low	32.9	Very low	92 Å²	92	128.8 Å²	128.8	48%	0.482	72%	0.721	S	S	.	*			trans	-96.2	124.7	-177.5	-92.9	146.5	0	0	0	112.7	F28	L26-F28 HydrophobicContact CB-CE2 4.14Å; L26-F28 HydrophobicContact CD2-CZ 4.25Å
27	S	23.2	Very low	35.6	Very low	103 Å²	103	125.3 Å²	125.3	72%	0.72	68%	0.684	S	S	*	*			trans	-106	130.6	173.6	46	0	0	0	0	110.4
28	F	27.4	Very low	38.6	Very low	124 Å²	124	121.8 Å²	121.8	54%	0.544	65%	0.647	S	S	.	*			trans	-112.2	127.5	178.6	-69.5	-81.9	0	0	0	111.5	L26	L26-F28 HydrophobicContact CB-CE2 4.14Å; L26-F28 HydrophobicContact CD2-CZ 4.25Å
29	H	26.1	Very low	41.7	Very low	193 Å²	193	116.6 Å²	116.6	89%	0.894	61%	0.611	S	S	*	*			trans	-91.2	128.1	170.1	-89.8	-77.8	0	0	0	110.2
30	T	25.6	Very low	44.7	Very low	147 Å²	147	109.7 Å²	109.7	90%	0.902	57%	0.574	S	S	*	*			trans	-89.4	105.7	174.3	50.5	0	0	0	0	110.3
31	G	28.7	Very low	47.7	Very low	69 Å²	69	102 Å²	102	71%	0.711	53%	0.533	S	S	*	.			trans	-127.8	134.1	170.5	0	0	0	0	0	110.4	Y33	G31-Y33 PolarHBondContact O-N 3.11Å
32	S	30.8	Very low	50.9	Low	104 Å²	104	90.1 Å²	90.1	73%	0.727	49%	0.488	S	S	*	.			trans	-92.4	97.5	-161.3	172	0	0	0	0	114
33	Y	40.1	Very low	53.8	Low	206 Å²	206	86.3 Å²	86.3	81%	0.808	47%	0.47	S	S	*	.			trans	-157.4	108	150.6	-64.3	-73.2	0	0	0	112	G31	G31-Y33 PolarHBondContact O-N 3.11Å
34	P	52.6	Low	57	Low	89 Å²	89	83 Å²	83	58%	0.578	43%	0.434	S	S	*	.			trans	-121.8	92.3	165.8	34.6	-18.8	0	0	0	110.7
35	T	64.4	Low	59.6	Low	62 Å²	62	75.6 Å²	75.6	38%	0.38	41%	0.41	S	S	.	.			trans	-97.5	145	164.7	49.5	0	0	0	0	109.6	G263	T35-G263 WeakPolarHBondContact CB-O 3.32Å; T35-G263 WeakPolarHBondContact CG2-O 3.33Å
36	Q	74.9	Confident	61.9	Low	58 Å²	58	68 Å²	68	27%	0.271	38%	0.382	S	S	.	.			trans	-67.2	143.4	173.7	-72.9	179	-40.9	0	0	109.7	S261 S264 E265	Q36-S261 PolarHBondContact OE1-OG 3.39Å; Q36-S264 WeakPolarHBondContact O-CA 3.39Å; Q36-S264 VanDerWaalsContact O-CB 3.31Å; Q36-S264 WeakPolarHBondContact O-CB 3.42Å; Q36-E265 PolarHBondContact O-N 3.21Å
37	M	86.5	Confident	63.8	Low	5 Å²	5	66.4 Å²	66.4	3%	0.025	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	131.5	174.6	-173.8	169.6	-84	0	0	109.9	I39 E265 C267 F305 M330 R336 Y340	M37-I39 HydrophobicContact CG-CG1 3.95Å; M37-I39 HydrophobicContact SD-CG1 4.3Å; M37-E265 CarbonylContact C-O 3.56Å; M37-E265 VanDerWaalsContact CA-O 3.26Å; M37-E265 WeakPolarHBondContact CA-O 3.37Å; M37-E265 HydrophobicContact CE-CB 4.43Å; M37-E265 WeakPolarHBondContact CG-O 3.44Å; M37-C267 HydrophobicContact CG-CB 4.29Å; M37-C267 HydrophobicContact SD-CB 3.7Å; M37-F305 HydrophobicContact CE-CD2 3.8Å; M37-F305 HydrophobicContact CE-CE2 3.81Å; M37-F305 HydrophobicContact SD-CD2 4.49Å; M37-M330 HydrophobicContact CE-CE 4.2Å; M37-M330 HydrophobicContact SD-CE 3.52Å; M37-M330 VanDerWaalsContact SD-CE 3.52Å; M37-R336 HydrophobicContact CE-CG 4.24Å; M37-R336 WeakPolarHBondContact SD-CD 3.41Å; M37-R336 HydrophobicContact SD-CG 4.35Å; M37-Y340 HydrophobicContact CE-CE2 4.21Å; M37-Y340 VanDerWaalsContact CE-OH 3.3Å; M37-Y340 WeakPolarHBondContact CE-OH 3.44Å
38	F	91.1	Very high	65.3	Low	1 Å²	1	65.8 Å²	65.8	0%	0.004	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	124.6	168.5	-176.7	-100.5	0	0	0	108.4	E40 R76 V78 L256 L260 E265 A266 C267 S297 V299	F38-E40 HydrophobicContact CE1-CB 3.91Å; F38-E40 HydrophobicContact CE1-CG 4.35Å; F38-R76 HydrophobicContact CE2-CB 4.4Å; F38-R76 HydrophobicContact CZ-CB 4.15Å; F38-V78 HydrophobicContact CD2-CG2 3.88Å; F38-V78 HydrophobicContact CE2-CG2 4.41Å; F38-L256 HydrophobicContact CE2-CD2 3.89Å; F38-L256 HydrophobicContact CE2-CG 4.47Å; F38-L256 HydrophobicContact CZ-CD2 4.05Å; F38-L260 HydrophobicContact CB-CD1 4.23Å; F38-L260 HydrophobicContact CD2-CD1 4.01Å; F38-L260 HydrophobicContact CG-CD1 4.3Å; F38-E265 PolarHBondContact N-O 3.3Å; F38-A266 CarbonylContact O-C 3.5Å; F38-A266 WeakPolarHBondContact O-CA 3.43Å; F38-C267 PolarHBondContact O-N 3.25Å; F38-S297 VanDerWaalsContact CE1-OG 3.31Å; F38-S297 WeakPolarHBondContact CE1-OG 3.43Å; F38-V299 HydrophobicContact CD1-CB 4.3Å; F38-V299 HydrophobicContact CD1-CG2 3.93Å; F38-V299 HydrophobicContact CD2-CG2 4.15Å; F38-V299 HydrophobicContact CE1-CB 4.32Å; F38-V299 HydrophobicContact CE1-CG2 3.6Å; F38-V299 HydrophobicContact CE2-CG2 3.85Å; F38-V299 HydrophobicContact CG-CG2 4.2Å; F38-V299 HydrophobicContact CZ-CG2 3.56Å
39	I	93.1	Very high	65.9	Low	1 Å²	1	66 Å²	66	1%	0.005	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	131.7	-178.4	-55.5	155.3	0	0	0	107.7	M37 R76 W77 C267 V269 A327 M330 T331	M37-I39 HydrophobicContact CG-CG1 3.95Å; M37-I39 HydrophobicContact SD-CG1 4.3Å; I39-R76 CarbonylContact O-C 3.5Å; I39-R76 VanDerWaalsContact O-CA 3.29Å; I39-R76 WeakPolarHBondContact O-CA 3.31Å; I39-W77 HydrophobicContact CB-CB 4.19Å; I39-W77 HydrophobicContact CB-CE3 4.24Å; I39-W77 HydrophobicContact CD1-CB 4.43Å; I39-W77 HydrophobicContact CG2-CE3 3.96Å; I39-W77 PolarHBondContact N-O 2.92Å; I39-W77 PolarHBondContact O-N 3.36Å; I39-C267 VanDerWaalsContact CA-O 3.29Å; I39-C267 WeakPolarHBondContact CA-O 3.5Å; I39-C267 HydrophobicContact CG1-CB 4.19Å; I39-V269 HydrophobicContact CG2-CG2 4.18Å; I39-A327 HydrophobicContact CG2-CB 3.73Å; I39-M330 HydrophobicContact CD1-CB 3.62Å; I39-M330 HydrophobicContact CG1-CB 4.29Å; I39-T331 HydrophobicContact CD1-CG2 3.67Å
40	E	92.8	Very high	66.5	Low	0 Å²	0	60.3 Å²	60.3	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	135.7	-177.2	-164.6	-172.8	140.1	0	0	110	F38 Q42 E73 H161 C267 V269 S297 E298	F38-E40 HydrophobicContact CE1-CB 3.91Å; F38-E40 HydrophobicContact CE1-CG 4.35Å; E40-Q42 PolarHBondContact OE1-NE2 3.05Å; E40-E73 HydrophobicContact CG-CG 3.74Å; E40-E73 WeakPolarHBondContact OE1-CG 3.45Å; E40-H161 IonicContact OE1-CE1 2.87Å; E40-H161 PolarHBondContact OE1-CE1 2.95Å; E40-H161 IonicContact OE1-ND1 2.93Å; E40-H161 PolarHBondContact OE1-ND1 3.18Å; E40-H161 VanDerWaalsContact OE1-ND1 3.13Å; E40-H161 IonicContact OE2-CE1 3.85Å; E40-C267 PolarHBondContact N-O 3.35Å; E40-C267 VanDerWaalsContact N-O 3.08Å; E40-V269 PolarHBondContact O-N 3.31Å; E40-S297 WeakPolarHBondContact OE2-CA 3.4Å; E40-S297 VanDerWaalsContact OE2-CB 3.3Å; E40-S297 WeakPolarHBondContact OE2-CB 3.24Å; E40-S297 PolarHBondContact OE2-OG 2.81Å; E40-E298 PolarHBondContact OE2-N 2.92Å
41	L	94	Very high	66.9	Low	5 Å²	5	56.5 Å²	56.5	3%	0.026	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	122.8	175.7	178.1	65.9	0	0	0	110.2	E73 T74 A75 W77 V269 A323 R324	L41-E73 WeakPolarHBondContact O-CA 3.26Å; L41-T74 PolarHBondContact O-N 2.97Å; L41-A75 HydrophobicContact CB-CB 4.26Å; L41-A75 HydrophobicContact CD2-CB 4.34Å; L41-A75 PolarHBondContact N-O 3.23Å; L41-W77 HydrophobicContact CB-CH2 3.99Å; L41-W77 HydrophobicContact CB-CZ3 3.7Å; L41-W77 HydrophobicContact CD2-CH2 4.17Å; L41-V269 CarbonylContact C-O 3.58Å; L41-V269 WeakPolarHBondContact CA-O 3.27Å; L41-V269 HydrophobicContact CD1-CB 3.94Å; L41-V269 HydrophobicContact CD1-CG1 3.64Å; L41-A323 HydrophobicContact CD1-CB 3.63Å; L41-R324 HydrophobicContact CD2-CB 4.15Å; L41-R324 HydrophobicContact CD2-CG 4.46Å
42	Q	92.5	Very high	67.2	Low	0 Å²	0	60.5 Å²	60.5	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	132.2	177.7	-66.8	176.6	-7.1	0	0	110.9	E40 W71 L72 H161 V269 I270 C271 I296	E40-Q42 PolarHBondContact OE1-NE2 3.05Å; Q42-W71 HydrophobicContact CB-CB 4.37Å; Q42-L72 CarbonylContact C-O 3.52Å; Q42-L72 VanDerWaalsContact CA-O 3.26Å; Q42-L72 WeakPolarHBondContact CA-O 3.45Å; Q42-H161 PolarHBondContact NE2-CE1 3.35Å; Q42-H161 VanDerWaalsContact NE2-CE1 3.33Å; Q42-V269 PolarHBondContact N-O 3.12Å; Q42-I270 WeakPolarHBondContact O-CA 3.37Å; Q42-C271 PolarHBondContact O-N 3.42Å; Q42-I296 PolarHBondContact NE2-O 3.34Å
43	E	90.1	Very high	68	Low	72 Å²	72	61.9 Å²	61.9	34%	0.336	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	140	177	-168.8	169.8	176.4	0	0	111.6	V45 W71 L72 T74 C271	E43-V45 PolarHBondContact O-N 3.09Å; E43-W71 WeakPolarHBondContact O-CA 3.49Å; E43-L72 PolarHBondContact N-O 3.03Å; E43-L72 PolarHBondContact O-N 2.83Å; E43-T74 HydrophobicContact CB-CG2 3.69Å; E43-C271 CarbonylContact C-O 3.52Å; E43-C271 VanDerWaalsContact CA-O 3.27Å; E43-C271 WeakPolarHBondContact CA-O 3.37Å
44	L	88.9	Confident	68.6	Low	6 Å²	6	53.2 Å²	53.2	3%	0.031	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	116.4	176	-170.2	66.4	0	0	0	110.8	F54 V69 W71 I154 C271 I274	L44-F54 HydrophobicContact CD2-CE1 4.17Å; L44-F54 HydrophobicContact CD2-CZ 3.99Å; L44-F54 HydrophobicContact CG-CZ 4.1Å; L44-V69 HydrophobicContact CD1-CB 3.85Å; L44-V69 HydrophobicContact CD1-CG2 3.98Å; L44-V69 HydrophobicContact CG-CB 4.49Å; L44-W71 HydrophobicContact CB-CE3 3.93Å; L44-W71 HydrophobicContact CB-CH2 3.87Å; L44-W71 HydrophobicContact CB-CZ3 3.5Å; L44-W71 HydrophobicContact CD1-CD2 3.97Å; L44-W71 HydrophobicContact CD1-CE3 4.12Å; L44-W71 HydrophobicContact CD1-CH2 3.98Å; L44-W71 HydrophobicContact CD1-CZ2 3.81Å; L44-W71 HydrophobicContact CD1-CZ3 4.11Å; L44-W71 HydrophobicContact CD2-CH2 4.44Å; L44-W71 HydrophobicContact CG-CH2 4.31Å; L44-W71 HydrophobicContact CG-CZ3 4.34Å; L44-I154 HydrophobicContact CD1-CG2 3.9Å; L44-I154 HydrophobicContact CD2-CG2 3.85Å; L44-C271 PolarHBondContact N-O 3.4Å; L44-I274 HydrophobicContact CD2-CD1 4.24Å; L44-I274 HydrophobicContact CD2-CG1 3.8Å
45	V	80.3	Confident	68.7	Low	44 Å²	44	53.7 Å²	53.7	27%	0.267	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	139.3	-178.2	-176.3	0	0	0	0	110.5	E43 V69 L70 L72	E43-V45 PolarHBondContact O-N 3.09Å; V45-V69 WeakPolarHBondContact O-CA 3.37Å; V45-L70 HydrophobicContact CB-CD1 4.24Å; V45-L70 HydrophobicContact CB-CG 4.49Å; V45-L70 PolarHBondContact N-O 2.9Å; V45-L70 PolarHBondContact O-N 2.81Å; V45-L72 HydrophobicContact CG2-CB 3.81Å; V45-L72 HydrophobicContact CG2-CD2 3.96Å
46	P	71.3	Confident	68.2	Low	47 Å²	47	58 Å²	58	31%	0.305	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	144.3	173.3	29.3	-34.6	0	0	0	112.4	V48	P46-V48 VanDerWaalsContact C-N 3.33Å; P46-V48 PolarHBondContact O-N 3.3Å
47	R	65.7	Low	67.3	Low	59 Å²	59	58 Å²	58	22%	0.223	34%	0.337	C	S	.	.			trans	-87.2	11.6	-178.9	-154	175	-172.1	149.9	5.5	113.9	F67 R68 L70 E158	R47-F67 VanDerWaalsContact CD-O 3.31Å; R47-F67 WeakPolarHBondContact CD-O 3.49Å; R47-R68 WeakPolarHBondContact CB-O 3.43Å; R47-R68 PolarHBondContact N-O 3.46Å; R47-L70 HydrophobicContact CG-CD2 4.27Å; R47-E158 IonicContact CZ-OE2 2.94Å; R47-E158 VanDerWaalsContact CZ-OE2 3.29Å; R47-E158 IonicContact NH1-OE2 2.74Å; R47-E158 PolarHBondContact NH1-OE2 3.26Å; R47-E158 IonicContact NH2-OE2 2.95Å; R47-E158 PolarHBondContact NH2-OE2 3.16Å
48	V	53.6	Low	66	Low	89 Å²	89	58.1 Å²	58.1	54%	0.539	34%	0.338	S	S	.	.	S	Bend	trans	-106.8	139.7	-168.9	-171.7	0	0	0	0	112.4	P46 G50	P46-V48 VanDerWaalsContact C-N 3.33Å; P46-V48 PolarHBondContact O-N 3.3Å; V48-G50 PolarHBondContact O-N 3.38Å
49	D	41.1	Very low	64.6	Low	129 Å²	129	59.1 Å²	59.1	69%	0.69	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	130.5	174.6	-82.6	-44.8	0	0	0	113.2	A191	D49-A191 WeakPolarHBondContact OD1-CB 3.5Å; D49-A191 WeakPolarHBondContact OD2-CB 3.4Å
50	G	37.9	Very low	63.1	Low	74 Å²	74	66.9 Å²	66.9	76%	0.763	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	118.7	-0.8	161.9	0	0	0	0	0	117.1	V48 L52	V48-G50 PolarHBondContact O-N 3.38Å; G50-L52 PolarHBondContact O-N 3.02Å
51	G	34.5	Very low	61.8	Low	67 Å²	67	72.5 Å²	72.5	69%	0.691	40%	0.403	S	S	*	.			trans	42.2	71.9	166	0	0	0	0	0	114.3
52	L	35	Very low	60.2	Low	152 Å²	152	73.7 Å²	73.7	80%	0.796	41%	0.411	S	S	*	.			trans	179.4	126.5	159.5	-99.8	140	0	0	0	108.1	G50	G50-L52 PolarHBondContact O-N 3.02Å
53	Q	47.3	Very low	58.9	Low	134 Å²	134	74.6 Å²	74.6	63%	0.626	42%	0.417	S	S	*	.			trans	73.9	121.2	165	-58.6	177.8	-14.2	0	0	116.6	N55	Q53-N55 PolarHBondContact O-N 2.68Å
54	F	53.3	Low	57.8	Low	23 Å²	23	71.7 Å²	71.7	10%	0.101	41%	0.405	C	S	.	.			trans	-55.1	112.3	158.1	-80.9	-88.8	0	0	0	106	L44 I58 F59 V69 L273 E275	L44-F54 HydrophobicContact CD2-CE1 4.17Å; L44-F54 HydrophobicContact CD2-CZ 3.99Å; L44-F54 HydrophobicContact CG-CZ 4.1Å; F54-I58 HydrophobicContact CD1-CD1 4.5Å; F54-F59 HydrophobicContact CB-CE2 4.29Å; F54-F59 HydrophobicContact CD1-CE1 4.41Å; F54-F59 AromaticContact CD1-CE2 3.79Å; F54-F59 HydrophobicContact CD1-CE2 3.79Å; F54-F59 AromaticContact CD1-CZ 3.37Å; F54-F59 HydrophobicContact CD1-CZ 3.37Å; F54-F59 AromaticContact CE1-CZ 3.77Å; F54-F59 HydrophobicContact CE1-CZ 3.77Å; F54-F59 HydrophobicContact CG-CE2 4.41Å; F54-F59 HydrophobicContact CG-CZ 4.32Å; F54-V69 HydrophobicContact CE1-CG1 4.38Å; F54-L273 HydrophobicContact CD2-CB 4.11Å; F54-L273 HydrophobicContact CE2-CB 3.87Å; F54-L273 WeakPolarHBondContact CE2-O 3.49Å; F54-L273 VanDerWaalsContact CZ-O 3.22Å; F54-L273 WeakPolarHBondContact CZ-O 3.41Å; F54-E275 HydrophobicContact CB-CG 4.05Å; F54-E275 VanDerWaalsContact O-CD 3.26Å; F54-E275 VanDerWaalsContact O-OE2 3.13Å
55	N	53.5	Low	56.7	Low	99 Å²	99	71.4 Å²	71.4	53%	0.529	40%	0.404	S	S	.	.			trans	-88.1	132.4	171.4	-91.6	-37.8	0	0	0	107.3	Q53 S57 I58	Q53-N55 PolarHBondContact O-N 2.68Å; N55-S57 PolarHBondContact O-N 3.23Å; N55-I58 WeakPolarHBondContact O-CB 3.5Å; N55-I58 WeakPolarHBondContact O-CG1 3.38Å; N55-I58 PolarHBondContact O-N 3.05Å
56	E	55.3	Low	56.2	Low	154 Å²	154	69.9 Å²	69.9	72%	0.72	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-44.7	-26.6	178	-71.3	-171.9	157.8	0	0	113.9	I58 F59	E56-I58 PolarHBondContact O-N 3.04Å; E56-F59 PolarHBondContact O-N 2.92Å
57	S	56.4	Low	55.9	Low	56 Å²	56	68.4 Å²	68.4	39%	0.392	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-57.7	-24.2	174.4	74.4	0	0	0	0	115.5	N55 F59	N55-S57 PolarHBondContact O-N 3.23Å; S57-F59 VanDerWaalsContact C-N 3.3Å; S57-F59 PolarHBondContact O-N 3.49Å
58	I	57.9	Low	56.1	Low	9 Å²	9	69.9 Å²	69.9	5%	0.046	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-68.3	-33.1	-178.4	-64.6	172	0	0	0	110.8	F54 N55 E56 R68 V69	F54-I58 HydrophobicContact CD1-CD1 4.5Å; N55-I58 WeakPolarHBondContact O-CB 3.5Å; N55-I58 WeakPolarHBondContact O-CG1 3.38Å; N55-I58 PolarHBondContact O-N 3.05Å; E56-I58 PolarHBondContact O-N 3.04Å; I58-R68 HydrophobicContact CG2-CB 3.96Å; I58-V69 HydrophobicContact CG2-CG1 4.15Å
59	F	62.9	Low	57.2	Low	21 Å²	21	65.7 Å²	65.7	9%	0.092	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-96.3	9	-169.9	-57.2	-61.4	0	0	0	114.5	F54 E56 S57 V150 I154 I274 E275 F276	F54-F59 HydrophobicContact CB-CE2 4.29Å; F54-F59 HydrophobicContact CD1-CE1 4.41Å; F54-F59 AromaticContact CD1-CE2 3.79Å; F54-F59 HydrophobicContact CD1-CE2 3.79Å; F54-F59 AromaticContact CD1-CZ 3.37Å; F54-F59 HydrophobicContact CD1-CZ 3.37Å; F54-F59 AromaticContact CE1-CZ 3.77Å; F54-F59 HydrophobicContact CE1-CZ 3.77Å; F54-F59 HydrophobicContact CG-CE2 4.41Å; F54-F59 HydrophobicContact CG-CZ 4.32Å; E56-F59 PolarHBondContact O-N 2.92Å; S57-F59 VanDerWaalsContact C-N 3.3Å; S57-F59 PolarHBondContact O-N 3.49Å; F59-V150 HydrophobicContact CB-CG1 4.23Å; F59-V150 HydrophobicContact CD1-CG1 4.14Å; F59-V150 WeakPolarHBondContact O-CG2 3.3Å; F59-I154 HydrophobicContact CD1-CD1 3.73Å; F59-I154 HydrophobicContact CE1-CD1 3.54Å; F59-I154 HydrophobicContact CE1-CG1 4.46Å; F59-I274 HydrophobicContact CE1-CG2 4.32Å; F59-I274 HydrophobicContact CZ-CG2 4.29Å; F59-E275 HydrophobicContact CE2-CB 4.43Å; F59-F276 HydrophobicContact CB-CD1 3.73Å; F59-F276 HydrophobicContact CB-CE1 4.09Å; F59-F276 AromaticContact CD1-CD1 3.86Å; F59-F276 HydrophobicContact CD1-CD1 3.86Å; F59-F276 AromaticContact CD1-CE1 3.59Å; F59-F276 HydrophobicContact CD1-CE1 3.59Å; F59-F276 AromaticContact CD2-CD1 3.97Å; F59-F276 HydrophobicContact CD2-CD1 3.97Å; F59-F276 HydrophobicContact CE1-CD1 4.41Å; F59-F276 HydrophobicContact CE1-CE1 4.07Å; F59-F276 AromaticContact CG-CD1 3.58Å; F59-F276 HydrophobicContact CG-CD1 3.58Å; F59-F276 AromaticContact CG-CE1 3.83Å; F59-F276 HydrophobicContact CG-CE1 3.83Å
60	K	61.9	Low	59.1	Low	165 Å²	165	61.1 Å²	61.1	72%	0.717	34%	0.338	S	S	*	.	S	Bend	trans	-73.2	-25.7	-175.7	-71.1	-172.3	176.2	-175.5	0	114.8
61	M	63.6	Low	61.4	Low	118 Å²	118	57.6 Å²	57.6	58%	0.581	30%	0.302	S	S	*	.	S	Bend	trans	-139.7	135	-179.4	-66.7	-177.4	76	0	0	110.2	V63 A64 A65	M61-V63 VanDerWaalsContact C-N 3.29Å; M61-V63 PolarHBondContact O-N 2.86Å; M61-A64 HydrophobicContact CB-CB 4.06Å; M61-A64 PolarHBondContact O-N 3.5Å; M61-A65 PolarHBondContact O-N 3.36Å
62	P	60.4	Low	63.9	Low	30 Å²	30	55.1 Å²	55.1	20%	0.195	27%	0.273	C	S	.	.	H	α-helix	trans	-54	-43.9	-178.1	-27.7	33.7	0	0	0	113.4	A65 H66 D149 V150 A153 L235	P62-A65 PolarHBondContact O-N 2.94Å; P62-H66 PolarHBondContact O-N 3.23Å; P62-D149 HydrophobicContact CB-CB 4.07Å; P62-D149 HydrophobicContact CG-CB 3.57Å; P62-V150 HydrophobicContact CB-CG2 4.39Å; P62-V150 HydrophobicContact CG-CG2 3.93Å; P62-A153 HydrophobicContact CB-CB 4.23Å; P62-A153 WeakPolarHBondContact O-CB 3.24Å; P62-L235 HydrophobicContact CB-CD1 3.69Å; P62-L235 HydrophobicContact CB-CD2 3.73Å; P62-L235 HydrophobicContact CB-CG 4.3Å; P62-L235 HydrophobicContact CG-CD2 4.47Å
63	V	65.6	Low	66.4	Low	18 Å²	18	47.9 Å²	47.9	11%	0.109	24%	0.235	C	C	.	.	H	α-helix	trans	-65.8	-42.6	179.9	-177.4	0	0	0	0	111	M61 A65 H66 F67 P183 L235	M61-V63 VanDerWaalsContact C-N 3.29Å; M61-V63 PolarHBondContact O-N 2.86Å; V63-A65 VanDerWaalsContact C-N 3.35Å; V63-A65 PolarHBondContact O-N 3.07Å; V63-H66 PolarHBondContact O-N 2.82Å; V63-F67 HydrophobicContact CG1-CD2 3.93Å; V63-F67 HydrophobicContact CG1-CE2 3.69Å; V63-F67 WeakPolarHBondContact O-CD2 3.28Å; V63-F67 PolarHBondContact O-N 3.44Å; V63-P183 HydrophobicContact CG1-CG 4.31Å; V63-L235 HydrophobicContact CG2-CB 4.17Å; V63-L235 HydrophobicContact CG2-CD1 4Å
64	A	66.6	Low	68.4	Low	12 Å²	12	42.9 Å²	42.9	10%	0.099	21%	0.213	C	C	.	.	H	α-helix	trans	-66	-39.2	178.1	0	0	0	0	0	111.7	M61 F67 R68	M61-A64 HydrophobicContact CB-CB 4.06Å; M61-A64 PolarHBondContact O-N 3.5Å; A64-F67 PolarHBondContact O-N 2.98Å; A64-R68 VanDerWaalsContact O-CB 3.25Å; A64-R68 WeakPolarHBondContact O-CB 3.46Å; A64-R68 WeakPolarHBondContact O-CG 3.34Å; A64-R68 PolarHBondContact O-N 3.43Å; A64-R68 VanDerWaalsContact O-N 3.11Å
65	A	67.5	Low	70.2	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-61.7	-46.4	176.8	0	0	0	0	0	111.4	M61 P62 V63 F67 R68 V69 V150 I154	M61-A65 PolarHBondContact O-N 3.36Å; P62-A65 PolarHBondContact O-N 2.94Å; V63-A65 VanDerWaalsContact C-N 3.35Å; V63-A65 PolarHBondContact O-N 3.07Å; A65-F67 VanDerWaalsContact C-N 3.32Å; A65-F67 PolarHBondContact O-N 3.19Å; A65-R68 PolarHBondContact O-N 3.44Å; A65-V69 WeakPolarHBondContact O-CG2 3.41Å; A65-V69 PolarHBondContact O-N 2.92Å; A65-V150 HydrophobicContact CB-CG1 3.86Å; A65-I154 HydrophobicContact CB-CG1 4.15Å
66	H	68.9	Low	72	Confident	12 Å²	12	37.9 Å²	37.9	6%	0.056	19%	0.186	C	C	.	.	H	α-helix	trans	-55	-42.7	178.3	-174.4	71.6	0	0	0	113.4	P62 V63 A153 F156 H242	P62-H66 PolarHBondContact O-N 3.23Å; V63-H66 PolarHBondContact O-N 2.82Å; H66-A153 HydrophobicContact CB-CB 4.12Å; H66-A153 PolarHBondContact ND1-O 3.47Å; H66-F156 PolarHBondContact CE1-O 3.08Å; H66-F156 VanDerWaalsContact CE1-O 3.23Å; H66-H242 AromaticContact CE1-NE2 3.53Å; H66-H242 AromaticContact NE2-NE2 3.94Å
67	F	66	Low	73.7	Confident	15 Å²	15	30.6 Å²	30.6	7%	0.066	15%	0.152	C	C	.	.	H	α-helix	trans	-86.4	-16.9	-176.1	-69.2	-65.4	0	0	0	114.2	R47 V63 A64 A65 W178 L182	R47-F67 VanDerWaalsContact CD-O 3.31Å; R47-F67 WeakPolarHBondContact CD-O 3.49Å; V63-F67 HydrophobicContact CG1-CD2 3.93Å; V63-F67 HydrophobicContact CG1-CE2 3.69Å; V63-F67 WeakPolarHBondContact O-CD2 3.28Å; V63-F67 PolarHBondContact O-N 3.44Å; A64-F67 PolarHBondContact O-N 2.98Å; A65-F67 VanDerWaalsContact C-N 3.32Å; A65-F67 PolarHBondContact O-N 3.19Å; F67-W178 HydrophobicContact CE1-CD2 4.16Å; F67-W178 HydrophobicContact CE1-CE3 4.11Å; F67-W178 HydrophobicContact CE1-CH2 4.28Å; F67-W178 HydrophobicContact CE1-CZ2 4.31Å; F67-W178 HydrophobicContact CE1-CZ3 4.18Å; F67-W178 HydrophobicContact CZ-CD2 4.49Å; F67-W178 HydrophobicContact CZ-CE3 4Å; F67-W178 HydrophobicContact CZ-CH2 4.43Å; F67-W178 AromaticContact CZ-CZ3 3.98Å; F67-W178 HydrophobicContact CZ-CZ3 3.98Å; F67-L182 HydrophobicContact CD2-CD2 3.86Å; F67-L182 HydrophobicContact CE1-CD2 4.35Å; F67-L182 HydrophobicContact CE2-CD2 3.62Å; F67-L182 HydrophobicContact CG-CD2 4.36Å; F67-L182 HydrophobicContact CZ-CD2 3.89Å
68	R	69.3	Low	75	Confident	91 Å²	91	30 Å²	30	34%	0.343	15%	0.147	S	C	.	.	H	α-helix	trans	-97	-4.7	-176.3	-73.9	-180	176.5	-168.1	-0.6	114.3	R47 I58 A64 A65	R47-R68 WeakPolarHBondContact CB-O 3.43Å; R47-R68 PolarHBondContact N-O 3.46Å; I58-R68 HydrophobicContact CG2-CB 3.96Å; A64-R68 VanDerWaalsContact O-CB 3.25Å; A64-R68 WeakPolarHBondContact O-CB 3.46Å; A64-R68 WeakPolarHBondContact O-CG 3.34Å; A64-R68 PolarHBondContact O-N 3.43Å; A64-R68 VanDerWaalsContact O-N 3.11Å; A65-R68 PolarHBondContact O-N 3.44Å
69	V	75.5	Confident	75.8	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	155.3	177.9	-57	0	0	0	0	110.3	L44 V45 F54 I58 A65 I154 A157	L44-V69 HydrophobicContact CD1-CB 3.85Å; L44-V69 HydrophobicContact CD1-CG2 3.98Å; L44-V69 HydrophobicContact CG-CB 4.49Å; V45-V69 WeakPolarHBondContact O-CA 3.37Å; F54-V69 HydrophobicContact CE1-CG1 4.38Å; I58-V69 HydrophobicContact CG2-CG1 4.15Å; A65-V69 WeakPolarHBondContact O-CG2 3.41Å; A65-V69 PolarHBondContact O-N 2.92Å; V69-I154 HydrophobicContact CG2-CG1 4.33Å; V69-I154 HydrophobicContact CG2-CG2 4.28Å; V69-A157 HydrophobicContact CG2-CB 3.65Å
70	L	82.1	Confident	76.7	Confident	33 Å²	33	34.9 Å²	34.9	17%	0.173	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	155.3	173.3	67.1	88.1	0	0	0	110	V45 R47 L72 E158 W160	V45-L70 HydrophobicContact CB-CD1 4.24Å; V45-L70 HydrophobicContact CB-CG 4.49Å; V45-L70 PolarHBondContact N-O 2.9Å; V45-L70 PolarHBondContact O-N 2.81Å; R47-L70 HydrophobicContact CG-CD2 4.27Å; L70-L72 HydrophobicContact CD1-CB 3.82Å; L70-E158 WeakPolarHBondContact CA-O 3.49Å; L70-W160 HydrophobicContact CD1-CB 4.18Å
71	W	86.3	Confident	77.8	Confident	1 Å²	1	27 Å²	27	0%	0.004	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	110.4	172	-67.3	103.8	0	0	0	109.1	Q42 E43 L44 I154 E158 R159 W160 I270 C271 I310	Q42-W71 HydrophobicContact CB-CB 4.37Å; E43-W71 WeakPolarHBondContact O-CA 3.49Å; L44-W71 HydrophobicContact CB-CE3 3.93Å; L44-W71 HydrophobicContact CB-CH2 3.87Å; L44-W71 HydrophobicContact CB-CZ3 3.5Å; L44-W71 HydrophobicContact CD1-CD2 3.97Å; L44-W71 HydrophobicContact CD1-CE3 4.12Å; L44-W71 HydrophobicContact CD1-CH2 3.98Å; L44-W71 HydrophobicContact CD1-CZ2 3.81Å; L44-W71 HydrophobicContact CD1-CZ3 4.11Å; L44-W71 HydrophobicContact CD2-CH2 4.44Å; L44-W71 HydrophobicContact CG-CH2 4.31Å; L44-W71 HydrophobicContact CG-CZ3 4.34Å; W71-I154 HydrophobicContact CZ2-CG2 4.17Å; W71-I154 PolarHBondContact NE1-O 2.82Å; W71-E158 PolarHBondContact N-O 3.35Å; W71-R159 HydrophobicContact CB-CG 3.74Å; W71-R159 HydrophobicContact CG-CG 4.34Å; W71-R159 CarbonylContact O-C 3.58Å; W71-R159 WeakPolarHBondContact O-CA 3.31Å; W71-W160 PolarHBondContact O-N 2.85Å; W71-I270 HydrophobicContact CD2-CG2 3.92Å; W71-I270 HydrophobicContact CE3-CG2 3.38Å; W71-I270 HydrophobicContact CH2-CG2 3.21Å; W71-I270 HydrophobicContact CZ2-CG2 3.77Å; W71-I270 HydrophobicContact CZ3-CB 4.41Å; W71-I270 HydrophobicContact CZ3-CG2 2.99Å; W71-C271 WeakPolarHBondContact CZ3-O 3.31Å; W71-I310 HydrophobicContact CH2-CG2 4.03Å
72	L	85.9	Confident	79	Confident	15 Å²	15	24 Å²	24	8%	0.079	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	124.4	-178.5	172.1	58.1	0	0	0	109.9	Q42 E43 V45 L70 T74 W160	Q42-L72 CarbonylContact C-O 3.52Å; Q42-L72 VanDerWaalsContact CA-O 3.26Å; Q42-L72 WeakPolarHBondContact CA-O 3.45Å; E43-L72 PolarHBondContact N-O 3.03Å; E43-L72 PolarHBondContact O-N 2.83Å; V45-L72 HydrophobicContact CG2-CB 3.81Å; V45-L72 HydrophobicContact CG2-CD2 3.96Å; L70-L72 HydrophobicContact CD1-CB 3.82Å; L72-T74 HydrophobicContact CG-CG2 4.31Å; L72-T74 PolarHBondContact O-N 3.07Å; L72-W160 HydrophobicContact CD1-CD2 4.24Å; L72-W160 HydrophobicContact CD1-CE3 3.14Å; L72-W160 HydrophobicContact CD1-CZ3 3.4Å; L72-W160 VanDerWaalsContact CD1-CZ3 3.4Å
73	E	88	Confident	80.4	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	114.9	169.1	-174.7	-179.7	174.6	0	0	110.7	E40 L41 R76 F91 W160 H161	E40-E73 HydrophobicContact CG-CG 3.74Å; E40-E73 WeakPolarHBondContact OE1-CG 3.45Å; L41-E73 WeakPolarHBondContact O-CA 3.26Å; E73-R76 WeakPolarHBondContact OE1-CD 3.37Å; E73-F91 HydrophobicContact CG-CZ 4Å; E73-F91 WeakPolarHBondContact OE1-CZ 3.26Å; E73-W160 PolarHBondContact N-O 3.07Å; E73-H161 IonicContact OE2-CG 3.97Å; E73-H161 IonicContact OE2-ND1 3.15Å; E73-H161 PolarHBondContact OE2-ND1 3.16Å
74	T	88.9	Confident	81.4	Confident	29 Å²	29	24.7 Å²	24.7	18%	0.178	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	-28.9	-177.9	61.4	0	0	0	0	113.1	L41 E43 L72 F84	L41-T74 PolarHBondContact O-N 2.97Å; E43-T74 HydrophobicContact CB-CG2 3.69Å; L72-T74 HydrophobicContact CG-CG2 4.31Å; L72-T74 PolarHBondContact O-N 3.07Å; T74-F84 PolarHBondContact O-N 3.48Å
75	A	91.7	Very high	82.1	Confident	1 Å²	1	26.5 Å²	26.5	1%	0.008	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	153.6	-179	0	0	0	0	0	111.8	L41 W77 E82 N83	L41-A75 HydrophobicContact CB-CB 4.26Å; L41-A75 HydrophobicContact CD2-CB 4.34Å; L41-A75 PolarHBondContact N-O 3.23Å; A75-W77 HydrophobicContact CB-CH2 3.4Å; A75-W77 VanDerWaalsContact CB-CH2 3.4Å; A75-W77 HydrophobicContact CB-CZ2 4.05Å; A75-W77 HydrophobicContact CB-CZ3 3.81Å; A75-E82 CarbonylContact C-O 3.53Å; A75-E82 VanDerWaalsContact CA-O 3.28Å; A75-E82 WeakPolarHBondContact CA-O 3.36Å; A75-N83 VanDerWaalsContact CB-OD1 3.24Å; A75-N83 WeakPolarHBondContact CB-OD1 3.25Å
76	R	91.6	Very high	82.4	Confident	15 Å²	15	32 Å²	32	6%	0.057	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	154.2	177.2	65.4	-173.3	-172.2	-164.8	-6	112.2	F38 I39 E73 E82 F91 E163 E298	F38-R76 HydrophobicContact CE2-CB 4.4Å; F38-R76 HydrophobicContact CZ-CB 4.15Å; I39-R76 CarbonylContact O-C 3.5Å; I39-R76 VanDerWaalsContact O-CA 3.29Å; I39-R76 WeakPolarHBondContact O-CA 3.31Å; E73-R76 WeakPolarHBondContact OE1-CD 3.37Å; R76-E82 HydrophobicContact CG-CB 4.01Å; R76-E82 IonicContact CZ-OE2 3.39Å; R76-E82 VanDerWaalsContact CZ-OE2 3.32Å; R76-E82 PolarHBondContact N-O 2.75Å; R76-E82 IonicContact NE-OE2 3.88Å; R76-E82 PolarHBondContact NE-OE2 3.36Å; R76-E82 IonicContact NH2-OE2 2.96Å; R76-E82 PolarHBondContact NH2-OE2 3.26Å; R76-E82 PolarHBondContact O-N 3.46Å; R76-F91 HydrophobicContact CG-CD1 4.19Å; R76-F91 HydrophobicContact CG-CE1 3.94Å; R76-F91 HydrophobicContact CG-CZ 4.48Å; R76-E163 IonicContact CZ-OE2 2.72Å; R76-E163 IonicContact NH1-OE2 3.72Å; R76-E163 PolarHBondContact NH1-OE2 2.91Å; R76-E163 IonicContact NH2-OE1 2.59Å; R76-E163 IonicContact NH2-OE2 3.39Å; R76-E163 PolarHBondContact NH2-OE2 3.5Å; R76-E163 VanDerWaalsContact NH2-OE2 3.15Å; R76-E298 IonicContact NH1-OE2 3.85Å; R76-E298 PolarHBondContact NH1-OE2 3.26Å
77	W	91	Very high	82.4	Confident	2 Å²	2	37.9 Å²	37.9	1%	0.008	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	138.9	177.6	-55.6	-106.2	0	0	0	111.5	I39 L41 A75 F80 E81 R324 A327 V328 T331	I39-W77 HydrophobicContact CB-CB 4.19Å; I39-W77 HydrophobicContact CB-CE3 4.24Å; I39-W77 HydrophobicContact CD1-CB 4.43Å; I39-W77 HydrophobicContact CG2-CE3 3.96Å; I39-W77 PolarHBondContact N-O 2.92Å; I39-W77 PolarHBondContact O-N 3.36Å; L41-W77 HydrophobicContact CB-CH2 3.99Å; L41-W77 HydrophobicContact CB-CZ3 3.7Å; L41-W77 HydrophobicContact CD2-CH2 4.17Å; A75-W77 HydrophobicContact CB-CH2 3.4Å; A75-W77 VanDerWaalsContact CB-CH2 3.4Å; A75-W77 HydrophobicContact CB-CZ2 4.05Å; A75-W77 HydrophobicContact CB-CZ3 3.81Å; W77-F80 WeakPolarHBondContact CA-O 3.26Å; W77-E81 VanDerWaalsContact CD1-CA 3.46Å; W77-E81 HydrophobicContact CZ2-CG 3.8Å; W77-E81 VanDerWaalsContact NE1-CB 3.26Å; W77-R324 HydrophobicContact CH2-CG 3.99Å; W77-R324 HydrophobicContact CZ2-CG 3.8Å; W77-A327 HydrophobicContact CD2-CB 4.36Å; W77-A327 HydrophobicContact CE3-CB 3.84Å; W77-A327 HydrophobicContact CH2-CB 3.72Å; W77-A327 HydrophobicContact CZ2-CB 4.22Å; W77-A327 HydrophobicContact CZ3-CB 3.52Å; W77-V328 HydrophobicContact CZ2-CG2 3.96Å; W77-T331 HydrophobicContact CB-CG2 3.69Å; W77-T331 HydrophobicContact CG-CG2 3.88Å
78	V	82.4	Confident	82.7	Confident	44 Å²	44	41.8 Å²	41.8	27%	0.267	21%	0.209	S	C	.	.	S	Bend	trans	-111.4	-40.8	157.7	179.2	0	0	0	0	109.9	F38 L260	F38-V78 HydrophobicContact CD2-CG2 3.88Å; F38-V78 HydrophobicContact CE2-CG2 4.41Å; V78-L260 HydrophobicContact CG1-CD2 3.84Å; V78-L260 HydrophobicContact CG2-CD2 3.79Å
79	N	76.3	Confident	82.8	Confident	49 Å²	49	41.8 Å²	41.8	26%	0.262	21%	0.213	S	C	.	.	S	Bend	trans	-147.3	-35.3	171.3	-72.2	-30.5	0	0	0	110	T5	T5-N79 WeakPolarHBondContact CG2-O 3.48Å
80	F	80.5	Confident	83.1	Confident	82 Å²	82	48.6 Å²	48.6	36%	0.36	24%	0.239	S	C	.	.	S	Bend	trans	-115.1	156	179.7	-61.7	-70.6	0	0	0	110	W77 A94 H95 V96	W77-F80 WeakPolarHBondContact CA-O 3.26Å; F80-A94 HydrophobicContact CB-CB 3.95Å; F80-H95 WeakPolarHBondContact CB-O 3.43Å; F80-V96 HydrophobicContact CD1-CG2 3.97Å; F80-V96 HydrophobicContact CE1-CG2 3.89Å
81	E	86.2	Confident	83.1	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	132	178.8	-173	175.1	-178.8	0	0	110.4	W77 N83 A94 H95 P97 R324	W77-E81 VanDerWaalsContact CD1-CA 3.46Å; W77-E81 HydrophobicContact CZ2-CG 3.8Å; W77-E81 VanDerWaalsContact NE1-CB 3.26Å; E81-N83 PolarHBondContact OE1-ND2 2.87Å; E81-N83 PolarHBondContact OE1-OD1 3.02Å; E81-A94 WeakPolarHBondContact O-CA 3.21Å; E81-H95 PolarHBondContact N-O 3.11Å; E81-H95 PolarHBondContact O-CE1 3.43Å; E81-H95 PolarHBondContact O-N 3.1Å; E81-H95 PolarHBondContact O-ND1 3.35Å; E81-H95 IonicContact OE2-NE2 3.82Å; E81-P97 HydrophobicContact CB-CB 4.09Å; E81-P97 HydrophobicContact CB-CG 4.47Å; E81-P97 WeakPolarHBondContact OE2-CA 3.13Å; E81-P97 WeakPolarHBondContact OE2-CB 3.47Å; E81-R324 WeakPolarHBondContact OE1-CD 3.45Å; E81-R324 IonicContact OE1-CZ 3.93Å; E81-R324 IonicContact OE1-NE 3.55Å; E81-R324 IonicContact OE1-NH1 3.61Å; E81-R324 PolarHBondContact OE1-NH1 2.83Å; E81-R324 IonicContact OE2-CZ 3.29Å; E81-R324 IonicContact OE2-NH1 2.88Å; E81-R324 PolarHBondContact OE2-NH1 3.39Å
82	E	89.1	Confident	83.1	Confident	54 Å²	54	50 Å²	50	25%	0.252	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	120	164.5	-67.5	-175.4	163.7	0	0	107.9	A75 R76 F91 A94	A75-E82 CarbonylContact C-O 3.53Å; A75-E82 VanDerWaalsContact CA-O 3.28Å; A75-E82 WeakPolarHBondContact CA-O 3.36Å; R76-E82 HydrophobicContact CG-CB 4.01Å; R76-E82 IonicContact CZ-OE2 3.39Å; R76-E82 VanDerWaalsContact CZ-OE2 3.32Å; R76-E82 PolarHBondContact N-O 2.75Å; R76-E82 IonicContact NE-OE2 3.88Å; R76-E82 PolarHBondContact NE-OE2 3.36Å; R76-E82 IonicContact NH2-OE2 2.96Å; R76-E82 PolarHBondContact NH2-OE2 3.26Å; R76-E82 PolarHBondContact O-N 3.46Å; E82-F91 HydrophobicContact CB-CB 4.26Å; E82-F91 HydrophobicContact CB-CD1 4.07Å; E82-A94 HydrophobicContact CG-CB 4.07Å
83	N	88.5	Confident	82.8	Confident	42 Å²	42	57.8 Å²	57.8	23%	0.225	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	137.7	179.5	-74.3	-43.1	0	0	0	110.1	A75 E81 N85 F91 T92 H95	A75-N83 VanDerWaalsContact CB-OD1 3.24Å; A75-N83 WeakPolarHBondContact CB-OD1 3.25Å; E81-N83 PolarHBondContact OE1-ND2 2.87Å; E81-N83 PolarHBondContact OE1-OD1 3.02Å; N83-N85 PolarHBondContact O-N 3.4Å; N83-F91 CarbonylContact O-C 3.57Å; N83-F91 WeakPolarHBondContact O-CA 3.33Å; N83-T92 HydrophobicContact CB-CG2 4.33Å; N83-T92 PolarHBondContact N-OG1 3.07Å; N83-T92 WeakPolarHBondContact O-CG2 3.35Å; N83-T92 PolarHBondContact O-N 3.43Å; N83-T92 PolarHBondContact O-OG1 3.04Å; N83-H95 PolarHBondContact ND2-CE1 2.95Å
84	F	87.3	Confident	82.4	Confident	22 Å²	22	60.4 Å²	60.4	10%	0.096	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	118.6	174.5	-176.4	-114.6	0	0	0	109.8	T74 E86 F91 W160 P162	T74-F84 PolarHBondContact O-N 3.48Å; F84-E86 HydrophobicContact CD1-CG 4.12Å; F84-E86 HydrophobicContact CE1-CG 4.1Å; F84-E86 PolarHBondContact O-N 3.27Å; F84-F91 HydrophobicContact CB-CD1 4.11Å; F84-F91 HydrophobicContact CB-CE1 3.79Å; F84-F91 HydrophobicContact CB-CZ 4.13Å; F84-F91 HydrophobicContact CD2-CD2 4.24Å; F84-F91 HydrophobicContact CD2-CE2 4.14Å; F84-F91 HydrophobicContact CD2-CZ 4.31Å; F84-W160 HydrophobicContact CE1-CH2 4.12Å; F84-W160 AromaticContact CE1-CZ3 3.8Å; F84-W160 HydrophobicContact CE1-CZ3 3.8Å; F84-W160 AromaticContact CZ-CH2 3.83Å; F84-W160 HydrophobicContact CZ-CH2 3.83Å; F84-W160 AromaticContact CZ-CZ3 3.87Å; F84-W160 HydrophobicContact CZ-CZ3 3.87Å; F84-P162 HydrophobicContact CD1-CG 4.22Å; F84-P162 HydrophobicContact CD2-CB 3.83Å; F84-P162 HydrophobicContact CD2-CG 3.32Å; F84-P162 HydrophobicContact CE1-CB 4.5Å; F84-P162 HydrophobicContact CE1-CG 4.14Å; F84-P162 HydrophobicContact CE2-CB 3.21Å; F84-P162 HydrophobicContact CE2-CG 3.25Å; F84-P162 HydrophobicContact CG-CG 3.84Å; F84-P162 HydrophobicContact CZ-CB 3.61Å; F84-P162 HydrophobicContact CZ-CG 3.68Å
85	N	81.3	Confident	81.8	Confident	50 Å²	50	62.2 Å²	62.2	27%	0.267	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	102.3	174.1	-174.8	-17.4	0	0	0	109.2	N83 V87 E88 Q89 R90	N83-N85 PolarHBondContact O-N 3.4Å; N85-V87 PolarHBondContact O-N 3.42Å; N85-V87 VanDerWaalsContact O-N 3.15Å; N85-V87 WeakPolarHBondContact OD1-CB 3.21Å; N85-V87 PolarHBondContact OD1-N 3.39Å; N85-E88 HydrophobicContact CB-CB 4.24Å; N85-E88 WeakPolarHBondContact ND2-CG 3.16Å; N85-E88 PolarHBondContact ND2-OE2 3.28Å; N85-E88 PolarHBondContact O-N 3.1Å; N85-E88 VanDerWaalsContact O-N 3.15Å; N85-E88 PolarHBondContact OD1-N 3.14Å; N85-Q89 PolarHBondContact O-N 3.3Å; N85-R90 WeakPolarHBondContact CB-O 3.21Å; N85-R90 PolarHBondContact N-O 3.36Å
86	E	72.7	Confident	80.9	Confident	115 Å²	115	64.4 Å²	64.4	54%	0.537	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-31.8	179.2	-63.5	-176.5	175.6	0	0	113.2	F84 Q89	F84-E86 HydrophobicContact CD1-CG 4.12Å; F84-E86 HydrophobicContact CE1-CG 4.1Å; F84-E86 PolarHBondContact O-N 3.27Å; E86-Q89 PolarHBondContact O-NE2 3.45Å
87	V	69.4	Low	80.1	Confident	135 Å²	135	63.8 Å²	63.8	82%	0.818	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-40.6	-179.2	-176.7	0	0	0	0	111.3	N85	N85-V87 PolarHBondContact O-N 3.42Å; N85-V87 VanDerWaalsContact O-N 3.15Å; N85-V87 WeakPolarHBondContact OD1-CB 3.21Å; N85-V87 PolarHBondContact OD1-N 3.39Å
88	E	71.7	Confident	79.2	Confident	97 Å²	97	66.9 Å²	66.9	45%	0.453	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-8.4	-178.9	-63.6	-173.3	153.1	0	0	113.2	N85 R90	N85-E88 HydrophobicContact CB-CB 4.24Å; N85-E88 WeakPolarHBondContact ND2-CG 3.16Å; N85-E88 PolarHBondContact ND2-OE2 3.28Å; N85-E88 PolarHBondContact O-N 3.1Å; N85-E88 VanDerWaalsContact O-N 3.15Å; N85-E88 PolarHBondContact OD1-N 3.14Å; E88-R90 HydrophobicContact CB-CG 3.76Å; E88-R90 VanDerWaalsContact CD-NH2 3.25Å; E88-R90 PolarHBondContact O-N 3.38Å; E88-R90 IonicContact OE1-NH2 3.16Å; E88-R90 PolarHBondContact OE1-NH2 2.79Å; E88-R90 IonicContact OE2-CZ 2.68Å; E88-R90 IonicContact OE2-NE 2.94Å; E88-R90 PolarHBondContact OE2-NE 3.11Å; E88-R90 IonicContact OE2-NH2 3.37Å; E88-R90 PolarHBondContact OE2-NH2 3.3Å
89	Q	73.3	Confident	78.7	Confident	92 Å²	92	65.1 Å²	65.1	43%	0.43	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	39.1	-175.9	-65.9	-73.1	-51.4	0	0	112.4	N85 E86	N85-Q89 PolarHBondContact O-N 3.3Å; E86-Q89 PolarHBondContact O-NE2 3.45Å
90	R	80.2	Confident	78.5	Confident	142 Å²	142	67.9 Å²	67.9	54%	0.536	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	155.6	178.6	67.3	-178.4	179.9	168	-0	110.5	N85 E88	N85-R90 WeakPolarHBondContact CB-O 3.21Å; N85-R90 PolarHBondContact N-O 3.36Å; E88-R90 HydrophobicContact CB-CG 3.76Å; E88-R90 VanDerWaalsContact CD-NH2 3.25Å; E88-R90 PolarHBondContact O-N 3.38Å; E88-R90 IonicContact OE1-NH2 3.16Å; E88-R90 PolarHBondContact OE1-NH2 2.79Å; E88-R90 IonicContact OE2-CZ 2.68Å; E88-R90 IonicContact OE2-NE 2.94Å; E88-R90 PolarHBondContact OE2-NE 3.11Å; E88-R90 IonicContact OE2-NH2 3.37Å; E88-R90 PolarHBondContact OE2-NH2 3.3Å
91	F	83.4	Confident	78.1	Confident	17 Å²	17	68.2 Å²	68.2	8%	0.075	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	145.7	168	-74.4	-87.6	0	0	0	111.5	E73 R76 E82 N83 F84 P162 E163	E73-F91 HydrophobicContact CG-CZ 4Å; E73-F91 WeakPolarHBondContact OE1-CZ 3.26Å; R76-F91 HydrophobicContact CG-CD1 4.19Å; R76-F91 HydrophobicContact CG-CE1 3.94Å; R76-F91 HydrophobicContact CG-CZ 4.48Å; E82-F91 HydrophobicContact CB-CB 4.26Å; E82-F91 HydrophobicContact CB-CD1 4.07Å; N83-F91 CarbonylContact O-C 3.57Å; N83-F91 WeakPolarHBondContact O-CA 3.33Å; F84-F91 HydrophobicContact CB-CD1 4.11Å; F84-F91 HydrophobicContact CB-CE1 3.79Å; F84-F91 HydrophobicContact CB-CZ 4.13Å; F84-F91 HydrophobicContact CD2-CD2 4.24Å; F84-F91 HydrophobicContact CD2-CE2 4.14Å; F84-F91 HydrophobicContact CD2-CZ 4.31Å; F91-P162 HydrophobicContact CE2-CG 3.84Å; F91-P162 HydrophobicContact CZ-CG 4.12Å; F91-E163 HydrophobicContact CD2-CG 4.16Å; F91-E163 HydrophobicContact CE2-CG 4.28Å
92	T	85.4	Confident	77.6	Confident	46 Å²	46	71.1 Å²	71.1	28%	0.282	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-66.8	162.6	172.3	59.8	0	0	0	0	111.1	N83 A94	N83-T92 HydrophobicContact CB-CG2 4.33Å; N83-T92 PolarHBondContact N-OG1 3.07Å; N83-T92 WeakPolarHBondContact O-CG2 3.35Å; N83-T92 PolarHBondContact O-N 3.43Å; N83-T92 PolarHBondContact O-OG1 3.04Å; T92-A94 PolarHBondContact O-N 3.33Å
93	E	80.1	Confident	77.1	Confident	179 Å²	179	69.6 Å²	69.6	84%	0.836	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-58.3	141.1	168.7	-63.9	-176.2	175.3	0	0	110.8	H95	E93-H95 PolarHBondContact O-N 2.83Å; E93-H95 PolarHBondContact O-ND1 3.19Å
94	A	79.4	Confident	76.8	Confident	56 Å²	56	67.7 Å²	67.7	46%	0.463	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-54.5	120.4	176.7	0	0	0	0	0	111.1	F80 E81 E82 T92	F80-A94 HydrophobicContact CB-CB 3.95Å; E81-A94 WeakPolarHBondContact O-CA 3.21Å; E82-A94 HydrophobicContact CG-CB 4.07Å; T92-A94 PolarHBondContact O-N 3.33Å
95	H	76.6	Confident	76.6	Confident	66 Å²	66	69.5 Å²	69.5	31%	0.306	36%	0.359	S	S	.	.	B	Isolated β-bridge	trans	-133.3	163.7	-178.2	60.8	-77.7	0	0	0	111.7	F80 E81 N83 E93 P97	F80-H95 WeakPolarHBondContact CB-O 3.43Å; E81-H95 PolarHBondContact N-O 3.11Å; E81-H95 PolarHBondContact O-CE1 3.43Å; E81-H95 PolarHBondContact O-N 3.1Å; E81-H95 PolarHBondContact O-ND1 3.35Å; E81-H95 IonicContact OE2-NE2 3.82Å; N83-H95 PolarHBondContact ND2-CE1 2.95Å; E93-H95 PolarHBondContact O-N 2.83Å; E93-H95 PolarHBondContact O-ND1 3.19Å; H95-P97 WeakPolarHBondContact O-CD 3.22Å
96	V	72.2	Confident	76.6	Confident	47 Å²	47	69.9 Å²	69.9	29%	0.285	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-76.9	124.5	177.1	-172.8	0	0	0	0	108.9	I6 Y8 F80 P98	I6-V96 VanDerWaalsContact O-CG1 3.32Å; I6-V96 WeakPolarHBondContact O-CG1 3.44Å; Y8-V96 HydrophobicContact CD2-CB 4.04Å; Y8-V96 HydrophobicContact CD2-CG1 3.4Å; Y8-V96 VanDerWaalsContact CD2-CG1 3.4Å; Y8-V96 HydrophobicContact CE2-CB 4.1Å; Y8-V96 HydrophobicContact CE2-CG1 3.74Å; Y8-V96 HydrophobicContact CE2-CG2 4.13Å; Y8-V96 HydrophobicContact CG-CG1 4.46Å; F80-V96 HydrophobicContact CD1-CG2 3.97Å; F80-V96 HydrophobicContact CE1-CG2 3.89Å; V96-P98 WeakPolarHBondContact O-CD 3.39Å
97	P	74.7	Confident	77.2	Confident	2 Å²	2	64.5 Å²	64.5	1%	0.013	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-64.8	120.6	-178.3	20.6	-30.3	0	0	0	111.4	L7 E81 H95 V328	L7-P97 HydrophobicContact CD2-CG 4.12Å; L7-P97 HydrophobicContact CG-CG 4.28Å; E81-P97 HydrophobicContact CB-CB 4.09Å; E81-P97 HydrophobicContact CB-CG 4.47Å; E81-P97 WeakPolarHBondContact OE2-CA 3.13Å; E81-P97 WeakPolarHBondContact OE2-CB 3.47Å; H95-P97 WeakPolarHBondContact O-CD 3.22Å; P97-V328 HydrophobicContact CB-CB 4.39Å; P97-V328 HydrophobicContact CB-CG1 3.72Å; P97-V328 HydrophobicContact CB-CG2 3.61Å; P97-V328 HydrophobicContact CG-CB 4.38Å; P97-V328 HydrophobicContact CG-CG1 3.37Å; P97-V328 HydrophobicContact CG-CG2 4.01Å
98	P	72.7	Confident	78.1	Confident	67 Å²	67	61.5 Å²	61.5	44%	0.435	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	132	173	31.5	-31.2	0	0	0	110.5	V96 R324	V96-P98 WeakPolarHBondContact O-CD 3.39Å; P98-R324 PolarHBondContact O-NH2 2.9Å
99	M	72.2	Confident	78.8	Confident	7 Å²	7	60.8 Å²	60.8	3%	0.034	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	139.6	174	-72.6	-167.5	-71.2	0	0	112.1	L7 V10 I104 I325 V328 F355	L7-M99 HydrophobicContact CD2-CE 3.37Å; V10-M99 PolarHBondContact N-O 3.25Å; M99-I104 HydrophobicContact CB-CD1 4.48Å; M99-I325 HydrophobicContact SD-CB 4.18Å; M99-I325 HydrophobicContact SD-CG1 3.87Å; M99-I325 HydrophobicContact SD-CG2 4.17Å; M99-V328 HydrophobicContact CE-CB 3.62Å; M99-V328 HydrophobicContact CE-CG1 3.15Å; M99-V328 HydrophobicContact CE-CG2 4.5Å; M99-V328 HydrophobicContact SD-CB 3.77Å; M99-V328 HydrophobicContact SD-CG1 3.91Å; M99-V328 HydrophobicContact SD-CG2 4.24Å; M99-F355 HydrophobicContact CE-CE1 4.29Å; M99-F355 HydrophobicContact CE-CZ 3.9Å
100	K	71.3	Confident	79.3	Confident	107 Å²	107	58.2 Å²	58.2	47%	0.465	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	136.5	173.9	-62.8	-176.1	179.5	-172	0	109.7	S102 C103 I104	K100-S102 VanDerWaalsContact C-N 3.26Å; K100-S102 PolarHBondContact O-N 3.18Å; K100-C103 HydrophobicContact CB-CB 4.45Å; K100-C103 PolarHBondContact O-N 3.27Å; K100-I104 PolarHBondContact O-N 2.96Å
101	F	72.5	Confident	79.7	Confident	89 Å²	89	51.5 Å²	51.5	39%	0.39	28%	0.276	S	S	.	.	H	α-helix	trans	-57.9	-39.4	177.1	-174.1	-93.2	0	0	0	112.4	V9 V10 C103 I104 N105 M356	V9-F101 HydrophobicContact CG1-CB 3.8Å; V9-F101 HydrophobicContact CG1-CD2 3.91Å; V9-F101 HydrophobicContact CG1-CG 4.37Å; V10-F101 PolarHBondContact O-N 3.06Å; F101-C103 VanDerWaalsContact C-N 3.33Å; F101-C103 PolarHBondContact O-N 2.93Å; F101-I104 PolarHBondContact O-N 2.92Å; F101-N105 WeakPolarHBondContact CE1-ND2 3.44Å; F101-N105 PolarHBondContact O-N 3.3Å; F101-M356 HydrophobicContact CD2-CE 3.2Å; F101-M356 HydrophobicContact CE2-CE 3.11Å; F101-M356 HydrophobicContact CG-CE 4.36Å; F101-M356 HydrophobicContact CZ-CE 4.24Å
102	S	75.9	Confident	79.9	Confident	62 Å²	62	56.1 Å²	56.1	43%	0.434	30%	0.297	S	S	.	.	H	α-helix	trans	-58.9	-41.6	178	51	0	0	0	0	112.9	K100 I104 N105 S106	K100-S102 VanDerWaalsContact C-N 3.26Å; K100-S102 PolarHBondContact O-N 3.18Å; S102-I104 VanDerWaalsContact C-N 3.31Å; S102-I104 PolarHBondContact O-N 3.2Å; S102-N105 PolarHBondContact O-N 3.04Å; S102-S106 PolarHBondContact O-N 3.44Å; S102-S106 PolarHBondContact O-OG 3.31Å
103	C	78.6	Confident	79.8	Confident	22 Å²	22	60.9 Å²	60.9	15%	0.149	32%	0.317	C	S	.	.	H	α-helix	trans	-68	-31.2	180	-55.1	0	0	0	0	112.3	K100 F101 F107 E321 I325	K100-C103 HydrophobicContact CB-CB 4.45Å; K100-C103 PolarHBondContact O-N 3.27Å; F101-C103 VanDerWaalsContact C-N 3.33Å; F101-C103 PolarHBondContact O-N 2.93Å; C103-F107 WeakPolarHBondContact O-CB 3.41Å; C103-F107 PolarHBondContact O-N 3.08Å; C103-E321 PolarHBondContact SG-OE1 2.96Å; C103-I325 HydrophobicContact CB-CD1 3.52Å
104	I	83.1	Confident	80	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-67.9	-42.4	175.9	-60.6	173.5	0	0	0	110.6	V9 M99 K100 F101 S102 F107 R108 I325 I352 F355 M356	V9-I104 HydrophobicContact CG1-CD1 4.26Å; V9-I104 HydrophobicContact CG2-CD1 4.01Å; M99-I104 HydrophobicContact CB-CD1 4.48Å; K100-I104 PolarHBondContact O-N 2.96Å; F101-I104 PolarHBondContact O-N 2.92Å; S102-I104 VanDerWaalsContact C-N 3.31Å; S102-I104 PolarHBondContact O-N 3.2Å; I104-F107 WeakPolarHBondContact O-CB 3.26Å; I104-F107 PolarHBondContact O-N 3.07Å; I104-R108 PolarHBondContact O-N 3.5Å; I104-I325 HydrophobicContact CG1-CG2 4.46Å; I104-I352 HydrophobicContact CG2-CG2 4Å; I104-F355 HydrophobicContact CD1-CE1 4.41Å; I104-M356 HydrophobicContact CB-SD 4.46Å; I104-M356 HydrophobicContact CD1-CE 4.07Å; I104-M356 HydrophobicContact CD1-SD 3.53Å; I104-M356 VanDerWaalsContact CD1-SD 3.53Å; I104-M356 HydrophobicContact CG2-CG 4.46Å; I104-M356 HydrophobicContact CG2-SD 3.81Å
105	N	81.5	Confident	80.4	Confident	61 Å²	61	53.2 Å²	53.2	33%	0.326	27%	0.274	S	S	.	.	H	α-helix	trans	-64.2	-45.5	175.6	-71.4	-18.4	0	0	0	111.5	F101 S102 F107 R108 D109	F101-N105 WeakPolarHBondContact CE1-ND2 3.44Å; F101-N105 PolarHBondContact O-N 3.3Å; S102-N105 PolarHBondContact O-N 3.04Å; N105-F107 PolarHBondContact O-N 3.37Å; N105-R108 WeakPolarHBondContact O-CB 3.05Å; N105-R108 PolarHBondContact O-N 3.39Å; N105-R108 VanDerWaalsContact O-N 3.17Å; N105-D109 PolarHBondContact O-N 3.22Å; N105-D109 VanDerWaalsContact O-N 3.07Å
106	S	81.9	Confident	81	Confident	57 Å²	57	54.9 Å²	54.9	40%	0.399	28%	0.28	S	S	.	.	H	α-helix	trans	-61	-32.9	174.2	-58.7	0	0	0	0	112.7	S102 K110	S102-S106 PolarHBondContact O-N 3.44Å; S102-S106 PolarHBondContact O-OG 3.31Å; S106-K110 VanDerWaalsContact O-CG 3.26Å; S106-K110 WeakPolarHBondContact O-CG 3.46Å; S106-K110 PolarHBondContact O-N 3.08Å
107	F	86	Confident	81.8	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.009	27%	0.272	C	S	.	.	H	α-helix	trans	-69.7	-43.7	174.4	-175	-116.5	0	0	0	112.1	C103 I104 N105 D109 K110 L111 F307 L322 I325 F326 M329	C103-F107 WeakPolarHBondContact O-CB 3.41Å; C103-F107 PolarHBondContact O-N 3.08Å; I104-F107 WeakPolarHBondContact O-CB 3.26Å; I104-F107 PolarHBondContact O-N 3.07Å; N105-F107 PolarHBondContact O-N 3.37Å; F107-D109 VanDerWaalsContact C-N 3.33Å; F107-D109 PolarHBondContact O-N 3.19Å; F107-K110 PolarHBondContact O-N 3.08Å; F107-L111 HydrophobicContact CD1-CD1 3.83Å; F107-L111 HydrophobicContact CD1-CG 4.15Å; F107-L111 HydrophobicContact CD2-CG 4.33Å; F107-L111 HydrophobicContact CE1-CD1 3.32Å; F107-L111 HydrophobicContact CE1-CD2 4.08Å; F107-L111 HydrophobicContact CE1-CG 3.75Å; F107-L111 HydrophobicContact CE2-CD1 4.44Å; F107-L111 HydrophobicContact CE2-CD2 3.8Å; F107-L111 HydrophobicContact CE2-CG 3.96Å; F107-L111 HydrophobicContact CG-CG 4.43Å; F107-L111 HydrophobicContact CZ-CD1 3.68Å; F107-L111 HydrophobicContact CZ-CD2 3.49Å; F107-L111 VanDerWaalsContact CZ-CD2 3.49Å; F107-L111 HydrophobicContact CZ-CG 3.65Å; F107-L111 WeakPolarHBondContact O-CG 3.22Å; F107-L111 PolarHBondContact O-N 3.21Å; F107-F307 HydrophobicContact CE2-CZ 4.2Å; F107-F307 HydrophobicContact CZ-CZ 4Å; F107-L322 HydrophobicContact CB-CD2 3.71Å; F107-L322 HydrophobicContact CD2-CB 3.82Å; F107-L322 HydrophobicContact CD2-CD2 3.67Å; F107-L322 HydrophobicContact CD2-CG 4.25Å; F107-L322 HydrophobicContact CE2-CB 4.15Å; F107-L322 HydrophobicContact CG-CD2 4.14Å; F107-I325 HydrophobicContact CB-CG2 4.28Å; F107-I325 HydrophobicContact CD1-CG2 3.82Å; F107-I325 HydrophobicContact CE1-CG2 4.4Å; F107-I325 HydrophobicContact CG-CG2 4.07Å; F107-F326 HydrophobicContact CE1-CB 4.23Å; F107-F326 HydrophobicContact CE1-CD2 4.22Å; F107-F326 HydrophobicContact CZ-CB 3.74Å; F107-F326 AromaticContact CZ-CD2 3.97Å; F107-F326 HydrophobicContact CZ-CD2 3.97Å; F107-F326 HydrophobicContact CZ-CG 4.3Å; F107-M329 HydrophobicContact CD1-CE 3.56Å; F107-M329 HydrophobicContact CE1-CE 3.29Å; F107-M329 HydrophobicContact CZ-CE 4.44Å
108	R	87.5	Confident	82.6	Confident	72 Å²	72	54.9 Å²	54.9	27%	0.272	28%	0.278	S	S	.	.	H	α-helix	trans	-53.2	-49.9	174.2	-179.8	-168.3	-176.2	138.6	14.7	111.2	I104 N105 K110 L111 Q112 I349 D353	I104-R108 PolarHBondContact O-N 3.5Å; N105-R108 WeakPolarHBondContact O-CB 3.05Å; N105-R108 PolarHBondContact O-N 3.39Å; N105-R108 VanDerWaalsContact O-N 3.17Å; R108-K110 PolarHBondContact O-N 3.23Å; R108-L111 PolarHBondContact O-N 3.12Å; R108-Q112 WeakPolarHBondContact O-CB 3.44Å; R108-Q112 PolarHBondContact O-N 3.37Å; R108-I349 HydrophobicContact CG-CG2 4.44Å; R108-D353 IonicContact CZ-OD1 3.44Å; R108-D353 IonicContact CZ-OD2 3.82Å; R108-D353 IonicContact NH1-OD1 2.79Å; R108-D353 PolarHBondContact NH1-OD1 3.13Å; R108-D353 IonicContact NH1-OD2 3.83Å; R108-D353 IonicContact NH2-OD1 3.47Å; R108-D353 PolarHBondContact NH2-OD1 2.7Å; R108-D353 IonicContact NH2-OD2 3.08Å; R108-D353 PolarHBondContact NH2-OD2 3.35Å; R108-D353 VanDerWaalsContact NH2-OD2 3.08Å
109	D	86.1	Confident	83.4	Confident	83 Å²	83	56.2 Å²	56.2	44%	0.444	28%	0.278	S	S	.	.	H	α-helix	trans	-62.8	-42.8	-178.9	-64.4	-21.9	0	0	0	111.6	N105 F107 Q112 Q113	N105-D109 PolarHBondContact O-N 3.22Å; N105-D109 VanDerWaalsContact O-N 3.07Å; F107-D109 VanDerWaalsContact C-N 3.33Å; F107-D109 PolarHBondContact O-N 3.19Å; D109-Q112 PolarHBondContact O-N 2.92Å; D109-Q113 VanDerWaalsContact O-CG 3.31Å; D109-Q113 WeakPolarHBondContact O-CG 3.38Å; D109-Q113 PolarHBondContact O-N 2.67Å; D109-Q113 VanDerWaalsContact O-N 3.1Å
110	K	84.9	Confident	84.1	Confident	38 Å²	38	55.9 Å²	55.9	17%	0.165	28%	0.277	C	S	.	.	H	α-helix	trans	-67.5	-38.2	178.7	-72.4	172.9	-173	-175	0	112.6	S106 F107 R108 N114 E316 L317 L322	S106-K110 VanDerWaalsContact O-CG 3.26Å; S106-K110 WeakPolarHBondContact O-CG 3.46Å; S106-K110 PolarHBondContact O-N 3.08Å; F107-K110 PolarHBondContact O-N 3.08Å; R108-K110 PolarHBondContact O-N 3.23Å; K110-N114 PolarHBondContact O-N 2.95Å; K110-E316 PolarHBondContact NZ-O 2.86Å; K110-L317 HydrophobicContact CD-CD2 3.71Å; K110-L322 HydrophobicContact CD-CD1 3.41Å; K110-L322 VanDerWaalsContact CD-CD1 3.41Å; K110-L322 HydrophobicContact CD-CD2 4.42Å
111	L	87.7	Confident	84.8	Confident	1 Å²	1	56 Å²	56	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-64	-45.8	173.4	-73.6	-176.7	0	0	0	111	F107 R108 Q113 N114 L115 L282 F307 I348 I352	F107-L111 HydrophobicContact CD1-CD1 3.83Å; F107-L111 HydrophobicContact CD1-CG 4.15Å; F107-L111 HydrophobicContact CD2-CG 4.33Å; F107-L111 HydrophobicContact CE1-CD1 3.32Å; F107-L111 HydrophobicContact CE1-CD2 4.08Å; F107-L111 HydrophobicContact CE1-CG 3.75Å; F107-L111 HydrophobicContact CE2-CD1 4.44Å; F107-L111 HydrophobicContact CE2-CD2 3.8Å; F107-L111 HydrophobicContact CE2-CG 3.96Å; F107-L111 HydrophobicContact CG-CG 4.43Å; F107-L111 HydrophobicContact CZ-CD1 3.68Å; F107-L111 HydrophobicContact CZ-CD2 3.49Å; F107-L111 VanDerWaalsContact CZ-CD2 3.49Å; F107-L111 HydrophobicContact CZ-CG 3.65Å; F107-L111 WeakPolarHBondContact O-CG 3.22Å; F107-L111 PolarHBondContact O-N 3.21Å; R108-L111 PolarHBondContact O-N 3.12Å; L111-Q113 PolarHBondContact O-N 3.23Å; L111-N114 PolarHBondContact O-N 2.91Å; L111-L115 HydrophobicContact CB-CB 4.34Å; L111-L115 HydrophobicContact CD2-CB 4.14Å; L111-L115 HydrophobicContact CD2-CD1 4.06Å; L111-L115 HydrophobicContact CD2-CD2 3.96Å; L111-L115 HydrophobicContact CD2-CG 4.26Å; L111-L115 WeakPolarHBondContact O-CB 3.29Å; L111-L115 PolarHBondContact O-N 3.32Å; L111-L282 HydrophobicContact CD2-CD1 4.31Å; L111-L282 HydrophobicContact CD2-CD2 3.88Å; L111-L282 HydrophobicContact CD2-CG 4.43Å; L111-F307 HydrophobicContact CD2-CE2 4.26Å; L111-F307 HydrophobicContact CD2-CZ 4.31Å; L111-I348 HydrophobicContact CD1-CG2 4.24Å; L111-I352 HydrophobicContact CD1-CD1 3.67Å
112	Q	86.9	Confident	85.3	Confident	113 Å²	113	52 Å²	52	53%	0.528	27%	0.265	S	S	.	.	H	α-helix	trans	-61.9	-34	-179.3	-170.7	172.1	-15.7	0	0	112.3	R108 D109 I349	R108-Q112 WeakPolarHBondContact O-CB 3.44Å; R108-Q112 PolarHBondContact O-N 3.37Å; D109-Q112 PolarHBondContact O-N 2.92Å; Q112-I349 HydrophobicContact CB-CD1 3.86Å; Q112-I349 HydrophobicContact CG-CD1 3.82Å
113	Q	84.3	Confident	85.5	Confident	147 Å²	147	54.5 Å²	54.5	69%	0.687	27%	0.273	S	S	*	.	H	α-helix	trans	-81.1	-41.7	179.8	-69.9	173.4	9.2	0	0	113.7	D109 L111	D109-Q113 VanDerWaalsContact O-CG 3.31Å; D109-Q113 WeakPolarHBondContact O-CG 3.38Å; D109-Q113 PolarHBondContact O-N 2.67Å; D109-Q113 VanDerWaalsContact O-N 3.1Å; L111-Q113 PolarHBondContact O-N 3.23Å
114	N	83.4	Confident	85.7	Confident	59 Å²	59	55.3 Å²	55.3	32%	0.316	28%	0.278	S	S	.	.	H	α-helix	trans	-122.2	-10.8	-163	-58.8	-58.7	0	0	0	115	K110 L111 K116 L282	K110-N114 PolarHBondContact O-N 2.95Å; L111-N114 PolarHBondContact O-N 2.91Å; N114-K116 PolarHBondContact O-N 2.95Å; N114-L282 HydrophobicContact CB-CB 4.16Å; N114-L282 HydrophobicContact CB-CD2 3.95Å
115	L	87.9	Confident	85.8	Confident	15 Å²	15	55.9 Å²	55.9	8%	0.079	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	126.9	-173.5	-176.9	66.4	0	0	0	111.8	L111 I117 L282 L284 F307 V345 I348	L111-L115 HydrophobicContact CB-CB 4.34Å; L111-L115 HydrophobicContact CD2-CB 4.14Å; L111-L115 HydrophobicContact CD2-CD1 4.06Å; L111-L115 HydrophobicContact CD2-CD2 3.96Å; L111-L115 HydrophobicContact CD2-CG 4.26Å; L111-L115 WeakPolarHBondContact O-CB 3.29Å; L111-L115 PolarHBondContact O-N 3.32Å; L115-I117 HydrophobicContact CD2-CG1 4.44Å; L115-L282 HydrophobicContact CB-CD2 4.12Å; L115-L282 HydrophobicContact CB-CG 4.28Å; L115-L282 HydrophobicContact CD1-CD1 4.29Å; L115-L282 HydrophobicContact CD1-CD2 4.47Å; L115-L282 HydrophobicContact CD1-CG 3.86Å; L115-L284 HydrophobicContact CD1-CB 4.08Å; L115-F307 HydrophobicContact CD1-CE2 4.16Å; L115-V345 HydrophobicContact CB-CG1 4.45Å; L115-V345 HydrophobicContact CB-CG2 4.45Å; L115-V345 HydrophobicContact CD2-CG1 4.37Å; L115-V345 WeakPolarHBondContact O-CG2 3.32Å; L115-I348 HydrophobicContact CD2-CD1 3.62Å
116	K	89.4	Confident	85.8	Confident	100 Å²	100	53.4 Å²	53.4	44%	0.435	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	124.5	164.6	-173.7	70.3	178.2	178.1	0	111.1	N114 I118 Y135 L282 V283 L284	N114-K116 PolarHBondContact O-N 2.95Å; K116-I118 HydrophobicContact CG-CG1 3.96Å; K116-Y135 HydrophobicContact CB-CE1 4.05Å; K116-Y135 HydrophobicContact CB-CE2 3.96Å; K116-Y135 WeakPolarHBondContact CB-OH 3.31Å; K116-Y135 HydrophobicContact CD-CE2 4.05Å; K116-Y135 HydrophobicContact CG-CD2 4.18Å; K116-Y135 HydrophobicContact CG-CE1 4.42Å; K116-Y135 HydrophobicContact CG-CE2 3.57Å; K116-L282 PolarHBondContact N-O 2.79Å; K116-V283 WeakPolarHBondContact O-CA 3.49Å; K116-L284 PolarHBondContact O-N 3.42Å
117	I	90.3	Very high	85.9	Confident	25 Å²	25	55.5 Å²	55.5	13%	0.128	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	120.7	167.8	-52.1	172.7	0	0	0	107.8	L115 L284 S344 I348	L115-I117 HydrophobicContact CD2-CG1 4.44Å; I117-L284 WeakPolarHBondContact CA-O 3.4Å; I117-S344 WeakPolarHBondContact CD1-O 3.36Å; I117-I348 HydrophobicContact CD1-CD1 3.49Å; I117-I348 VanDerWaalsContact CD1-CD1 3.49Å; I117-I348 HydrophobicContact CD1-CG1 4.21Å; I117-I348 HydrophobicContact CG1-CD1 3.92Å
118	I	90.6	Very high	86	Confident	25 Å²	25	55.4 Å²	55.4	13%	0.128	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	113.1	174.4	-60.1	-179.5	0	0	0	107.4	K116 Y135 V283 L284 L285 R286	K116-I118 HydrophobicContact CG-CG1 3.96Å; I118-Y135 HydrophobicContact CD1-CD1 4.43Å; I118-Y135 HydrophobicContact CD1-CD2 4.45Å; I118-Y135 HydrophobicContact CD1-CG 3.99Å; I118-V283 HydrophobicContact CB-CG1 4.38Å; I118-V283 HydrophobicContact CD1-CG1 3.59Å; I118-V283 HydrophobicContact CD1-CG2 4.5Å; I118-V283 HydrophobicContact CG1-CG1 3.88Å; I118-L284 PolarHBondContact N-O 3.05Å; I118-L285 HydrophobicContact CB-CD2 3.86Å; I118-L285 HydrophobicContact CD1-CD2 4.5Å; I118-L285 HydrophobicContact CG2-CD2 3.85Å; I118-L285 WeakPolarHBondContact O-CA 3.48Å; I118-R286 PolarHBondContact O-N 2.79Å
119	Q	89.7	Confident	86	Confident	94 Å²	94	52 Å²	52	44%	0.439	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	118.4	169.8	-69	-178.1	-5.6	0	0	108.3	R286	Q119-R286 WeakPolarHBondContact CA-O 3.28Å
120	T	86.5	Confident	86	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.006	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	139	-176.1	-170	0	0	0	0	111.6	A122 E131 L285 R286 L287 N288	T120-A122 VanDerWaalsContact C-N 3.33Å; T120-A122 HydrophobicContact CG2-CB 4.14Å; T120-A122 VanDerWaalsContact OG1-CB 3.31Å; T120-A122 WeakPolarHBondContact OG1-CB 3.08Å; T120-A122 PolarHBondContact OG1-N 3.22Å; T120-E131 WeakPolarHBondContact CB-OE2 3.45Å; T120-E131 PolarHBondContact OG1-OE1 2.73Å; T120-E131 VanDerWaalsContact OG1-OE1 3.08Å; T120-E131 PolarHBondContact OG1-OE2 3.08Å; T120-L285 HydrophobicContact CG2-CD2 4.27Å; T120-R286 PolarHBondContact N-O 2.94Å; T120-R286 VanDerWaalsContact N-O 3.07Å; T120-L287 HydrophobicContact CG2-CD2 3.29Å; T120-L287 HydrophobicContact CG2-CG 4.2Å; T120-N288 PolarHBondContact O-N 3.29Å; T120-N288 VanDerWaalsContact O-N 3.12Å
121	D	86.5	Confident	86.2	Confident	109 Å²	109	50.4 Å²	50.4	58%	0.583	25%	0.251	S	S	*	.			trans	-96.3	11.7	171.7	-70.7	-36.5	0	0	0	111.7	L123 N288	D121-L123 PolarHBondContact O-N 3.17Å; D121-N288 WeakPolarHBondContact OD1-CB 3.35Å; D121-N288 PolarHBondContact OD1-ND2 3.07Å
122	A	82.7	Confident	86.3	Confident	4 Å²	4	50.4 Å²	50.4	3%	0.033	25%	0.251	C	S	.	.			trans	-52.8	126	178	0	0	0	0	0	111.8	T120 Q127 A128	T120-A122 VanDerWaalsContact C-N 3.33Å; T120-A122 HydrophobicContact CG2-CB 4.14Å; T120-A122 VanDerWaalsContact OG1-CB 3.31Å; T120-A122 WeakPolarHBondContact OG1-CB 3.08Å; T120-A122 PolarHBondContact OG1-N 3.22Å; A122-Q127 HydrophobicContact CB-CB 3.64Å; A122-A128 HydrophobicContact CB-CB 3.82Å
123	L	81.1	Confident	86.3	Confident	116 Å²	116	45 Å²	45	61%	0.607	23%	0.225	S	C	*	.	S	Bend	trans	-90.4	-14.3	177.4	-63.2	175.5	0	0	0	112.3	D121 Q127 K289	D121-L123 PolarHBondContact O-N 3.17Å; L123-Q127 VanDerWaalsContact N-OE1 3.15Å; L123-K289 HydrophobicContact CD2-CD 3.92Å
124	T	82.3	Confident	86.5	Confident	39 Å²	39	43.2 Å²	43.2	24%	0.239	22%	0.216	C	C	.	.	S	Bend	trans	-128.3	148.4	-176.9	56.9	0	0	0	0	109.6	G126 Q127 A128	T124-G126 PolarHBondContact O-N 3.24Å; T124-Q127 PolarHBondContact O-N 3.41Å; T124-Q127 VanDerWaalsContact O-N 3.17Å; T124-Q127 VanDerWaalsContact OG1-CG 3.3Å; T124-Q127 WeakPolarHBondContact OG1-CG 3.38Å; T124-Q127 PolarHBondContact OG1-N 2.97Å; T124-Q127 PolarHBondContact OG1-OE1 3.35Å; T124-A128 PolarHBondContact O-N 2.88Å
125	L	84.3	Confident	86.8	Confident	13 Å²	13	42.3 Å²	42.3	7%	0.068	21%	0.208	C	C	.	.	H	α-helix	trans	-56.9	-36.1	174.5	-178.7	66.3	0	0	0	111.2	Q127 A128 L129 S294 I296 I306	L125-Q127 PolarHBondContact O-N 3.46Å; L125-A128 PolarHBondContact O-N 2.88Å; L125-L129 HydrophobicContact CD1-CD1 3.91Å; L125-L129 HydrophobicContact CD1-CD2 4.47Å; L125-L129 HydrophobicContact CD1-CG 3.94Å; L125-L129 HydrophobicContact CD2-CD1 4.21Å; L125-L129 HydrophobicContact CG-CD1 3.78Å; L125-L129 HydrophobicContact CG-CG 4.18Å; L125-L129 WeakPolarHBondContact O-CG 3.4Å; L125-L129 PolarHBondContact O-N 3.41Å; L125-S294 WeakPolarHBondContact CD2-O 3.45Å; L125-I296 HydrophobicContact CD1-CB 4.13Å; L125-I296 HydrophobicContact CD1-CD1 3.58Å; L125-I296 HydrophobicContact CD1-CG1 4.18Å; L125-I296 HydrophobicContact CD2-CB 3.98Å; L125-I296 HydrophobicContact CD2-CG1 4.34Å; L125-I306 HydrophobicContact CD1-CD1 3.96Å
126	G	82	Confident	86.8	Confident	8 Å²	8	41.6 Å²	41.6	8%	0.082	20%	0.204	C	C	.	.	H	α-helix	trans	-47.1	-54.8	172	0	0	0	0	0	114	T124 D130 F156	T124-G126 PolarHBondContact O-N 3.24Å; G126-D130 VanDerWaalsContact O-CB 3.29Å; G126-D130 WeakPolarHBondContact O-CB 3.03Å; G126-D130 PolarHBondContact O-N 3.28Å; G126-D130 VanDerWaalsContact O-N 3.13Å; G126-F156 WeakPolarHBondContact O-CZ 3.24Å
127	Q	85	Confident	86.7	Confident	101 Å²	101	39.6 Å²	39.6	47%	0.472	20%	0.198	S	C	.	.	H	α-helix	trans	-67	-42.4	-179.3	-72.4	167.7	-16.1	0	0	111.9	A122 L123 T124 L125 D130 E131	A122-Q127 HydrophobicContact CB-CB 3.64Å; L123-Q127 VanDerWaalsContact N-OE1 3.15Å; T124-Q127 PolarHBondContact O-N 3.41Å; T124-Q127 VanDerWaalsContact O-N 3.17Å; T124-Q127 VanDerWaalsContact OG1-CG 3.3Å; T124-Q127 WeakPolarHBondContact OG1-CG 3.38Å; T124-Q127 PolarHBondContact OG1-N 2.97Å; T124-Q127 PolarHBondContact OG1-OE1 3.35Å; L125-Q127 PolarHBondContact O-N 3.46Å; Q127-D130 PolarHBondContact O-N 3.02Å; Q127-E131 PolarHBondContact O-N 3.37Å; Q127-E131 VanDerWaalsContact O-N 3.12Å
128	A	86.5	Confident	86.5	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.7	-43.4	-178.3	0	0	0	0	0	112.5	A122 T124 L125 L285 I291	A122-A128 HydrophobicContact CB-CB 3.82Å; T124-A128 PolarHBondContact O-N 2.88Å; L125-A128 PolarHBondContact O-N 2.88Å; A128-L285 HydrophobicContact CB-CD1 4.42Å; A128-I291 HydrophobicContact CB-CD1 4.07Å
129	L	87.6	Confident	86.1	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-74.3	-30.8	178.5	-64.6	178.4	0	0	0	112.7	L125 E131 V132 A133 L155 F156 I308	L125-L129 HydrophobicContact CD1-CD1 3.91Å; L125-L129 HydrophobicContact CD1-CD2 4.47Å; L125-L129 HydrophobicContact CD1-CG 3.94Å; L125-L129 HydrophobicContact CD2-CD1 4.21Å; L125-L129 HydrophobicContact CG-CD1 3.78Å; L125-L129 HydrophobicContact CG-CG 4.18Å; L125-L129 WeakPolarHBondContact O-CG 3.4Å; L125-L129 PolarHBondContact O-N 3.41Å; L129-E131 VanDerWaalsContact C-N 3.32Å; L129-V132 WeakPolarHBondContact O-CB 3.12Å; L129-V132 PolarHBondContact O-N 3.09Å; L129-A133 PolarHBondContact O-N 3.24Å; L129-L155 HydrophobicContact CB-CB 4.42Å; L129-L155 HydrophobicContact CD1-CB 4.31Å; L129-L155 WeakPolarHBondContact CD1-O 3.26Å; L129-F156 HydrophobicContact CB-CE1 4.25Å; L129-F156 HydrophobicContact CB-CE2 4.45Å; L129-F156 HydrophobicContact CB-CZ 3.88Å; L129-F156 HydrophobicContact CD1-CD1 4.18Å; L129-F156 HydrophobicContact CD1-CE1 3.89Å; L129-F156 HydrophobicContact CD1-CZ 4.34Å; L129-I308 HydrophobicContact CD2-CD1 4.08Å
130	D	87	Confident	85.8	Confident	23 Å²	23	47 Å²	47	12%	0.123	24%	0.244	C	C	.	.	H	α-helix	trans	-67.2	-32.7	174.9	-165.9	59.7	0	0	0	111.8	G126 Q127 V132 A133 K134 Y148 R152	G126-D130 VanDerWaalsContact O-CB 3.29Å; G126-D130 WeakPolarHBondContact O-CB 3.03Å; G126-D130 PolarHBondContact O-N 3.28Å; G126-D130 VanDerWaalsContact O-N 3.13Å; Q127-D130 PolarHBondContact O-N 3.02Å; D130-V132 VanDerWaalsContact C-N 3.33Å; D130-V132 PolarHBondContact O-N 3.47Å; D130-A133 PolarHBondContact O-N 3.49Å; D130-K134 WeakPolarHBondContact O-CB 3.21Å; D130-K134 VanDerWaalsContact O-CG 3.31Å; D130-K134 WeakPolarHBondContact O-CG 2.94Å; D130-K134 PolarHBondContact O-N 2.74Å; D130-K134 VanDerWaalsContact OD2-CE 3.26Å; D130-K134 WeakPolarHBondContact OD2-CE 3.31Å; D130-K134 IonicContact OD2-NZ 2.7Å; D130-K134 PolarHBondContact OD2-NZ 3.5Å; D130-Y148 PolarHBondContact OD1-OH 2.79Å; D130-R152 IonicContact OD1-CZ 3.83Å; D130-R152 IonicContact OD1-NE 3.39Å; D130-R152 PolarHBondContact OD1-NE 3.48Å
131	E	88.6	Confident	85.7	Confident	65 Å²	65	47.3 Å²	47.3	30%	0.304	25%	0.245	S	C	.	.	H	α-helix	trans	-63.6	-36.4	170.7	-75.5	-178.7	-168	0	0	112.8	T120 Q127 L129 K134 Y135	T120-E131 WeakPolarHBondContact CB-OE2 3.45Å; T120-E131 PolarHBondContact OG1-OE1 2.73Å; T120-E131 VanDerWaalsContact OG1-OE1 3.08Å; T120-E131 PolarHBondContact OG1-OE2 3.08Å; Q127-E131 PolarHBondContact O-N 3.37Å; Q127-E131 VanDerWaalsContact O-N 3.12Å; L129-E131 VanDerWaalsContact C-N 3.32Å; E131-K134 PolarHBondContact O-N 3.41Å; E131-Y135 WeakPolarHBondContact O-CB 3.46Å; E131-Y135 PolarHBondContact O-N 2.85Å
132	V	89.8	Confident	85.5	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-67.9	-43.1	175.2	179.8	0	0	0	0	110.7	L129 D130 K134 Y135 A136 L155 I281 V283 L285 I308	L129-V132 WeakPolarHBondContact O-CB 3.12Å; L129-V132 PolarHBondContact O-N 3.09Å; D130-V132 VanDerWaalsContact C-N 3.33Å; D130-V132 PolarHBondContact O-N 3.47Å; V132-K134 VanDerWaalsContact C-N 3.35Å; V132-K134 PolarHBondContact O-N 3.09Å; V132-Y135 WeakPolarHBondContact O-CB 3.47Å; V132-Y135 PolarHBondContact O-N 3.19Å; V132-A136 WeakPolarHBondContact O-CB 3.49Å; V132-A136 PolarHBondContact O-N 3Å; V132-L155 HydrophobicContact CB-CD1 4.49Å; V132-L155 HydrophobicContact CG1-CD1 4.44Å; V132-I281 HydrophobicContact CG1-CG2 4.22Å; V132-V283 HydrophobicContact CG1-CG2 4.46Å; V132-V283 HydrophobicContact CG2-CG1 4.3Å; V132-L285 HydrophobicContact CG2-CD1 3.53Å; V132-L285 HydrophobicContact CG2-CD2 3.89Å; V132-L285 HydrophobicContact CG2-CG 3.88Å; V132-I308 HydrophobicContact CB-CD1 4.33Å; V132-I308 HydrophobicContact CG1-CD1 3.96Å; V132-I308 HydrophobicContact CG2-CD1 3.77Å
133	A	87.8	Confident	85.2	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62.2	-42	175.7	0	0	0	0	0	111.7	L129 D130 A136 L137 Y148 L155	L129-A133 PolarHBondContact O-N 3.24Å; D130-A133 PolarHBondContact O-N 3.49Å; A133-A136 PolarHBondContact O-N 3.43Å; A133-L137 PolarHBondContact O-N 2.87Å; A133-Y148 HydrophobicContact CB-CD2 4.21Å; A133-Y148 HydrophobicContact CB-CE2 3.74Å; A133-L155 HydrophobicContact CB-CD1 4.44Å
134	K	88.8	Confident	84.8	Confident	110 Å²	110	44.2 Å²	44.2	48%	0.478	23%	0.232	S	C	.	.	H	α-helix	trans	-63.3	-41.2	173.5	-75.9	165.6	175.2	153.6	0	112.2	D130 E131 V132 L137 S138 Y148	D130-K134 WeakPolarHBondContact O-CB 3.21Å; D130-K134 VanDerWaalsContact O-CG 3.31Å; D130-K134 WeakPolarHBondContact O-CG 2.94Å; D130-K134 PolarHBondContact O-N 2.74Å; D130-K134 VanDerWaalsContact OD2-CE 3.26Å; D130-K134 WeakPolarHBondContact OD2-CE 3.31Å; D130-K134 IonicContact OD2-NZ 2.7Å; D130-K134 PolarHBondContact OD2-NZ 3.5Å; E131-K134 PolarHBondContact O-N 3.41Å; V132-K134 VanDerWaalsContact C-N 3.35Å; V132-K134 PolarHBondContact O-N 3.09Å; K134-L137 PolarHBondContact O-N 2.91Å; K134-S138 WeakPolarHBondContact O-CB 3.41Å; K134-S138 PolarHBondContact O-N 3Å; K134-Y148 HydrophobicContact CG-CE2 4.18Å
135	Y	89.7	Confident	84.6	Confident	39 Å²	39	48.1 Å²	48.1	15%	0.153	25%	0.251	C	S	.	.	H	α-helix	trans	-61.3	-46.3	175	169.2	-104.1	0	0	0	111.3	K116 I118 E131 V132 L137 S138 Q139 V283	K116-Y135 HydrophobicContact CB-CE1 4.05Å; K116-Y135 HydrophobicContact CB-CE2 3.96Å; K116-Y135 WeakPolarHBondContact CB-OH 3.31Å; K116-Y135 HydrophobicContact CD-CE2 4.05Å; K116-Y135 HydrophobicContact CG-CD2 4.18Å; K116-Y135 HydrophobicContact CG-CE1 4.42Å; K116-Y135 HydrophobicContact CG-CE2 3.57Å; I118-Y135 HydrophobicContact CD1-CD1 4.43Å; I118-Y135 HydrophobicContact CD1-CD2 4.45Å; I118-Y135 HydrophobicContact CD1-CG 3.99Å; E131-Y135 WeakPolarHBondContact O-CB 3.46Å; E131-Y135 PolarHBondContact O-N 2.85Å; V132-Y135 WeakPolarHBondContact O-CB 3.47Å; V132-Y135 PolarHBondContact O-N 3.19Å; Y135-L137 VanDerWaalsContact C-N 3.28Å; Y135-L137 PolarHBondContact O-N 3.43Å; Y135-S138 WeakPolarHBondContact CA-OG 3.18Å; Y135-S138 WeakPolarHBondContact O-CB 3.41Å; Y135-S138 PolarHBondContact O-N 3.09Å; Y135-S138 PolarHBondContact O-OG 2.99Å; Y135-Q139 HydrophobicContact CD2-CG 3.9Å; Y135-Q139 HydrophobicContact CE1-CG 4.19Å; Y135-Q139 HydrophobicContact CE2-CG 3.31Å; Y135-Q139 VanDerWaalsContact CZ-CG 3.48Å; Y135-Q139 PolarHBondContact O-N 3.23Å; Y135-V283 HydrophobicContact CD1-CG2 3.57Å; Y135-V283 HydrophobicContact CE1-CG2 3.54Å
136	A	87.2	Confident	84.2	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-61.2	-36.3	177.8	0	0	0	0	0	112.8	V132 A133 C141 I142 L151 I281	V132-A136 WeakPolarHBondContact O-CB 3.49Å; V132-A136 PolarHBondContact O-N 3Å; A133-A136 PolarHBondContact O-N 3.43Å; A136-C141 HydrophobicContact CB-CB 4.34Å; A136-C141 WeakPolarHBondContact O-CB 3.37Å; A136-C141 PolarHBondContact O-N 2.87Å; A136-C141 VanDerWaalsContact O-N 3.09Å; A136-I142 HydrophobicContact CB-CD1 3.7Å; A136-I142 HydrophobicContact CB-CG1 4.18Å; A136-L151 HydrophobicContact CB-CD2 3.84Å; A136-I281 HydrophobicContact CB-CD1 3.52Å; A136-I281 HydrophobicContact CB-CG1 4.12Å
137	L	86.8	Confident	84.2	Confident	59 Å²	59	57.1 Å²	57.1	31%	0.309	29%	0.291	S	S	.	.	H	α-helix	trans	-66.5	-42.7	171.5	-171.7	67.8	0	0	0	111.6	A133 K134 Y135 Q139 N140 Y148	A133-L137 PolarHBondContact O-N 2.87Å; K134-L137 PolarHBondContact O-N 2.91Å; Y135-L137 VanDerWaalsContact C-N 3.28Å; Y135-L137 PolarHBondContact O-N 3.43Å; L137-Q139 VanDerWaalsContact C-N 3.31Å; L137-Q139 PolarHBondContact O-N 3.24Å; L137-N140 PolarHBondContact O-N 3.29Å; L137-Y148 HydrophobicContact CB-CD2 4.2Å; L137-Y148 HydrophobicContact CD2-CD2 4.13Å
138	S	85.9	Confident	84.1	Confident	74 Å²	74	53.8 Å²	53.8	52%	0.517	27%	0.274	S	S	.	.	H	α-helix	trans	-65.7	-29.9	-179.1	78.5	0	0	0	0	114	K134 Y135	K134-S138 WeakPolarHBondContact O-CB 3.41Å; K134-S138 PolarHBondContact O-N 3Å; Y135-S138 WeakPolarHBondContact CA-OG 3.18Å; Y135-S138 WeakPolarHBondContact O-CB 3.41Å; Y135-S138 PolarHBondContact O-N 3.09Å; Y135-S138 PolarHBondContact O-OG 2.99Å
139	Q	82.7	Confident	83.9	Confident	106 Å²	106	56.5 Å²	56.5	50%	0.495	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	9	-179.1	-64.7	-57.5	-57	0	0	113.2	Y135 L137 C141	Y135-Q139 HydrophobicContact CD2-CG 3.9Å; Y135-Q139 HydrophobicContact CE1-CG 4.19Å; Y135-Q139 HydrophobicContact CE2-CG 3.31Å; Y135-Q139 VanDerWaalsContact CZ-CG 3.48Å; Y135-Q139 PolarHBondContact O-N 3.23Å; L137-Q139 VanDerWaalsContact C-N 3.31Å; L137-Q139 PolarHBondContact O-N 3.24Å; Q139-C141 PolarHBondContact O-N 2.95Å; Q139-C141 VanDerWaalsContact O-N 3.16Å
140	N	84.2	Confident	83.7	Confident	120 Å²	120	56.7 Å²	56.7	64%	0.642	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	26.4	-175.8	-62.3	-53.1	0	0	0	114	L137 I142	L137-N140 PolarHBondContact O-N 3.29Å; N140-I142 PolarHBondContact O-N 3.34Å
141	C	82.5	Confident	83.7	Confident	6 Å²	6	55.6 Å²	55.6	4%	0.041	28%	0.284	C	S	.	.	S	Bend	trans	-64.8	-21	170.8	-54.1	0	0	0	0	111	A136 Q139 K278 S279 I281	A136-C141 HydrophobicContact CB-CB 4.34Å; A136-C141 WeakPolarHBondContact O-CB 3.37Å; A136-C141 PolarHBondContact O-N 2.87Å; A136-C141 VanDerWaalsContact O-N 3.09Å; Q139-C141 PolarHBondContact O-N 2.95Å; Q139-C141 VanDerWaalsContact O-N 3.16Å; C141-K278 PolarHBondContact O-N 3.33Å; C141-S279 PolarHBondContact SG-OG 2.77Å; C141-I281 HydrophobicContact CB-CD1 4.49Å; C141-I281 HydrophobicContact CB-CG1 4.14Å
142	I	84.1	Confident	83.5	Confident	5 Å²	5	56 Å²	56	3%	0.026	28%	0.283	C	S	.	.	S	Bend	trans	-126.8	141.6	-173.5	-53.6	178.7	0	0	0	109.1	A136 N140 Q147 L151 L277	A136-I142 HydrophobicContact CB-CD1 3.7Å; A136-I142 HydrophobicContact CB-CG1 4.18Å; N140-I142 PolarHBondContact O-N 3.34Å; I142-Q147 HydrophobicContact CG2-CB 3.13Å; I142-Q147 HydrophobicContact CG2-CG 4.2Å; I142-Q147 VanDerWaalsContact CG2-OE1 3.23Å; I142-L151 HydrophobicContact CD1-CB 4.13Å; I142-L151 HydrophobicContact CD1-CD2 3.41Å; I142-L151 VanDerWaalsContact CD1-CD2 3.41Å; I142-L151 HydrophobicContact CD1-CG 4.39Å; I142-L151 HydrophobicContact CG1-CD2 4.49Å; I142-L277 HydrophobicContact CD1-CD2 4.47Å; I142-L277 HydrophobicContact CG1-CD2 3.84Å
143	Q	74.5	Confident	83.1	Confident	131 Å²	131	56 Å²	56	61%	0.612	28%	0.283	S	S	*	.	S	Bend	trans	-91.5	-8.7	-172.5	-55	-164.5	35.5	0	0	115.3	K278	Q143-K278 HydrophobicContact CG-CD 4.13Å; Q143-K278 HydrophobicContact CG-CG 4.35Å
144	G	74.4	Confident	83	Confident	29 Å²	29	56 Å²	56	30%	0.299	28%	0.283	S	S	.	.	S	Bend	trans	-177	173	-179.7	0	0	0	0	0	114.9	E146 Q147 Y148	G144-E146 VanDerWaalsContact C-N 3.28Å; G144-E146 PolarHBondContact O-N 3.08Å; G144-Q147 PolarHBondContact O-N 3.37Å; G144-Y148 PolarHBondContact O-N 2.86Å
145	N	77.4	Confident	82.9	Confident	120 Å²	120	50.9 Å²	50.9	64%	0.642	26%	0.26	S	S	*	.	H	α-helix	trans	-61.3	-31.3	-179.2	-84.5	-4.1	0	0	0	113.6	Q147 Y148 D149	N145-Q147 VanDerWaalsContact C-N 3.35Å; N145-Q147 PolarHBondContact O-N 2.89Å; N145-Y148 VanDerWaalsContact O-CB 3.32Å; N145-Y148 WeakPolarHBondContact O-CB 3.27Å; N145-Y148 PolarHBondContact O-N 2.93Å; N145-D149 PolarHBondContact O-N 3.24Å; N145-D149 VanDerWaalsContact O-N 3.11Å
146	E	75.9	Confident	82.5	Confident	163 Å²	163	49.2 Å²	49.2	76%	0.762	25%	0.254	S	S	*	.	H	α-helix	trans	-62.8	-43.9	177.3	-64.7	-174	165.7	0	0	111.5	G144 Y148 D149 V150	G144-E146 VanDerWaalsContact C-N 3.28Å; G144-E146 PolarHBondContact O-N 3.08Å; E146-Y148 VanDerWaalsContact C-N 3.3Å; E146-Y148 PolarHBondContact O-N 3.25Å; E146-D149 PolarHBondContact O-N 3.49Å; E146-V150 WeakPolarHBondContact O-CG2 3.5Å; E146-V150 PolarHBondContact O-N 3Å
147	Q	81	Confident	82.1	Confident	48 Å²	48	49.2 Å²	49.2	22%	0.224	25%	0.254	C	S	.	.	H	α-helix	trans	-71.5	-25.9	177.3	-66.8	-178.8	-18	0	0	112.1	I142 G144 N145 V150 L151 F276	I142-Q147 HydrophobicContact CG2-CB 3.13Å; I142-Q147 HydrophobicContact CG2-CG 4.2Å; I142-Q147 VanDerWaalsContact CG2-OE1 3.23Å; G144-Q147 PolarHBondContact O-N 3.37Å; N145-Q147 VanDerWaalsContact C-N 3.35Å; N145-Q147 PolarHBondContact O-N 2.89Å; Q147-V150 PolarHBondContact O-N 3.27Å; Q147-L151 WeakPolarHBondContact O-CB 3.47Å; Q147-L151 PolarHBondContact O-N 3.17Å; Q147-F276 HydrophobicContact CB-CD2 4.09Å; Q147-F276 HydrophobicContact CB-CE2 4.06Å; Q147-F276 HydrophobicContact CG-CD2 4.07Å
148	Y	84.5	Confident	81.5	Confident	30 Å²	30	48.7 Å²	48.7	12%	0.118	25%	0.25	C	C	.	.	H	α-helix	trans	-61.5	-48.3	169.8	173.1	-88.5	0	0	0	110.9	D130 A133 K134 L137 G144 N145 E146 V150 L151 R152	D130-Y148 PolarHBondContact OD1-OH 2.79Å; A133-Y148 HydrophobicContact CB-CD2 4.21Å; A133-Y148 HydrophobicContact CB-CE2 3.74Å; K134-Y148 HydrophobicContact CG-CE2 4.18Å; L137-Y148 HydrophobicContact CB-CD2 4.2Å; L137-Y148 HydrophobicContact CD2-CD2 4.13Å; G144-Y148 PolarHBondContact O-N 2.86Å; N145-Y148 VanDerWaalsContact O-CB 3.32Å; N145-Y148 WeakPolarHBondContact O-CB 3.27Å; N145-Y148 PolarHBondContact O-N 2.93Å; E146-Y148 VanDerWaalsContact C-N 3.3Å; E146-Y148 PolarHBondContact O-N 3.25Å; Y148-V150 VanDerWaalsContact C-N 3.31Å; Y148-V150 PolarHBondContact O-N 3.27Å; Y148-L151 PolarHBondContact O-N 3.16Å; Y148-R152 VanDerWaalsContact O-CB 3.28Å; Y148-R152 WeakPolarHBondContact O-CB 3.49Å; Y148-R152 PolarHBondContact O-N 3.4Å
149	D	81.9	Confident	81.3	Confident	58 Å²	58	46.4 Å²	46.4	31%	0.31	23%	0.23	S	C	.	.	H	α-helix	trans	-65.6	-35.8	178.2	-72.8	-31.3	0	0	0	111.9	P62 N145 E146 A153 L235	P62-D149 HydrophobicContact CB-CB 4.07Å; P62-D149 HydrophobicContact CG-CB 3.57Å; N145-D149 PolarHBondContact O-N 3.24Å; N145-D149 VanDerWaalsContact O-N 3.11Å; E146-D149 PolarHBondContact O-N 3.49Å; D149-A153 VanDerWaalsContact O-CB 3.24Å; D149-A153 WeakPolarHBondContact O-CB 3.37Å; D149-A153 PolarHBondContact O-N 3Å; D149-L235 HydrophobicContact CB-CD2 4.18Å
150	V	83.4	Confident	81	Confident	5 Å²	5	43.8 Å²	43.8	3%	0.03	22%	0.215	C	C	.	.	H	α-helix	trans	-65.9	-48	173.5	174.7	0	0	0	0	111.6	F59 P62 A65 E146 Q147 Y148 R152 A153 I154 F276	F59-V150 HydrophobicContact CB-CG1 4.23Å; F59-V150 HydrophobicContact CD1-CG1 4.14Å; F59-V150 WeakPolarHBondContact O-CG2 3.3Å; P62-V150 HydrophobicContact CB-CG2 4.39Å; P62-V150 HydrophobicContact CG-CG2 3.93Å; A65-V150 HydrophobicContact CB-CG1 3.86Å; E146-V150 WeakPolarHBondContact O-CG2 3.5Å; E146-V150 PolarHBondContact O-N 3Å; Q147-V150 PolarHBondContact O-N 3.27Å; Y148-V150 VanDerWaalsContact C-N 3.31Å; Y148-V150 PolarHBondContact O-N 3.27Å; V150-R152 VanDerWaalsContact C-N 3.31Å; V150-R152 PolarHBondContact O-N 3.43Å; V150-A153 WeakPolarHBondContact O-CB 3.42Å; V150-A153 PolarHBondContact O-N 3.36Å; V150-I154 HydrophobicContact CG1-CD1 3.89Å; V150-I154 VanDerWaalsContact O-CG1 3.3Å; V150-I154 WeakPolarHBondContact O-CG1 3.46Å; V150-I154 PolarHBondContact O-N 3.4Å; V150-F276 HydrophobicContact CB-CZ 4.39Å; V150-F276 HydrophobicContact CG1-CE1 3.68Å; V150-F276 HydrophobicContact CG1-CZ 3.87Å
151	L	85.8	Confident	80.7	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61.1	-43.9	177.5	178.3	63.8	0	0	0	110.8	A136 I142 Q147 Y148 A153 I154 L155 I274 F276 I281 I310	A136-L151 HydrophobicContact CB-CD2 3.84Å; I142-L151 HydrophobicContact CD1-CB 4.13Å; I142-L151 HydrophobicContact CD1-CD2 3.41Å; I142-L151 VanDerWaalsContact CD1-CD2 3.41Å; I142-L151 HydrophobicContact CD1-CG 4.39Å; I142-L151 HydrophobicContact CG1-CD2 4.49Å; Q147-L151 WeakPolarHBondContact O-CB 3.47Å; Q147-L151 PolarHBondContact O-N 3.17Å; Y148-L151 PolarHBondContact O-N 3.16Å; L151-A153 VanDerWaalsContact C-N 3.32Å; L151-A153 PolarHBondContact O-N 2.95Å; L151-I154 PolarHBondContact O-N 2.84Å; L151-L155 HydrophobicContact CD1-CD1 4.48Å; L151-L155 HydrophobicContact CD1-CG 4.28Å; L151-L155 HydrophobicContact CG-CD1 4.15Å; L151-L155 HydrophobicContact CG-CG 4.38Å; L151-L155 WeakPolarHBondContact O-CG 3.48Å; L151-L155 PolarHBondContact O-N 3.39Å; L151-I274 HydrophobicContact CD1-CD1 3.95Å; L151-F276 HydrophobicContact CB-CE2 4.46Å; L151-F276 HydrophobicContact CB-CZ 4.21Å; L151-I281 HydrophobicContact CD2-CD1 3.86Å; L151-I310 HydrophobicContact CD1-CD1 3.92Å
152	R	85.4	Confident	80.2	Confident	74 Å²	74	39.6 Å²	39.6	28%	0.279	19%	0.194	S	C	.	.	H	α-helix	trans	-56.2	-49.8	175	-169	177.4	177.8	-156.9	-0.5	110.1	D130 Y148 V150 I154 L155 F156 L239	D130-R152 IonicContact OD1-CZ 3.83Å; D130-R152 IonicContact OD1-NE 3.39Å; D130-R152 PolarHBondContact OD1-NE 3.48Å; Y148-R152 VanDerWaalsContact O-CB 3.28Å; Y148-R152 WeakPolarHBondContact O-CB 3.49Å; Y148-R152 PolarHBondContact O-N 3.4Å; V150-R152 VanDerWaalsContact C-N 3.31Å; V150-R152 PolarHBondContact O-N 3.43Å; R152-I154 VanDerWaalsContact C-N 3.29Å; R152-I154 PolarHBondContact O-N 2.89Å; R152-L155 PolarHBondContact O-N 3.22Å; R152-F156 HydrophobicContact CG-CD2 3.76Å; R152-F156 HydrophobicContact CG-CE2 3.61Å; R152-F156 WeakPolarHBondContact O-CD2 3.3Å; R152-F156 PolarHBondContact O-N 2.96Å; R152-F156 VanDerWaalsContact O-N 3.08Å; R152-L239 HydrophobicContact CG-CD1 4.38Å
153	A	81.3	Confident	79.6	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-57.4	-37.5	177.4	0	0	0	0	0	113.9	P62 H66 D149 V150 L151 A157 L235	P62-A153 HydrophobicContact CB-CB 4.23Å; P62-A153 WeakPolarHBondContact O-CB 3.24Å; H66-A153 HydrophobicContact CB-CB 4.12Å; H66-A153 PolarHBondContact ND1-O 3.47Å; D149-A153 VanDerWaalsContact O-CB 3.24Å; D149-A153 WeakPolarHBondContact O-CB 3.37Å; D149-A153 PolarHBondContact O-N 3Å; V150-A153 WeakPolarHBondContact O-CB 3.42Å; V150-A153 PolarHBondContact O-N 3.36Å; L151-A153 VanDerWaalsContact C-N 3.32Å; L151-A153 PolarHBondContact O-N 2.95Å; A153-A157 PolarHBondContact O-N 2.87Å; A153-L235 HydrophobicContact CB-CD1 4.11Å
154	I	85.1	Confident	79.2	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-70.9	-45.8	176.7	-65.3	162.1	0	0	0	111.5	L44 F59 A65 V69 W71 V150 L151 R152 F156 A157 I274 F276	L44-I154 HydrophobicContact CD1-CG2 3.9Å; L44-I154 HydrophobicContact CD2-CG2 3.85Å; F59-I154 HydrophobicContact CD1-CD1 3.73Å; F59-I154 HydrophobicContact CE1-CD1 3.54Å; F59-I154 HydrophobicContact CE1-CG1 4.46Å; A65-I154 HydrophobicContact CB-CG1 4.15Å; V69-I154 HydrophobicContact CG2-CG1 4.33Å; V69-I154 HydrophobicContact CG2-CG2 4.28Å; W71-I154 HydrophobicContact CZ2-CG2 4.17Å; W71-I154 PolarHBondContact NE1-O 2.82Å; V150-I154 HydrophobicContact CG1-CD1 3.89Å; V150-I154 VanDerWaalsContact O-CG1 3.3Å; V150-I154 WeakPolarHBondContact O-CG1 3.46Å; V150-I154 PolarHBondContact O-N 3.4Å; L151-I154 PolarHBondContact O-N 2.84Å; R152-I154 VanDerWaalsContact C-N 3.29Å; R152-I154 PolarHBondContact O-N 2.89Å; I154-F156 PolarHBondContact O-N 3.24Å; I154-A157 WeakPolarHBondContact O-CB 3.31Å; I154-A157 PolarHBondContact O-N 3.46Å; I154-I274 HydrophobicContact CD1-CD1 4.35Å; I154-I274 HydrophobicContact CD1-CG2 4.39Å; I154-I274 HydrophobicContact CG2-CD1 4.09Å; I154-F276 HydrophobicContact CD1-CE1 3.81Å; I154-F276 HydrophobicContact CD1-CZ 4.08Å
155	L	86.8	Confident	78.1	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-60.1	-32.4	177.4	-69.8	174.8	0	0	0	111.7	L129 V132 A133 L151 R152 R159 I310	L129-L155 HydrophobicContact CB-CB 4.42Å; L129-L155 HydrophobicContact CD1-CB 4.31Å; L129-L155 WeakPolarHBondContact CD1-O 3.26Å; V132-L155 HydrophobicContact CB-CD1 4.49Å; V132-L155 HydrophobicContact CG1-CD1 4.44Å; A133-L155 HydrophobicContact CB-CD1 4.44Å; L151-L155 HydrophobicContact CD1-CD1 4.48Å; L151-L155 HydrophobicContact CD1-CG 4.28Å; L151-L155 HydrophobicContact CG-CD1 4.15Å; L151-L155 HydrophobicContact CG-CG 4.38Å; L151-L155 WeakPolarHBondContact O-CG 3.48Å; L151-L155 PolarHBondContact O-N 3.39Å; R152-L155 PolarHBondContact O-N 3.22Å; L155-R159 PolarHBondContact O-NH2 2.92Å; L155-R159 VanDerWaalsContact O-NH2 3.08Å; L155-I310 HydrophobicContact CD2-CD1 4.21Å
156	F	82.7	Confident	76.7	Confident	4 Å²	4	41.4 Å²	41.4	2%	0.018	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-1	175	-72.1	-64.1	0	0	0	115.1	H66 G126 L129 R152 I154 L239 H242	H66-F156 PolarHBondContact CE1-O 3.08Å; H66-F156 VanDerWaalsContact CE1-O 3.23Å; G126-F156 WeakPolarHBondContact O-CZ 3.24Å; L129-F156 HydrophobicContact CB-CE1 4.25Å; L129-F156 HydrophobicContact CB-CE2 4.45Å; L129-F156 HydrophobicContact CB-CZ 3.88Å; L129-F156 HydrophobicContact CD1-CD1 4.18Å; L129-F156 HydrophobicContact CD1-CE1 3.89Å; L129-F156 HydrophobicContact CD1-CZ 4.34Å; R152-F156 HydrophobicContact CG-CD2 3.76Å; R152-F156 HydrophobicContact CG-CE2 3.61Å; R152-F156 WeakPolarHBondContact O-CD2 3.3Å; R152-F156 PolarHBondContact O-N 2.96Å; R152-F156 VanDerWaalsContact O-N 3.08Å; I154-F156 PolarHBondContact O-N 3.24Å; F156-L239 HydrophobicContact CB-CD2 3.57Å; F156-L239 HydrophobicContact CD2-CD2 3.39Å; F156-L239 HydrophobicContact CE2-CD2 4.32Å; F156-L239 HydrophobicContact CG-CD2 3.61Å; F156-H242 HydrophobicContact CD1-CB 4.1Å; F156-H242 PolarHBondContact O-CE1 3.25Å; F156-H242 VanDerWaalsContact O-CE1 3.24Å; F156-H242 PolarHBondContact O-NE2 3.08Å; F156-H242 VanDerWaalsContact O-NE2 3.09Å
157	A	78.6	Confident	75.5	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.172	C	C	.	.	S	Bend	trans	-56.3	159.7	-179.9	0	0	0	0	0	113.3	V69 A153 I154 R159	V69-A157 HydrophobicContact CG2-CB 3.65Å; A153-A157 PolarHBondContact O-N 2.87Å; I154-A157 WeakPolarHBondContact O-CB 3.31Å; I154-A157 PolarHBondContact O-N 3.46Å; A157-R159 PolarHBondContact O-NH1 2.89Å
158	E	74.5	Confident	73.9	Confident	48 Å²	48	34.7 Å²	34.7	22%	0.224	17%	0.168	C	C	.	.			trans	-58.8	141.2	-179.9	-170.4	177.7	-176.8	0	0	111.5	R47 L70 W71	R47-E158 IonicContact CZ-OE2 2.94Å; R47-E158 VanDerWaalsContact CZ-OE2 3.29Å; R47-E158 IonicContact NH1-OE2 2.74Å; R47-E158 PolarHBondContact NH1-OE2 3.26Å; R47-E158 IonicContact NH2-OE2 2.95Å; R47-E158 PolarHBondContact NH2-OE2 3.16Å; L70-E158 WeakPolarHBondContact CA-O 3.49Å; W71-E158 PolarHBondContact N-O 3.35Å
159	R	79.8	Confident	71.9	Confident	26 Å²	26	35.7 Å²	35.7	10%	0.098	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	129.2	175.6	-74.9	160.5	-177.1	73.9	0.5	109.6	W71 L155 A157 C295	W71-R159 HydrophobicContact CB-CG 3.74Å; W71-R159 HydrophobicContact CG-CG 4.34Å; W71-R159 CarbonylContact O-C 3.58Å; W71-R159 WeakPolarHBondContact O-CA 3.31Å; L155-R159 PolarHBondContact O-NH2 2.92Å; L155-R159 VanDerWaalsContact O-NH2 3.08Å; A157-R159 PolarHBondContact O-NH1 2.89Å; R159-C295 WeakPolarHBondContact CD-O 3.43Å
160	W	77.4	Confident	70	Confident	50 Å²	50	37.9 Å²	37.9	19%	0.189	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	116.8	-179.7	-170.7	85.2	0	0	0	110.5	L70 W71 L72 E73 F84 P162 H167	L70-W160 HydrophobicContact CD1-CB 4.18Å; W71-W160 PolarHBondContact O-N 2.85Å; L72-W160 HydrophobicContact CD1-CD2 4.24Å; L72-W160 HydrophobicContact CD1-CE3 3.14Å; L72-W160 HydrophobicContact CD1-CZ3 3.4Å; L72-W160 VanDerWaalsContact CD1-CZ3 3.4Å; E73-W160 PolarHBondContact N-O 3.07Å; F84-W160 HydrophobicContact CE1-CH2 4.12Å; F84-W160 AromaticContact CE1-CZ3 3.8Å; F84-W160 HydrophobicContact CE1-CZ3 3.8Å; F84-W160 AromaticContact CZ-CH2 3.83Å; F84-W160 HydrophobicContact CZ-CH2 3.83Å; F84-W160 AromaticContact CZ-CZ3 3.87Å; F84-W160 HydrophobicContact CZ-CZ3 3.87Å; W160-P162 HydrophobicContact CE3-CB 4.42Å; W160-P162 HydrophobicContact CE3-CG 4.12Å; W160-P162 HydrophobicContact CH2-CB 3.64Å; W160-P162 HydrophobicContact CH2-CG 4.07Å; W160-P162 HydrophobicContact CZ2-CB 4.43Å; W160-P162 HydrophobicContact CZ3-CB 3.63Å; W160-P162 HydrophobicContact CZ3-CG 3.5Å; W160-H167 AromaticContact CD1-CE1 3.49Å; W160-H167 VanDerWaalsContact CD1-CE1 3.49Å; W160-H167 AromaticContact CD1-ND1 3.7Å; W160-H167 AromaticContact CD1-NE2 3.76Å; W160-H167 AromaticContact NE1-CD2 3.69Å; W160-H167 AromaticContact NE1-CE1 3.82Å; W160-H167 AromaticContact NE1-CG 3.91Å; W160-H167 AromaticContact NE1-NE2 3.62Å
161	H	77.2	Confident	68.3	Low	12 Å²	12	39.8 Å²	39.8	6%	0.056	21%	0.208	C	C	.	.			trans	-111.9	119.3	175.9	-56.7	-75.9	0	0	0	109.7	E40 Q42 E73 E163 V164 H167 E298	E40-H161 IonicContact OE1-CE1 2.87Å; E40-H161 PolarHBondContact OE1-CE1 2.95Å; E40-H161 IonicContact OE1-ND1 2.93Å; E40-H161 PolarHBondContact OE1-ND1 3.18Å; E40-H161 VanDerWaalsContact OE1-ND1 3.13Å; E40-H161 IonicContact OE2-CE1 3.85Å; Q42-H161 PolarHBondContact NE2-CE1 3.35Å; Q42-H161 VanDerWaalsContact NE2-CE1 3.33Å; E73-H161 IonicContact OE2-CG 3.97Å; E73-H161 IonicContact OE2-ND1 3.15Å; E73-H161 PolarHBondContact OE2-ND1 3.16Å; H161-E163 PolarHBondContact O-N 3.12Å; H161-V164 HydrophobicContact CB-CB 4.27Å; H161-V164 HydrophobicContact CB-CG2 3.66Å; H161-V164 PolarHBondContact O-N 3.09Å; H161-H167 PolarHBondContact O-NE2 2.8Å; H161-E298 HydrophobicContact CB-CB 4.25Å; H161-E298 HydrophobicContact CB-CG 3.78Å; H161-E298 PolarHBondContact CE1-N 2.88Å; H161-E298 VanDerWaalsContact CE1-N 3.26Å
162	P	71.8	Confident	66.4	Low	27 Å²	27	43.1 Å²	43.1	18%	0.175	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-34.2	-170.1	-5.8	5	0	0	0	115.1	F84 F91 W160	F84-P162 HydrophobicContact CD1-CG 4.22Å; F84-P162 HydrophobicContact CD2-CB 3.83Å; F84-P162 HydrophobicContact CD2-CG 3.32Å; F84-P162 HydrophobicContact CE1-CB 4.5Å; F84-P162 HydrophobicContact CE1-CG 4.14Å; F84-P162 HydrophobicContact CE2-CB 3.21Å; F84-P162 HydrophobicContact CE2-CG 3.25Å; F84-P162 HydrophobicContact CG-CG 3.84Å; F84-P162 HydrophobicContact CZ-CB 3.61Å; F84-P162 HydrophobicContact CZ-CG 3.68Å; F91-P162 HydrophobicContact CE2-CG 3.84Å; F91-P162 HydrophobicContact CZ-CG 4.12Å; W160-P162 HydrophobicContact CE3-CB 4.42Å; W160-P162 HydrophobicContact CE3-CG 4.12Å; W160-P162 HydrophobicContact CH2-CB 3.64Å; W160-P162 HydrophobicContact CH2-CG 4.07Å; W160-P162 HydrophobicContact CZ2-CB 4.43Å; W160-P162 HydrophobicContact CZ3-CB 3.63Å; W160-P162 HydrophobicContact CZ3-CG 3.5Å
163	E	71.5	Confident	64.7	Low	78 Å²	78	44.1 Å²	44.1	36%	0.364	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-7.4	-174.3	-66.9	-177.2	163.5	0	0	113.9	R76 F91 H161 K165 N253 E298	R76-E163 IonicContact CZ-OE2 2.72Å; R76-E163 IonicContact NH1-OE2 3.72Å; R76-E163 PolarHBondContact NH1-OE2 2.91Å; R76-E163 IonicContact NH2-OE1 2.59Å; R76-E163 IonicContact NH2-OE2 3.39Å; R76-E163 PolarHBondContact NH2-OE2 3.5Å; R76-E163 VanDerWaalsContact NH2-OE2 3.15Å; F91-E163 HydrophobicContact CD2-CG 4.16Å; F91-E163 HydrophobicContact CE2-CG 4.28Å; H161-E163 PolarHBondContact O-N 3.12Å; E163-K165 PolarHBondContact O-N 3.33Å; E163-K165 VanDerWaalsContact O-N 3.12Å; E163-N253 WeakPolarHBondContact CB-ND2 3.46Å; E163-N253 PolarHBondContact OE2-ND2 3.39Å; E163-E298 WeakPolarHBondContact CB-OE1 3.31Å
164	V	67.3	Low	63.3	Low	12 Å²	12	44.3 Å²	44.3	7%	0.073	24%	0.244	C	C	.	.	S	Bend	trans	-75.8	102.2	174.6	-178.2	0	0	0	0	109.5	H161 G166 H167 R251 N253 E298	H161-V164 HydrophobicContact CB-CB 4.27Å; H161-V164 HydrophobicContact CB-CG2 3.66Å; H161-V164 PolarHBondContact O-N 3.09Å; V164-G166 PolarHBondContact O-N 3.26Å; V164-H167 PolarHBondContact O-CD2 3.45Å; V164-H167 PolarHBondContact O-NE2 3.29Å; V164-R251 HydrophobicContact CG1-CB 3.58Å; V164-N253 HydrophobicContact CG2-CB 4.14Å; V164-E298 HydrophobicContact CG2-CG 3.55Å
165	K	51.6	Low	61.6	Low	192 Å²	192	48.5 Å²	48.5	84%	0.835	27%	0.267	S	S	*	.	S	Bend	trans	-67.3	127.9	-178.5	-69.9	-174.5	178.6	179.4	0	112.4	E163 R251	E163-K165 PolarHBondContact O-N 3.33Å; E163-K165 VanDerWaalsContact O-N 3.12Å; K165-R251 PolarHBondContact O-NH1 2.78Å
166	G	47.5	Very low	60.1	Low	41 Å²	41	56.3 Å²	56.3	42%	0.423	30%	0.303	S	S	.	.			trans	98.3	43.8	168.9	0	0	0	0	0	114.6	V164 R251	V164-G166 PolarHBondContact O-N 3.26Å; G166-R251 VanDerWaalsContact CA-NH1 3.3Å; G166-R251 PolarHBondContact O-NH1 3.2Å
167	H	50.4	Low	58.5	Low	42 Å²	42	60.4 Å²	60.4	19%	0.194	32%	0.319	C	S	.	.			trans	-50.9	157	160.5	-76.2	-69.3	0	0	0	111.5	W160 H161 V164 S169	W160-H167 AromaticContact CD1-CE1 3.49Å; W160-H167 VanDerWaalsContact CD1-CE1 3.49Å; W160-H167 AromaticContact CD1-ND1 3.7Å; W160-H167 AromaticContact CD1-NE2 3.76Å; W160-H167 AromaticContact NE1-CD2 3.69Å; W160-H167 AromaticContact NE1-CE1 3.82Å; W160-H167 AromaticContact NE1-CG 3.91Å; W160-H167 AromaticContact NE1-NE2 3.62Å; H161-H167 PolarHBondContact O-NE2 2.8Å; V164-H167 PolarHBondContact O-CD2 3.45Å; V164-H167 PolarHBondContact O-NE2 3.29Å; H167-S169 PolarHBondContact O-N 2.79Å; H167-S169 PolarHBondContact O-OG 2.91Å
168	I	47.3	Very low	57.1	Low	27 Å²	27	61.3 Å²	61.3	14%	0.138	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	50.5	160.9	-49.1	-178.3	0	0	0	108.9	E173 F174 Y249	I168-E173 HydrophobicContact CG2-CB 3.89Å; I168-F174 HydrophobicContact CG2-CB 3.49Å; I168-F174 VanDerWaalsContact CG2-CB 3.49Å; I168-F174 HydrophobicContact CG2-CD2 4.02Å; I168-F174 HydrophobicContact CG2-CG 4.24Å; I168-Y249 HydrophobicContact CD1-CD1 3.96Å; I168-Y249 HydrophobicContact CD1-CE1 3.16Å; I168-Y249 HydrophobicContact CD1-CE2 3.96Å; I168-Y249 WeakPolarHBondContact CD1-OH 3.49Å; I168-Y249 HydrophobicContact CG1-CE1 4.42Å
169	S	43.4	Very low	55.9	Low	52 Å²	52	62.9 Å²	62.9	36%	0.364	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-19.4	171.3	42.5	0	0	0	0	111.2	H167 A171	H167-S169 PolarHBondContact O-N 2.79Å; H167-S169 PolarHBondContact O-OG 2.91Å; S169-A171 PolarHBondContact O-N 3.49Å
170	D	40.7	Very low	54.6	Low	104 Å²	104	65.6 Å²	65.6	56%	0.556	38%	0.379	S	S	*	.	S	Bend	trans	-79.9	111.8	170.3	-76.5	-15.2	0	0	0	108.7	A172 E173 F174	D170-A172 PolarHBondContact O-N 3.01Å; D170-E173 PolarHBondContact O-N 3.35Å; D170-F174 PolarHBondContact O-N 2.91Å
171	A	47.4	Very low	53.4	Low	44 Å²	44	65.8 Å²	65.8	36%	0.364	39%	0.386	S	S	.	.	H	α-helix	trans	-49.1	-29.6	173.2	0	0	0	0	0	112.1	S169 F174 D175 P190	S169-A171 PolarHBondContact O-N 3.49Å; A171-F174 PolarHBondContact O-N 3.07Å; A171-D175 WeakPolarHBondContact O-CB 3.46Å; A171-D175 VanDerWaalsContact O-CG 3.31Å; A171-D175 PolarHBondContact O-N 3.37Å; A171-P190 HydrophobicContact CB-CG 4.26Å
172	A	46.1	Very low	52.2	Low	71 Å²	71	67.4 Å²	67.4	59%	0.587	40%	0.395	S	S	*	.	H	α-helix	trans	-66.9	-38.6	176.7	0	0	0	0	0	114.2	D170 Q176	D170-A172 PolarHBondContact O-N 3.01Å; A172-Q176 WeakPolarHBondContact O-CB 3.45Å; A172-Q176 PolarHBondContact O-N 2.94Å; A172-Q176 VanDerWaalsContact O-N 3.15Å
173	E	49.6	Very low	51.2	Low	95 Å²	95	68.7 Å²	68.7	44%	0.444	40%	0.403	S	S	.	.	H	α-helix	trans	-75.1	-34.2	175.9	-77.4	-168.5	159.8	0	0	111.1	I168 D170 Q176 Y177	I168-E173 HydrophobicContact CG2-CB 3.89Å; D170-E173 PolarHBondContact O-N 3.35Å; E173-Q176 PolarHBondContact O-N 3.26Å; E173-Y177 WeakPolarHBondContact O-CB 3.33Å; E173-Y177 PolarHBondContact O-N 3.39Å; E173-Y177 VanDerWaalsContact O-N 3.13Å
174	F	52	Low	49.9	Very low	4 Å²	4	74.9 Å²	74.9	2%	0.018	43%	0.432	C	S	.	.	H	α-helix	trans	-62.5	-50.6	175.6	-168.1	-81.4	0	0	0	110.7	I168 D170 A171 Q176 Y177 W178 P188	I168-F174 HydrophobicContact CG2-CB 3.49Å; I168-F174 VanDerWaalsContact CG2-CB 3.49Å; I168-F174 HydrophobicContact CG2-CD2 4.02Å; I168-F174 HydrophobicContact CG2-CG 4.24Å; D170-F174 PolarHBondContact O-N 2.91Å; A171-F174 PolarHBondContact O-N 3.07Å; F174-Q176 PolarHBondContact O-N 3.18Å; F174-Y177 PolarHBondContact O-N 3.27Å; F174-W178 AromaticContact CD1-CD1 3.86Å; F174-W178 AromaticContact CD2-CD1 3.82Å; F174-W178 HydrophobicContact CE1-CB 4.15Å; F174-W178 AromaticContact CE1-CD1 3.57Å; F174-W178 HydrophobicContact CE1-CG 4.04Å; F174-W178 AromaticContact CE2-CD1 3.6Å; F174-W178 AromaticContact CE2-NE1 3.69Å; F174-W178 AromaticContact CG-CD1 3.95Å; F174-W178 AromaticContact CZ-CD1 3.46Å; F174-W178 VanDerWaalsContact CZ-CD1 3.46Å; F174-W178 HydrophobicContact CZ-CG 4.1Å; F174-W178 AromaticContact CZ-NE1 3.88Å; F174-W178 PolarHBondContact O-N 2.99Å; F174-P188 HydrophobicContact CD1-CG 4.05Å; F174-P188 HydrophobicContact CE1-CB 3.74Å; F174-P188 HydrophobicContact CE1-CG 3.28Å; F174-P188 HydrophobicContact CZ-CB 4Å; F174-P188 HydrophobicContact CZ-CG 4.01Å
175	D	51	Low	49.1	Very low	88 Å²	88	78.4 Å²	78.4	47%	0.471	47%	0.471	S	S	.	.	H	α-helix	trans	-63.4	-39.7	179.7	-75.5	-17.8	0	0	0	111.6	A171 Y177 A179	A171-D175 WeakPolarHBondContact O-CB 3.46Å; A171-D175 VanDerWaalsContact O-CG 3.31Å; A171-D175 PolarHBondContact O-N 3.37Å; D175-Y177 VanDerWaalsContact C-N 3.33Å; D175-Y177 PolarHBondContact O-N 3.48Å; D175-A179 WeakPolarHBondContact O-CB 3.47Å; D175-A179 PolarHBondContact O-N 3.03Å; D175-A179 VanDerWaalsContact O-N 3.09Å
176	Q	54.7	Low	49	Very low	165 Å²	165	71.3 Å²	71.3	77%	0.771	44%	0.442	S	S	*	.	H	α-helix	trans	-64.2	-37.2	177.6	-100.2	-176.1	-10.1	0	0	113.4	A172 E173 F174	A172-Q176 WeakPolarHBondContact O-CB 3.45Å; A172-Q176 PolarHBondContact O-N 2.94Å; A172-Q176 VanDerWaalsContact O-N 3.15Å; E173-Q176 PolarHBondContact O-N 3.26Å; F174-Q176 PolarHBondContact O-N 3.18Å
177	Y	48.7	Very low	49	Very low	91 Å²	91	76.1 Å²	76.1	36%	0.357	46%	0.458	S	S	.	.	H	α-helix	trans	-84.9	-38.9	-173.8	-171.2	-82.8	0	0	0	112.4	E173 F174 D175 H247 Y249	E173-Y177 WeakPolarHBondContact O-CB 3.33Å; E173-Y177 PolarHBondContact O-N 3.39Å; E173-Y177 VanDerWaalsContact O-N 3.13Å; F174-Y177 PolarHBondContact O-N 3.27Å; D175-Y177 VanDerWaalsContact C-N 3.33Å; D175-Y177 PolarHBondContact O-N 3.48Å; Y177-H247 AromaticContact CZ-CE1 3.52Å; Y177-H247 AromaticContact CZ-NE2 3.76Å; Y177-H247 PolarHBondContact OH-CE1 3.04Å; Y177-H247 PolarHBondContact OH-NE2 3.48Å; Y177-Y249 AromaticContact CD1-CE2 3.61Å; Y177-Y249 HydrophobicContact CD1-CE2 3.61Å; Y177-Y249 AromaticContact CD1-CZ 3.57Å; Y177-Y249 WeakPolarHBondContact CD1-OH 3.49Å; Y177-Y249 AromaticContact CD2-CE2 3.85Å; Y177-Y249 HydrophobicContact CD2-CE2 3.85Å; Y177-Y249 AromaticContact CE1-CE2 3.41Å; Y177-Y249 HydrophobicContact CE1-CE2 3.41Å; Y177-Y249 VanDerWaalsContact CE1-CE2 3.41Å; Y177-Y249 AromaticContact CE1-CZ 3.69Å; Y177-Y249 WeakPolarHBondContact CE1-OH 3.26Å; Y177-Y249 HydrophobicContact CE2-CD2 4.5Å; Y177-Y249 AromaticContact CE2-CE2 3.68Å; Y177-Y249 HydrophobicContact CE2-CE2 3.68Å; Y177-Y249 AromaticContact CG-CE2 3.83Å; Y177-Y249 HydrophobicContact CG-CE2 3.83Å; Y177-Y249 AromaticContact CG-CZ 3.99Å; Y177-Y249 VanDerWaalsContact CG-OH 3.23Å; Y177-Y249 AromaticContact CZ-CE2 3.49Å; Y177-Y249 VanDerWaalsContact CZ-CE2 3.49Å
178	W	50.4	Low	48.9	Very low	19 Å²	19	75.2 Å²	75.2	7%	0.072	46%	0.456	C	S	.	.	H	α-helix	trans	-93.3	-2.3	-178.2	-65.4	105.5	0	0	0	114.4	F67 F174 G180 T181 L182 I241 Y249	F67-W178 HydrophobicContact CE1-CD2 4.16Å; F67-W178 HydrophobicContact CE1-CE3 4.11Å; F67-W178 HydrophobicContact CE1-CH2 4.28Å; F67-W178 HydrophobicContact CE1-CZ2 4.31Å; F67-W178 HydrophobicContact CE1-CZ3 4.18Å; F67-W178 HydrophobicContact CZ-CD2 4.49Å; F67-W178 HydrophobicContact CZ-CE3 4Å; F67-W178 HydrophobicContact CZ-CH2 4.43Å; F67-W178 AromaticContact CZ-CZ3 3.98Å; F67-W178 HydrophobicContact CZ-CZ3 3.98Å; F174-W178 AromaticContact CD1-CD1 3.86Å; F174-W178 AromaticContact CD2-CD1 3.82Å; F174-W178 HydrophobicContact CE1-CB 4.15Å; F174-W178 AromaticContact CE1-CD1 3.57Å; F174-W178 HydrophobicContact CE1-CG 4.04Å; F174-W178 AromaticContact CE2-CD1 3.6Å; F174-W178 AromaticContact CE2-NE1 3.69Å; F174-W178 AromaticContact CG-CD1 3.95Å; F174-W178 AromaticContact CZ-CD1 3.46Å; F174-W178 VanDerWaalsContact CZ-CD1 3.46Å; F174-W178 HydrophobicContact CZ-CG 4.1Å; F174-W178 AromaticContact CZ-NE1 3.88Å; F174-W178 PolarHBondContact O-N 2.99Å; W178-G180 PolarHBondContact O-N 3.45Å; W178-T181 PolarHBondContact O-N 3.31Å; W178-T181 PolarHBondContact O-OG1 3.01Å; W178-L182 HydrophobicContact CB-CD1 3.91Å; W178-L182 HydrophobicContact CB-CG 4.32Å; W178-I241 HydrophobicContact CH2-CD1 3.69Å; W178-I241 HydrophobicContact CZ3-CD1 4.01Å; W178-Y249 HydrophobicContact CZ2-CE1 4.32Å; W178-Y249 AromaticContact NE1-CZ 3.99Å; W178-Y249 PolarHBondContact NE1-OH 3.06Å
179	A	47.9	Very low	48.6	Very low	80 Å²	80	81.3 Å²	81.3	66%	0.661	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	108.2	169.2	0	0	0	0	0	110.6	D175	D175-A179 WeakPolarHBondContact O-CB 3.47Å; D175-A179 PolarHBondContact O-N 3.03Å; D175-A179 VanDerWaalsContact O-N 3.09Å
180	G	51.9	Low	48.6	Very low	83 Å²	83	80.5 Å²	80.5	86%	0.856	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	110.6	-9.9	177.4	0	0	0	0	0	115.6	W178	W178-G180 PolarHBondContact O-N 3.45Å
181	T	53.2	Low	48.7	Very low	55 Å²	55	76.9 Å²	76.9	34%	0.337	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-14.5	177.2	16.3	0	0	0	0	113.7	W178	W178-T181 PolarHBondContact O-N 3.31Å; W178-T181 PolarHBondContact O-OG1 3.01Å
182	L	51.1	Low	48.4	Very low	45 Å²	45	81.9 Å²	81.9	24%	0.236	47%	0.473	C	S	.	.	S	Bend	trans	-88.8	134.6	179.6	-69.4	163.3	0	0	0	111.9	F67 W178 P188	F67-L182 HydrophobicContact CD2-CD2 3.86Å; F67-L182 HydrophobicContact CE1-CD2 4.35Å; F67-L182 HydrophobicContact CE2-CD2 3.62Å; F67-L182 HydrophobicContact CG-CD2 4.36Å; F67-L182 HydrophobicContact CZ-CD2 3.89Å; W178-L182 HydrophobicContact CB-CD1 3.91Å; W178-L182 HydrophobicContact CB-CG 4.32Å; L182-P188 HydrophobicContact CD1-CG 3.92Å
183	P	51.4	Low	48.2	Very low	54 Å²	54	82.7 Å²	82.7	35%	0.351	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-59.4	142.7	166.1	-18	29.1	0	0	0	111.5	V63 G185 I186	V63-P183 HydrophobicContact CG1-CG 4.31Å; P183-G185 PolarHBondContact O-N 3.13Å; P183-I186 HydrophobicContact CG-CD1 4.33Å
184	E	45.2	Very low	47.4	Very low	208 Å²	208	86.1 Å²	86.1	97%	0.972	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	124.5	172.5	-76.6	-175.6	160.2	0	0	110.4
185	G	49	Very low	46.4	Very low	86 Å²	86	97 Å²	97	89%	0.887	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	113	-5.6	176.5	0	0	0	0	0	116.7	P183	P183-G185 PolarHBondContact O-N 3.13Å
186	I	50.7	Low	45.7	Very low	43 Å²	43	96.2 Å²	96.2	22%	0.221	53%	0.53	C	S	.	.			trans	-98.6	115.8	173.3	-56.3	-178.7	0	0	0	109	P183 P188	P183-I186 HydrophobicContact CG-CD1 4.33Å; I186-P188 VanDerWaalsContact O-CD 3.26Å; I186-P188 WeakPolarHBondContact O-CD 3.46Å
187	N	47.6	Very low	44.6	Very low	142 Å²	142	92.8 Å²	92.8	76%	0.759	52%	0.524	S	S	*	.			trans	-106.9	92.8	177.1	-118.9	-22.3	0	0	0	109.4	K189	N187-K189 VanDerWaalsContact C-N 3.31Å; N187-K189 PolarHBondContact O-N 3.46Å; N187-K189 VanDerWaalsContact O-N 3.14Å
188	P	47.9	Very low	43.8	Very low	23 Å²	23	94 Å²	94	15%	0.149	54%	0.541	C	S	.	.			trans	-89.7	61.6	-175.4	37	-35.2	0	0	0	110.3	F174 L182 I186 P190	F174-P188 HydrophobicContact CD1-CG 4.05Å; F174-P188 HydrophobicContact CE1-CB 3.74Å; F174-P188 HydrophobicContact CE1-CG 3.28Å; F174-P188 HydrophobicContact CZ-CB 4Å; F174-P188 HydrophobicContact CZ-CG 4.01Å; L182-P188 HydrophobicContact CD1-CG 3.92Å; I186-P188 VanDerWaalsContact O-CD 3.26Å; I186-P188 WeakPolarHBondContact O-CD 3.46Å; P188-P190 VanDerWaalsContact O-CD 3.31Å; P188-P190 WeakPolarHBondContact O-CD 3.47Å
189	K	41.8	Very low	42.9	Very low	155 Å²	155	97.7 Å²	97.7	67%	0.674	58%	0.575	S	S	*	*			trans	-75.1	121.3	174.3	-73.3	-174	178.1	-179.7	0	109.3	N187 A191	N187-K189 VanDerWaalsContact C-N 3.31Å; N187-K189 PolarHBondContact O-N 3.46Å; N187-K189 VanDerWaalsContact O-N 3.14Å; K189-A191 PolarHBondContact O-N 3.49Å; K189-A191 VanDerWaalsContact O-N 3.09Å
190	P	42.4	Very low	42.1	Very low	35 Å²	35	98 Å²	98	23%	0.227	58%	0.578	C	S	.	*			trans	-71.2	104.5	174.1	27.7	-31.2	0	0	0	109	A171 P188	A171-P190 HydrophobicContact CB-CG 4.26Å; P188-P190 VanDerWaalsContact O-CD 3.31Å; P188-P190 WeakPolarHBondContact O-CD 3.47Å
191	A	42.8	Very low	41	Very low	29 Å²	29	101.7 Å²	101.7	24%	0.24	58%	0.576	C	S	.	*			trans	-83.7	-13.3	-178.2	0	0	0	0	0	113.8	D49 K189 L193	D49-A191 WeakPolarHBondContact OD1-CB 3.5Å; D49-A191 WeakPolarHBondContact OD2-CB 3.4Å; K189-A191 PolarHBondContact O-N 3.49Å; K189-A191 VanDerWaalsContact O-N 3.09Å; A191-L193 PolarHBondContact O-N 3.15Å
192	F	41.5	Very low	39.8	Very low	148 Å²	148	102.4 Å²	102.4	65%	0.649	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-16.2	-168.8	-167	-106.5	0	0	0	115.3
193	L	40.3	Very low	38.8	Very low	89 Å²	89	105.1 Å²	105.1	47%	0.466	62%	0.624	S	S	.	*	T	Hydrogen-bonded Turn	trans	-112.8	-6.2	-172.6	-68.6	172.5	0	0	0	116	A191 R195	A191-L193 PolarHBondContact O-N 3.15Å; L193-R195 VanDerWaalsContact C-N 3.35Å; L193-R195 PolarHBondContact O-N 3.09Å
194	Q	33.3	Very low	37.6	Very low	167 Å²	167	112.6 Å²	112.6	78%	0.78	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-12.5	-173.8	-143.1	164.2	13.7	0	0	114.1
195	R	31.6	Very low	36.9	Very low	232 Å²	232	112.1 Å²	112.1	88%	0.875	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-14.7	-179.9	-126.7	172.2	-172.1	167.3	2.1	114.6	L193	L193-R195 VanDerWaalsContact C-N 3.35Å; L193-R195 PolarHBondContact O-N 3.09Å
196	A	36.1	Very low	35.8	Very low	72 Å²	72	116.4 Å²	116.4	60%	0.595	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-17	-175.4	0	0	0	0	0	114.4	V198	A196-V198 PolarHBondContact O-N 3.32Å
197	S	31.3	Very low	34.8	Very low	93 Å²	93	122.4 Å²	122.4	65%	0.65	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-7.9	-174.9	59.8	0	0	0	0	115.1
198	V	32	Very low	33.9	Very low	117 Å²	117	120.3 Å²	120.3	71%	0.709	67%	0.669	S	S	*	*	S	Bend	trans	-108.4	-15.2	-174.4	-176.1	0	0	0	0	113.7	A196	A196-V198 PolarHBondContact O-N 3.32Å
199	A	31.7	Very low	32.8	Very low	95 Å²	95	128 Å²	128	79%	0.785	71%	0.705	S	S	*	*	S	Bend	trans	-96	-5.7	-176.3	0	0	0	0	0	115.5
200	A	31.2	Very low	32.1	Very low	86 Å²	86	127.4 Å²	127.4	71%	0.711	72%	0.715	S	S	*	*			trans	-108.5	32	-176	0	0	0	0	0	114.5	G202	A200-G202 VanDerWaalsContact C-N 3.33Å; A200-G202 PolarHBondContact O-N 3.19Å
201	I	29.2	Very low	31.3	Very low	161 Å²	161	137.2 Å²	137.2	83%	0.826	75%	0.747	S	S	*	*			trans	-85.9	78.5	164.7	-57.6	176.1	0	0	0	107.3
202	G	26.8	Very low	30.5	Very low	71 Å²	71	140 Å²	140	73%	0.732	77%	0.771	S	S	*	*	S	Bend	trans	-168.3	9.4	-170.6	0	0	0	0	0	120.4	A200	A200-G202 VanDerWaalsContact C-N 3.33Å; A200-G202 PolarHBondContact O-N 3.19Å
203	A	31.7	Very low	29.9	Very low	102 Å²	102	138.3 Å²	138.3	84%	0.843	78%	0.777	S	S	*	*			trans	-168.9	88.8	163.6	0	0	0	0	0	112.4
204	K	26.4	Very low	29.2	Very low	210 Å²	210	138.5 Å²	138.5	91%	0.913	79%	0.792	S	S	*	*			trans	-70.1	128.3	167.6	-80.3	177.9	175.4	175.9	0	110.8
205	K	29.4	Very low	28.9	Very low	199 Å²	199	136.3 Å²	136.3	87%	0.865	80%	0.795	S	S	*	*			trans	-152.3	102.6	140.7	-119	176.8	-175.7	177.5	0	112.2
206	H	25.7	Very low	28.6	Very low	175 Å²	175	131 Å²	131	81%	0.81	79%	0.789	S	S	*	*			trans	18.1	120.4	147.5	-80.7	-96.6	0	0	0	118.5
207	I	29.8	Very low	28.2	Very low	169 Å²	169	135.5 Å²	135.5	87%	0.867	80%	0.802	S	S	*	*				-144.9	135.9	124.4	-84.7	126.1	0	0	0	108.5
208	S	29.1	Very low	27.9	Very low	98 Å²	98	138.1 Å²	138.1	69%	0.685	81%	0.809	S	S	*	*			trans	-63.3	141.3	-174.8	45.4	0	0	0	0	115.1
209	M	24.3	Very low	27.7	Very low	184 Å²	184	142.2 Å²	142.2	91%	0.906	82%	0.818	S	S	*	*			trans	-59.9	137.3	160.2	-77.6	-165.9	-82.5	0	0	111.9
210	T	28.3	Very low	27.5	Very low	144 Å²	144	146.7 Å²	146.7	88%	0.883	82%	0.82	S	S	*	*			trans	-127	121.5	151.2	-19.5	0	0	0	0	108.3
211	R	24.2	Very low	27.4	Very low	240 Å²	240	148.1 Å²	148.1	91%	0.906	82%	0.822	S	S	*	*			trans	-95.8	124.2	-172.4	-166.1	177.9	-174.4	171.1	0.8	107.9
212	A	27.7	Very low	27.2	Very low	89 Å²	89	150 Å²	150	74%	0.736	82%	0.824	S	S	*	*			trans	-146.6	89.8	164.3	0	0	0	0	0	106.5
213	S	28.1	Very low	27.4	Very low	112 Å²	112	154.4 Å²	154.4	78%	0.783	83%	0.83	S	S	*	*				79.3	102.9	96.3	63.8	0	0	0	0	111.8
214	A	25.1	Very low	27.2	Very low	93 Å²	93	154.9 Å²	154.9	77%	0.769	83%	0.827	S	S	*	*			trans	-63.3	147.3	177.4	0	0	0	0	0	113.2
215	S	27.2	Very low	27.3	Very low	121 Å²	121	153.3 Å²	153.3	85%	0.846	83%	0.827	S	S	*	*			trans	-124.6	109.1	138.8	55.4	0	0	0	0	108.1
216	T	25.5	Very low	27.2	Very low	121 Å²	121	146.7 Å²	146.7	74%	0.742	82%	0.816	S	S	*	*			trans	-62.9	126.4	168.6	43.1	0	0	0	0	109.8
217	N	28.3	Very low	27.3	Very low	165 Å²	165	143.9 Å²	143.9	88%	0.882	82%	0.816	S	S	*	*			trans	-134.6	123.8	152	-93.3	-17.5	0	0	0	108.2
218	D	25.1	Very low	27.1	Very low	149 Å²	149	146.6 Å²	146.6	80%	0.797	82%	0.815	S	S	*	*			trans	-57.6	129.6	-173.2	-71.4	-60.2	0	0	0	113.9
219	F	28.1	Very low	27.2	Very low	202 Å²	202	151 Å²	151	89%	0.886	83%	0.825	S	S	*	*			trans	-140.2	89.1	155.8	-129.7	-93.2	0	0	0	108.9
220	K	26.1	Very low	27.4	Very low	189 Å²	189	150.7 Å²	150.7	82%	0.822	82%	0.822	S	S	*	*			trans	-89	116.8	162.1	-82	-178.8	176.6	176.9	0	107.8	K222	K220-K222 PolarHBondContact O-N 2.95Å
221	P	29.4	Very low	27.5	Very low	116 Å²	116	147.7 Å²	147.7	75%	0.753	82%	0.819	S	S	*	*			trans	-78	105.8	168.9	30.2	-27.4	0	0	0	108.6	L223	P221-L223 PolarHBondContact O-N 3.05Å
222	K	25.8	Very low	28.1	Very low	202 Å²	202	139.7 Å²	139.7	88%	0.878	80%	0.8	S	S	*	*			trans	-76.3	108.3	162.5	-85.3	179.8	174.8	177.9	0	107.7	K220 S224	K220-K222 PolarHBondContact O-N 2.95Å; K222-S224 PolarHBondContact O-N 2.75Å
223	L	29.5	Very low	29.2	Very low	163 Å²	163	138.5 Å²	138.5	85%	0.853	79%	0.786	S	S	*	*			trans	-81.2	99.9	162.2	-134.5	93.6	0	0	0	107.8	P221 L225	P221-L223 PolarHBondContact O-N 3.05Å; L223-L225 PolarHBondContact O-N 2.96Å
224	S	27.6	Very low	30.4	Very low	111 Å²	111	135.9 Å²	135.9	78%	0.776	77%	0.768	S	S	*	*			trans	-71.3	112.4	172.4	50.7	0	0	0	0	109.9	K222 G226	K222-S224 PolarHBondContact O-N 2.75Å; S224-G226 PolarHBondContact O-N 2.88Å
225	L	28.5	Very low	31.9	Very low	177 Å²	177	132 Å²	132	93%	0.927	73%	0.734	S	S	*	*			trans	-68.4	103.7	170.5	-128.2	85.7	0	0	0	109.3	L223	L223-L225 PolarHBondContact O-N 2.96Å
226	G	27.3	Very low	33.4	Very low	61 Å²	61	130 Å²	130	63%	0.629	72%	0.717	S	S	*	*			trans	-116.4	125.8	172.2	0	0	0	0	0	111	S224	S224-G226 PolarHBondContact O-N 2.88Å
227	S	29.1	Very low	35	Very low	116 Å²	116	130 Å²	130	81%	0.811	71%	0.706	S	S	*	*			trans	54	88.1	161.1	54.3	0	0	0	0	119.3	E229	S227-E229 PolarHBondContact O-N 2.84Å
228	R	25.9	Very low	36.4	Very low	226 Å²	226	122.6 Å²	122.6	85%	0.853	67%	0.668	S	S	*	*				18.7	86.6	126.5	-168.9	165.9	160.2	157.8	-7.2	117.2
229	E	30.1	Very low	38	Very low	189 Å²	189	115.9 Å²	115.9	88%	0.883	63%	0.632	S	S	*	*			trans	-114	119.6	151.6	-78.8	-171.4	163.7	0	0	109.5	S227	S227-E229 PolarHBondContact O-N 2.84Å
230	Q	28	Very low	39.5	Very low	179 Å²	179	108.9 Å²	108.9	84%	0.836	61%	0.609	S	S	*	*			trans	-77.5	126.7	177.6	-71.5	171.8	-37.8	0	0	109.4
231	G	31.1	Very low	41	Very low	80 Å²	80	101.3 Å²	101.3	83%	0.825	58%	0.577	S	S	*	*			trans	133.8	-6.4	154.4	0	0	0	0	0	119.8
232	S	36.4	Very low	42.3	Very low	72 Å²	72	98.2 Å²	98.2	50%	0.503	55%	0.552	S	S	.	*			trans	-85.1	125.1	-178.9	65.3	0	0	0	0	113.2
233	S	51	Low	43.5	Very low	64 Å²	64	92.5 Å²	92.5	45%	0.448	53%	0.531	S	S	.	.			trans	-57.8	143.3	177.2	78.9	0	0	0	0	111.1	L235 T236	S233-L235 PolarHBondContact O-N 3.07Å; S233-L235 VanDerWaalsContact O-N 3.1Å; S233-T236 WeakPolarHBondContact O-CB 3.22Å; S233-T236 PolarHBondContact O-N 3.33Å; S233-T236 PolarHBondContact O-OG1 2.78Å; S233-T236 PolarHBondContact OG-N 2.8Å; S233-T236 PolarHBondContact OG-OG1 3.35Å
234	S	54.1	Low	44.8	Very low	57 Å²	57	90.6 Å²	90.6	40%	0.399	52%	0.518	S	S	.	.	H	α-helix	trans	-55.7	-29.7	179.7	56.9	0	0	0	0	113	K237 A238	S234-K237 PolarHBondContact O-N 3.26Å; S234-A238 PolarHBondContact O-N 3.27Å; S234-A238 VanDerWaalsContact O-N 3.11Å
235	L	56.4	Low	45.7	Very low	13 Å²	13	88.6 Å²	88.6	7%	0.068	50%	0.503	C	S	.	.	H	α-helix	trans	-61.3	-42.1	173.6	-168	75.5	0	0	0	112	P62 V63 D149 A153 S233 K237 A238 L239	P62-L235 HydrophobicContact CB-CD1 3.69Å; P62-L235 HydrophobicContact CB-CD2 3.73Å; P62-L235 HydrophobicContact CB-CG 4.3Å; P62-L235 HydrophobicContact CG-CD2 4.47Å; V63-L235 HydrophobicContact CG2-CB 4.17Å; V63-L235 HydrophobicContact CG2-CD1 4Å; D149-L235 HydrophobicContact CB-CD2 4.18Å; A153-L235 HydrophobicContact CB-CD1 4.11Å; S233-L235 PolarHBondContact O-N 3.07Å; S233-L235 VanDerWaalsContact O-N 3.1Å; L235-K237 VanDerWaalsContact C-N 3.26Å; L235-K237 PolarHBondContact O-N 2.84Å; L235-A238 PolarHBondContact O-N 3.26Å; L235-L239 HydrophobicContact CD2-CD1 4Å; L235-L239 HydrophobicContact CG-CD1 3.77Å; L235-L239 HydrophobicContact CG-CG 4.14Å; L235-L239 WeakPolarHBondContact O-CB 3.31Å; L235-L239 WeakPolarHBondContact O-CG 3.31Å; L235-L239 PolarHBondContact O-N 2.75Å
236	T	59.3	Low	46.5	Very low	78 Å²	78	88.7 Å²	88.7	48%	0.479	50%	0.499	S	S	.	.	H	α-helix	trans	-63.3	-35.1	-179.5	-41.9	0	0	0	0	111.6	S233 S240	S233-T236 WeakPolarHBondContact O-CB 3.22Å; S233-T236 PolarHBondContact O-N 3.33Å; S233-T236 PolarHBondContact O-OG1 2.78Å; S233-T236 PolarHBondContact OG-N 2.8Å; S233-T236 PolarHBondContact OG-OG1 3.35Å; T236-S240 WeakPolarHBondContact O-CB 3.46Å; T236-S240 PolarHBondContact O-N 2.77Å; T236-S240 PolarHBondContact O-OG 2.82Å
237	K	57.3	Low	47.6	Very low	120 Å²	120	86.8 Å²	86.8	52%	0.522	47%	0.473	S	S	.	.	H	α-helix	trans	-72.6	-37.7	174.8	-71.4	-178	-179	177	0	112.8	S234 L235 S240	S234-K237 PolarHBondContact O-N 3.26Å; L235-K237 VanDerWaalsContact C-N 3.26Å; L235-K237 PolarHBondContact O-N 2.84Å; K237-S240 WeakPolarHBondContact CA-OG 3.1Å; K237-S240 PolarHBondContact O-OG 2.98Å
238	A	58	Low	48.4	Very low	10 Å²	10	85.8 Å²	85.8	8%	0.083	46%	0.464	C	S	.	.	H	α-helix	trans	-66.5	-43.8	174.2	0	0	0	0	0	111.2	S234 L235 S240 I241	S234-A238 PolarHBondContact O-N 3.27Å; S234-A238 VanDerWaalsContact O-N 3.11Å; L235-A238 PolarHBondContact O-N 3.26Å; A238-S240 PolarHBondContact O-N 2.86Å; A238-I241 WeakPolarHBondContact O-CB 3.4Å; A238-I241 PolarHBondContact O-N 2.87Å
239	L	59.8	Low	49.7	Very low	9 Å²	9	78 Å²	78	5%	0.047	44%	0.435	C	S	.	.	H	α-helix	trans	-69.3	-31.1	178.6	-68	177.2	0	0	0	113	R152 F156 L235 I241 H242	R152-L239 HydrophobicContact CG-CD1 4.38Å; F156-L239 HydrophobicContact CB-CD2 3.57Å; F156-L239 HydrophobicContact CD2-CD2 3.39Å; F156-L239 HydrophobicContact CE2-CD2 4.32Å; F156-L239 HydrophobicContact CG-CD2 3.61Å; L235-L239 HydrophobicContact CD2-CD1 4Å; L235-L239 HydrophobicContact CG-CD1 3.77Å; L235-L239 HydrophobicContact CG-CG 4.14Å; L235-L239 WeakPolarHBondContact O-CB 3.31Å; L235-L239 WeakPolarHBondContact O-CG 3.31Å; L235-L239 PolarHBondContact O-N 2.75Å; L239-I241 PolarHBondContact O-N 3.21Å; L239-H242 PolarHBondContact O-N 3.43Å
240	S	57.9	Low	51.1	Low	55 Å²	55	71.1 Å²	71.1	39%	0.385	40%	0.403	S	S	.	.	H	α-helix	trans	-66.2	-25.5	178.2	57.7	0	0	0	0	113.2	T236 K237 A238 H242 N243	T236-S240 WeakPolarHBondContact O-CB 3.46Å; T236-S240 PolarHBondContact O-N 2.77Å; T236-S240 PolarHBondContact O-OG 2.82Å; K237-S240 WeakPolarHBondContact CA-OG 3.1Å; K237-S240 PolarHBondContact O-OG 2.98Å; A238-S240 PolarHBondContact O-N 2.86Å; S240-H242 PolarHBondContact O-N 2.99Å; S240-N243 WeakPolarHBondContact O-CB 3.11Å; S240-N243 PolarHBondContact O-N 3.31Å
241	I	58.7	Low	52.9	Low	30 Å²	30	68.8 Å²	68.8	15%	0.154	39%	0.386	C	S	.	.	H	α-helix	trans	-61.2	-36.6	177.2	-64.9	164.6	0	0	0	110.7	W178 A238 L239 N243 E244	W178-I241 HydrophobicContact CH2-CD1 3.69Å; W178-I241 HydrophobicContact CZ3-CD1 4.01Å; A238-I241 WeakPolarHBondContact O-CB 3.4Å; A238-I241 PolarHBondContact O-N 2.87Å; L239-I241 PolarHBondContact O-N 3.21Å; I241-N243 PolarHBondContact O-N 3.3Å; I241-E244 PolarHBondContact O-N 3.49Å
242	H	56.3	Low	55	Low	50 Å²	50	66.8 Å²	66.8	23%	0.231	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-9.2	178.3	-66.1	-74.2	0	0	0	114.2	H66 F156 L239 S240	H66-H242 AromaticContact CE1-NE2 3.53Å; H66-H242 AromaticContact NE2-NE2 3.94Å; F156-H242 HydrophobicContact CD1-CB 4.1Å; F156-H242 PolarHBondContact O-CE1 3.25Å; F156-H242 VanDerWaalsContact O-CE1 3.24Å; F156-H242 PolarHBondContact O-NE2 3.08Å; F156-H242 VanDerWaalsContact O-NE2 3.09Å; L239-H242 PolarHBondContact O-N 3.43Å; S240-H242 PolarHBondContact O-N 2.99Å
243	N	52.3	Low	57.2	Low	82 Å²	82	64 Å²	64	44%	0.439	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-7.9	174.7	-70.6	-28.4	0	0	0	112.8	S240 I241	S240-N243 WeakPolarHBondContact O-CB 3.11Å; S240-N243 PolarHBondContact O-N 3.31Å; I241-N243 PolarHBondContact O-N 3.3Å
244	E	54.9	Low	58.5	Low	123 Å²	123	65.6 Å²	65.6	58%	0.575	33%	0.334	S	S	*	.			trans	-98.8	100.3	179.8	-70.8	-171.4	173.9	0	0	112	I241 Q246 H247 H250	I241-E244 PolarHBondContact O-N 3.49Å; E244-Q246 PolarHBondContact O-N 2.98Å; E244-H247 PolarHBondContact O-N 3.37Å; E244-H250 PolarHBondContact O-CD2 3.07Å
245	C	47	Very low	59.8	Low	69 Å²	69	67.3 Å²	67.3	47%	0.466	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-1.9	-179.2	-55.1	0	0	0	0	115.7
246	Q	46.2	Very low	61	Low	179 Å²	179	68 Å²	68	84%	0.836	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.9	12	-177.3	-65.9	-172.3	-0.9	0	0	113.3	E244	E244-Q246 PolarHBondContact O-N 2.98Å
247	H	50.7	Low	62.2	Low	21 Å²	21	65.3 Å²	65.3	10%	0.097	33%	0.331	C	S	.	.			trans	-69.7	136.7	-177.4	-156.4	-100.1	0	0	0	111.8	Y177 E244 Y249 H250	Y177-H247 AromaticContact CZ-CE1 3.52Å; Y177-H247 AromaticContact CZ-NE2 3.76Å; Y177-H247 PolarHBondContact OH-CE1 3.04Å; Y177-H247 PolarHBondContact OH-NE2 3.48Å; E244-H247 PolarHBondContact O-N 3.37Å; H247-Y249 AromaticContact CE1-CD2 3.13Å; H247-Y249 WeakPolarHBondContact CE1-CD2 3.42Å; H247-Y249 AromaticContact CE1-CE2 3.61Å; H247-Y249 AromaticContact CE1-CG 3.99Å; H247-Y249 AromaticContact ND1-CD2 3.14Å; H247-Y249 WeakPolarHBondContact ND1-CD2 2.79Å; H247-Y249 AromaticContact ND1-CG 3.62Å; H247-Y249 PolarHBondContact O-N 3.23Å; H247-H250 WeakPolarHBondContact O-CB 3.37Å; H247-H250 PolarHBondContact O-N 3Å
248	P	46.2	Very low	63.5	Low	95 Å²	95	65.3 Å²	65.3	62%	0.617	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-10.2	-177.6	20.1	-31.2	0	0	0	115.1	H250	P248-H250 VanDerWaalsContact C-N 3.28Å
249	Y	52.1	Low	64.7	Low	63 Å²	63	69.7 Å²	69.7	25%	0.247	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-21.3	171.4	-84.5	-110.4	0	0	0	113.5	I168 Y177 W178 H247 R251	I168-Y249 HydrophobicContact CD1-CD1 3.96Å; I168-Y249 HydrophobicContact CD1-CE1 3.16Å; I168-Y249 HydrophobicContact CD1-CE2 3.96Å; I168-Y249 WeakPolarHBondContact CD1-OH 3.49Å; I168-Y249 HydrophobicContact CG1-CE1 4.42Å; Y177-Y249 AromaticContact CD1-CE2 3.61Å; Y177-Y249 HydrophobicContact CD1-CE2 3.61Å; Y177-Y249 AromaticContact CD1-CZ 3.57Å; Y177-Y249 WeakPolarHBondContact CD1-OH 3.49Å; Y177-Y249 AromaticContact CD2-CE2 3.85Å; Y177-Y249 HydrophobicContact CD2-CE2 3.85Å; Y177-Y249 AromaticContact CE1-CE2 3.41Å; Y177-Y249 HydrophobicContact CE1-CE2 3.41Å; Y177-Y249 VanDerWaalsContact CE1-CE2 3.41Å; Y177-Y249 AromaticContact CE1-CZ 3.69Å; Y177-Y249 WeakPolarHBondContact CE1-OH 3.26Å; Y177-Y249 HydrophobicContact CE2-CD2 4.5Å; Y177-Y249 AromaticContact CE2-CE2 3.68Å; Y177-Y249 HydrophobicContact CE2-CE2 3.68Å; Y177-Y249 AromaticContact CG-CE2 3.83Å; Y177-Y249 HydrophobicContact CG-CE2 3.83Å; Y177-Y249 AromaticContact CG-CZ 3.99Å; Y177-Y249 VanDerWaalsContact CG-OH 3.23Å; Y177-Y249 AromaticContact CZ-CE2 3.49Å; Y177-Y249 VanDerWaalsContact CZ-CE2 3.49Å; W178-Y249 HydrophobicContact CZ2-CE1 4.32Å; W178-Y249 AromaticContact NE1-CZ 3.99Å; W178-Y249 PolarHBondContact NE1-OH 3.06Å; H247-Y249 AromaticContact CE1-CD2 3.13Å; H247-Y249 WeakPolarHBondContact CE1-CD2 3.42Å; H247-Y249 AromaticContact CE1-CE2 3.61Å; H247-Y249 AromaticContact CE1-CG 3.99Å; H247-Y249 AromaticContact ND1-CD2 3.14Å; H247-Y249 WeakPolarHBondContact ND1-CD2 2.79Å; H247-Y249 AromaticContact ND1-CG 3.62Å; H247-Y249 PolarHBondContact O-N 3.23Å; Y249-R251 PolarHBondContact O-N 3.4Å
250	H	58.7	Low	65.7	Low	44 Å²	44	70.4 Å²	70.4	20%	0.204	37%	0.369	C	S	.	.			trans	-89.4	88.2	-172.8	-64	-46.7	0	0	0	110.6	E244 H247 P248 C295	E244-H250 PolarHBondContact O-CD2 3.07Å; H247-H250 WeakPolarHBondContact O-CB 3.37Å; H247-H250 PolarHBondContact O-N 3Å; P248-H250 VanDerWaalsContact C-N 3.28Å; H250-C295 WeakPolarHBondContact CB-SG 3.47Å; H250-C295 VanDerWaalsContact CE1-SG 3.57Å; H250-C295 WeakPolarHBondContact ND1-CB 3.37Å; H250-C295 PolarHBondContact ND1-SG 3.45Å
251	R	66.3	Low	66.8	Low	130 Å²	130	70 Å²	70	49%	0.491	37%	0.367	S	S	.	.			trans	-108.9	140.3	174.1	-65.7	-173.6	-173	171.7	11.1	110.4	V164 K165 G166 Y249	V164-R251 HydrophobicContact CG1-CB 3.58Å; K165-R251 PolarHBondContact O-NH1 2.78Å; G166-R251 VanDerWaalsContact CA-NH1 3.3Å; G166-R251 PolarHBondContact O-NH1 3.2Å; Y249-R251 PolarHBondContact O-N 3.4Å
252	Y	76.2	Confident	67.5	Low	39 Å²	39	74.9 Å²	74.9	15%	0.153	40%	0.403	C	S	.	.			trans	-113.7	154.1	178	-62	-80.1	0	0	0	110.7	Q254 R293 C295 E298 V299 D300	Y252-Q254 VanDerWaalsContact C-N 3.31Å; Y252-Q254 PolarHBondContact O-N 3.18Å; Y252-R293 WeakPolarHBondContact OH-CA 3.13Å; Y252-R293 PolarHBondContact OH-O 3.17Å; Y252-C295 PolarHBondContact OH-N 3.03Å; Y252-C295 PolarHBondContact OH-SG 3.19Å; Y252-E298 CarbonylContact C-O 3.59Å; Y252-E298 VanDerWaalsContact CA-O 3.31Å; Y252-E298 WeakPolarHBondContact CA-O 3.48Å; Y252-V299 VanDerWaalsContact CD1-C 3.49Å; Y252-D300 HydrophobicContact CD1-CB 3.85Å; Y252-D300 HydrophobicContact CD2-CB 3.88Å; Y252-D300 HydrophobicContact CE1-CB 4.18Å; Y252-D300 HydrophobicContact CE2-CB 4.24Å; Y252-D300 HydrophobicContact CG-CB 3.68Å
253	N	81.1	Confident	68.6	Low	12 Å²	12	74.9 Å²	74.9	6%	0.064	42%	0.417	C	S	.	.			trans	-75.4	86.9	168.4	-172.4	-21	0	0	0	109.2	E163 V164 P255 L256 T257 E298	E163-N253 WeakPolarHBondContact CB-ND2 3.46Å; E163-N253 PolarHBondContact OE2-ND2 3.39Å; V164-N253 HydrophobicContact CG2-CB 4.14Å; N253-P255 WeakPolarHBondContact OD1-CD 3.24Å; N253-L256 HydrophobicContact CB-CB 4.03Å; N253-L256 VanDerWaalsContact CG-CB 3.5Å; N253-L256 PolarHBondContact O-N 3.44Å; N253-L256 PolarHBondContact OD1-N 2.96Å; N253-L256 VanDerWaalsContact OD1-N 3.1Å; N253-T257 WeakPolarHBondContact O-CB 3.36Å; N253-T257 PolarHBondContact O-N 2.86Å; N253-T257 PolarHBondContact O-OG1 3.08Å; N253-E298 HydrophobicContact CB-CG 3.62Å; N253-E298 VanDerWaalsContact CB-OE1 3.26Å; N253-E298 WeakPolarHBondContact CB-OE1 3.47Å; N253-E298 PolarHBondContact N-O 2.92Å; N253-E298 PolarHBondContact ND2-OE1 3.13Å
254	Q	80	Confident	70.1	Confident	98 Å²	98	71.2 Å²	71.2	46%	0.458	40%	0.398	S	S	.	.	H	α-helix	trans	-57.5	-41.7	-179.9	-149.5	70.7	26.2	0	0	113.2	Y252 L256 T257 N258	Y252-Q254 VanDerWaalsContact C-N 3.31Å; Y252-Q254 PolarHBondContact O-N 3.18Å; Q254-L256 PolarHBondContact O-N 2.77Å; Q254-T257 PolarHBondContact O-N 2.97Å; Q254-N258 WeakPolarHBondContact O-CB 3.5Å; Q254-N258 PolarHBondContact O-N 3.16Å; Q254-N258 PolarHBondContact O-ND2 3.34Å
255	P	80.9	Confident	71.8	Confident	93 Å²	93	66.7 Å²	66.7	60%	0.604	38%	0.377	S	S	*	.	H	α-helix	trans	-54.2	-48.5	173.1	-27.4	34	0	0	0	113.3	N253 N258 C259	N253-P255 WeakPolarHBondContact OD1-CD 3.24Å; P255-N258 PolarHBondContact O-N 2.97Å; P255-C259 PolarHBondContact O-N 3.16Å; P255-C259 PolarHBondContact O-SG 3.46Å; P255-C259 VanDerWaalsContact O-SG 3.35Å
256	L	82.1	Confident	73.9	Confident	29 Å²	29	63.4 Å²	63.4	15%	0.152	35%	0.354	C	S	.	.	H	α-helix	trans	-67.7	-41.7	179.3	-172.8	60.5	0	0	0	111.8	F38 N253 Q254 N258 C259 E298 V299	F38-L256 HydrophobicContact CE2-CD2 3.89Å; F38-L256 HydrophobicContact CE2-CG 4.47Å; F38-L256 HydrophobicContact CZ-CD2 4.05Å; N253-L256 HydrophobicContact CB-CB 4.03Å; N253-L256 VanDerWaalsContact CG-CB 3.5Å; N253-L256 PolarHBondContact O-N 3.44Å; N253-L256 PolarHBondContact OD1-N 2.96Å; N253-L256 VanDerWaalsContact OD1-N 3.1Å; Q254-L256 PolarHBondContact O-N 2.77Å; L256-N258 VanDerWaalsContact C-N 3.29Å; L256-N258 PolarHBondContact O-N 2.74Å; L256-C259 WeakPolarHBondContact O-CB 3.49Å; L256-C259 PolarHBondContact O-N 2.89Å; L256-E298 WeakPolarHBondContact CD2-OE2 3.5Å; L256-V299 HydrophobicContact CB-CG2 4.46Å; L256-V299 HydrophobicContact CD2-CG2 3.64Å; L256-V299 HydrophobicContact CG-CG2 3.9Å
257	T	84.4	Confident	76.1	Confident	21 Å²	21	54.9 Å²	54.9	13%	0.129	31%	0.314	C	S	.	.	H	α-helix	trans	-55.8	-42.9	174.8	-51.2	0	0	0	0	112	N253 Q254 C259 L260 V299 D300	N253-T257 WeakPolarHBondContact O-CB 3.36Å; N253-T257 PolarHBondContact O-N 2.86Å; N253-T257 PolarHBondContact O-OG1 3.08Å; Q254-T257 PolarHBondContact O-N 2.97Å; T257-C259 PolarHBondContact O-N 3.41Å; T257-L260 PolarHBondContact O-N 3.4Å; T257-V299 HydrophobicContact CG2-CG1 3.95Å; T257-V299 VanDerWaalsContact OG1-CG1 3.3Å; T257-V299 WeakPolarHBondContact OG1-CG1 3.27Å; T257-D300 HydrophobicContact CG2-CB 4.13Å; T257-D300 PolarHBondContact OG1-N 3.17Å
258	N	83.5	Confident	78.1	Confident	119 Å²	119	53.9 Å²	53.9	64%	0.636	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-16.1	179.8	-68.3	-22.2	0	0	0	113.7	Q254 P255 L256	Q254-N258 WeakPolarHBondContact O-CB 3.5Å; Q254-N258 PolarHBondContact O-N 3.16Å; Q254-N258 PolarHBondContact O-ND2 3.34Å; P255-N258 PolarHBondContact O-N 2.97Å; L256-N258 VanDerWaalsContact C-N 3.29Å; L256-N258 PolarHBondContact O-N 2.74Å
259	C	82.4	Confident	80.5	Confident	103 Å²	103	49.3 Å²	49.3	70%	0.696	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-14.3	177.7	-69.8	0	0	0	0	113.4	P255 L256 T257	P255-C259 PolarHBondContact O-N 3.16Å; P255-C259 PolarHBondContact O-SG 3.46Å; P255-C259 VanDerWaalsContact O-SG 3.35Å; L256-C259 WeakPolarHBondContact O-CB 3.49Å; L256-C259 PolarHBondContact O-N 2.89Å; T257-C259 PolarHBondContact O-N 3.41Å
260	L	82.4	Confident	82.5	Confident	23 Å²	23	46.4 Å²	46.4	12%	0.12	27%	0.269	C	S	.	.	S	Bend	trans	-93.3	147.9	-175.6	-66.3	161.6	0	0	0	111.1	F38 V78 T257 V299 I301	F38-L260 HydrophobicContact CB-CD1 4.23Å; F38-L260 HydrophobicContact CD2-CD1 4.01Å; F38-L260 HydrophobicContact CG-CD1 4.3Å; V78-L260 HydrophobicContact CG1-CD2 3.84Å; V78-L260 HydrophobicContact CG2-CD2 3.79Å; T257-L260 PolarHBondContact O-N 3.4Å; L260-V299 HydrophobicContact CD1-CG1 3.64Å; L260-V299 HydrophobicContact CD1-CG2 4.35Å; L260-I301 HydrophobicContact CB-CD1 3.76Å; L260-I301 HydrophobicContact CD1-CD1 3.26Å; L260-I301 HydrophobicContact CG-CD1 4.07Å
261	S	79.8	Confident	84.1	Confident	47 Å²	47	44.3 Å²	44.3	33%	0.329	26%	0.26	S	S	.	.			trans	-69.1	148.3	-176.1	69.9	0	0	0	0	112.8	Q36 G263 S264	Q36-S261 PolarHBondContact OE1-OG 3.39Å; S261-G263 PolarHBondContact O-N 2.88Å; S261-S264 PolarHBondContact N-OG 3.36Å; S261-S264 VanDerWaalsContact N-OG 3.11Å; S261-S264 WeakPolarHBondContact O-CB 3.2Å; S261-S264 PolarHBondContact O-N 3.27Å; S261-S264 PolarHBondContact O-OG 3.38Å; S261-S264 PolarHBondContact OG-OG 2.82Å
262	S	74	Confident	85.1	Confident	132 Å²	132	38.3 Å²	38.3	92%	0.923	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	108.5	173.2	56.2	0	0	0	0	109.8
263	G	80	Confident	85.6	Confident	51 Å²	51	39 Å²	39	53%	0.526	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	111.2	4.3	-172.7	0	0	0	0	0	114.5	T35 S261	T35-G263 WeakPolarHBondContact CB-O 3.32Å; T35-G263 WeakPolarHBondContact CG2-O 3.33Å; S261-G263 PolarHBondContact O-N 2.88Å
264	S	84	Confident	85.8	Confident	4 Å²	4	38.4 Å²	38.4	3%	0.028	24%	0.241	C	C	.	.			trans	-63.9	147.6	169.5	-49.9	0	0	0	0	110.3	Q36 S261 I301	Q36-S264 WeakPolarHBondContact O-CA 3.39Å; Q36-S264 VanDerWaalsContact O-CB 3.31Å; Q36-S264 WeakPolarHBondContact O-CB 3.42Å; S261-S264 PolarHBondContact N-OG 3.36Å; S261-S264 VanDerWaalsContact N-OG 3.11Å; S261-S264 WeakPolarHBondContact O-CB 3.2Å; S261-S264 PolarHBondContact O-N 3.27Å; S261-S264 PolarHBondContact O-OG 3.38Å; S261-S264 PolarHBondContact OG-OG 2.82Å; S264-I301 VanDerWaalsContact O-CG2 3.3Å; S264-I301 WeakPolarHBondContact O-CG2 3.5Å
265	E	89.1	Confident	85.7	Confident	28 Å²	28	36.6 Å²	36.6	13%	0.131	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	160.5	174.1	-62.8	-169.8	157.9	0	0	109.5	Q36 M37 F38 I301 P302 R304 Y340	Q36-E265 PolarHBondContact O-N 3.21Å; M37-E265 CarbonylContact C-O 3.56Å; M37-E265 VanDerWaalsContact CA-O 3.26Å; M37-E265 WeakPolarHBondContact CA-O 3.37Å; M37-E265 HydrophobicContact CE-CB 4.43Å; M37-E265 WeakPolarHBondContact CG-O 3.44Å; F38-E265 PolarHBondContact N-O 3.3Å; E265-I301 VanDerWaalsContact C-CG2 3.48Å; E265-P302 WeakPolarHBondContact CA-O 3.24Å; E265-R304 HydrophobicContact CB-CB 4.22Å; E265-R304 IonicContact OE1-CZ 2.92Å; E265-R304 IonicContact OE1-NE 3.83Å; E265-R304 PolarHBondContact OE1-NE 2.99Å; E265-R304 IonicContact OE1-NH2 3.13Å; E265-R304 PolarHBondContact OE1-NH2 2.95Å; E265-R304 WeakPolarHBondContact OE2-CB 3.08Å; E265-R304 VanDerWaalsContact OE2-CG 3.28Å; E265-R304 WeakPolarHBondContact OE2-CG 3.32Å; E265-R304 IonicContact OE2-CZ 2.9Å; E265-R304 IonicContact OE2-NE 2.71Å; E265-R304 PolarHBondContact OE2-NE 2.98Å; E265-R304 IonicContact OE2-NH2 3.11Å; E265-Y340 PolarHBondContact OE2-OH 3.06Å
266	A	90.7	Very high	85.7	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	144.1	179.4	0	0	0	0	0	112.5	F38 I301 P302 V303 R304	F38-A266 CarbonylContact O-C 3.5Å; F38-A266 WeakPolarHBondContact O-CA 3.43Å; A266-I301 HydrophobicContact CB-CB 4.38Å; A266-I301 HydrophobicContact CB-CG2 3.86Å; A266-P302 PolarHBondContact N-O 3.02Å; A266-V303 HydrophobicContact CB-CG2 4.02Å; A266-V303 WeakPolarHBondContact O-CA 3.29Å; A266-R304 PolarHBondContact O-N 3.29Å
267	C	93.6	Very high	85.7	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	118.1	169.5	176.4	0	0	0	0	109	M37 F38 I39 E40 F305 M330	M37-C267 HydrophobicContact CG-CB 4.29Å; M37-C267 HydrophobicContact SD-CB 3.7Å; F38-C267 PolarHBondContact O-N 3.25Å; I39-C267 VanDerWaalsContact CA-O 3.29Å; I39-C267 WeakPolarHBondContact CA-O 3.5Å; I39-C267 HydrophobicContact CG1-CB 4.19Å; E40-C267 PolarHBondContact N-O 3.35Å; E40-C267 VanDerWaalsContact N-O 3.08Å; C267-F305 WeakPolarHBondContact CA-O 3.22Å; C267-F305 HydrophobicContact CB-CB 4.17Å; C267-M330 HydrophobicContact CB-CE 4.35Å
268	T	93.4	Very high	85.7	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	125.5	178.5	-51.6	0	0	0	0	110	I270 I296 F305 I306 F307	T268-I270 HydrophobicContact CG2-CD1 4.32Å; T268-I270 HydrophobicContact CG2-CG1 3.95Å; T268-I296 HydrophobicContact CG2-CD1 4.2Å; T268-I296 HydrophobicContact CG2-CG1 4.01Å; T268-F305 PolarHBondContact N-O 3.48Å; T268-I306 CarbonylContact O-C 3.55Å; T268-I306 WeakPolarHBondContact O-CA 3.29Å; T268-F307 PolarHBondContact O-N 2.82Å
269	V	95.1	Very high	85.7	Confident	0 Å²	0	34 Å²	34	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	121.9	179.9	-173.2	0	0	0	0	107.5	I39 E40 L41 Q42 F307 A323 F326 A327	I39-V269 HydrophobicContact CG2-CG2 4.18Å; E40-V269 PolarHBondContact O-N 3.31Å; L41-V269 CarbonylContact C-O 3.58Å; L41-V269 WeakPolarHBondContact CA-O 3.27Å; L41-V269 HydrophobicContact CD1-CB 3.94Å; L41-V269 HydrophobicContact CD1-CG1 3.64Å; Q42-V269 PolarHBondContact N-O 3.12Å; V269-F307 CarbonylContact C-O 3.56Å; V269-F307 WeakPolarHBondContact CA-O 3.46Å; V269-F307 HydrophobicContact CG1-CB 4.42Å; V269-F307 HydrophobicContact CG1-CD1 3.76Å; V269-F307 HydrophobicContact CG2-CB 4.42Å; V269-A323 HydrophobicContact CG1-CB 3.74Å; V269-F326 HydrophobicContact CG2-CD1 4.1Å; V269-A327 HydrophobicContact CG2-CB 3.99Å
270	I	93.8	Very high	85.9	Confident	2 Å²	2	30.3 Å²	30.3	1%	0.01	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	128	-174.1	-58.5	-176.3	0	0	0	108.4	Q42 W71 T268 I296 I306 F307 I308 Y309	Q42-I270 WeakPolarHBondContact O-CA 3.37Å; W71-I270 HydrophobicContact CD2-CG2 3.92Å; W71-I270 HydrophobicContact CE3-CG2 3.38Å; W71-I270 HydrophobicContact CH2-CG2 3.21Å; W71-I270 HydrophobicContact CZ2-CG2 3.77Å; W71-I270 HydrophobicContact CZ3-CB 4.41Å; W71-I270 HydrophobicContact CZ3-CG2 2.99Å; T268-I270 HydrophobicContact CG2-CD1 4.32Å; T268-I270 HydrophobicContact CG2-CG1 3.95Å; I270-I296 HydrophobicContact CD1-CD1 3.75Å; I270-I296 HydrophobicContact CD1-CG1 4.18Å; I270-I306 HydrophobicContact CD1-CG2 4.3Å; I270-F307 PolarHBondContact N-O 2.95Å; I270-I308 WeakPolarHBondContact O-CA 3.21Å; I270-Y309 PolarHBondContact O-N 3.46Å
271	C	93.1	Very high	86.2	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	151.8	-178.7	68.8	0	0	0	0	113	Q42 E43 L44 W71 Y309 A323	Q42-C271 PolarHBondContact O-N 3.42Å; E43-C271 CarbonylContact C-O 3.52Å; E43-C271 VanDerWaalsContact CA-O 3.27Å; E43-C271 WeakPolarHBondContact CA-O 3.37Å; L44-C271 PolarHBondContact N-O 3.4Å; W71-C271 WeakPolarHBondContact CZ3-O 3.31Å; C271-Y309 VanDerWaalsContact CA-O 3.22Å; C271-Y309 WeakPolarHBondContact CA-O 3.35Å; C271-A323 HydrophobicContact CB-CB 3.59Å
272	G	88.2	Confident	86.8	Confident	3 Å²	3	27.1 Å²	27.1	3%	0.031	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.8	165.4	179.9	0	0	0	0	0	115.1	Y309 I310 G311	G272-Y309 PolarHBondContact N-O 3.49Å; G272-I310 VanDerWaalsContact O-CA 3.26Å; G272-I310 WeakPolarHBondContact O-CA 3.14Å; G272-G311 PolarHBondContact O-N 2.72Å
273	L	85.7	Confident	87.7	Confident	54 Å²	54	20.8 Å²	20.8	28%	0.283	12%	0.118	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	128.5	179.4	-66.6	168.1	0	0	0	110.5	F54 G311 Q313 Y319	F54-L273 HydrophobicContact CD2-CB 4.11Å; F54-L273 HydrophobicContact CE2-CB 3.87Å; F54-L273 WeakPolarHBondContact CE2-O 3.49Å; F54-L273 VanDerWaalsContact CZ-O 3.22Å; F54-L273 WeakPolarHBondContact CZ-O 3.41Å; L273-G311 CarbonylContact C-O 3.49Å; L273-G311 WeakPolarHBondContact CA-O 3.36Å; L273-Q313 HydrophobicContact CD2-CB 4.4Å; L273-Y319 HydrophobicContact CD2-CD2 3.51Å; L273-Y319 HydrophobicContact CD2-CE2 3.5Å; L273-Y319 VanDerWaalsContact CD2-CE2 3.5Å; L273-Y319 HydrophobicContact CG-CD2 4.4Å
274	I	85.5	Confident	88.3	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.093	C	C	.	.			trans	-137.2	104.6	175.5	-56.1	179.9	0	0	0	108.1	L44 F59 L151 I154 F276 L277 I310 G311	L44-I274 HydrophobicContact CD2-CD1 4.24Å; L44-I274 HydrophobicContact CD2-CG1 3.8Å; F59-I274 HydrophobicContact CE1-CG2 4.32Å; F59-I274 HydrophobicContact CZ-CG2 4.29Å; L151-I274 HydrophobicContact CD1-CD1 3.95Å; I154-I274 HydrophobicContact CD1-CD1 4.35Å; I154-I274 HydrophobicContact CD1-CG2 4.39Å; I154-I274 HydrophobicContact CG2-CD1 4.09Å; I274-F276 VanDerWaalsContact C-N 3.35Å; I274-F276 HydrophobicContact CG2-CD1 3.48Å; I274-F276 VanDerWaalsContact CG2-CD1 3.48Å; I274-F276 HydrophobicContact CG2-CD2 4.45Å; I274-F276 HydrophobicContact CG2-CE1 3.13Å; I274-F276 HydrophobicContact CG2-CE2 4.18Å; I274-F276 HydrophobicContact CG2-CG 4.14Å; I274-F276 HydrophobicContact CG2-CZ 3.52Å; I274-F276 PolarHBondContact O-N 2.93Å; I274-L277 HydrophobicContact CB-CD1 3.85Å; I274-L277 HydrophobicContact CB-CG 4.08Å; I274-L277 HydrophobicContact CD1-CD1 4.26Å; I274-L277 HydrophobicContact CG2-CD1 4.16Å; I274-L277 HydrophobicContact CG2-CG 3.91Å; I274-L277 PolarHBondContact O-N 2.97Å; I274-I310 HydrophobicContact CD1-CB 4.12Å; I274-I310 HydrophobicContact CD1-CD1 3.91Å; I274-I310 HydrophobicContact CD1-CG1 4.37Å; I274-I310 HydrophobicContact CD1-CG2 4.49Å; I274-G311 PolarHBondContact N-O 3.22Å; I274-G311 CarbonylContact O-C 3.54Å
275	E	77.6	Confident	88.7	Confident	60 Å²	60	18.2 Å²	18.2	28%	0.28	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-29.8	-168.7	-62.8	-177.6	153.6	0	0	114.7	F54 F59 L277	F54-E275 HydrophobicContact CB-CG 4.05Å; F54-E275 VanDerWaalsContact O-CD 3.26Å; F54-E275 VanDerWaalsContact O-OE2 3.13Å; F59-E275 HydrophobicContact CE2-CB 4.43Å; E275-L277 VanDerWaalsContact C-N 3.27Å; E275-L277 PolarHBondContact O-N 3.45Å
276	F	80.6	Confident	88.9	Confident	32 Å²	32	19.2 Å²	19.2	14%	0.14	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-7.7	-176.8	68.6	-99.5	0	0	0	114.2	F59 Q147 V150 L151 I154 I274	F59-F276 HydrophobicContact CB-CD1 3.73Å; F59-F276 HydrophobicContact CB-CE1 4.09Å; F59-F276 AromaticContact CD1-CD1 3.86Å; F59-F276 HydrophobicContact CD1-CD1 3.86Å; F59-F276 AromaticContact CD1-CE1 3.59Å; F59-F276 HydrophobicContact CD1-CE1 3.59Å; F59-F276 AromaticContact CD2-CD1 3.97Å; F59-F276 HydrophobicContact CD2-CD1 3.97Å; F59-F276 HydrophobicContact CE1-CD1 4.41Å; F59-F276 HydrophobicContact CE1-CE1 4.07Å; F59-F276 AromaticContact CG-CD1 3.58Å; F59-F276 HydrophobicContact CG-CD1 3.58Å; F59-F276 AromaticContact CG-CE1 3.83Å; F59-F276 HydrophobicContact CG-CE1 3.83Å; Q147-F276 HydrophobicContact CB-CD2 4.09Å; Q147-F276 HydrophobicContact CB-CE2 4.06Å; Q147-F276 HydrophobicContact CG-CD2 4.07Å; V150-F276 HydrophobicContact CB-CZ 4.39Å; V150-F276 HydrophobicContact CG1-CE1 3.68Å; V150-F276 HydrophobicContact CG1-CZ 3.87Å; L151-F276 HydrophobicContact CB-CE2 4.46Å; L151-F276 HydrophobicContact CB-CZ 4.21Å; I154-F276 HydrophobicContact CD1-CE1 3.81Å; I154-F276 HydrophobicContact CD1-CZ 4.08Å; I274-F276 VanDerWaalsContact C-N 3.35Å; I274-F276 HydrophobicContact CG2-CD1 3.48Å; I274-F276 VanDerWaalsContact CG2-CD1 3.48Å; I274-F276 HydrophobicContact CG2-CD2 4.45Å; I274-F276 HydrophobicContact CG2-CE1 3.13Å; I274-F276 HydrophobicContact CG2-CE2 4.18Å; I274-F276 HydrophobicContact CG2-CG 4.14Å; I274-F276 HydrophobicContact CG2-CZ 3.52Å; I274-F276 PolarHBondContact O-N 2.93Å
277	L	83.7	Confident	88.8	Confident	4 Å²	4	19.3 Å²	19.3	2%	0.021	10%	0.095	C	C	.	.			trans	-74.9	127.8	176.8	-67.8	179.6	0	0	0	110.2	I142 I274 E275 S279 I281 I310 P312	I142-L277 HydrophobicContact CD1-CD2 4.47Å; I142-L277 HydrophobicContact CG1-CD2 3.84Å; I274-L277 HydrophobicContact CB-CD1 3.85Å; I274-L277 HydrophobicContact CB-CG 4.08Å; I274-L277 HydrophobicContact CD1-CD1 4.26Å; I274-L277 HydrophobicContact CG2-CD1 4.16Å; I274-L277 HydrophobicContact CG2-CG 3.91Å; I274-L277 PolarHBondContact O-N 2.97Å; E275-L277 VanDerWaalsContact C-N 3.27Å; E275-L277 PolarHBondContact O-N 3.45Å; L277-S279 VanDerWaalsContact C-N 3.35Å; L277-I281 HydrophobicContact CD1-CD1 3.74Å; L277-I281 HydrophobicContact CD1-CG1 4.24Å; L277-I281 HydrophobicContact CD2-CD1 3.76Å; L277-I281 HydrophobicContact CG-CD1 4.42Å; L277-I310 HydrophobicContact CD1-CG1 4.13Å; L277-P312 WeakPolarHBondContact O-CB 3.3Å; L277-P312 WeakPolarHBondContact O-CG 3.45Å
278	K	82.6	Confident	88.4	Confident	129 Å²	129	22.8 Å²	22.8	56%	0.561	11%	0.113	S	C	*	.	S	Bend	trans	-69	-34.9	175.8	-78.3	-173.6	172.4	166.9	0	113	C141 Q143	C141-K278 PolarHBondContact O-N 3.33Å; Q143-K278 HydrophobicContact CG-CD 4.13Å; Q143-K278 HydrophobicContact CG-CG 4.35Å
279	S	84.1	Confident	88.1	Confident	41 Å²	41	29 Å²	29	29%	0.287	14%	0.141	S	C	.	.	S	Bend	trans	-139	150.6	-175.4	51.1	0	0	0	0	109.3	C141 L277	C141-S279 PolarHBondContact SG-OG 2.77Å; L277-S279 VanDerWaalsContact C-N 3.35Å
280	P	87.4	Confident	87.7	Confident	26 Å²	26	30.8 Å²	30.8	17%	0.169	15%	0.152	C	C	.	.			trans	-65.6	139.1	176.9	28.2	-34.4	0	0	0	110.9	Y309 I310 Y319	P280-Y309 HydrophobicContact CB-CE2 4Å; P280-I310 CarbonylContact C-O 3.56Å; P280-I310 WeakPolarHBondContact CA-O 3.4Å; P280-Y319 HydrophobicContact CB-CE1 4.1Å
281	I	89.3	Confident	87.3	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	111.1	172.4	-59.7	165.5	0	0	0	107	V132 A136 C141 L151 L277 V283 Y309 I310	V132-I281 HydrophobicContact CG1-CG2 4.22Å; A136-I281 HydrophobicContact CB-CD1 3.52Å; A136-I281 HydrophobicContact CB-CG1 4.12Å; C141-I281 HydrophobicContact CB-CD1 4.49Å; C141-I281 HydrophobicContact CB-CG1 4.14Å; L151-I281 HydrophobicContact CD2-CD1 3.86Å; L277-I281 HydrophobicContact CD1-CD1 3.74Å; L277-I281 HydrophobicContact CD1-CG1 4.24Å; L277-I281 HydrophobicContact CD2-CD1 3.76Å; L277-I281 HydrophobicContact CG-CD1 4.42Å; I281-V283 HydrophobicContact CG2-CG2 3.74Å; I281-Y309 WeakPolarHBondContact O-CA 3.22Å; I281-I310 HydrophobicContact CB-CD1 4.43Å; I281-I310 HydrophobicContact CB-CG1 3.83Å; I281-I310 HydrophobicContact CD1-CD1 4.08Å; I281-I310 HydrophobicContact CD1-CG1 4.16Å; I281-I310 HydrophobicContact CG1-CG1 4.46Å; I281-I310 HydrophobicContact CG2-CG1 4.47Å; I281-I310 PolarHBondContact N-O 3.39Å; I281-I310 PolarHBondContact O-N 3.02Å; I281-I310 VanDerWaalsContact O-N 3.08Å
282	L	90.9	Very high	86.7	Confident	2 Å²	2	37.5 Å²	37.5	1%	0.01	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	99.1	177.9	178.6	61	0	0	0	109.4	L111 N114 L115 K116 F307 I308 Y309	L111-L282 HydrophobicContact CD2-CD1 4.31Å; L111-L282 HydrophobicContact CD2-CD2 3.88Å; L111-L282 HydrophobicContact CD2-CG 4.43Å; N114-L282 HydrophobicContact CB-CB 4.16Å; N114-L282 HydrophobicContact CB-CD2 3.95Å; L115-L282 HydrophobicContact CB-CD2 4.12Å; L115-L282 HydrophobicContact CB-CG 4.28Å; L115-L282 HydrophobicContact CD1-CD1 4.29Å; L115-L282 HydrophobicContact CD1-CD2 4.47Å; L115-L282 HydrophobicContact CD1-CG 3.86Å; K116-L282 PolarHBondContact N-O 2.79Å; L282-F307 HydrophobicContact CD1-CE1 4.03Å; L282-F307 HydrophobicContact CD1-CE2 3.86Å; L282-F307 HydrophobicContact CD1-CZ 3.37Å; L282-I308 WeakPolarHBondContact CA-O 3.35Å; L282-Y309 HydrophobicContact CB-CD2 3.84Å; L282-Y309 HydrophobicContact CB-CE2 4.12Å; L282-Y309 HydrophobicContact CD1-CD2 3.57Å; L282-Y309 HydrophobicContact CD1-CE2 4.19Å; L282-Y309 HydrophobicContact CD1-CG 3.81Å; L282-Y309 HydrophobicContact CD2-CE2 4.47Å; L282-Y309 HydrophobicContact CG-CD2 4.18Å; L282-Y309 HydrophobicContact CG-CE2 4.49Å
283	V	92.7	Very high	86.1	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	130.7	-171.8	177.7	0	0	0	0	110.6	K116 I118 V132 Y135 I281 L285 I308	K116-V283 WeakPolarHBondContact O-CA 3.49Å; I118-V283 HydrophobicContact CB-CG1 4.38Å; I118-V283 HydrophobicContact CD1-CG1 3.59Å; I118-V283 HydrophobicContact CD1-CG2 4.5Å; I118-V283 HydrophobicContact CG1-CG1 3.88Å; V132-V283 HydrophobicContact CG1-CG2 4.46Å; V132-V283 HydrophobicContact CG2-CG1 4.3Å; Y135-V283 HydrophobicContact CD1-CG2 3.57Å; Y135-V283 HydrophobicContact CE1-CG2 3.54Å; I281-V283 HydrophobicContact CG2-CG2 3.74Å; V283-L285 HydrophobicContact CG1-CD2 4.48Å; V283-L285 HydrophobicContact CG1-CG 4.18Å; V283-I308 PolarHBondContact N-O 3.14Å; V283-I308 PolarHBondContact O-N 2.66Å
284	L	93.8	Very high	85.6	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	106.2	165.1	177.2	64.3	0	0	0	108.7	L115 K116 I117 I118 R286 F305 F307 F326 V339 I348	L115-L284 HydrophobicContact CD1-CB 4.08Å; K116-L284 PolarHBondContact O-N 3.42Å; I117-L284 WeakPolarHBondContact CA-O 3.4Å; I118-L284 PolarHBondContact N-O 3.05Å; L284-R286 PolarHBondContact O-N 3.45Å; L284-F305 HydrophobicContact CD1-CB 4.44Å; L284-F307 HydrophobicContact CB-CD2 4.27Å; L284-F307 HydrophobicContact CD1-CB 4.28Å; L284-F307 HydrophobicContact CD1-CD2 4.15Å; L284-F326 HydrophobicContact CD1-CE1 4.37Å; L284-F326 HydrophobicContact CD1-CZ 3.86Å; L284-V339 HydrophobicContact CD2-CG1 4.06Å; L284-I348 HydrophobicContact CD2-CD1 3.7Å
285	L	92.4	Very high	85.2	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	113.6	170	-71.4	165.4	0	0	0	109	I118 T120 A128 V132 V283 F305 I306 I308	I118-L285 HydrophobicContact CB-CD2 3.86Å; I118-L285 HydrophobicContact CD1-CD2 4.5Å; I118-L285 HydrophobicContact CG2-CD2 3.85Å; I118-L285 WeakPolarHBondContact O-CA 3.48Å; T120-L285 HydrophobicContact CG2-CD2 4.27Å; A128-L285 HydrophobicContact CB-CD1 4.42Å; V132-L285 HydrophobicContact CG2-CD1 3.53Å; V132-L285 HydrophobicContact CG2-CD2 3.89Å; V132-L285 HydrophobicContact CG2-CG 3.88Å; V283-L285 HydrophobicContact CG1-CD2 4.48Å; V283-L285 HydrophobicContact CG1-CG 4.18Å; L285-F305 WeakPolarHBondContact O-CA 3.12Å; L285-I306 HydrophobicContact CB-CB 4.08Å; L285-I306 WeakPolarHBondContact CB-O 3.21Å; L285-I306 HydrophobicContact CD1-CB 3.98Å; L285-I306 HydrophobicContact CD1-CD1 4.3Å; L285-I306 HydrophobicContact CD1-CG2 4.26Å; L285-I306 PolarHBondContact N-O 2.94Å; L285-I306 PolarHBondContact O-N 2.9Å; L285-I306 VanDerWaalsContact O-N 3.08Å; L285-I308 HydrophobicContact CD1-CD1 4.22Å
286	R	91.7	Very high	85.5	Confident	49 Å²	49	40 Å²	40	19%	0.185	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	111.6	172.4	176.6	174.8	163.5	-172.7	-0.1	108.8	I118 Q119 T120 L284 F305 Y340 S342	I118-R286 PolarHBondContact O-N 2.79Å; Q119-R286 WeakPolarHBondContact CA-O 3.28Å; T120-R286 PolarHBondContact N-O 2.94Å; T120-R286 VanDerWaalsContact N-O 3.07Å; L284-R286 PolarHBondContact O-N 3.45Å; R286-F305 HydrophobicContact CB-CD1 4.43Å; R286-F305 HydrophobicContact CB-CE1 4.38Å; R286-F305 HydrophobicContact CG-CD1 4.41Å; R286-F305 HydrophobicContact CG-CE1 3.93Å; R286-Y340 PolarHBondContact NH1-O 2.94Å; R286-Y340 PolarHBondContact NH2-O 3.15Å; R286-S342 PolarHBondContact NH1-O 3.04Å
287	L	89.8	Confident	85.7	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	114.2	-177.8	-66.2	162.7	0	0	0	110.4	T120 K289 I291 V303 R304 I306	T120-L287 HydrophobicContact CG2-CD2 3.29Å; T120-L287 HydrophobicContact CG2-CG 4.2Å; L287-K289 VanDerWaalsContact C-N 3.27Å; L287-K289 WeakPolarHBondContact CB-O 3.45Å; L287-K289 PolarHBondContact O-N 3.37Å; L287-I291 HydrophobicContact CD1-CD1 3.95Å; L287-I291 HydrophobicContact CD1-CG1 4.05Å; L287-I291 HydrophobicContact CD2-CD1 3.64Å; L287-I291 HydrophobicContact CD2-CG1 3.97Å; L287-I291 HydrophobicContact CG-CD1 4.5Å; L287-V303 HydrophobicContact CD1-CG1 4.14Å; L287-V303 WeakPolarHBondContact CD1-O 3.42Å; L287-R304 VanDerWaalsContact CB-O 3.27Å; L287-R304 WeakPolarHBondContact CB-O 3.27Å; L287-R304 PolarHBondContact N-O 3.29Å; L287-R304 WeakPolarHBondContact O-CD 3.37Å; L287-R304 PolarHBondContact O-NH1 3.5Å; L287-I306 HydrophobicContact CD1-CD1 4.44Å
288	N	85.9	Confident	85.7	Confident	73 Å²	73	38.4 Å²	38.4	39%	0.39	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	-40.8	174.4	-74.8	-20.6	0	0	0	110.7	T120 D121 R304	T120-N288 PolarHBondContact O-N 3.29Å; T120-N288 VanDerWaalsContact O-N 3.12Å; D121-N288 WeakPolarHBondContact OD1-CB 3.35Å; D121-N288 PolarHBondContact OD1-ND2 3.07Å; N288-R304 PolarHBondContact O-NH1 3.31Å
289	K	86.3	Confident	85.9	Confident	132 Å²	132	32.4 Å²	32.4	57%	0.574	16%	0.158	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-113.8	130.7	170.1	-67.3	178.1	-179	172.5	0	109.1	L123 L287	L123-K289 HydrophobicContact CD2-CD 3.92Å; L287-K289 VanDerWaalsContact C-N 3.27Å; L287-K289 WeakPolarHBondContact CB-O 3.45Å; L287-K289 PolarHBondContact O-N 3.37Å
290	T	85.9	Confident	86	Confident	37 Å²	37	32.8 Å²	32.8	23%	0.227	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	141.4	178.6	52	0	0	0	0	111.4	Q292 P302 V303 R304	T290-Q292 PolarHBondContact O-N 3.15Å; T290-P302 VanDerWaalsContact CB-CB 3.49Å; T290-P302 HydrophobicContact CG2-CB 4Å; T290-P302 WeakPolarHBondContact OG1-CB 3.42Å; T290-V303 VanDerWaalsContact CA-O 3.22Å; T290-V303 WeakPolarHBondContact CA-O 3.28Å; T290-V303 WeakPolarHBondContact CB-O 3.31Å; T290-R304 HydrophobicContact CG2-CB 4.1Å
291	I	85.4	Confident	85.9	Confident	4 Å²	4	32.2 Å²	32.2	2%	0.021	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	113.9	174	-58.2	169.5	0	0	0	107	A128 L287 V303	A128-I291 HydrophobicContact CB-CD1 4.07Å; L287-I291 HydrophobicContact CD1-CD1 3.95Å; L287-I291 HydrophobicContact CD1-CG1 4.05Å; L287-I291 HydrophobicContact CD2-CD1 3.64Å; L287-I291 HydrophobicContact CD2-CG1 3.97Å; L287-I291 HydrophobicContact CG-CD1 4.5Å; I291-V303 PolarHBondContact N-O 3.37Å; I291-V303 VanDerWaalsContact N-O 3.09Å; I291-V303 PolarHBondContact O-N 2.84Å
292	Q	82.2	Confident	85.9	Confident	139 Å²	139	33.9 Å²	33.9	65%	0.65	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	148.1	173	-64	-175.5	-5	0	0	109.8	T290 S294 P302	T290-Q292 PolarHBondContact O-N 3.15Å; Q292-S294 PolarHBondContact O-N 3.19Å; Q292-S294 VanDerWaalsContact O-N 3.14Å; Q292-P302 HydrophobicContact CG-CB 4.36Å
293	R	75.1	Confident	85.9	Confident	130 Å²	130	33.8 Å²	33.8	49%	0.491	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	38.6	178.5	-62.8	179	179.6	174.2	3.2	113.6	Y252 C295 D300	Y252-R293 WeakPolarHBondContact OH-CA 3.13Å; Y252-R293 PolarHBondContact OH-O 3.17Å; R293-C295 PolarHBondContact O-N 3.47Å; R293-C295 PolarHBondContact O-SG 2.86Å; R293-D300 WeakPolarHBondContact CG-OD1 3.14Å
294	S	75.2	Confident	85.8	Confident	15 Å²	15	36.2 Å²	36.2	11%	0.105	17%	0.172	C	C	.	.			trans	-66.2	-22.4	-177.6	54.9	0	0	0	0	112.8	L125 Q292 I296 V303	L125-S294 WeakPolarHBondContact CD2-O 3.45Å; Q292-S294 PolarHBondContact O-N 3.19Å; Q292-S294 VanDerWaalsContact O-N 3.14Å; S294-I296 PolarHBondContact O-N 2.95Å; S294-I296 VanDerWaalsContact OG-CG2 3.24Å; S294-I296 WeakPolarHBondContact OG-CG2 3.41Å; S294-V303 VanDerWaalsContact OG-CG2 3.27Å; S294-V303 WeakPolarHBondContact OG-CG2 3.3Å
295	C	76.4	Confident	85.8	Confident	23 Å²	23	36.2 Å²	36.2	16%	0.155	17%	0.172	C	C	.	.	S	Bend	trans	57.7	13.3	-173.7	-45.3	0	0	0	0	113.7	R159 H250 Y252 R293 S297	R159-C295 WeakPolarHBondContact CD-O 3.43Å; H250-C295 WeakPolarHBondContact CB-SG 3.47Å; H250-C295 VanDerWaalsContact CE1-SG 3.57Å; H250-C295 WeakPolarHBondContact ND1-CB 3.37Å; H250-C295 PolarHBondContact ND1-SG 3.45Å; Y252-C295 PolarHBondContact OH-N 3.03Å; Y252-C295 PolarHBondContact OH-SG 3.19Å; R293-C295 PolarHBondContact O-N 3.47Å; R293-C295 PolarHBondContact O-SG 2.86Å; C295-S297 VanDerWaalsContact C-N 3.33Å
296	I	84.9	Confident	85.8	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.172	C	C	.	.	S	Bend	trans	-80.3	-21.2	173.6	-159.7	179.8	0	0	0	111.1	Q42 L125 T268 I270 S294 V303 I306	Q42-I296 PolarHBondContact NE2-O 3.34Å; L125-I296 HydrophobicContact CD1-CB 4.13Å; L125-I296 HydrophobicContact CD1-CD1 3.58Å; L125-I296 HydrophobicContact CD1-CG1 4.18Å; L125-I296 HydrophobicContact CD2-CB 3.98Å; L125-I296 HydrophobicContact CD2-CG1 4.34Å; T268-I296 HydrophobicContact CG2-CD1 4.2Å; T268-I296 HydrophobicContact CG2-CG1 4.01Å; I270-I296 HydrophobicContact CD1-CD1 3.75Å; I270-I296 HydrophobicContact CD1-CG1 4.18Å; S294-I296 PolarHBondContact O-N 2.95Å; S294-I296 VanDerWaalsContact OG-CG2 3.24Å; S294-I296 WeakPolarHBondContact OG-CG2 3.41Å; I296-V303 HydrophobicContact CG2-CG1 4.35Å; I296-V303 HydrophobicContact CG2-CG2 3.68Å; I296-I306 HydrophobicContact CD1-CD1 3.77Å; I296-I306 HydrophobicContact CD1-CG1 4.06Å; I296-I306 HydrophobicContact CD1-CG2 4Å
297	S	84.8	Confident	86	Confident	3 Å²	3	33.9 Å²	33.9	2%	0.021	16%	0.163	C	C	.	.	S	Bend	trans	-122.3	153.1	179.8	-176.1	0	0	0	0	110.8	F38 E40 C295 V299	F38-S297 VanDerWaalsContact CE1-OG 3.31Å; F38-S297 WeakPolarHBondContact CE1-OG 3.43Å; E40-S297 WeakPolarHBondContact OE2-CA 3.4Å; E40-S297 VanDerWaalsContact OE2-CB 3.3Å; E40-S297 WeakPolarHBondContact OE2-CB 3.24Å; E40-S297 PolarHBondContact OE2-OG 2.81Å; C295-S297 VanDerWaalsContact C-N 3.33Å; S297-V299 PolarHBondContact O-N 3.36Å; S297-V299 VanDerWaalsContact O-N 3.17Å
298	E	83.8	Confident	86.1	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.163	C	C	.	.	S	Bend	trans	-58	-28.4	178.9	-166.7	-174.8	-172.3	0	0	112.7	E40 R76 H161 E163 V164 Y252 N253 L256	E40-E298 PolarHBondContact OE2-N 2.92Å; R76-E298 IonicContact NH1-OE2 3.85Å; R76-E298 PolarHBondContact NH1-OE2 3.26Å; H161-E298 HydrophobicContact CB-CB 4.25Å; H161-E298 HydrophobicContact CB-CG 3.78Å; H161-E298 PolarHBondContact CE1-N 2.88Å; H161-E298 VanDerWaalsContact CE1-N 3.26Å; E163-E298 WeakPolarHBondContact CB-OE1 3.31Å; V164-E298 HydrophobicContact CG2-CG 3.55Å; Y252-E298 CarbonylContact C-O 3.59Å; Y252-E298 VanDerWaalsContact CA-O 3.31Å; Y252-E298 WeakPolarHBondContact CA-O 3.48Å; N253-E298 HydrophobicContact CB-CG 3.62Å; N253-E298 VanDerWaalsContact CB-OE1 3.26Å; N253-E298 WeakPolarHBondContact CB-OE1 3.47Å; N253-E298 PolarHBondContact N-O 2.92Å; N253-E298 PolarHBondContact ND2-OE1 3.13Å; L256-E298 WeakPolarHBondContact CD2-OE2 3.5Å
299	V	85.9	Confident	86.4	Confident	3 Å²	3	30.4 Å²	30.4	2%	0.018	14%	0.144	C	C	.	.	S	Bend	trans	-105	139.9	-169	-171.8	0	0	0	0	111	F38 Y252 L256 T257 L260 S297 I301	F38-V299 HydrophobicContact CD1-CB 4.3Å; F38-V299 HydrophobicContact CD1-CG2 3.93Å; F38-V299 HydrophobicContact CD2-CG2 4.15Å; F38-V299 HydrophobicContact CE1-CB 4.32Å; F38-V299 HydrophobicContact CE1-CG2 3.6Å; F38-V299 HydrophobicContact CE2-CG2 3.85Å; F38-V299 HydrophobicContact CG-CG2 4.2Å; F38-V299 HydrophobicContact CZ-CG2 3.56Å; Y252-V299 VanDerWaalsContact CD1-C 3.49Å; L256-V299 HydrophobicContact CB-CG2 4.46Å; L256-V299 HydrophobicContact CD2-CG2 3.64Å; L256-V299 HydrophobicContact CG-CG2 3.9Å; T257-V299 HydrophobicContact CG2-CG1 3.95Å; T257-V299 VanDerWaalsContact OG1-CG1 3.3Å; T257-V299 WeakPolarHBondContact OG1-CG1 3.27Å; L260-V299 HydrophobicContact CD1-CG1 3.64Å; L260-V299 HydrophobicContact CD1-CG2 4.35Å; S297-V299 PolarHBondContact O-N 3.36Å; S297-V299 VanDerWaalsContact O-N 3.17Å; V299-I301 HydrophobicContact CG1-CB 4.31Å; V299-I301 HydrophobicContact CG1-CD1 3.57Å; V299-I301 HydrophobicContact CG1-CG1 3.7Å; V299-I301 PolarHBondContact O-N 2.91Å
300	D	86.3	Confident	86.7	Confident	50 Å²	50	24.1 Å²	24.1	27%	0.267	12%	0.117	S	C	.	.			trans	-78.3	69.2	176.2	-169.5	17.5	0	0	0	111.4	Y252 T257 R293	Y252-D300 HydrophobicContact CD1-CB 3.85Å; Y252-D300 HydrophobicContact CD2-CB 3.88Å; Y252-D300 HydrophobicContact CE1-CB 4.18Å; Y252-D300 HydrophobicContact CE2-CB 4.24Å; Y252-D300 HydrophobicContact CG-CB 3.68Å; T257-D300 HydrophobicContact CG2-CB 4.13Å; T257-D300 PolarHBondContact OG1-N 3.17Å; R293-D300 WeakPolarHBondContact CG-OD1 3.14Å
301	I	86	Confident	86.7	Confident	13 Å²	13	22.3 Å²	22.3	7%	0.067	11%	0.106	C	C	.	.	S	Bend	trans	-126.1	144.1	179.8	-76.6	177	0	0	0	110.5	L260 S264 E265 A266 V299 V303	L260-I301 HydrophobicContact CB-CD1 3.76Å; L260-I301 HydrophobicContact CD1-CD1 3.26Å; L260-I301 HydrophobicContact CG-CD1 4.07Å; S264-I301 VanDerWaalsContact O-CG2 3.3Å; S264-I301 WeakPolarHBondContact O-CG2 3.5Å; E265-I301 VanDerWaalsContact C-CG2 3.48Å; A266-I301 HydrophobicContact CB-CB 4.38Å; A266-I301 HydrophobicContact CB-CG2 3.86Å; V299-I301 HydrophobicContact CG1-CB 4.31Å; V299-I301 HydrophobicContact CG1-CD1 3.57Å; V299-I301 HydrophobicContact CG1-CG1 3.7Å; V299-I301 PolarHBondContact O-N 2.91Å; I301-V303 PolarHBondContact O-N 3.17Å
302	P	89.1	Confident	86.7	Confident	36 Å²	36	23 Å²	23	23%	0.234	11%	0.11	C	C	.	.			trans	-56.5	119	174.5	20.7	-33.5	0	0	0	112.6	E265 A266 T290 Q292	E265-P302 WeakPolarHBondContact CA-O 3.24Å; A266-P302 PolarHBondContact N-O 3.02Å; T290-P302 VanDerWaalsContact CB-CB 3.49Å; T290-P302 HydrophobicContact CG2-CB 4Å; T290-P302 WeakPolarHBondContact OG1-CB 3.42Å; Q292-P302 HydrophobicContact CG-CB 4.36Å
303	V	90.3	Very high	86.5	Confident	1 Å²	1	21.8 Å²	21.8	1%	0.006	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	128.6	176.6	179.8	0	0	0	0	109.7	A266 L287 T290 I291 S294 I296 I301 I306	A266-V303 HydrophobicContact CB-CG2 4.02Å; A266-V303 WeakPolarHBondContact O-CA 3.29Å; L287-V303 HydrophobicContact CD1-CG1 4.14Å; L287-V303 WeakPolarHBondContact CD1-O 3.42Å; T290-V303 VanDerWaalsContact CA-O 3.22Å; T290-V303 WeakPolarHBondContact CA-O 3.28Å; T290-V303 WeakPolarHBondContact CB-O 3.31Å; I291-V303 PolarHBondContact N-O 3.37Å; I291-V303 VanDerWaalsContact N-O 3.09Å; I291-V303 PolarHBondContact O-N 2.84Å; S294-V303 VanDerWaalsContact OG-CG2 3.27Å; S294-V303 WeakPolarHBondContact OG-CG2 3.3Å; I296-V303 HydrophobicContact CG2-CG1 4.35Å; I296-V303 HydrophobicContact CG2-CG2 3.68Å; I301-V303 PolarHBondContact O-N 3.17Å; V303-I306 HydrophobicContact CG1-CD1 4.39Å; V303-I306 HydrophobicContact CG1-CG1 3.82Å
304	R	91	Very high	86.4	Confident	51 Å²	51	19.4 Å²	19.4	19%	0.192	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	-35.2	-179.1	178.3	66.1	74.9	-179.4	6	113.2	E265 A266 L287 N288 T290 Y340	E265-R304 HydrophobicContact CB-CB 4.22Å; E265-R304 IonicContact OE1-CZ 2.92Å; E265-R304 IonicContact OE1-NE 3.83Å; E265-R304 PolarHBondContact OE1-NE 2.99Å; E265-R304 IonicContact OE1-NH2 3.13Å; E265-R304 PolarHBondContact OE1-NH2 2.95Å; E265-R304 WeakPolarHBondContact OE2-CB 3.08Å; E265-R304 VanDerWaalsContact OE2-CG 3.28Å; E265-R304 WeakPolarHBondContact OE2-CG 3.32Å; E265-R304 IonicContact OE2-CZ 2.9Å; E265-R304 IonicContact OE2-NE 2.71Å; E265-R304 PolarHBondContact OE2-NE 2.98Å; E265-R304 IonicContact OE2-NH2 3.11Å; A266-R304 PolarHBondContact O-N 3.29Å; L287-R304 VanDerWaalsContact CB-O 3.27Å; L287-R304 WeakPolarHBondContact CB-O 3.27Å; L287-R304 PolarHBondContact N-O 3.29Å; L287-R304 WeakPolarHBondContact O-CD 3.37Å; L287-R304 PolarHBondContact O-NH1 3.5Å; N288-R304 PolarHBondContact O-NH1 3.31Å; T290-R304 HydrophobicContact CG2-CB 4.1Å; R304-Y340 HydrophobicContact CG-CE1 3.77Å
305	F	93.3	Very high	85.8	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	135	-176.8	-59.1	-72.5	0	0	0	110.1	M37 C267 T268 L284 L285 R286 M330 V339 Y340	M37-F305 HydrophobicContact CE-CD2 3.8Å; M37-F305 HydrophobicContact CE-CE2 3.81Å; M37-F305 HydrophobicContact SD-CD2 4.49Å; C267-F305 WeakPolarHBondContact CA-O 3.22Å; C267-F305 HydrophobicContact CB-CB 4.17Å; T268-F305 PolarHBondContact N-O 3.48Å; L284-F305 HydrophobicContact CD1-CB 4.44Å; L285-F305 WeakPolarHBondContact O-CA 3.12Å; R286-F305 HydrophobicContact CB-CD1 4.43Å; R286-F305 HydrophobicContact CB-CE1 4.38Å; R286-F305 HydrophobicContact CG-CD1 4.41Å; R286-F305 HydrophobicContact CG-CE1 3.93Å; F305-M330 HydrophobicContact CD2-CE 3.76Å; F305-M330 HydrophobicContact CE2-CE 4.09Å; F305-M330 HydrophobicContact CG-CE 4.4Å; F305-V339 HydrophobicContact CD1-CG1 4.05Å; F305-V339 HydrophobicContact CE1-CG1 3.7Å; F305-V339 HydrophobicContact CE2-CG1 4.47Å; F305-V339 HydrophobicContact CZ-CG1 3.94Å; F305-Y340 HydrophobicContact CE2-CD1 4.14Å; F305-Y340 HydrophobicContact CE2-CD2 4.26Å; F305-Y340 AromaticContact CE2-CE1 3.76Å; F305-Y340 HydrophobicContact CE2-CE1 3.76Å; F305-Y340 AromaticContact CE2-CE2 3.87Å; F305-Y340 HydrophobicContact CE2-CE2 3.87Å; F305-Y340 HydrophobicContact CE2-CG 4.36Å; F305-Y340 AromaticContact CE2-CZ 3.6Å; F305-Y340 AromaticContact CZ-CD1 3.64Å; F305-Y340 HydrophobicContact CZ-CD1 3.64Å; F305-Y340 HydrophobicContact CZ-CD2 4.17Å; F305-Y340 AromaticContact CZ-CE1 3.71Å; F305-Y340 HydrophobicContact CZ-CE1 3.71Å; F305-Y340 HydrophobicContact CZ-CE2 4.21Å; F305-Y340 AromaticContact CZ-CG 3.87Å; F305-Y340 HydrophobicContact CZ-CG 3.87Å; F305-Y340 AromaticContact CZ-CZ 3.99Å
306	I	93.5	Very high	85.3	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	115.8	169	-55.4	167.8	0	0	0	107.1	L125 T268 I270 L285 L287 I296 V303 I308	L125-I306 HydrophobicContact CD1-CD1 3.96Å; T268-I306 CarbonylContact O-C 3.55Å; T268-I306 WeakPolarHBondContact O-CA 3.29Å; I270-I306 HydrophobicContact CD1-CG2 4.3Å; L285-I306 HydrophobicContact CB-CB 4.08Å; L285-I306 WeakPolarHBondContact CB-O 3.21Å; L285-I306 HydrophobicContact CD1-CB 3.98Å; L285-I306 HydrophobicContact CD1-CD1 4.3Å; L285-I306 HydrophobicContact CD1-CG2 4.26Å; L285-I306 PolarHBondContact N-O 2.94Å; L285-I306 PolarHBondContact O-N 2.9Å; L285-I306 VanDerWaalsContact O-N 3.08Å; L287-I306 HydrophobicContact CD1-CD1 4.44Å; I296-I306 HydrophobicContact CD1-CD1 3.77Å; I296-I306 HydrophobicContact CD1-CG1 4.06Å; I296-I306 HydrophobicContact CD1-CG2 4Å; V303-I306 HydrophobicContact CG1-CD1 4.39Å; V303-I306 HydrophobicContact CG1-CG1 3.82Å; I306-I308 HydrophobicContact CG2-CD1 4.19Å; I306-I308 HydrophobicContact CG2-CG1 3.9Å
307	F	94.5	Very high	84.4	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	124.5	176.4	-177.5	-91.6	0	0	0	108.9	F107 L111 L115 T268 V269 I270 L282 L284 F326	F107-F307 HydrophobicContact CE2-CZ 4.2Å; F107-F307 HydrophobicContact CZ-CZ 4Å; L111-F307 HydrophobicContact CD2-CE2 4.26Å; L111-F307 HydrophobicContact CD2-CZ 4.31Å; L115-F307 HydrophobicContact CD1-CE2 4.16Å; T268-F307 PolarHBondContact O-N 2.82Å; V269-F307 CarbonylContact C-O 3.56Å; V269-F307 WeakPolarHBondContact CA-O 3.46Å; V269-F307 HydrophobicContact CG1-CB 4.42Å; V269-F307 HydrophobicContact CG1-CD1 3.76Å; V269-F307 HydrophobicContact CG2-CB 4.42Å; I270-F307 PolarHBondContact N-O 2.95Å; L282-F307 HydrophobicContact CD1-CE1 4.03Å; L282-F307 HydrophobicContact CD1-CE2 3.86Å; L282-F307 HydrophobicContact CD1-CZ 3.37Å; L284-F307 HydrophobicContact CB-CD2 4.27Å; L284-F307 HydrophobicContact CD1-CB 4.28Å; L284-F307 HydrophobicContact CD1-CD2 4.15Å; F307-F326 HydrophobicContact CB-CD1 3.8Å; F307-F326 HydrophobicContact CB-CE1 3.58Å; F307-F326 HydrophobicContact CB-CZ 4.35Å; F307-F326 HydrophobicContact CD1-CB 4.45Å; F307-F326 AromaticContact CD1-CD1 3.96Å; F307-F326 HydrophobicContact CD1-CD1 3.96Å; F307-F326 HydrophobicContact CD1-CG 4.21Å; F307-F326 AromaticContact CD2-CD1 3.76Å; F307-F326 HydrophobicContact CD2-CD1 3.76Å; F307-F326 AromaticContact CD2-CD2 3.97Å; F307-F326 HydrophobicContact CD2-CD2 3.97Å; F307-F326 AromaticContact CD2-CE1 3.67Å; F307-F326 HydrophobicContact CD2-CE1 3.67Å; F307-F326 AromaticContact CD2-CE2 3.87Å; F307-F326 HydrophobicContact CD2-CE2 3.87Å; F307-F326 AromaticContact CD2-CG 3.91Å; F307-F326 HydrophobicContact CD2-CG 3.91Å; F307-F326 AromaticContact CD2-CZ 3.73Å; F307-F326 HydrophobicContact CD2-CZ 3.73Å; F307-F326 HydrophobicContact CE1-CB 4.12Å; F307-F326 HydrophobicContact CE1-CD1 4.39Å; F307-F326 HydrophobicContact CE1-CG 4.17Å; F307-F326 HydrophobicContact CE2-CD1 4.24Å; F307-F326 AromaticContact CE2-CD2 3.76Å; F307-F326 HydrophobicContact CE2-CD2 3.76Å; F307-F326 HydrophobicContact CE2-CE1 4.43Å; F307-F326 AromaticContact CE2-CE2 3.96Å; F307-F326 HydrophobicContact CE2-CE2 3.96Å; F307-F326 AromaticContact CE2-CG 3.9Å; F307-F326 HydrophobicContact CE2-CG 3.9Å; F307-F326 HydrophobicContact CE2-CZ 4.3Å; F307-F326 AromaticContact CG-CD1 3.57Å; F307-F326 HydrophobicContact CG-CD1 3.57Å; F307-F326 AromaticContact CG-CE1 3.69Å; F307-F326 HydrophobicContact CG-CE1 3.69Å; F307-F326 HydrophobicContact CG-CG 4.03Å; F307-F326 HydrophobicContact CG-CZ 4.24Å; F307-F326 HydrophobicContact CZ-CB 4.14Å; F307-F326 HydrophobicContact CZ-CD1 4.49Å; F307-F326 HydrophobicContact CZ-CD2 4.15Å; F307-F326 AromaticContact CZ-CG 3.99Å; F307-F326 HydrophobicContact CZ-CG 3.99Å
308	I	93.4	Very high	84	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	123.8	-176.5	-57.2	174.1	0	0	0	108.2	L129 V132 I270 L282 V283 L285 I306 I310	L129-I308 HydrophobicContact CD2-CD1 4.08Å; V132-I308 HydrophobicContact CB-CD1 4.33Å; V132-I308 HydrophobicContact CG1-CD1 3.96Å; V132-I308 HydrophobicContact CG2-CD1 3.77Å; I270-I308 WeakPolarHBondContact O-CA 3.21Å; L282-I308 WeakPolarHBondContact CA-O 3.35Å; V283-I308 PolarHBondContact N-O 3.14Å; V283-I308 PolarHBondContact O-N 2.66Å; L285-I308 HydrophobicContact CD1-CD1 4.22Å; I306-I308 HydrophobicContact CG2-CD1 4.19Å; I306-I308 HydrophobicContact CG2-CG1 3.9Å; I308-I310 HydrophobicContact CG2-CD1 3.94Å; I308-I310 HydrophobicContact CG2-CG1 4.04Å; I308-I310 HydrophobicContact CG2-CG2 4.16Å
309	Y	91.9	Very high	84.2	Confident	1 Å²	1	39.9 Å²	39.9	0%	0.004	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	92.7	172.9	-170	-144.5	0	0	0	111.9	I270 C271 G272 P280 I281 L282 L317 Y319 L322	I270-Y309 PolarHBondContact O-N 3.46Å; C271-Y309 VanDerWaalsContact CA-O 3.22Å; C271-Y309 WeakPolarHBondContact CA-O 3.35Å; G272-Y309 PolarHBondContact N-O 3.49Å; P280-Y309 HydrophobicContact CB-CE2 4Å; I281-Y309 WeakPolarHBondContact O-CA 3.22Å; L282-Y309 HydrophobicContact CB-CD2 3.84Å; L282-Y309 HydrophobicContact CB-CE2 4.12Å; L282-Y309 HydrophobicContact CD1-CD2 3.57Å; L282-Y309 HydrophobicContact CD1-CE2 4.19Å; L282-Y309 HydrophobicContact CD1-CG 3.81Å; L282-Y309 HydrophobicContact CD2-CE2 4.47Å; L282-Y309 HydrophobicContact CG-CD2 4.18Å; L282-Y309 HydrophobicContact CG-CE2 4.49Å; Y309-L317 WeakPolarHBondContact OH-CD2 3.33Å; Y309-Y319 AromaticContact CD1-CD1 3.58Å; Y309-Y319 HydrophobicContact CD1-CD1 3.58Å; Y309-Y319 HydrophobicContact CD1-CE1 4.43Å; Y309-Y319 HydrophobicContact CD1-CG 4.37Å; Y309-Y319 AromaticContact CD2-CD1 3.95Å; Y309-Y319 HydrophobicContact CD2-CD1 3.95Å; Y309-Y319 HydrophobicContact CD2-CE1 4.12Å; Y309-Y319 AromaticContact CE1-CD1 3.43Å; Y309-Y319 HydrophobicContact CE1-CD1 3.43Å; Y309-Y319 VanDerWaalsContact CE1-CD1 3.43Å; Y309-Y319 HydrophobicContact CE1-CE1 4.01Å; Y309-Y319 HydrophobicContact CE1-CG 4.24Å; Y309-Y319 AromaticContact CE2-CD1 3.84Å; Y309-Y319 HydrophobicContact CE2-CD1 3.84Å; Y309-Y319 AromaticContact CE2-CE1 3.71Å; Y309-Y319 HydrophobicContact CE2-CE1 3.71Å; Y309-Y319 AromaticContact CG-CD1 3.84Å; Y309-Y319 HydrophobicContact CG-CD1 3.84Å; Y309-Y319 HydrophobicContact CG-CE1 4.48Å; Y309-Y319 AromaticContact CZ-CD1 3.58Å; Y309-Y319 AromaticContact CZ-CE1 3.65Å; Y309-L322 HydrophobicContact CD1-CB 4.15Å; Y309-L322 HydrophobicContact CE1-CB 3.87Å; Y309-L322 HydrophobicContact CE1-CD1 3.55Å; Y309-L322 HydrophobicContact CE1-CG 4.35Å
310	I	91	Very high	84.2	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	145.7	-176.6	58.6	-173.8	0	0	0	110.2	W71 L151 L155 G272 I274 L277 P280 I281 I308	W71-I310 HydrophobicContact CH2-CG2 4.03Å; L151-I310 HydrophobicContact CD1-CD1 3.92Å; L155-I310 HydrophobicContact CD2-CD1 4.21Å; G272-I310 VanDerWaalsContact O-CA 3.26Å; G272-I310 WeakPolarHBondContact O-CA 3.14Å; I274-I310 HydrophobicContact CD1-CB 4.12Å; I274-I310 HydrophobicContact CD1-CD1 3.91Å; I274-I310 HydrophobicContact CD1-CG1 4.37Å; I274-I310 HydrophobicContact CD1-CG2 4.49Å; L277-I310 HydrophobicContact CD1-CG1 4.13Å; P280-I310 CarbonylContact C-O 3.56Å; P280-I310 WeakPolarHBondContact CA-O 3.4Å; I281-I310 HydrophobicContact CB-CD1 4.43Å; I281-I310 HydrophobicContact CB-CG1 3.83Å; I281-I310 HydrophobicContact CD1-CD1 4.08Å; I281-I310 HydrophobicContact CD1-CG1 4.16Å; I281-I310 HydrophobicContact CG1-CG1 4.46Å; I281-I310 HydrophobicContact CG2-CG1 4.47Å; I281-I310 PolarHBondContact N-O 3.39Å; I281-I310 PolarHBondContact O-N 3.02Å; I281-I310 VanDerWaalsContact O-N 3.08Å; I308-I310 HydrophobicContact CG2-CD1 3.94Å; I308-I310 HydrophobicContact CG2-CG1 4.04Å; I308-I310 HydrophobicContact CG2-CG2 4.16Å
311	G	87.6	Confident	84.1	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.2	-179.6	-179	0	0	0	0	0	114.3	G272 L273 I274 Y319	G272-G311 PolarHBondContact O-N 2.72Å; L273-G311 CarbonylContact C-O 3.49Å; L273-G311 WeakPolarHBondContact CA-O 3.36Å; I274-G311 PolarHBondContact N-O 3.22Å; I274-G311 CarbonylContact O-C 3.54Å; G311-Y319 WeakPolarHBondContact CA-OH 3.5Å
312	P	85	Confident	84.1	Confident	17 Å²	17	41.9 Å²	41.9	11%	0.11	21%	0.214	C	C	.	.			trans	-69.6	162	179	29.8	-34.9	0	0	0	112	L277 N314 Y319	L277-P312 WeakPolarHBondContact O-CB 3.3Å; L277-P312 WeakPolarHBondContact O-CG 3.45Å; P312-N314 PolarHBondContact O-N 3.08Å; P312-N314 VanDerWaalsContact O-N 3.16Å; P312-Y319 WeakPolarHBondContact O-CE2 3.4Å; P312-Y319 PolarHBondContact O-OH 3.19Å
313	Q	78.7	Confident	84.2	Confident	114 Å²	114	40.1 Å²	40.1	53%	0.533	20%	0.203	S	C	.	.			trans	-67.5	113.4	174.4	-171.9	173.3	1.3	0	0	110.5	L273	L273-Q313 HydrophobicContact CD2-CB 4.4Å
314	N	72.3	Confident	84.3	Confident	81 Å²	81	43.2 Å²	43.2	43%	0.433	21%	0.214	S	C	.	.			trans	-132.2	128.4	175.8	-83.6	-15.6	0	0	0	108.9	P312 E316 L317	P312-N314 PolarHBondContact O-N 3.08Å; P312-N314 VanDerWaalsContact O-N 3.16Å; N314-E316 PolarHBondContact O-N 2.78Å; N314-E316 VanDerWaalsContact O-N 3.07Å; N314-L317 HydrophobicContact CB-CB 4.11Å; N314-L317 HydrophobicContact CB-CD1 3.88Å; N314-L317 HydrophobicContact CB-CG 4.1Å; N314-L317 PolarHBondContact O-N 2.82Å
315	D	62.8	Low	84.2	Confident	170 Å²	170	41 Å²	41	91%	0.909	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-21.9	-177.1	-69.2	-24.7	0	0	0	113.6
316	E	64.6	Low	84.2	Confident	178 Å²	178	41 Å²	41	83%	0.832	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-10.3	179	-61.4	-174.2	171.2	0	0	114.4	K110 N314	K110-E316 PolarHBondContact NZ-O 2.86Å; N314-E316 PolarHBondContact O-N 2.78Å; N314-E316 VanDerWaalsContact O-N 3.07Å
317	L	66	Low	84.1	Confident	31 Å²	31	41 Å²	41	16%	0.162	21%	0.206	C	C	.	.			trans	-114.9	93.8	-171.6	-66.5	173.9	0	0	0	111	K110 Y309 N314 Y319	K110-L317 HydrophobicContact CD-CD2 3.71Å; Y309-L317 WeakPolarHBondContact OH-CD2 3.33Å; N314-L317 HydrophobicContact CB-CB 4.11Å; N314-L317 HydrophobicContact CB-CD1 3.88Å; N314-L317 HydrophobicContact CB-CG 4.1Å; N314-L317 PolarHBondContact O-N 2.82Å; L317-Y319 HydrophobicContact CB-CE2 3.99Å; L317-Y319 WeakPolarHBondContact CD1-OH 3.21Å; L317-Y319 WeakPolarHBondContact O-CD2 3.28Å; L317-Y319 PolarHBondContact O-N 3.09Å
318	N	78.1	Confident	83.8	Confident	83 Å²	83	41 Å²	41	44%	0.444	21%	0.206	S	C	.	.			trans	-83.1	89.8	166.8	-167.1	-6.6	0	0	0	110.3	A320 E321 L322	N318-A320 VanDerWaalsContact C-N 3.31Å; N318-A320 PolarHBondContact O-N 2.89Å; N318-E321 HydrophobicContact CB-CB 3.97Å; N318-E321 WeakPolarHBondContact ND2-CB 3.31Å; N318-E321 PolarHBondContact ND2-OE2 3.13Å; N318-E321 PolarHBondContact O-N 2.76Å; N318-E321 PolarHBondContact OD1-N 3.4Å; N318-L322 WeakPolarHBondContact O-CG 3.22Å; N318-L322 PolarHBondContact O-N 2.6Å
319	Y	86.5	Confident	83.6	Confident	8 Å²	8	41 Å²	41	3%	0.031	21%	0.206	C	C	.	.	H	α-helix	trans	-56.6	-42.5	-177.8	-65.9	-83.3	0	0	0	112.6	L273 P280 Y309 G311 P312 L317 L322 A323	L273-Y319 HydrophobicContact CD2-CD2 3.51Å; L273-Y319 HydrophobicContact CD2-CE2 3.5Å; L273-Y319 VanDerWaalsContact CD2-CE2 3.5Å; L273-Y319 HydrophobicContact CG-CD2 4.4Å; P280-Y319 HydrophobicContact CB-CE1 4.1Å; Y309-Y319 AromaticContact CD1-CD1 3.58Å; Y309-Y319 HydrophobicContact CD1-CD1 3.58Å; Y309-Y319 HydrophobicContact CD1-CE1 4.43Å; Y309-Y319 HydrophobicContact CD1-CG 4.37Å; Y309-Y319 AromaticContact CD2-CD1 3.95Å; Y309-Y319 HydrophobicContact CD2-CD1 3.95Å; Y309-Y319 HydrophobicContact CD2-CE1 4.12Å; Y309-Y319 AromaticContact CE1-CD1 3.43Å; Y309-Y319 HydrophobicContact CE1-CD1 3.43Å; Y309-Y319 VanDerWaalsContact CE1-CD1 3.43Å; Y309-Y319 HydrophobicContact CE1-CE1 4.01Å; Y309-Y319 HydrophobicContact CE1-CG 4.24Å; Y309-Y319 AromaticContact CE2-CD1 3.84Å; Y309-Y319 HydrophobicContact CE2-CD1 3.84Å; Y309-Y319 AromaticContact CE2-CE1 3.71Å; Y309-Y319 HydrophobicContact CE2-CE1 3.71Å; Y309-Y319 AromaticContact CG-CD1 3.84Å; Y309-Y319 HydrophobicContact CG-CD1 3.84Å; Y309-Y319 HydrophobicContact CG-CE1 4.48Å; Y309-Y319 AromaticContact CZ-CD1 3.58Å; Y309-Y319 AromaticContact CZ-CE1 3.65Å; G311-Y319 WeakPolarHBondContact CA-OH 3.5Å; P312-Y319 WeakPolarHBondContact O-CE2 3.4Å; P312-Y319 PolarHBondContact O-OH 3.19Å; L317-Y319 HydrophobicContact CB-CE2 3.99Å; L317-Y319 WeakPolarHBondContact CD1-OH 3.21Å; L317-Y319 WeakPolarHBondContact O-CD2 3.28Å; L317-Y319 PolarHBondContact O-N 3.09Å; Y319-L322 PolarHBondContact O-N 2.75Å; Y319-A323 VanDerWaalsContact O-CB 3.24Å; Y319-A323 WeakPolarHBondContact O-CB 3.2Å; Y319-A323 PolarHBondContact O-N 2.84Å
320	A	86.4	Confident	83.5	Confident	25 Å²	25	41 Å²	41	21%	0.207	21%	0.206	C	C	.	.	H	α-helix	trans	-65.7	-42.7	-179.2	0	0	0	0	0	112.3	N318 A323 R324	N318-A320 VanDerWaalsContact C-N 3.31Å; N318-A320 PolarHBondContact O-N 2.89Å; A320-A323 PolarHBondContact O-N 3.43Å; A320-R324 VanDerWaalsContact O-CB 3.31Å; A320-R324 WeakPolarHBondContact O-CB 3.19Å; A320-R324 PolarHBondContact O-N 3.44Å
321	E	84.8	Confident	83.2	Confident	76 Å²	76	41 Å²	41	36%	0.355	21%	0.206	S	C	.	.	H	α-helix	trans	-65.5	-40.3	178.7	-176	172.9	-170.5	0	0	112.1	C103 N318 R324 I325	C103-E321 PolarHBondContact SG-OE1 2.96Å; N318-E321 HydrophobicContact CB-CB 3.97Å; N318-E321 WeakPolarHBondContact ND2-CB 3.31Å; N318-E321 PolarHBondContact ND2-OE2 3.13Å; N318-E321 PolarHBondContact O-N 2.76Å; N318-E321 PolarHBondContact OD1-N 3.4Å; E321-R324 WeakPolarHBondContact O-CB 3.48Å; E321-R324 PolarHBondContact O-N 3.34Å; E321-I325 HydrophobicContact CG-CD1 4.37Å; E321-I325 VanDerWaalsContact O-CG1 3.26Å; E321-I325 WeakPolarHBondContact O-CG1 3.31Å; E321-I325 PolarHBondContact O-N 2.54Å
322	L	86.4	Confident	83	Confident	7 Å²	7	41.9 Å²	41.9	4%	0.037	21%	0.211	C	C	.	.	H	α-helix	trans	-71.3	-40	178.2	-65.3	170	0	0	0	112.2	F107 K110 Y309 N318 Y319 R324 I325 F326	F107-L322 HydrophobicContact CB-CD2 3.71Å; F107-L322 HydrophobicContact CD2-CB 3.82Å; F107-L322 HydrophobicContact CD2-CD2 3.67Å; F107-L322 HydrophobicContact CD2-CG 4.25Å; F107-L322 HydrophobicContact CE2-CB 4.15Å; F107-L322 HydrophobicContact CG-CD2 4.14Å; K110-L322 HydrophobicContact CD-CD1 3.41Å; K110-L322 VanDerWaalsContact CD-CD1 3.41Å; K110-L322 HydrophobicContact CD-CD2 4.42Å; Y309-L322 HydrophobicContact CD1-CB 4.15Å; Y309-L322 HydrophobicContact CE1-CB 3.87Å; Y309-L322 HydrophobicContact CE1-CD1 3.55Å; Y309-L322 HydrophobicContact CE1-CG 4.35Å; N318-L322 WeakPolarHBondContact O-CG 3.22Å; N318-L322 PolarHBondContact O-N 2.6Å; Y319-L322 PolarHBondContact O-N 2.75Å; L322-R324 VanDerWaalsContact C-N 3.32Å; L322-I325 HydrophobicContact CD2-CD1 4.3Å; L322-I325 PolarHBondContact O-N 3.02Å; L322-F326 PolarHBondContact O-N 3.2Å; L322-F326 VanDerWaalsContact O-N 3.08Å
323	A	90.7	Very high	82.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.6	-41.7	172.4	0	0	0	0	0	111.3	L41 V269 C271 Y319 A320 I325 F326 A327	L41-A323 HydrophobicContact CD1-CB 3.63Å; V269-A323 HydrophobicContact CG1-CB 3.74Å; C271-A323 HydrophobicContact CB-CB 3.59Å; Y319-A323 VanDerWaalsContact O-CB 3.24Å; Y319-A323 WeakPolarHBondContact O-CB 3.2Å; Y319-A323 PolarHBondContact O-N 2.84Å; A320-A323 PolarHBondContact O-N 3.43Å; A323-I325 PolarHBondContact O-N 2.94Å; A323-F326 PolarHBondContact O-N 2.86Å; A323-A327 PolarHBondContact O-N 3.05Å
324	R	91.5	Very high	82.9	Confident	65 Å²	65	41 Å²	41	25%	0.245	21%	0.211	C	C	.	.	H	α-helix	trans	-60.2	-43.8	172.9	-163.4	-179	91.8	141.5	1.3	111.8	L41 W77 E81 P98 A320 E321 L322 F326 A327 V328	L41-R324 HydrophobicContact CD2-CB 4.15Å; L41-R324 HydrophobicContact CD2-CG 4.46Å; W77-R324 HydrophobicContact CH2-CG 3.99Å; W77-R324 HydrophobicContact CZ2-CG 3.8Å; E81-R324 WeakPolarHBondContact OE1-CD 3.45Å; E81-R324 IonicContact OE1-CZ 3.93Å; E81-R324 IonicContact OE1-NE 3.55Å; E81-R324 IonicContact OE1-NH1 3.61Å; E81-R324 PolarHBondContact OE1-NH1 2.83Å; E81-R324 IonicContact OE2-CZ 3.29Å; E81-R324 IonicContact OE2-NH1 2.88Å; E81-R324 PolarHBondContact OE2-NH1 3.39Å; P98-R324 PolarHBondContact O-NH2 2.9Å; A320-R324 VanDerWaalsContact O-CB 3.31Å; A320-R324 WeakPolarHBondContact O-CB 3.19Å; A320-R324 PolarHBondContact O-N 3.44Å; E321-R324 WeakPolarHBondContact O-CB 3.48Å; E321-R324 PolarHBondContact O-N 3.34Å; L322-R324 VanDerWaalsContact C-N 3.32Å; R324-F326 VanDerWaalsContact C-N 3.33Å; R324-F326 PolarHBondContact O-N 2.97Å; R324-A327 WeakPolarHBondContact O-CB 3.48Å; R324-A327 PolarHBondContact O-N 3.44Å; R324-V328 HydrophobicContact CG-CG2 4.38Å; R324-V328 VanDerWaalsContact O-CG2 3.27Å; R324-V328 WeakPolarHBondContact O-CG2 3.44Å; R324-V328 PolarHBondContact O-N 3.01Å
325	I	89.6	Confident	83.6	Confident	4 Å²	4	37.1 Å²	37.1	2%	0.021	19%	0.19	C	C	.	.	H	α-helix	trans	-58.8	-45.1	177.3	-71.2	163.2	0	0	0	111	M99 C103 I104 F107 E321 L322 A323 V328 M329	M99-I325 HydrophobicContact SD-CB 4.18Å; M99-I325 HydrophobicContact SD-CG1 3.87Å; M99-I325 HydrophobicContact SD-CG2 4.17Å; C103-I325 HydrophobicContact CB-CD1 3.52Å; I104-I325 HydrophobicContact CG1-CG2 4.46Å; F107-I325 HydrophobicContact CB-CG2 4.28Å; F107-I325 HydrophobicContact CD1-CG2 3.82Å; F107-I325 HydrophobicContact CE1-CG2 4.4Å; F107-I325 HydrophobicContact CG-CG2 4.07Å; E321-I325 HydrophobicContact CG-CD1 4.37Å; E321-I325 VanDerWaalsContact O-CG1 3.26Å; E321-I325 WeakPolarHBondContact O-CG1 3.31Å; E321-I325 PolarHBondContact O-N 2.54Å; L322-I325 HydrophobicContact CD2-CD1 4.3Å; L322-I325 PolarHBondContact O-N 3.02Å; A323-I325 PolarHBondContact O-N 2.94Å; I325-V328 PolarHBondContact O-N 2.69Å; I325-M329 HydrophobicContact CG2-CE 3.84Å; I325-M329 HydrophobicContact CG2-SD 4.36Å; I325-M329 WeakPolarHBondContact O-CG 3.23Å; I325-M329 PolarHBondContact O-N 3.23Å
326	F	92.3	Very high	84.8	Confident	1 Å²	1	30 Å²	30	0%	0.004	15%	0.151	C	C	.	.	H	α-helix	trans	-60.6	-47.1	174.7	-174	-97.2	0	0	0	112.3	F107 V269 L284 F307 L322 A323 R324 V328 M329 M330 F335	F107-F326 HydrophobicContact CE1-CB 4.23Å; F107-F326 HydrophobicContact CE1-CD2 4.22Å; F107-F326 HydrophobicContact CZ-CB 3.74Å; F107-F326 AromaticContact CZ-CD2 3.97Å; F107-F326 HydrophobicContact CZ-CD2 3.97Å; F107-F326 HydrophobicContact CZ-CG 4.3Å; V269-F326 HydrophobicContact CG2-CD1 4.1Å; L284-F326 HydrophobicContact CD1-CE1 4.37Å; L284-F326 HydrophobicContact CD1-CZ 3.86Å; F307-F326 HydrophobicContact CB-CD1 3.8Å; F307-F326 HydrophobicContact CB-CE1 3.58Å; F307-F326 HydrophobicContact CB-CZ 4.35Å; F307-F326 HydrophobicContact CD1-CB 4.45Å; F307-F326 AromaticContact CD1-CD1 3.96Å; F307-F326 HydrophobicContact CD1-CD1 3.96Å; F307-F326 HydrophobicContact CD1-CG 4.21Å; F307-F326 AromaticContact CD2-CD1 3.76Å; F307-F326 HydrophobicContact CD2-CD1 3.76Å; F307-F326 AromaticContact CD2-CD2 3.97Å; F307-F326 HydrophobicContact CD2-CD2 3.97Å; F307-F326 AromaticContact CD2-CE1 3.67Å; F307-F326 HydrophobicContact CD2-CE1 3.67Å; F307-F326 AromaticContact CD2-CE2 3.87Å; F307-F326 HydrophobicContact CD2-CE2 3.87Å; F307-F326 AromaticContact CD2-CG 3.91Å; F307-F326 HydrophobicContact CD2-CG 3.91Å; F307-F326 AromaticContact CD2-CZ 3.73Å; F307-F326 HydrophobicContact CD2-CZ 3.73Å; F307-F326 HydrophobicContact CE1-CB 4.12Å; F307-F326 HydrophobicContact CE1-CD1 4.39Å; F307-F326 HydrophobicContact CE1-CG 4.17Å; F307-F326 HydrophobicContact CE2-CD1 4.24Å; F307-F326 AromaticContact CE2-CD2 3.76Å; F307-F326 HydrophobicContact CE2-CD2 3.76Å; F307-F326 HydrophobicContact CE2-CE1 4.43Å; F307-F326 AromaticContact CE2-CE2 3.96Å; F307-F326 HydrophobicContact CE2-CE2 3.96Å; F307-F326 AromaticContact CE2-CG 3.9Å; F307-F326 HydrophobicContact CE2-CG 3.9Å; F307-F326 HydrophobicContact CE2-CZ 4.3Å; F307-F326 AromaticContact CG-CD1 3.57Å; F307-F326 HydrophobicContact CG-CD1 3.57Å; F307-F326 AromaticContact CG-CE1 3.69Å; F307-F326 HydrophobicContact CG-CE1 3.69Å; F307-F326 HydrophobicContact CG-CG 4.03Å; F307-F326 HydrophobicContact CG-CZ 4.24Å; F307-F326 HydrophobicContact CZ-CB 4.14Å; F307-F326 HydrophobicContact CZ-CD1 4.49Å; F307-F326 HydrophobicContact CZ-CD2 4.15Å; F307-F326 AromaticContact CZ-CG 3.99Å; F307-F326 HydrophobicContact CZ-CG 3.99Å; L322-F326 PolarHBondContact O-N 3.2Å; L322-F326 VanDerWaalsContact O-N 3.08Å; A323-F326 PolarHBondContact O-N 2.86Å; R324-F326 VanDerWaalsContact C-N 3.33Å; R324-F326 PolarHBondContact O-N 2.97Å; F326-V328 VanDerWaalsContact C-N 3.32Å; F326-V328 PolarHBondContact O-N 3.48Å; F326-M329 PolarHBondContact O-N 2.91Å; F326-M330 HydrophobicContact CD1-CG 4.11Å; F326-M330 HydrophobicContact CE1-CG 3.66Å; F326-M330 HydrophobicContact CE1-SD 4.28Å; F326-M330 HydrophobicContact CZ-CG 3.93Å; F326-M330 HydrophobicContact CZ-SD 4Å; F326-M330 WeakPolarHBondContact O-CG 3.45Å; F326-M330 PolarHBondContact O-N 2.72Å; F326-F335 HydrophobicContact CD2-CZ 4.49Å; F326-F335 HydrophobicContact CE2-CE1 4.19Å; F326-F335 HydrophobicContact CE2-CZ 4.22Å
327	A	92.1	Very high	85.8	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-57.5	-44.5	177.4	0	0	0	0	0	111.8	I39 W77 V269 A323 R324 M330	I39-A327 HydrophobicContact CG2-CB 3.73Å; W77-A327 HydrophobicContact CD2-CB 4.36Å; W77-A327 HydrophobicContact CE3-CB 3.84Å; W77-A327 HydrophobicContact CH2-CB 3.72Å; W77-A327 HydrophobicContact CZ2-CB 4.22Å; W77-A327 HydrophobicContact CZ3-CB 3.52Å; V269-A327 HydrophobicContact CG2-CB 3.99Å; A323-A327 PolarHBondContact O-N 3.05Å; R324-A327 WeakPolarHBondContact O-CB 3.48Å; R324-A327 PolarHBondContact O-N 3.44Å; A327-M330 PolarHBondContact O-N 2.87Å
328	V	88.8	Confident	86.8	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-67.1	-41	178.6	-179.2	0	0	0	0	111.5	L7 W77 P97 M99 R324 I325 F326 M330 T331	L7-V328 HydrophobicContact CD1-CG1 3.65Å; L7-V328 HydrophobicContact CD2-CG1 3.3Å; L7-V328 HydrophobicContact CG-CG1 3.96Å; W77-V328 HydrophobicContact CZ2-CG2 3.96Å; P97-V328 HydrophobicContact CB-CB 4.39Å; P97-V328 HydrophobicContact CB-CG1 3.72Å; P97-V328 HydrophobicContact CB-CG2 3.61Å; P97-V328 HydrophobicContact CG-CB 4.38Å; P97-V328 HydrophobicContact CG-CG1 3.37Å; P97-V328 HydrophobicContact CG-CG2 4.01Å; M99-V328 HydrophobicContact CE-CB 3.62Å; M99-V328 HydrophobicContact CE-CG1 3.15Å; M99-V328 HydrophobicContact CE-CG2 4.5Å; M99-V328 HydrophobicContact SD-CB 3.77Å; M99-V328 HydrophobicContact SD-CG1 3.91Å; M99-V328 HydrophobicContact SD-CG2 4.24Å; R324-V328 HydrophobicContact CG-CG2 4.38Å; R324-V328 VanDerWaalsContact O-CG2 3.27Å; R324-V328 WeakPolarHBondContact O-CG2 3.44Å; R324-V328 PolarHBondContact O-N 3.01Å; I325-V328 PolarHBondContact O-N 2.69Å; F326-V328 VanDerWaalsContact C-N 3.32Å; F326-V328 PolarHBondContact O-N 3.48Å; V328-M330 VanDerWaalsContact C-N 3.3Å; V328-M330 PolarHBondContact O-N 3.15Å; V328-T331 WeakPolarHBondContact O-CB 3.43Å; V328-T331 PolarHBondContact O-N 3.43Å; V328-T331 VanDerWaalsContact O-N 3.13Å; V328-T331 PolarHBondContact O-OG1 3.22Å
329	M	88.9	Confident	87.4	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-63.6	-35	176.3	-70.6	-172.9	-59.8	0	0	112.5	F107 I325 F326 T331 N332 F335 I352 F355	F107-M329 HydrophobicContact CD1-CE 3.56Å; F107-M329 HydrophobicContact CE1-CE 3.29Å; F107-M329 HydrophobicContact CZ-CE 4.44Å; I325-M329 HydrophobicContact CG2-CE 3.84Å; I325-M329 HydrophobicContact CG2-SD 4.36Å; I325-M329 WeakPolarHBondContact O-CG 3.23Å; I325-M329 PolarHBondContact O-N 3.23Å; F326-M329 PolarHBondContact O-N 2.91Å; M329-T331 PolarHBondContact O-N 3.46Å; M329-N332 WeakPolarHBondContact O-CB 3.47Å; M329-N332 PolarHBondContact O-N 3.2Å; M329-F335 VanDerWaalsContact C-CD1 3.43Å; M329-F335 HydrophobicContact CB-CD1 3.64Å; M329-F335 HydrophobicContact CB-CD2 4.33Å; M329-F335 HydrophobicContact CB-CE1 3.7Å; M329-F335 HydrophobicContact CB-CE2 4.43Å; M329-F335 HydrophobicContact CB-CG 3.96Å; M329-F335 HydrophobicContact CB-CZ 4.12Å; M329-F335 HydrophobicContact CE-CE2 4.4Å; M329-F335 HydrophobicContact CE-CZ 4.1Å; M329-F335 WeakPolarHBondContact O-CB 3.06Å; M329-F335 VanDerWaalsContact O-CD1 3.31Å; M329-F335 WeakPolarHBondContact O-CD1 3.45Å; M329-F335 HydrophobicContact SD-CE2 4.33Å; M329-I352 HydrophobicContact CE-CG1 4.48Å; M329-I352 HydrophobicContact SD-CG1 4.23Å; M329-F355 HydrophobicContact CB-CD2 4.43Å; M329-F355 HydrophobicContact CB-CE2 4.41Å; M329-F355 HydrophobicContact CG-CD1 3.97Å; M329-F355 HydrophobicContact CG-CD2 4.21Å; M329-F355 HydrophobicContact CG-CE1 3.83Å; M329-F355 HydrophobicContact CG-CE2 4.07Å; M329-F355 HydrophobicContact CG-CG 4.16Å; M329-F355 HydrophobicContact CG-CZ 3.88Å; M329-F355 HydrophobicContact SD-CD1 4.09Å; M329-F355 HydrophobicContact SD-CE1 4.35Å; M329-F355 HydrophobicContact SD-CG 4.46Å
330	M	89.9	Confident	87.4	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62.8	-20.4	175.3	-75	-63.9	-66.7	0	0	113.8	M37 I39 C267 F305 F326 A327 V328 N332 F335 R336 V339	M37-M330 HydrophobicContact CE-CE 4.2Å; M37-M330 HydrophobicContact SD-CE 3.52Å; M37-M330 VanDerWaalsContact SD-CE 3.52Å; I39-M330 HydrophobicContact CD1-CB 3.62Å; I39-M330 HydrophobicContact CG1-CB 4.29Å; C267-M330 HydrophobicContact CB-CE 4.35Å; F305-M330 HydrophobicContact CD2-CE 3.76Å; F305-M330 HydrophobicContact CE2-CE 4.09Å; F305-M330 HydrophobicContact CG-CE 4.4Å; F326-M330 HydrophobicContact CD1-CG 4.11Å; F326-M330 HydrophobicContact CE1-CG 3.66Å; F326-M330 HydrophobicContact CE1-SD 4.28Å; F326-M330 HydrophobicContact CZ-CG 3.93Å; F326-M330 HydrophobicContact CZ-SD 4Å; F326-M330 WeakPolarHBondContact O-CG 3.45Å; F326-M330 PolarHBondContact O-N 2.72Å; A327-M330 PolarHBondContact O-N 2.87Å; V328-M330 VanDerWaalsContact C-N 3.3Å; V328-M330 PolarHBondContact O-N 3.15Å; M330-N332 PolarHBondContact O-N 3Å; M330-F335 HydrophobicContact CG-CE1 4.23Å; M330-F335 HydrophobicContact SD-CD1 4.05Å; M330-F335 HydrophobicContact SD-CE1 3.85Å; M330-R336 HydrophobicContact CE-CG 4.02Å; M330-R336 PolarHBondContact O-NH1 3.03Å; M330-V339 HydrophobicContact CE-CG1 4.39Å; M330-V339 HydrophobicContact SD-CB 4.11Å; M330-V339 HydrophobicContact SD-CG1 4.12Å; M330-V339 HydrophobicContact SD-CG2 3.82Å
331	T	85.3	Confident	87.4	Confident	2 Å²	2	27.5 Å²	27.5	1%	0.012	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-23.9	173.3	69.7	0	0	0	0	112.6	L7 I39 W77 V328 M329 R336	L7-T331 WeakPolarHBondContact CD1-OG1 3.34Å; I39-T331 HydrophobicContact CD1-CG2 3.67Å; W77-T331 HydrophobicContact CB-CG2 3.69Å; W77-T331 HydrophobicContact CG-CG2 3.88Å; V328-T331 WeakPolarHBondContact O-CB 3.43Å; V328-T331 PolarHBondContact O-N 3.43Å; V328-T331 VanDerWaalsContact O-N 3.13Å; V328-T331 PolarHBondContact O-OG1 3.22Å; M329-T331 PolarHBondContact O-N 3.46Å; T331-R336 PolarHBondContact O-NH1 3.4Å
332	N	82.5	Confident	87.4	Confident	18 Å²	18	24 Å²	24	10%	0.096	12%	0.122	C	C	.	.	S	Bend	trans	-81.4	129.4	178.4	172.4	-67.4	0	0	0	110.6	M329 M330 T334 F335 R336 F355	M329-N332 WeakPolarHBondContact O-CB 3.47Å; M329-N332 PolarHBondContact O-N 3.2Å; M330-N332 PolarHBondContact O-N 3Å; N332-T334 PolarHBondContact O-N 3.36Å; N332-T334 WeakPolarHBondContact OD1-CA 3.33Å; N332-T334 PolarHBondContact OD1-N 3.34Å; N332-T334 PolarHBondContact OD1-OG1 3.5Å; N332-F335 HydrophobicContact CB-CB 4.34Å; N332-F335 PolarHBondContact OD1-N 3.18Å; N332-R336 WeakPolarHBondContact O-CB 3.38Å; N332-R336 PolarHBondContact O-N 2.81Å; N332-F355 HydrophobicContact CB-CD2 3.59Å; N332-F355 HydrophobicContact CB-CE2 3.71Å
333	D	81.2	Confident	87.3	Confident	66 Å²	66	29.8 Å²	29.8	35%	0.353	15%	0.152	S	C	.	.	H	α-helix	trans	-64.7	-37.5	-175.1	-66	-1.6	0	0	0	112.7	R336 L337	D333-R336 IonicContact OD1-CZ 2.85Å; D333-R336 IonicContact OD1-NH1 3.89Å; D333-R336 PolarHBondContact OD1-NH1 3.02Å; D333-R336 IonicContact OD1-NH2 3.16Å; D333-R336 PolarHBondContact OD1-NH2 3.41Å; D333-L337 WeakPolarHBondContact O-CB 3.26Å; D333-L337 VanDerWaalsContact O-CG 3.23Å; D333-L337 WeakPolarHBondContact O-CG 3.31Å; D333-L337 PolarHBondContact O-N 2.87Å
334	T	80	Confident	87.1	Confident	46 Å²	46	32 Å²	32	28%	0.282	17%	0.167	S	C	.	.	H	α-helix	trans	-71.5	-44.4	-178.5	58.4	0	0	0	0	111.5	N332 L337 C338 D358	N332-T334 PolarHBondContact O-N 3.36Å; N332-T334 WeakPolarHBondContact OD1-CA 3.33Å; N332-T334 PolarHBondContact OD1-N 3.34Å; N332-T334 PolarHBondContact OD1-OG1 3.5Å; T334-L337 PolarHBondContact O-N 2.78Å; T334-C338 PolarHBondContact O-N 2.72Å; T334-C338 VanDerWaalsContact O-N 3.15Å; T334-C338 PolarHBondContact O-SG 2.89Å; T334-C338 VanDerWaalsContact O-SG 3.38Å; T334-D358 WeakPolarHBondContact CB-OD2 3.31Å; T334-D358 WeakPolarHBondContact CG2-OD2 3.45Å; T334-D358 PolarHBondContact OG1-OD2 3.02Å
335	F	87.8	Confident	87	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.8	-46.5	172.6	-177.3	-100.1	0	0	0	111.6	F326 M329 M330 N332 L337 C338 V339 I348 I352 F355	F326-F335 HydrophobicContact CD2-CZ 4.49Å; F326-F335 HydrophobicContact CE2-CE1 4.19Å; F326-F335 HydrophobicContact CE2-CZ 4.22Å; M329-F335 VanDerWaalsContact C-CD1 3.43Å; M329-F335 HydrophobicContact CB-CD1 3.64Å; M329-F335 HydrophobicContact CB-CD2 4.33Å; M329-F335 HydrophobicContact CB-CE1 3.7Å; M329-F335 HydrophobicContact CB-CE2 4.43Å; M329-F335 HydrophobicContact CB-CG 3.96Å; M329-F335 HydrophobicContact CB-CZ 4.12Å; M329-F335 HydrophobicContact CE-CE2 4.4Å; M329-F335 HydrophobicContact CE-CZ 4.1Å; M329-F335 WeakPolarHBondContact O-CB 3.06Å; M329-F335 VanDerWaalsContact O-CD1 3.31Å; M329-F335 WeakPolarHBondContact O-CD1 3.45Å; M329-F335 HydrophobicContact SD-CE2 4.33Å; M330-F335 HydrophobicContact CG-CE1 4.23Å; M330-F335 HydrophobicContact SD-CD1 4.05Å; M330-F335 HydrophobicContact SD-CE1 3.85Å; N332-F335 HydrophobicContact CB-CB 4.34Å; N332-F335 PolarHBondContact OD1-N 3.18Å; F335-L337 VanDerWaalsContact C-N 3.33Å; F335-L337 PolarHBondContact O-N 3.27Å; F335-C338 WeakPolarHBondContact O-CA 3.43Å; F335-C338 WeakPolarHBondContact O-CB 3.48Å; F335-C338 PolarHBondContact O-N 3.42Å; F335-C338 VanDerWaalsContact O-N 3.08Å; F335-V339 HydrophobicContact CD1-CG2 4Å; F335-V339 HydrophobicContact CE1-CG2 3.56Å; F335-V339 HydrophobicContact CZ-CG2 3.86Å; F335-V339 PolarHBondContact O-N 3.32Å; F335-I348 HydrophobicContact CE2-CG2 4.38Å; F335-I348 HydrophobicContact CZ-CG2 4.28Å; F335-I352 HydrophobicContact CD2-CG1 4.49Å; F335-I352 HydrophobicContact CE2-CG1 3.72Å; F335-F355 HydrophobicContact CB-CB 4.24Å; F335-F355 HydrophobicContact CB-CD2 4.33Å; F335-F355 HydrophobicContact CD2-CB 4.31Å
336	R	87.8	Confident	87	Confident	21 Å²	21	34.9 Å²	34.9	8%	0.079	19%	0.189	C	C	.	.	H	α-helix	trans	-60.6	-41.3	-179.4	-177.1	166.5	67.2	-105.6	3.7	111.9	M37 M330 T331 N332 D333 V339 Y340	M37-R336 HydrophobicContact CE-CG 4.24Å; M37-R336 WeakPolarHBondContact SD-CD 3.41Å; M37-R336 HydrophobicContact SD-CG 4.35Å; M330-R336 HydrophobicContact CE-CG 4.02Å; M330-R336 PolarHBondContact O-NH1 3.03Å; T331-R336 PolarHBondContact O-NH1 3.4Å; N332-R336 WeakPolarHBondContact O-CB 3.38Å; N332-R336 PolarHBondContact O-N 2.81Å; D333-R336 IonicContact OD1-CZ 2.85Å; D333-R336 IonicContact OD1-NH1 3.89Å; D333-R336 PolarHBondContact OD1-NH1 3.02Å; D333-R336 IonicContact OD1-NH2 3.16Å; D333-R336 PolarHBondContact OD1-NH2 3.41Å; R336-V339 WeakPolarHBondContact O-CB 3.46Å; R336-V339 PolarHBondContact O-N 3.37Å; R336-V339 VanDerWaalsContact O-N 3.16Å; R336-Y340 HydrophobicContact CG-CD2 4.03Å; R336-Y340 HydrophobicContact CG-CE2 3.71Å; R336-Y340 WeakPolarHBondContact O-CD2 3.42Å; R336-Y340 PolarHBondContact O-N 3.19Å
337	L	84.8	Confident	86.8	Confident	72 Å²	72	37 Å²	37	38%	0.377	20%	0.201	S	C	.	.	H	α-helix	trans	-61.1	-42.6	173.2	-73.5	170.1	0	0	0	112	D333 T334 F335 V339 Y340 D341	D333-L337 WeakPolarHBondContact O-CB 3.26Å; D333-L337 VanDerWaalsContact O-CG 3.23Å; D333-L337 WeakPolarHBondContact O-CG 3.31Å; D333-L337 PolarHBondContact O-N 2.87Å; T334-L337 PolarHBondContact O-N 2.78Å; F335-L337 VanDerWaalsContact C-N 3.33Å; F335-L337 PolarHBondContact O-N 3.27Å; L337-V339 VanDerWaalsContact C-N 3.27Å; L337-V339 PolarHBondContact O-N 3Å; L337-Y340 WeakPolarHBondContact O-CB 3.26Å; L337-Y340 PolarHBondContact O-N 2.88Å; L337-Y340 VanDerWaalsContact O-N 3.16Å; L337-D341 PolarHBondContact O-N 2.88Å
338	C	87.5	Confident	86.7	Confident	28 Å²	28	37.1 Å²	37.1	19%	0.189	20%	0.201	C	C	.	.	H	α-helix	trans	-59.8	-37.5	173.3	-65.9	0	0	0	0	112.1	T334 F335 D341 S342	T334-C338 PolarHBondContact O-N 2.72Å; T334-C338 VanDerWaalsContact O-N 3.15Å; T334-C338 PolarHBondContact O-SG 2.89Å; T334-C338 VanDerWaalsContact O-SG 3.38Å; F335-C338 WeakPolarHBondContact O-CA 3.43Å; F335-C338 WeakPolarHBondContact O-CB 3.48Å; F335-C338 PolarHBondContact O-N 3.42Å; F335-C338 VanDerWaalsContact O-N 3.08Å; C338-D341 PolarHBondContact O-N 2.76Å; C338-S342 WeakPolarHBondContact O-CA 3.46Å; C338-S342 VanDerWaalsContact O-CB 3.22Å; C338-S342 WeakPolarHBondContact O-CB 3.3Å; C338-S342 PolarHBondContact O-N 2.84Å
339	V	89.9	Confident	86.8	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.006	20%	0.204	C	C	.	.	H	α-helix	trans	-67	-40.1	175.3	175.4	0	0	0	0	111.8	L284 F305 M330 F335 R336 L337 D341 S342	L284-V339 HydrophobicContact CD2-CG1 4.06Å; F305-V339 HydrophobicContact CD1-CG1 4.05Å; F305-V339 HydrophobicContact CE1-CG1 3.7Å; F305-V339 HydrophobicContact CE2-CG1 4.47Å; F305-V339 HydrophobicContact CZ-CG1 3.94Å; M330-V339 HydrophobicContact CE-CG1 4.39Å; M330-V339 HydrophobicContact SD-CB 4.11Å; M330-V339 HydrophobicContact SD-CG1 4.12Å; M330-V339 HydrophobicContact SD-CG2 3.82Å; F335-V339 HydrophobicContact CD1-CG2 4Å; F335-V339 HydrophobicContact CE1-CG2 3.56Å; F335-V339 HydrophobicContact CZ-CG2 3.86Å; F335-V339 PolarHBondContact O-N 3.32Å; R336-V339 WeakPolarHBondContact O-CB 3.46Å; R336-V339 PolarHBondContact O-N 3.37Å; R336-V339 VanDerWaalsContact O-N 3.16Å; L337-V339 VanDerWaalsContact C-N 3.27Å; L337-V339 PolarHBondContact O-N 3Å; V339-D341 VanDerWaalsContact C-N 3.31Å; V339-D341 PolarHBondContact O-N 2.94Å; V339-S342 PolarHBondContact O-N 2.81Å; V339-S342 PolarHBondContact O-OG 2.98Å
340	Y	88.5	Confident	86.7	Confident	50 Å²	50	43.4 Å²	43.4	20%	0.196	23%	0.229	C	C	.	.	H	α-helix	trans	-61.5	-36.3	171.9	-82.8	-77.7	0	0	0	112.9	M37 E265 R286 R304 F305 R336 L337	M37-Y340 HydrophobicContact CE-CE2 4.21Å; M37-Y340 VanDerWaalsContact CE-OH 3.3Å; M37-Y340 WeakPolarHBondContact CE-OH 3.44Å; E265-Y340 PolarHBondContact OE2-OH 3.06Å; R286-Y340 PolarHBondContact NH1-O 2.94Å; R286-Y340 PolarHBondContact NH2-O 3.15Å; R304-Y340 HydrophobicContact CG-CE1 3.77Å; F305-Y340 HydrophobicContact CE2-CD1 4.14Å; F305-Y340 HydrophobicContact CE2-CD2 4.26Å; F305-Y340 AromaticContact CE2-CE1 3.76Å; F305-Y340 HydrophobicContact CE2-CE1 3.76Å; F305-Y340 AromaticContact CE2-CE2 3.87Å; F305-Y340 HydrophobicContact CE2-CE2 3.87Å; F305-Y340 HydrophobicContact CE2-CG 4.36Å; F305-Y340 AromaticContact CE2-CZ 3.6Å; F305-Y340 AromaticContact CZ-CD1 3.64Å; F305-Y340 HydrophobicContact CZ-CD1 3.64Å; F305-Y340 HydrophobicContact CZ-CD2 4.17Å; F305-Y340 AromaticContact CZ-CE1 3.71Å; F305-Y340 HydrophobicContact CZ-CE1 3.71Å; F305-Y340 HydrophobicContact CZ-CE2 4.21Å; F305-Y340 AromaticContact CZ-CG 3.87Å; F305-Y340 HydrophobicContact CZ-CG 3.87Å; F305-Y340 AromaticContact CZ-CZ 3.99Å; R336-Y340 HydrophobicContact CG-CD2 4.03Å; R336-Y340 HydrophobicContact CG-CE2 3.71Å; R336-Y340 WeakPolarHBondContact O-CD2 3.42Å; R336-Y340 PolarHBondContact O-N 3.19Å; L337-Y340 WeakPolarHBondContact O-CB 3.26Å; L337-Y340 PolarHBondContact O-N 2.88Å; L337-Y340 VanDerWaalsContact O-N 3.16Å
341	D	85.9	Confident	86.6	Confident	121 Å²	121	43.4 Å²	43.4	65%	0.647	23%	0.229	S	C	*	.	H	α-helix	trans	-90.3	-16	-177.3	-68.7	-23.1	0	0	0	112.9	L337 C338 V339 L343	L337-D341 PolarHBondContact O-N 2.88Å; C338-D341 PolarHBondContact O-N 2.76Å; V339-D341 VanDerWaalsContact C-N 3.31Å; V339-D341 PolarHBondContact O-N 2.94Å; D341-L343 PolarHBondContact O-N 2.82Å
342	S	84.7	Confident	86.7	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.007	23%	0.229	C	C	.	.			trans	-59.9	122.7	-173.3	63.5	0	0	0	0	113.3	R286 C338 V339	R286-S342 PolarHBondContact NH1-O 3.04Å; C338-S342 WeakPolarHBondContact O-CA 3.46Å; C338-S342 VanDerWaalsContact O-CB 3.22Å; C338-S342 WeakPolarHBondContact O-CB 3.3Å; C338-S342 PolarHBondContact O-N 2.84Å; V339-S342 PolarHBondContact O-N 2.81Å; V339-S342 PolarHBondContact O-OG 2.98Å
343	L	83.9	Confident	86.9	Confident	130 Å²	130	45.2 Å²	45.2	68%	0.681	24%	0.238	S	C	*	.	S	Bend	trans	-108.9	-22.9	168.6	-62.2	178.7	0	0	0	111.1	D341 D347	D341-L343 PolarHBondContact O-N 2.82Å; L343-D347 PolarHBondContact N-OD2 2.64Å
344	S	87.2	Confident	87	Confident	45 Å²	45	45.1 Å²	45.1	32%	0.315	24%	0.238	S	C	.	.	S	Bend	trans	-124.9	160.1	-179.3	71.1	0	0	0	0	111.4	I117 D346 D347	I117-S344 WeakPolarHBondContact CD1-O 3.36Å; S344-D346 PolarHBondContact O-N 3.4Å; S344-D347 PolarHBondContact N-OD2 3.22Å; S344-D347 PolarHBondContact O-N 3.3Å; S344-D347 PolarHBondContact OG-N 2.9Å; S344-D347 PolarHBondContact OG-OD2 2.9Å
345	V	88.5	Confident	87.2	Confident	35 Å²	35	43 Å²	43	21%	0.212	23%	0.225	C	C	.	.	H	α-helix	trans	-62.9	-33.5	173.9	179.1	0	0	0	0	110.7	L115 D347 I348 I349	L115-V345 HydrophobicContact CB-CG1 4.45Å; L115-V345 HydrophobicContact CB-CG2 4.45Å; L115-V345 HydrophobicContact CD2-CG1 4.37Å; L115-V345 WeakPolarHBondContact O-CG2 3.32Å; V345-D347 PolarHBondContact O-N 3.03Å; V345-I348 WeakPolarHBondContact O-CB 3.17Å; V345-I348 PolarHBondContact O-N 3.29Å; V345-I348 VanDerWaalsContact O-N 3.09Å; V345-I349 HydrophobicContact CG1-CD1 4.21Å; V345-I349 HydrophobicContact CG1-CG1 4.5Å; V345-I349 WeakPolarHBondContact O-CG1 3.47Å; V345-I349 PolarHBondContact O-N 3.06Å
346	D	89.9	Confident	86.9	Confident	96 Å²	96	44.6 Å²	44.6	51%	0.513	23%	0.232	S	C	.	.	H	α-helix	trans	-61.7	-31.3	177.7	-66	-25.3	0	0	0	112.8	S344 I348 I349 K350	S344-D346 PolarHBondContact O-N 3.4Å; D346-I348 VanDerWaalsContact C-N 3.35Å; D346-I349 PolarHBondContact O-N 2.94Å; D346-K350 VanDerWaalsContact O-CG 3.31Å; D346-K350 WeakPolarHBondContact O-CG 3.21Å; D346-K350 PolarHBondContact O-N 3.21Å
347	D	88.7	Confident	86.3	Confident	46 Å²	46	49.1 Å²	49.1	25%	0.246	26%	0.255	C	S	.	.	H	α-helix	trans	-70.6	-34.4	176.7	-58.3	-40.4	0	0	0	111.7	L343 S344 V345 K350 G351	L343-D347 PolarHBondContact N-OD2 2.64Å; S344-D347 PolarHBondContact N-OD2 3.22Å; S344-D347 PolarHBondContact O-N 3.3Å; S344-D347 PolarHBondContact OG-N 2.9Å; S344-D347 PolarHBondContact OG-OD2 2.9Å; V345-D347 PolarHBondContact O-N 3.03Å; D347-K350 IonicContact OD1-NZ 3.48Å; D347-K350 PolarHBondContact OD1-NZ 2.9Å; D347-G351 PolarHBondContact O-N 3.19Å
348	I	89.8	Confident	85.5	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.01	25%	0.249	C	C	.	.	H	α-helix	trans	-68.4	-41.5	172.6	-62.4	178.9	0	0	0	109.9	L111 L115 I117 L284 F335 V345 D346 K350 G351 I352	L111-I348 HydrophobicContact CD1-CG2 4.24Å; L115-I348 HydrophobicContact CD2-CD1 3.62Å; I117-I348 HydrophobicContact CD1-CD1 3.49Å; I117-I348 VanDerWaalsContact CD1-CD1 3.49Å; I117-I348 HydrophobicContact CD1-CG1 4.21Å; I117-I348 HydrophobicContact CG1-CD1 3.92Å; L284-I348 HydrophobicContact CD2-CD1 3.7Å; F335-I348 HydrophobicContact CE2-CG2 4.38Å; F335-I348 HydrophobicContact CZ-CG2 4.28Å; V345-I348 WeakPolarHBondContact O-CB 3.17Å; V345-I348 PolarHBondContact O-N 3.29Å; V345-I348 VanDerWaalsContact O-N 3.09Å; D346-I348 VanDerWaalsContact C-N 3.35Å; I348-K350 PolarHBondContact O-N 3.47Å; I348-G351 CarbonylContact O-C 3.53Å; I348-G351 VanDerWaalsContact O-CA 3.31Å; I348-G351 WeakPolarHBondContact O-CA 3.37Å; I348-G351 PolarHBondContact O-N 3.12Å; I348-I352 WeakPolarHBondContact O-CG1 3.21Å; I348-I352 PolarHBondContact O-N 2.97Å
349	I	90.5	Very high	84.5	Confident	12 Å²	12	47.3 Å²	47.3	6%	0.062	25%	0.245	C	C	.	.	H	α-helix	trans	-61.3	-44.8	176	-65.1	171.1	0	0	0	110.9	R108 Q112 V345 D346 G351 I352 D353	R108-I349 HydrophobicContact CG-CG2 4.44Å; Q112-I349 HydrophobicContact CB-CD1 3.86Å; Q112-I349 HydrophobicContact CG-CD1 3.82Å; V345-I349 HydrophobicContact CG1-CD1 4.21Å; V345-I349 HydrophobicContact CG1-CG1 4.5Å; V345-I349 WeakPolarHBondContact O-CG1 3.47Å; V345-I349 PolarHBondContact O-N 3.06Å; D346-I349 PolarHBondContact O-N 2.94Å; I349-G351 PolarHBondContact O-N 3.15Å; I349-I352 WeakPolarHBondContact O-CB 3.4Å; I349-I352 PolarHBondContact O-N 3.36Å; I349-I352 VanDerWaalsContact O-N 3.07Å; I349-D353 PolarHBondContact O-N 3.1Å
350	K	87.3	Confident	83.2	Confident	119 Å²	119	50.8 Å²	50.8	52%	0.517	26%	0.26	S	S	.	.	H	α-helix	trans	-59.4	-37.6	171.6	-70.8	169.7	-166.2	159.6	0	111.7	D346 D347 I348 I352 D353 N354	D346-K350 VanDerWaalsContact O-CG 3.31Å; D346-K350 WeakPolarHBondContact O-CG 3.21Å; D346-K350 PolarHBondContact O-N 3.21Å; D347-K350 IonicContact OD1-NZ 3.48Å; D347-K350 PolarHBondContact OD1-NZ 2.9Å; I348-K350 PolarHBondContact O-N 3.47Å; K350-I352 VanDerWaalsContact C-N 3.33Å; K350-D353 PolarHBondContact O-N 3.49Å; K350-N354 PolarHBondContact O-N 3.06Å; K350-N354 PolarHBondContact O-ND2 3.21Å
351	G	86.8	Confident	81.7	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-58.9	-42.3	172.4	0	0	0	0	0	112.6	D347 I348 I349 N354 F355	D347-G351 PolarHBondContact O-N 3.19Å; I348-G351 CarbonylContact O-C 3.53Å; I348-G351 VanDerWaalsContact O-CA 3.31Å; I348-G351 WeakPolarHBondContact O-CA 3.37Å; I348-G351 PolarHBondContact O-N 3.12Å; I349-G351 PolarHBondContact O-N 3.15Å; G351-N354 PolarHBondContact O-N 2.78Å; G351-F355 WeakPolarHBondContact O-CB 3.48Å; G351-F355 PolarHBondContact O-N 3.28Å
352	I	88.9	Confident	80	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-63.2	-44.8	174.8	-60.9	171.7	0	0	0	110.2	I104 L111 M329 F335 I348 I349 K350 N354 F355 M356	I104-I352 HydrophobicContact CG2-CG2 4Å; L111-I352 HydrophobicContact CD1-CD1 3.67Å; M329-I352 HydrophobicContact CE-CG1 4.48Å; M329-I352 HydrophobicContact SD-CG1 4.23Å; F335-I352 HydrophobicContact CD2-CG1 4.49Å; F335-I352 HydrophobicContact CE2-CG1 3.72Å; I348-I352 WeakPolarHBondContact O-CG1 3.21Å; I348-I352 PolarHBondContact O-N 2.97Å; I349-I352 WeakPolarHBondContact O-CB 3.4Å; I349-I352 PolarHBondContact O-N 3.36Å; I349-I352 VanDerWaalsContact O-N 3.07Å; K350-I352 VanDerWaalsContact C-N 3.33Å; I352-N354 VanDerWaalsContact C-N 3.3Å; I352-N354 PolarHBondContact O-N 3.34Å; I352-F355 WeakPolarHBondContact O-CB 3.3Å; I352-F355 PolarHBondContact O-N 3.3Å; I352-M356 HydrophobicContact CG2-CG 4.33Å; I352-M356 VanDerWaalsContact O-CG 3.28Å; I352-M356 WeakPolarHBondContact O-CG 3.39Å; I352-M356 PolarHBondContact O-N 3.11Å
353	D	86	Confident	78.1	Confident	56 Å²	56	52.1 Å²	52.1	30%	0.299	28%	0.277	S	S	.	.	H	α-helix	trans	-61.5	-39.9	178.1	-69.6	-33.1	0	0	0	111.3	R108 I349 K350 M356 Q357	R108-D353 IonicContact CZ-OD1 3.44Å; R108-D353 IonicContact CZ-OD2 3.82Å; R108-D353 IonicContact NH1-OD1 2.79Å; R108-D353 PolarHBondContact NH1-OD1 3.13Å; R108-D353 IonicContact NH1-OD2 3.83Å; R108-D353 IonicContact NH2-OD1 3.47Å; R108-D353 PolarHBondContact NH2-OD1 2.7Å; R108-D353 IonicContact NH2-OD2 3.08Å; R108-D353 PolarHBondContact NH2-OD2 3.35Å; R108-D353 VanDerWaalsContact NH2-OD2 3.08Å; I349-D353 PolarHBondContact O-N 3.1Å; K350-D353 PolarHBondContact O-N 3.49Å; D353-M356 PolarHBondContact O-N 2.91Å; D353-Q357 WeakPolarHBondContact O-CG 3.4Å; D353-Q357 PolarHBondContact O-N 2.99Å; D353-Q357 VanDerWaalsContact O-N 3.12Å
354	N	83.3	Confident	76.4	Confident	65 Å²	65	50.6 Å²	50.6	35%	0.348	27%	0.269	S	S	.	.	H	α-helix	trans	-64.5	-43.3	173.2	-69.5	-22.1	0	0	0	112.2	K350 G351 I352 M356 Q357 D358	K350-N354 PolarHBondContact O-N 3.06Å; K350-N354 PolarHBondContact O-ND2 3.21Å; G351-N354 PolarHBondContact O-N 2.78Å; I352-N354 VanDerWaalsContact C-N 3.3Å; I352-N354 PolarHBondContact O-N 3.34Å; N354-M356 VanDerWaalsContact C-N 3.3Å; N354-M356 PolarHBondContact O-N 2.67Å; N354-Q357 PolarHBondContact O-N 3.07Å; N354-D358 PolarHBondContact O-N 3.12Å
355	F	84.1	Confident	74.2	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-58.1	-43.9	175.6	172	-94.4	0	0	0	111.6	L7 M99 I104 M329 N332 F335 G351 I352 Q357 D358 S359	L7-F355 HydrophobicContact CB-CE2 4.5Å; L7-F355 HydrophobicContact CB-CZ 4.43Å; L7-F355 HydrophobicContact CD1-CE2 4.06Å; L7-F355 HydrophobicContact CD1-CZ 4.31Å; L7-F355 HydrophobicContact CD2-CZ 3.98Å; L7-F355 HydrophobicContact CG-CZ 4.46Å; M99-F355 HydrophobicContact CE-CE1 4.29Å; M99-F355 HydrophobicContact CE-CZ 3.9Å; I104-F355 HydrophobicContact CD1-CE1 4.41Å; M329-F355 HydrophobicContact CB-CD2 4.43Å; M329-F355 HydrophobicContact CB-CE2 4.41Å; M329-F355 HydrophobicContact CG-CD1 3.97Å; M329-F355 HydrophobicContact CG-CD2 4.21Å; M329-F355 HydrophobicContact CG-CE1 3.83Å; M329-F355 HydrophobicContact CG-CE2 4.07Å; M329-F355 HydrophobicContact CG-CG 4.16Å; M329-F355 HydrophobicContact CG-CZ 3.88Å; M329-F355 HydrophobicContact SD-CD1 4.09Å; M329-F355 HydrophobicContact SD-CE1 4.35Å; M329-F355 HydrophobicContact SD-CG 4.46Å; N332-F355 HydrophobicContact CB-CD2 3.59Å; N332-F355 HydrophobicContact CB-CE2 3.71Å; F335-F355 HydrophobicContact CB-CB 4.24Å; F335-F355 HydrophobicContact CB-CD2 4.33Å; F335-F355 HydrophobicContact CD2-CB 4.31Å; G351-F355 WeakPolarHBondContact O-CB 3.48Å; G351-F355 PolarHBondContact O-N 3.28Å; I352-F355 WeakPolarHBondContact O-CB 3.3Å; I352-F355 PolarHBondContact O-N 3.3Å; F355-Q357 VanDerWaalsContact C-N 3.34Å; F355-Q357 PolarHBondContact O-N 3.04Å; F355-D358 PolarHBondContact O-N 3.33Å; F355-S359 VanDerWaalsContact O-CB 3.31Å; F355-S359 WeakPolarHBondContact O-CB 3.45Å; F355-S359 PolarHBondContact O-N 2.98Å
356	M	81.1	Confident	72	Confident	34 Å²	34	62.6 Å²	62.6	17%	0.167	32%	0.318	C	S	.	.	H	α-helix	trans	-65	-38.2	179.1	-68.3	-57.4	-72.9	0	0	112.1	V9 F101 I104 I352 D353 N354 D358 S359	V9-M356 HydrophobicContact CG1-CE 4.25Å; V9-M356 HydrophobicContact CG2-CE 4.47Å; V9-M356 HydrophobicContact CG2-SD 4.38Å; F101-M356 HydrophobicContact CD2-CE 3.2Å; F101-M356 HydrophobicContact CE2-CE 3.11Å; F101-M356 HydrophobicContact CG-CE 4.36Å; F101-M356 HydrophobicContact CZ-CE 4.24Å; I104-M356 HydrophobicContact CB-SD 4.46Å; I104-M356 HydrophobicContact CD1-CE 4.07Å; I104-M356 HydrophobicContact CD1-SD 3.53Å; I104-M356 VanDerWaalsContact CD1-SD 3.53Å; I104-M356 HydrophobicContact CG2-CG 4.46Å; I104-M356 HydrophobicContact CG2-SD 3.81Å; I352-M356 HydrophobicContact CG2-CG 4.33Å; I352-M356 VanDerWaalsContact O-CG 3.28Å; I352-M356 WeakPolarHBondContact O-CG 3.39Å; I352-M356 PolarHBondContact O-N 3.11Å; D353-M356 PolarHBondContact O-N 2.91Å; N354-M356 VanDerWaalsContact C-N 3.3Å; N354-M356 PolarHBondContact O-N 2.67Å; M356-D358 VanDerWaalsContact C-N 3.34Å; M356-S359 PolarHBondContact O-N 2.88Å; M356-S359 PolarHBondContact O-OG 3.26Å
357	Q	75	Confident	69.8	Low	116 Å²	116	64.9 Å²	64.9	54%	0.542	33%	0.325	S	S	.	.	H	α-helix	trans	-66.1	-34.6	174.5	-70.3	174.3	21.2	0	0	112.8	D353 N354 F355	D353-Q357 WeakPolarHBondContact O-CG 3.4Å; D353-Q357 PolarHBondContact O-N 2.99Å; D353-Q357 VanDerWaalsContact O-N 3.12Å; N354-Q357 PolarHBondContact O-N 3.07Å; F355-Q357 VanDerWaalsContact C-N 3.34Å; F355-Q357 PolarHBondContact O-N 3.04Å
358	D	68.4	Low	67.6	Low	47 Å²	47	73 Å²	73	25%	0.251	35%	0.354	S	S	.	.	H	α-helix	trans	-82.7	-17.9	177.8	-77	-23.9	0	0	0	113.5	T334 N354 F355 M356	T334-D358 WeakPolarHBondContact CB-OD2 3.31Å; T334-D358 WeakPolarHBondContact CG2-OD2 3.45Å; T334-D358 PolarHBondContact OG1-OD2 3.02Å; N354-D358 PolarHBondContact O-N 3.12Å; F355-D358 PolarHBondContact O-N 3.33Å; M356-D358 VanDerWaalsContact C-N 3.34Å
359	S	66.4	Low	65.5	Low	16 Å²	16	76.9 Å²	76.9	11%	0.112	38%	0.375	C	S	.	.	S	Bend	trans	-79.4	149.3	-178.1	75.6	0	0	0	0	112.7	V9 F355 M356	V9-S359 WeakPolarHBondContact CG2-OG 3.32Å; F355-S359 VanDerWaalsContact O-CB 3.31Å; F355-S359 WeakPolarHBondContact O-CB 3.45Å; F355-S359 PolarHBondContact O-N 2.98Å; M356-S359 PolarHBondContact O-N 2.88Å; M356-S359 PolarHBondContact O-OG 3.26Å
360	F	62.5	Low	63.3	Low	74 Å²	74	80 Å²	80	33%	0.325	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	124.6	179.3	-170.2	-99.5	0	0	0	111.2	L7 Y8 V9 M362 I380	L7-F360 PolarHBondContact O-N 3.2Å; Y8-F360 CarbonylContact C-O 3.56Å; Y8-F360 VanDerWaalsContact CA-O 3.31Å; Y8-F360 WeakPolarHBondContact CA-O 3.5Å; Y8-F360 HydrophobicContact CD1-CB 4.16Å; Y8-F360 AromaticContact CD1-CD1 3.87Å; Y8-F360 HydrophobicContact CD1-CD1 3.87Å; Y8-F360 HydrophobicContact CD1-CG 4.48Å; Y8-F360 AromaticContact CE1-CD1 3.98Å; Y8-F360 HydrophobicContact CE1-CD1 3.98Å; V9-F360 PolarHBondContact N-O 3.25Å; F360-M362 HydrophobicContact CD1-CG 3.65Å; F360-M362 HydrophobicContact CE1-CG 3.73Å; F360-I380 HydrophobicContact CD2-CD1 4.07Å; F360-I380 HydrophobicContact CE1-CD1 3.88Å; F360-I380 HydrophobicContact CE2-CD1 3.39Å; F360-I380 HydrophobicContact CE2-CG1 4.27Å; F360-I380 HydrophobicContact CZ-CD1 3.28Å; F360-I380 HydrophobicContact CZ-CG1 4.45Å
361	V	56.6	Low	61.2	Low	60 Å²	60	78.3 Å²	78.3	36%	0.364	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	123	176.1	-176.1	0	0	0	0	110.6	V9 E11	V9-V361 HydrophobicContact CB-CG2 4.35Å; V9-V361 CarbonylContact O-C 3.52Å; V9-V361 VanDerWaalsContact O-CA 3.22Å; V9-V361 WeakPolarHBondContact O-CA 3.33Å; E11-V361 HydrophobicContact CB-CG1 3.89Å
362	M	50.5	Low	59.2	Low	36 Å²	36	81 Å²	81	18%	0.177	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	123.4	175	-71.8	-152.6	-67.8	0	0	112.1	Y8 V9 F360 L364 L373	Y8-M362 HydrophobicContact CD1-CE 3.55Å; Y8-M362 HydrophobicContact CD1-CG 3.7Å; Y8-M362 HydrophobicContact CD1-SD 3.73Å; Y8-M362 HydrophobicContact CD2-CE 3.83Å; Y8-M362 HydrophobicContact CE1-CE 3.94Å; Y8-M362 HydrophobicContact CE1-CG 4.21Å; Y8-M362 HydrophobicContact CE1-SD 3.78Å; Y8-M362 HydrophobicContact CE2-CE 4.24Å; Y8-M362 HydrophobicContact CG-CE 3.49Å; Y8-M362 VanDerWaalsContact CG-CE 3.49Å; Y8-M362 HydrophobicContact CG-CG 4.4Å; Y8-M362 HydrophobicContact CG-SD 4.31Å; V9-M362 PolarHBondContact O-N 3.47Å; F360-M362 HydrophobicContact CD1-CG 3.65Å; F360-M362 HydrophobicContact CE1-CG 3.73Å; M362-L364 PolarHBondContact O-N 3.1Å; M362-L373 HydrophobicContact CE-CD1 3.64Å; M362-L373 HydrophobicContact CE-CD2 4.34Å; M362-L373 HydrophobicContact CE-CG 4.34Å; M362-L373 HydrophobicContact SD-CD1 3.37Å; M362-L373 WeakPolarHBondContact SD-CD1 3.27Å; M362-L373 HydrophobicContact SD-CG 4.2Å
363	P	45.8	Very low	57	Low	104 Å²	104	84.2 Å²	84.2	68%	0.675	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.7	127.5	171.7	26.4	-30.8	0	0	0	110.3	S365	P363-S365 VanDerWaalsContact C-N 3.31Å; P363-S365 PolarHBondContact O-N 3.35Å
364	L	47.6	Very low	55.2	Low	98 Å²	98	83.3 Å²	83.3	51%	0.513	44%	0.438	S	S	.	.			trans	-67.8	81.7	176.3	-74	168.1	0	0	0	111.2	V10 E12 M362	V10-L364 HydrophobicContact CG1-CD1 3.43Å; V10-L364 VanDerWaalsContact CG1-CD1 3.43Å; V10-L364 HydrophobicContact CG1-CD2 3.57Å; V10-L364 HydrophobicContact CG1-CG 3.35Å; E12-L364 HydrophobicContact CG-CD1 4.42Å; M362-L364 PolarHBondContact O-N 3.1Å
365	S	40.9	Very low	53.4	Low	93 Å²	93	81.8 Å²	81.8	65%	0.65	44%	0.438	S	S	*	.			trans	-75.7	134.2	163.8	76.4	0	0	0	0	109.6	P363 H367	P363-S365 VanDerWaalsContact C-N 3.31Å; P363-S365 PolarHBondContact O-N 3.35Å; S365-H367 PolarHBondContact O-N 3.27Å
366	R	42.1	Very low	51.6	Low	238 Å²	238	86.8 Å²	86.8	90%	0.898	46%	0.463	S	S	*	.	S	Bend	trans	-54.8	0.6	-171.8	-120.8	173.8	-176.5	168.4	1.7	117.1
367	H	43.5	Very low	49.9	Very low	144 Å²	144	86.4 Å²	86.4	67%	0.667	46%	0.462	S	S	*	.			trans	-135	96.3	-173.3	-64.6	-48.7	0	0	0	111.4	S365 N369	S365-H367 PolarHBondContact O-N 3.27Å; H367-N369 PolarHBondContact O-N 3.02Å
368	Y	42	Very low	48.6	Very low	218 Å²	218	85.9 Å²	85.9	86%	0.855	46%	0.455	S	S	*	.			trans	-58.3	106.9	167.9	-74.3	-88.2	0	0	0	110.2
369	N	46	Very low	47.6	Very low	82 Å²	82	88.4 Å²	88.4	44%	0.439	47%	0.465	S	S	.	.			trans	-119.8	104.4	164.4	-167	-6.5	0	0	0	107.6	H367 N371 A372 L373	H367-N369 PolarHBondContact O-N 3.02Å; N369-N371 PolarHBondContact O-N 3.04Å; N369-A372 HydrophobicContact CB-CB 4.1Å; N369-A372 WeakPolarHBondContact O-CB 3.49Å; N369-A372 PolarHBondContact O-N 3.24Å; N369-L373 PolarHBondContact O-N 3Å
370	A	44.5	Very low	46.6	Very low	79 Å²	79	90.8 Å²	90.8	65%	0.653	48%	0.476	S	S	*	.	H	α-helix	trans	-51.9	-28.5	-179.3	0	0	0	0	0	112.8	A374	A370-A374 PolarHBondContact O-N 3.18Å; A370-A374 VanDerWaalsContact O-N 3.1Å
371	N	43.9	Very low	46	Very low	83 Å²	83	91.6 Å²	91.6	44%	0.444	48%	0.481	S	S	.	.	H	α-helix	trans	-75.2	-32.7	177.5	-62.7	-44.7	0	0	0	113.6	N369 L373 G375	N369-N371 PolarHBondContact O-N 3.04Å; N371-L373 VanDerWaalsContact C-N 3.34Å; N371-G375 PolarHBondContact O-N 2.91Å
372	A	43.7	Very low	45.5	Very low	55 Å²	55	90.3 Å²	90.3	46%	0.455	48%	0.477	S	S	.	.	H	α-helix	trans	-69.7	-38.9	175.6	0	0	0	0	0	110.4	N369 G375 M376	N369-A372 HydrophobicContact CB-CB 4.1Å; N369-A372 WeakPolarHBondContact O-CB 3.49Å; N369-A372 PolarHBondContact O-N 3.24Å; A372-G375 PolarHBondContact O-N 3.09Å; A372-M376 PolarHBondContact O-N 2.83Å
373	L	43.1	Very low	45.3	Very low	71 Å²	71	96.4 Å²	96.4	37%	0.372	50%	0.499	S	S	.	.	H	α-helix	trans	-58.4	-54	172.9	-145.7	78	0	0	0	110.9	M362 N369 N371 G375 M376 T377	M362-L373 HydrophobicContact CE-CD1 3.64Å; M362-L373 HydrophobicContact CE-CD2 4.34Å; M362-L373 HydrophobicContact CE-CG 4.34Å; M362-L373 HydrophobicContact SD-CD1 3.37Å; M362-L373 WeakPolarHBondContact SD-CD1 3.27Å; M362-L373 HydrophobicContact SD-CG 4.2Å; N369-L373 PolarHBondContact O-N 3Å; N371-L373 VanDerWaalsContact C-N 3.34Å; L373-G375 PolarHBondContact O-N 3.05Å; L373-M376 PolarHBondContact O-N 2.95Å; L373-M376 VanDerWaalsContact O-N 3.09Å; L373-T377 PolarHBondContact O-N 3.48Å; L373-T377 PolarHBondContact O-OG1 3.14Å
374	A	48.2	Very low	45.4	Very low	36 Å²	36	98 Å²	98	30%	0.298	49%	0.492	S	S	.	.	H	α-helix	trans	-60.8	-28.4	178.5	0	0	0	0	0	113.3	A370 R378	A370-A374 PolarHBondContact O-N 3.18Å; A370-A374 VanDerWaalsContact O-N 3.1Å; A374-R378 WeakPolarHBondContact O-CB 3.32Å; A374-R378 VanDerWaalsContact O-CG 3.28Å; A374-R378 WeakPolarHBondContact O-CG 3.35Å; A374-R378 PolarHBondContact O-N 3.26Å
375	G	46.1	Very low	45.4	Very low	33 Å²	33	100 Å²	100	34%	0.34	50%	0.496	S	S	.	.	H	α-helix	trans	-69.2	-48.3	172.8	0	0	0	0	0	112.4	N371 A372 L373 R378 Q379	N371-G375 PolarHBondContact O-N 2.91Å; A372-G375 PolarHBondContact O-N 3.09Å; L373-G375 PolarHBondContact O-N 3.05Å; G375-R378 PolarHBondContact O-N 2.99Å; G375-Q379 PolarHBondContact O-N 2.88Å
376	M	46	Very low	45.5	Very low	106 Å²	106	99.6 Å²	99.6	52%	0.522	48%	0.484	S	S	.	.	H	α-helix	trans	-63.4	-47.2	177.2	-81.6	176.6	140.7	0	0	111.9	A372 L373 R378 Q379 I380	A372-M376 PolarHBondContact O-N 2.83Å; L373-M376 PolarHBondContact O-N 2.95Å; L373-M376 VanDerWaalsContact O-N 3.09Å; M376-R378 PolarHBondContact O-N 2.93Å; M376-Q379 PolarHBondContact O-N 3.41Å; M376-Q379 VanDerWaalsContact O-N 3.14Å; M376-I380 WeakPolarHBondContact O-CD1 3.46Å; M376-I380 VanDerWaalsContact O-CG1 3.28Å; M376-I380 WeakPolarHBondContact O-CG1 3.28Å; M376-I380 PolarHBondContact O-N 3.5Å
377	T	45.1	Very low	45.4	Very low	25 Å²	25	90.5 Å²	90.5	15%	0.153	46%	0.455	C	S	.	.	H	α-helix	trans	-57.7	-40.1	179	-36	0	0	0	0	111.4	I6 Y8 L373 I380 E381	I6-T377 HydrophobicContact CD1-CG2 3.6Å; Y8-T377 VanDerWaalsContact OH-CG2 3.32Å; Y8-T377 WeakPolarHBondContact OH-CG2 3.49Å; Y8-T377 PolarHBondContact OH-OG1 3.23Å; Y8-T377 VanDerWaalsContact OH-OG1 3.05Å; L373-T377 PolarHBondContact O-N 3.48Å; L373-T377 PolarHBondContact O-OG1 3.14Å; T377-I380 PolarHBondContact O-N 3.22Å; T377-E381 WeakPolarHBondContact O-CG 3.12Å; T377-E381 PolarHBondContact O-N 2.87Å
378	R	47.6	Very low	45.2	Very low	106 Å²	106	87.2 Å²	87.2	40%	0.4	45%	0.445	S	S	.	.	H	α-helix	trans	-71.7	-36.6	177.4	-76.7	179	-174.8	151.8	-12	114.1	A374 G375 M376 I380 A382 H1049	A374-R378 WeakPolarHBondContact O-CB 3.32Å; A374-R378 VanDerWaalsContact O-CG 3.28Å; A374-R378 WeakPolarHBondContact O-CG 3.35Å; A374-R378 PolarHBondContact O-N 3.26Å; G375-R378 PolarHBondContact O-N 2.99Å; M376-R378 PolarHBondContact O-N 2.93Å; R378-I380 VanDerWaalsContact C-N 3.27Å; R378-A382 WeakPolarHBondContact O-CB 3.45Å; R378-A382 PolarHBondContact O-N 3.4Å; R378-H1049 PolarHBondContact NH1-CD2 3.38Å; R378-H1049 PolarHBondContact NH1-CE1 3.01Å; R378-H1049 VanDerWaalsContact NH1-CE1 3.32Å; R378-H1049 PolarHBondContact NH1-ND1 3.25Å; R378-H1049 PolarHBondContact NH1-NE2 3.43Å; R378-H1049 PolarHBondContact NH2-CE1 3.18Å; R378-H1049 VanDerWaalsContact NH2-CE1 3.26Å; R378-H1049 PolarHBondContact NH2-NE2 3.13Å
379	Q	46.7	Very low	44.9	Very low	99 Å²	99	81.2 Å²	81.2	46%	0.463	43%	0.433	S	S	.	.	H	α-helix	trans	-61.9	-40.3	173.1	-87.5	-177.9	-28	0	0	111	G375 M376 A382 Y383 I1046	G375-Q379 PolarHBondContact O-N 2.88Å; M376-Q379 PolarHBondContact O-N 3.41Å; M376-Q379 VanDerWaalsContact O-N 3.14Å; Q379-A382 PolarHBondContact O-N 3.2Å; Q379-Y383 PolarHBondContact O-N 3.35Å; Q379-I1046 HydrophobicContact CG-CD1 4.27Å; Q379-I1046 HydrophobicContact CG-CG2 4.22Å
380	I	47.2	Very low	44.4	Very low	67 Å²	67	84.1 Å²	84.1	34%	0.344	45%	0.445	S	S	.	.	H	α-helix	trans	-71.6	-42.5	179.9	-63.6	158	0	0	0	110.8	F360 M376 T377 R378 A382 Y383 R384	F360-I380 HydrophobicContact CD2-CD1 4.07Å; F360-I380 HydrophobicContact CE1-CD1 3.88Å; F360-I380 HydrophobicContact CE2-CD1 3.39Å; F360-I380 HydrophobicContact CE2-CG1 4.27Å; F360-I380 HydrophobicContact CZ-CD1 3.28Å; F360-I380 HydrophobicContact CZ-CG1 4.45Å; M376-I380 WeakPolarHBondContact O-CD1 3.46Å; M376-I380 VanDerWaalsContact O-CG1 3.28Å; M376-I380 WeakPolarHBondContact O-CG1 3.28Å; M376-I380 PolarHBondContact O-N 3.5Å; T377-I380 PolarHBondContact O-N 3.22Å; R378-I380 VanDerWaalsContact C-N 3.27Å; I380-A382 VanDerWaalsContact C-N 3.29Å; I380-A382 PolarHBondContact O-N 3.46Å; I380-Y383 PolarHBondContact O-N 3.36Å; I380-R384 WeakPolarHBondContact O-CB 3.44Å; I380-R384 PolarHBondContact O-N 3.1Å
381	E	48.1	Very low	43.9	Very low	91 Å²	91	87.2 Å²	87.2	43%	0.425	44%	0.439	S	S	.	.	H	α-helix	trans	-59.8	-38.2	172.3	-80	-179.6	-170.8	0	0	112.5	I6 T377 R384 K385	I6-E381 HydrophobicContact CD1-CG 4.34Å; T377-E381 WeakPolarHBondContact O-CG 3.12Å; T377-E381 PolarHBondContact O-N 2.87Å; E381-R384 PolarHBondContact O-N 2.96Å; E381-K385 WeakPolarHBondContact O-CG 3.36Å; E381-K385 PolarHBondContact O-N 3.2Å
382	A	47.6	Very low	43.6	Very low	33 Å²	33	88.9 Å²	88.9	27%	0.273	45%	0.448	S	S	.	.	H	α-helix	trans	-64.6	-46.3	174.7	0	0	0	0	0	111.2	R378 Q379 I380 R384 K385 E386	R378-A382 WeakPolarHBondContact O-CB 3.45Å; R378-A382 PolarHBondContact O-N 3.4Å; Q379-A382 PolarHBondContact O-N 3.2Å; I380-A382 VanDerWaalsContact C-N 3.29Å; I380-A382 PolarHBondContact O-N 3.46Å; A382-R384 VanDerWaalsContact C-N 3.29Å; A382-R384 PolarHBondContact O-N 3.38Å; A382-K385 PolarHBondContact O-N 3.45Å; A382-E386 WeakPolarHBondContact O-CG 3.44Å; A382-E386 PolarHBondContact O-N 3.41Å
383	Y	46.6	Very low	43.1	Very low	164 Å²	164	88.2 Å²	88.2	64%	0.643	45%	0.447	S	S	*	.	H	α-helix	trans	-61	-37.5	176.2	-131.3	-85.2	0	0	0	112.5	Q379 I380 E386 T387	Q379-Y383 PolarHBondContact O-N 3.35Å; I380-Y383 PolarHBondContact O-N 3.36Å; Y383-E386 PolarHBondContact O-N 3.2Å; Y383-T387 PolarHBondContact O-N 3Å; Y383-T387 PolarHBondContact O-OG1 3.22Å
384	R	47	Very low	42.7	Very low	138 Å²	138	92.1 Å²	92.1	52%	0.521	47%	0.468	S	S	.	.	H	α-helix	trans	-68.9	-38.3	176.7	-152.2	177.1	-167.3	176.9	6	111.5	I380 E381 A382 T387 V388	I380-R384 WeakPolarHBondContact O-CB 3.44Å; I380-R384 PolarHBondContact O-N 3.1Å; E381-R384 PolarHBondContact O-N 2.96Å; A382-R384 VanDerWaalsContact C-N 3.29Å; A382-R384 PolarHBondContact O-N 3.38Å; R384-T387 WeakPolarHBondContact CA-OG1 3.5Å; R384-T387 PolarHBondContact O-OG1 3.37Å; R384-T387 VanDerWaalsContact O-OG1 3.1Å; R384-V388 VanDerWaalsContact O-CG2 3.22Å; R384-V388 WeakPolarHBondContact O-CG2 3.49Å; R384-V388 PolarHBondContact O-N 3.21Å; R384-V388 VanDerWaalsContact O-N 3.16Å
385	K	47.5	Very low	41.8	Very low	140 Å²	140	100.9 Å²	100.9	61%	0.609	49%	0.493	S	S	*	.	H	α-helix	trans	-67.1	-39.4	173.6	-79.2	175.8	179.2	167.3	0	112.5	E381 A382 V388 C389	E381-K385 WeakPolarHBondContact O-CG 3.36Å; E381-K385 PolarHBondContact O-N 3.2Å; A382-K385 PolarHBondContact O-N 3.45Å; K385-V388 PolarHBondContact O-N 2.99Å; K385-C389 WeakPolarHBondContact O-CB 3.43Å; K385-C389 PolarHBondContact O-N 3.33Å
386	E	42.4	Very low	40.8	Very low	83 Å²	83	109.4 Å²	109.4	39%	0.388	52%	0.515	S	S	.	.	H	α-helix	trans	-63.3	-46.1	176.4	-74.5	177.8	168.5	0	0	111.2	A382 Y383 V388 C389 E390	A382-E386 WeakPolarHBondContact O-CG 3.44Å; A382-E386 PolarHBondContact O-N 3.41Å; Y383-E386 PolarHBondContact O-N 3.2Å; E386-V388 VanDerWaalsContact C-N 3.3Å; E386-V388 PolarHBondContact O-N 2.84Å; E386-C389 PolarHBondContact O-N 3.24Å; E386-E390 WeakPolarHBondContact O-CG 3.3Å; E386-E390 PolarHBondContact O-N 3.34Å
387	T	40.8	Very low	39.9	Very low	48 Å²	48	110.3 Å²	110.3	29%	0.294	53%	0.529	S	S	.	.	H	α-helix	trans	-71.3	-17.5	178.9	47.8	0	0	0	0	115.2	Y383 R384 R391	Y383-T387 PolarHBondContact O-N 3Å; Y383-T387 PolarHBondContact O-OG1 3.22Å; R384-T387 WeakPolarHBondContact CA-OG1 3.5Å; R384-T387 PolarHBondContact O-OG1 3.37Å; R384-T387 VanDerWaalsContact O-OG1 3.1Å; T387-R391 PolarHBondContact O-NE 3.39Å
388	V	40.2	Very low	39	Very low	75 Å²	75	119.4 Å²	119.4	46%	0.455	57%	0.567	S	S	.	*	H	α-helix	trans	-84.9	-43	170.7	172.1	0	0	0	0	110.5	R384 K385 E386 E390 R391 D392	R384-V388 VanDerWaalsContact O-CG2 3.22Å; R384-V388 WeakPolarHBondContact O-CG2 3.49Å; R384-V388 PolarHBondContact O-N 3.21Å; R384-V388 VanDerWaalsContact O-N 3.16Å; K385-V388 PolarHBondContact O-N 2.99Å; E386-V388 VanDerWaalsContact C-N 3.3Å; E386-V388 PolarHBondContact O-N 2.84Å; V388-E390 VanDerWaalsContact C-N 3.35Å; V388-E390 PolarHBondContact O-N 3.22Å; V388-R391 PolarHBondContact O-N 2.98Å; V388-D392 PolarHBondContact O-N 2.65Å; V388-D392 VanDerWaalsContact O-N 3.1Å
389	C	33.7	Very low	38	Very low	91 Å²	91	117.4 Å²	117.4	62%	0.615	58%	0.579	S	S	*	*	H	α-helix	trans	-67.1	-31.2	176.3	-78	0	0	0	0	113.5	K385 E386 R391 G393	K385-C389 WeakPolarHBondContact O-CB 3.43Å; K385-C389 PolarHBondContact O-N 3.33Å; E386-C389 PolarHBondContact O-N 3.24Å; C389-R391 VanDerWaalsContact C-N 3.3Å; C389-R391 PolarHBondContact O-N 3.42Å; C389-G393 PolarHBondContact O-N 3.18Å
390	E	37.2	Very low	36.9	Very low	144 Å²	144	118.4 Å²	118.4	67%	0.673	60%	0.597	S	S	*	*	H	α-helix	trans	-66.8	-30	173.1	-79.5	-176.8	156.5	0	0	112.7	E386 V388	E386-E390 WeakPolarHBondContact O-CG 3.3Å; E386-E390 PolarHBondContact O-N 3.34Å; V388-E390 VanDerWaalsContact C-N 3.35Å; V388-E390 PolarHBondContact O-N 3.22Å
391	R	33.9	Very low	35.8	Very low	144 Å²	144	124.7 Å²	124.7	54%	0.543	62%	0.622	S	S	.	*	H	α-helix	trans	-87.6	-28.4	179.8	-79.5	-173.3	-82.9	-172.8	-5.8	114	T387 V388 C389	T387-R391 PolarHBondContact O-NE 3.39Å; V388-R391 PolarHBondContact O-N 2.98Å; C389-R391 VanDerWaalsContact C-N 3.3Å; C389-R391 PolarHBondContact O-N 3.42Å
392	D	36.3	Very low	34.8	Very low	118 Å²	118	124.6 Å²	124.6	63%	0.631	64%	0.637	S	S	*	*	H	α-helix	trans	-84.3	-19.9	171.4	-80.3	-27.9	0	0	0	112.9	V388	V388-D392 PolarHBondContact O-N 2.65Å; V388-D392 VanDerWaalsContact O-N 3.1Å
393	G	34.4	Very low	33.8	Very low	41 Å²	41	129 Å²	129	42%	0.423	66%	0.66	S	S	.	*	H	α-helix	trans	-74.2	-23.7	176	0	0	0	0	0	114.8	C389 R395	C389-G393 PolarHBondContact O-N 3.18Å; G393-R395 VanDerWaalsContact C-N 3.32Å
394	D	34.5	Very low	32.7	Very low	153 Å²	153	133 Å²	133	82%	0.818	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	1.9	-179.5	-117.1	-2.2	0	0	0	113.8
395	R	28.2	Very low	31.7	Very low	220 Å²	220	135.2 Å²	135.2	83%	0.83	69%	0.687	S	S	*	*			trans	-109.3	58.5	167.8	-72.3	-176.3	177	170.8	0.1	111.2	G393	G393-R395 VanDerWaalsContact C-N 3.32Å
396	R	25.7	Very low	30.7	Very low	211 Å²	211	136.3 Å²	136.3	80%	0.796	70%	0.699	S	S	*	*			trans	-80.4	134.8	156.2	-70.2	-171.7	-169.6	-179.6	5.4	109.1	K398	R396-K398 PolarHBondContact O-N 2.82Å
397	P	27	Very low	29.8	Very low	125 Å²	125	139 Å²	139	81%	0.812	72%	0.721	S	S	*	*			trans	-69.4	99	-174	29.5	-32.7	0	0	0	109.1	G399	P397-G399 PolarHBondContact O-N 3.33Å; P397-G399 VanDerWaalsContact O-N 3.16Å
398	K	25.7	Very low	29.1	Very low	217 Å²	217	145.1 Å²	145.1	94%	0.943	75%	0.746	S	S	*	*			trans	-68.6	104.8	160.6	-75.6	-177.1	178.6	175	0	106.8	R396	R396-K398 PolarHBondContact O-N 2.82Å
399	G	26.5	Very low	28.4	Very low	64 Å²	64	150.7 Å²	150.7	66%	0.66	77%	0.768	S	S	*	*			trans	128.9	61.9	171.5	0	0	0	0	0	114.1	P397 F401	P397-G399 PolarHBondContact O-N 3.33Å; P397-G399 VanDerWaalsContact O-N 3.16Å; G399-F401 PolarHBondContact O-N 3.17Å
400	S	23.2	Very low	28.1	Very low	120 Å²	120	151.9 Å²	151.9	84%	0.839	78%	0.777	S	S	*	*			trans	-67.2	82.4	144.4	166.5	0	0	0	0	107.3
401	F	25.7	Very low	27.5	Very low	199 Å²	199	153.1 Å²	153.1	87%	0.873	78%	0.783	S	S	*	*			trans	-154.6	118.1	158.5	-122.6	-88.7	0	0	0	109.8	G399	G399-F401 PolarHBondContact O-N 3.17Å
402	A	26.7	Very low	27.1	Very low	89 Å²	89	152.6 Å²	152.6	74%	0.736	79%	0.791	S	S	*	*			trans	87.4	133.6	158.8	0	0	0	0	0	119.8
403	V	26.6	Very low	26.6	Very low	126 Å²	126	153.2 Å²	153.2	76%	0.764	79%	0.794	S	S	*	*			trans	91.4	62.1	154.9	-151.6	0	0	0	0	117.7	K405	V403-K405 HydrophobicContact CG1-CB 4.49Å; V403-K405 PolarHBondContact O-N 3.23Å
404	R	23.4	Very low	26.2	Very low	248 Å²	248	158.2 Å²	158.2	94%	0.936	81%	0.81	S	S	*	*			trans	-49.7	102.4	130.6	-169.7	-175.8	-160.2	-179.6	4.8	110.2
405	K	25.8	Very low	25.7	Very low	183 Å²	183	156 Å²	156	80%	0.796	80%	0.802	S	S	*	*			trans	-179.8	142.2	150.8	-106.1	174.6	-177.3	-174.9	0	109.5	V403	V403-K405 HydrophobicContact CG1-CB 4.49Å; V403-K405 PolarHBondContact O-N 3.23Å
406	L	27.5	Very low	25.6	Very low	164 Å²	164	152.7 Å²	152.7	86%	0.859	80%	0.801	S	S	*	*			trans	92.5	49.2	173.4	-52.2	165	0	0	0	116.4
407	T	22.9	Very low	25.5	Very low	139 Å²	139	146.1 Å²	146.1	85%	0.853	80%	0.799	S	S	*	*			trans	-98.7	104.6	135.7	-41.2	0	0	0	0	105.4
408	E	25.3	Very low	25.3	Very low	176 Å²	176	144.9 Å²	144.9	82%	0.822	79%	0.793	S	S	*	*			trans	154.9	99.9	162	-92	169.1	-165	0	0	108.6
409	Q	26.4	Very low	25.2	Very low	193 Å²	193	144.9 Å²	144.9	90%	0.902	79%	0.789	S	S	*	*			trans	168.7	126.3	135.6	-92.6	173.5	-3.6	0	0	110.6
410	S	26.6	Very low	25.3	Very low	116 Å²	116	147.5 Å²	147.5	81%	0.811	79%	0.792	S	S	*	*			trans	66	108.3	164.5	-112.4	0	0	0	0	116.8
411	Q	24.4	Very low	26	Very low	170 Å²	170	146.9 Å²	146.9	79%	0.794	79%	0.785	S	S	*	*			cis	38.3	92.8	42.4	-82.8	-168.8	-6	0	0	113.1
412	N	25.6	Very low	26	Very low	133 Å²	133	143 Å²	143	71%	0.711	78%	0.782	S	S	*	*				168.2	131.6	115.7	-83.9	-20.4	0	0	0	112.2
413	N	27.1	Very low	26.3	Very low	130 Å²	130	144 Å²	144	70%	0.695	78%	0.784	S	S	*	*			trans	76.9	111.8	139.6	-63.2	-15.9	0	0	0	121.5
414	L	25	Very low	26.4	Very low	146 Å²	146	145.1 Å²	145.1	76%	0.764	79%	0.785	S	S	*	*				61.7	120	121.1	-88.6	90.8	0	0	0	120.5
415	V	25.4	Very low	26.7	Very low	107 Å²	107	139.6 Å²	139.6	65%	0.648	77%	0.774	S	S	*	*				84.2	130.4	122.3	174.8	0	0	0	0	119.1
416	N	24.8	Very low	27	Very low	150 Å²	150	137.4 Å²	137.4	80%	0.802	77%	0.77	S	S	*	*			trans	72.3	108.9	158.4	-69.5	-13.2	0	0	0	120
417	G	23.3	Very low	27	Very low	74 Å²	74	138.3 Å²	138.3	76%	0.763	77%	0.767	S	S	*	*				83.8	128.1	116.8	0	0	0	0	0	118.8
418	S	22.9	Very low	27.2	Very low	98 Å²	98	139.9 Å²	139.9	69%	0.685	77%	0.765	S	S	*	*			trans	85.9	113.9	135.8	176.7	0	0	0	0	120.3
419	Y	24.8	Very low	27.4	Very low	218 Å²	218	140.7 Å²	140.7	86%	0.855	77%	0.769	S	S	*	*			trans	65.5	151	143	-71.5	-116.5	0	0	0	116.5
420	V	27.4	Very low	27.4	Very low	118 Å²	118	136.8 Å²	136.8	72%	0.715	76%	0.758	S	S	*	*			cis	-169.7	163.4	-0	127.1	0	0	0	0	105.7
421	P	37.4	Very low	27.3	Very low	107 Å²	107	137.5 Å²	137.5	70%	0.695	75%	0.753	S	S	*	*			trans	-92	163.8	-166.2	36.8	-34.6	0	0	0	114.6
422	S	25.7	Very low	27.6	Very low	117 Å²	117	136 Å²	136	82%	0.818	75%	0.75	S	S	*	*			trans	159.6	144.5	140.4	47.6	0	0	0	0	113.4
423	S	34.7	Very low	27.6	Very low	112 Å²	112	136.6 Å²	136.6	78%	0.783	75%	0.752	S	S	*	*			trans	151.3	108.8	134.1	66.6	0	0	0	0	111.3
424	L	27.5	Very low	27.7	Very low	149 Å²	149	137.4 Å²	137.4	78%	0.78	76%	0.755	S	S	*	*				59.1	114	84.4	-124.3	86.1	0	0	0	113.3
425	N	30.7	Very low	27.8	Very low	131 Å²	131	139.8 Å²	139.8	70%	0.701	76%	0.759	S	S	*	*				164.6	155.6	94.9	-91.7	-39.5	0	0	0	107.2
426	L	31.2	Very low	28.2	Very low	138 Å²	138	140 Å²	140	72%	0.723	76%	0.762	S	S	*	*			cis	-168.6	123	22	-144.9	76.7	0	0	0	104.8
427	K	27.2	Very low	28.2	Very low	183 Å²	183	140.4 Å²	140.4	80%	0.796	77%	0.765	S	S	*	*				54.5	135.8	89.7	-124.2	-178.8	-172.9	179.2	0	117.6
428	Q	28.7	Very low	28.4	Very low	172 Å²	172	141.5 Å²	141.5	80%	0.804	76%	0.761	S	S	*	*			trans	85.2	122.6	163.6	-60.6	165.5	-27	0	0	114.6
429	Q	29.2	Very low	28.8	Very low	193 Å²	193	144.4 Å²	144.4	90%	0.902	77%	0.769	S	S	*	*				-162.9	145.6	53.1	-155.7	166.5	-6.9	0	0	111
430	T	26.5	Very low	28.9	Very low	111 Å²	111	143.2 Å²	143.2	68%	0.681	77%	0.768	S	S	*	*			trans	-97.6	170.7	-168.5	51.4	0	0	0	0	113.6
431	D	24.5	Very low	28.8	Very low	130 Å²	130	145.4 Å²	145.4	70%	0.695	78%	0.775	S	S	*	*			trans	73.9	117.3	146.9	-52.3	-37.1	0	0	0	121.5
432	N	30.7	Very low	28.2	Very low	139 Å²	139	145.7 Å²	145.7	74%	0.743	78%	0.776	S	S	*	*				157.7	99.8	122.2	-76.9	-34.9	0	0	0	110.5
433	I	25.9	Very low	28.3	Very low	146 Å²	146	147.9 Å²	147.9	75%	0.749	78%	0.777	S	S	*	*				63.1	131.1	94.8	-49.8	165.8	0	0	0	113.8
434	I	29.1	Very low	27.8	Very low	146 Å²	146	147.5 Å²	147.5	75%	0.749	77%	0.772	S	S	*	*			trans	113.6	95.5	149.4	-50	-176.2	0	0	0	117.6
435	K	25.7	Very low	27.7	Very low	196 Å²	196	145.1 Å²	145.1	85%	0.852	77%	0.768	S	S	*	*			trans	62.3	148.6	131.5	-74.4	-176.2	177.4	179.1	0	123.2
436	P	33.5	Very low	27.5	Very low	111 Å²	111	146.2 Å²	146.2	72%	0.721	77%	0.774	S	S	*	*			trans	-90.1	144.6	-168.8	37.1	-30.1	0	0	0	111.1
437	D	26.2	Very low	27.2	Very low	160 Å²	160	146.2 Å²	146.2	86%	0.856	77%	0.77	S	S	*	*			trans	-162.6	148.6	146.2	-103.9	-27.5	0	0	0	111.6
438	S	26.9	Very low	27.3	Very low	97 Å²	97	145.1 Å²	145.1	68%	0.678	77%	0.772	S	S	*	*			trans	-45.6	131	175.2	50.3	0	0	0	0	113.6
439	D	30.7	Very low	27.2	Very low	159 Å²	159	142.9 Å²	142.9	85%	0.85	77%	0.765	S	S	*	*				-161.1	134.7	127.3	-97.5	-29.7	0	0	0	112.1
440	K	27.7	Very low	27	Very low	192 Å²	192	137.2 Å²	137.2	84%	0.835	74%	0.744	S	S	*	*			trans	-56.3	138.9	173.7	-66.5	165.6	177	172.6	0	109.4
441	L	25	Very low	27	Very low	165 Å²	165	135.7 Å²	135.7	86%	0.864	74%	0.736	S	S	*	*			trans	177.7	152.9	136	-90.5	155.7	0	0	0	109
442	P	26.3	Very low	27.4	Very low	112 Å²	112	137.9 Å²	137.9	73%	0.727	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-101.9	136.3	-132.4	35.9	-29.1	0	0	0	112.2
443	I	25.8	Very low	27.6	Very low	163 Å²	163	135.6 Å²	135.6	84%	0.836	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-85.4	127.7	174.6	-57.9	174	0	0	0	107.9	S445	I443-S445 PolarHBondContact O-N 3.12Å
444	P	26	Very low	28.1	Very low	104 Å²	104	131.6 Å²	131.6	68%	0.675	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-73.4	122.9	-162	28.9	-34.3	0	0	0	111.8	N446	P444-N446 PolarHBondContact O-N 3.06Å; P444-N446 VanDerWaalsContact O-N 3.1Å
445	S	24.3	Very low	28.8	Very low	99 Å²	99	133.9 Å²	133.9	69%	0.692	72%	0.715	S	S	*	*			trans	-66.1	98.8	162.5	51.3	0	0	0	0	109.2	I443 E447	I443-S445 PolarHBondContact O-N 3.12Å; S445-E447 PolarHBondContact O-N 3.46Å
446	N	26.7	Very low	29.8	Very low	154 Å²	154	134 Å²	134	82%	0.824	71%	0.711	S	S	*	*			trans	-75.6	71.9	160.5	-81.8	-16.5	0	0	0	108.5	P444 I448	P444-N446 PolarHBondContact O-N 3.06Å; P444-N446 VanDerWaalsContact O-N 3.1Å; N446-I448 PolarHBondContact O-N 3.34Å
447	E	25.4	Very low	30.5	Very low	138 Å²	138	135.9 Å²	135.9	65%	0.645	71%	0.707	S	S	*	*			trans	-55.2	117.5	151.3	-94.3	-179.5	146.5	0	0	106.3	S445 D449	S445-E447 PolarHBondContact O-N 3.46Å; E447-D449 PolarHBondContact O-N 3.27Å
448	I	28.3	Very low	31.8	Very low	161 Å²	161	131.8 Å²	131.8	83%	0.826	69%	0.685	S	S	*	*			trans	-64.5	98.8	162.1	-65	172.5	0	0	0	104.7	N446 T450	N446-I448 PolarHBondContact O-N 3.34Å; I448-T450 VanDerWaalsContact C-N 3.25Å; I448-T450 PolarHBondContact O-N 3.27Å
449	D	26.5	Very low	32.9	Very low	124 Å²	124	133.3 Å²	133.3	66%	0.663	68%	0.679	S	S	*	*			trans	-51.3	90.3	170.5	-83.5	-44.2	0	0	0	109.1	E447	E447-D449 PolarHBondContact O-N 3.27Å
450	T	26.5	Very low	34.1	Very low	74 Å²	74	131 Å²	131	45%	0.454	67%	0.667	S	S	.	*			trans	-51.9	124.9	141.2	54.3	0	0	0	0	104.4	I448 K452	I448-T450 VanDerWaalsContact C-N 3.25Å; I448-T450 PolarHBondContact O-N 3.27Å; T450-K452 PolarHBondContact O-N 3.37Å
451	P	26.2	Very low	35.5	Very low	80 Å²	80	127.5 Å²	127.5	52%	0.519	65%	0.648	S	S	.	*			trans	-54	120.5	175.8	22.8	-30.8	0	0	0	105.4	I453	P451-I453 HydrophobicContact CB-CG1 4.42Å; P451-I453 HydrophobicContact CG-CG1 4.28Å; P451-I453 PolarHBondContact O-N 3.03Å
452	K	31.8	Very low	37.2	Very low	175 Å²	175	122.9 Å²	122.9	76%	0.761	62%	0.624	S	S	*	*			trans	-60.5	77.8	168.1	-78.7	174.3	179.5	159.3	0	106.2	T450 S454	T450-K452 PolarHBondContact O-N 3.37Å; K452-S454 PolarHBondContact O-N 3.41Å
453	I	36.1	Very low	38.8	Very low	92 Å²	92	121.7 Å²	121.7	47%	0.472	61%	0.608	S	S	.	*			trans	-61.1	109.8	171	-61.9	174.5	0	0	0	102.4	P451 K455 K457 I458	P451-I453 HydrophobicContact CB-CG1 4.42Å; P451-I453 HydrophobicContact CG-CG1 4.28Å; P451-I453 PolarHBondContact O-N 3.03Å; I453-K455 PolarHBondContact O-N 2.95Å; I453-K457 HydrophobicContact CG2-CB 3.63Å; I453-I458 HydrophobicContact CB-CD1 4.29Å; I453-I458 HydrophobicContact CB-CG1 4.2Å; I453-I458 HydrophobicContact CG2-CD1 4.22Å; I453-I458 HydrophobicContact CG2-CG1 3.59Å
454	S	35.1	Very low	40.5	Very low	62 Å²	62	117.5 Å²	117.5	43%	0.434	59%	0.592	S	S	.	*			trans	-52.2	139.2	-175.6	85.5	0	0	0	0	108.4	K452 R456 K457 I458	K452-S454 PolarHBondContact O-N 3.41Å; S454-R456 CarbonylContact O-C 3.55Å; S454-R456 PolarHBondContact O-N 3.42Å; S454-K457 PolarHBondContact O-N 3.36Å; S454-K457 PolarHBondContact OG-N 3.45Å; S454-I458 PolarHBondContact O-N 3.37Å
455	K	45.3	Very low	42.7	Very low	193 Å²	193	116.2 Å²	116.2	84%	0.839	58%	0.584	S	S	*	*	H	α-helix	trans	-48.3	-27	178.5	-67.4	-177.4	178.3	179.2	0	111.9	I453 F459	I453-K455 PolarHBondContact O-N 2.95Å; K455-F459 VanDerWaalsContact O-CB 3.22Å; K455-F459 WeakPolarHBondContact O-CB 3.28Å; K455-F459 PolarHBondContact O-N 2.97Å
456	R	45.7	Very low	45.3	Very low	200 Å²	200	115.2 Å²	115.2	76%	0.755	58%	0.575	S	S	*	*	H	α-helix	trans	-66.3	-42.4	172.4	-69.4	-174.2	177.8	-173	-0.2	114.4	S454 F459 L460	S454-R456 CarbonylContact O-C 3.55Å; S454-R456 PolarHBondContact O-N 3.42Å; R456-F459 PolarHBondContact O-N 2.93Å; R456-L460 WeakPolarHBondContact O-CB 3.45Å; R456-L460 PolarHBondContact O-N 3.01Å
457	K	47.6	Very low	48	Very low	149 Å²	149	111.6 Å²	111.6	65%	0.648	55%	0.552	S	S	*	*	H	α-helix	trans	-69.1	-33.8	178.5	-86	-174.1	178.1	-179.8	0	112.5	I453 S454 R461	I453-K457 HydrophobicContact CG2-CB 3.63Å; S454-K457 PolarHBondContact O-N 3.36Å; S454-K457 PolarHBondContact OG-N 3.45Å; K457-R461 VanDerWaalsContact O-CB 3.32Å; K457-R461 WeakPolarHBondContact O-CB 3.35Å; K457-R461 PolarHBondContact O-N 3.17Å; K457-R461 VanDerWaalsContact O-N 3.11Å
458	I	53.5	Low	50.8	Low	75 Å²	75	106.1 Å²	106.1	39%	0.385	53%	0.527	S	S	.	.	H	α-helix	trans	-69.1	-47.8	172.4	-60.1	175.2	0	0	0	109.7	I453 S454 L460 R461 D462	I453-I458 HydrophobicContact CB-CD1 4.29Å; I453-I458 HydrophobicContact CB-CG1 4.2Å; I453-I458 HydrophobicContact CG2-CD1 4.22Å; I453-I458 HydrophobicContact CG2-CG1 3.59Å; S454-I458 PolarHBondContact O-N 3.37Å; I458-L460 PolarHBondContact O-N 3.17Å; I458-R461 PolarHBondContact O-N 3.01Å; I458-R461 VanDerWaalsContact O-N 3.13Å; I458-D462 WeakPolarHBondContact CG2-OD2 3.48Å; I458-D462 VanDerWaalsContact O-CG 3.31Å; I458-D462 PolarHBondContact O-N 3.4Å
459	F	51.2	Low	53.3	Low	129 Å²	129	100.2 Å²	100.2	57%	0.566	50%	0.496	S	S	*	.	H	α-helix	trans	-57.7	-44.7	177.3	-175.2	-97.5	0	0	0	112.8	K455 R456 D462 F463	K455-F459 VanDerWaalsContact O-CB 3.22Å; K455-F459 WeakPolarHBondContact O-CB 3.28Å; K455-F459 PolarHBondContact O-N 2.97Å; R456-F459 PolarHBondContact O-N 2.93Å; F459-D462 PolarHBondContact O-N 3Å; F459-F463 HydrophobicContact CE2-CD2 4.04Å; F459-F463 HydrophobicContact CE2-CE2 4.08Å; F459-F463 HydrophobicContact CZ-CD2 4.07Å; F459-F463 HydrophobicContact CZ-CE2 4.2Å; F459-F463 PolarHBondContact O-N 3.2Å
460	L	54.8	Low	56.2	Low	111 Å²	111	96.1 Å²	96.1	58%	0.581	47%	0.474	S	S	*	.	H	α-helix	trans	-66.6	-34.7	176.1	-89.9	149.9	0	0	0	113.1	R456 I458 D462 C464	R456-L460 WeakPolarHBondContact O-CB 3.45Å; R456-L460 PolarHBondContact O-N 3.01Å; I458-L460 PolarHBondContact O-N 3.17Å; L460-D462 VanDerWaalsContact C-N 3.34Å; L460-C464 WeakPolarHBondContact O-CB 3.35Å; L460-C464 PolarHBondContact O-N 3.39Å; L460-C464 VanDerWaalsContact O-O 3.08Å
461	R	58.5	Low	58.9	Low	118 Å²	118	96 Å²	96	45%	0.445	48%	0.476	S	S	.	.	H	α-helix	trans	-71.1	-29.5	176.9	-169.8	-177.6	81.1	153	1.1	112.6	K457 I458 E1033	K457-R461 VanDerWaalsContact O-CB 3.32Å; K457-R461 WeakPolarHBondContact O-CB 3.35Å; K457-R461 PolarHBondContact O-N 3.17Å; K457-R461 VanDerWaalsContact O-N 3.11Å; I458-R461 PolarHBondContact O-N 3.01Å; I458-R461 VanDerWaalsContact O-N 3.13Å; R461-E1033 IonicContact CZ-OE1 3.58Å; R461-E1033 IonicContact NH1-OE1 3.51Å; R461-E1033 PolarHBondContact NH1-OE1 3.21Å; R461-E1033 IonicContact NH2-OE1 3.35Å; R461-E1033 PolarHBondContact NH2-OE1 3.14Å
462	D	59.1	Low	61.7	Low	68 Å²	68	98.5 Å²	98.5	36%	0.364	48%	0.475	S	S	.	.	H	α-helix	trans	-89.6	-28	-177.2	-66.3	-17.2	0	0	0	112.3	I458 F459 L460 N600	I458-D462 WeakPolarHBondContact CG2-OD2 3.48Å; I458-D462 VanDerWaalsContact O-CG 3.31Å; I458-D462 PolarHBondContact O-N 3.4Å; F459-D462 PolarHBondContact O-N 3Å; L460-D462 VanDerWaalsContact C-N 3.34Å; D462-N600 PolarHBondContact O-ND2 3.38Å
463	F	60.5	Low	64.1	Low	86 Å²	86	90.5 Å²	90.5	38%	0.377	44%	0.443	S	S	.	.	H	α-helix	trans	-89.9	-31.1	175.9	-107.2	-99.2	0	0	0	114.3	F459 C599 N600	F459-F463 HydrophobicContact CE2-CD2 4.04Å; F459-F463 HydrophobicContact CE2-CE2 4.08Å; F459-F463 HydrophobicContact CZ-CD2 4.07Å; F459-F463 HydrophobicContact CZ-CE2 4.2Å; F459-F463 PolarHBondContact O-N 3.2Å; F463-C599 HydrophobicContact CE1-CB 3.96Å; F463-C599 WeakPolarHBondContact CE1-O 3.45Å; F463-N600 PolarHBondContact O-ND2 3.18Å
464	C	61.1	Low	66.6	Low	76 Å²	76	89.2 Å²	89.2	51%	0.514	44%	0.436	S	S	.	.	S	Bend	trans	-126.3	133.3	-179.1	-71.9	0	0	0	0	110.5	L460	L460-C464 WeakPolarHBondContact O-CB 3.35Å; L460-C464 PolarHBondContact O-N 3.39Å; L460-C464 VanDerWaalsContact O-O 3.08Å
465	P	73.5	Confident	69.1	Low	76 Å²	76	96.4 Å²	96.4	49%	0.494	45%	0.453	S	S	.	.	S	Bend	cis	-74.8	154.5	4.5	29.1	-36.2	0	0	0	114.3	I468 N600	P465-I468 HydrophobicContact CG-CB 4.33Å; P465-I468 HydrophobicContact CG-CD1 4.2Å; P465-I468 WeakPolarHBondContact O-CB 3.46Å; P465-I468 PolarHBondContact O-N 3.05Å; P465-N600 PolarHBondContact O-ND2 3.39Å
466	P	78.7	Confident	71	Confident	78 Å²	78	90.1 Å²	90.1	51%	0.506	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	150.3	172.4	27.5	-35.1	0	0	0	110.7	I468 G598	P466-I468 PolarHBondContact O-N 2.92Å; P466-G598 WeakPolarHBondContact CA-O 3.29Å; P466-G598 WeakPolarHBondContact CB-O 3.35Å
467	F	83	Confident	73.1	Confident	78 Å²	78	82.3 Å²	82.3	34%	0.342	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	14.2	-178.5	-52.3	-83.5	0	0	0	115.9	E469 L470 S471 F594 V597 G598	F467-E469 VanDerWaalsContact C-N 3.3Å; F467-E469 PolarHBondContact O-N 3.32Å; F467-L470 HydrophobicContact CB-CB 4.37Å; F467-L470 HydrophobicContact CD1-CD2 4.05Å; F467-L470 PolarHBondContact O-N 3.41Å; F467-S471 PolarHBondContact O-N 3.16Å; F467-S471 PolarHBondContact O-OG 3.26Å; F467-F594 HydrophobicContact CE1-CD1 4.13Å; F467-F594 HydrophobicContact CE1-CE1 4.48Å; F467-F594 HydrophobicContact CZ-CD1 4.1Å; F467-V597 HydrophobicContact CD1-CG1 3.83Å; F467-V597 HydrophobicContact CE1-CB 4.43Å; F467-V597 HydrophobicContact CE1-CG1 4.06Å; F467-G598 PolarHBondContact N-O 3.21Å
468	I	83	Confident	75.2	Confident	23 Å²	23	80 Å²	80	12%	0.118	40%	0.397	C	S	.	.	H	α-helix	trans	-62.1	-37.6	178	-163	167.5	0	0	0	112.2	P465 P466 L470 S471 R472 N600	P465-I468 HydrophobicContact CG-CB 4.33Å; P465-I468 HydrophobicContact CG-CD1 4.2Å; P465-I468 WeakPolarHBondContact O-CB 3.46Å; P465-I468 PolarHBondContact O-N 3.05Å; P466-I468 PolarHBondContact O-N 2.92Å; I468-L470 VanDerWaalsContact C-N 3.34Å; I468-S471 PolarHBondContact O-N 3.1Å; I468-S471 PolarHBondContact O-OG 3.29Å; I468-R472 HydrophobicContact CG1-CG 4.46Å; I468-R472 WeakPolarHBondContact O-CB 3.47Å; I468-R472 VanDerWaalsContact O-CG 3.28Å; I468-R472 WeakPolarHBondContact O-CG 3.49Å; I468-R472 PolarHBondContact O-N 3.2Å; I468-N600 WeakPolarHBondContact CG2-ND2 3.43Å; I468-N600 PolarHBondContact N-OD1 3.1Å
469	E	82.1	Confident	76.8	Confident	38 Å²	38	85 Å²	85	18%	0.178	42%	0.416	C	S	.	.	H	α-helix	trans	-68.4	-35.7	177.3	-71.5	-164.2	137.8	0	0	111.8	F467 R472 G473 N600 S602 G603	F467-E469 VanDerWaalsContact C-N 3.3Å; F467-E469 PolarHBondContact O-N 3.32Å; E469-R472 PolarHBondContact O-N 3.45Å; E469-G473 PolarHBondContact O-N 2.96Å; E469-N600 HydrophobicContact CG-CB 3.93Å; E469-N600 PolarHBondContact N-OD1 2.99Å; E469-S602 VanDerWaalsContact OE2-CB 3.26Å; E469-S602 WeakPolarHBondContact OE2-CB 3.35Å; E469-S602 PolarHBondContact OE2-OG 3.38Å; E469-G603 PolarHBondContact OE1-N 3.14Å; E469-G603 PolarHBondContact OE2-N 2.94Å; E469-G603 VanDerWaalsContact OE2-N 3.1Å
470	L	86.2	Confident	78.6	Confident	37 Å²	37	79.8 Å²	79.8	19%	0.194	39%	0.392	C	S	.	.	H	α-helix	trans	-64.1	-50.3	175.1	-180	61.6	0	0	0	110.9	F467 I468 R472 G473 I474 V597 V791 M792 V795	F467-L470 HydrophobicContact CB-CB 4.37Å; F467-L470 HydrophobicContact CD1-CD2 4.05Å; F467-L470 PolarHBondContact O-N 3.41Å; I468-L470 VanDerWaalsContact C-N 3.34Å; L470-R472 VanDerWaalsContact C-N 3.33Å; L470-R472 PolarHBondContact O-N 3.46Å; L470-G473 PolarHBondContact O-N 3.05Å; L470-G473 VanDerWaalsContact O-N 3.08Å; L470-I474 HydrophobicContact CD1-CD1 4.18Å; L470-I474 HydrophobicContact CD1-CG1 4.26Å; L470-I474 HydrophobicContact CG-CD1 4.02Å; L470-I474 VanDerWaalsContact O-CG1 3.3Å; L470-I474 WeakPolarHBondContact O-CG1 3.42Å; L470-I474 PolarHBondContact O-N 3.48Å; L470-V597 HydrophobicContact CB-CG1 4.28Å; L470-V597 HydrophobicContact CD2-CG1 4.21Å; L470-V791 HydrophobicContact CB-CG2 4.02Å; L470-V791 HydrophobicContact CD1-CG1 4.49Å; L470-V791 HydrophobicContact CD1-CG2 4.11Å; L470-M792 HydrophobicContact CD1-SD 3.98Å; L470-V795 HydrophobicContact CD1-CG2 3.93Å
471	S	84.5	Confident	80.1	Confident	72 Å²	72	76.5 Å²	76.5	50%	0.503	38%	0.375	S	S	.	.	H	α-helix	trans	-60.9	-40.2	177.9	64.3	0	0	0	0	112.6	F467 I468 G473	F467-S471 PolarHBondContact O-N 3.16Å; F467-S471 PolarHBondContact O-OG 3.26Å; I468-S471 PolarHBondContact O-N 3.1Å; I468-S471 PolarHBondContact O-OG 3.29Å; S471-G473 VanDerWaalsContact C-N 3.35Å
472	R	83.7	Confident	81.6	Confident	132 Å²	132	74.5 Å²	74.5	50%	0.498	38%	0.377	S	S	.	.	H	α-helix	trans	-67.6	-32.5	173.9	-73.3	175.8	176.9	165.1	-0.1	112.7	I468 E469 L470 P476	I468-R472 HydrophobicContact CG1-CG 4.46Å; I468-R472 WeakPolarHBondContact O-CB 3.47Å; I468-R472 VanDerWaalsContact O-CG 3.28Å; I468-R472 WeakPolarHBondContact O-CG 3.49Å; I468-R472 PolarHBondContact O-N 3.2Å; E469-R472 PolarHBondContact O-N 3.45Å; L470-R472 VanDerWaalsContact C-N 3.33Å; L470-R472 PolarHBondContact O-N 3.46Å; R472-P476 WeakPolarHBondContact O-CD 3.46Å; R472-P476 WeakPolarHBondContact O-CG 3.22Å
473	G	83.6	Confident	83	Confident	8 Å²	8	72.5 Å²	72.5	8%	0.082	37%	0.372	C	S	.	.	H	α-helix	trans	-77.2	-33.9	-179	0	0	0	0	0	114.4	E469 L470 S471 R475 P476 W477	E469-G473 PolarHBondContact O-N 2.96Å; L470-G473 PolarHBondContact O-N 3.05Å; L470-G473 VanDerWaalsContact O-N 3.08Å; S471-G473 VanDerWaalsContact C-N 3.35Å; G473-R475 PolarHBondContact O-N 3.49Å; G473-P476 WeakPolarHBondContact O-CD 3.46Å; G473-W477 WeakPolarHBondContact O-CB 3.48Å; G473-W477 PolarHBondContact O-N 3.38Å; G473-W477 VanDerWaalsContact O-N 3.1Å
474	I	88.1	Confident	84.5	Confident	65 Å²	65	68.4 Å²	68.4	33%	0.333	35%	0.354	S	S	.	.	H	α-helix	trans	-61.1	-43.5	-177.9	-72.9	163.7	0	0	0	111.9	L470 W477 I478 M792	L470-I474 HydrophobicContact CD1-CD1 4.18Å; L470-I474 HydrophobicContact CD1-CG1 4.26Å; L470-I474 HydrophobicContact CG-CD1 4.02Å; L470-I474 VanDerWaalsContact O-CG1 3.3Å; L470-I474 WeakPolarHBondContact O-CG1 3.42Å; L470-I474 PolarHBondContact O-N 3.48Å; I474-W477 WeakPolarHBondContact O-CB 3.32Å; I474-W477 PolarHBondContact O-N 2.97Å; I474-I478 HydrophobicContact CG2-CD1 3.71Å; I474-I478 HydrophobicContact CG2-CG1 4.36Å; I474-I478 WeakPolarHBondContact O-CG1 3.33Å; I474-I478 PolarHBondContact O-N 3.32Å; I474-M792 HydrophobicContact CG1-SD 4.11Å
475	R	87.3	Confident	86	Confident	212 Å²	212	68.9 Å²	68.9	80%	0.8	35%	0.346	S	S	*	.	H	α-helix	trans	-65.4	-49.7	-175.9	-179.2	-178.6	-174.2	-173.4	3.2	113	G473 W477 K479	G473-R475 PolarHBondContact O-N 3.49Å; R475-W477 VanDerWaalsContact C-N 3.29Å; R475-W477 PolarHBondContact O-N 3.29Å; R475-K479 WeakPolarHBondContact O-CB 2.94Å; R475-K479 PolarHBondContact O-N 3.26Å
476	P	86.1	Confident	86.8	Confident	62 Å²	62	72.9 Å²	72.9	40%	0.403	36%	0.355	S	S	.	.	H	α-helix	trans	-61.1	-35.3	171.2	-23.6	33.7	0	0	0	113.3	R472 G473 K479 R480 I789	R472-P476 WeakPolarHBondContact O-CD 3.46Å; R472-P476 WeakPolarHBondContact O-CG 3.22Å; G473-P476 WeakPolarHBondContact O-CD 3.46Å; P476-K479 PolarHBondContact O-N 2.85Å; P476-R480 VanDerWaalsContact O-CB 3.26Å; P476-R480 WeakPolarHBondContact O-CB 3.38Å; P476-R480 PolarHBondContact O-N 3.45Å; P476-I789 HydrophobicContact CB-CD1 3.9Å
477	W	89.9	Confident	87.4	Confident	36 Å²	36	71.4 Å²	71.4	14%	0.136	34%	0.343	C	S	.	.	H	α-helix	trans	-63.5	-50.1	-179.9	172	70.3	0	0	0	112	G473 I474 R475 K479 R480 M481 L546 S547 I789 M792	G473-W477 WeakPolarHBondContact O-CB 3.48Å; G473-W477 PolarHBondContact O-N 3.38Å; G473-W477 VanDerWaalsContact O-N 3.1Å; I474-W477 WeakPolarHBondContact O-CB 3.32Å; I474-W477 PolarHBondContact O-N 2.97Å; R475-W477 VanDerWaalsContact C-N 3.29Å; R475-W477 PolarHBondContact O-N 3.29Å; W477-K479 PolarHBondContact O-N 2.91Å; W477-R480 PolarHBondContact O-N 2.89Å; W477-M481 HydrophobicContact CD2-CE 3.92Å; W477-M481 HydrophobicContact CE3-CE 4.48Å; W477-M481 HydrophobicContact CH2-CE 3.73Å; W477-M481 HydrophobicContact CZ2-CE 3.07Å; W477-M481 HydrophobicContact CZ3-CE 4.39Å; W477-M481 PolarHBondContact O-N 3.23Å; W477-L546 VanDerWaalsContact CE2-O 3.24Å; W477-L546 HydrophobicContact CZ2-CB 4.39Å; W477-L546 HydrophobicContact CZ2-CD2 4.25Å; W477-L546 WeakPolarHBondContact CZ2-O 3.31Å; W477-L546 PolarHBondContact NE1-O 3.04Å; W477-S547 PolarHBondContact NE1-O 3.5Å; W477-I789 HydrophobicContact CB-CD1 3.67Å; W477-I789 VanDerWaalsContact N-CD1 3.32Å; W477-M792 HydrophobicContact CB-CG 4.19Å; W477-M792 HydrophobicContact CD2-CE 3.83Å; W477-M792 HydrophobicContact CD2-CG 4.19Å; W477-M792 HydrophobicContact CD2-SD 4.3Å; W477-M792 HydrophobicContact CE3-CE 3.87Å; W477-M792 HydrophobicContact CE3-SD 4.36Å; W477-M792 HydrophobicContact CG-CG 3.9Å; W477-M792 HydrophobicContact CH2-CE 3.87Å; W477-M792 HydrophobicContact CZ2-CE 3.78Å; W477-M792 HydrophobicContact CZ3-CE 3.91Å
478	I	89.9	Confident	87.7	Confident	100 Å²	100	67.7 Å²	67.7	51%	0.513	33%	0.327	S	S	.	.	H	α-helix	trans	-62.1	-43.3	176.4	-65.8	171.2	0	0	0	110.8	I474 R480 M481 P482	I474-I478 HydrophobicContact CG2-CD1 3.71Å; I474-I478 HydrophobicContact CG2-CG1 4.36Å; I474-I478 WeakPolarHBondContact O-CG1 3.33Å; I474-I478 PolarHBondContact O-N 3.32Å; I478-R480 VanDerWaalsContact C-N 3.25Å; I478-R480 PolarHBondContact O-N 3.42Å; I478-M481 PolarHBondContact O-N 3.08Å; I478-P482 WeakPolarHBondContact O-CD 3.24Å
479	K	88.6	Confident	88	Confident	180 Å²	180	72.3 Å²	72.3	78%	0.783	35%	0.35	S	S	*	.	H	α-helix	trans	-63.7	-31.3	179.7	-170.9	177.6	179.6	-178.4	0	112.5	R475 P476 W477	R475-K479 WeakPolarHBondContact O-CB 2.94Å; R475-K479 PolarHBondContact O-N 3.26Å; P476-K479 PolarHBondContact O-N 2.85Å; W477-K479 PolarHBondContact O-N 2.91Å
480	R	87.4	Confident	88.3	Confident	20 Å²	20	77.1 Å²	77.1	8%	0.075	37%	0.367	C	S	.	.	H	α-helix	trans	-74.4	-37.3	-178.5	178.5	174.7	171.6	176.8	-2.9	113	P476 W477 I478 G483 D484 G548 K786 P787	P476-R480 VanDerWaalsContact O-CB 3.26Å; P476-R480 WeakPolarHBondContact O-CB 3.38Å; P476-R480 PolarHBondContact O-N 3.45Å; W477-R480 PolarHBondContact O-N 2.89Å; I478-R480 VanDerWaalsContact C-N 3.25Å; I478-R480 PolarHBondContact O-N 3.42Å; R480-G483 PolarHBondContact O-N 3.31Å; R480-D484 IonicContact NE-OD1 2.86Å; R480-D484 PolarHBondContact NE-OD1 3.33Å; R480-D484 IonicContact NE-OD2 3.3Å; R480-D484 PolarHBondContact O-N 3.25Å; R480-G548 PolarHBondContact NH1-O 3.44Å; R480-K786 HydrophobicContact CG-CD 4.05Å; R480-P787 PolarHBondContact NH1-O 3.1Å
481	M	87.6	Confident	88.1	Confident	42 Å²	42	84.8 Å²	84.8	21%	0.207	40%	0.399	C	S	.	.	H	α-helix	trans	-51.9	-50.7	-170.1	-77.6	-166.9	-175.5	0	0	115.2	W477 I478 G483 D484 Y485	W477-M481 HydrophobicContact CD2-CE 3.92Å; W477-M481 HydrophobicContact CE3-CE 4.48Å; W477-M481 HydrophobicContact CH2-CE 3.73Å; W477-M481 HydrophobicContact CZ2-CE 3.07Å; W477-M481 HydrophobicContact CZ3-CE 4.39Å; W477-M481 PolarHBondContact O-N 3.23Å; I478-M481 PolarHBondContact O-N 3.08Å; M481-G483 PolarHBondContact O-N 3.39Å; M481-D484 PolarHBondContact O-N 2.79Å; M481-D484 VanDerWaalsContact O-N 3.16Å; M481-Y485 VanDerWaalsContact O-CD2 3.3Å; M481-Y485 WeakPolarHBondContact O-CD2 3.39Å
482	P	88.8	Confident	88	Confident	75 Å²	75	87.2 Å²	87.2	49%	0.487	40%	0.402	S	S	.	.	H	α-helix	trans	-63.8	-28.3	-178	-21.8	34.4	0	0	0	112.8	I478 K486	I478-P482 WeakPolarHBondContact O-CD 3.24Å; P482-K486 WeakPolarHBondContact O-CG 3.45Å; P482-K486 PolarHBondContact O-N 2.91Å
483	G	89.5	Confident	88.2	Confident	26 Å²	26	81.2 Å²	81.2	27%	0.268	38%	0.38	S	S	.	.	H	α-helix	trans	-67.8	-39.8	176.3	0	0	0	0	0	112.5	R480 M481 Y485 K486 D487	R480-G483 PolarHBondContact O-N 3.31Å; M481-G483 PolarHBondContact O-N 3.39Å; G483-Y485 VanDerWaalsContact C-N 3.34Å; G483-Y485 PolarHBondContact O-N 3.1Å; G483-K486 PolarHBondContact O-N 3.21Å; G483-D487 WeakPolarHBondContact O-CB 3.49Å; G483-D487 VanDerWaalsContact O-CG 3.25Å; G483-D487 PolarHBondContact O-N 2.88Å
484	D	91.4	Very high	88.4	Confident	0 Å²	0	85.7 Å²	85.7	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-64.4	-35.8	-178.4	-62.6	-21.4	0	0	0	112.6	R480 M481 A488 K786 R849	R480-D484 IonicContact NE-OD1 2.86Å; R480-D484 PolarHBondContact NE-OD1 3.33Å; R480-D484 IonicContact NE-OD2 3.3Å; R480-D484 PolarHBondContact O-N 3.25Å; M481-D484 PolarHBondContact O-N 2.79Å; M481-D484 VanDerWaalsContact O-N 3.16Å; D484-A488 PolarHBondContact O-N 3.48Å; D484-K786 IonicContact OD1-NZ 3.02Å; D484-K786 PolarHBondContact OD1-NZ 3.23Å; D484-R849 HydrophobicContact CB-CG 3.96Å; D484-R849 IonicContact OD2-CZ 3.35Å; D484-R849 IonicContact OD2-NE 3.5Å; D484-R849 PolarHBondContact OD2-NE 3.44Å; D484-R849 IonicContact OD2-NH2 2.64Å; D484-R849 PolarHBondContact OD2-NH2 2.84Å
485	Y	92.5	Very high	88.2	Confident	87 Å²	87	87 Å²	87	34%	0.341	41%	0.412	S	S	.	.	H	α-helix	trans	-74.7	-39.2	175.3	-67.3	-75.6	0	0	0	112.4	M481 G483 D487 A488 I489 R849 V850	M481-Y485 VanDerWaalsContact O-CD2 3.3Å; M481-Y485 WeakPolarHBondContact O-CD2 3.39Å; G483-Y485 VanDerWaalsContact C-N 3.34Å; G483-Y485 PolarHBondContact O-N 3.1Å; Y485-D487 VanDerWaalsContact C-N 3.31Å; Y485-D487 PolarHBondContact O-N 2.72Å; Y485-A488 WeakPolarHBondContact O-CB 3.29Å; Y485-A488 PolarHBondContact O-N 3.41Å; Y485-I489 PolarHBondContact O-N 3.32Å; Y485-R849 HydrophobicContact CE1-CB 4Å; Y485-V850 HydrophobicContact CD1-CG2 3.79Å; Y485-V850 HydrophobicContact CE1-CG2 4.29Å
486	K	91.7	Very high	88.1	Confident	159 Å²	159	79.1 Å²	79.1	69%	0.691	39%	0.386	S	S	*	.	H	α-helix	trans	-63.3	-38.9	174.1	-73	177.7	-178.5	-176	0	111.6	P482 G483 A488 I489 R490	P482-K486 WeakPolarHBondContact O-CG 3.45Å; P482-K486 PolarHBondContact O-N 2.91Å; G483-K486 PolarHBondContact O-N 3.21Å; K486-A488 VanDerWaalsContact C-N 3.29Å; K486-A488 PolarHBondContact O-N 2.83Å; K486-I489 PolarHBondContact O-N 3.22Å; K486-R490 PolarHBondContact O-N 3.4Å
487	D	89.9	Confident	88.1	Confident	48 Å²	48	76.2 Å²	76.2	26%	0.257	37%	0.367	S	S	.	.	H	α-helix	trans	-66.1	-30.9	177.6	-75.1	-25.2	0	0	0	112.3	G483 Y485 N493 K786	G483-D487 WeakPolarHBondContact O-CB 3.49Å; G483-D487 VanDerWaalsContact O-CG 3.25Å; G483-D487 PolarHBondContact O-N 2.88Å; Y485-D487 VanDerWaalsContact C-N 3.31Å; Y485-D487 PolarHBondContact O-N 2.72Å; D487-N493 WeakPolarHBondContact O-CB 3.41Å; D487-N493 PolarHBondContact O-ND2 3.48Å; D487-K786 WeakPolarHBondContact OD2-CE 3.33Å; D487-K786 IonicContact OD2-NZ 2.84Å; D487-K786 PolarHBondContact OD2-NZ 3.09Å
488	A	89.3	Confident	88	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-66.3	-35.8	175.5	0	0	0	0	0	113.2	D484 Y485 K486 Q848 V850	D484-A488 PolarHBondContact O-N 3.48Å; Y485-A488 WeakPolarHBondContact O-CB 3.29Å; Y485-A488 PolarHBondContact O-N 3.41Å; K486-A488 VanDerWaalsContact C-N 3.29Å; K486-A488 PolarHBondContact O-N 2.83Å; A488-Q848 HydrophobicContact CB-CB 3.98Å; A488-V850 HydrophobicContact CB-CB 3.94Å; A488-V850 HydrophobicContact CB-CG2 3.5Å
489	I	90.3	Very high	87.7	Confident	119 Å²	119	76.4 Å²	76.4	61%	0.61	38%	0.382	S	S	*	.	H	α-helix	trans	-92	-12.8	-172.3	-59.7	170.7	0	0	0	112.2	Y485 K486 K491	Y485-I489 PolarHBondContact O-N 3.32Å; K486-I489 PolarHBondContact O-N 3.22Å; I489-K491 PolarHBondContact O-N 2.93Å
490	R	88.5	Confident	87.5	Confident	139 Å²	139	68.1 Å²	68.1	53%	0.525	35%	0.347	S	S	.	.	S	Bend	trans	-54.8	134.4	177.5	-163.5	177.8	-135.3	-113.7	0.4	111.1	K486 E492 N493 F494	K486-R490 PolarHBondContact O-N 3.4Å; R490-E492 IonicContact NH1-OE1 2.67Å; R490-E492 IonicContact NH1-OE2 2.84Å; R490-E492 PolarHBondContact NH1-OE2 3.01Å; R490-E492 PolarHBondContact O-N 3.45Å; R490-N493 HydrophobicContact CB-CB 4.34Å; R490-N493 WeakPolarHBondContact O-CA 3.29Å; R490-N493 PolarHBondContact O-N 2.94Å; R490-F494 PolarHBondContact O-N 3.1Å
491	K	81.5	Confident	87.6	Confident	198 Å²	198	67.9 Å²	67.9	86%	0.861	35%	0.347	S	S	*	.	H	α-helix	trans	-50	-39.2	-173.9	-173.6	174.8	178.7	179	0	114.3	I489 N493	I489-K491 PolarHBondContact O-N 2.93Å; K491-N493 VanDerWaalsContact C-N 3.34Å
492	E	82.8	Confident	87.4	Confident	123 Å²	123	70.2 Å²	70.2	58%	0.575	36%	0.36	S	S	*	.	H	α-helix	trans	-69.2	-29.6	177.7	-64.7	165.1	-168.3	0	0	113.5	R490 K829	R490-E492 IonicContact NH1-OE1 2.67Å; R490-E492 IonicContact NH1-OE2 2.84Å; R490-E492 PolarHBondContact NH1-OE2 3.01Å; R490-E492 PolarHBondContact O-N 3.45Å; E492-K829 IonicContact OE2-NZ 3.46Å
493	N	87.4	Confident	87	Confident	6 Å²	6	68.2 Å²	68.2	3%	0.032	34%	0.344	C	S	.	.	H	α-helix	trans	-97	-31.4	-172.5	-63.7	-5.1	0	0	0	112	D487 R490 K491 S495 I496 V497 K829 V846	D487-N493 WeakPolarHBondContact O-CB 3.41Å; D487-N493 PolarHBondContact O-ND2 3.48Å; R490-N493 HydrophobicContact CB-CB 4.34Å; R490-N493 WeakPolarHBondContact O-CA 3.29Å; R490-N493 PolarHBondContact O-N 2.94Å; K491-N493 VanDerWaalsContact C-N 3.34Å; N493-S495 VanDerWaalsContact C-N 3.31Å; N493-S495 PolarHBondContact O-N 3.26Å; N493-I496 WeakPolarHBondContact O-CA 3.49Å; N493-I496 WeakPolarHBondContact O-CB 3.48Å; N493-I496 PolarHBondContact O-N 3.3Å; N493-V497 WeakPolarHBondContact O-CG2 3.38Å; N493-V497 PolarHBondContact O-N 2.86Å; N493-K829 WeakPolarHBondContact OD1-CE 3.43Å; N493-K829 PolarHBondContact OD1-NZ 3.33Å; N493-V846 HydrophobicContact CB-CG1 3.93Å; N493-V846 HydrophobicContact CB-CG2 4.29Å
494	F	87.7	Confident	86.8	Confident	103 Å²	103	67.1 Å²	67.1	45%	0.452	33%	0.332	S	S	.	.	H	α-helix	trans	-50.5	-48.7	-172.9	-177.5	-92.9	0	0	0	112.6	R490 I496 V497 F498	R490-F494 PolarHBondContact O-N 3.1Å; F494-I496 VanDerWaalsContact C-N 3.32Å; F494-I496 PolarHBondContact O-N 3.27Å; F494-V497 PolarHBondContact O-N 2.95Å; F494-F498 HydrophobicContact CD1-CD2 4.39Å; F494-F498 AromaticContact CD2-CD2 3.64Å; F494-F498 HydrophobicContact CD2-CD2 3.64Å; F494-F498 AromaticContact CD2-CE2 3.58Å; F494-F498 HydrophobicContact CD2-CE2 3.58Å; F494-F498 HydrophobicContact CE1-CD2 4.21Å; F494-F498 AromaticContact CE2-CD2 3.44Å; F494-F498 HydrophobicContact CE2-CD2 3.44Å; F494-F498 VanDerWaalsContact CE2-CD2 3.44Å; F494-F498 AromaticContact CE2-CE2 3.23Å; F494-F498 HydrophobicContact CE2-CE2 3.23Å; F494-F498 HydrophobicContact CE2-CG 4.46Å; F494-F498 HydrophobicContact CE2-CZ 4.12Å; F494-F498 HydrophobicContact CG-CD2 4.12Å; F494-F498 HydrophobicContact CG-CE2 4.49Å; F494-F498 AromaticContact CZ-CD2 3.74Å; F494-F498 HydrophobicContact CZ-CD2 3.74Å; F494-F498 AromaticContact CZ-CE2 3.9Å; F494-F498 HydrophobicContact CZ-CE2 3.9Å; F494-F498 HydrophobicContact CZ-CG 4.39Å; F494-F498 WeakPolarHBondContact O-CD2 3.43Å; F494-F498 PolarHBondContact O-N 2.94Å
495	S	83.9	Confident	86.8	Confident	92 Å²	92	68 Å²	68	64%	0.643	34%	0.335	S	S	*	.	H	α-helix	trans	-64	-35.5	179	177.9	0	0	0	0	113	N493 G499	N493-S495 VanDerWaalsContact C-N 3.31Å; N493-S495 PolarHBondContact O-N 3.26Å; S495-G499 WeakPolarHBondContact O-CA 3.31Å; S495-G499 PolarHBondContact O-N 3.04Å
496	I	85.1	Confident	86.4	Confident	47 Å²	47	66.2 Å²	66.2	24%	0.241	33%	0.329	C	S	.	.	H	α-helix	trans	-71.4	-47.2	179.2	-58.4	173.3	0	0	0	109.8	N493 F494 S500 K829 V846	N493-I496 WeakPolarHBondContact O-CA 3.49Å; N493-I496 WeakPolarHBondContact O-CB 3.48Å; N493-I496 PolarHBondContact O-N 3.3Å; F494-I496 VanDerWaalsContact C-N 3.32Å; F494-I496 PolarHBondContact O-N 3.27Å; I496-S500 VanDerWaalsContact O-CB 3.27Å; I496-S500 WeakPolarHBondContact O-CB 3.34Å; I496-S500 PolarHBondContact O-N 3.14Å; I496-S500 PolarHBondContact O-OG 3.22Å; I496-K829 HydrophobicContact CD1-CG 4.02Å; I496-V846 HydrophobicContact CD1-CG2 4.4Å; I496-V846 HydrophobicContact CG2-CG2 4.43Å
497	V	87.4	Confident	85.8	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-63.5	-57.7	-177.7	177.7	0	0	0	0	110.6	N493 F494 G499 S500 V501 L827 V846 Q848	N493-V497 WeakPolarHBondContact O-CG2 3.38Å; N493-V497 PolarHBondContact O-N 2.86Å; F494-V497 PolarHBondContact O-N 2.95Å; V497-G499 VanDerWaalsContact C-N 3.34Å; V497-G499 PolarHBondContact O-N 3.29Å; V497-S500 PolarHBondContact O-N 3.1Å; V497-S500 VanDerWaalsContact O-N 3.11Å; V497-S500 PolarHBondContact O-OG 3.31Å; V497-V501 PolarHBondContact O-N 2.9Å; V497-L827 HydrophobicContact CG2-CD2 4.33Å; V497-V846 HydrophobicContact CG2-CG1 3.76Å; V497-Q848 HydrophobicContact CG1-CG 4.38Å; V497-Q848 HydrophobicContact CG2-CG 4Å
498	F	87.8	Confident	85.7	Confident	81 Å²	81	58 Å²	58	36%	0.355	29%	0.294	S	S	.	.	H	α-helix	trans	-69.4	-32.2	-178	-76.8	-83.1	0	0	0	112.6	F494 S500 V501 V850 F854	F494-F498 HydrophobicContact CD1-CD2 4.39Å; F494-F498 AromaticContact CD2-CD2 3.64Å; F494-F498 HydrophobicContact CD2-CD2 3.64Å; F494-F498 AromaticContact CD2-CE2 3.58Å; F494-F498 HydrophobicContact CD2-CE2 3.58Å; F494-F498 HydrophobicContact CE1-CD2 4.21Å; F494-F498 AromaticContact CE2-CD2 3.44Å; F494-F498 HydrophobicContact CE2-CD2 3.44Å; F494-F498 VanDerWaalsContact CE2-CD2 3.44Å; F494-F498 AromaticContact CE2-CE2 3.23Å; F494-F498 HydrophobicContact CE2-CE2 3.23Å; F494-F498 HydrophobicContact CE2-CG 4.46Å; F494-F498 HydrophobicContact CE2-CZ 4.12Å; F494-F498 HydrophobicContact CG-CD2 4.12Å; F494-F498 HydrophobicContact CG-CE2 4.49Å; F494-F498 AromaticContact CZ-CD2 3.74Å; F494-F498 HydrophobicContact CZ-CD2 3.74Å; F494-F498 AromaticContact CZ-CE2 3.9Å; F494-F498 HydrophobicContact CZ-CE2 3.9Å; F494-F498 HydrophobicContact CZ-CG 4.39Å; F494-F498 WeakPolarHBondContact O-CD2 3.43Å; F494-F498 PolarHBondContact O-N 2.94Å; F498-S500 PolarHBondContact O-N 3.13Å; F498-V501 PolarHBondContact O-N 2.89Å; F498-V850 HydrophobicContact CZ-CG1 4.35Å; F498-F854 HydrophobicContact CE1-CD2 4.33Å; F498-F854 AromaticContact CE1-CE2 3.69Å; F498-F854 HydrophobicContact CE1-CE2 3.69Å; F498-F854 HydrophobicContact CE1-CZ 4.06Å; F498-F854 HydrophobicContact CZ-CE2 4.08Å
499	G	82.1	Confident	85.6	Confident	60 Å²	60	58.4 Å²	58.4	62%	0.619	30%	0.296	S	S	*	.	H	α-helix	trans	-65	-26.1	172	0	0	0	0	0	113.6	S495 V497	S495-G499 WeakPolarHBondContact O-CA 3.31Å; S495-G499 PolarHBondContact O-N 3.04Å; V497-G499 VanDerWaalsContact C-N 3.34Å; V497-G499 PolarHBondContact O-N 3.29Å
500	S	84.5	Confident	85.2	Confident	6 Å²	6	53 Å²	53	4%	0.042	27%	0.269	C	S	.	.	H	α-helix	trans	-84.5	-22.2	179.6	72.3	0	0	0	0	114.5	I496 V497 F498 L502 F503 I504	I496-S500 VanDerWaalsContact O-CB 3.27Å; I496-S500 WeakPolarHBondContact O-CB 3.34Å; I496-S500 PolarHBondContact O-N 3.14Å; I496-S500 PolarHBondContact O-OG 3.22Å; V497-S500 PolarHBondContact O-N 3.1Å; V497-S500 VanDerWaalsContact O-N 3.11Å; V497-S500 PolarHBondContact O-OG 3.31Å; F498-S500 PolarHBondContact O-N 3.13Å; S500-L502 PolarHBondContact O-N 2.87Å; S500-F503 WeakPolarHBondContact O-CB 3.07Å; S500-F503 PolarHBondContact O-N 2.74Å; S500-F503 VanDerWaalsContact O-N 3.12Å; S500-I504 WeakPolarHBondContact O-CD1 3.49Å; S500-I504 VanDerWaalsContact O-CG1 3.27Å; S500-I504 WeakPolarHBondContact O-CG1 3.4Å; S500-I504 PolarHBondContact O-N 2.76Å; S500-I504 WeakPolarHBondContact OG-CD1 3.42Å
501	V	89.8	Confident	85	Confident	14 Å²	14	46.6 Å²	46.6	9%	0.085	25%	0.245	C	C	.	.	H	α-helix	trans	-56.2	-48.6	-172.9	172.7	0	0	0	0	111.9	V497 F498 F503 I504 Y505 F854 V855 L858	V497-V501 PolarHBondContact O-N 2.9Å; F498-V501 PolarHBondContact O-N 2.89Å; V501-F503 VanDerWaalsContact C-N 3.31Å; V501-F503 PolarHBondContact O-N 3.17Å; V501-I504 PolarHBondContact O-N 3.34Å; V501-Y505 WeakPolarHBondContact O-CB 3.45Å; V501-Y505 PolarHBondContact O-N 2.71Å; V501-F854 HydrophobicContact CG1-CB 3.87Å; V501-F854 HydrophobicContact CG2-CB 4.35Å; V501-V855 HydrophobicContact CG1-CG2 4.24Å; V501-L858 HydrophobicContact CG1-CD1 3.86Å
502	L	83.4	Confident	85.4	Confident	91 Å²	91	37.2 Å²	37.2	48%	0.476	21%	0.205	S	C	.	.	H	α-helix	trans	-61.1	-41	-179.7	-171	78.8	0	0	0	111.8	S500 F506 L695	S500-L502 PolarHBondContact O-N 2.87Å; L502-F506 HydrophobicContact CD1-CE2 3.88Å; L502-F506 HydrophobicContact CG-CD2 4.21Å; L502-F506 HydrophobicContact CG-CE2 3.91Å; L502-F506 WeakPolarHBondContact O-CD2 3.08Å; L502-F506 PolarHBondContact O-N 2.91Å; L502-L695 HydrophobicContact CD2-CD2 3.94Å
503	F	80.9	Confident	85.6	Confident	33 Å²	33	31.5 Å²	31.5	15%	0.145	18%	0.178	C	C	.	.	H	α-helix	trans	-64.7	-49.6	177.9	172	-111.2	0	0	0	111.3	S500 V501 Y505 F506 V507 A694 A826	S500-F503 WeakPolarHBondContact O-CB 3.07Å; S500-F503 PolarHBondContact O-N 2.74Å; S500-F503 VanDerWaalsContact O-N 3.12Å; V501-F503 VanDerWaalsContact C-N 3.31Å; V501-F503 PolarHBondContact O-N 3.17Å; F503-Y505 VanDerWaalsContact C-N 3.27Å; F503-Y505 PolarHBondContact O-N 3.34Å; F503-F506 PolarHBondContact O-N 3.35Å; F503-V507 HydrophobicContact CD1-CG2 4.49Å; F503-V507 HydrophobicContact CD2-CG2 4.15Å; F503-V507 HydrophobicContact CE1-CG2 4.11Å; F503-V507 HydrophobicContact CE2-CG2 3.74Å; F503-V507 HydrophobicContact CZ-CG2 3.72Å; F503-V507 VanDerWaalsContact O-CG2 3.31Å; F503-V507 WeakPolarHBondContact O-CG2 3.36Å; F503-V507 PolarHBondContact O-N 3.38Å; F503-V507 VanDerWaalsContact O-N 3.07Å; F503-A694 HydrophobicContact CB-CB 4.16Å; F503-A694 VanDerWaalsContact CD2-CA 3.49Å; F503-A694 HydrophobicContact CD2-CB 3.54Å; F503-A694 WeakPolarHBondContact CD2-O 3.4Å; F503-A694 HydrophobicContact CE2-CB 4.29Å; F503-A694 HydrophobicContact CG-CB 4.14Å; F503-A826 HydrophobicContact CD1-CB 3.66Å; F503-A826 HydrophobicContact CE1-CB 3.98Å
504	I	86	Confident	85.4	Confident	3 Å²	3	31.3 Å²	31.3	2%	0.015	18%	0.177	C	C	.	.	H	α-helix	trans	-63.8	-37	-178.9	-59.3	156.6	0	0	0	110.6	S500 V501 V507 N508 I553 N823 A826 V855	S500-I504 WeakPolarHBondContact O-CD1 3.49Å; S500-I504 VanDerWaalsContact O-CG1 3.27Å; S500-I504 WeakPolarHBondContact O-CG1 3.4Å; S500-I504 PolarHBondContact O-N 2.76Å; S500-I504 WeakPolarHBondContact OG-CD1 3.42Å; V501-I504 PolarHBondContact O-N 3.34Å; I504-V507 PolarHBondContact O-N 3.22Å; I504-N508 WeakPolarHBondContact O-CB 3.41Å; I504-N508 PolarHBondContact O-N 2.51Å; I504-N508 PolarHBondContact O-ND2 3.38Å; I504-I553 HydrophobicContact CG2-CD1 3.56Å; I504-N823 WeakPolarHBondContact CD1-OD1 3.37Å; I504-N823 WeakPolarHBondContact CG1-OD1 3.41Å; I504-A826 HydrophobicContact CG1-CB 4.37Å; I504-V855 HydrophobicContact CB-CG2 3.79Å; I504-V855 HydrophobicContact CG2-CB 4.4Å; I504-V855 HydrophobicContact CG2-CG1 4.19Å; I504-V855 HydrophobicContact CG2-CG2 3.72Å
505	Y	90	Very high	85.4	Confident	19 Å²	19	26.5 Å²	26.5	8%	0.075	16%	0.156	C	C	.	.	H	α-helix	trans	-55.7	-52	174.5	164.5	-109.3	0	0	0	112.2	V501 F503 V507 N508 L509 L858 V859 S862	V501-Y505 WeakPolarHBondContact O-CB 3.45Å; V501-Y505 PolarHBondContact O-N 2.71Å; F503-Y505 VanDerWaalsContact C-N 3.27Å; F503-Y505 PolarHBondContact O-N 3.34Å; Y505-V507 PolarHBondContact O-N 2.74Å; Y505-N508 PolarHBondContact O-N 3.3Å; Y505-N508 VanDerWaalsContact O-N 3.16Å; Y505-L509 HydrophobicContact CE1-CD2 4.15Å; Y505-L509 HydrophobicContact CE2-CB 4.32Å; Y505-L509 HydrophobicContact CE2-CD2 4.17Å; Y505-L509 WeakPolarHBondContact O-CB 3.36Å; Y505-L509 PolarHBondContact O-N 2.92Å; Y505-L509 WeakPolarHBondContact OH-CD2 3.01Å; Y505-L858 HydrophobicContact CD2-CB 3.49Å; Y505-L858 VanDerWaalsContact CD2-CB 3.49Å; Y505-L858 HydrophobicContact CD2-CD1 4.4Å; Y505-L858 HydrophobicContact CE2-CB 3.71Å; Y505-L858 HydrophobicContact CG-CB 4.22Å; Y505-L858 HydrophobicContact CG-CD1 4.32Å; Y505-V859 HydrophobicContact CD2-CG2 3.93Å; Y505-V859 HydrophobicContact CE2-CG2 4.19Å; Y505-S862 WeakPolarHBondContact CE2-OG 3.49Å; Y505-S862 PolarHBondContact OH-OG 3.13Å
506	F	83.6	Confident	85.7	Confident	50 Å²	50	22.1 Å²	22.1	22%	0.219	13%	0.126	C	C	.	.	H	α-helix	trans	-70.3	-33.2	-179.4	-73.2	-61.1	0	0	0	113.6	L502 F503 N508 L509 S510 L695 P698	L502-F506 HydrophobicContact CD1-CE2 3.88Å; L502-F506 HydrophobicContact CG-CD2 4.21Å; L502-F506 HydrophobicContact CG-CE2 3.91Å; L502-F506 WeakPolarHBondContact O-CD2 3.08Å; L502-F506 PolarHBondContact O-N 2.91Å; F503-F506 PolarHBondContact O-N 3.35Å; F506-N508 PolarHBondContact O-N 2.92Å; F506-L509 HydrophobicContact CD1-CD2 4.45Å; F506-S510 WeakPolarHBondContact O-CB 3.46Å; F506-S510 PolarHBondContact O-N 2.98Å; F506-L695 HydrophobicContact CD2-CD2 4.12Å; F506-L695 HydrophobicContact CE2-CD2 3.98Å; F506-P698 HydrophobicContact CB-CG 3.72Å; F506-P698 HydrophobicContact CD1-CB 4.18Å; F506-P698 HydrophobicContact CD1-CG 3.31Å; F506-P698 HydrophobicContact CD2-CG 3.57Å; F506-P698 HydrophobicContact CE1-CB 4.05Å; F506-P698 HydrophobicContact CE1-CG 3.65Å; F506-P698 HydrophobicContact CE2-CB 4.5Å; F506-P698 HydrophobicContact CE2-CG 3.9Å; F506-P698 HydrophobicContact CG-CB 4.44Å; F506-P698 HydrophobicContact CG-CG 3.25Å; F506-P698 HydrophobicContact CZ-CB 4.22Å; F506-P698 HydrophobicContact CZ-CG 3.93Å
507	V	80.2	Confident	85.6	Confident	32 Å²	32	20.6 Å²	20.6	19%	0.194	12%	0.12	C	C	.	.	H	α-helix	trans	-61.7	-31	172.2	169.8	0	0	0	0	111.7	F503 I504 Y505 P511 R819	F503-V507 HydrophobicContact CD1-CG2 4.49Å; F503-V507 HydrophobicContact CD2-CG2 4.15Å; F503-V507 HydrophobicContact CE1-CG2 4.11Å; F503-V507 HydrophobicContact CE2-CG2 3.74Å; F503-V507 HydrophobicContact CZ-CG2 3.72Å; F503-V507 VanDerWaalsContact O-CG2 3.31Å; F503-V507 WeakPolarHBondContact O-CG2 3.36Å; F503-V507 PolarHBondContact O-N 3.38Å; F503-V507 VanDerWaalsContact O-N 3.07Å; I504-V507 PolarHBondContact O-N 3.22Å; Y505-V507 PolarHBondContact O-N 2.74Å; V507-P511 WeakPolarHBondContact O-CD 3.36Å; V507-P511 VanDerWaalsContact O-CG 3.28Å; V507-P511 WeakPolarHBondContact O-CG 3.35Å; V507-R819 HydrophobicContact CG1-CG 4.41Å
508	N	87.7	Confident	85.5	Confident	1 Å²	1	20.8 Å²	20.8	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-89.6	-42.4	178.7	-75.4	-20.8	0	0	0	114	I504 Y505 F506 S510 S512 I553 R819 V855 V859	I504-N508 WeakPolarHBondContact O-CB 3.41Å; I504-N508 PolarHBondContact O-N 2.51Å; I504-N508 PolarHBondContact O-ND2 3.38Å; Y505-N508 PolarHBondContact O-N 3.3Å; Y505-N508 VanDerWaalsContact O-N 3.16Å; F506-N508 PolarHBondContact O-N 2.92Å; N508-S510 VanDerWaalsContact C-N 3.34Å; N508-S510 PolarHBondContact O-N 3.31Å; N508-S512 WeakPolarHBondContact O-CB 3.44Å; N508-S512 PolarHBondContact O-N 3.38Å; N508-S512 PolarHBondContact O-OG 3.43Å; N508-I553 VanDerWaalsContact OD1-CG2 3.23Å; N508-I553 WeakPolarHBondContact OD1-CG2 3.4Å; N508-R819 WeakPolarHBondContact OD1-CD 3.28Å; N508-V855 HydrophobicContact CB-CG1 4.26Å; N508-V855 VanDerWaalsContact ND2-CG1 3.26Å; N508-V855 WeakPolarHBondContact ND2-CG1 3.43Å; N508-V859 HydrophobicContact CB-CG2 4.33Å
509	L	87.6	Confident	85.6	Confident	9 Å²	9	17 Å²	17	5%	0.047	10%	0.104	C	C	.	.	H	α-helix	trans	-61.1	-45.6	-176.5	178.9	67.4	0	0	0	111	Y505 F506 S512 I513 L533	Y505-L509 HydrophobicContact CE1-CD2 4.15Å; Y505-L509 HydrophobicContact CE2-CB 4.32Å; Y505-L509 HydrophobicContact CE2-CD2 4.17Å; Y505-L509 WeakPolarHBondContact O-CB 3.36Å; Y505-L509 PolarHBondContact O-N 2.92Å; Y505-L509 WeakPolarHBondContact OH-CD2 3.01Å; F506-L509 HydrophobicContact CD1-CD2 4.45Å; L509-S512 WeakPolarHBondContact O-CB 3.41Å; L509-S512 PolarHBondContact O-N 2.93Å; L509-S512 VanDerWaalsContact O-N 3.14Å; L509-I513 HydrophobicContact CD1-CD1 3.89Å; L509-I513 HydrophobicContact CD1-CG1 4.09Å; L509-I513 HydrophobicContact CD2-CD1 4.21Å; L509-I513 HydrophobicContact CG-CD1 3.7Å; L509-I513 HydrophobicContact CG-CG1 4.26Å; L509-I513 WeakPolarHBondContact O-CG1 3.39Å; L509-I513 PolarHBondContact O-N 2.88Å; L509-L533 HydrophobicContact CD1-CD2 3.97Å
510	S	81.4	Confident	85.9	Confident	6 Å²	6	16.1 Å²	16.1	4%	0.042	9%	0.085	C	C	.	.	H	α-helix	trans	-64.9	-49.6	-170.2	179.4	0	0	0	0	114.1	F506 N508 S512 T514 V697 M701 M880	F506-S510 WeakPolarHBondContact O-CB 3.46Å; F506-S510 PolarHBondContact O-N 2.98Å; N508-S510 VanDerWaalsContact C-N 3.34Å; N508-S510 PolarHBondContact O-N 3.31Å; S510-S512 VanDerWaalsContact C-N 3.27Å; S510-S512 PolarHBondContact O-N 2.87Å; S510-T514 PolarHBondContact O-N 2.93Å; S510-T514 PolarHBondContact O-OG1 3.28Å; S510-V697 WeakPolarHBondContact OG-CG1 3.45Å; S510-M701 WeakPolarHBondContact OG-CE 3.22Å; S510-M880 VanDerWaalsContact O-CE 3.27Å; S510-M880 WeakPolarHBondContact O-CE 3.43Å; S510-M880 WeakPolarHBondContact OG-CE 3.46Å; S510-M880 VanDerWaalsContact OG-CG 3.25Å; S510-M880 WeakPolarHBondContact OG-CG 3.29Å; S510-M880 PolarHBondContact OG-SD 2.96Å
511	P	84.3	Confident	85.8	Confident	4 Å²	4	20.4 Å²	20.4	3%	0.026	11%	0.111	C	C	.	.	H	α-helix	trans	-60	-36.8	169.9	-20.4	29	0	0	0	112.8	V507 T514 F515 M884	V507-P511 WeakPolarHBondContact O-CD 3.36Å; V507-P511 VanDerWaalsContact O-CG 3.28Å; V507-P511 WeakPolarHBondContact O-CG 3.35Å; P511-T514 PolarHBondContact O-N 3.37Å; P511-F515 HydrophobicContact CB-CD2 4.49Å; P511-F515 VanDerWaalsContact O-CD2 3.31Å; P511-F515 WeakPolarHBondContact O-CD2 3.35Å; P511-F515 PolarHBondContact O-N 2.89Å; P511-M884 HydrophobicContact CB-CE 4.22Å; P511-M884 HydrophobicContact CB-SD 4.39Å; P511-M884 HydrophobicContact CG-CE 4.06Å; P511-M884 HydrophobicContact CG-SD 3.61Å
512	S	89.2	Confident	85.5	Confident	1 Å²	1	23.1 Å²	23.1	1%	0.007	12%	0.123	C	C	.	.	H	α-helix	trans	-66.3	-44	-176.6	-55.5	0	0	0	0	111.7	N508 L509 S510 T514 A516	N508-S512 WeakPolarHBondContact O-CB 3.44Å; N508-S512 PolarHBondContact O-N 3.38Å; N508-S512 PolarHBondContact O-OG 3.43Å; L509-S512 WeakPolarHBondContact O-CB 3.41Å; L509-S512 PolarHBondContact O-N 2.93Å; L509-S512 VanDerWaalsContact O-N 3.14Å; S510-S512 VanDerWaalsContact C-N 3.27Å; S510-S512 PolarHBondContact O-N 2.87Å; S512-T514 PolarHBondContact O-N 3.49Å; S512-A516 WeakPolarHBondContact O-CB 3.32Å; S512-A516 PolarHBondContact O-N 3.45Å
513	I	87.3	Confident	85.7	Confident	3 Å²	3	19 Å²	19	2%	0.015	10%	0.101	C	C	.	.	H	α-helix	trans	-59.8	-38.8	173.6	-66.6	171	0	0	0	110.9	L509 A516 A517 L533 V720 L869 L877	L509-I513 HydrophobicContact CD1-CD1 3.89Å; L509-I513 HydrophobicContact CD1-CG1 4.09Å; L509-I513 HydrophobicContact CD2-CD1 4.21Å; L509-I513 HydrophobicContact CG-CD1 3.7Å; L509-I513 HydrophobicContact CG-CG1 4.26Å; L509-I513 WeakPolarHBondContact O-CG1 3.39Å; L509-I513 PolarHBondContact O-N 2.88Å; I513-A516 WeakPolarHBondContact O-CB 3.49Å; I513-A516 PolarHBondContact O-N 2.86Å; I513-A517 PolarHBondContact O-N 3.39Å; I513-L533 HydrophobicContact CG1-CD1 4.37Å; I513-L533 HydrophobicContact CG1-CD2 4.04Å; I513-V720 HydrophobicContact CG2-CG1 4.03Å; I513-V720 HydrophobicContact CG2-CG2 4.18Å; I513-L869 HydrophobicContact CD1-CD1 4.31Å; I513-L869 HydrophobicContact CD1-CD2 3.85Å; I513-L877 HydrophobicContact CG2-CD1 3.92Å; I513-L877 HydrophobicContact CG2-CD2 4.14Å
514	T	82.8	Confident	86.1	Confident	3 Å²	3	19.6 Å²	19.6	2%	0.018	11%	0.106	C	C	.	.	H	α-helix	trans	-75.2	-44	-175.5	-46.2	0	0	0	0	111.8	S510 P511 S512 A516 A517 L518 L877 M880 F881	S510-T514 PolarHBondContact O-N 2.93Å; S510-T514 PolarHBondContact O-OG1 3.28Å; P511-T514 PolarHBondContact O-N 3.37Å; S512-T514 PolarHBondContact O-N 3.49Å; T514-A516 VanDerWaalsContact C-N 3.28Å; T514-A516 PolarHBondContact O-N 3.48Å; T514-A517 PolarHBondContact O-N 3.15Å; T514-L518 WeakPolarHBondContact O-CG 3.32Å; T514-L518 PolarHBondContact O-N 3.02Å; T514-L877 HydrophobicContact CG2-CB 3.96Å; T514-M880 WeakPolarHBondContact OG1-CE 3.29Å; T514-F881 HydrophobicContact CG2-CD1 3.59Å; T514-F881 HydrophobicContact CG2-CD2 4.04Å; T514-F881 HydrophobicContact CG2-CE1 3.19Å; T514-F881 HydrophobicContact CG2-CE2 3.65Å; T514-F881 HydrophobicContact CG2-CG 4.03Å; T514-F881 HydrophobicContact CG2-CZ 3.22Å
515	F	88.9	Confident	86.2	Confident	2 Å²	2	24 Å²	24	1%	0.009	14%	0.135	C	C	.	.	H	α-helix	trans	-64	-36.1	172.3	-81.4	-61.6	0	0	0	112	P511 L518 L519 I556 A558 Y561 F623 F624 F881	P511-F515 HydrophobicContact CB-CD2 4.49Å; P511-F515 VanDerWaalsContact O-CD2 3.31Å; P511-F515 WeakPolarHBondContact O-CD2 3.35Å; P511-F515 PolarHBondContact O-N 2.89Å; F515-L518 PolarHBondContact O-N 3.4Å; F515-L519 WeakPolarHBondContact O-CB 3.29Å; F515-L519 VanDerWaalsContact O-CG 3.29Å; F515-L519 WeakPolarHBondContact O-CG 3.43Å; F515-L519 PolarHBondContact O-N 3.48Å; F515-I556 HydrophobicContact CB-CB 4.03Å; F515-I556 HydrophobicContact CB-CD1 4.07Å; F515-I556 HydrophobicContact CB-CG2 3.78Å; F515-I556 HydrophobicContact CD1-CG2 4.08Å; F515-I556 HydrophobicContact CD2-CB 4.21Å; F515-I556 HydrophobicContact CD2-CG2 4.16Å; F515-I556 HydrophobicContact CG-CB 4.18Å; F515-I556 HydrophobicContact CG-CG2 3.76Å; F515-A558 HydrophobicContact CZ-CB 4.42Å; F515-Y561 HydrophobicContact CD1-CD2 4.42Å; F515-Y561 HydrophobicContact CD1-CG 4.48Å; F515-Y561 HydrophobicContact CE1-CG 4.46Å; F515-F623 HydrophobicContact CE1-CE1 4.44Å; F515-F624 AromaticContact CE2-CE1 3.74Å; F515-F624 HydrophobicContact CE2-CE1 3.74Å; F515-F624 HydrophobicContact CE2-CZ 4.03Å; F515-F624 AromaticContact CZ-CE1 3.49Å; F515-F624 HydrophobicContact CZ-CE1 3.49Å; F515-F624 VanDerWaalsContact CZ-CE1 3.49Å; F515-F624 AromaticContact CZ-CZ 4Å; F515-F624 HydrophobicContact CZ-CZ 4Å; F515-F881 HydrophobicContact CD2-CZ 4.47Å; F515-F881 HydrophobicContact CE1-CZ 4.42Å; F515-F881 HydrophobicContact CE2-CZ 4.39Å; F515-F881 HydrophobicContact CZ-CZ 4.37Å
516	A	89.2	Confident	86	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-58.5	-47.2	172.8	0	0	0	0	0	112.3	S512 I513 T514 L518 L519 N520 V529 T532	S512-A516 WeakPolarHBondContact O-CB 3.32Å; S512-A516 PolarHBondContact O-N 3.45Å; I513-A516 WeakPolarHBondContact O-CB 3.49Å; I513-A516 PolarHBondContact O-N 2.86Å; T514-A516 VanDerWaalsContact C-N 3.28Å; T514-A516 PolarHBondContact O-N 3.48Å; A516-L518 VanDerWaalsContact C-N 3.35Å; A516-L518 PolarHBondContact O-N 3.42Å; A516-L519 PolarHBondContact O-N 3.31Å; A516-N520 WeakPolarHBondContact O-CB 3.5Å; A516-N520 PolarHBondContact O-N 3.5Å; A516-V529 HydrophobicContact CB-CB 4.23Å; A516-V529 HydrophobicContact CB-CG1 3.89Å; A516-V529 HydrophobicContact CB-CG2 4.12Å; A516-T532 HydrophobicContact CB-CG2 4.18Å; A516-T532 WeakPolarHBondContact CB-OG1 3.48Å
517	A	84.3	Confident	86.3	Confident	14 Å²	14	22.1 Å²	22.1	12%	0.116	13%	0.131	C	C	.	.	H	α-helix	trans	-63.2	-39.6	176.1	0	0	0	0	0	112.1	I513 T514 T521 L874	I513-A517 PolarHBondContact O-N 3.39Å; T514-A517 PolarHBondContact O-N 3.15Å; A517-T521 WeakPolarHBondContact O-CB 3.07Å; A517-T521 VanDerWaalsContact O-CG2 3.29Å; A517-T521 WeakPolarHBondContact O-CG2 3.16Å; A517-T521 PolarHBondContact O-N 3.22Å; A517-T521 PolarHBondContact O-OG1 3Å; A517-L874 HydrophobicContact CB-CD2 4.27Å
518	L	84.1	Confident	86.7	Confident	4 Å²	4	22.1 Å²	22.1	2%	0.021	13%	0.131	C	C	.	.	H	α-helix	trans	-68.2	-41.8	176.9	-70.5	175.6	0	0	0	112.7	T514 F515 A516 N520 T521 Q522 Y561 K627 F881	T514-L518 WeakPolarHBondContact O-CG 3.32Å; T514-L518 PolarHBondContact O-N 3.02Å; F515-L518 PolarHBondContact O-N 3.4Å; A516-L518 VanDerWaalsContact C-N 3.35Å; A516-L518 PolarHBondContact O-N 3.42Å; L518-N520 VanDerWaalsContact C-N 3.34Å; L518-T521 PolarHBondContact O-N 3Å; L518-T521 PolarHBondContact O-OG1 3.17Å; L518-Q522 WeakPolarHBondContact O-CB 3.31Å; L518-Q522 PolarHBondContact O-N 3.41Å; L518-Y561 HydrophobicContact CB-CD2 4.38Å; L518-Y561 HydrophobicContact CB-CE2 3.8Å; L518-K627 HydrophobicContact CD1-CG 4.46Å; L518-F881 HydrophobicContact CD1-CE2 3.66Å; L518-F881 HydrophobicContact CD1-CZ 4.2Å
519	L	89.5	Confident	86.6	Confident	1 Å²	1	22.4 Å²	22.4	1%	0.005	13%	0.132	C	C	.	.	I	π-helix	trans	-62.4	-43.3	175	-72.9	171.6	0	0	0	111.1	F515 A516 T521 V523 D524 Y527 T532 I556 Y561 E564 P811	F515-L519 WeakPolarHBondContact O-CB 3.29Å; F515-L519 VanDerWaalsContact O-CG 3.29Å; F515-L519 WeakPolarHBondContact O-CG 3.43Å; F515-L519 PolarHBondContact O-N 3.48Å; A516-L519 PolarHBondContact O-N 3.31Å; L519-T521 VanDerWaalsContact C-N 3.34Å; L519-T521 PolarHBondContact O-N 3.5Å; L519-V523 HydrophobicContact CD2-CB 4.26Å; L519-V523 HydrophobicContact CD2-CG2 3.8Å; L519-V523 WeakPolarHBondContact O-CB 3.4Å; L519-V523 PolarHBondContact O-N 2.71Å; L519-D524 PolarHBondContact O-N 3.2Å; L519-D524 VanDerWaalsContact O-N 3.08Å; L519-Y527 HydrophobicContact CB-CD2 4.33Å; L519-Y527 HydrophobicContact CB-CG 4.1Å; L519-T532 HydrophobicContact CD1-CG2 4.24Å; L519-I556 HydrophobicContact CD1-CD1 3.88Å; L519-Y561 HydrophobicContact CD2-CD2 3.93Å; L519-Y561 HydrophobicContact CD2-CE2 4.4Å; L519-Y561 HydrophobicContact CG-CD2 4.34Å; L519-E564 HydrophobicContact CD2-CB 4.14Å; L519-E564 HydrophobicContact CD2-CG 4.41Å; L519-P811 HydrophobicContact CD1-CB 3.92Å; L519-P811 HydrophobicContact CD1-CG 4.35Å
520	N	88.7	Confident	86.7	Confident	43 Å²	43	22.1 Å²	22.1	23%	0.23	13%	0.131	C	C	.	.	I	π-helix	trans	-62.7	-39.7	178.1	-170.5	-101.6	0	0	0	112.8	A516 L518 P525 Y527	A516-N520 WeakPolarHBondContact O-CB 3.5Å; A516-N520 PolarHBondContact O-N 3.5Å; L518-N520 VanDerWaalsContact C-N 3.34Å; N520-P525 PolarHBondContact ND2-O 3.2Å; N520-Y527 WeakPolarHBondContact CB-O 3.27Å; N520-Y527 PolarHBondContact ND2-O 3.32Å
521	T	83.7	Confident	87.2	Confident	96 Å²	96	21.9 Å²	21.9	59%	0.589	13%	0.129	S	C	*	.	I	π-helix	trans	-91.3	-36.1	-172.3	53.3	0	0	0	0	114.2	A517 L518 L519	A517-T521 WeakPolarHBondContact O-CB 3.07Å; A517-T521 VanDerWaalsContact O-CG2 3.29Å; A517-T521 WeakPolarHBondContact O-CG2 3.16Å; A517-T521 PolarHBondContact O-N 3.22Å; A517-T521 PolarHBondContact O-OG1 3Å; L518-T521 PolarHBondContact O-N 3Å; L518-T521 PolarHBondContact O-OG1 3.17Å; L519-T521 VanDerWaalsContact C-N 3.34Å; L519-T521 PolarHBondContact O-N 3.5Å
522	Q	83.5	Confident	87.6	Confident	71 Å²	71	21.7 Å²	21.7	33%	0.332	13%	0.128	S	C	.	.	I	π-helix	trans	-106	-26.8	-172.4	-59.5	-168.3	6.5	0	0	113.7	L518 Y561	L518-Q522 WeakPolarHBondContact O-CB 3.31Å; L518-Q522 PolarHBondContact O-N 3.41Å; Q522-Y561 WeakPolarHBondContact CB-OH 3.31Å; Q522-Y561 PolarHBondContact OE1-OH 3.38Å
523	V	87.4	Confident	87.7	Confident	3 Å²	3	21.7 Å²	21.7	2%	0.018	13%	0.128	C	C	.	.	I	π-helix	trans	-97.9	-75.5	-176.8	179.8	0	0	0	0	110	L519 Y527 Y561 E564 V568 F578	L519-V523 HydrophobicContact CD2-CB 4.26Å; L519-V523 HydrophobicContact CD2-CG2 3.8Å; L519-V523 WeakPolarHBondContact O-CB 3.4Å; L519-V523 PolarHBondContact O-N 2.71Å; V523-Y527 HydrophobicContact CG1-CD2 4.29Å; V523-Y527 HydrophobicContact CG1-CE2 3.9Å; V523-Y561 HydrophobicContact CG2-CE2 4.09Å; V523-E564 HydrophobicContact CG1-CB 4.17Å; V523-V568 HydrophobicContact CB-CG2 4.46Å; V523-V568 HydrophobicContact CG1-CB 4.44Å; V523-V568 HydrophobicContact CG1-CG2 3.4Å; V523-V568 VanDerWaalsContact CG1-CG2 3.4Å; V523-F578 HydrophobicContact CG1-CZ 4.34Å
524	D	89.3	Confident	88	Confident	47 Å²	47	23 Å²	23	25%	0.251	14%	0.135	S	C	.	.			trans	-155.2	136.1	-179	-170.5	80.6	0	0	0	111.1	L519 S526 Y527 F578	L519-D524 PolarHBondContact O-N 3.2Å; L519-D524 VanDerWaalsContact O-N 3.08Å; D524-S526 PolarHBondContact O-N 2.86Å; D524-S526 VanDerWaalsContact O-N 3.07Å; D524-S526 WeakPolarHBondContact OD2-CA 3.29Å; D524-S526 WeakPolarHBondContact OD2-CB 3.36Å; D524-S526 PolarHBondContact OD2-N 2.93Å; D524-S526 PolarHBondContact OD2-OG 2.97Å; D524-Y527 HydrophobicContact CB-CD2 4.19Å; D524-Y527 HydrophobicContact CB-CE2 4.41Å; D524-Y527 PolarHBondContact O-N 3.27Å; D524-Y527 VanDerWaalsContact O-N 3.1Å; D524-F578 HydrophobicContact CB-CD1 4.47Å; D524-F578 HydrophobicContact CB-CE1 4.4Å
525	P	87.7	Confident	88.5	Confident	95 Å²	95	22.8 Å²	22.8	62%	0.617	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-14.1	-179.3	25.9	-35.8	0	0	0	113.8	N520 Y527	N520-P525 PolarHBondContact ND2-O 3.2Å; P525-Y527 PolarHBondContact O-N 3.45Å
526	S	86.5	Confident	88.8	Confident	28 Å²	28	22.8 Å²	22.8	20%	0.196	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-24.5	173	66.9	0	0	0	0	113.2	D524 T528 N735	D524-S526 PolarHBondContact O-N 2.86Å; D524-S526 VanDerWaalsContact O-N 3.07Å; D524-S526 WeakPolarHBondContact OD2-CA 3.29Å; D524-S526 WeakPolarHBondContact OD2-CB 3.36Å; D524-S526 PolarHBondContact OD2-N 2.93Å; D524-S526 PolarHBondContact OD2-OG 2.97Å; S526-T528 VanDerWaalsContact C-N 3.29Å; S526-T528 PolarHBondContact O-N 2.87Å; S526-N735 PolarHBondContact O-ND2 3.16Å
527	Y	88.5	Confident	89.1	Confident	1 Å²	1	22.8 Å²	22.8	0%	0.004	13%	0.134	C	C	.	.	S	Bend	trans	-75.9	81.9	172.2	-69.3	-74.6	0	0	0	110.6	L519 N520 V523 D524 P525 L531 T532 E564 F578 R582 P811	L519-Y527 HydrophobicContact CB-CD2 4.33Å; L519-Y527 HydrophobicContact CB-CG 4.1Å; N520-Y527 WeakPolarHBondContact CB-O 3.27Å; N520-Y527 PolarHBondContact ND2-O 3.32Å; V523-Y527 HydrophobicContact CG1-CD2 4.29Å; V523-Y527 HydrophobicContact CG1-CE2 3.9Å; D524-Y527 HydrophobicContact CB-CD2 4.19Å; D524-Y527 HydrophobicContact CB-CE2 4.41Å; D524-Y527 PolarHBondContact O-N 3.27Å; D524-Y527 VanDerWaalsContact O-N 3.1Å; P525-Y527 PolarHBondContact O-N 3.45Å; Y527-L531 HydrophobicContact CD1-CD2 3.92Å; Y527-T532 HydrophobicContact CD1-CG2 4.38Å; Y527-E564 PolarHBondContact OH-OE1 2.99Å; Y527-E564 VanDerWaalsContact OH-OE1 3.11Å; Y527-E564 PolarHBondContact OH-OE2 3.06Å; Y527-E564 VanDerWaalsContact OH-OE2 3.06Å; Y527-F578 AromaticContact CE2-CE1 3.75Å; Y527-F578 HydrophobicContact CE2-CE1 3.75Å; Y527-F578 AromaticContact CE2-CZ 3.87Å; Y527-F578 HydrophobicContact CE2-CZ 3.87Å; Y527-F578 WeakPolarHBondContact OH-CZ 3.4Å; Y527-R582 PolarHBondContact OH-NE 2.97Å; Y527-R582 PolarHBondContact OH-NH1 3.45Å; Y527-R582 PolarHBondContact OH-NH2 3.22Å; Y527-P811 HydrophobicContact CD1-CB 4.4Å; Y527-P811 HydrophobicContact CE1-CB 3.97Å; Y527-P811 HydrophobicContact CE1-CG 4.46Å
528	T	88.3	Confident	89.6	Confident	32 Å²	32	24.1 Å²	24.1	20%	0.196	14%	0.14	C	C	.	.			trans	-68.7	150.9	173.4	63.1	0	0	0	0	110.7	S526 T530 L531 T532	S526-T528 VanDerWaalsContact C-N 3.29Å; S526-T528 PolarHBondContact O-N 2.87Å; T528-T530 PolarHBondContact O-N 3.33Å; T528-T530 PolarHBondContact OG1-OG1 2.93Å; T528-L531 PolarHBondContact O-N 3.45Å; T528-L531 WeakPolarHBondContact OG1-CB 3.3Å; T528-L531 PolarHBondContact OG1-N 3.06Å; T528-T532 WeakPolarHBondContact O-CG2 3.43Å; T528-T532 PolarHBondContact O-N 2.96Å; T528-T532 VanDerWaalsContact O-N 3.12Å; T528-T532 PolarHBondContact O-OG1 3.17Å; T528-T532 VanDerWaalsContact O-OG1 3.05Å
529	V	87.3	Confident	90.2	Very high	7 Å²	7	24 Å²	24	4%	0.042	14%	0.14	C	C	.	.	H	α-helix	trans	-63.7	-30.2	177.5	-179.2	0	0	0	0	111.4	A516 T532 L533 V720 I722	A516-V529 HydrophobicContact CB-CB 4.23Å; A516-V529 HydrophobicContact CB-CG1 3.89Å; A516-V529 HydrophobicContact CB-CG2 4.12Å; V529-T532 WeakPolarHBondContact CA-OG1 3.49Å; V529-T532 PolarHBondContact O-OG1 2.8Å; V529-L533 HydrophobicContact CG1-CD1 4.15Å; V529-L533 HydrophobicContact CG1-CG 4.44Å; V529-L533 WeakPolarHBondContact O-CB 3.18Å; V529-L533 VanDerWaalsContact O-CG 3.25Å; V529-L533 WeakPolarHBondContact O-CG 3.29Å; V529-L533 PolarHBondContact O-N 2.94Å; V529-L533 VanDerWaalsContact O-N 3.14Å; V529-V720 HydrophobicContact CG1-CG1 4.29Å; V529-V720 HydrophobicContact CG2-CG1 4.33Å; V529-I722 HydrophobicContact CB-CG1 3.89Å; V529-I722 HydrophobicContact CG1-CD1 3.82Å; V529-I722 HydrophobicContact CG1-CG1 3.67Å
530	T	90	Very high	90.5	Very high	4 Å²	4	24 Å²	24	3%	0.025	14%	0.14	C	C	.	.	H	α-helix	trans	-69.6	-45.1	175.9	52.8	0	0	0	0	112.3	T528 L533 L534 I722 P723 I863	T528-T530 PolarHBondContact O-N 3.33Å; T528-T530 PolarHBondContact OG1-OG1 2.93Å; T530-L533 PolarHBondContact O-N 2.7Å; T530-L534 WeakPolarHBondContact O-CB 3.34Å; T530-L534 PolarHBondContact O-N 3.29Å; T530-I722 HydrophobicContact CG2-CG2 4.08Å; T530-P723 HydrophobicContact CG2-CG 4.28Å; T530-I863 HydrophobicContact CG2-CG2 3.94Å
531	L	91.5	Very high	90.9	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-55.9	-51.6	174.6	172.3	99.8	0	0	0	111.5	Y527 T528 L534 A535 T732 W733	Y527-L531 HydrophobicContact CD1-CD2 3.92Å; T528-L531 PolarHBondContact O-N 3.45Å; T528-L531 WeakPolarHBondContact OG1-CB 3.3Å; T528-L531 PolarHBondContact OG1-N 3.06Å; L531-L534 PolarHBondContact O-N 2.94Å; L531-A535 WeakPolarHBondContact O-CB 3.42Å; L531-A535 PolarHBondContact O-N 2.98Å; L531-T732 WeakPolarHBondContact CD1-O 3.15Å; L531-W733 WeakPolarHBondContact CD1-O 3.37Å
532	T	91.7	Very high	91.5	Very high	1 Å²	1	22 Å²	22	1%	0.006	13%	0.125	C	C	.	.	H	α-helix	trans	-64.7	-41	-176	51.5	0	0	0	0	111.6	A516 L519 Y527 T528 V529 A535 V536 P811	A516-T532 HydrophobicContact CB-CG2 4.18Å; A516-T532 WeakPolarHBondContact CB-OG1 3.48Å; L519-T532 HydrophobicContact CD1-CG2 4.24Å; Y527-T532 HydrophobicContact CD1-CG2 4.38Å; T528-T532 WeakPolarHBondContact O-CG2 3.43Å; T528-T532 PolarHBondContact O-N 2.96Å; T528-T532 VanDerWaalsContact O-N 3.12Å; T528-T532 PolarHBondContact O-OG1 3.17Å; T528-T532 VanDerWaalsContact O-OG1 3.05Å; V529-T532 WeakPolarHBondContact CA-OG1 3.49Å; V529-T532 PolarHBondContact O-OG1 2.8Å; T532-A535 PolarHBondContact O-N 3.23Å; T532-V536 VanDerWaalsContact O-CG2 3.29Å; T532-V536 WeakPolarHBondContact O-CG2 3.48Å; T532-V536 PolarHBondContact O-N 3.24Å; T532-P811 HydrophobicContact CG2-CG 4.08Å
533	L	92.2	Very high	92.1	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-65.3	-42.3	174.5	-72.3	177.2	0	0	0	112.5	L509 I513 V529 T530 V536 G537 I863	L509-L533 HydrophobicContact CD1-CD2 3.97Å; I513-L533 HydrophobicContact CG1-CD1 4.37Å; I513-L533 HydrophobicContact CG1-CD2 4.04Å; V529-L533 HydrophobicContact CG1-CD1 4.15Å; V529-L533 HydrophobicContact CG1-CG 4.44Å; V529-L533 WeakPolarHBondContact O-CB 3.18Å; V529-L533 VanDerWaalsContact O-CG 3.25Å; V529-L533 WeakPolarHBondContact O-CG 3.29Å; V529-L533 PolarHBondContact O-N 2.94Å; V529-L533 VanDerWaalsContact O-N 3.14Å; T530-L533 PolarHBondContact O-N 2.7Å; L533-V536 PolarHBondContact O-N 2.99Å; L533-G537 PolarHBondContact O-N 2.84Å; L533-I863 HydrophobicContact CB-CG1 4.19Å
534	L	93.2	Very high	92.4	Very high	29 Å²	29	18.6 Å²	18.6	15%	0.152	11%	0.109	C	C	.	.	H	α-helix	trans	-59.1	-50.1	174.5	-171.6	66.5	0	0	0	110.7	T530 L531 V536 G537 V538 W733 W810 A860 I863	T530-L534 WeakPolarHBondContact O-CB 3.34Å; T530-L534 PolarHBondContact O-N 3.29Å; L531-L534 PolarHBondContact O-N 2.94Å; L534-V536 PolarHBondContact O-N 3.29Å; L534-G537 PolarHBondContact O-N 2.9Å; L534-V538 HydrophobicContact CD1-CG2 4.36Å; L534-V538 HydrophobicContact CG-CG2 4.39Å; L534-V538 WeakPolarHBondContact O-CG2 3.44Å; L534-V538 PolarHBondContact O-N 3.4Å; L534-W733 HydrophobicContact CD2-CB 3.91Å; L534-W733 HydrophobicContact CD2-CD2 3.83Å; L534-W733 HydrophobicContact CD2-CE3 3.7Å; L534-W733 HydrophobicContact CD2-CG 3.98Å; L534-W733 HydrophobicContact CD2-CZ3 4.43Å; L534-W810 HydrophobicContact CD2-CZ2 4.36Å; L534-A860 HydrophobicContact CD1-CB 4.41Å; L534-I863 HydrophobicContact CB-CD1 3.58Å; L534-I863 HydrophobicContact CD1-CD1 3.71Å; L534-I863 HydrophobicContact CG-CD1 4.18Å
535	A	94.3	Very high	92.6	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-58	-48.8	-179.9	0	0	0	0	0	111.4	L531 T532 G537 V538 F539 W810 M813	L531-A535 WeakPolarHBondContact O-CB 3.42Å; L531-A535 PolarHBondContact O-N 2.98Å; T532-A535 PolarHBondContact O-N 3.23Å; A535-G537 VanDerWaalsContact C-N 3.34Å; A535-G537 PolarHBondContact O-N 3.02Å; A535-V538 PolarHBondContact O-N 3.25Å; A535-F539 HydrophobicContact CB-CD2 4.27Å; A535-F539 HydrophobicContact CB-CE2 4.34Å; A535-F539 WeakPolarHBondContact O-CB 3.41Å; A535-F539 WeakPolarHBondContact O-CD2 3.3Å; A535-F539 PolarHBondContact O-N 3.21Å; A535-W810 HydrophobicContact CB-CB 3.76Å; A535-W810 HydrophobicContact CB-CD2 3.66Å; A535-W810 HydrophobicContact CB-CE3 3.91Å; A535-W810 HydrophobicContact CB-CG 3.62Å; A535-M813 HydrophobicContact CB-CE 3.92Å
536	V	94.9	Very high	92.9	Very high	2 Å²	2	17.2 Å²	17.2	1%	0.012	10%	0.098	C	C	.	.	H	α-helix	trans	-59.3	-45.2	177.8	172.4	0	0	0	0	111.1	T532 L533 L534 L540 I556 M813 V859	T532-V536 VanDerWaalsContact O-CG2 3.29Å; T532-V536 WeakPolarHBondContact O-CG2 3.48Å; T532-V536 PolarHBondContact O-N 3.24Å; L533-V536 PolarHBondContact O-N 2.99Å; L534-V536 PolarHBondContact O-N 3.29Å; V536-L540 WeakPolarHBondContact O-CB 3.37Å; V536-L540 PolarHBondContact O-N 2.97Å; V536-I556 HydrophobicContact CG2-CD1 4.2Å; V536-I556 HydrophobicContact CG2-CG1 4.06Å; V536-M813 HydrophobicContact CB-CE 4.38Å; V536-M813 HydrophobicContact CG2-CE 3.49Å; V536-M813 VanDerWaalsContact CG2-CE 3.49Å; V536-M813 HydrophobicContact CG2-SD 3.97Å; V536-V859 HydrophobicContact CB-CG1 4.42Å; V536-V859 HydrophobicContact CG1-CG1 4.14Å
537	G	95	Very high	93.2	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-61.5	-48.1	178.8	0	0	0	0	0	112.6	L533 L534 A535 L540 I541 G856	L533-G537 PolarHBondContact O-N 2.84Å; L534-G537 PolarHBondContact O-N 2.9Å; A535-G537 VanDerWaalsContact C-N 3.34Å; A535-G537 PolarHBondContact O-N 3.02Å; G537-L540 PolarHBondContact O-N 2.91Å; G537-I541 VanDerWaalsContact O-CG1 3.3Å; G537-I541 WeakPolarHBondContact O-CG1 3.36Å; G537-I541 PolarHBondContact O-N 3.25Å; G537-G856 VanDerWaalsContact CA-O 3.3Å; G537-G856 WeakPolarHBondContact CA-O 3.21Å
538	V	95.6	Very high	93.2	Very high	41 Å²	41	15.9 Å²	15.9	25%	0.248	9%	0.088	C	C	.	.	H	α-helix	trans	-66.8	-47.7	-179.5	174.5	0	0	0	0	111.6	L534 A535 L540 I541 I542 W810	L534-V538 HydrophobicContact CD1-CG2 4.36Å; L534-V538 HydrophobicContact CG-CG2 4.39Å; L534-V538 WeakPolarHBondContact O-CG2 3.44Å; L534-V538 PolarHBondContact O-N 3.4Å; A535-V538 PolarHBondContact O-N 3.25Å; V538-L540 VanDerWaalsContact C-N 3.27Å; V538-L540 PolarHBondContact O-N 3.16Å; V538-I541 PolarHBondContact O-N 3.28Å; V538-I542 HydrophobicContact CG1-CD1 3.78Å; V538-I542 HydrophobicContact CG1-CG1 4.39Å; V538-I542 WeakPolarHBondContact O-CG1 3.34Å; V538-I542 PolarHBondContact O-N 2.8Å; V538-W810 HydrophobicContact CB-CH2 4.02Å; V538-W810 HydrophobicContact CB-CZ3 3.99Å; V538-W810 HydrophobicContact CG1-CH2 3.89Å; V538-W810 HydrophobicContact CG1-CZ3 3.8Å; V538-W810 HydrophobicContact CG2-CH2 4.18Å
539	F	96.2	Very high	93.3	Very high	1 Å²	1	14.3 Å²	14.3	0%	0.004	8%	0.079	C	C	.	.	H	α-helix	trans	-60.3	-38.4	177	-79.2	-57.6	0	0	0	111.8	A535 I542 F543 F801 I804 W810 M813	A535-F539 HydrophobicContact CB-CD2 4.27Å; A535-F539 HydrophobicContact CB-CE2 4.34Å; A535-F539 WeakPolarHBondContact O-CB 3.41Å; A535-F539 WeakPolarHBondContact O-CD2 3.3Å; A535-F539 PolarHBondContact O-N 3.21Å; F539-I542 PolarHBondContact O-N 2.99Å; F539-F543 VanDerWaalsContact O-CB 3.3Å; F539-F543 WeakPolarHBondContact O-CB 3.36Å; F539-F543 PolarHBondContact O-N 2.8Å; F539-F801 HydrophobicContact CB-CE2 4.05Å; F539-F801 HydrophobicContact CB-CZ 4.31Å; F539-F801 HydrophobicContact CD1-CB 4.37Å; F539-F801 AromaticContact CD1-CD1 3.71Å; F539-F801 HydrophobicContact CD1-CD1 3.71Å; F539-F801 AromaticContact CD1-CD2 3.7Å; F539-F801 HydrophobicContact CD1-CD2 3.7Å; F539-F801 AromaticContact CD1-CE1 3.8Å; F539-F801 HydrophobicContact CD1-CE1 3.8Å; F539-F801 AromaticContact CD1-CE2 3.77Å; F539-F801 HydrophobicContact CD1-CE2 3.77Å; F539-F801 AromaticContact CD1-CG 3.66Å; F539-F801 HydrophobicContact CD1-CG 3.66Å; F539-F801 AromaticContact CD1-CZ 3.82Å; F539-F801 HydrophobicContact CD1-CZ 3.82Å; F539-F801 HydrophobicContact CE1-CB 3.97Å; F539-F801 AromaticContact CE1-CD1 3.83Å; F539-F801 HydrophobicContact CE1-CD1 3.83Å; F539-F801 HydrophobicContact CE1-CD2 4.16Å; F539-F801 HydrophobicContact CE1-CE1 4.34Å; F539-F801 AromaticContact CE1-CG 3.72Å; F539-F801 HydrophobicContact CE1-CG 3.72Å; F539-F801 HydrophobicContact CG-CD2 4.34Å; F539-F801 HydrophobicContact CG-CE2 4.26Å; F539-F801 WeakPolarHBondContact O-CZ 3.47Å; F539-I804 HydrophobicContact CE1-CB 4Å; F539-I804 HydrophobicContact CE1-CD1 4.28Å; F539-I804 HydrophobicContact CE1-CG2 3.82Å; F539-I804 HydrophobicContact CZ-CB 4.14Å; F539-I804 HydrophobicContact CZ-CG2 3.75Å; F539-W810 HydrophobicContact CD2-CE3 4.14Å; F539-W810 HydrophobicContact CE2-CB 4.03Å; F539-W810 HydrophobicContact CE2-CD2 4.44Å; F539-W810 AromaticContact CE2-CE3 3.6Å; F539-W810 HydrophobicContact CE2-CE3 3.6Å; F539-W810 HydrophobicContact CE2-CZ3 4.45Å; F539-W810 AromaticContact CZ-CE3 3.84Å; F539-W810 HydrophobicContact CZ-CE3 3.84Å; F539-M813 HydrophobicContact CB-CG 4.23Å; F539-M813 HydrophobicContact CD2-CB 4.33Å; F539-M813 HydrophobicContact CD2-CE 3.95Å; F539-M813 HydrophobicContact CD2-CG 3.33Å; F539-M813 HydrophobicContact CD2-SD 4.46Å; F539-M813 HydrophobicContact CE2-CE 4.34Å; F539-M813 HydrophobicContact CE2-CG 3.75Å; F539-M813 HydrophobicContact CG-CG 3.92Å
540	L	95.4	Very high	93.5	Very high	2 Å²	2	14.1 Å²	14.1	1%	0.01	8%	0.078	C	C	.	.	H	α-helix	trans	-65.9	-39.5	176.9	-175	61.3	0	0	0	112.2	V536 G537 V538 T544 I553 V855	V536-L540 WeakPolarHBondContact O-CB 3.37Å; V536-L540 PolarHBondContact O-N 2.97Å; G537-L540 PolarHBondContact O-N 2.91Å; V538-L540 VanDerWaalsContact C-N 3.27Å; V538-L540 PolarHBondContact O-N 3.16Å; L540-T544 WeakPolarHBondContact O-CB 3.31Å; L540-T544 PolarHBondContact O-N 3.44Å; L540-T544 PolarHBondContact O-OG1 3.42Å; L540-I553 HydrophobicContact CD1-CG2 4.3Å; L540-V855 HydrophobicContact CD2-CB 4.4Å; L540-V855 HydrophobicContact CD2-CG1 3.91Å
541	I	96.4	Very high	93.6	Very high	47 Å²	47	14 Å²	14	24%	0.241	8%	0.076	C	C	.	.	H	α-helix	trans	-62.1	-53.1	174.7	-66.6	163.5	0	0	0	109.9	G537 V538 F543 T544 V545 I857	G537-I541 VanDerWaalsContact O-CG1 3.3Å; G537-I541 WeakPolarHBondContact O-CG1 3.36Å; G537-I541 PolarHBondContact O-N 3.25Å; V538-I541 PolarHBondContact O-N 3.28Å; I541-F543 VanDerWaalsContact C-N 3.29Å; I541-F543 PolarHBondContact O-N 3.34Å; I541-T544 PolarHBondContact O-N 3.37Å; I541-V545 HydrophobicContact CG2-CG2 4.49Å; I541-V545 WeakPolarHBondContact O-CG2 3.31Å; I541-V545 PolarHBondContact O-N 2.99Å; I541-I857 HydrophobicContact CD1-CG1 3.81Å; I541-I857 HydrophobicContact CG1-CG1 4.36Å
542	I	96.1	Very high	93.6	Very high	50 Å²	50	14 Å²	14	26%	0.256	8%	0.077	S	C	.	.	H	α-helix	trans	-57.9	-46	-178.4	-65.2	170.3	0	0	0	110.1	V538 F539 V545 L546 F801	V538-I542 HydrophobicContact CG1-CD1 3.78Å; V538-I542 HydrophobicContact CG1-CG1 4.39Å; V538-I542 WeakPolarHBondContact O-CG1 3.34Å; V538-I542 PolarHBondContact O-N 2.8Å; F539-I542 PolarHBondContact O-N 2.99Å; I542-V545 PolarHBondContact O-N 3.35Å; I542-L546 HydrophobicContact CG2-CD1 4.05Å; I542-L546 WeakPolarHBondContact O-CB 3.34Å; I542-L546 PolarHBondContact O-N 2.91Å; I542-F801 HydrophobicContact CB-CE1 4.33Å; I542-F801 HydrophobicContact CB-CZ 4.42Å; I542-F801 HydrophobicContact CG2-CE1 3.82Å; I542-F801 HydrophobicContact CG2-CZ 4.29Å
543	F	95.9	Very high	93.7	Very high	1 Å²	1	14.2 Å²	14.2	0%	0.004	8%	0.078	C	C	.	.	H	α-helix	trans	-64.5	-46.3	178.6	-174.8	-106.5	0	0	0	112.6	F539 I541 V545 L546 S547 A552 I554 D793 L796 L797 F801	F539-F543 VanDerWaalsContact O-CB 3.3Å; F539-F543 WeakPolarHBondContact O-CB 3.36Å; F539-F543 PolarHBondContact O-N 2.8Å; I541-F543 VanDerWaalsContact C-N 3.29Å; I541-F543 PolarHBondContact O-N 3.34Å; F543-V545 PolarHBondContact O-N 2.87Å; F543-L546 PolarHBondContact O-N 3.28Å; F543-S547 WeakPolarHBondContact O-CA 3.33Å; F543-S547 WeakPolarHBondContact O-CB 3.23Å; F543-S547 PolarHBondContact O-N 3.48Å; F543-S547 PolarHBondContact O-OG 2.9Å; F543-A552 HydrophobicContact CE1-CB 3.83Å; F543-A552 WeakPolarHBondContact CE1-O 3.41Å; F543-A552 HydrophobicContact CZ-CB 4.19Å; F543-I554 HydrophobicContact CB-CD1 3.58Å; F543-I554 HydrophobicContact CB-CG1 4.42Å; F543-I554 HydrophobicContact CD1-CD1 3.5Å; F543-I554 HydrophobicContact CD1-CG1 3.76Å; F543-I554 HydrophobicContact CD2-CD1 3.1Å; F543-I554 HydrophobicContact CD2-CG1 4.21Å; F543-I554 HydrophobicContact CE1-CD1 3.87Å; F543-I554 HydrophobicContact CE1-CG1 3.97Å; F543-I554 HydrophobicContact CE2-CD1 3.5Å; F543-I554 VanDerWaalsContact CE2-CD1 3.5Å; F543-I554 HydrophobicContact CE2-CG1 4.38Å; F543-I554 HydrophobicContact CG-CD1 3.09Å; F543-I554 HydrophobicContact CG-CG1 3.88Å; F543-I554 HydrophobicContact CZ-CD1 3.87Å; F543-I554 HydrophobicContact CZ-CG1 4.27Å; F543-D793 HydrophobicContact CE2-CB 4.21Å; F543-D793 HydrophobicContact CZ-CB 4.43Å; F543-L796 HydrophobicContact CD2-CB 4.38Å; F543-L796 HydrophobicContact CD2-CD1 3.82Å; F543-L796 HydrophobicContact CE2-CD1 4.33Å; F543-L797 HydrophobicContact CE2-CD1 4.24Å; F543-L797 HydrophobicContact CE2-CG 4.28Å; F543-F801 HydrophobicContact CB-CE2 4.26Å; F543-F801 HydrophobicContact CB-CZ 3.91Å
544	T	93.8	Very high	93.8	Very high	2 Å²	2	14.2 Å²	14.2	1%	0.012	8%	0.078	C	C	.	.	H	α-helix	trans	-63.3	-35.6	-177.3	-52.6	0	0	0	0	111.5	L540 I541 P550 R849 V853	L540-T544 WeakPolarHBondContact O-CB 3.31Å; L540-T544 PolarHBondContact O-N 3.44Å; L540-T544 PolarHBondContact O-OG1 3.42Å; I541-T544 PolarHBondContact O-N 3.37Å; T544-P550 HydrophobicContact CG2-CB 4.28Å; T544-R849 HydrophobicContact CG2-CB 4.27Å; T544-R849 WeakPolarHBondContact CG2-O 3.34Å; T544-R849 PolarHBondContact O-NH1 2.88Å; T544-V853 HydrophobicContact CG2-CG2 4.11Å
545	V	94.3	Very high	93.7	Very high	49 Å²	49	12.8 Å²	12.8	30%	0.297	7%	0.071	S	C	.	.	H	α-helix	trans	-71.6	-43.8	177.9	175.2	0	0	0	0	111.6	I541 I542 F543 R849 V853	I541-V545 HydrophobicContact CG2-CG2 4.49Å; I541-V545 WeakPolarHBondContact O-CG2 3.31Å; I541-V545 PolarHBondContact O-N 2.99Å; I542-V545 PolarHBondContact O-N 3.35Å; F543-V545 PolarHBondContact O-N 2.87Å; V545-R849 PolarHBondContact O-NH1 3.48Å; V545-R849 VanDerWaalsContact O-NH1 3.09Å; V545-V853 HydrophobicContact CG2-CG2 3.86Å
546	L	93.7	Very high	93.6	Very high	64 Å²	64	12.9 Å²	12.9	34%	0.335	7%	0.071	S	C	.	.	H	α-helix	trans	-103	-13.2	-168.8	-60.6	178	0	0	0	115.3	W477 I542 F543 L796	W477-L546 VanDerWaalsContact CE2-O 3.24Å; W477-L546 HydrophobicContact CZ2-CB 4.39Å; W477-L546 HydrophobicContact CZ2-CD2 4.25Å; W477-L546 WeakPolarHBondContact CZ2-O 3.31Å; W477-L546 PolarHBondContact NE1-O 3.04Å; I542-L546 HydrophobicContact CG2-CD1 4.05Å; I542-L546 WeakPolarHBondContact O-CB 3.34Å; I542-L546 PolarHBondContact O-N 2.91Å; F543-L546 PolarHBondContact O-N 3.28Å; L546-L796 HydrophobicContact CB-CD1 3.74Å; L546-L796 HydrophobicContact CB-CD2 3.96Å; L546-L796 HydrophobicContact CB-CG 4.45Å; L546-L796 HydrophobicContact CD1-CD2 4.16Å
547	S	92.3	Very high	93.4	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.072	C	C	.	.			trans	-64.3	155.2	-175.9	52.2	0	0	0	0	113.5	W477 F543 P550 D793 R849	W477-S547 PolarHBondContact NE1-O 3.5Å; F543-S547 WeakPolarHBondContact O-CA 3.33Å; F543-S547 WeakPolarHBondContact O-CB 3.23Å; F543-S547 PolarHBondContact O-N 3.48Å; F543-S547 PolarHBondContact O-OG 2.9Å; S547-P550 WeakPolarHBondContact OG-CA 3.28Å; S547-D793 WeakPolarHBondContact CA-OD1 3.24Å; S547-D793 VanDerWaalsContact CB-OD1 3.25Å; S547-D793 WeakPolarHBondContact CB-OD1 3.29Å; S547-R849 PolarHBondContact O-NH1 3.14Å; S547-R849 PolarHBondContact O-NH2 3.09Å
548	G	88.8	Confident	93	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.073	C	C	.	.	S	Bend	trans	-69.9	-36.3	166.1	0	0	0	0	0	112	R480 D793	R480-G548 PolarHBondContact NH1-O 3.44Å; G548-D793 WeakPolarHBondContact CA-OD1 3.36Å; G548-D793 PolarHBondContact N-OD1 3.03Å
549	Q	90.7	Very high	92.7	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.061	C	C	.	.			trans	-123.5	93.7	175.3	-175.2	63.9	-28.5	0	0	113	L551 A552 A779 M780 N788 D793	Q549-L551 PolarHBondContact O-N 2.9Å; Q549-L551 VanDerWaalsContact O-N 3.17Å; Q549-A552 WeakPolarHBondContact O-CB 3.38Å; Q549-A552 PolarHBondContact O-N 3.36Å; Q549-A552 VanDerWaalsContact O-N 3.16Å; Q549-A779 HydrophobicContact CG-CB 3.56Å; Q549-A779 PolarHBondContact NE2-O 3.21Å; Q549-M780 PolarHBondContact NE2-SD 3.24Å; Q549-M780 VanDerWaalsContact NE2-SD 3.37Å; Q549-N788 WeakPolarHBondContact CB-OD1 3.34Å; Q549-D793 PolarHBondContact N-OD1 2.9Å
550	P	92	Very high	92.4	Very high	3 Å²	3	11.2 Å²	11.2	2%	0.019	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-7.4	-174	30.6	-37.5	0	0	0	115.3	T544 S547 R849	T544-P550 HydrophobicContact CG2-CB 4.28Å; S547-P550 WeakPolarHBondContact OG-CA 3.28Å; P550-R849 HydrophobicContact CB-CB 4.4Å; P550-R849 HydrophobicContact CB-CG 3.49Å; P550-R849 VanDerWaalsContact CB-CG 3.49Å; P550-R849 HydrophobicContact CG-CG 3.63Å
551	L	91.2	Very high	92.2	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-18.4	172.2	-64.9	-178.4	0	0	0	112.5	Q549 A779 N823 L827 T845 E847	Q549-L551 PolarHBondContact O-N 2.9Å; Q549-L551 VanDerWaalsContact O-N 3.17Å; L551-A779 HydrophobicContact CB-CB 4.36Å; L551-N823 PolarHBondContact O-ND2 3.39Å; L551-L827 HydrophobicContact CD2-CD1 3.5Å; L551-L827 VanDerWaalsContact CD2-CD1 3.5Å; L551-T845 HydrophobicContact CD1-CG2 3.83Å; L551-E847 HydrophobicContact CD1-CG 4.01Å
552	A	92.2	Very high	91.8	Very high	2 Å²	2	9.6 Å²	9.6	2%	0.017	5%	0.053	C	C	.	.			trans	-73.5	136.7	176.9	0	0	0	0	0	111	F543 Q549 A779 T820	F543-A552 HydrophobicContact CE1-CB 3.83Å; F543-A552 WeakPolarHBondContact CE1-O 3.41Å; F543-A552 HydrophobicContact CZ-CB 4.19Å; Q549-A552 WeakPolarHBondContact O-CB 3.38Å; Q549-A552 PolarHBondContact O-N 3.36Å; Q549-A552 VanDerWaalsContact O-N 3.16Å; A552-A779 HydrophobicContact CB-CB 4.44Å; A552-T820 HydrophobicContact CB-CG2 4.41Å
553	I	93	Very high	91.5	Very high	4 Å²	4	7.2 Å²	7.2	2%	0.021	4%	0.04	C	C	.	.			trans	-105.2	137.4	176.6	-66.7	-171.4	0	0	0	110	I504 N508 L540 N775 T816 R819 T820 N823	I504-I553 HydrophobicContact CG2-CD1 3.56Å; N508-I553 VanDerWaalsContact OD1-CG2 3.23Å; N508-I553 WeakPolarHBondContact OD1-CG2 3.4Å; L540-I553 HydrophobicContact CD1-CG2 4.3Å; I553-N775 PolarHBondContact O-ND2 3.39Å; I553-T816 PolarHBondContact O-N 3.22Å; I553-T816 PolarHBondContact O-OG1 2.93Å; I553-R819 HydrophobicContact CB-CB 4.21Å; I553-R819 HydrophobicContact CG2-CB 3.92Å; I553-T820 PolarHBondContact N-OG1 2.88Å; I553-N823 HydrophobicContact CD1-CB 3.45Å; I553-N823 VanDerWaalsContact CD1-CB 3.45Å; I553-N823 HydrophobicContact CG1-CB 4.03Å
554	I	94.1	Very high	91.3	Very high	1 Å²	1	7.2 Å²	7.2	1%	0.005	4%	0.041	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	151.3	176	-67.4	-175.1	0	0	0	110.4	F543 L797 F801 M813 S814	F543-I554 HydrophobicContact CB-CD1 3.58Å; F543-I554 HydrophobicContact CB-CG1 4.42Å; F543-I554 HydrophobicContact CD1-CD1 3.5Å; F543-I554 HydrophobicContact CD1-CG1 3.76Å; F543-I554 HydrophobicContact CD2-CD1 3.1Å; F543-I554 HydrophobicContact CD2-CG1 4.21Å; F543-I554 HydrophobicContact CE1-CD1 3.87Å; F543-I554 HydrophobicContact CE1-CG1 3.97Å; F543-I554 HydrophobicContact CE2-CD1 3.5Å; F543-I554 VanDerWaalsContact CE2-CD1 3.5Å; F543-I554 HydrophobicContact CE2-CG1 4.38Å; F543-I554 HydrophobicContact CG-CD1 3.09Å; F543-I554 HydrophobicContact CG-CG1 3.88Å; F543-I554 HydrophobicContact CZ-CD1 3.87Å; F543-I554 HydrophobicContact CZ-CG1 4.27Å; I554-L797 HydrophobicContact CD1-CD1 4.35Å; I554-L797 HydrophobicContact CD1-CD2 3.36Å; I554-L797 HydrophobicContact CD1-CG 4.07Å; I554-L797 HydrophobicContact CG1-CD2 4.26Å; I554-F801 HydrophobicContact CD1-CD2 4.47Å; I554-F801 HydrophobicContact CD1-CE2 3.7Å; I554-F801 HydrophobicContact CG2-CE2 4.29Å; I554-M813 HydrophobicContact CG2-CB 3.74Å; I554-S814 WeakPolarHBondContact CA-O 3.29Å
555	G	92.5	Very high	90.9	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	5%	0.048	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.3	-157.8	157.6	0	0	0	0	0	109.2	S557 S814 R819	G555-S557 PolarHBondContact O-N 3.28Å; G555-S814 PolarHBondContact N-O 3.28Å; G555-S814 PolarHBondContact O-N 2.7Å; G555-S814 VanDerWaalsContact O-O 3.1Å; G555-R819 VanDerWaalsContact N-NH2 3.15Å; G555-R819 PolarHBondContact O-NH2 3.45Å
556	I	92.5	Very high	90.6	Very high	2 Å²	2	6 Å²	6	1%	0.01	3%	0.034	C	C	.	.			trans	-66.4	128.9	177.4	-53.7	168.1	0	0	0	108.8	F515 L519 V536 P811 M813 R819	F515-I556 HydrophobicContact CB-CB 4.03Å; F515-I556 HydrophobicContact CB-CD1 4.07Å; F515-I556 HydrophobicContact CB-CG2 3.78Å; F515-I556 HydrophobicContact CD1-CG2 4.08Å; F515-I556 HydrophobicContact CD2-CB 4.21Å; F515-I556 HydrophobicContact CD2-CG2 4.16Å; F515-I556 HydrophobicContact CG-CB 4.18Å; F515-I556 HydrophobicContact CG-CG2 3.76Å; L519-I556 HydrophobicContact CD1-CD1 3.88Å; V536-I556 HydrophobicContact CG2-CD1 4.2Å; V536-I556 HydrophobicContact CG2-CG1 4.06Å; I556-P811 HydrophobicContact CD1-CB 4.42Å; I556-P811 HydrophobicContact CD1-CG 4.04Å; I556-P811 HydrophobicContact CG1-CG 4.35Å; I556-M813 HydrophobicContact CB-SD 4.42Å; I556-M813 HydrophobicContact CD1-CE 4.38Å; I556-M813 HydrophobicContact CG1-CE 3.76Å; I556-M813 HydrophobicContact CG1-SD 3.57Å; I556-M813 VanDerWaalsContact CG1-SD 3.57Å; I556-M813 PolarHBondContact N-SD 2.86Å; I556-M813 VanDerWaalsContact N-SD 3.37Å; I556-R819 PolarHBondContact O-NH2 2.89Å
557	S	90.2	Very high	90.4	Very high	5 Å²	5	3 Å²	3	4%	0.035	2%	0.018	C	C	.	.			trans	-111.6	164.6	175.2	83.9	0	0	0	0	110.9	G555 P559 M560 Y561 E771 S814	G555-S557 PolarHBondContact O-N 3.28Å; S557-P559 WeakPolarHBondContact OG-CD 3.43Å; S557-M560 PolarHBondContact O-N 2.99Å; S557-M560 WeakPolarHBondContact OG-CG 3.47Å; S557-M560 PolarHBondContact OG-N 3.32Å; S557-Y561 PolarHBondContact O-N 3.44Å; S557-E771 WeakPolarHBondContact CB-OE1 3.48Å; S557-E771 PolarHBondContact OG-OE1 3.17Å; S557-E771 PolarHBondContact OG-OE2 3.01Å; S557-S814 WeakPolarHBondContact CB-OG 3.43Å; S557-S814 PolarHBondContact OG-OG 3.01Å
558	A	86.7	Confident	90.3	Very high	2 Å²	2	3.4 Å²	3.4	2%	0.017	2%	0.021	C	C	.	.	H	α-helix	trans	-59.6	-46.4	175.8	0	0	0	0	0	112.8	F515 M560 Y561 I562 I620 F623	F515-A558 HydrophobicContact CZ-CB 4.42Å; A558-M560 PolarHBondContact O-N 3.27Å; A558-Y561 WeakPolarHBondContact O-CB 3.29Å; A558-Y561 PolarHBondContact O-N 3.13Å; A558-I562 WeakPolarHBondContact O-CG1 3.48Å; A558-I562 PolarHBondContact O-N 2.99Å; A558-I620 HydrophobicContact CB-CD1 3.99Å; A558-F623 HydrophobicContact CB-CB 4.47Å; A558-F623 HydrophobicContact CB-CD1 3.23Å; A558-F623 HydrophobicContact CB-CD2 3.94Å; A558-F623 HydrophobicContact CB-CE1 3.26Å; A558-F623 HydrophobicContact CB-CE2 4Å; A558-F623 HydrophobicContact CB-CG 3.61Å; A558-F623 HydrophobicContact CB-CZ 3.67Å
559	P	87.8	Confident	90.2	Very high	0 Å²	0	4.8 Å²	4.8	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-47.6	-49.3	166.5	-40.9	44.9	0	0	0	115.7	S557 Y561 I562 V563 I620 I767 E771 F955	S557-P559 WeakPolarHBondContact OG-CD 3.43Å; P559-Y561 VanDerWaalsContact C-N 3.3Å; P559-Y561 PolarHBondContact O-N 2.71Å; P559-I562 PolarHBondContact O-N 2.68Å; P559-V563 WeakPolarHBondContact O-CG2 3.48Å; P559-V563 PolarHBondContact O-N 2.96Å; P559-I620 HydrophobicContact CG-CD1 4.29Å; P559-I767 HydrophobicContact CB-CG2 3.65Å; P559-E771 VanDerWaalsContact CG-OE1 3.25Å; P559-E771 WeakPolarHBondContact CG-OE1 3.19Å; P559-F955 HydrophobicContact CB-CE1 4.29Å; P559-F955 HydrophobicContact CB-CE2 4.27Å; P559-F955 HydrophobicContact CB-CZ 3.51Å; P559-F955 HydrophobicContact CG-CE1 4.34Å; P559-F955 HydrophobicContact CG-CE2 3.78Å; P559-F955 HydrophobicContact CG-CZ 3.46Å; P559-F955 VanDerWaalsContact CG-CZ 3.46Å
560	M	91.3	Very high	90.1	Very high	2 Å²	2	6 Å²	6	1%	0.01	4%	0.038	C	C	.	.	H	α-helix	trans	-63.5	-39	-179.5	-63.6	-59.7	94.2	0	0	111.3	S557 A558 I562 V563 E564 L764 I767 I768 F812	S557-M560 PolarHBondContact O-N 2.99Å; S557-M560 WeakPolarHBondContact OG-CG 3.47Å; S557-M560 PolarHBondContact OG-N 3.32Å; A558-M560 PolarHBondContact O-N 3.27Å; M560-I562 PolarHBondContact O-N 3.27Å; M560-V563 PolarHBondContact O-N 3.44Å; M560-E564 WeakPolarHBondContact O-CG 3.38Å; M560-E564 PolarHBondContact O-N 2.94Å; M560-L764 HydrophobicContact CE-CD1 3.69Å; M560-L764 HydrophobicContact SD-CD1 3.86Å; M560-I767 HydrophobicContact CE-CB 4.13Å; M560-I767 HydrophobicContact CE-CG2 3.23Å; M560-I768 HydrophobicContact CE-CG1 4.07Å; M560-I768 HydrophobicContact SD-CG1 4.22Å; M560-F812 HydrophobicContact CB-CB 4.37Å; M560-F812 WeakPolarHBondContact CB-O 3.12Å; M560-F812 HydrophobicContact CG-CB 4.29Å; M560-F812 HydrophobicContact SD-CB 3.6Å; M560-F812 VanDerWaalsContact SD-CB 3.6Å
561	Y	90.1	Very high	89.9	Confident	5 Å²	5	6.5 Å²	6.5	2%	0.02	4%	0.042	C	C	.	.	H	α-helix	trans	-60.5	-42.8	173.8	172.7	-89.6	0	0	0	112.9	F515 L518 L519 Q522 V523 S557 A558 P559 V563 E564 S565 F623	F515-Y561 HydrophobicContact CD1-CD2 4.42Å; F515-Y561 HydrophobicContact CD1-CG 4.48Å; F515-Y561 HydrophobicContact CE1-CG 4.46Å; L518-Y561 HydrophobicContact CB-CD2 4.38Å; L518-Y561 HydrophobicContact CB-CE2 3.8Å; L519-Y561 HydrophobicContact CD2-CD2 3.93Å; L519-Y561 HydrophobicContact CD2-CE2 4.4Å; L519-Y561 HydrophobicContact CG-CD2 4.34Å; Q522-Y561 WeakPolarHBondContact CB-OH 3.31Å; Q522-Y561 PolarHBondContact OE1-OH 3.38Å; V523-Y561 HydrophobicContact CG2-CE2 4.09Å; S557-Y561 PolarHBondContact O-N 3.44Å; A558-Y561 WeakPolarHBondContact O-CB 3.29Å; A558-Y561 PolarHBondContact O-N 3.13Å; P559-Y561 VanDerWaalsContact C-N 3.3Å; P559-Y561 PolarHBondContact O-N 2.71Å; Y561-V563 VanDerWaalsContact C-N 3.33Å; Y561-V563 PolarHBondContact O-N 2.9Å; Y561-E564 PolarHBondContact O-N 3.16Å; Y561-S565 WeakPolarHBondContact CE1-OG 3.28Å; Y561-S565 WeakPolarHBondContact O-CB 3.45Å; Y561-S565 PolarHBondContact O-N 2.87Å; Y561-S565 PolarHBondContact O-OG 2.73Å; Y561-F623 HydrophobicContact CD1-CZ 4.1Å
562	I	88.2	Confident	89.7	Confident	9 Å²	9	15 Å²	15	5%	0.046	7%	0.074	C	C	.	.	H	α-helix	trans	-63.8	-40.6	177.7	-65.9	166.9	0	0	0	110.7	A558 P559 M560 S565 S566 F623 F955	A558-I562 WeakPolarHBondContact O-CG1 3.48Å; A558-I562 PolarHBondContact O-N 2.99Å; P559-I562 PolarHBondContact O-N 2.68Å; M560-I562 PolarHBondContact O-N 3.27Å; I562-S565 PolarHBondContact O-N 3.2Å; I562-S566 WeakPolarHBondContact O-CB 3.27Å; I562-S566 PolarHBondContact O-N 2.82Å; I562-S566 PolarHBondContact O-OG 3.27Å; I562-F623 HydrophobicContact CD1-CD2 4.25Å; I562-F623 HydrophobicContact CD1-CE2 3.81Å; I562-F623 HydrophobicContact CG1-CE2 3.98Å; I562-F955 HydrophobicContact CD1-CD1 4.31Å; I562-F955 HydrophobicContact CD1-CE1 4.11Å
563	V	90	Very high	89.4	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-63.5	-47.9	177.4	174.6	0	0	0	0	111.1	P559 M560 Y561 S565 S566 L567 I760 L764 I767 L953	P559-V563 WeakPolarHBondContact O-CG2 3.48Å; P559-V563 PolarHBondContact O-N 2.96Å; M560-V563 PolarHBondContact O-N 3.44Å; Y561-V563 VanDerWaalsContact C-N 3.33Å; Y561-V563 PolarHBondContact O-N 2.9Å; V563-S565 VanDerWaalsContact C-N 3.3Å; V563-S565 PolarHBondContact O-N 3.37Å; V563-S566 WeakPolarHBondContact O-CB 3.36Å; V563-S566 PolarHBondContact O-N 3.16Å; V563-S566 VanDerWaalsContact O-N 3.14Å; V563-L567 HydrophobicContact CG1-CD1 4.08Å; V563-L567 HydrophobicContact CG1-CG 4.49Å; V563-L567 WeakPolarHBondContact O-CG 3.22Å; V563-L567 PolarHBondContact O-N 3.37Å; V563-I760 HydrophobicContact CG1-CG2 4.42Å; V563-L764 HydrophobicContact CG1-CD1 4.2Å; V563-L764 HydrophobicContact CG2-CD1 4.23Å; V563-I767 HydrophobicContact CG2-CD1 3.45Å; V563-I767 VanDerWaalsContact CG2-CD1 3.45Å; V563-L953 HydrophobicContact CB-CD2 4.36Å; V563-L953 HydrophobicContact CG2-CD2 3.74Å
564	E	91.1	Very high	89	Confident	2 Å²	2	20.8 Å²	20.8	1%	0.009	11%	0.113	C	C	.	.	H	α-helix	trans	-62.2	-39.5	178.7	-63.6	-76.4	-157.7	0	0	111.2	L519 V523 Y527 M560 Y561 S566 L567 V568 R582 F812	L519-E564 HydrophobicContact CD2-CB 4.14Å; L519-E564 HydrophobicContact CD2-CG 4.41Å; V523-E564 HydrophobicContact CG1-CB 4.17Å; Y527-E564 PolarHBondContact OH-OE1 2.99Å; Y527-E564 VanDerWaalsContact OH-OE1 3.11Å; Y527-E564 PolarHBondContact OH-OE2 3.06Å; Y527-E564 VanDerWaalsContact OH-OE2 3.06Å; M560-E564 WeakPolarHBondContact O-CG 3.38Å; M560-E564 PolarHBondContact O-N 2.94Å; Y561-E564 PolarHBondContact O-N 3.16Å; E564-S566 VanDerWaalsContact C-N 3.34Å; E564-S566 PolarHBondContact O-N 3.42Å; E564-L567 PolarHBondContact O-N 2.85Å; E564-V568 PolarHBondContact O-N 3.02Å; E564-V568 VanDerWaalsContact O-N 3.14Å; E564-R582 IonicContact OE1-CZ 3.31Å; E564-R582 VanDerWaalsContact OE1-CZ 3.31Å; E564-R582 IonicContact OE1-NE 3.19Å; E564-R582 PolarHBondContact OE1-NE 2.88Å; E564-R582 IonicContact OE1-NH2 2.73Å; E564-R582 PolarHBondContact OE1-NH2 3.35Å; E564-R582 IonicContact OE2-CZ 3.87Å; E564-R582 IonicContact OE2-NE 3.08Å; E564-R582 PolarHBondContact OE2-NE 2.85Å; E564-R582 VanDerWaalsContact OE2-NE 3.08Å; E564-F812 VanDerWaalsContact CD-CD2 3.49Å; E564-F812 HydrophobicContact CG-CD2 4.17Å; E564-F812 WeakPolarHBondContact OE1-CD2 3.39Å; E564-F812 PolarHBondContact OE1-N 3.44Å
565	S	87.2	Confident	88.6	Confident	24 Å²	24	23.7 Å²	23.7	17%	0.168	14%	0.143	C	C	.	.	H	α-helix	trans	-64.1	-38.8	174.3	-56.4	0	0	0	0	112.4	Y561 I562 V563 S569	Y561-S565 WeakPolarHBondContact CE1-OG 3.28Å; Y561-S565 WeakPolarHBondContact O-CB 3.45Å; Y561-S565 PolarHBondContact O-N 2.87Å; Y561-S565 PolarHBondContact O-OG 2.73Å; I562-S565 PolarHBondContact O-N 3.2Å; V563-S565 VanDerWaalsContact C-N 3.3Å; V563-S565 PolarHBondContact O-N 3.37Å; S565-S569 PolarHBondContact O-N 2.88Å; S565-S569 VanDerWaalsContact O-N 3.09Å
566	S	87.4	Confident	88.3	Confident	1 Å²	1	24 Å²	24	1%	0.007	15%	0.145	C	C	.	.	H	α-helix	trans	-67.6	-41.2	176.6	-59.6	0	0	0	0	111.5	I562 V563 E564 V568 S569 V570 N949	I562-S566 WeakPolarHBondContact O-CB 3.27Å; I562-S566 PolarHBondContact O-N 2.82Å; I562-S566 PolarHBondContact O-OG 3.27Å; V563-S566 WeakPolarHBondContact O-CB 3.36Å; V563-S566 PolarHBondContact O-N 3.16Å; V563-S566 VanDerWaalsContact O-N 3.14Å; E564-S566 VanDerWaalsContact C-N 3.34Å; E564-S566 PolarHBondContact O-N 3.42Å; S566-V568 PolarHBondContact O-N 3.4Å; S566-S569 WeakPolarHBondContact O-CB 3.47Å; S566-S569 PolarHBondContact O-N 3.28Å; S566-V570 WeakPolarHBondContact O-CG2 3.42Å; S566-V570 PolarHBondContact O-N 2.99Å; S566-N949 PolarHBondContact OG-O 3.01Å
567	L	90.3	Very high	88.2	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-60	-44.5	176.4	-80.7	165.5	0	0	0	111.8	V563 E564 S569 V570 S571 F578 L581 R582 S585 I760 F812	V563-L567 HydrophobicContact CG1-CD1 4.08Å; V563-L567 HydrophobicContact CG1-CG 4.49Å; V563-L567 WeakPolarHBondContact O-CG 3.22Å; V563-L567 PolarHBondContact O-N 3.37Å; E564-L567 PolarHBondContact O-N 2.85Å; L567-S569 VanDerWaalsContact C-N 3.35Å; L567-V570 PolarHBondContact O-N 2.94Å; L567-S571 WeakPolarHBondContact O-CB 3.46Å; L567-S571 PolarHBondContact O-N 3.48Å; L567-F578 HydrophobicContact CB-CD2 4.3Å; L567-F578 HydrophobicContact CB-CE2 3.78Å; L567-L581 HydrophobicContact CD2-CD2 4.08Å; L567-L581 HydrophobicContact CD2-CG 3.98Å; L567-R582 HydrophobicContact CD1-CG 4.35Å; L567-S585 WeakPolarHBondContact CD2-OG 3.25Å; L567-I760 HydrophobicContact CD2-CD1 3.91Å; L567-I760 HydrophobicContact CD2-CG2 3.96Å; L567-I760 HydrophobicContact CG-CG2 4.27Å; L567-F812 HydrophobicContact CD1-CE2 3.85Å
568	V	89.5	Confident	88.1	Confident	9 Å²	9	27.8 Å²	27.8	6%	0.055	16%	0.164	C	C	.	.	H	α-helix	trans	-63.1	-42.1	174.6	169.8	0	0	0	0	111.4	V523 E564 S566 V570 S571 R572 F578	V523-V568 HydrophobicContact CB-CG2 4.46Å; V523-V568 HydrophobicContact CG1-CB 4.44Å; V523-V568 HydrophobicContact CG1-CG2 3.4Å; V523-V568 VanDerWaalsContact CG1-CG2 3.4Å; E564-V568 PolarHBondContact O-N 3.02Å; E564-V568 VanDerWaalsContact O-N 3.14Å; S566-V568 PolarHBondContact O-N 3.4Å; V568-V570 VanDerWaalsContact C-N 3.32Å; V568-V570 PolarHBondContact O-N 3.47Å; V568-S571 PolarHBondContact O-N 3.28Å; V568-R572 HydrophobicContact CG1-CG 4.43Å; V568-R572 WeakPolarHBondContact O-CG 3.11Å; V568-R572 PolarHBondContact O-N 3.41Å; V568-F578 HydrophobicContact CB-CD2 4.41Å; V568-F578 HydrophobicContact CG2-CD2 3.49Å; V568-F578 VanDerWaalsContact CG2-CD2 3.49Å; V568-F578 HydrophobicContact CG2-CE2 3.43Å; V568-F578 VanDerWaalsContact CG2-CE2 3.43Å; V568-F578 HydrophobicContact CG2-CG 4.08Å; V568-F578 HydrophobicContact CG2-CZ 3.97Å
569	S	86.7	Confident	88.3	Confident	29 Å²	29	31.1 Å²	31.1	20%	0.203	18%	0.178	C	C	.	.	H	α-helix	trans	-60	-43.2	176.9	-164.3	0	0	0	0	111.9	S565 S566 L567 S573	S565-S569 PolarHBondContact O-N 2.88Å; S565-S569 VanDerWaalsContact O-N 3.09Å; S566-S569 WeakPolarHBondContact O-CB 3.47Å; S566-S569 PolarHBondContact O-N 3.28Å; L567-S569 VanDerWaalsContact C-N 3.35Å; S569-S573 PolarHBondContact O-N 3.23Å; S569-S573 VanDerWaalsContact O-N 3.13Å
570	V	87.5	Confident	88.4	Confident	25 Å²	25	31.7 Å²	31.7	15%	0.152	18%	0.181	C	C	.	.	H	α-helix	trans	-68	-45.1	177.7	174.2	0	0	0	0	110.7	S566 L567 V568 R572 S573 T574 L581 I760	S566-V570 WeakPolarHBondContact O-CG2 3.42Å; S566-V570 PolarHBondContact O-N 2.99Å; L567-V570 PolarHBondContact O-N 2.94Å; V568-V570 VanDerWaalsContact C-N 3.32Å; V568-V570 PolarHBondContact O-N 3.47Å; V570-R572 VanDerWaalsContact C-N 3.31Å; V570-R572 PolarHBondContact O-N 3.4Å; V570-S573 WeakPolarHBondContact CA-OG 3.21Å; V570-S573 PolarHBondContact O-N 3.5Å; V570-S573 PolarHBondContact O-OG 3.39Å; V570-T574 HydrophobicContact CG1-CG2 4.2Å; V570-T574 PolarHBondContact O-N 2.84Å; V570-T574 PolarHBondContact O-OG1 3.48Å; V570-T574 VanDerWaalsContact O-OG1 3.08Å; V570-L581 HydrophobicContact CB-CD2 4.02Å; V570-L581 HydrophobicContact CG1-CD2 3.78Å; V570-I760 HydrophobicContact CG2-CD1 4.21Å
571	S	88.3	Confident	88.3	Confident	15 Å²	15	31.6 Å²	31.6	11%	0.105	18%	0.181	C	C	.	.	H	α-helix	trans	-55.7	-43.6	175.2	161.7	0	0	0	0	112.1	L567 V568 S573 T574 G575 V576 F578	L567-S571 WeakPolarHBondContact O-CB 3.46Å; L567-S571 PolarHBondContact O-N 3.48Å; V568-S571 PolarHBondContact O-N 3.28Å; S571-S573 VanDerWaalsContact C-N 3.32Å; S571-S573 PolarHBondContact O-N 3.43Å; S571-T574 PolarHBondContact O-N 3.43Å; S571-T574 PolarHBondContact O-OG1 3.32Å; S571-G575 WeakPolarHBondContact O-CA 3.48Å; S571-G575 PolarHBondContact O-N 3.01Å; S571-V576 WeakPolarHBondContact CB-O 3.45Å; S571-V576 PolarHBondContact O-N 3.43Å; S571-V576 PolarHBondContact OG-O 3.07Å; S571-F578 PolarHBondContact OG-N 3.02Å
572	R	87.5	Confident	88.4	Confident	178 Å²	178	32 Å²	32	67%	0.672	18%	0.182	S	C	*	.	H	α-helix	trans	-64.3	-35.3	174.9	-71.4	176.7	-173	158.6	6.7	112.8	V568 V570	V568-R572 HydrophobicContact CG1-CG 4.43Å; V568-R572 WeakPolarHBondContact O-CG 3.11Å; V568-R572 PolarHBondContact O-N 3.41Å; V570-R572 VanDerWaalsContact C-N 3.31Å; V570-R572 PolarHBondContact O-N 3.4Å
573	S	85.2	Confident	88.7	Confident	94 Å²	94	33 Å²	33	66%	0.657	19%	0.187	S	C	*	.	H	α-helix	trans	-75.3	-33.6	178.8	73.1	0	0	0	0	113.6	S569 V570 S571	S569-S573 PolarHBondContact O-N 3.23Å; S569-S573 VanDerWaalsContact O-N 3.13Å; V570-S573 WeakPolarHBondContact CA-OG 3.21Å; V570-S573 PolarHBondContact O-N 3.5Å; V570-S573 PolarHBondContact O-OG 3.39Å; S571-S573 VanDerWaalsContact C-N 3.32Å; S571-S573 PolarHBondContact O-N 3.43Å
574	T	85.2	Confident	88.8	Confident	33 Å²	33	34.9 Å²	34.9	20%	0.202	19%	0.193	C	C	.	.	H	α-helix	trans	-93.1	-17.6	-178.2	58.3	0	0	0	0	113.2	V570 S571 V576	V570-T574 HydrophobicContact CG1-CG2 4.2Å; V570-T574 PolarHBondContact O-N 2.84Å; V570-T574 PolarHBondContact O-OG1 3.48Å; V570-T574 VanDerWaalsContact O-OG1 3.08Å; S571-T574 PolarHBondContact O-N 3.43Å; S571-T574 PolarHBondContact O-OG1 3.32Å; T574-V576 VanDerWaalsContact C-N 3.26Å; T574-V576 PolarHBondContact O-N 3.02Å
575	G	85.7	Confident	88.9	Confident	62 Å²	62	34.8 Å²	34.8	64%	0.639	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.6	12.3	-175.7	0	0	0	0	0	114.2	S571	S571-G575 WeakPolarHBondContact O-CA 3.48Å; S571-G575 PolarHBondContact O-N 3.01Å
576	V	86.6	Confident	89.3	Confident	6 Å²	6	33.7 Å²	33.7	4%	0.036	19%	0.185	C	C	.	.			trans	-87.1	145.3	178.2	179.3	0	0	0	0	109.7	S571 T574 F578 Q580 Y745 A748 I753	S571-V576 WeakPolarHBondContact CB-O 3.45Å; S571-V576 PolarHBondContact O-N 3.43Å; S571-V576 PolarHBondContact OG-O 3.07Å; T574-V576 VanDerWaalsContact C-N 3.26Å; T574-V576 PolarHBondContact O-N 3.02Å; V576-F578 PolarHBondContact O-N 3.42Å; V576-Q580 HydrophobicContact CG1-CB 4.35Å; V576-Y745 HydrophobicContact CG1-CD1 4.39Å; V576-A748 HydrophobicContact CG2-CB 4.14Å; V576-I753 HydrophobicContact CG2-CD1 3.48Å; V576-I753 VanDerWaalsContact CG2-CD1 3.48Å; V576-I753 HydrophobicContact CG2-CG1 3.94Å
577	D	89.1	Confident	89.6	Confident	75 Å²	75	38 Å²	38	40%	0.401	20%	0.204	S	C	.	.			trans	-58.3	131.5	175.4	-177.1	24.2	0	0	0	111.1	K579 Q580 L581	D577-K579 PolarHBondContact O-N 2.98Å; D577-Q580 HydrophobicContact CB-CG 4.07Å; D577-Q580 PolarHBondContact O-N 3.32Å; D577-Q580 VanDerWaalsContact O-N 3.14Å; D577-L581 PolarHBondContact O-N 3.09Å
578	F	89.6	Confident	89.9	Confident	12 Å²	12	39.7 Å²	39.7	5%	0.053	21%	0.211	C	C	.	.	H	α-helix	trans	-55.8	-40.9	-176.9	165.2	-112.3	0	0	0	111.5	V523 D524 Y527 L567 V568 S571 V576 Q580 L581 R582	V523-F578 HydrophobicContact CG1-CZ 4.34Å; D524-F578 HydrophobicContact CB-CD1 4.47Å; D524-F578 HydrophobicContact CB-CE1 4.4Å; Y527-F578 AromaticContact CE2-CE1 3.75Å; Y527-F578 HydrophobicContact CE2-CE1 3.75Å; Y527-F578 AromaticContact CE2-CZ 3.87Å; Y527-F578 HydrophobicContact CE2-CZ 3.87Å; Y527-F578 WeakPolarHBondContact OH-CZ 3.4Å; L567-F578 HydrophobicContact CB-CD2 4.3Å; L567-F578 HydrophobicContact CB-CE2 3.78Å; V568-F578 HydrophobicContact CB-CD2 4.41Å; V568-F578 HydrophobicContact CG2-CD2 3.49Å; V568-F578 VanDerWaalsContact CG2-CD2 3.49Å; V568-F578 HydrophobicContact CG2-CE2 3.43Å; V568-F578 VanDerWaalsContact CG2-CE2 3.43Å; V568-F578 HydrophobicContact CG2-CG 4.08Å; V568-F578 HydrophobicContact CG2-CZ 3.97Å; S571-F578 PolarHBondContact OG-N 3.02Å; V576-F578 PolarHBondContact O-N 3.42Å; F578-Q580 VanDerWaalsContact C-N 3.34Å; F578-Q580 PolarHBondContact O-N 2.95Å; F578-L581 PolarHBondContact O-N 3.25Å; F578-R582 WeakPolarHBondContact O-CB 3.05Å; F578-R582 PolarHBondContact O-N 2.97Å
579	K	89.8	Confident	90.1	Very high	72 Å²	72	39.2 Å²	39.2	31%	0.313	21%	0.208	S	C	.	.	H	α-helix	trans	-63.2	-38.9	-179	-61.6	178.8	-177.6	177.4	0	112.3	D577 F583 P737	D577-K579 PolarHBondContact O-N 2.98Å; K579-F583 WeakPolarHBondContact O-CB 3.4Å; K579-F583 PolarHBondContact O-N 3.23Å; K579-P737 HydrophobicContact CB-CB 4.28Å
580	Q	90	Very high	90.5	Very high	12 Å²	12	38.1 Å²	38.1	6%	0.056	20%	0.2	C	C	.	.	H	α-helix	trans	-68.7	-49	178.9	-63.2	176.2	-7.6	0	0	111.4	V576 D577 F578 R582 F583 W584 R741	V576-Q580 HydrophobicContact CG1-CB 4.35Å; D577-Q580 HydrophobicContact CB-CG 4.07Å; D577-Q580 PolarHBondContact O-N 3.32Å; D577-Q580 VanDerWaalsContact O-N 3.14Å; F578-Q580 VanDerWaalsContact C-N 3.34Å; F578-Q580 PolarHBondContact O-N 2.95Å; Q580-R582 PolarHBondContact O-N 3.02Å; Q580-F583 PolarHBondContact O-N 2.97Å; Q580-W584 VanDerWaalsContact O-CD1 3.26Å; Q580-W584 PolarHBondContact O-N 3.48Å; Q580-W584 VanDerWaalsContact O-N 3.13Å; Q580-R741 PolarHBondContact NE2-O 3.01Å
581	L	89.9	Confident	90.9	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-59.8	-39.1	178.3	-180	67.5	0	0	0	111.3	L567 V570 D577 F578 S585 I753 S757	L567-L581 HydrophobicContact CD2-CD2 4.08Å; L567-L581 HydrophobicContact CD2-CG 3.98Å; V570-L581 HydrophobicContact CB-CD2 4.02Å; V570-L581 HydrophobicContact CG1-CD2 3.78Å; D577-L581 PolarHBondContact O-N 3.09Å; F578-L581 PolarHBondContact O-N 3.25Å; L581-S585 WeakPolarHBondContact O-CB 3.44Å; L581-S585 PolarHBondContact O-N 3.17Å; L581-S585 PolarHBondContact O-OG 2.81Å; L581-I753 HydrophobicContact CD1-CG2 4.35Å; L581-S757 WeakPolarHBondContact CD1-OG 3.44Å
582	R	92.7	Very high	91.2	Very high	12 Å²	12	41.9 Å²	41.9	5%	0.045	22%	0.215	C	C	.	.	H	α-helix	trans	-66.4	-43.8	177.3	-176.4	172.6	-172.2	-124.6	-15.3	112.9	Y527 E564 L567 F578 Q580 S585 A586 S805 G809 W810 F812	Y527-R582 PolarHBondContact OH-NE 2.97Å; Y527-R582 PolarHBondContact OH-NH1 3.45Å; Y527-R582 PolarHBondContact OH-NH2 3.22Å; E564-R582 IonicContact OE1-CZ 3.31Å; E564-R582 VanDerWaalsContact OE1-CZ 3.31Å; E564-R582 IonicContact OE1-NE 3.19Å; E564-R582 PolarHBondContact OE1-NE 2.88Å; E564-R582 IonicContact OE1-NH2 2.73Å; E564-R582 PolarHBondContact OE1-NH2 3.35Å; E564-R582 IonicContact OE2-CZ 3.87Å; E564-R582 IonicContact OE2-NE 3.08Å; E564-R582 PolarHBondContact OE2-NE 2.85Å; E564-R582 VanDerWaalsContact OE2-NE 3.08Å; L567-R582 HydrophobicContact CD1-CG 4.35Å; F578-R582 WeakPolarHBondContact O-CB 3.05Å; F578-R582 PolarHBondContact O-N 2.97Å; Q580-R582 PolarHBondContact O-N 3.02Å; R582-S585 PolarHBondContact O-N 3.46Å; R582-A586 WeakPolarHBondContact O-CB 3.26Å; R582-A586 PolarHBondContact O-N 3.43Å; R582-S805 PolarHBondContact NH2-OG 3.38Å; R582-G809 PolarHBondContact NH1-O 3.25Å; R582-W810 VanDerWaalsContact NH2-C 3.25Å; R582-W810 PolarHBondContact NH2-O 2.89Å; R582-F812 HydrophobicContact CG-CE2 4.2Å; R582-F812 HydrophobicContact CG-CZ 4.11Å
583	F	93.5	Very high	91.4	Very high	32 Å²	32	33.4 Å²	33.4	14%	0.14	18%	0.183	C	C	.	.	H	α-helix	trans	-56.9	-50.3	175.2	173.8	-95.5	0	0	0	111.3	K579 Q580 S585 A586 F587 P737 F739 L742 I807	K579-F583 WeakPolarHBondContact O-CB 3.4Å; K579-F583 PolarHBondContact O-N 3.23Å; Q580-F583 PolarHBondContact O-N 2.97Å; F583-S585 PolarHBondContact O-N 3.28Å; F583-A586 PolarHBondContact O-N 3.49Å; F583-F587 WeakPolarHBondContact O-CB 3.43Å; F583-F587 PolarHBondContact O-N 3.39Å; F583-P737 HydrophobicContact CB-CB 4.46Å; F583-P737 HydrophobicContact CB-CG 4.17Å; F583-P737 HydrophobicContact CD2-CG 3.93Å; F583-P737 HydrophobicContact CG-CG 4.2Å; F583-F739 HydrophobicContact CE2-CE1 4.26Å; F583-L742 HydrophobicContact CB-CD2 4.47Å; F583-L742 HydrophobicContact CD1-CD1 4.4Å; F583-L742 HydrophobicContact CD1-CD2 3.78Å; F583-L742 HydrophobicContact CE1-CD1 4.04Å; F583-L742 HydrophobicContact CE1-CD2 4.25Å; F583-L742 HydrophobicContact CG-CD2 4.14Å; F583-L742 HydrophobicContact CZ-CD1 4.36Å; F583-I807 HydrophobicContact CE2-CG1 4.46Å
584	W	92.9	Very high	91.8	Very high	38 Å²	38	34.2 Å²	34.2	14%	0.144	18%	0.175	C	C	.	.	H	α-helix	trans	-63.8	-41.8	178.7	-73.3	117.2	0	0	0	112.5	Q580 A586 F587 Y588 L742 Y745 H754	Q580-W584 VanDerWaalsContact O-CD1 3.26Å; Q580-W584 PolarHBondContact O-N 3.48Å; Q580-W584 VanDerWaalsContact O-N 3.13Å; W584-A586 VanDerWaalsContact C-N 3.34Å; W584-A586 PolarHBondContact O-N 3.34Å; W584-F587 HydrophobicContact CE3-CD1 4.27Å; W584-F587 HydrophobicContact CZ3-CD1 4.22Å; W584-F587 PolarHBondContact O-N 3.49Å; W584-Y588 HydrophobicContact CB-CD2 4.47Å; W584-Y588 HydrophobicContact CB-CE2 4.23Å; W584-Y588 HydrophobicContact CE3-CE2 4.3Å; W584-Y588 WeakPolarHBondContact O-CD2 3.3Å; W584-Y588 PolarHBondContact O-N 3.35Å; W584-L742 PolarHBondContact NE1-O 2.93Å; W584-Y745 AromaticContact NE1-CE1 4Å; W584-Y745 AromaticContact NE1-CZ 3.95Å; W584-Y745 PolarHBondContact NE1-OH 3.07Å; W584-H754 AromaticContact CD2-CE1 3.62Å; W584-H754 AromaticContact CD2-ND1 3.99Å; W584-H754 AromaticContact CE2-CE1 3.56Å; W584-H754 AromaticContact CE3-CE1 3.74Å; W584-H754 AromaticContact CE3-ND1 3.99Å; W584-H754 AromaticContact CH2-CE1 3.8Å; W584-H754 AromaticContact CZ2-CE1 3.66Å; W584-H754 AromaticContact CZ3-CE1 3.84Å
585	S	92.9	Very high	92.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.1	-40.2	176.7	-58.9	0	0	0	0	112.3	L567 L581 R582 F583 C589	L567-S585 WeakPolarHBondContact CD2-OG 3.25Å; L581-S585 WeakPolarHBondContact O-CB 3.44Å; L581-S585 PolarHBondContact O-N 3.17Å; L581-S585 PolarHBondContact O-OG 2.81Å; R582-S585 PolarHBondContact O-N 3.46Å; F583-S585 PolarHBondContact O-N 3.28Å; S585-C589 WeakPolarHBondContact O-CB 3.36Å; S585-C589 PolarHBondContact O-N 3.28Å
586	A	94.7	Very high	92.4	Very high	1 Å²	1	35 Å²	35	1%	0.008	16%	0.161	C	C	.	.	H	α-helix	trans	-66.5	-40.5	175.4	0	0	0	0	0	112.5	R582 F583 W584 C589 S590 P802 F812	R582-A586 WeakPolarHBondContact O-CB 3.26Å; R582-A586 PolarHBondContact O-N 3.43Å; F583-A586 PolarHBondContact O-N 3.49Å; W584-A586 VanDerWaalsContact C-N 3.34Å; W584-A586 PolarHBondContact O-N 3.34Å; A586-C589 WeakPolarHBondContact O-CB 3.4Å; A586-C589 PolarHBondContact O-N 2.88Å; A586-S590 PolarHBondContact O-N 3.48Å; A586-S590 VanDerWaalsContact O-N 3.07Å; A586-S590 PolarHBondContact O-OG 3.29Å; A586-P802 HydrophobicContact CB-CB 4.46Å; A586-P802 WeakPolarHBondContact CB-O 3.3Å; A586-F812 HydrophobicContact CB-CE1 3.67Å; A586-F812 HydrophobicContact CB-CZ 3.84Å
587	F	94.4	Very high	92.5	Very high	91 Å²	91	34.9 Å²	34.9	40%	0.399	16%	0.16	S	C	.	.	H	α-helix	trans	-63.7	-47.3	176.8	-174.1	-105.8	0	0	0	111.4	F583 W584 C589 S590 I591	F583-F587 WeakPolarHBondContact O-CB 3.43Å; F583-F587 PolarHBondContact O-N 3.39Å; W584-F587 HydrophobicContact CE3-CD1 4.27Å; W584-F587 HydrophobicContact CZ3-CD1 4.22Å; W584-F587 PolarHBondContact O-N 3.49Å; F587-C589 PolarHBondContact O-N 3.46Å; F587-S590 WeakPolarHBondContact O-CB 3.39Å; F587-S590 PolarHBondContact O-N 3.45Å; F587-S590 VanDerWaalsContact O-N 3.11Å; F587-I591 HydrophobicContact CD1-CD1 3.77Å; F587-I591 HydrophobicContact CE1-CD1 3.47Å; F587-I591 VanDerWaalsContact CE1-CD1 3.47Å; F587-I591 HydrophobicContact CE1-CG1 4.37Å; F587-I591 HydrophobicContact CZ-CD1 4.14Å; F587-I591 PolarHBondContact O-N 3.37Å
588	Y	95.2	Very high	92.5	Very high	36 Å²	36	31.8 Å²	31.8	14%	0.141	15%	0.146	C	C	.	.	H	α-helix	trans	-64.3	-40.1	175.7	-70.1	-57.2	0	0	0	112.6	W584 S590 I591 F592 H754 I758	W584-Y588 HydrophobicContact CB-CD2 4.47Å; W584-Y588 HydrophobicContact CB-CE2 4.23Å; W584-Y588 HydrophobicContact CE3-CE2 4.3Å; W584-Y588 WeakPolarHBondContact O-CD2 3.3Å; W584-Y588 PolarHBondContact O-N 3.35Å; Y588-S590 PolarHBondContact O-N 3.46Å; Y588-I591 HydrophobicContact CD1-CD1 4.01Å; Y588-I591 HydrophobicContact CE1-CD1 4.42Å; Y588-I591 PolarHBondContact O-N 3.47Å; Y588-I591 VanDerWaalsContact O-N 3.16Å; Y588-F592 WeakPolarHBondContact O-CD2 2.83Å; Y588-F592 PolarHBondContact O-N 2.95Å; Y588-H754 AromaticContact CE2-ND1 3.89Å; Y588-H754 AromaticContact CZ-ND1 3.77Å; Y588-H754 PolarHBondContact OH-ND1 2.83Å; Y588-I758 HydrophobicContact CD1-CD1 4.45Å; Y588-I758 HydrophobicContact CD1-CG1 3.62Å; Y588-I758 HydrophobicContact CD2-CG1 3.74Å; Y588-I758 HydrophobicContact CE1-CD1 4.01Å; Y588-I758 HydrophobicContact CE1-CG1 3.6Å; Y588-I758 HydrophobicContact CE2-CD1 4.49Å; Y588-I758 HydrophobicContact CE2-CG1 3.73Å; Y588-I758 HydrophobicContact CG-CG1 3.7Å
589	C	94.8	Very high	92.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-54.2	-41.2	171.8	178.3	0	0	0	0	111.7	S585 A586 F587 F592 G593 L764 P802	S585-C589 WeakPolarHBondContact O-CB 3.36Å; S585-C589 PolarHBondContact O-N 3.28Å; A586-C589 WeakPolarHBondContact O-CB 3.4Å; A586-C589 PolarHBondContact O-N 2.88Å; F587-C589 PolarHBondContact O-N 3.46Å; C589-F592 PolarHBondContact O-N 2.87Å; C589-G593 PolarHBondContact O-N 2.98Å; C589-L764 HydrophobicContact CB-CB 4.39Å; C589-L764 HydrophobicContact CB-CD2 3.97Å; C589-L764 HydrophobicContact CB-CG 4.24Å; C589-P802 HydrophobicContact CB-CB 4.49Å
590	S	95.4	Very high	92.2	Very high	5 Å²	5	30.4 Å²	30.4	4%	0.035	15%	0.146	C	C	.	.	H	α-helix	trans	-69.6	-36.5	179.6	-51.8	0	0	0	0	112.7	A586 F587 Y588 G593 F594 Q798 I799 I803	A586-S590 PolarHBondContact O-N 3.48Å; A586-S590 VanDerWaalsContact O-N 3.07Å; A586-S590 PolarHBondContact O-OG 3.29Å; F587-S590 WeakPolarHBondContact O-CB 3.39Å; F587-S590 PolarHBondContact O-N 3.45Å; F587-S590 VanDerWaalsContact O-N 3.11Å; Y588-S590 PolarHBondContact O-N 3.46Å; S590-G593 PolarHBondContact O-N 2.84Å; S590-F594 PolarHBondContact O-N 2.8Å; S590-Q798 WeakPolarHBondContact CA-O 3.35Å; S590-I799 PolarHBondContact OG-O 3.21Å; S590-I803 WeakPolarHBondContact OG-CG1 3.49Å
591	I	95.5	Very high	91.9	Very high	67 Å²	67	31.4 Å²	31.4	34%	0.344	15%	0.151	S	C	.	.	H	α-helix	trans	-62.4	-49	172.4	-69.4	167.1	0	0	0	110.4	F587 Y588 G593 F594 I595	F587-I591 HydrophobicContact CD1-CD1 3.77Å; F587-I591 HydrophobicContact CE1-CD1 3.47Å; F587-I591 VanDerWaalsContact CE1-CD1 3.47Å; F587-I591 HydrophobicContact CE1-CG1 4.37Å; F587-I591 HydrophobicContact CZ-CD1 4.14Å; F587-I591 PolarHBondContact O-N 3.37Å; Y588-I591 HydrophobicContact CD1-CD1 4.01Å; Y588-I591 HydrophobicContact CE1-CD1 4.42Å; Y588-I591 PolarHBondContact O-N 3.47Å; Y588-I591 VanDerWaalsContact O-N 3.16Å; I591-G593 PolarHBondContact O-N 3.36Å; I591-F594 WeakPolarHBondContact O-CB 3.45Å; I591-F594 PolarHBondContact O-N 3.31Å; I591-F594 VanDerWaalsContact O-N 3.16Å; I591-I595 HydrophobicContact CG2-CD1 4.16Å; I591-I595 WeakPolarHBondContact O-CG1 3.03Å; I591-I595 PolarHBondContact O-N 3.26Å
592	F	93.7	Very high	91.4	Very high	53 Å²	53	32 Å²	32	23%	0.232	16%	0.155	C	C	.	.	H	α-helix	trans	-63.1	-33	175.7	-77.4	-72.4	0	0	0	112	Y588 C589 I595 F596 I758 V762 A765	Y588-F592 WeakPolarHBondContact O-CD2 2.83Å; Y588-F592 PolarHBondContact O-N 2.95Å; C589-F592 PolarHBondContact O-N 2.87Å; F592-I595 HydrophobicContact CD1-CD1 4.13Å; F592-I595 HydrophobicContact CE1-CD1 4.38Å; F592-I595 WeakPolarHBondContact O-CB 3.38Å; F592-I595 PolarHBondContact O-N 2.98Å; F592-F596 VanDerWaalsContact O-CD1 3.31Å; F592-F596 WeakPolarHBondContact O-CD1 3.47Å; F592-F596 WeakPolarHBondContact O-CG 3.28Å; F592-F596 PolarHBondContact O-N 2.94Å; F592-I758 HydrophobicContact CE2-CG2 4.2Å; F592-I758 HydrophobicContact CZ-CG2 4.39Å; F592-V762 HydrophobicContact CD1-CG2 4.16Å; F592-V762 HydrophobicContact CD2-CG2 3.6Å; F592-V762 HydrophobicContact CE1-CG2 3.75Å; F592-V762 HydrophobicContact CE2-CB 4.43Å; F592-V762 HydrophobicContact CE2-CG2 3.16Å; F592-V762 HydrophobicContact CG-CG2 4.11Å; F592-V762 HydrophobicContact CZ-CG2 3.24Å; F592-A765 HydrophobicContact CB-CB 3.8Å
593	G	92.4	Very high	90.6	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-62.5	-43	171.8	0	0	0	0	0	113.4	C589 S590 I591 I595 F596 V597 Q798	C589-G593 PolarHBondContact O-N 2.98Å; S590-G593 PolarHBondContact O-N 2.84Å; I591-G593 PolarHBondContact O-N 3.36Å; G593-I595 VanDerWaalsContact C-N 3.31Å; G593-I595 PolarHBondContact O-N 2.71Å; G593-F596 PolarHBondContact O-N 3.47Å; G593-V597 WeakPolarHBondContact O-CG2 3.19Å; G593-V597 PolarHBondContact O-N 2.97Å; G593-Q798 VanDerWaalsContact CA-OE1 3.24Å
594	F	92.9	Very high	89.9	Confident	110 Å²	110	34.8 Å²	34.8	48%	0.482	18%	0.175	S	C	.	.	H	α-helix	trans	-60.4	-41	171.7	-103.6	-78.1	0	0	0	112.2	F467 S590 I591 G598 I799	F467-F594 HydrophobicContact CE1-CD1 4.13Å; F467-F594 HydrophobicContact CE1-CE1 4.48Å; F467-F594 HydrophobicContact CZ-CD1 4.1Å; S590-F594 PolarHBondContact O-N 2.8Å; I591-F594 WeakPolarHBondContact O-CB 3.45Å; I591-F594 PolarHBondContact O-N 3.31Å; I591-F594 VanDerWaalsContact O-N 3.16Å; F594-G598 PolarHBondContact O-N 3.44Å; F594-I799 HydrophobicContact CD1-CD1 4.36Å; F594-I799 HydrophobicContact CD2-CD1 3.81Å; F594-I799 HydrophobicContact CD2-CG1 4.1Å; F594-I799 HydrophobicContact CD2-CG2 3.75Å; F594-I799 HydrophobicContact CE2-CD1 4.03Å; F594-I799 HydrophobicContact CE2-CG1 4.45Å; F594-I799 HydrophobicContact CE2-CG2 3.4Å; F594-I799 VanDerWaalsContact CE2-CG2 3.4Å; F594-I799 HydrophobicContact CG-CD1 4Å; F594-I799 HydrophobicContact CZ-CD1 4.39Å; F594-I799 HydrophobicContact CZ-CG2 4.3Å
595	I	92.5	Very high	89.1	Confident	80 Å²	80	33.3 Å²	33.3	41%	0.41	17%	0.171	S	C	.	.	H	α-helix	trans	-63.9	-45	175.5	-64.9	167.9	0	0	0	110.4	I591 F592 G593 V597 G598 C599	I591-I595 HydrophobicContact CG2-CD1 4.16Å; I591-I595 WeakPolarHBondContact O-CG1 3.03Å; I591-I595 PolarHBondContact O-N 3.26Å; F592-I595 HydrophobicContact CD1-CD1 4.13Å; F592-I595 HydrophobicContact CE1-CD1 4.38Å; F592-I595 WeakPolarHBondContact O-CB 3.38Å; F592-I595 PolarHBondContact O-N 2.98Å; G593-I595 VanDerWaalsContact C-N 3.31Å; G593-I595 PolarHBondContact O-N 2.71Å; I595-V597 PolarHBondContact O-N 2.65Å; I595-G598 PolarHBondContact O-N 3.43Å; I595-C599 VanDerWaalsContact O-CB 3.28Å; I595-C599 WeakPolarHBondContact O-CB 2.86Å; I595-C599 PolarHBondContact O-N 3.45Å; I595-C599 PolarHBondContact O-SG 3.3Å; I595-C599 VanDerWaalsContact O-SG 3.32Å
596	F	90.8	Very high	88.1	Confident	32 Å²	32	38.6 Å²	38.6	14%	0.14	19%	0.194	C	C	.	.	H	α-helix	trans	-64	-41.9	-179.3	-74	6.1	0	0	0	112.5	F592 G593 N600 I601 A765 I766 F769	F592-F596 VanDerWaalsContact O-CD1 3.31Å; F592-F596 WeakPolarHBondContact O-CD1 3.47Å; F592-F596 WeakPolarHBondContact O-CG 3.28Å; F592-F596 PolarHBondContact O-N 2.94Å; G593-F596 PolarHBondContact O-N 3.47Å; F596-N600 PolarHBondContact O-N 2.94Å; F596-I601 HydrophobicContact CB-CB 4.4Å; F596-I601 HydrophobicContact CB-CD1 4.12Å; F596-I601 HydrophobicContact CD1-CD1 3.55Å; F596-I601 HydrophobicContact CE1-CD1 4.13Å; F596-I601 HydrophobicContact CG-CD1 3.9Å; F596-I601 WeakPolarHBondContact O-CB 3.49Å; F596-I601 PolarHBondContact O-N 3.21Å; F596-A765 HydrophobicContact CE2-CB 4.22Å; F596-I766 HydrophobicContact CZ-CG1 4.24Å; F596-F769 HydrophobicContact CD2-CD2 4.35Å; F596-F769 HydrophobicContact CE2-CB 4.36Å
597	V	89.7	Confident	87.2	Confident	3 Å²	3	43.5 Å²	43.5	2%	0.018	22%	0.217	C	C	.	.	H	α-helix	trans	-68.1	-41.4	174.5	177.8	0	0	0	0	110.7	F467 L470 G593 I595 N600 V791 L794 V795 I799	F467-V597 HydrophobicContact CD1-CG1 3.83Å; F467-V597 HydrophobicContact CE1-CB 4.43Å; F467-V597 HydrophobicContact CE1-CG1 4.06Å; L470-V597 HydrophobicContact CB-CG1 4.28Å; L470-V597 HydrophobicContact CD2-CG1 4.21Å; G593-V597 WeakPolarHBondContact O-CG2 3.19Å; G593-V597 PolarHBondContact O-N 2.97Å; I595-V597 PolarHBondContact O-N 2.65Å; V597-N600 PolarHBondContact O-N 3.16Å; V597-V791 HydrophobicContact CG1-CG2 4.27Å; V597-L794 HydrophobicContact CG2-CD2 3.73Å; V597-L794 HydrophobicContact CG2-CG 3.99Å; V597-V795 HydrophobicContact CG1-CG2 4.23Å; V597-V795 HydrophobicContact CG2-CG2 4.08Å; V597-I799 HydrophobicContact CG2-CD1 4.17Å
598	G	88.6	Confident	86.3	Confident	10 Å²	10	40.5 Å²	40.5	10%	0.103	20%	0.204	C	C	.	.	H	α-helix	trans	-63.1	-40.6	177.1	0	0	0	0	0	112.9	P466 F467 F594 I595 N600	P466-G598 WeakPolarHBondContact CA-O 3.29Å; P466-G598 WeakPolarHBondContact CB-O 3.35Å; F467-G598 PolarHBondContact N-O 3.21Å; F594-G598 PolarHBondContact O-N 3.44Å; I595-G598 PolarHBondContact O-N 3.43Å; G598-N600 PolarHBondContact O-N 2.59Å
599	C	88	Confident	85.7	Confident	43 Å²	43	39.9 Å²	39.9	29%	0.291	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	6.4	176.6	-68	0	0	0	0	114	F463 I595 I601	F463-C599 HydrophobicContact CE1-CB 3.96Å; F463-C599 WeakPolarHBondContact CE1-O 3.45Å; I595-C599 VanDerWaalsContact O-CB 3.28Å; I595-C599 WeakPolarHBondContact O-CB 2.86Å; I595-C599 PolarHBondContact O-N 3.45Å; I595-C599 PolarHBondContact O-SG 3.3Å; I595-C599 VanDerWaalsContact O-SG 3.32Å; C599-I601 HydrophobicContact CB-CD1 4.18Å; C599-I601 HydrophobicContact CB-CG1 3.87Å; C599-I601 PolarHBondContact O-N 3.5Å
600	N	85.2	Confident	85	Confident	12 Å²	12	44 Å²	44	6%	0.064	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	53	37.1	-179.9	-55	-51.3	0	0	0	113.5	D462 F463 P465 I468 E469 F596 V597 G598 S602 G603	D462-N600 PolarHBondContact O-ND2 3.38Å; F463-N600 PolarHBondContact O-ND2 3.18Å; P465-N600 PolarHBondContact O-ND2 3.39Å; I468-N600 WeakPolarHBondContact CG2-ND2 3.43Å; I468-N600 PolarHBondContact N-OD1 3.1Å; E469-N600 HydrophobicContact CG-CB 3.93Å; E469-N600 PolarHBondContact N-OD1 2.99Å; F596-N600 PolarHBondContact O-N 2.94Å; V597-N600 PolarHBondContact O-N 3.16Å; G598-N600 PolarHBondContact O-N 2.59Å; N600-S602 PolarHBondContact O-N 3.44Å; N600-S602 VanDerWaalsContact O-N 3.14Å; N600-G603 PolarHBondContact O-N 3.33Å
601	I	83.5	Confident	84.5	Confident	34 Å²	34	43.8 Å²	43.8	17%	0.174	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-66.9	-14.5	179.3	-63	-175.6	0	0	0	111.3	F596 C599 G603 I604 F769	F596-I601 HydrophobicContact CB-CB 4.4Å; F596-I601 HydrophobicContact CB-CD1 4.12Å; F596-I601 HydrophobicContact CD1-CD1 3.55Å; F596-I601 HydrophobicContact CE1-CD1 4.13Å; F596-I601 HydrophobicContact CG-CD1 3.9Å; F596-I601 WeakPolarHBondContact O-CB 3.49Å; F596-I601 PolarHBondContact O-N 3.21Å; C599-I601 HydrophobicContact CB-CD1 4.18Å; C599-I601 HydrophobicContact CB-CG1 3.87Å; C599-I601 PolarHBondContact O-N 3.5Å; I601-G603 PolarHBondContact O-N 3.35Å; I601-G603 VanDerWaalsContact O-N 3.14Å; I601-I604 HydrophobicContact CG2-CD1 3.81Å; I601-I604 HydrophobicContact CG2-CG1 4.2Å; I601-I604 VanDerWaalsContact O-CB 3.3Å; I601-I604 WeakPolarHBondContact O-CB 3.5Å; I601-I604 WeakPolarHBondContact O-CG1 3.26Å; I601-I604 PolarHBondContact O-N 3.39Å; I601-F769 HydrophobicContact CG2-CE1 4.35Å; I601-F769 HydrophobicContact CG2-CE2 3.75Å; I601-F769 HydrophobicContact CG2-CZ 3.66Å
602	S	80.8	Confident	84.1	Confident	13 Å²	13	41 Å²	41	9%	0.091	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-58.5	-28.1	178.2	105.3	0	0	0	0	112.4	E469 N600 I604 A605	E469-S602 VanDerWaalsContact OE2-CB 3.26Å; E469-S602 WeakPolarHBondContact OE2-CB 3.35Å; E469-S602 PolarHBondContact OE2-OG 3.38Å; N600-S602 PolarHBondContact O-N 3.44Å; N600-S602 VanDerWaalsContact O-N 3.14Å; S602-I604 VanDerWaalsContact C-N 3.26Å; S602-I604 PolarHBondContact O-N 2.98Å; S602-A605 VanDerWaalsContact O-CB 3.29Å; S602-A605 WeakPolarHBondContact O-CB 3.47Å; S602-A605 PolarHBondContact O-N 3.3Å; S602-A605 VanDerWaalsContact O-N 3.15Å
603	G	74.4	Confident	83.7	Confident	15 Å²	15	38.5 Å²	38.5	16%	0.155	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-60.4	-26.4	170.8	0	0	0	0	0	115.1	E469 N600 I601 A605 K606 H607	E469-G603 PolarHBondContact OE1-N 3.14Å; E469-G603 PolarHBondContact OE2-N 2.94Å; E469-G603 VanDerWaalsContact OE2-N 3.1Å; N600-G603 PolarHBondContact O-N 3.33Å; I601-G603 PolarHBondContact O-N 3.35Å; I601-G603 VanDerWaalsContact O-N 3.14Å; G603-A605 PolarHBondContact O-N 2.86Å; G603-K606 WeakPolarHBondContact O-CB 3.45Å; G603-K606 PolarHBondContact O-N 2.96Å; G603-H607 PolarHBondContact O-ND1 2.87Å
604	I	79.4	Confident	83.5	Confident	87 Å²	87	38.7 Å²	38.7	45%	0.446	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-63.6	-30.6	176	-59.9	-171	0	0	0	110.9	I601 S602 K606 H607 F769	I601-I604 HydrophobicContact CG2-CD1 3.81Å; I601-I604 HydrophobicContact CG2-CG1 4.2Å; I601-I604 VanDerWaalsContact O-CB 3.3Å; I601-I604 WeakPolarHBondContact O-CB 3.5Å; I601-I604 WeakPolarHBondContact O-CG1 3.26Å; I601-I604 PolarHBondContact O-N 3.39Å; S602-I604 VanDerWaalsContact C-N 3.26Å; S602-I604 PolarHBondContact O-N 2.98Å; I604-K606 PolarHBondContact O-N 3.43Å; I604-K606 VanDerWaalsContact O-N 3.08Å; I604-H607 WeakPolarHBondContact O-CB 3.48Å; I604-H607 PolarHBondContact O-N 3.41Å; I604-F769 HydrophobicContact CB-CZ 4.35Å
605	A	76.4	Confident	83.4	Confident	7 Å²	7	33.4 Å²	33.4	6%	0.058	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-58.2	-27.7	178.3	0	0	0	0	0	112.7	S602 G603 H607 I608 A773 F790	S602-A605 VanDerWaalsContact O-CB 3.29Å; S602-A605 WeakPolarHBondContact O-CB 3.47Å; S602-A605 PolarHBondContact O-N 3.3Å; S602-A605 VanDerWaalsContact O-N 3.15Å; G603-A605 PolarHBondContact O-N 2.86Å; A605-H607 PolarHBondContact O-N 3.47Å; A605-I608 PolarHBondContact O-N 2.83Å; A605-A773 HydrophobicContact CB-CB 4.07Å; A605-F790 HydrophobicContact CB-CD1 3.54Å; A605-F790 HydrophobicContact CB-CE1 3.61Å; A605-F790 HydrophobicContact CB-CG 4.06Å; A605-F790 HydrophobicContact CB-CZ 4.19Å
606	K	71	Confident	83.3	Confident	111 Å²	111	29.8 Å²	29.8	48%	0.483	15%	0.15	S	C	.	.	G	3₁₀ helix	trans	-66.8	-20.3	175.4	-60.5	175.7	-176.9	168.7	0	113.5	G603 I604 L989	G603-K606 WeakPolarHBondContact O-CB 3.45Å; G603-K606 PolarHBondContact O-N 2.96Å; I604-K606 PolarHBondContact O-N 3.43Å; I604-K606 VanDerWaalsContact O-N 3.08Å; K606-L989 HydrophobicContact CB-CD1 4.41Å; K606-L989 HydrophobicContact CG-CD2 4.42Å
607	H	75.4	Confident	83.1	Confident	105 Å²	105	28.6 Å²	28.6	49%	0.486	15%	0.145	S	C	.	.	G	3₁₀ helix	trans	-93.2	-5.3	179.9	-60.7	83.5	0	0	0	112.6	G603 I604 A605 R609	G603-H607 PolarHBondContact O-ND1 2.87Å; I604-H607 WeakPolarHBondContact O-CB 3.48Å; I604-H607 PolarHBondContact O-N 3.41Å; A605-H607 PolarHBondContact O-N 3.47Å; H607-R609 VanDerWaalsContact O-CG 3.29Å; H607-R609 WeakPolarHBondContact O-CG 3.4Å
608	I	77.5	Confident	83.2	Confident	27 Å²	27	28.5 Å²	28.5	14%	0.138	14%	0.144	C	C	.	.			trans	-75.9	137	176	-59.5	178.3	0	0	0	109.5	A605 V612 A773 L774 L777	A605-I608 PolarHBondContact O-N 2.83Å; I608-V612 HydrophobicContact CG2-CB 4.23Å; I608-V612 HydrophobicContact CG2-CG1 4.36Å; I608-A773 HydrophobicContact CD1-CB 3.4Å; I608-A773 VanDerWaalsContact CD1-CB 3.4Å; I608-L774 HydrophobicContact CG2-CD2 3.71Å; I608-L777 HydrophobicContact CG2-CD2 4.05Å
609	R	81.3	Confident	83.3	Confident	23 Å²	23	28 Å²	28	9%	0.087	14%	0.14	C	C	.	.			trans	-121.7	163.2	-165.9	-60.1	-88.8	-161.8	136.8	9.5	110	H607 S611 V612 E613 R966 E967 K986	H607-R609 VanDerWaalsContact O-CG 3.29Å; H607-R609 WeakPolarHBondContact O-CG 3.4Å; R609-S611 PolarHBondContact O-N 3.35Å; R609-V612 PolarHBondContact O-N 3.22Å; R609-V612 VanDerWaalsContact O-N 3.13Å; R609-E613 PolarHBondContact O-N 2.95Å; R609-R966 VanDerWaalsContact CB-CZ 3.43Å; R609-R966 VanDerWaalsContact CD-NH2 3.3Å; R609-R966 VanDerWaalsContact CG-NH1 3.31Å; R609-E967 IonicContact CZ-OE1 2.78Å; R609-E967 IonicContact CZ-OE2 2.89Å; R609-E967 IonicContact NE-OE2 2.72Å; R609-E967 PolarHBondContact NE-OE2 3.35Å; R609-E967 VanDerWaalsContact NE-OE2 3.16Å; R609-E967 VanDerWaalsContact NH2-CD 3.33Å; R609-E967 IonicContact NH2-OE1 2.72Å; R609-E967 PolarHBondContact NH2-OE1 2.96Å; R609-E967 IonicContact NH2-OE2 2.89Å; R609-E967 PolarHBondContact NH2-OE2 2.93Å; R609-K986 VanDerWaalsContact CZ-CG 3.48Å
610	R	79.8	Confident	83.3	Confident	87 Å²	87	26.5 Å²	26.5	33%	0.328	13%	0.128	S	C	.	.	H	α-helix	trans	-60	-36.5	-175.4	178.7	178	179.2	165	3.4	111.7	V612 E613 E614 T893 D984 Y987	R610-V612 VanDerWaalsContact C-N 3.32Å; R610-V612 PolarHBondContact O-N 3.24Å; R610-E613 PolarHBondContact O-N 3.1Å; R610-E614 HydrophobicContact CG-CG 4.25Å; R610-E614 WeakPolarHBondContact CG-OE1 3.43Å; R610-E614 IonicContact CZ-OE1 3.17Å; R610-E614 IonicContact NE-OE1 3.94Å; R610-E614 PolarHBondContact NE-OE1 3.42Å; R610-E614 IonicContact NH2-OE1 2.75Å; R610-E614 WeakPolarHBondContact O-CG 3.34Å; R610-E614 PolarHBondContact O-N 3.43Å; R610-T893 VanDerWaalsContact CZ-OG1 3.31Å; R610-T893 PolarHBondContact NE-OG1 3.42Å; R610-T893 PolarHBondContact NH2-OG1 3.48Å; R610-D984 VanDerWaalsContact CB-OD1 3.31Å; R610-D984 WeakPolarHBondContact CB-OD1 3.39Å; R610-D984 PolarHBondContact N-OD1 3.32Å; R610-Y987 HydrophobicContact CB-CD2 4.3Å; R610-Y987 HydrophobicContact CB-CE2 3.5Å; R610-Y987 WeakPolarHBondContact CD-OH 3.43Å; R610-Y987 HydrophobicContact CG-CE2 3.92Å; R610-Y987 WeakPolarHBondContact CG-OH 3.47Å
611	S	85.6	Confident	83.5	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-57.8	-39.6	176.5	69.2	0	0	0	0	114.2	R609 E614 V615 Q929 D984	R609-S611 PolarHBondContact O-N 3.35Å; S611-E614 PolarHBondContact O-N 3.33Å; S611-V615 WeakPolarHBondContact O-CG2 3.37Å; S611-V615 PolarHBondContact O-N 3.28Å; S611-Q929 PolarHBondContact O-NE2 3.19Å; S611-D984 VanDerWaalsContact CB-OD2 3.31Å; S611-D984 WeakPolarHBondContact CB-OD2 3.27Å; S611-D984 PolarHBondContact N-OD1 2.88Å; S611-D984 PolarHBondContact OG-OD2 2.8Å
612	V	88.1	Confident	83.8	Confident	9 Å²	9	27.7 Å²	27.7	6%	0.055	13%	0.132	C	C	.	.	H	α-helix	trans	-67.9	-42.6	178.8	-177.1	0	0	0	0	110.1	I608 R609 R610 V615 Y616 L774 I959 Y962	I608-V612 HydrophobicContact CG2-CB 4.23Å; I608-V612 HydrophobicContact CG2-CG1 4.36Å; R609-V612 PolarHBondContact O-N 3.22Å; R609-V612 VanDerWaalsContact O-N 3.13Å; R610-V612 VanDerWaalsContact C-N 3.32Å; R610-V612 PolarHBondContact O-N 3.24Å; V612-V615 PolarHBondContact O-N 3.11Å; V612-Y616 WeakPolarHBondContact O-CB 3.22Å; V612-Y616 PolarHBondContact O-N 2.9Å; V612-L774 HydrophobicContact CG1-CD2 4.41Å; V612-I959 HydrophobicContact CG1-CG2 3.79Å; V612-Y962 HydrophobicContact CG2-CD1 4.06Å; V612-Y962 HydrophobicContact CG2-CE1 4.05Å
613	E	85.3	Confident	84.3	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-64.6	-39.7	176.2	-160.4	-144	128	0	0	112.4	R609 R610 Y616 N617 L774 T778 K781	R609-E613 PolarHBondContact O-N 2.95Å; R610-E613 PolarHBondContact O-N 3.1Å; E613-Y616 PolarHBondContact O-N 3.43Å; E613-N617 WeakPolarHBondContact O-CB 3.02Å; E613-N617 PolarHBondContact O-N 3.06Å; E613-N617 PolarHBondContact O-ND2 3.38Å; E613-N617 PolarHBondContact OE1-ND2 2.88Å; E613-L774 HydrophobicContact CB-CD2 3.89Å; E613-L774 HydrophobicContact CG-CD2 4.01Å; E613-T778 PolarHBondContact OE1-OG1 2.86Å; E613-K781 WeakPolarHBondContact OE1-CE 3.25Å; E613-K781 IonicContact OE1-NZ 3.32Å; E613-K781 PolarHBondContact OE1-NZ 2.99Å; E613-K781 WeakPolarHBondContact OE2-CE 3.39Å; E613-K781 IonicContact OE2-NZ 3.18Å; E613-K781 PolarHBondContact OE2-NZ 3Å; E613-K781 VanDerWaalsContact OE2-NZ 3.16Å
614	E	86.8	Confident	84.9	Confident	4 Å²	4	27.2 Å²	27.2	2%	0.019	12%	0.124	C	C	.	.	H	α-helix	trans	-66.1	-41.8	176.5	-74	178.9	-174.1	0	0	112.5	R610 S611 Y616 N617 S618 T893 F894 R897	R610-E614 HydrophobicContact CG-CG 4.25Å; R610-E614 WeakPolarHBondContact CG-OE1 3.43Å; R610-E614 IonicContact CZ-OE1 3.17Å; R610-E614 IonicContact NE-OE1 3.94Å; R610-E614 PolarHBondContact NE-OE1 3.42Å; R610-E614 IonicContact NH2-OE1 2.75Å; R610-E614 WeakPolarHBondContact O-CG 3.34Å; R610-E614 PolarHBondContact O-N 3.43Å; S611-E614 PolarHBondContact O-N 3.33Å; E614-Y616 VanDerWaalsContact C-N 3.35Å; E614-N617 PolarHBondContact O-N 3.48Å; E614-S618 VanDerWaalsContact O-CB 3.3Å; E614-S618 WeakPolarHBondContact O-CB 3.3Å; E614-S618 PolarHBondContact O-N 2.84Å; E614-T893 WeakPolarHBondContact OE1-CB 3.35Å; E614-T893 PolarHBondContact OE1-OG1 2.87Å; E614-T893 WeakPolarHBondContact OE2-CB 3.29Å; E614-F894 HydrophobicContact CB-CB 4.22Å; E614-F894 PolarHBondContact OE2-N 3.28Å; E614-R897 IonicContact OE2-NH2 3.2Å; E614-R897 PolarHBondContact OE2-NH2 2.98Å
615	V	91.1	Very high	85.4	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-61.9	-44.6	174.3	167.4	0	0	0	0	110.4	S611 V612 S618 F619 Q929 V932 V933 L936 Y962	S611-V615 WeakPolarHBondContact O-CG2 3.37Å; S611-V615 PolarHBondContact O-N 3.28Å; V612-V615 PolarHBondContact O-N 3.11Å; V615-S618 PolarHBondContact O-N 3.46Å; V615-F619 PolarHBondContact O-N 2.62Å; V615-Q929 HydrophobicContact CG2-CB 4.1Å; V615-Q929 HydrophobicContact CG2-CG 4.04Å; V615-V932 HydrophobicContact CG1-CB 4.39Å; V615-V932 HydrophobicContact CG1-CG1 3.76Å; V615-V933 HydrophobicContact CB-CG2 4.37Å; V615-V933 HydrophobicContact CG1-CG2 3.96Å; V615-V933 HydrophobicContact CG2-CG2 4.33Å; V615-L936 HydrophobicContact CG1-CD1 3.86Å; V615-Y962 HydrophobicContact CB-CD1 4.48Å; V615-Y962 HydrophobicContact CB-CE1 4.23Å; V615-Y962 HydrophobicContact CG2-CD1 4.31Å; V615-Y962 HydrophobicContact CG2-CE1 3.71Å
616	Y	89.7	Confident	86.1	Confident	4 Å²	4	25.6 Å²	25.6	2%	0.016	12%	0.115	C	C	.	.	H	α-helix	trans	-62.8	-49.4	177.1	180	-111.8	0	0	0	112.6	V612 E613 E614 S618 F619 I620 E771 L774 T817 I959	V612-Y616 WeakPolarHBondContact O-CB 3.22Å; V612-Y616 PolarHBondContact O-N 2.9Å; E613-Y616 PolarHBondContact O-N 3.43Å; E614-Y616 VanDerWaalsContact C-N 3.35Å; Y616-S618 VanDerWaalsContact C-N 3.25Å; Y616-S618 PolarHBondContact O-N 3.32Å; Y616-F619 WeakPolarHBondContact O-CB 3.4Å; Y616-F619 PolarHBondContact O-N 2.92Å; Y616-F619 VanDerWaalsContact O-N 3.14Å; Y616-I620 HydrophobicContact CD1-CG1 4.38Å; Y616-I620 HydrophobicContact CD2-CG1 4.34Å; Y616-I620 HydrophobicContact CE1-CG1 3.94Å; Y616-I620 HydrophobicContact CE2-CD1 3.95Å; Y616-I620 HydrophobicContact CE2-CG1 3.9Å; Y616-I620 WeakPolarHBondContact O-CG1 3.45Å; Y616-I620 PolarHBondContact O-N 3.31Å; Y616-E771 WeakPolarHBondContact OH-CG 3.15Å; Y616-E771 PolarHBondContact OH-OE1 2.91Å; Y616-L774 HydrophobicContact CD1-CB 4.46Å; Y616-L774 HydrophobicContact CD1-CD1 3.47Å; Y616-L774 VanDerWaalsContact CD1-CD1 3.47Å; Y616-L774 HydrophobicContact CD2-CD1 4.06Å; Y616-L774 HydrophobicContact CE1-CD1 4.13Å; Y616-L774 HydrophobicContact CG-CD1 3.41Å; Y616-L774 VanDerWaalsContact CG-CD1 3.41Å; Y616-T817 HydrophobicContact CD1-CG2 4.03Å; Y616-T817 HydrophobicContact CE1-CG2 3.89Å; Y616-I959 HydrophobicContact CD2-CD1 3.51Å; Y616-I959 HydrophobicContact CE2-CD1 4.27Å; Y616-I959 HydrophobicContact CG-CD1 4.43Å
617	N	88.5	Confident	86.9	Confident	7 Å²	7	20.8 Å²	20.8	4%	0.037	9%	0.094	C	C	.	.	H	α-helix	trans	-62.6	-34.9	178.3	-69.6	-27.5	0	0	0	111.6	E613 E614 G621 T817 L892	E613-N617 WeakPolarHBondContact O-CB 3.02Å; E613-N617 PolarHBondContact O-N 3.06Å; E613-N617 PolarHBondContact O-ND2 3.38Å; E613-N617 PolarHBondContact OE1-ND2 2.88Å; E614-N617 PolarHBondContact O-N 3.48Å; N617-G621 PolarHBondContact O-N 2.84Å; N617-T817 WeakPolarHBondContact OD1-CB 3.32Å; N617-T817 PolarHBondContact OD1-OG1 3.19Å; N617-L892 HydrophobicContact CB-CD1 4.19Å; N617-L892 HydrophobicContact CB-CD2 3.68Å
618	S	90.4	Very high	87.4	Confident	0 Å²	0	15.8 Å²	15.8	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-64.8	-44.4	173.6	-168.2	0	0	0	0	111.7	E614 V615 Y616 G621 F622	E614-S618 VanDerWaalsContact O-CB 3.3Å; E614-S618 WeakPolarHBondContact O-CB 3.3Å; E614-S618 PolarHBondContact O-N 2.84Å; V615-S618 PolarHBondContact O-N 3.46Å; Y616-S618 VanDerWaalsContact C-N 3.25Å; Y616-S618 PolarHBondContact O-N 3.32Å; S618-G621 PolarHBondContact O-N 3.33Å; S618-F622 WeakPolarHBondContact O-CD2 3.38Å; S618-F622 PolarHBondContact O-N 3.2Å
619	F	91	Very high	88	Confident	1 Å²	1	16.8 Å²	16.8	0%	0.004	8%	0.077	C	C	.	.	H	α-helix	trans	-59.1	-46.9	175.6	167.4	-111.7	0	0	0	111.8	V615 Y616 G621 F622 F623 L936 N940 F955	V615-F619 PolarHBondContact O-N 2.62Å; Y616-F619 WeakPolarHBondContact O-CB 3.4Å; Y616-F619 PolarHBondContact O-N 2.92Å; Y616-F619 VanDerWaalsContact O-N 3.14Å; F619-G621 VanDerWaalsContact C-N 3.34Å; F619-G621 PolarHBondContact O-N 2.97Å; F619-F622 PolarHBondContact O-N 3.49Å; F619-F623 WeakPolarHBondContact O-CB 3.45Å; F619-F623 PolarHBondContact O-N 2.91Å; F619-L936 HydrophobicContact CB-CB 4.44Å; F619-L936 HydrophobicContact CB-CD1 4.09Å; F619-L936 HydrophobicContact CD2-CB 3.53Å; F619-L936 HydrophobicContact CE2-CB 3.99Å; F619-L936 WeakPolarHBondContact CE2-O 3.24Å; F619-L936 HydrophobicContact CG-CB 4.12Å; F619-L936 HydrophobicContact CG-CD1 4.33Å; F619-N940 HydrophobicContact CE2-CB 4.1Å; F619-F955 AromaticContact CE1-CD2 3.9Å; F619-F955 HydrophobicContact CE1-CD2 3.9Å; F619-F955 HydrophobicContact CE1-CE2 4.33Å; F619-F955 HydrophobicContact CE1-CG 4.1Å; F619-F955 HydrophobicContact CZ-CB 4.39Å; F619-F955 HydrophobicContact CZ-CD1 4.39Å; F619-F955 HydrophobicContact CZ-CD2 4.38Å; F619-F955 HydrophobicContact CZ-CG 4.11Å
620	I	88.7	Confident	88.3	Confident	10 Å²	10	17.5 Å²	17.5	5%	0.051	8%	0.08	C	C	.	.	H	α-helix	trans	-63.9	-39.1	177.6	-62.6	-62.7	0	0	0	111.6	A558 P559 Y616 F623 F624 V818	A558-I620 HydrophobicContact CB-CD1 3.99Å; P559-I620 HydrophobicContact CG-CD1 4.29Å; Y616-I620 HydrophobicContact CD1-CG1 4.38Å; Y616-I620 HydrophobicContact CD2-CG1 4.34Å; Y616-I620 HydrophobicContact CE1-CG1 3.94Å; Y616-I620 HydrophobicContact CE2-CD1 3.95Å; Y616-I620 HydrophobicContact CE2-CG1 3.9Å; Y616-I620 WeakPolarHBondContact O-CG1 3.45Å; Y616-I620 PolarHBondContact O-N 3.31Å; I620-F623 WeakPolarHBondContact O-CB 3.41Å; I620-F623 PolarHBondContact O-N 3.49Å; I620-F624 HydrophobicContact CG2-CD2 3.89Å; I620-F624 HydrophobicContact CG2-CE2 3.5Å; I620-F624 VanDerWaalsContact CG2-CE2 3.5Å; I620-F624 HydrophobicContact CG2-CZ 4.33Å; I620-F624 VanDerWaalsContact O-CD2 3.27Å; I620-F624 WeakPolarHBondContact O-CD2 3.35Å; I620-F624 PolarHBondContact O-N 3.46Å; I620-V818 HydrophobicContact CG2-CG2 4.41Å
621	G	88.7	Confident	88.5	Confident	1 Å²	1	13.8 Å²	13.8	1%	0.01	7%	0.067	C	C	.	.	H	α-helix	trans	-58.7	-47.5	173.4	0	0	0	0	0	112.3	N617 S618 F619 F624 L625 G885	N617-G621 PolarHBondContact O-N 2.84Å; S618-G621 PolarHBondContact O-N 3.33Å; F619-G621 VanDerWaalsContact C-N 3.34Å; F619-G621 PolarHBondContact O-N 2.97Å; G621-F624 PolarHBondContact O-N 2.94Å; G621-L625 WeakPolarHBondContact O-CG 3.5Å; G621-L625 PolarHBondContact O-N 2.87Å; G621-G885 WeakPolarHBondContact O-CA 3.25Å
622	F	90.7	Very high	88.5	Confident	70 Å²	70	14 Å²	14	31%	0.307	7%	0.068	S	C	.	.	H	α-helix	trans	-67.1	-37.3	175	-77.6	-63.1	0	0	0	113.2	S618 F619 F624 L625 L626 L889 V933 V937	S618-F622 WeakPolarHBondContact O-CD2 3.38Å; S618-F622 PolarHBondContact O-N 3.2Å; F619-F622 PolarHBondContact O-N 3.49Å; F622-F624 VanDerWaalsContact C-N 3.33Å; F622-F624 PolarHBondContact O-N 3.21Å; F622-L625 HydrophobicContact CD1-CD1 4.33Å; F622-L625 PolarHBondContact O-N 2.89Å; F622-L626 WeakPolarHBondContact O-CB 3.42Å; F622-L626 WeakPolarHBondContact O-CG 3.42Å; F622-L626 PolarHBondContact O-N 3.45Å; F622-L889 HydrophobicContact CD1-CD1 4.28Å; F622-L889 HydrophobicContact CD2-CD2 4.3Å; F622-L889 HydrophobicContact CE1-CD1 4.04Å; F622-L889 HydrophobicContact CE2-CD1 4.39Å; F622-L889 HydrophobicContact CE2-CD2 4.22Å; F622-L889 HydrophobicContact CZ-CD1 4.09Å; F622-V933 HydrophobicContact CD2-CG1 3.76Å; F622-V933 HydrophobicContact CE2-CG1 3.79Å; F622-V937 HydrophobicContact CB-CG2 3.69Å; F622-V937 HydrophobicContact CD2-CG2 4Å; F622-V937 HydrophobicContact CG-CG2 3.95Å
623	F	89.8	Confident	88.4	Confident	1 Å²	1	18.8 Å²	18.8	0%	0.004	9%	0.089	C	C	.	.	H	α-helix	trans	-56.1	-48.8	174.5	176.5	-81	0	0	0	110.7	F515 A558 Y561 I562 F619 I620 L625 L626 K627 N940	F515-F623 HydrophobicContact CE1-CE1 4.44Å; A558-F623 HydrophobicContact CB-CB 4.47Å; A558-F623 HydrophobicContact CB-CD1 3.23Å; A558-F623 HydrophobicContact CB-CD2 3.94Å; A558-F623 HydrophobicContact CB-CE1 3.26Å; A558-F623 HydrophobicContact CB-CE2 4Å; A558-F623 HydrophobicContact CB-CG 3.61Å; A558-F623 HydrophobicContact CB-CZ 3.67Å; Y561-F623 HydrophobicContact CD1-CZ 4.1Å; I562-F623 HydrophobicContact CD1-CD2 4.25Å; I562-F623 HydrophobicContact CD1-CE2 3.81Å; I562-F623 HydrophobicContact CG1-CE2 3.98Å; F619-F623 WeakPolarHBondContact O-CB 3.45Å; F619-F623 PolarHBondContact O-N 2.91Å; I620-F623 WeakPolarHBondContact O-CB 3.41Å; I620-F623 PolarHBondContact O-N 3.49Å; F623-L625 PolarHBondContact O-N 3.34Å; F623-L626 PolarHBondContact O-N 2.92Å; F623-K627 HydrophobicContact CE1-CB 4.2Å; F623-K627 HydrophobicContact CE1-CG 4.35Å; F623-K627 HydrophobicContact CZ-CB 4.45Å; F623-K627 HydrophobicContact CZ-CD 4.5Å; F623-K627 HydrophobicContact CZ-CG 4.35Å; F623-K627 WeakPolarHBondContact O-CB 3.26Å; F623-K627 PolarHBondContact O-N 3.45Å; F623-N940 WeakPolarHBondContact CD2-ND2 3.46Å
624	F	87.9	Confident	88.4	Confident	17 Å²	17	25 Å²	25	8%	0.075	12%	0.121	C	C	.	.	H	α-helix	trans	-63	-41.8	179	-75.7	-52.3	0	0	0	112.9	F515 I620 G621 F622 A628 F881 M884	F515-F624 AromaticContact CE2-CE1 3.74Å; F515-F624 HydrophobicContact CE2-CE1 3.74Å; F515-F624 HydrophobicContact CE2-CZ 4.03Å; F515-F624 AromaticContact CZ-CE1 3.49Å; F515-F624 HydrophobicContact CZ-CE1 3.49Å; F515-F624 VanDerWaalsContact CZ-CE1 3.49Å; F515-F624 AromaticContact CZ-CZ 4Å; F515-F624 HydrophobicContact CZ-CZ 4Å; I620-F624 HydrophobicContact CG2-CD2 3.89Å; I620-F624 HydrophobicContact CG2-CE2 3.5Å; I620-F624 VanDerWaalsContact CG2-CE2 3.5Å; I620-F624 HydrophobicContact CG2-CZ 4.33Å; I620-F624 VanDerWaalsContact O-CD2 3.27Å; I620-F624 WeakPolarHBondContact O-CD2 3.35Å; I620-F624 PolarHBondContact O-N 3.46Å; G621-F624 PolarHBondContact O-N 2.94Å; F622-F624 VanDerWaalsContact C-N 3.33Å; F622-F624 PolarHBondContact O-N 3.21Å; F624-A628 VanDerWaalsContact O-CB 3.31Å; F624-A628 WeakPolarHBondContact O-CB 3.45Å; F624-A628 PolarHBondContact O-N 2.9Å; F624-A628 VanDerWaalsContact O-N 3.16Å; F624-F881 HydrophobicContact CD1-CD1 4.45Å; F624-F881 HydrophobicContact CD1-CD2 4.2Å; F624-F881 HydrophobicContact CD1-CE1 4.36Å; F624-F881 HydrophobicContact CD1-CE2 4.16Å; F624-F881 HydrophobicContact CD1-CG 4.33Å; F624-F881 HydrophobicContact CD1-CZ 4.23Å; F624-F881 HydrophobicContact CE1-CE1 4.24Å; F624-F881 HydrophobicContact CE1-CE2 4.43Å; F624-F881 HydrophobicContact CE1-CZ 4.1Å; F624-M884 HydrophobicContact CE1-CE 4.33Å
625	L	90.8	Very high	88.2	Confident	30 Å²	30	27.4 Å²	27.4	16%	0.157	13%	0.134	C	C	.	.	H	α-helix	trans	-61.5	-53.7	176.6	-70	173.3	0	0	0	111.4	G621 F622 F623 A628 L629 L882 V886 L889	G621-L625 WeakPolarHBondContact O-CG 3.5Å; G621-L625 PolarHBondContact O-N 2.87Å; F622-L625 HydrophobicContact CD1-CD1 4.33Å; F622-L625 PolarHBondContact O-N 2.89Å; F623-L625 PolarHBondContact O-N 3.34Å; L625-A628 PolarHBondContact O-N 3.48Å; L625-L629 WeakPolarHBondContact O-CB 3.34Å; L625-L629 VanDerWaalsContact O-CG 3.26Å; L625-L629 WeakPolarHBondContact O-CG 3.43Å; L625-L629 PolarHBondContact O-N 3.25Å; L625-L882 HydrophobicContact CD2-CD2 4.09Å; L625-V886 HydrophobicContact CD2-CG2 3.89Å; L625-L889 HydrophobicContact CD1-CD1 3.75Å
626	L	90.2	Very high	88.1	Confident	31 Å²	31	31.1 Å²	31.1	16%	0.162	15%	0.153	C	C	.	.	H	α-helix	trans	-66.5	-43.7	-176.2	-69.1	174.4	0	0	0	111.5	F622 F623 A628 L629 F630 V937 I941	F622-L626 WeakPolarHBondContact O-CB 3.42Å; F622-L626 WeakPolarHBondContact O-CG 3.42Å; F622-L626 PolarHBondContact O-N 3.45Å; F623-L626 PolarHBondContact O-N 2.92Å; L626-A628 VanDerWaalsContact C-N 3.32Å; L626-A628 PolarHBondContact O-N 3.44Å; L626-L629 PolarHBondContact O-N 3.17Å; L626-F630 HydrophobicContact CB-CD2 4.25Å; L626-F630 HydrophobicContact CB-CE2 3.86Å; L626-F630 HydrophobicContact CB-CZ 4.22Å; L626-F630 HydrophobicContact CD2-CE1 4.32Å; L626-F630 HydrophobicContact CD2-CE2 4.35Å; L626-F630 HydrophobicContact CD2-CZ 3.85Å; L626-F630 HydrophobicContact CG-CZ 4.48Å; L626-F630 WeakPolarHBondContact O-CB 3.27Å; L626-F630 WeakPolarHBondContact O-CD2 3.46Å; L626-F630 WeakPolarHBondContact O-CG 3.5Å; L626-F630 PolarHBondContact O-N 2.99Å; L626-V937 HydrophobicContact CD1-CG1 3.65Å; L626-I941 HydrophobicContact CD1-CD1 4.25Å; L626-I941 HydrophobicContact CD1-CG1 4.08Å
627	K	87.3	Confident	87.9	Confident	10 Å²	10	32.2 Å²	32.2	4%	0.043	16%	0.161	C	C	.	.	H	α-helix	trans	-62.7	-40.3	179.8	-165	65.4	174	176.1	0	111.7	L518 F623 T631 D944	L518-K627 HydrophobicContact CD1-CG 4.46Å; F623-K627 HydrophobicContact CE1-CB 4.2Å; F623-K627 HydrophobicContact CE1-CG 4.35Å; F623-K627 HydrophobicContact CZ-CB 4.45Å; F623-K627 HydrophobicContact CZ-CD 4.5Å; F623-K627 HydrophobicContact CZ-CG 4.35Å; F623-K627 WeakPolarHBondContact O-CB 3.26Å; F623-K627 PolarHBondContact O-N 3.45Å; K627-T631 VanDerWaalsContact O-CB 3.3Å; K627-T631 WeakPolarHBondContact O-CB 3.3Å; K627-T631 PolarHBondContact O-N 3.4Å; K627-T631 PolarHBondContact O-OG1 3.32Å; K627-D944 IonicContact NZ-OD1 2.81Å; K627-D944 PolarHBondContact NZ-OD1 3.19Å; K627-D944 IonicContact NZ-OD2 3.43Å; K627-D944 PolarHBondContact NZ-OD2 3.04Å
628	A	86.6	Confident	87.7	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-65.3	-49	174.7	0	0	0	0	0	111.9	F624 L625 L626 T631 M632 F881 L882	F624-A628 VanDerWaalsContact O-CB 3.31Å; F624-A628 WeakPolarHBondContact O-CB 3.45Å; F624-A628 PolarHBondContact O-N 2.9Å; F624-A628 VanDerWaalsContact O-N 3.16Å; L625-A628 PolarHBondContact O-N 3.48Å; L626-A628 VanDerWaalsContact C-N 3.32Å; L626-A628 PolarHBondContact O-N 3.44Å; A628-T631 PolarHBondContact O-N 3.46Å; A628-M632 VanDerWaalsContact O-CG 3.26Å; A628-M632 WeakPolarHBondContact O-CG 3.44Å; A628-M632 PolarHBondContact O-N 3.35Å; A628-F881 HydrophobicContact CB-CB 3.73Å; A628-L882 HydrophobicContact CB-CD2 3.9Å; A628-L882 HydrophobicContact CB-CG 4.01Å
629	L	89.9	Confident	87.4	Confident	48 Å²	48	44.2 Å²	44.2	25%	0.251	23%	0.23	S	C	.	.	H	α-helix	trans	-61.9	-48.6	179.5	-71.5	173.3	0	0	0	111.9	L625 L626 T631 M632 F633 L882	L625-L629 WeakPolarHBondContact O-CB 3.34Å; L625-L629 VanDerWaalsContact O-CG 3.26Å; L625-L629 WeakPolarHBondContact O-CG 3.43Å; L625-L629 PolarHBondContact O-N 3.25Å; L626-L629 PolarHBondContact O-N 3.17Å; L629-T631 PolarHBondContact O-N 2.92Å; L629-M632 PolarHBondContact O-N 2.89Å; L629-F633 HydrophobicContact CB-CD2 4.31Å; L629-F633 HydrophobicContact CB-CE2 4.14Å; L629-F633 HydrophobicContact CD2-CE2 4.3Å; L629-F633 WeakPolarHBondContact O-CD2 3.44Å; L629-F633 WeakPolarHBondContact O-CG 3.27Å; L629-F633 PolarHBondContact O-N 3.38Å; L629-L882 HydrophobicContact CD2-CD2 3.98Å; L629-L882 HydrophobicContact CG-CD2 3.9Å
630	F	87.5	Confident	87	Confident	37 Å²	37	45.8 Å²	45.8	16%	0.162	24%	0.24	C	C	.	.	H	α-helix	trans	-62.1	-44	178.8	-64.4	-24.8	0	0	0	111.5	L626 M632 F633 L634 I941 F945	L626-F630 HydrophobicContact CB-CD2 4.25Å; L626-F630 HydrophobicContact CB-CE2 3.86Å; L626-F630 HydrophobicContact CB-CZ 4.22Å; L626-F630 HydrophobicContact CD2-CE1 4.32Å; L626-F630 HydrophobicContact CD2-CE2 4.35Å; L626-F630 HydrophobicContact CD2-CZ 3.85Å; L626-F630 HydrophobicContact CG-CZ 4.48Å; L626-F630 WeakPolarHBondContact O-CB 3.27Å; L626-F630 WeakPolarHBondContact O-CD2 3.46Å; L626-F630 WeakPolarHBondContact O-CG 3.5Å; L626-F630 PolarHBondContact O-N 2.99Å; F630-M632 VanDerWaalsContact C-N 3.34Å; F630-M632 PolarHBondContact O-N 3.02Å; F630-F633 PolarHBondContact O-N 3.41Å; F630-L634 WeakPolarHBondContact O-CB 3.5Å; F630-L634 WeakPolarHBondContact O-CD1 3.39Å; F630-L634 WeakPolarHBondContact O-CG 3.25Å; F630-L634 PolarHBondContact O-N 3Å; F630-I941 HydrophobicContact CE2-CG1 4.22Å; F630-I941 HydrophobicContact CZ-CG1 4.15Å; F630-F945 HydrophobicContact CD1-CE2 4.2Å; F630-F945 AromaticContact CD1-CZ 4Å; F630-F945 HydrophobicContact CD1-CZ 4Å; F630-F945 HydrophobicContact CD2-CE2 4Å; F630-F945 HydrophobicContact CD2-CZ 4.36Å; F630-F945 AromaticContact CE1-CE2 3.92Å; F630-F945 HydrophobicContact CE1-CE2 3.92Å; F630-F945 HydrophobicContact CE1-CZ 4.06Å; F630-F945 AromaticContact CE2-CE2 3.71Å; F630-F945 HydrophobicContact CE2-CE2 3.71Å; F630-F945 HydrophobicContact CE2-CZ 4.41Å; F630-F945 HydrophobicContact CG-CE2 4.25Å; F630-F945 HydrophobicContact CG-CZ 4.17Å; F630-F945 AromaticContact CZ-CE2 3.67Å; F630-F945 HydrophobicContact CZ-CE2 3.67Å; F630-F945 HydrophobicContact CZ-CZ 4.27Å
631	T	83.4	Confident	86.7	Confident	10 Å²	10	55 Å²	55	6%	0.061	28%	0.28	C	S	.	.	H	α-helix	trans	-61.2	-44.2	176.6	-52.6	0	0	0	0	110.8	K627 A628 L629 F633 L634 L635 Y878	K627-T631 VanDerWaalsContact O-CB 3.3Å; K627-T631 WeakPolarHBondContact O-CB 3.3Å; K627-T631 PolarHBondContact O-N 3.4Å; K627-T631 PolarHBondContact O-OG1 3.32Å; A628-T631 PolarHBondContact O-N 3.46Å; L629-T631 PolarHBondContact O-N 2.92Å; T631-F633 PolarHBondContact O-N 3.46Å; T631-L634 PolarHBondContact O-N 2.72Å; T631-L635 HydrophobicContact CG2-CD1 4.34Å; T631-L635 WeakPolarHBondContact O-CD1 3.49Å; T631-L635 PolarHBondContact O-N 3.31Å; T631-Y878 HydrophobicContact CG2-CD1 4.49Å; T631-Y878 HydrophobicContact CG2-CE1 3.56Å; T631-Y878 HydrophobicContact CG2-CE2 4.46Å; T631-Y878 WeakPolarHBondContact CG2-OH 3.37Å
632	M	86	Confident	86.3	Confident	3 Å²	3	60.4 Å²	60.4	2%	0.015	31%	0.308	C	S	.	.	H	α-helix	trans	-61.8	-43.1	175.7	-70.2	178	-163.4	0	0	113	A628 L629 F630 L634 L635 A665 Y878 L882	A628-M632 VanDerWaalsContact O-CG 3.26Å; A628-M632 WeakPolarHBondContact O-CG 3.44Å; A628-M632 PolarHBondContact O-N 3.35Å; L629-M632 PolarHBondContact O-N 2.89Å; F630-M632 VanDerWaalsContact C-N 3.34Å; F630-M632 PolarHBondContact O-N 3.02Å; M632-L634 VanDerWaalsContact C-N 3.34Å; M632-L635 WeakPolarHBondContact O-CB 3.47Å; M632-L635 PolarHBondContact O-N 2.88Å; M632-A665 HydrophobicContact CE-CB 3.31Å; M632-A665 HydrophobicContact SD-CB 4.1Å; M632-Y878 HydrophobicContact CE-CG 4.34Å; M632-Y878 HydrophobicContact CG-CD2 4.22Å; M632-Y878 HydrophobicContact CG-CG 4.35Å; M632-L882 HydrophobicContact CE-CD1 3.59Å; M632-L882 HydrophobicContact CE-CG 4.06Å; M632-L882 HydrophobicContact SD-CD1 4.42Å
633	F	87.1	Confident	85.7	Confident	111 Å²	111	63 Å²	63	49%	0.487	33%	0.325	S	S	.	.	H	α-helix	trans	-70.2	-31.7	179.3	-71.1	-52.9	0	0	0	112.3	L629 F630 T631 L635 I636 L662	L629-F633 HydrophobicContact CB-CD2 4.31Å; L629-F633 HydrophobicContact CB-CE2 4.14Å; L629-F633 HydrophobicContact CD2-CE2 4.3Å; L629-F633 WeakPolarHBondContact O-CD2 3.44Å; L629-F633 WeakPolarHBondContact O-CG 3.27Å; L629-F633 PolarHBondContact O-N 3.38Å; F630-F633 PolarHBondContact O-N 3.41Å; T631-F633 PolarHBondContact O-N 3.46Å; F633-L635 PolarHBondContact O-N 2.95Å; F633-I636 HydrophobicContact CD1-CD1 3.94Å; F633-I636 WeakPolarHBondContact O-CB 3.47Å; F633-I636 WeakPolarHBondContact O-CG1 3.43Å; F633-I636 PolarHBondContact O-N 3.29Å; F633-I636 VanDerWaalsContact O-N 3.09Å; F633-L662 HydrophobicContact CE1-CD1 4.31Å
634	L	84.1	Confident	85.5	Confident	129 Å²	129	66.3 Å²	66.3	68%	0.675	35%	0.346	S	S	*	.	H	α-helix	trans	-66.3	-20.8	173.8	-74.7	165.9	0	0	0	113.1	F630 T631 M632 I636	F630-L634 WeakPolarHBondContact O-CB 3.5Å; F630-L634 WeakPolarHBondContact O-CD1 3.39Å; F630-L634 WeakPolarHBondContact O-CG 3.25Å; F630-L634 PolarHBondContact O-N 3Å; T631-L634 PolarHBondContact O-N 2.72Å; M632-L634 VanDerWaalsContact C-N 3.34Å; L634-I636 PolarHBondContact O-N 3Å
635	L	82.9	Confident	85.4	Confident	55 Å²	55	70.2 Å²	70.2	29%	0.288	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-17.9	172.3	-89.1	75.3	0	0	0	112.5	T631 M632 F633 P637 A658 T661	T631-L635 HydrophobicContact CG2-CD1 4.34Å; T631-L635 WeakPolarHBondContact O-CD1 3.49Å; T631-L635 PolarHBondContact O-N 3.31Å; M632-L635 WeakPolarHBondContact O-CB 3.47Å; M632-L635 PolarHBondContact O-N 2.88Å; F633-L635 PolarHBondContact O-N 2.95Å; L635-P637 WeakPolarHBondContact O-CD 3.46Å; L635-A658 HydrophobicContact CB-CB 4.09Å; L635-T661 HydrophobicContact CD2-CG2 4.24Å
636	I	88.1	Confident	85.1	Confident	78 Å²	78	76.1 Å²	76.1	40%	0.4	40%	0.401	S	S	.	.	S	Bend	trans	-74.1	116.8	-179	-58.1	175.8	0	0	0	109.1	F633 L634 L655 A658	F633-I636 HydrophobicContact CD1-CD1 3.94Å; F633-I636 WeakPolarHBondContact O-CB 3.47Å; F633-I636 WeakPolarHBondContact O-CG1 3.43Å; F633-I636 PolarHBondContact O-N 3.29Å; F633-I636 VanDerWaalsContact O-N 3.09Å; L634-I636 PolarHBondContact O-N 3Å; I636-L655 HydrophobicContact CG2-CD1 3.94Å; I636-A658 HydrophobicContact CG1-CB 4.28Å
637	P	86.1	Confident	84.8	Confident	28 Å²	28	75.9 Å²	75.9	18%	0.182	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-69.6	144	-178.1	29.5	-35.5	0	0	0	111.5	L635 Y651 K654 L655	L635-P637 WeakPolarHBondContact O-CD 3.46Å; P637-Y651 HydrophobicContact CB-CD2 4.04Å; P637-Y651 HydrophobicContact CB-CE2 4.19Å; P637-Y651 HydrophobicContact CG-CD2 3.85Å; P637-Y651 HydrophobicContact CG-CE2 3.85Å; P637-Y651 WeakPolarHBondContact O-CE2 3.5Å; P637-K654 HydrophobicContact CB-CB 4.29Å; P637-K654 HydrophobicContact CG-CB 3.88Å; P637-L655 HydrophobicContact CG-CB 4.11Å
638	A	84.8	Confident	84.8	Confident	92 Å²	92	81.2 Å²	81.2	76%	0.76	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-67.5	148.6	167	0	0	0	0	0	110.8	Y651	A638-Y651 WeakPolarHBondContact O-CD2 3.27Å; A638-Y651 WeakPolarHBondContact O-CE2 3.34Å
639	K	84.6	Confident	84.7	Confident	167 Å²	167	87.5 Å²	87.5	73%	0.726	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-56.6	129.6	177.3	-172.7	178.9	179.5	-179.8	0	109.5	K641	K639-K641 PolarHBondContact O-N 2.9Å
640	P	82.4	Confident	84.6	Confident	34 Å²	34	87.4 Å²	87.4	22%	0.221	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-62.6	139.6	-179.5	26.3	-34.5	0	0	0	109.9	D642 Y651	P640-D642 VanDerWaalsContact C-N 3.32Å; P640-Y651 VanDerWaalsContact CD-CD2 3.49Å; P640-Y651 HydrophobicContact CG-CG 4.22Å
641	K	80.8	Confident	84.6	Confident	204 Å²	204	88 Å²	88	89%	0.887	46%	0.461	S	S	*	.	S	Bend	trans	-70.9	-32.3	172.7	-69	-175.5	178.4	-179	0	111.4	K639	K639-K641 PolarHBondContact O-N 2.9Å
642	D	80.8	Confident	84.9	Confident	114 Å²	114	94.6 Å²	94.6	61%	0.61	49%	0.485	S	S	*	.	S	Bend	trans	-91	128.4	-179.5	-56.4	-26.7	0	0	0	110.9	P640 T644 S647	P640-D642 VanDerWaalsContact C-N 3.32Å; D642-T644 VanDerWaalsContact C-N 3.27Å; D642-T644 PolarHBondContact O-N 3.04Å; D642-S647 PolarHBondContact O-OG 3.02Å
643	N	78.6	Confident	85.1	Confident	123 Å²	123	99.4 Å²	99.4	66%	0.658	51%	0.508	S	S	*	.			trans	-87.2	21.6	-177.9	-73.9	-24.6	0	0	0	114.1	R648	N643-R648 PolarHBondContact O-NE 3.39Å
644	T	85.4	Confident	85.1	Confident	72 Å²	72	100.8 Å²	100.8	44%	0.442	51%	0.514	S	S	.	.			trans	-64	147.4	178	65	0	0	0	0	110.7	D642 M646 S647 R648	D642-T644 VanDerWaalsContact C-N 3.27Å; D642-T644 PolarHBondContact O-N 3.04Å; T644-M646 PolarHBondContact O-N 3.46Å; T644-S647 PolarHBondContact N-OG 3.43Å; T644-S647 PolarHBondContact O-N 3.46Å; T644-S647 PolarHBondContact O-OG 3.02Å; T644-S647 WeakPolarHBondContact OG1-CB 3.36Å; T644-S647 PolarHBondContact OG1-N 3.4Å; T644-S647 PolarHBondContact OG1-OG 3.39Å; T644-S647 VanDerWaalsContact OG1-OG 3.08Å; T644-R648 PolarHBondContact O-N 3.22Å; T644-R648 VanDerWaalsContact O-N 3.14Å
645	P	85.3	Confident	85.5	Confident	98 Å²	98	97.4 Å²	97.4	64%	0.636	50%	0.496	S	S	*	.	H	α-helix	trans	-59.7	-33.4	177.8	23.2	-32.6	0	0	0	111.7	M649	P645-M649 WeakPolarHBondContact O-CB 3.26Å; P645-M649 PolarHBondContact O-N 3.09Å
646	M	84.9	Confident	85.9	Confident	154 Å²	154	96.3 Å²	96.3	76%	0.759	50%	0.495	S	S	*	.	H	α-helix	trans	-68.7	-44.1	178.4	-167.6	-179.8	-67.6	0	0	112.7	T644 R648 M649 A650	T644-M646 PolarHBondContact O-N 3.46Å; M646-R648 VanDerWaalsContact C-N 3.32Å; M646-R648 PolarHBondContact O-N 2.94Å; M646-M649 PolarHBondContact O-N 3.5Å; M646-A650 WeakPolarHBondContact O-CB 3.33Å; M646-A650 PolarHBondContact O-N 3.27Å
647	S	84.9	Confident	86	Confident	27 Å²	27	93.9 Å²	93.9	19%	0.189	48%	0.484	C	S	.	.	H	α-helix	trans	-64.4	-38.4	176.3	66.6	0	0	0	0	111.5	D642 T644 A650 Y651	D642-S647 PolarHBondContact O-OG 3.02Å; T644-S647 PolarHBondContact N-OG 3.43Å; T644-S647 PolarHBondContact O-N 3.46Å; T644-S647 PolarHBondContact O-OG 3.02Å; T644-S647 WeakPolarHBondContact OG1-CB 3.36Å; T644-S647 PolarHBondContact OG1-N 3.4Å; T644-S647 PolarHBondContact OG1-OG 3.39Å; T644-S647 VanDerWaalsContact OG1-OG 3.08Å; S647-A650 PolarHBondContact O-N 2.99Å; S647-Y651 VanDerWaalsContact O-CB 3.28Å; S647-Y651 WeakPolarHBondContact O-CB 3.47Å; S647-Y651 PolarHBondContact O-N 3.3Å
648	R	85.9	Confident	86.3	Confident	122 Å²	122	92.8 Å²	92.8	46%	0.46	48%	0.477	S	S	.	.	H	α-helix	trans	-63.8	-46.5	175.4	-75.5	-172.2	-76.9	158.7	-5.7	111.7	N643 T644 M646 Y651 Y652	N643-R648 PolarHBondContact O-NE 3.39Å; T644-R648 PolarHBondContact O-N 3.22Å; T644-R648 VanDerWaalsContact O-N 3.14Å; M646-R648 VanDerWaalsContact C-N 3.32Å; M646-R648 PolarHBondContact O-N 2.94Å; R648-Y651 WeakPolarHBondContact O-CB 3.45Å; R648-Y651 PolarHBondContact O-N 2.81Å; R648-Y652 HydrophobicContact CB-CE2 4.3Å; R648-Y652 WeakPolarHBondContact O-CD2 3.48Å; R648-Y652 PolarHBondContact O-N 3.07Å
649	M	86.1	Confident	86.6	Confident	132 Å²	132	90.3 Å²	90.3	65%	0.65	46%	0.461	S	S	*	.	H	α-helix	trans	-61	-46.1	177.3	-178.1	176.6	154.8	0	0	111.6	P645 M646 Y651 Y652 Q653	P645-M649 WeakPolarHBondContact O-CB 3.26Å; P645-M649 PolarHBondContact O-N 3.09Å; M646-M649 PolarHBondContact O-N 3.5Å; M649-Y651 VanDerWaalsContact C-N 3.33Å; M649-Y651 PolarHBondContact O-N 3.28Å; M649-Y652 PolarHBondContact O-N 2.87Å; M649-Q653 WeakPolarHBondContact O-CB 2.81Å; M649-Q653 PolarHBondContact O-N 2.91Å
650	A	86.4	Confident	87	Confident	45 Å²	45	83 Å²	83	37%	0.372	43%	0.43	S	S	.	.	H	α-helix	trans	-63.2	-38	176.4	0	0	0	0	0	112.5	M646 S647 K654	M646-A650 WeakPolarHBondContact O-CB 3.33Å; M646-A650 PolarHBondContact O-N 3.27Å; S647-A650 PolarHBondContact O-N 2.99Å; A650-K654 WeakPolarHBondContact O-CB 3.5Å; A650-K654 WeakPolarHBondContact O-CG 3.39Å; A650-K654 PolarHBondContact O-N 3.43Å
651	Y	88.8	Confident	87.4	Confident	51 Å²	51	81.4 Å²	81.4	20%	0.2	42%	0.42	C	S	.	.	H	α-helix	trans	-61.6	-51.5	174.2	170.5	-101.5	0	0	0	111.8	P637 A638 P640 S647 R648 M649 Q653 K654 L655	P637-Y651 HydrophobicContact CB-CD2 4.04Å; P637-Y651 HydrophobicContact CB-CE2 4.19Å; P637-Y651 HydrophobicContact CG-CD2 3.85Å; P637-Y651 HydrophobicContact CG-CE2 3.85Å; P637-Y651 WeakPolarHBondContact O-CE2 3.5Å; A638-Y651 WeakPolarHBondContact O-CD2 3.27Å; A638-Y651 WeakPolarHBondContact O-CE2 3.34Å; P640-Y651 VanDerWaalsContact CD-CD2 3.49Å; P640-Y651 HydrophobicContact CG-CG 4.22Å; S647-Y651 VanDerWaalsContact O-CB 3.28Å; S647-Y651 WeakPolarHBondContact O-CB 3.47Å; S647-Y651 PolarHBondContact O-N 3.3Å; R648-Y651 WeakPolarHBondContact O-CB 3.45Å; R648-Y651 PolarHBondContact O-N 2.81Å; M649-Y651 VanDerWaalsContact C-N 3.33Å; M649-Y651 PolarHBondContact O-N 3.28Å; Y651-Q653 VanDerWaalsContact C-N 3.31Å; Y651-Q653 PolarHBondContact O-N 2.92Å; Y651-K654 PolarHBondContact O-N 3.25Å; Y651-L655 HydrophobicContact CE1-CD2 4.14Å; Y651-L655 VanDerWaalsContact O-CB 3.27Å; Y651-L655 WeakPolarHBondContact O-CB 3.16Å; Y651-L655 PolarHBondContact O-N 2.97Å
652	Y	89.7	Confident	87.9	Confident	147 Å²	147	74 Å²	74	58%	0.576	39%	0.39	S	S	*	.	H	α-helix	trans	-63.8	-36.8	178.7	-71.8	-60.2	0	0	0	112.3	R648 M649 L655 A656	R648-Y652 HydrophobicContact CB-CE2 4.3Å; R648-Y652 WeakPolarHBondContact O-CD2 3.48Å; R648-Y652 PolarHBondContact O-N 3.07Å; M649-Y652 PolarHBondContact O-N 2.87Å; Y652-L655 PolarHBondContact O-N 3.01Å; Y652-A656 WeakPolarHBondContact O-CB 3.33Å; Y652-A656 PolarHBondContact O-N 3.21Å
653	Q	89.2	Confident	88.6	Confident	105 Å²	105	73.7 Å²	73.7	49%	0.491	38%	0.383	S	S	.	.	H	α-helix	trans	-63.5	-50.4	175	-173.6	176.1	-3.9	0	0	111.2	M649 Y651 L655 A656 V657	M649-Q653 WeakPolarHBondContact O-CB 2.81Å; M649-Q653 PolarHBondContact O-N 2.91Å; Y651-Q653 VanDerWaalsContact C-N 3.31Å; Y651-Q653 PolarHBondContact O-N 2.92Å; Q653-L655 VanDerWaalsContact C-N 3.31Å; Q653-L655 PolarHBondContact O-N 3.32Å; Q653-A656 PolarHBondContact O-N 2.95Å; Q653-V657 WeakPolarHBondContact O-CG2 3.44Å; Q653-V657 PolarHBondContact O-N 3.17Å
654	K	88.3	Confident	89.3	Confident	139 Å²	139	67.9 Å²	67.9	60%	0.604	35%	0.352	S	S	*	.	H	α-helix	trans	-60.8	-40.3	176.6	-75.1	-177.8	179.2	-176.6	0	112.2	P637 A650 Y651 A656 V657 A658	P637-K654 HydrophobicContact CB-CB 4.29Å; P637-K654 HydrophobicContact CG-CB 3.88Å; A650-K654 WeakPolarHBondContact O-CB 3.5Å; A650-K654 WeakPolarHBondContact O-CG 3.39Å; A650-K654 PolarHBondContact O-N 3.43Å; Y651-K654 PolarHBondContact O-N 3.25Å; K654-A656 VanDerWaalsContact C-N 3.34Å; K654-V657 PolarHBondContact O-N 2.91Å; K654-A658 WeakPolarHBondContact O-CB 3.18Å; K654-A658 PolarHBondContact O-N 3.14Å
655	L	91.2	Very high	89.7	Confident	59 Å²	59	64.4 Å²	64.4	31%	0.309	33%	0.331	S	S	.	.	H	α-helix	trans	-63.4	-40.8	176.3	-175.2	65	0	0	0	111.4	I636 P637 Y651 Y652 Q653 A658 G659	I636-L655 HydrophobicContact CG2-CD1 3.94Å; P637-L655 HydrophobicContact CG-CB 4.11Å; Y651-L655 HydrophobicContact CE1-CD2 4.14Å; Y651-L655 VanDerWaalsContact O-CB 3.27Å; Y651-L655 WeakPolarHBondContact O-CB 3.16Å; Y651-L655 PolarHBondContact O-N 2.97Å; Y652-L655 PolarHBondContact O-N 3.01Å; Q653-L655 VanDerWaalsContact C-N 3.31Å; Q653-L655 PolarHBondContact O-N 3.32Å; L655-A658 PolarHBondContact O-N 3Å; L655-G659 PolarHBondContact O-N 3.21Å
656	A	91.8	Very high	90.1	Very high	32 Å²	32	63.5 Å²	63.5	26%	0.264	32%	0.317	S	S	.	.	H	α-helix	trans	-65.4	-43.3	175.5	0	0	0	0	0	111.9	Y652 Q653 K654 A658 G659 V660 Y715	Y652-A656 WeakPolarHBondContact O-CB 3.33Å; Y652-A656 PolarHBondContact O-N 3.21Å; Q653-A656 PolarHBondContact O-N 2.95Å; K654-A656 VanDerWaalsContact C-N 3.34Å; A656-A658 VanDerWaalsContact C-N 3.34Å; A656-A658 PolarHBondContact O-N 2.99Å; A656-G659 PolarHBondContact O-N 3.38Å; A656-V660 VanDerWaalsContact O-CG2 3.3Å; A656-V660 WeakPolarHBondContact O-CG2 3.27Å; A656-V660 PolarHBondContact O-N 3.47Å; A656-Y715 HydrophobicContact CB-CD1 3.89Å; A656-Y715 HydrophobicContact CB-CE1 3.57Å
657	V	91.1	Very high	90.6	Very high	26 Å²	26	58.4 Å²	58.4	16%	0.158	29%	0.292	C	S	.	.	H	α-helix	trans	-58.4	-46.9	173.6	-179.3	0	0	0	0	110.6	Q653 K654 G659 V660 T661 Y715	Q653-V657 WeakPolarHBondContact O-CG2 3.44Å; Q653-V657 PolarHBondContact O-N 3.17Å; K654-V657 PolarHBondContact O-N 2.91Å; V657-G659 PolarHBondContact O-N 3.35Å; V657-V660 PolarHBondContact O-N 3.43Å; V657-T661 HydrophobicContact CG1-CG2 4.24Å; V657-T661 WeakPolarHBondContact O-CG2 3.31Å; V657-T661 PolarHBondContact O-N 3.38Å; V657-T661 PolarHBondContact O-OG1 2.68Å; V657-Y715 WeakPolarHBondContact CG2-O 3.3Å
658	A	90.5	Very high	91	Very high	5 Å²	5	57.1 Å²	57.1	4%	0.041	28%	0.283	C	S	.	.	H	α-helix	trans	-59.3	-46.3	176.7	0	0	0	0	0	111.8	L635 I636 K654 L655 A656 V660 T661 L662	L635-A658 HydrophobicContact CB-CB 4.09Å; I636-A658 HydrophobicContact CG1-CB 4.28Å; K654-A658 WeakPolarHBondContact O-CB 3.18Å; K654-A658 PolarHBondContact O-N 3.14Å; L655-A658 PolarHBondContact O-N 3Å; A656-A658 VanDerWaalsContact C-N 3.34Å; A656-A658 PolarHBondContact O-N 2.99Å; A658-V660 PolarHBondContact O-N 3.04Å; A658-T661 WeakPolarHBondContact CA-OG1 3.34Å; A658-T661 PolarHBondContact O-N 2.64Å; A658-T661 PolarHBondContact O-OG1 2.75Å; A658-L662 WeakPolarHBondContact O-CB 3.35Å; A658-L662 PolarHBondContact O-N 3.33Å
659	G	92.1	Very high	91.3	Very high	41 Å²	41	52.1 Å²	52.1	42%	0.423	27%	0.266	S	S	.	.	H	α-helix	trans	-59.6	-45.5	176.7	0	0	0	0	0	113.3	L655 A656 V657 L662 F663	L655-G659 PolarHBondContact O-N 3.21Å; A656-G659 PolarHBondContact O-N 3.38Å; V657-G659 PolarHBondContact O-N 3.35Å; G659-L662 PolarHBondContact O-N 2.86Å; G659-F663 WeakPolarHBondContact O-CB 3.23Å; G659-F663 PolarHBondContact O-N 3.19Å
660	V	92.8	Very high	91.7	Very high	13 Å²	13	51 Å²	51	8%	0.079	26%	0.258	C	S	.	.	H	α-helix	trans	-65.8	-41.6	177.4	178	0	0	0	0	111	A656 V657 A658 L662 F663 L664 F712 Y715 L717	A656-V660 VanDerWaalsContact O-CG2 3.3Å; A656-V660 WeakPolarHBondContact O-CG2 3.27Å; A656-V660 PolarHBondContact O-N 3.47Å; V657-V660 PolarHBondContact O-N 3.43Å; A658-V660 PolarHBondContact O-N 3.04Å; V660-L662 VanDerWaalsContact C-N 3.35Å; V660-L662 PolarHBondContact O-N 2.79Å; V660-F663 PolarHBondContact O-N 3.27Å; V660-L664 HydrophobicContact CG1-CD1 3.94Å; V660-L664 HydrophobicContact CG1-CG 4.23Å; V660-L664 WeakPolarHBondContact O-CB 3.33Å; V660-L664 WeakPolarHBondContact O-CG 3.49Å; V660-L664 PolarHBondContact O-N 2.85Å; V660-F712 HydrophobicContact CB-CD1 4.33Å; V660-F712 HydrophobicContact CG1-CB 3.86Å; V660-F712 HydrophobicContact CG1-CD1 3.56Å; V660-F712 HydrophobicContact CG1-CD2 3.97Å; V660-F712 HydrophobicContact CG1-CE1 4.05Å; V660-F712 HydrophobicContact CG1-CE2 4.41Å; V660-F712 HydrophobicContact CG1-CG 3.51Å; V660-F712 HydrophobicContact CG1-CZ 4.44Å; V660-F712 HydrophobicContact CG2-CD1 3.68Å; V660-F712 HydrophobicContact CG2-CE1 3.92Å; V660-F712 HydrophobicContact CG2-CG 4.46Å; V660-Y715 HydrophobicContact CG2-CD2 4.07Å; V660-Y715 HydrophobicContact CG2-CE2 4.29Å; V660-Y715 HydrophobicContact CG2-CG 4.22Å; V660-L717 HydrophobicContact CG1-CD1 3.96Å; V660-L717 HydrophobicContact CG1-CD2 4.07Å
661	T	91.2	Very high	92.1	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.006	25%	0.252	C	S	.	.	H	α-helix	trans	-61.9	-41.9	177.2	60.5	0	0	0	0	112.2	L635 V657 A658 A665 L717 A875	L635-T661 HydrophobicContact CD2-CG2 4.24Å; V657-T661 HydrophobicContact CG1-CG2 4.24Å; V657-T661 WeakPolarHBondContact O-CG2 3.31Å; V657-T661 PolarHBondContact O-N 3.38Å; V657-T661 PolarHBondContact O-OG1 2.68Å; A658-T661 WeakPolarHBondContact CA-OG1 3.34Å; A658-T661 PolarHBondContact O-N 2.64Å; A658-T661 PolarHBondContact O-OG1 2.75Å; T661-A665 VanDerWaalsContact O-CB 3.26Å; T661-A665 WeakPolarHBondContact O-CB 3.23Å; T661-A665 PolarHBondContact O-N 3.16Å; T661-L717 HydrophobicContact CG2-CD2 3.7Å; T661-L717 HydrophobicContact CG2-CG 4.04Å; T661-A875 HydrophobicContact CG2-CB 4.44Å; T661-A875 WeakPolarHBondContact O-CB 3.46Å
662	L	92.2	Very high	92.2	Very high	49 Å²	49	49 Å²	49	26%	0.257	24%	0.243	S	C	.	.	H	α-helix	trans	-64.5	-46.8	175.9	-177.5	150.3	0	0	0	110.8	F633 A658 G659 V660 A665 F666	F633-L662 HydrophobicContact CE1-CD1 4.31Å; A658-L662 WeakPolarHBondContact O-CB 3.35Å; A658-L662 PolarHBondContact O-N 3.33Å; G659-L662 PolarHBondContact O-N 2.86Å; V660-L662 VanDerWaalsContact C-N 3.35Å; V660-L662 PolarHBondContact O-N 2.79Å; L662-A665 PolarHBondContact O-N 3.24Å; L662-F666 HydrophobicContact CD1-CE2 4.3Å; L662-F666 HydrophobicContact CD2-CD2 3.49Å; L662-F666 VanDerWaalsContact CD2-CD2 3.49Å; L662-F666 HydrophobicContact CD2-CE2 3.57Å; L662-F666 HydrophobicContact CG-CD2 3.85Å; L662-F666 HydrophobicContact CG-CE2 3.7Å; L662-F666 VanDerWaalsContact O-CD2 3.27Å; L662-F666 WeakPolarHBondContact O-CD2 3.42Å; L662-F666 PolarHBondContact O-N 3.46Å
663	F	93.9	Very high	92.2	Very high	107 Å²	107	43.7 Å²	43.7	47%	0.469	22%	0.224	S	C	.	.	H	α-helix	trans	-58.7	-50.6	178.8	179.4	-109.6	0	0	0	112.2	G659 V660 A665 F666 I667 F712	G659-F663 WeakPolarHBondContact O-CB 3.23Å; G659-F663 PolarHBondContact O-N 3.19Å; V660-F663 PolarHBondContact O-N 3.27Å; F663-A665 VanDerWaalsContact C-N 3.31Å; F663-A665 PolarHBondContact O-N 3.46Å; F663-F666 PolarHBondContact O-N 3.23Å; F663-I667 HydrophobicContact CD1-CD1 3.78Å; F663-I667 HydrophobicContact CD2-CD1 4.47Å; F663-I667 HydrophobicContact CE1-CD1 3.29Å; F663-I667 HydrophobicContact CE1-CG1 4.46Å; F663-I667 HydrophobicContact CE2-CD1 4.06Å; F663-I667 HydrophobicContact CG-CD1 4.36Å; F663-I667 HydrophobicContact CZ-CD1 3.47Å; F663-I667 VanDerWaalsContact CZ-CD1 3.47Å; F663-I667 HydrophobicContact CZ-CG1 4.39Å; F663-I667 WeakPolarHBondContact O-CG1 3.2Å; F663-I667 PolarHBondContact O-N 3.46Å; F663-F712 HydrophobicContact CD1-CE2 4.23Å; F663-F712 AromaticContact CD1-CZ 3.95Å; F663-F712 HydrophobicContact CD1-CZ 3.95Å; F663-F712 HydrophobicContact CE1-CE2 4.23Å; F663-F712 AromaticContact CE1-CZ 3.96Å; F663-F712 HydrophobicContact CE1-CZ 3.96Å
664	L	94.2	Very high	92.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63	-37.2	177.6	-71.5	178.8	0	0	0	112.1	V660 I667 M668 I704 L707 E708 F712 L717 A875	V660-L664 HydrophobicContact CG1-CD1 3.94Å; V660-L664 HydrophobicContact CG1-CG 4.23Å; V660-L664 WeakPolarHBondContact O-CB 3.33Å; V660-L664 WeakPolarHBondContact O-CG 3.49Å; V660-L664 PolarHBondContact O-N 2.85Å; L664-I667 PolarHBondContact O-N 3.26Å; L664-M668 WeakPolarHBondContact O-CB 3.18Å; L664-M668 PolarHBondContact O-N 3.05Å; L664-I704 HydrophobicContact CB-CG2 4.02Å; L664-I704 HydrophobicContact CD1-CG2 4.27Å; L664-I704 HydrophobicContact CD2-CD1 4.48Å; L664-I704 HydrophobicContact CD2-CG2 4.42Å; L664-I704 HydrophobicContact CG-CG2 4.48Å; L664-I704 VanDerWaalsContact O-CD1 3.24Å; L664-I704 WeakPolarHBondContact O-CD1 3.26Å; L664-L707 HydrophobicContact CD2-CB 4.02Å; L664-E708 HydrophobicContact CD1-CB 4.03Å; L664-E708 HydrophobicContact CD1-CG 4.38Å; L664-F712 HydrophobicContact CD1-CD2 4.41Å; L664-F712 HydrophobicContact CD2-CD2 4.16Å; L664-F712 HydrophobicContact CD2-CE2 4.03Å; L664-F712 HydrophobicContact CG-CD2 4.49Å; L664-L717 HydrophobicContact CD1-CD2 3.68Å; L664-A875 HydrophobicContact CB-CB 3.92Å
665	A	92.7	Very high	92.4	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-67	-38.3	176.8	0	0	0	0	0	113	M632 T661 L662 F663 M668 L669 A875 G879	M632-A665 HydrophobicContact CE-CB 3.31Å; M632-A665 HydrophobicContact SD-CB 4.1Å; T661-A665 VanDerWaalsContact O-CB 3.26Å; T661-A665 WeakPolarHBondContact O-CB 3.23Å; T661-A665 PolarHBondContact O-N 3.16Å; L662-A665 PolarHBondContact O-N 3.24Å; F663-A665 VanDerWaalsContact C-N 3.31Å; F663-A665 PolarHBondContact O-N 3.46Å; A665-M668 WeakPolarHBondContact O-CB 3.41Å; A665-M668 PolarHBondContact O-N 3.36Å; A665-L669 PolarHBondContact O-N 2.88Å; A665-L669 VanDerWaalsContact O-N 3.09Å; A665-A875 WeakPolarHBondContact CA-O 3.49Å; A665-A875 VanDerWaalsContact CB-O 3.3Å; A665-A875 WeakPolarHBondContact CB-O 3.21Å; A665-G879 VanDerWaalsContact O-CA 3.22Å; A665-G879 WeakPolarHBondContact O-CA 3.21Å
666	F	94.2	Very high	91.9	Very high	79 Å²	79	34.1 Å²	34.1	35%	0.346	18%	0.183	S	C	.	.	H	α-helix	trans	-69.7	-37.2	173.6	-83.6	-70.8	0	0	0	112.5	L662 F663 M668 L669 Q670 L882	L662-F666 HydrophobicContact CD1-CE2 4.3Å; L662-F666 HydrophobicContact CD2-CD2 3.49Å; L662-F666 VanDerWaalsContact CD2-CD2 3.49Å; L662-F666 HydrophobicContact CD2-CE2 3.57Å; L662-F666 HydrophobicContact CG-CD2 3.85Å; L662-F666 HydrophobicContact CG-CE2 3.7Å; L662-F666 VanDerWaalsContact O-CD2 3.27Å; L662-F666 WeakPolarHBondContact O-CD2 3.42Å; L662-F666 PolarHBondContact O-N 3.46Å; F663-F666 PolarHBondContact O-N 3.23Å; F666-M668 VanDerWaalsContact C-N 3.3Å; F666-M668 PolarHBondContact O-N 2.73Å; F666-L669 HydrophobicContact CD1-CD2 4.31Å; F666-L669 PolarHBondContact O-N 2.95Å; F666-Q670 WeakPolarHBondContact O-CG 3.2Å; F666-Q670 PolarHBondContact O-N 3.37Å; F666-L882 HydrophobicContact CE1-CD1 4.36Å
667	I	95.7	Very high	91.7	Very high	47 Å²	47	38 Å²	38	24%	0.241	20%	0.196	C	C	.	.	H	α-helix	trans	-60	-44.5	171.9	-71.4	174.3	0	0	0	110.4	F663 L664 L669 Q670 F671 L703 I704 L707	F663-I667 HydrophobicContact CD1-CD1 3.78Å; F663-I667 HydrophobicContact CD2-CD1 4.47Å; F663-I667 HydrophobicContact CE1-CD1 3.29Å; F663-I667 HydrophobicContact CE1-CG1 4.46Å; F663-I667 HydrophobicContact CE2-CD1 4.06Å; F663-I667 HydrophobicContact CG-CD1 4.36Å; F663-I667 HydrophobicContact CZ-CD1 3.47Å; F663-I667 VanDerWaalsContact CZ-CD1 3.47Å; F663-I667 HydrophobicContact CZ-CG1 4.39Å; F663-I667 WeakPolarHBondContact O-CG1 3.2Å; F663-I667 PolarHBondContact O-N 3.46Å; L664-I667 PolarHBondContact O-N 3.26Å; I667-L669 VanDerWaalsContact C-N 3.34Å; I667-L669 PolarHBondContact O-N 3.27Å; I667-Q670 PolarHBondContact O-N 2.86Å; I667-F671 VanDerWaalsContact O-CB 3.29Å; I667-F671 WeakPolarHBondContact O-CB 3.41Å; I667-F671 PolarHBondContact O-N 3.37Å; I667-L703 HydrophobicContact CG2-CD2 4.48Å; I667-I704 HydrophobicContact CB-CD1 4.15Å; I667-I704 HydrophobicContact CG2-CD1 3.84Å; I667-L707 HydrophobicContact CD1-CD1 4.45Å; I667-L707 HydrophobicContact CG2-CD1 3.94Å
668	M	93.4	Very high	91.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-56.8	-48.3	177.2	-179.6	57.7	177.3	0	0	111.5	L664 A665 F666 F671 C672 G700 M701 I704 M880	L664-M668 WeakPolarHBondContact O-CB 3.18Å; L664-M668 PolarHBondContact O-N 3.05Å; A665-M668 WeakPolarHBondContact O-CB 3.41Å; A665-M668 PolarHBondContact O-N 3.36Å; F666-M668 VanDerWaalsContact C-N 3.3Å; F666-M668 PolarHBondContact O-N 2.73Å; M668-F671 PolarHBondContact O-N 3.37Å; M668-C672 WeakPolarHBondContact O-CB 3.2Å; M668-C672 PolarHBondContact O-N 2.85Å; M668-C672 PolarHBondContact O-SG 3.22Å; M668-G700 WeakPolarHBondContact SD-CA 3.02Å; M668-G700 VanDerWaalsContact SD-O 3.41Å; M668-M701 HydrophobicContact CE-CG 3.99Å; M668-I704 HydrophobicContact CB-CD1 3.94Å; M668-I704 HydrophobicContact CB-CG1 3.76Å; M668-I704 HydrophobicContact CG-CG1 4.22Å; M668-I704 HydrophobicContact SD-CG1 3.86Å; M668-M880 HydrophobicContact CE-CB 4.13Å
669	L	93	Very high	90.9	Very high	17 Å²	17	41.3 Å²	41.3	9%	0.089	21%	0.209	C	C	.	.	H	α-helix	trans	-57	-52.4	176.2	171.5	64.8	0	0	0	111.3	A665 F666 I667 F671 C672 L673 L882 V886	A665-L669 PolarHBondContact O-N 2.88Å; A665-L669 VanDerWaalsContact O-N 3.09Å; F666-L669 HydrophobicContact CD1-CD2 4.31Å; F666-L669 PolarHBondContact O-N 2.95Å; I667-L669 VanDerWaalsContact C-N 3.34Å; I667-L669 PolarHBondContact O-N 3.27Å; L669-F671 PolarHBondContact O-N 3.13Å; L669-C672 PolarHBondContact O-N 3.13Å; L669-L673 HydrophobicContact CD1-CD1 3.86Å; L669-L673 HydrophobicContact CD1-CG 4.13Å; L669-L673 HydrophobicContact CG-CD1 3.91Å; L669-L673 WeakPolarHBondContact O-CB 3.01Å; L669-L673 VanDerWaalsContact O-CG 3.3Å; L669-L673 WeakPolarHBondContact O-CG 3.32Å; L669-L673 PolarHBondContact O-N 3.42Å; L669-L882 HydrophobicContact CB-CB 4.48Å; L669-L882 HydrophobicContact CD1-CB 4.09Å; L669-L882 HydrophobicContact CD2-CB 4.15Å; L669-L882 HydrophobicContact CD2-CD1 4.26Å; L669-L882 HydrophobicContact CG-CB 4.47Å; L669-V886 HydrophobicContact CD1-CG2 4.38Å
670	Q	94.5	Very high	89.8	Confident	107 Å²	107	44.5 Å²	44.5	50%	0.5	21%	0.209	S	C	.	.	H	α-helix	trans	-63.4	-42.8	-177.7	-69.2	-62.2	-8.3	0	0	111.9	F666 I667 C672 L673 I674	F666-Q670 WeakPolarHBondContact O-CG 3.2Å; F666-Q670 PolarHBondContact O-N 3.37Å; I667-Q670 PolarHBondContact O-N 2.86Å; Q670-C672 PolarHBondContact O-N 2.99Å; Q670-L673 PolarHBondContact O-N 3.06Å; Q670-I674 VanDerWaalsContact O-CG1 3.27Å; Q670-I674 WeakPolarHBondContact O-CG1 2.97Å; Q670-I674 PolarHBondContact O-N 3.27Å
671	F	94.3	Very high	88.9	Confident	56 Å²	56	44.9 Å²	44.9	25%	0.246	22%	0.215	C	C	.	.	H	α-helix	trans	-60	-46.1	176.6	-178	-103.4	0	0	0	111.8	I667 M668 L669 L673 I674 L675 L699 L703	I667-F671 VanDerWaalsContact O-CB 3.29Å; I667-F671 WeakPolarHBondContact O-CB 3.41Å; I667-F671 PolarHBondContact O-N 3.37Å; M668-F671 PolarHBondContact O-N 3.37Å; L669-F671 PolarHBondContact O-N 3.13Å; F671-L673 VanDerWaalsContact C-N 3.33Å; F671-L673 PolarHBondContact O-N 2.96Å; F671-I674 PolarHBondContact O-N 3.35Å; F671-L675 HydrophobicContact CD1-CD1 4.03Å; F671-L675 HydrophobicContact CD1-CG 4.47Å; F671-L675 HydrophobicContact CE1-CD1 3.39Å; F671-L675 HydrophobicContact CE1-CG 4.09Å; F671-L675 HydrophobicContact CZ-CD1 3.7Å; F671-L675 HydrophobicContact CZ-CD2 4.4Å; F671-L675 HydrophobicContact CZ-CG 4.12Å; F671-L675 PolarHBondContact O-N 3.19Å; F671-L699 HydrophobicContact CE1-CB 4.06Å; F671-L699 HydrophobicContact CZ-CB 4.47Å; F671-L703 HydrophobicContact CB-CD2 3.93Å; F671-L703 HydrophobicContact CD1-CD2 3.87Å; F671-L703 HydrophobicContact CD2-CD2 3.44Å; F671-L703 VanDerWaalsContact CD2-CD2 3.44Å; F671-L703 HydrophobicContact CE1-CD2 4.2Å; F671-L703 HydrophobicContact CE2-CD2 3.82Å; F671-L703 HydrophobicContact CG-CD2 3.46Å; F671-L703 VanDerWaalsContact CG-CD2 3.46Å; F671-L703 HydrophobicContact CZ-CD2 4.17Å
672	C	90	Very high	88.4	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-65.3	-36.3	177.7	-65.9	0	0	0	0	112.2	M668 L669 Q670 A676 Y883	M668-C672 WeakPolarHBondContact O-CB 3.2Å; M668-C672 PolarHBondContact O-N 2.85Å; M668-C672 PolarHBondContact O-SG 3.22Å; L669-C672 PolarHBondContact O-N 3.13Å; Q670-C672 PolarHBondContact O-N 2.99Å; C672-A676 WeakPolarHBondContact O-CB 3.43Å; C672-A676 PolarHBondContact O-N 3.46Å; C672-Y883 HydrophobicContact CB-CD1 4.36Å; C672-Y883 HydrophobicContact CB-CD2 3.26Å; C672-Y883 HydrophobicContact CB-CE2 3.58Å; C672-Y883 HydrophobicContact CB-CG 3.71Å
673	L	90.4	Very high	87.7	Confident	34 Å²	34	57.5 Å²	57.5	18%	0.178	27%	0.271	C	S	.	.	H	α-helix	trans	-65.9	-42.4	174.4	-73.5	171.2	0	0	0	112.1	L669 Q670 F671 A676 Q677 V886 M887	L669-L673 HydrophobicContact CD1-CD1 3.86Å; L669-L673 HydrophobicContact CD1-CG 4.13Å; L669-L673 HydrophobicContact CG-CD1 3.91Å; L669-L673 WeakPolarHBondContact O-CB 3.01Å; L669-L673 VanDerWaalsContact O-CG 3.3Å; L669-L673 WeakPolarHBondContact O-CG 3.32Å; L669-L673 PolarHBondContact O-N 3.42Å; Q670-L673 PolarHBondContact O-N 3.06Å; F671-L673 VanDerWaalsContact C-N 3.33Å; F671-L673 PolarHBondContact O-N 2.96Å; L673-A676 CarbonylContact O-C 3.58Å; L673-A676 PolarHBondContact O-N 2.74Å; L673-Q677 WeakPolarHBondContact O-CG 3.41Å; L673-Q677 PolarHBondContact O-N 3.21Å; L673-V886 HydrophobicContact CD2-CG1 4.19Å; L673-M887 HydrophobicContact CD2-CE 3.56Å
674	I	91.6	Very high	87.2	Confident	83 Å²	83	58.3 Å²	58.3	43%	0.426	27%	0.274	S	S	.	.	H	α-helix	trans	-62.1	-47.6	175.7	-69.6	164.2	0	0	0	110.1	Q670 F671 A676 Q677 L678	Q670-I674 VanDerWaalsContact O-CG1 3.27Å; Q670-I674 WeakPolarHBondContact O-CG1 2.97Å; Q670-I674 PolarHBondContact O-N 3.27Å; F671-I674 PolarHBondContact O-N 3.35Å; I674-A676 VanDerWaalsContact C-N 3.27Å; I674-A676 PolarHBondContact O-N 3.11Å; I674-Q677 CarbonylContact O-C 3.56Å; I674-Q677 WeakPolarHBondContact O-CB 3.46Å; I674-Q677 PolarHBondContact O-N 3.37Å; I674-L678 HydrophobicContact CG2-CD1 4.1Å; I674-L678 HydrophobicContact CG2-CG 4.41Å; I674-L678 WeakPolarHBondContact O-CG 3.49Å; I674-L678 PolarHBondContact O-N 3.29Å
675	L	89.3	Confident	86.6	Confident	12 Å²	12	67.3 Å²	67.3	6%	0.063	31%	0.308	C	S	.	.	H	α-helix	trans	-60.9	-36.6	175.6	-69.8	-173.7	0	0	0	112.2	F671 L678 K679 N696 L699	F671-L675 HydrophobicContact CD1-CD1 4.03Å; F671-L675 HydrophobicContact CD1-CG 4.47Å; F671-L675 HydrophobicContact CE1-CD1 3.39Å; F671-L675 HydrophobicContact CE1-CG 4.09Å; F671-L675 HydrophobicContact CZ-CD1 3.7Å; F671-L675 HydrophobicContact CZ-CD2 4.4Å; F671-L675 HydrophobicContact CZ-CG 4.12Å; F671-L675 PolarHBondContact O-N 3.19Å; L675-L678 HydrophobicContact CD2-CD1 4.05Å; L675-L678 PolarHBondContact O-N 3.44Å; L675-K679 PolarHBondContact O-N 3.31Å; L675-N696 HydrophobicContact CB-CB 3.87Å; L675-N696 HydrophobicContact CD1-CB 3.88Å; L675-L699 HydrophobicContact CD1-CB 4.3Å; L675-L699 HydrophobicContact CD1-CD1 4.31Å
676	A	82.1	Confident	85.7	Confident	8 Å²	8	71.3 Å²	71.3	7%	0.066	32%	0.323	C	S	.	.	H	α-helix	trans	-71.5	-27.2	174.6	0	0	0	0	0	113.6	C672 L673 I674 R680 Y883 M887	C672-A676 WeakPolarHBondContact O-CB 3.43Å; C672-A676 PolarHBondContact O-N 3.46Å; L673-A676 CarbonylContact O-C 3.58Å; L673-A676 PolarHBondContact O-N 2.74Å; I674-A676 VanDerWaalsContact C-N 3.27Å; I674-A676 PolarHBondContact O-N 3.11Å; A676-R680 PolarHBondContact O-NE 3.1Å; A676-Y883 HydrophobicContact CB-CE2 4.47Å; A676-M887 HydrophobicContact CB-CE 3.49Å; A676-M887 VanDerWaalsContact CB-CE 3.49Å
677	Q	86.2	Confident	84.6	Confident	113 Å²	113	72.6 Å²	72.6	53%	0.528	33%	0.334	S	S	.	.	H	α-helix	trans	-74.6	-43.5	170.2	-73.9	176.7	-0.8	0	0	111.1	L673 I674 K679 R680 G681	L673-Q677 WeakPolarHBondContact O-CG 3.41Å; L673-Q677 PolarHBondContact O-N 3.21Å; I674-Q677 CarbonylContact O-C 3.56Å; I674-Q677 WeakPolarHBondContact O-CB 3.46Å; I674-Q677 PolarHBondContact O-N 3.37Å; Q677-K679 PolarHBondContact O-N 3.32Å; Q677-R680 CarbonylContact O-C 3.57Å; Q677-R680 WeakPolarHBondContact O-CA 3.32Å; Q677-R680 WeakPolarHBondContact O-CB 3.42Å; Q677-R680 PolarHBondContact O-N 2.86Å; Q677-G681 PolarHBondContact O-N 2.93Å
678	L	86.1	Confident	83.9	Confident	45 Å²	45	74.3 Å²	74.3	24%	0.236	34%	0.343	C	S	.	.	H	α-helix	trans	-57.7	-38	173.1	-72.7	171.3	0	0	0	111.2	I674 L675 R680 G681 F684 R689	I674-L678 HydrophobicContact CG2-CD1 4.1Å; I674-L678 HydrophobicContact CG2-CG 4.41Å; I674-L678 WeakPolarHBondContact O-CG 3.49Å; I674-L678 PolarHBondContact O-N 3.29Å; L675-L678 HydrophobicContact CD2-CD1 4.05Å; L675-L678 PolarHBondContact O-N 3.44Å; L678-R680 PolarHBondContact O-N 3.03Å; L678-G681 PolarHBondContact O-N 2.91Å; L678-F684 HydrophobicContact CD2-CE2 4.32Å; L678-R689 WeakPolarHBondContact O-CD 2.93Å; L678-R689 VanDerWaalsContact O-CG 3.29Å; L678-R689 WeakPolarHBondContact O-CG 3.38Å
679	K	79.2	Confident	83.3	Confident	55 Å²	55	75.3 Å²	75.3	24%	0.239	35%	0.347	C	S	.	.	H	α-helix	trans	-55.1	-35.3	171.9	-170.2	-172.6	-178.6	176.5	0	113.1	L675 Q677 R689 W1058	L675-K679 PolarHBondContact O-N 3.31Å; Q677-K679 PolarHBondContact O-N 3.32Å; K679-R689 VanDerWaalsContact CA-CG 3.46Å; K679-R689 WeakPolarHBondContact O-CD 3.43Å; K679-R689 VanDerWaalsContact O-CG 3.31Å; K679-R689 WeakPolarHBondContact O-CG 3.35Å; K679-R689 PolarHBondContact O-NE 3.45Å; K679-W1058 VanDerWaalsContact NZ-CH2 3.26Å
680	R	69.2	Low	82.2	Confident	109 Å²	109	79.4 Å²	79.4	41%	0.411	36%	0.364	S	S	.	.	H	α-helix	trans	-91.3	-19.7	-179.7	-68.1	-179.3	-72.5	169.2	2.9	113.2	A676 Q677 L678	A676-R680 PolarHBondContact O-NE 3.1Å; Q677-R680 CarbonylContact O-C 3.57Å; Q677-R680 WeakPolarHBondContact O-CA 3.32Å; Q677-R680 WeakPolarHBondContact O-CB 3.42Å; Q677-R680 PolarHBondContact O-N 2.86Å; L678-R680 PolarHBondContact O-N 3.03Å
681	G	74.5	Confident	81.3	Confident	20 Å²	20	79 Å²	79	21%	0.206	36%	0.364	C	S	.	.	S	Bend	trans	-77.7	169.3	-177.8	0	0	0	0	0	113.4	Q677 L678 Y683 R689	Q677-G681 PolarHBondContact O-N 2.93Å; L678-G681 PolarHBondContact O-N 2.91Å; G681-Y683 VanDerWaalsContact C-N 3.33Å; G681-R689 WeakPolarHBondContact O-CD 3.37Å; G681-R689 PolarHBondContact O-NH1 3.49Å
682	N	80.7	Confident	80.7	Confident	145 Å²	145	78.4 Å²	78.4	78%	0.775	36%	0.363	S	S	*	.	S	Bend	trans	-89.3	-1.5	176.7	-66	-16.3	0	0	0	113.2
683	Y	76	Confident	79.9	Confident	171 Å²	171	78.6 Å²	78.6	67%	0.671	37%	0.365	S	S	*	.	S	Bend	trans	-73.4	137.5	175.4	-54.8	-72.9	0	0	0	110.1	G681	G681-Y683 VanDerWaalsContact C-N 3.33Å
684	F	83.8	Confident	78.9	Confident	123 Å²	123	77.9 Å²	77.9	54%	0.539	37%	0.365	S	S	.	.	S	Bend	trans	70.7	155.9	-173.2	-51.9	-78.3	0	0	0	116.6	L678 I688 L692	L678-F684 HydrophobicContact CD2-CE2 4.32Å; F684-I688 HydrophobicContact CB-CB 4.34Å; F684-I688 HydrophobicContact CB-CG2 4.2Å; F684-I688 HydrophobicContact CD1-CG2 4.46Å; F684-I688 HydrophobicContact CG-CG2 4.42Å; F684-L692 HydrophobicContact CD2-CD1 4.43Å
685	R	82.5	Confident	78.3	Confident	189 Å²	189	75.7 Å²	75.7	71%	0.713	35%	0.354	S	S	*	.			trans	-62.6	143.5	173.5	-169.6	174	-178.6	178.2	1.1	110.3	N687 I688 R689	R685-N687 VanDerWaalsContact C-N 3.26Å; R685-N687 PolarHBondContact O-N 3.47Å; R685-I688 HydrophobicContact CB-CD1 4.35Å; R685-I688 WeakPolarHBondContact O-CB 3.46Å; R685-I688 PolarHBondContact O-N 2.94Å; R685-R689 PolarHBondContact O-N 3.24Å
686	R	72.1	Confident	78	Confident	84 Å²	84	75.7 Å²	75.7	32%	0.317	35%	0.354	S	S	.	.	H	α-helix	trans	-44.6	-43.9	-178.8	-170.3	-177.7	-170.1	177.9	8.9	114.6	R689 K690 T1060	R686-R689 PolarHBondContact O-N 3.29Å; R686-K690 HydrophobicContact CG-CD 4.48Å; R686-K690 WeakPolarHBondContact O-CG 3.45Å; R686-K690 PolarHBondContact O-N 2.67Å; R686-T1060 PolarHBondContact NE-OXT 3.25Å; R686-T1060 PolarHBondContact NH2-OXT 3.17Å
687	N	71.6	Confident	77.7	Confident	107 Å²	107	76 Å²	76	57%	0.572	36%	0.355	S	S	*	.	H	α-helix	trans	-65.7	-44.6	-179.3	-67.8	-1.8	0	0	0	112	R685 K690 L691	R685-N687 VanDerWaalsContact C-N 3.26Å; R685-N687 PolarHBondContact O-N 3.47Å; N687-K690 PolarHBondContact O-N 3.23Å; N687-L691 WeakPolarHBondContact O-CB 3.48Å; N687-L691 PolarHBondContact O-N 3.44Å
688	I	81.7	Confident	77.6	Confident	83 Å²	83	71.5 Å²	71.5	43%	0.426	34%	0.335	S	S	.	.	H	α-helix	trans	-64.3	-43.9	177.4	-61.5	173.5	0	0	0	109.6	F684 R685 K690 L691 L692	F684-I688 HydrophobicContact CB-CB 4.34Å; F684-I688 HydrophobicContact CB-CG2 4.2Å; F684-I688 HydrophobicContact CD1-CG2 4.46Å; F684-I688 HydrophobicContact CG-CG2 4.42Å; R685-I688 HydrophobicContact CB-CD1 4.35Å; R685-I688 WeakPolarHBondContact O-CB 3.46Å; R685-I688 PolarHBondContact O-N 2.94Å; I688-K690 PolarHBondContact O-N 3.1Å; I688-L691 PolarHBondContact O-N 3.39Å; I688-L691 VanDerWaalsContact O-N 3.16Å; I688-L692 HydrophobicContact CG2-CD1 3.83Å; I688-L692 HydrophobicContact CG2-CG 4.14Å; I688-L692 WeakPolarHBondContact O-CB 3.43Å; I688-L692 WeakPolarHBondContact O-CG 3.36Å; I688-L692 PolarHBondContact O-N 2.99Å
689	R	80.8	Confident	77.7	Confident	21 Å²	21	72.1 Å²	72.1	8%	0.079	34%	0.339	C	S	.	.	H	α-helix	trans	-60	-42.9	178	-172.6	171.4	73.9	-149.1	0.3	112.8	L678 K679 G681 R685 R686 G693 T1060	L678-R689 WeakPolarHBondContact O-CD 2.93Å; L678-R689 VanDerWaalsContact O-CG 3.29Å; L678-R689 WeakPolarHBondContact O-CG 3.38Å; K679-R689 VanDerWaalsContact CA-CG 3.46Å; K679-R689 WeakPolarHBondContact O-CD 3.43Å; K679-R689 VanDerWaalsContact O-CG 3.31Å; K679-R689 WeakPolarHBondContact O-CG 3.35Å; K679-R689 PolarHBondContact O-NE 3.45Å; G681-R689 WeakPolarHBondContact O-CD 3.37Å; G681-R689 PolarHBondContact O-NH1 3.49Å; R685-R689 PolarHBondContact O-N 3.24Å; R686-R689 PolarHBondContact O-N 3.29Å; R689-G693 PolarHBondContact O-N 3.08Å; R689-T1060 VanDerWaalsContact NH2-C 3.28Å; R689-T1060 PolarHBondContact NH2-O 3.3Å
690	K	70.1	Confident	78.2	Confident	103 Å²	103	69.5 Å²	69.5	45%	0.448	33%	0.327	S	S	.	.	H	α-helix	trans	-63.1	-43	173.9	-74.7	178.1	179.8	-177.9	0	111.7	R686 N687 I688 A694	R686-K690 HydrophobicContact CG-CD 4.48Å; R686-K690 WeakPolarHBondContact O-CG 3.45Å; R686-K690 PolarHBondContact O-N 2.67Å; N687-K690 PolarHBondContact O-N 3.23Å; I688-K690 PolarHBondContact O-N 3.1Å; K690-A694 VanDerWaalsContact O-CB 3.28Å; K690-A694 WeakPolarHBondContact O-CB 3.23Å; K690-A694 PolarHBondContact O-N 3.32Å
691	L	75.4	Confident	79	Confident	97 Å²	97	65.2 Å²	65.2	51%	0.508	31%	0.312	S	S	.	.	H	α-helix	trans	-65.5	-49.3	178.5	-175.4	66.8	0	0	0	112.1	N687 I688 G693 A694 L695	N687-L691 WeakPolarHBondContact O-CB 3.48Å; N687-L691 PolarHBondContact O-N 3.44Å; I688-L691 PolarHBondContact O-N 3.39Å; I688-L691 VanDerWaalsContact O-N 3.16Å; L691-G693 VanDerWaalsContact C-N 3.32Å; L691-G693 PolarHBondContact O-N 3.2Å; L691-A694 WeakPolarHBondContact O-CB 3.29Å; L691-A694 PolarHBondContact O-N 3.15Å; L691-A694 VanDerWaalsContact O-N 3.07Å; L691-L695 HydrophobicContact CD1-CD1 3.73Å; L691-L695 HydrophobicContact CD1-CG 4.17Å; L691-L695 HydrophobicContact CG-CD1 3.93Å; L691-L695 PolarHBondContact O-N 3.29Å
692	L	81.3	Confident	79.8	Confident	44 Å²	44	70 Å²	70	23%	0.23	33%	0.332	C	S	.	.	H	α-helix	trans	-60.6	-41.8	177.5	-74.1	175.3	0	0	0	112	F684 I688 A694 L695 N696 L699	F684-L692 HydrophobicContact CD2-CD1 4.43Å; I688-L692 HydrophobicContact CG2-CD1 3.83Å; I688-L692 HydrophobicContact CG2-CG 4.14Å; I688-L692 WeakPolarHBondContact O-CB 3.43Å; I688-L692 WeakPolarHBondContact O-CG 3.36Å; I688-L692 PolarHBondContact O-N 2.99Å; L692-A694 VanDerWaalsContact C-N 3.28Å; L692-A694 PolarHBondContact O-N 3.04Å; L692-L695 PolarHBondContact O-N 3.23Å; L692-N696 PolarHBondContact O-N 2.88Å; L692-L699 HydrophobicContact CD2-CD1 4.14Å
693	G	73	Confident	80.4	Confident	4 Å²	4	66 Å²	66	4%	0.041	31%	0.31	C	S	.	.	H	α-helix	trans	-67.7	-26.5	175.3	0	0	0	0	0	113.8	R689 L691	R689-G693 PolarHBondContact O-N 3.08Å; L691-G693 VanDerWaalsContact C-N 3.32Å; L691-G693 PolarHBondContact O-N 3.2Å
694	A	69.1	Low	81.2	Confident	20 Å²	20	57.8 Å²	57.8	17%	0.165	28%	0.278	C	S	.	.	H	α-helix	trans	-83.2	-33.6	177.3	0	0	0	0	0	112.8	F503 K690 L691 L692 N696	F503-A694 HydrophobicContact CB-CB 4.16Å; F503-A694 VanDerWaalsContact CD2-CA 3.49Å; F503-A694 HydrophobicContact CD2-CB 3.54Å; F503-A694 WeakPolarHBondContact CD2-O 3.4Å; F503-A694 HydrophobicContact CE2-CB 4.29Å; F503-A694 HydrophobicContact CG-CB 4.14Å; K690-A694 VanDerWaalsContact O-CB 3.28Å; K690-A694 WeakPolarHBondContact O-CB 3.23Å; K690-A694 PolarHBondContact O-N 3.32Å; L691-A694 WeakPolarHBondContact O-CB 3.29Å; L691-A694 PolarHBondContact O-N 3.15Å; L691-A694 VanDerWaalsContact O-N 3.07Å; L692-A694 VanDerWaalsContact C-N 3.28Å; L692-A694 PolarHBondContact O-N 3.04Å; A694-N696 VanDerWaalsContact C-N 3.34Å
695	L	79.7	Confident	81.6	Confident	37 Å²	37	52.8 Å²	52.8	19%	0.194	26%	0.258	C	S	.	.	S	Bend	trans	-94.4	14.5	-179.9	-64	179.2	0	0	0	113.1	L502 F506 L691 L692 V697 P698 L699	L502-L695 HydrophobicContact CD2-CD2 3.94Å; F506-L695 HydrophobicContact CD2-CD2 4.12Å; F506-L695 HydrophobicContact CE2-CD2 3.98Å; L691-L695 HydrophobicContact CD1-CD1 3.73Å; L691-L695 HydrophobicContact CD1-CG 4.17Å; L691-L695 HydrophobicContact CG-CD1 3.93Å; L691-L695 PolarHBondContact O-N 3.29Å; L692-L695 PolarHBondContact O-N 3.23Å; L695-V697 PolarHBondContact O-N 2.89Å; L695-P698 WeakPolarHBondContact O-CD 3.44Å; L695-L699 HydrophobicContact CB-CD1 3.83Å; L695-L699 HydrophobicContact CB-CG 4Å; L695-L699 WeakPolarHBondContact O-CB 3.41Å; L695-L699 WeakPolarHBondContact O-CG 3.48Å; L695-L699 PolarHBondContact O-N 3.36Å
696	N	81.8	Confident	82.1	Confident	11 Å²	11	45 Å²	45	6%	0.059	24%	0.237	C	C	.	.	H	α-helix	trans	-59.9	-43.2	-173.5	66.5	-22.2	0	0	0	113.7	L675 L692 A694 G700 Y883	L675-N696 HydrophobicContact CB-CB 3.87Å; L675-N696 HydrophobicContact CD1-CB 3.88Å; L692-N696 PolarHBondContact O-N 2.88Å; A694-N696 VanDerWaalsContact C-N 3.34Å; N696-G700 PolarHBondContact O-N 3.43Å; N696-Y883 PolarHBondContact ND2-OH 3.19Å
697	V	77.1	Confident	83.1	Confident	16 Å²	16	42.9 Å²	42.9	10%	0.097	23%	0.231	C	C	.	.	H	α-helix	trans	-70.7	-50.3	179.8	173.7	0	0	0	0	111.5	S510 L695 L699 G700 M701 M880 Y883	S510-V697 WeakPolarHBondContact OG-CG1 3.45Å; L695-V697 PolarHBondContact O-N 2.89Å; V697-L699 PolarHBondContact O-N 2.89Å; V697-G700 PolarHBondContact O-N 3.02Å; V697-M701 HydrophobicContact CG1-CE 3.87Å; V697-M701 WeakPolarHBondContact O-CG 3.25Å; V697-M701 PolarHBondContact O-N 3.4Å; V697-M880 HydrophobicContact CG1-CG 3.7Å; V697-M880 HydrophobicContact CG2-CG 4.41Å; V697-Y883 HydrophobicContact CG2-CD1 4.2Å; V697-Y883 HydrophobicContact CG2-CE1 4.09Å
698	P	82.8	Confident	84.1	Confident	17 Å²	17	38.8 Å²	38.8	11%	0.11	21%	0.209	C	C	.	.	H	α-helix	trans	-60.1	-43.6	175.7	-25.8	34.3	0	0	0	113.8	F506 L695 G700 M701 L702	F506-P698 HydrophobicContact CB-CG 3.72Å; F506-P698 HydrophobicContact CD1-CB 4.18Å; F506-P698 HydrophobicContact CD1-CG 3.31Å; F506-P698 HydrophobicContact CD2-CG 3.57Å; F506-P698 HydrophobicContact CE1-CB 4.05Å; F506-P698 HydrophobicContact CE1-CG 3.65Å; F506-P698 HydrophobicContact CE2-CB 4.5Å; F506-P698 HydrophobicContact CE2-CG 3.9Å; F506-P698 HydrophobicContact CG-CB 4.44Å; F506-P698 HydrophobicContact CG-CG 3.25Å; F506-P698 HydrophobicContact CZ-CB 4.22Å; F506-P698 HydrophobicContact CZ-CG 3.93Å; L695-P698 WeakPolarHBondContact O-CD 3.44Å; P698-G700 VanDerWaalsContact C-N 3.25Å; P698-G700 PolarHBondContact O-N 2.88Å; P698-M701 PolarHBondContact O-N 2.77Å; P698-L702 WeakPolarHBondContact O-CG 3.36Å; P698-L702 PolarHBondContact O-N 3.41Å
699	L	88.9	Confident	84.5	Confident	59 Å²	59	41 Å²	41	31%	0.309	21%	0.212	S	C	.	.	H	α-helix	trans	-62.4	-37.6	176.5	-70.2	172.8	0	0	0	110.9	F671 L675 L692 L695 V697 L702 L703	F671-L699 HydrophobicContact CE1-CB 4.06Å; F671-L699 HydrophobicContact CZ-CB 4.47Å; L675-L699 HydrophobicContact CD1-CB 4.3Å; L675-L699 HydrophobicContact CD1-CD1 4.31Å; L692-L699 HydrophobicContact CD2-CD1 4.14Å; L695-L699 HydrophobicContact CB-CD1 3.83Å; L695-L699 HydrophobicContact CB-CG 4Å; L695-L699 WeakPolarHBondContact O-CB 3.41Å; L695-L699 WeakPolarHBondContact O-CG 3.48Å; L695-L699 PolarHBondContact O-N 3.36Å; V697-L699 PolarHBondContact O-N 2.89Å; L699-L702 PolarHBondContact O-N 2.89Å; L699-L703 WeakPolarHBondContact O-CB 3.23Å; L699-L703 PolarHBondContact O-N 3.49Å
700	G	89.3	Confident	85.1	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.6	-45.1	173.1	0	0	0	0	0	112.4	M668 N696 V697 P698 L702 L703 I704	M668-G700 WeakPolarHBondContact SD-CA 3.02Å; M668-G700 VanDerWaalsContact SD-O 3.41Å; N696-G700 PolarHBondContact O-N 3.43Å; V697-G700 PolarHBondContact O-N 3.02Å; P698-G700 VanDerWaalsContact C-N 3.25Å; P698-G700 PolarHBondContact O-N 2.88Å; G700-L702 VanDerWaalsContact C-N 3.34Å; G700-L702 PolarHBondContact O-N 2.85Å; G700-L703 WeakPolarHBondContact O-CB 3.49Å; G700-L703 PolarHBondContact O-N 2.96Å; G700-I704 WeakPolarHBondContact O-CG1 3.34Å; G700-I704 PolarHBondContact O-N 3.46Å
701	M	87.2	Confident	86.2	Confident	19 Å²	19	47.8 Å²	47.8	9%	0.094	25%	0.247	C	C	.	.	H	α-helix	trans	-60.3	-44.7	176.6	-70.3	178.8	174.7	0	0	111.6	S510 M668 V697 P698 L703 I704 T705 I872 L877 M880	S510-M701 WeakPolarHBondContact OG-CE 3.22Å; M668-M701 HydrophobicContact CE-CG 3.99Å; V697-M701 HydrophobicContact CG1-CE 3.87Å; V697-M701 WeakPolarHBondContact O-CG 3.25Å; V697-M701 PolarHBondContact O-N 3.4Å; P698-M701 PolarHBondContact O-N 2.77Å; M701-L703 VanDerWaalsContact C-N 3.35Å; M701-L703 PolarHBondContact O-N 3.35Å; M701-I704 PolarHBondContact O-N 2.97Å; M701-T705 WeakPolarHBondContact O-CB 3.32Å; M701-T705 PolarHBondContact O-N 2.94Å; M701-T705 PolarHBondContact O-OG1 2.87Å; M701-I872 HydrophobicContact SD-CD1 4.22Å; M701-L877 HydrophobicContact CE-CD2 3.88Å; M701-M880 HydrophobicContact CE-CG 4.45Å
702	L	90.2	Very high	86.9	Confident	120 Å²	120	45.1 Å²	45.1	63%	0.628	23%	0.231	S	C	*	.	H	α-helix	trans	-61.6	-42.2	175.6	-71.2	174.5	0	0	0	112	P698 L699 G700 T705 G706	P698-L702 WeakPolarHBondContact O-CG 3.36Å; P698-L702 PolarHBondContact O-N 3.41Å; L699-L702 PolarHBondContact O-N 2.89Å; G700-L702 VanDerWaalsContact C-N 3.34Å; G700-L702 PolarHBondContact O-N 2.85Å; L702-T705 PolarHBondContact O-N 3.18Å; L702-G706 PolarHBondContact O-N 2.88Å
703	L	93.4	Very high	87.1	Confident	60 Å²	60	52.5 Å²	52.5	31%	0.314	26%	0.256	S	S	.	.	H	α-helix	trans	-59.3	-49.1	176	177.5	70.2	0	0	0	110.9	I667 F671 L699 G700 M701 G706 L707	I667-L703 HydrophobicContact CG2-CD2 4.48Å; F671-L703 HydrophobicContact CB-CD2 3.93Å; F671-L703 HydrophobicContact CD1-CD2 3.87Å; F671-L703 HydrophobicContact CD2-CD2 3.44Å; F671-L703 VanDerWaalsContact CD2-CD2 3.44Å; F671-L703 HydrophobicContact CE1-CD2 4.2Å; F671-L703 HydrophobicContact CE2-CD2 3.82Å; F671-L703 HydrophobicContact CG-CD2 3.46Å; F671-L703 VanDerWaalsContact CG-CD2 3.46Å; F671-L703 HydrophobicContact CZ-CD2 4.17Å; L699-L703 WeakPolarHBondContact O-CB 3.23Å; L699-L703 PolarHBondContact O-N 3.49Å; G700-L703 WeakPolarHBondContact O-CB 3.49Å; G700-L703 PolarHBondContact O-N 2.96Å; M701-L703 VanDerWaalsContact C-N 3.35Å; M701-L703 PolarHBondContact O-N 3.35Å; L703-G706 PolarHBondContact O-N 2.98Å; L703-L707 HydrophobicContact CD1-CD1 4.23Å; L703-L707 HydrophobicContact CD1-CG 4.27Å; L703-L707 HydrophobicContact CG-CD1 4.01Å; L703-L707 HydrophobicContact CG-CG 4.38Å; L703-L707 WeakPolarHBondContact O-CG 3.41Å; L703-L707 PolarHBondContact O-N 2.94Å
704	I	93.4	Very high	87.6	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-66.8	-42.2	-178.5	-61.6	-52.8	0	0	0	111.8	L664 I667 M668 G700 M701 G706 L707 E708 P873 A876	L664-I704 HydrophobicContact CB-CG2 4.02Å; L664-I704 HydrophobicContact CD1-CG2 4.27Å; L664-I704 HydrophobicContact CD2-CD1 4.48Å; L664-I704 HydrophobicContact CD2-CG2 4.42Å; L664-I704 HydrophobicContact CG-CG2 4.48Å; L664-I704 VanDerWaalsContact O-CD1 3.24Å; L664-I704 WeakPolarHBondContact O-CD1 3.26Å; I667-I704 HydrophobicContact CB-CD1 4.15Å; I667-I704 HydrophobicContact CG2-CD1 3.84Å; M668-I704 HydrophobicContact CB-CD1 3.94Å; M668-I704 HydrophobicContact CB-CG1 3.76Å; M668-I704 HydrophobicContact CG-CG1 4.22Å; M668-I704 HydrophobicContact SD-CG1 3.86Å; G700-I704 WeakPolarHBondContact O-CG1 3.34Å; G700-I704 PolarHBondContact O-N 3.46Å; M701-I704 PolarHBondContact O-N 2.97Å; I704-G706 VanDerWaalsContact C-N 3.27Å; I704-G706 PolarHBondContact O-N 3.08Å; I704-L707 HydrophobicContact CD1-CD1 4.35Å; I704-L707 PolarHBondContact O-N 2.98Å; I704-E708 VanDerWaalsContact O-CB 3.26Å; I704-E708 WeakPolarHBondContact O-CB 3.48Å; I704-E708 PolarHBondContact O-N 3.37Å; I704-P873 HydrophobicContact CG2-CG 3.7Å; I704-A876 HydrophobicContact CB-CB 3.92Å; I704-A876 HydrophobicContact CG1-CB 4.29Å; I704-A876 HydrophobicContact CG2-CB 3.85Å
705	T	91.5	Very high	88.2	Confident	17 Å²	17	59.3 Å²	59.3	10%	0.104	30%	0.298	C	S	.	.	H	α-helix	trans	-60.5	-38	173	-64.9	0	0	0	0	111.4	M701 L702 R709 N871 P873	M701-T705 WeakPolarHBondContact O-CB 3.32Å; M701-T705 PolarHBondContact O-N 2.94Å; M701-T705 PolarHBondContact O-OG1 2.87Å; L702-T705 PolarHBondContact O-N 3.18Å; T705-R709 WeakPolarHBondContact O-CB 3.41Å; T705-R709 WeakPolarHBondContact O-CG 3.37Å; T705-R709 PolarHBondContact O-N 2.93Å; T705-N871 HydrophobicContact CG2-CB 4.31Å; T705-N871 WeakPolarHBondContact CG2-O 3.5Å; T705-N871 PolarHBondContact OG1-O 3.4Å; T705-P873 VanDerWaalsContact OG1-CD 3.31Å; T705-P873 WeakPolarHBondContact OG1-CD 3.28Å
706	G	93.1	Very high	88.4	Confident	27 Å²	27	63.9 Å²	63.9	28%	0.278	32%	0.323	S	S	.	.	H	α-helix	trans	-65.3	-47.8	174.2	0	0	0	0	0	112.9	L702 L703 I704 R709 I710	L702-G706 PolarHBondContact O-N 2.88Å; L703-G706 PolarHBondContact O-N 2.98Å; I704-G706 VanDerWaalsContact C-N 3.27Å; I704-G706 PolarHBondContact O-N 3.08Å; G706-R709 PolarHBondContact O-N 3.49Å; G706-I710 WeakPolarHBondContact O-CB 3.38Å; G706-I710 WeakPolarHBondContact O-CD1 3.37Å; G706-I710 VanDerWaalsContact O-CG1 3.23Å; G706-I710 WeakPolarHBondContact O-CG1 3.22Å; G706-I710 PolarHBondContact O-N 3.43Å
707	L	94	Very high	88.5	Confident	38 Å²	38	63.9 Å²	63.9	20%	0.199	32%	0.323	C	S	.	.	H	α-helix	trans	-64.3	-41	179.5	-71.6	176.4	0	0	0	112.3	L664 I667 L703 I704 I710 F711	L664-L707 HydrophobicContact CD2-CB 4.02Å; I667-L707 HydrophobicContact CD1-CD1 4.45Å; I667-L707 HydrophobicContact CG2-CD1 3.94Å; L703-L707 HydrophobicContact CD1-CD1 4.23Å; L703-L707 HydrophobicContact CD1-CG 4.27Å; L703-L707 HydrophobicContact CG-CD1 4.01Å; L703-L707 HydrophobicContact CG-CG 4.38Å; L703-L707 WeakPolarHBondContact O-CG 3.41Å; L703-L707 PolarHBondContact O-N 2.94Å; I704-L707 HydrophobicContact CD1-CD1 4.35Å; I704-L707 PolarHBondContact O-N 2.98Å; L707-I710 PolarHBondContact O-N 2.96Å; L707-F711 HydrophobicContact CD2-CD2 3.81Å; L707-F711 HydrophobicContact CD2-CE2 3.66Å; L707-F711 PolarHBondContact O-N 3.36Å
708	E	92.5	Very high	88.8	Confident	22 Å²	22	65.6 Å²	65.6	10%	0.103	33%	0.334	C	S	.	.	H	α-helix	trans	-59.1	-48.9	175.2	-177.6	-84.5	156.2	0	0	110.8	L664 I704 F712 R713 L717 P873	L664-E708 HydrophobicContact CD1-CB 4.03Å; L664-E708 HydrophobicContact CD1-CG 4.38Å; I704-E708 VanDerWaalsContact O-CB 3.26Å; I704-E708 WeakPolarHBondContact O-CB 3.48Å; I704-E708 PolarHBondContact O-N 3.37Å; E708-F712 CarbonylContact O-C 3.23Å; E708-F712 VanDerWaalsContact O-C 3.23Å; E708-F712 WeakPolarHBondContact O-CA 3.31Å; E708-F712 PolarHBondContact O-N 3.41Å; E708-R713 PolarHBondContact O-N 3.19Å; E708-R713 VanDerWaalsContact O-N 3.08Å; E708-L717 HydrophobicContact CG-CD1 4.21Å; E708-L717 HydrophobicContact CG-CD2 4.35Å; E708-P873 HydrophobicContact CB-CG 4.42Å; E708-P873 HydrophobicContact CG-CB 4.47Å; E708-P873 HydrophobicContact CG-CG 4.5Å
709	R	90.6	Very high	88.9	Confident	129 Å²	129	67 Å²	67	49%	0.487	34%	0.343	S	S	.	.	H	α-helix	trans	-68.3	-34.7	179.9	-72.4	-177.9	175.5	-172.3	-4.6	114.6	T705 G706 N871	T705-R709 WeakPolarHBondContact O-CB 3.41Å; T705-R709 WeakPolarHBondContact O-CG 3.37Å; T705-R709 PolarHBondContact O-N 2.93Å; G706-R709 PolarHBondContact O-N 3.49Å; R709-N871 PolarHBondContact NH2-ND2 3.42Å; R709-N871 PolarHBondContact NH2-OD1 3.36Å
710	I	93.3	Very high	88.3	Confident	126 Å²	126	64.4 Å²	64.4	65%	0.646	33%	0.329	S	S	*	.	H	α-helix	trans	-79.2	-49.5	-177.7	-67.8	165.9	0	0	0	111	G706 L707	G706-I710 WeakPolarHBondContact O-CB 3.38Å; G706-I710 WeakPolarHBondContact O-CD1 3.37Å; G706-I710 VanDerWaalsContact O-CG1 3.23Å; G706-I710 WeakPolarHBondContact O-CG1 3.22Å; G706-I710 PolarHBondContact O-N 3.43Å; L707-I710 PolarHBondContact O-N 2.96Å
711	F	92	Very high	87.5	Confident	141 Å²	141	70.7 Å²	70.7	62%	0.618	36%	0.363	S	S	*	.	H	α-helix	trans	-103	-30.1	-169.3	-64.6	-73.8	0	0	0	114	L707	L707-F711 HydrophobicContact CD2-CD2 3.81Å; L707-F711 HydrophobicContact CD2-CE2 3.66Å; L707-F711 PolarHBondContact O-N 3.36Å
712	F	90.2	Very high	87	Confident	40 Å²	40	70.2 Å²	70.2	18%	0.175	36%	0.36	C	S	.	.			trans	-120.5	16.5	-166.2	-59.6	-72.8	0	0	0	114.6	V660 F663 L664 E708 G714 Y715 L717	V660-F712 HydrophobicContact CB-CD1 4.33Å; V660-F712 HydrophobicContact CG1-CB 3.86Å; V660-F712 HydrophobicContact CG1-CD1 3.56Å; V660-F712 HydrophobicContact CG1-CD2 3.97Å; V660-F712 HydrophobicContact CG1-CE1 4.05Å; V660-F712 HydrophobicContact CG1-CE2 4.41Å; V660-F712 HydrophobicContact CG1-CG 3.51Å; V660-F712 HydrophobicContact CG1-CZ 4.44Å; V660-F712 HydrophobicContact CG2-CD1 3.68Å; V660-F712 HydrophobicContact CG2-CE1 3.92Å; V660-F712 HydrophobicContact CG2-CG 4.46Å; F663-F712 HydrophobicContact CD1-CE2 4.23Å; F663-F712 AromaticContact CD1-CZ 3.95Å; F663-F712 HydrophobicContact CD1-CZ 3.95Å; F663-F712 HydrophobicContact CE1-CE2 4.23Å; F663-F712 AromaticContact CE1-CZ 3.96Å; F663-F712 HydrophobicContact CE1-CZ 3.96Å; L664-F712 HydrophobicContact CD1-CD2 4.41Å; L664-F712 HydrophobicContact CD2-CD2 4.16Å; L664-F712 HydrophobicContact CD2-CE2 4.03Å; L664-F712 HydrophobicContact CG-CD2 4.49Å; E708-F712 CarbonylContact O-C 3.23Å; E708-F712 VanDerWaalsContact O-C 3.23Å; E708-F712 WeakPolarHBondContact O-CA 3.31Å; E708-F712 PolarHBondContact O-N 3.41Å; F712-G714 PolarHBondContact O-N 3.2Å; F712-Y715 HydrophobicContact CB-CD2 4.11Å; F712-Y715 AromaticContact CD1-CD2 3.95Å; F712-Y715 HydrophobicContact CD1-CD2 3.95Å; F712-Y715 AromaticContact CD1-CE2 3.98Å; F712-Y715 HydrophobicContact CD1-CE2 3.98Å; F712-Y715 PolarHBondContact O-N 3.33Å; F712-L717 HydrophobicContact CB-CD1 4.47Å
713	R	86.1	Confident	86.1	Confident	199 Å²	199	66.6 Å²	66.6	75%	0.751	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-51.9	-28.6	-178.7	-171.6	174.9	177.3	176	-1	114	E708 Y715	E708-R713 PolarHBondContact O-N 3.19Å; E708-R713 VanDerWaalsContact O-N 3.08Å; R713-Y715 VanDerWaalsContact C-N 3.33Å; R713-Y715 PolarHBondContact O-N 2.94Å
714	G	83	Confident	85.1	Confident	69 Å²	69	66.2 Å²	66.2	71%	0.711	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-74.5	-13.4	179.8	0	0	0	0	0	115.8	F712	F712-G714 PolarHBondContact O-N 3.2Å
715	Y	83.1	Confident	84.2	Confident	99 Å²	99	68.5 Å²	68.5	39%	0.388	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-94.9	-7.2	-173.2	-67	-77.9	0	0	0	114.4	A656 V657 V660 F712 R713	A656-Y715 HydrophobicContact CB-CD1 3.89Å; A656-Y715 HydrophobicContact CB-CE1 3.57Å; V657-Y715 WeakPolarHBondContact CG2-O 3.3Å; V660-Y715 HydrophobicContact CG2-CD2 4.07Å; V660-Y715 HydrophobicContact CG2-CE2 4.29Å; V660-Y715 HydrophobicContact CG2-CG 4.22Å; F712-Y715 HydrophobicContact CB-CD2 4.11Å; F712-Y715 AromaticContact CD1-CD2 3.95Å; F712-Y715 HydrophobicContact CD1-CD2 3.95Å; F712-Y715 AromaticContact CD1-CE2 3.98Å; F712-Y715 HydrophobicContact CD1-CE2 3.98Å; F712-Y715 PolarHBondContact O-N 3.33Å; R713-Y715 VanDerWaalsContact C-N 3.33Å; R713-Y715 PolarHBondContact O-N 2.94Å
716	N	83.4	Confident	83.5	Confident	133 Å²	133	75 Å²	75	71%	0.711	40%	0.395	S	S	*	.			trans	44.1	67.5	-179.6	-68.5	-27.9	0	0	0	113
717	L	84.2	Confident	82.8	Confident	11 Å²	11	80.3 Å²	80.3	6%	0.058	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-65.8	148.1	-179.9	-81.3	78.6	0	0	0	111.2	V660 T661 L664 E708 F712 T719 P873 A875	V660-L717 HydrophobicContact CG1-CD1 3.96Å; V660-L717 HydrophobicContact CG1-CD2 4.07Å; T661-L717 HydrophobicContact CG2-CD2 3.7Å; T661-L717 HydrophobicContact CG2-CG 4.04Å; L664-L717 HydrophobicContact CD1-CD2 3.68Å; E708-L717 HydrophobicContact CG-CD1 4.21Å; E708-L717 HydrophobicContact CG-CD2 4.35Å; F712-L717 HydrophobicContact CB-CD1 4.47Å; L717-T719 PolarHBondContact O-N 3.44Å; L717-P873 HydrophobicContact CD2-CB 4.48Å; L717-A875 HydrophobicContact CD2-CB 4.36Å
718	P	83.2	Confident	81.9	Confident	52 Å²	52	80 Å²	80	34%	0.338	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-67	125	174.2	29.9	-35	0	0	0	109.5	L874	P718-L874 HydrophobicContact CB-CD1 3.76Å; P718-L874 HydrophobicContact CB-CG 4.39Å; P718-L874 HydrophobicContact CG-CB 4.48Å; P718-L874 HydrophobicContact CG-CD1 4Å; P718-L874 WeakPolarHBondContact O-CB 3.35Å; P718-L874 WeakPolarHBondContact O-CG 3.39Å; P718-L874 PolarHBondContact O-N 2.84Å
719	T	84.9	Confident	81.3	Confident	47 Å²	47	83.5 Å²	83.5	29%	0.288	43%	0.432	S	S	.	.	B	Isolated β-bridge	trans	-103.5	170.7	176.1	62.8	0	0	0	0	111.1	L717 N721 S870 I872	L717-T719 PolarHBondContact O-N 3.44Å; T719-N721 PolarHBondContact O-N 3.36Å; T719-S870 WeakPolarHBondContact CB-O 3.21Å; T719-S870 PolarHBondContact OG1-O 3.48Å; T719-I872 WeakPolarHBondContact CA-O 3.31Å; T719-I872 WeakPolarHBondContact CB-O 3.34Å
720	V	75.7	Confident	80.9	Confident	3 Å²	3	80.2 Å²	80.2	2%	0.018	43%	0.432	C	S	.	.			trans	-69.2	114.8	175.5	-169.2	0	0	0	0	109.3	I513 V529 I722 S870 I872 L874 L877	I513-V720 HydrophobicContact CG2-CG1 4.03Å; I513-V720 HydrophobicContact CG2-CG2 4.18Å; V529-V720 HydrophobicContact CG1-CG1 4.29Å; V529-V720 HydrophobicContact CG2-CG1 4.33Å; V720-I722 VanDerWaalsContact C-N 3.32Å; V720-I722 HydrophobicContact CB-CD1 4.37Å; V720-I722 HydrophobicContact CG1-CD1 3.65Å; V720-I722 HydrophobicContact CG1-CG1 3.83Å; V720-I722 PolarHBondContact O-N 3.44Å; V720-S870 WeakPolarHBondContact O-CA 3.41Å; V720-I872 HydrophobicContact CG2-CB 4.42Å; V720-I872 PolarHBondContact N-O 3.2Å; V720-I872 VanDerWaalsContact N-O 3.13Å; V720-L874 HydrophobicContact CG2-CD2 4.15Å; V720-L877 HydrophobicContact CG2-CD1 3.65Å; V720-L877 HydrophobicContact CG2-CG 4.42Å
721	N	73.5	Confident	80.4	Confident	132 Å²	132	78 Å²	78	71%	0.706	43%	0.429	S	S	*	.			trans	-72.9	81.4	179.1	-71.5	-19.7	0	0	0	111.4	T719	T719-N721 PolarHBondContact O-N 3.36Å
722	I	74.7	Confident	79.9	Confident	9 Å²	9	73.4 Å²	73.4	5%	0.046	41%	0.412	C	S	.	.			trans	-112.3	125.3	170.9	-61.6	158.3	0	0	0	108	V529 T530 V720 G866 L869	V529-I722 HydrophobicContact CB-CG1 3.89Å; V529-I722 HydrophobicContact CG1-CD1 3.82Å; V529-I722 HydrophobicContact CG1-CG1 3.67Å; T530-I722 HydrophobicContact CG2-CG2 4.08Å; V720-I722 VanDerWaalsContact C-N 3.32Å; V720-I722 HydrophobicContact CB-CD1 4.37Å; V720-I722 HydrophobicContact CG1-CD1 3.65Å; V720-I722 HydrophobicContact CG1-CG1 3.83Å; V720-I722 PolarHBondContact O-N 3.44Å; I722-G866 VanDerWaalsContact CG2-CA 3.48Å; I722-L869 HydrophobicContact CD1-CB 3.53Å; I722-L869 HydrophobicContact CD1-CD1 4.12Å; I722-L869 HydrophobicContact CD1-CG 4.48Å
723	P	71.8	Confident	79.6	Confident	44 Å²	44	74.2 Å²	74.2	29%	0.286	41%	0.414	S	S	.	.			trans	-61	143.4	175.3	25	-32.8	0	0	0	110.2	T530 Q727 V728	T530-P723 HydrophobicContact CG2-CG 4.28Å; P723-Q727 HydrophobicContact CB-CB 4.12Å; P723-V728 HydrophobicContact CG-CG2 4.36Å
724	P	72.4	Confident	79.6	Confident	52 Å²	52	68 Å²	68	34%	0.338	40%	0.398	S	S	.	.			trans	-57.5	154.6	171.8	25.8	-33.5	0	0	0	110	N726 Q727	P724-N726 PolarHBondContact O-N 3.41Å; P724-Q727 HydrophobicContact CG-CB 4.21Å; P724-Q727 HydrophobicContact CG-CG 4.05Å; P724-Q727 PolarHBondContact O-N 3.35Å
725	S	74.6	Confident	79.7	Confident	48 Å²	48	66.2 Å²	66.2	34%	0.336	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-46.9	-32.7	-173.7	52.6	0	0	0	0	114.5	Q727	S725-Q727 VanDerWaalsContact C-N 3.33Å
726	N	76.5	Confident	79.9	Confident	154 Å²	154	64.1 Å²	64.1	82%	0.824	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-79.7	-14	-176.5	-59	4.9	0	0	0	113.7	P724	P724-N726 PolarHBondContact O-N 3.41Å
727	Q	79	Confident	80	Confident	139 Å²	139	58 Å²	58	65%	0.65	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-112.1	11.9	-177.3	-65	179	-4.3	0	0	112.1	P723 P724 S725 N729	P723-Q727 HydrophobicContact CB-CB 4.12Å; P724-Q727 HydrophobicContact CG-CB 4.21Å; P724-Q727 HydrophobicContact CG-CG 4.05Å; P724-Q727 PolarHBondContact O-N 3.35Å; S725-Q727 VanDerWaalsContact C-N 3.33Å; Q727-N729 PolarHBondContact O-N 2.9Å; Q727-N729 VanDerWaalsContact O-N 3.12Å
728	V	74.9	Confident	80	Confident	30 Å²	30	61.4 Å²	61.4	18%	0.182	36%	0.356	C	S	.	.			trans	-73.5	107.5	-180	-176.5	0	0	0	0	109.2	P723 A730 W733 I863	P723-V728 HydrophobicContact CG-CG2 4.36Å; V728-A730 PolarHBondContact O-N 3.14Å; V728-W733 HydrophobicContact CG1-CZ2 3.52Å; V728-I863 HydrophobicContact CG1-CG2 4.1Å
729	N	81	Confident	80	Confident	96 Å²	96	64.4 Å²	64.4	51%	0.513	36%	0.364	S	S	.	.			trans	-83.8	107.7	178	-166.2	-0.3	0	0	0	110.6	Q727 S731 T732	Q727-N729 PolarHBondContact O-N 2.9Å; Q727-N729 VanDerWaalsContact O-N 3.12Å; N729-S731 VanDerWaalsContact CG-OG 3.24Å; N729-S731 PolarHBondContact ND2-OG 3.46Å; N729-S731 PolarHBondContact O-N 3.3Å; N729-S731 PolarHBondContact OD1-N 2.93Å; N729-S731 PolarHBondContact OD1-OG 3.08Å; N729-T732 HydrophobicContact CB-CG2 4.12Å; N729-T732 PolarHBondContact O-N 3.36Å; N729-T732 PolarHBondContact O-OG1 2.89Å
730	A	81.6	Confident	80	Confident	60 Å²	60	67.2 Å²	67.2	50%	0.496	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-61.7	-23.4	-178.5	0	0	0	0	0	113.3	V728 T732 W733	V728-A730 PolarHBondContact O-N 3.14Å; A730-T732 PolarHBondContact O-N 2.63Å; A730-W733 HydrophobicContact CB-CD2 4.43Å; A730-W733 HydrophobicContact CB-CE3 4.27Å; A730-W733 HydrophobicContact CB-CZ3 4.48Å; A730-W733 WeakPolarHBondContact O-CB 3.45Å; A730-W733 PolarHBondContact O-N 3.27Å; A730-W733 VanDerWaalsContact O-N 3.13Å
731	S	82	Confident	80.2	Confident	81 Å²	81	73.9 Å²	73.9	57%	0.566	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-64.6	-23.6	175.8	67.6	0	0	0	0	112.9	N729 W733	N729-S731 VanDerWaalsContact CG-OG 3.24Å; N729-S731 PolarHBondContact ND2-OG 3.46Å; N729-S731 PolarHBondContact O-N 3.3Å; N729-S731 PolarHBondContact OD1-N 2.93Å; N729-S731 PolarHBondContact OD1-OG 3.08Å; S731-W733 PolarHBondContact O-N 3.5Å
732	T	81.4	Confident	80.6	Confident	43 Å²	43	68.5 Å²	68.5	26%	0.264	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-80.2	-3.4	177.8	66.9	0	0	0	0	113.5	L531 N729 A730 V734	L531-T732 WeakPolarHBondContact CD1-O 3.15Å; N729-T732 HydrophobicContact CB-CG2 4.12Å; N729-T732 PolarHBondContact O-N 3.36Å; N729-T732 PolarHBondContact O-OG1 2.89Å; A730-T732 PolarHBondContact O-N 2.63Å; T732-V734 VanDerWaalsContact C-N 3.34Å
733	W	83.8	Confident	80.8	Confident	58 Å²	58	75.3 Å²	75.3	22%	0.22	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-86	-6.5	-179.5	-64.2	-5.5	0	0	0	113.8	L531 L534 V728 A730 S731 W810 I863	L531-W733 WeakPolarHBondContact CD1-O 3.37Å; L534-W733 HydrophobicContact CD2-CB 3.91Å; L534-W733 HydrophobicContact CD2-CD2 3.83Å; L534-W733 HydrophobicContact CD2-CE3 3.7Å; L534-W733 HydrophobicContact CD2-CG 3.98Å; L534-W733 HydrophobicContact CD2-CZ3 4.43Å; V728-W733 HydrophobicContact CG1-CZ2 3.52Å; A730-W733 HydrophobicContact CB-CD2 4.43Å; A730-W733 HydrophobicContact CB-CE3 4.27Å; A730-W733 HydrophobicContact CB-CZ3 4.48Å; A730-W733 WeakPolarHBondContact O-CB 3.45Å; A730-W733 PolarHBondContact O-N 3.27Å; A730-W733 VanDerWaalsContact O-N 3.13Å; S731-W733 PolarHBondContact O-N 3.5Å; W733-W810 PolarHBondContact O-NE1 3.16Å; W733-I863 HydrophobicContact CZ2-CG2 4.06Å
734	V	86.9	Confident	81.3	Confident	69 Å²	69	78.1 Å²	78.1	42%	0.418	43%	0.426	S	S	.	.			trans	-139.2	122.1	172.5	-167.7	0	0	0	0	106.7	T732 P736 T808	T732-V734 VanDerWaalsContact C-N 3.34Å; V734-P736 VanDerWaalsContact C-CD 3.41Å; V734-P736 VanDerWaalsContact O-CD 3.27Å; V734-P736 WeakPolarHBondContact O-CD 3.28Å; V734-T808 HydrophobicContact CG1-CG2 4.44Å; V734-T808 WeakPolarHBondContact CG1-O 3.41Å
735	N	85.5	Confident	81.7	Confident	30 Å²	30	76.3 Å²	76.3	16%	0.16	41%	0.413	C	S	.	.			trans	-117.5	70.5	177.6	-69.5	-31.2	0	0	0	108.3	S526 T808 G809	S526-N735 PolarHBondContact O-ND2 3.16Å; N735-T808 CarbonylContact C-O 3.54Å; N735-T808 PolarHBondContact N-O 3.13Å; N735-G809 WeakPolarHBondContact O-CA 3.39Å
736	P	86.6	Confident	81.6	Confident	56 Å²	56	79.3 Å²	79.3	36%	0.364	43%	0.434	S	S	.	.			trans	-66.3	151.9	-177.9	30.9	-33.2	0	0	0	110.3	V734 F739 I807	V734-P736 VanDerWaalsContact C-CD 3.41Å; V734-P736 VanDerWaalsContact O-CD 3.27Å; V734-P736 WeakPolarHBondContact O-CD 3.28Å; P736-F739 HydrophobicContact CB-CE2 4.06Å; P736-I807 WeakPolarHBondContact CA-O 3.33Å; P736-I807 WeakPolarHBondContact CB-O 3.49Å
737	P	85.2	Confident	81.5	Confident	4 Å²	4	81.5 Å²	81.5	3%	0.026	44%	0.436	C	S	.	.			trans	-67.4	150.7	166.6	31	-34.4	0	0	0	110	K579 F583 F739 L742	K579-P737 HydrophobicContact CB-CB 4.28Å; F583-P737 HydrophobicContact CB-CB 4.46Å; F583-P737 HydrophobicContact CB-CG 4.17Å; F583-P737 HydrophobicContact CD2-CG 3.93Å; F583-P737 HydrophobicContact CG-CG 4.2Å; P737-F739 HydrophobicContact CG-CE1 4.21Å; P737-F739 HydrophobicContact CG-CZ 4.17Å; P737-F739 WeakPolarHBondContact O-CD2 3.47Å; P737-F739 PolarHBondContact O-N 2.86Å; P737-L742 HydrophobicContact CB-CD2 4.03Å; P737-L742 HydrophobicContact CG-CD2 4.35Å
738	D	84.6	Confident	81.4	Confident	83 Å²	83	75.7 Å²	75.7	44%	0.444	41%	0.412	S	S	.	.			trans	-68.5	96.8	173.7	-75.8	-14.4	0	0	0	109.7	S740 R741 L742	D738-S740 PolarHBondContact O-N 3.33Å; D738-S740 VanDerWaalsContact O-N 3.13Å; D738-R741 HydrophobicContact CB-CB 4.19Å; D738-R741 PolarHBondContact O-N 2.98Å; D738-L742 PolarHBondContact O-N 3.08Å
739	F	84.3	Confident	81.9	Confident	114 Å²	114	76.7 Å²	76.7	50%	0.5	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-56.9	-30.5	-175.2	-69.2	-77.2	0	0	0	113.7	F583 P736 P737 R741 L742 I807	F583-F739 HydrophobicContact CE2-CE1 4.26Å; P736-F739 HydrophobicContact CB-CE2 4.06Å; P737-F739 HydrophobicContact CG-CE1 4.21Å; P737-F739 HydrophobicContact CG-CZ 4.17Å; P737-F739 WeakPolarHBondContact O-CD2 3.47Å; P737-F739 PolarHBondContact O-N 2.86Å; F739-R741 VanDerWaalsContact C-N 3.34Å; F739-L742 HydrophobicContact CB-CD1 4.32Å; F739-L742 HydrophobicContact CD1-CD1 3.68Å; F739-L742 HydrophobicContact CE1-CD1 4.47Å; F739-L742 HydrophobicContact CG-CD1 4.41Å; F739-I807 HydrophobicContact CZ-CG2 4.32Å
740	S	83.7	Confident	82.2	Confident	107 Å²	107	75.5 Å²	75.5	75%	0.748	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-71.5	-26.1	177.1	53	0	0	0	0	113.7	D738	D738-S740 PolarHBondContact O-N 3.33Å; D738-S740 VanDerWaalsContact O-N 3.13Å
741	R	81.3	Confident	82.5	Confident	142 Å²	142	78.2 Å²	78.2	54%	0.536	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-106.6	11.8	-176.8	-67.7	-180	174.7	164.6	-2.6	113	Q580 D738 F739 Q743 D744	Q580-R741 PolarHBondContact NE2-O 3.01Å; D738-R741 HydrophobicContact CB-CB 4.19Å; D738-R741 PolarHBondContact O-N 2.98Å; F739-R741 VanDerWaalsContact C-N 3.34Å; R741-Q743 PolarHBondContact O-N 3.28Å; R741-Q743 VanDerWaalsContact O-N 3.1Å; R741-D744 HydrophobicContact CB-CB 4.27Å; R741-D744 PolarHBondContact O-N 2.96Å
742	L	80.6	Confident	82.8	Confident	20 Å²	20	79 Å²	79	11%	0.105	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-24	-176.3	-79.6	173.2	0	0	0	114.4	F583 W584 P737 D738 F739 Y745	F583-L742 HydrophobicContact CB-CD2 4.47Å; F583-L742 HydrophobicContact CD1-CD1 4.4Å; F583-L742 HydrophobicContact CD1-CD2 3.78Å; F583-L742 HydrophobicContact CE1-CD1 4.04Å; F583-L742 HydrophobicContact CE1-CD2 4.25Å; F583-L742 HydrophobicContact CG-CD2 4.14Å; F583-L742 HydrophobicContact CZ-CD1 4.36Å; W584-L742 PolarHBondContact NE1-O 2.93Å; P737-L742 HydrophobicContact CB-CD2 4.03Å; P737-L742 HydrophobicContact CG-CD2 4.35Å; D738-L742 PolarHBondContact O-N 3.08Å; F739-L742 HydrophobicContact CB-CD1 4.32Å; F739-L742 HydrophobicContact CD1-CD1 3.68Å; F739-L742 HydrophobicContact CE1-CD1 4.47Å; F739-L742 HydrophobicContact CG-CD1 4.41Å; L742-Y745 VanDerWaalsContact O-CE1 3.27Å; L742-Y745 WeakPolarHBondContact O-CE1 3.37Å; L742-Y745 PolarHBondContact O-OH 3.49Å
743	Q	79.8	Confident	83.2	Confident	152 Å²	152	77 Å²	77	71%	0.71	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-5	178.2	-62.9	-177.1	-6.7	0	0	112.7	R741 Y745	R741-Q743 PolarHBondContact O-N 3.28Å; R741-Q743 VanDerWaalsContact O-N 3.1Å; Q743-Y745 VanDerWaalsContact O-CD2 3.31Å; Q743-Y745 WeakPolarHBondContact O-CD2 3.22Å; Q743-Y745 PolarHBondContact O-N 3.03Å
744	D	80.9	Confident	83.6	Confident	103 Å²	103	76.3 Å²	76.3	55%	0.551	42%	0.415	S	S	*	.			trans	-88.4	85	-177.9	-71.2	-19.2	0	0	0	110.3	R741 S746	R741-D744 HydrophobicContact CB-CB 4.27Å; R741-D744 PolarHBondContact O-N 2.96Å; D744-S746 PolarHBondContact O-N 3.35Å
745	Y	81.1	Confident	83.8	Confident	13 Å²	13	74.9 Å²	74.9	5%	0.051	41%	0.414	C	S	.	.			trans	-85.1	15.3	-175.5	-59.4	-51.7	0	0	0	115.3	V576 W584 L742 Q743 K747 A748 P750 I753 H754	V576-Y745 HydrophobicContact CG1-CD1 4.39Å; W584-Y745 AromaticContact NE1-CE1 4Å; W584-Y745 AromaticContact NE1-CZ 3.95Å; W584-Y745 PolarHBondContact NE1-OH 3.07Å; L742-Y745 VanDerWaalsContact O-CE1 3.27Å; L742-Y745 WeakPolarHBondContact O-CE1 3.37Å; L742-Y745 PolarHBondContact O-OH 3.49Å; Q743-Y745 VanDerWaalsContact O-CD2 3.31Å; Q743-Y745 WeakPolarHBondContact O-CD2 3.22Å; Q743-Y745 PolarHBondContact O-N 3.03Å; Y745-K747 VanDerWaalsContact C-N 3.28Å; Y745-K747 PolarHBondContact O-N 3Å; Y745-A748 PolarHBondContact O-N 2.89Å; Y745-P750 HydrophobicContact CD2-CB 3.84Å; Y745-P750 HydrophobicContact CD2-CG 3.92Å; Y745-P750 HydrophobicContact CE2-CB 3.79Å; Y745-P750 HydrophobicContact CE2-CG 4.29Å; Y745-I753 HydrophobicContact CD1-CD1 3.4Å; Y745-I753 HydrophobicContact CD1-CG2 4.22Å; Y745-I753 HydrophobicContact CD2-CD1 3.87Å; Y745-I753 HydrophobicContact CE1-CD1 4.15Å; Y745-I753 HydrophobicContact CE1-CG2 3.98Å; Y745-I753 HydrophobicContact CG-CD1 3.21Å; Y745-H754 AromaticContact CE2-NE2 3.99Å; Y745-H754 AromaticContact CZ-NE2 3.81Å; Y745-H754 PolarHBondContact OH-CE1 3.39Å; Y745-H754 VanDerWaalsContact OH-CE1 3.28Å; Y745-H754 PolarHBondContact OH-NE2 3.07Å
746	S	72.8	Confident	84	Confident	112 Å²	112	75.2 Å²	75.2	78%	0.783	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	-74.7	-177	-172.6	0	0	0	0	115	D744	D744-S746 PolarHBondContact O-N 3.35Å
747	K	74.5	Confident	84.2	Confident	199 Å²	199	72.5 Å²	72.5	87%	0.865	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.6	-14.9	-172.2	-67.2	-177.1	-179.3	-179.3	0	114.6	Y745	Y745-K747 VanDerWaalsContact C-N 3.28Å; Y745-K747 PolarHBondContact O-N 3Å
748	A	77.6	Confident	84.6	Confident	18 Å²	18	75.5 Å²	75.5	15%	0.149	42%	0.415	C	S	.	.	S	Bend	trans	-95.5	143	-173.8	0	0	0	0	0	111.7	V576 Y745 I753	V576-A748 HydrophobicContact CG2-CB 4.14Å; Y745-A748 PolarHBondContact O-N 2.89Å; A748-I753 HydrophobicContact CB-CD1 3.74Å; A748-I753 HydrophobicContact CB-CG1 4.1Å
749	A	85.3	Confident	84.9	Confident	50 Å²	50	74.5 Å²	74.5	41%	0.413	42%	0.419	S	S	.	.			trans	-60.2	129	177.7	0	0	0	0	0	109.9	T751 L752 I753	A749-T751 PolarHBondContact O-N 3.3Å; A749-T751 VanDerWaalsContact O-N 3.14Å; A749-L752 HydrophobicContact CB-CB 4.29Å; A749-L752 WeakPolarHBondContact O-CB 3.37Å; A749-L752 PolarHBondContact O-N 3.29Å; A749-I753 PolarHBondContact O-N 3.33Å
750	P	86.2	Confident	85.2	Confident	72 Å²	72	69.6 Å²	69.6	47%	0.468	40%	0.397	S	S	.	.	H	α-helix	trans	-52	-39	178.1	-26.4	31	0	0	0	112.8	Y745 L752 I753 H754	Y745-P750 HydrophobicContact CD2-CB 3.84Å; Y745-P750 HydrophobicContact CD2-CG 3.92Å; Y745-P750 HydrophobicContact CE2-CB 3.79Å; Y745-P750 HydrophobicContact CE2-CG 4.29Å; P750-L752 PolarHBondContact O-N 3.29Å; P750-I753 PolarHBondContact O-N 2.95Å; P750-H754 PolarHBondContact O-CD2 3.38Å; P750-H754 PolarHBondContact O-N 3.12Å
751	T	88.6	Confident	85.6	Confident	116 Å²	116	64.5 Å²	64.5	71%	0.712	36%	0.362	S	S	*	.	H	α-helix	trans	-61.5	-40.8	179	50.8	0	0	0	0	112.6	A749 G755	A749-T751 PolarHBondContact O-N 3.3Å; A749-T751 VanDerWaalsContact O-N 3.14Å; T751-G755 PolarHBondContact O-N 3.33Å
752	L	88.3	Confident	86.1	Confident	98 Å²	98	59.9 Å²	59.9	51%	0.513	35%	0.349	S	S	.	.	H	α-helix	trans	-64.8	-43.3	177.3	-177.7	65.3	0	0	0	110.4	A749 P750 G755 T756	A749-L752 HydrophobicContact CB-CB 4.29Å; A749-L752 WeakPolarHBondContact O-CB 3.37Å; A749-L752 PolarHBondContact O-N 3.29Å; P750-L752 PolarHBondContact O-N 3.29Å; L752-G755 PolarHBondContact O-N 2.9Å; L752-T756 HydrophobicContact CD1-CG2 4.44Å; L752-T756 WeakPolarHBondContact O-CG2 3.05Å; L752-T756 PolarHBondContact O-N 3.38Å; L752-T756 PolarHBondContact O-OG1 3.04Å; L752-T756 VanDerWaalsContact O-OG1 3.11Å
753	I	89.6	Confident	86.5	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.005	35%	0.351	C	S	.	.	H	α-helix	trans	-68.8	-47.7	-177.1	-64.6	165.1	0	0	0	111.4	V576 L581 Y745 A748 A749 P750 G755 T756 S757	V576-I753 HydrophobicContact CG2-CD1 3.48Å; V576-I753 VanDerWaalsContact CG2-CD1 3.48Å; V576-I753 HydrophobicContact CG2-CG1 3.94Å; L581-I753 HydrophobicContact CD1-CG2 4.35Å; Y745-I753 HydrophobicContact CD1-CD1 3.4Å; Y745-I753 HydrophobicContact CD1-CG2 4.22Å; Y745-I753 HydrophobicContact CD2-CD1 3.87Å; Y745-I753 HydrophobicContact CE1-CD1 4.15Å; Y745-I753 HydrophobicContact CE1-CG2 3.98Å; Y745-I753 HydrophobicContact CG-CD1 3.21Å; A748-I753 HydrophobicContact CB-CD1 3.74Å; A748-I753 HydrophobicContact CB-CG1 4.1Å; A749-I753 PolarHBondContact O-N 3.33Å; P750-I753 PolarHBondContact O-N 2.95Å; I753-G755 VanDerWaalsContact C-N 3.29Å; I753-G755 PolarHBondContact O-N 3.39Å; I753-T756 WeakPolarHBondContact CA-OG1 2.98Å; I753-T756 PolarHBondContact O-N 2.66Å; I753-T756 PolarHBondContact O-OG1 3.41Å; I753-S757 VanDerWaalsContact O-CB 3.24Å; I753-S757 WeakPolarHBondContact O-CB 3.36Å; I753-S757 PolarHBondContact O-N 2.92Å; I753-S757 PolarHBondContact O-OG 3.38Å
754	H	92	Very high	87.1	Confident	43 Å²	43	52.5 Å²	52.5	20%	0.199	32%	0.317	C	S	.	.	H	α-helix	trans	-62.2	-40.2	174.2	-74.6	-71	0	0	0	110.5	W584 Y588 Y745 P750 S757 I758	W584-H754 AromaticContact CD2-CE1 3.62Å; W584-H754 AromaticContact CD2-ND1 3.99Å; W584-H754 AromaticContact CE2-CE1 3.56Å; W584-H754 AromaticContact CE3-CE1 3.74Å; W584-H754 AromaticContact CE3-ND1 3.99Å; W584-H754 AromaticContact CH2-CE1 3.8Å; W584-H754 AromaticContact CZ2-CE1 3.66Å; W584-H754 AromaticContact CZ3-CE1 3.84Å; Y588-H754 AromaticContact CE2-ND1 3.89Å; Y588-H754 AromaticContact CZ-ND1 3.77Å; Y588-H754 PolarHBondContact OH-ND1 2.83Å; Y745-H754 AromaticContact CE2-NE2 3.99Å; Y745-H754 AromaticContact CZ-NE2 3.81Å; Y745-H754 PolarHBondContact OH-CE1 3.39Å; Y745-H754 VanDerWaalsContact OH-CE1 3.28Å; Y745-H754 PolarHBondContact OH-NE2 3.07Å; P750-H754 PolarHBondContact O-CD2 3.38Å; P750-H754 PolarHBondContact O-N 3.12Å; H754-S757 PolarHBondContact O-N 3.23Å; H754-I758 WeakPolarHBondContact O-CB 3.35Å; H754-I758 WeakPolarHBondContact O-CD1 3.44Å; H754-I758 WeakPolarHBondContact O-CG1 3.47Å; H754-I758 PolarHBondContact O-N 3.21Å
755	G	91.8	Very high	87.7	Confident	39 Å²	39	47.6 Å²	47.6	40%	0.402	29%	0.291	S	S	.	.	H	α-helix	trans	-59.9	-48.1	174.5	0	0	0	0	0	113.5	T751 L752 I753 I758 A759	T751-G755 PolarHBondContact O-N 3.33Å; L752-G755 PolarHBondContact O-N 2.9Å; I753-G755 VanDerWaalsContact C-N 3.29Å; I753-G755 PolarHBondContact O-N 3.39Å; G755-I758 PolarHBondContact O-N 3.33Å; G755-A759 PolarHBondContact O-N 3.34Å
756	T	88.6	Confident	88.1	Confident	37 Å²	37	48.8 Å²	48.8	23%	0.227	30%	0.298	C	S	.	.	H	α-helix	trans	-65.8	-39	175.9	52.5	0	0	0	0	111.8	L752 I753 I758 A759 I760	L752-T756 HydrophobicContact CD1-CG2 4.44Å; L752-T756 WeakPolarHBondContact O-CG2 3.05Å; L752-T756 PolarHBondContact O-N 3.38Å; L752-T756 PolarHBondContact O-OG1 3.04Å; L752-T756 VanDerWaalsContact O-OG1 3.11Å; I753-T756 WeakPolarHBondContact CA-OG1 2.98Å; I753-T756 PolarHBondContact O-N 2.66Å; I753-T756 PolarHBondContact O-OG1 3.41Å; T756-I758 VanDerWaalsContact C-N 3.34Å; T756-A759 PolarHBondContact O-N 3.11Å; T756-I760 WeakPolarHBondContact O-CG1 3.41Å; T756-I760 PolarHBondContact O-N 3.31Å
757	S	91.3	Very high	89	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-66.8	-36	177.6	-56.9	0	0	0	0	111.8	L581 I753 H754 G761	L581-S757 WeakPolarHBondContact CD1-OG 3.44Å; I753-S757 VanDerWaalsContact O-CB 3.24Å; I753-S757 WeakPolarHBondContact O-CB 3.36Å; I753-S757 PolarHBondContact O-N 2.92Å; I753-S757 PolarHBondContact O-OG 3.38Å; H754-S757 PolarHBondContact O-N 3.23Å; S757-G761 WeakPolarHBondContact O-CA 3.31Å; S757-G761 PolarHBondContact O-N 2.89Å
758	I	93.7	Very high	89.8	Confident	66 Å²	66	34 Å²	34	34%	0.338	22%	0.22	S	C	.	.	H	α-helix	trans	-64.4	-48.7	172.8	-73.9	164.1	0	0	0	109.6	Y588 F592 H754 G755 T756 I760 G761 V762	Y588-I758 HydrophobicContact CD1-CD1 4.45Å; Y588-I758 HydrophobicContact CD1-CG1 3.62Å; Y588-I758 HydrophobicContact CD2-CG1 3.74Å; Y588-I758 HydrophobicContact CE1-CD1 4.01Å; Y588-I758 HydrophobicContact CE1-CG1 3.6Å; Y588-I758 HydrophobicContact CE2-CD1 4.49Å; Y588-I758 HydrophobicContact CE2-CG1 3.73Å; Y588-I758 HydrophobicContact CG-CG1 3.7Å; F592-I758 HydrophobicContact CE2-CG2 4.2Å; F592-I758 HydrophobicContact CZ-CG2 4.39Å; H754-I758 WeakPolarHBondContact O-CB 3.35Å; H754-I758 WeakPolarHBondContact O-CD1 3.44Å; H754-I758 WeakPolarHBondContact O-CG1 3.47Å; H754-I758 PolarHBondContact O-N 3.21Å; G755-I758 PolarHBondContact O-N 3.33Å; T756-I758 VanDerWaalsContact C-N 3.34Å; I758-I760 PolarHBondContact O-N 3.45Å; I758-G761 PolarHBondContact O-N 3.47Å; I758-V762 HydrophobicContact CG2-CG2 4.4Å; I758-V762 VanDerWaalsContact O-CG2 3.31Å; I758-V762 WeakPolarHBondContact O-CG2 3.27Å; I758-V762 PolarHBondContact O-N 2.73Å
759	A	90.6	Very high	90.5	Very high	63 Å²	63	33.8 Å²	33.8	52%	0.521	22%	0.215	S	C	.	.	H	α-helix	trans	-59.6	-46.3	-179.9	0	0	0	0	0	112	G755 T756 V762 A763	G755-A759 PolarHBondContact O-N 3.34Å; T756-A759 PolarHBondContact O-N 3.11Å; A759-V762 PolarHBondContact O-N 2.94Å; A759-A763 PolarHBondContact O-N 3.39Å; A759-A763 VanDerWaalsContact O-N 3.11Å
760	I	90.1	Very high	90.6	Very high	10 Å²	10	32 Å²	32	5%	0.051	20%	0.199	C	C	.	.	H	α-helix	trans	-67	-40.4	176	-62.7	169.4	0	0	0	110.7	V563 L567 V570 T756 I758 V762 A763 L764 L953	V563-I760 HydrophobicContact CG1-CG2 4.42Å; L567-I760 HydrophobicContact CD2-CD1 3.91Å; L567-I760 HydrophobicContact CD2-CG2 3.96Å; L567-I760 HydrophobicContact CG-CG2 4.27Å; V570-I760 HydrophobicContact CG2-CD1 4.21Å; T756-I760 WeakPolarHBondContact O-CG1 3.41Å; T756-I760 PolarHBondContact O-N 3.31Å; I758-I760 PolarHBondContact O-N 3.45Å; I760-V762 PolarHBondContact O-N 3.04Å; I760-A763 PolarHBondContact O-N 3.42Å; I760-L764 WeakPolarHBondContact O-CB 3.49Å; I760-L764 PolarHBondContact O-N 3.48Å; I760-L953 HydrophobicContact CG1-CD1 4.3Å
761	G	92.6	Very high	90.8	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-61.8	-40.1	177	0	0	0	0	0	113.3	S757 I758 L764 A765	S757-G761 WeakPolarHBondContact O-CA 3.31Å; S757-G761 PolarHBondContact O-N 2.89Å; I758-G761 PolarHBondContact O-N 3.47Å; G761-L764 PolarHBondContact O-N 2.86Å; G761-A765 WeakPolarHBondContact O-CB 3.33Å; G761-A765 PolarHBondContact O-N 2.95Å
762	V	91.5	Very high	90.9	Very high	45 Å²	45	23.2 Å²	23.2	27%	0.273	14%	0.144	S	C	.	.	H	α-helix	trans	-63.7	-48.1	172.7	172.5	0	0	0	0	110.6	F592 I758 A759 I760 L764 A765 I766	F592-V762 HydrophobicContact CD1-CG2 4.16Å; F592-V762 HydrophobicContact CD2-CG2 3.6Å; F592-V762 HydrophobicContact CE1-CG2 3.75Å; F592-V762 HydrophobicContact CE2-CB 4.43Å; F592-V762 HydrophobicContact CE2-CG2 3.16Å; F592-V762 HydrophobicContact CG-CG2 4.11Å; F592-V762 HydrophobicContact CZ-CG2 3.24Å; I758-V762 HydrophobicContact CG2-CG2 4.4Å; I758-V762 VanDerWaalsContact O-CG2 3.31Å; I758-V762 WeakPolarHBondContact O-CG2 3.27Å; I758-V762 PolarHBondContact O-N 2.73Å; A759-V762 PolarHBondContact O-N 2.94Å; I760-V762 PolarHBondContact O-N 3.04Å; V762-L764 VanDerWaalsContact C-N 3.32Å; V762-L764 PolarHBondContact O-N 3.49Å; V762-A765 PolarHBondContact O-N 2.75Å; V762-I766 HydrophobicContact CG1-CD1 3.9Å; V762-I766 WeakPolarHBondContact O-CG1 2.96Å; V762-I766 PolarHBondContact O-N 3.33Å
763	A	90.1	Very high	91	Very high	17 Å²	17	18.8 Å²	18.8	14%	0.14	12%	0.122	C	C	.	.	H	α-helix	trans	-58.8	-46.1	178	0	0	0	0	0	110.7	A759 I760 A765 I766 I767 L953	A759-A763 PolarHBondContact O-N 3.39Å; A759-A763 VanDerWaalsContact O-N 3.11Å; I760-A763 PolarHBondContact O-N 3.42Å; A763-A765 PolarHBondContact O-N 2.81Å; A763-I766 PolarHBondContact O-N 3.27Å; A763-I767 WeakPolarHBondContact O-CD1 3.07Å; A763-I767 WeakPolarHBondContact O-CG1 3.27Å; A763-I767 PolarHBondContact O-N 2.67Å; A763-L953 HydrophobicContact CB-CB 4.45Å
764	L	92.1	Very high	90.9	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.005	12%	0.122	C	C	.	.	H	α-helix	trans	-60.4	-43.1	176.4	-176.8	58.4	0	0	0	112.2	M560 V563 C589 I760 G761 V762 I766 I767 I768 F812	M560-L764 HydrophobicContact CE-CD1 3.69Å; M560-L764 HydrophobicContact SD-CD1 3.86Å; V563-L764 HydrophobicContact CG1-CD1 4.2Å; V563-L764 HydrophobicContact CG2-CD1 4.23Å; C589-L764 HydrophobicContact CB-CB 4.39Å; C589-L764 HydrophobicContact CB-CD2 3.97Å; C589-L764 HydrophobicContact CB-CG 4.24Å; I760-L764 WeakPolarHBondContact O-CB 3.49Å; I760-L764 PolarHBondContact O-N 3.48Å; G761-L764 PolarHBondContact O-N 2.86Å; V762-L764 VanDerWaalsContact C-N 3.32Å; V762-L764 PolarHBondContact O-N 3.49Å; L764-I766 PolarHBondContact O-N 3.48Å; L764-I767 WeakPolarHBondContact O-CB 2.98Å; L764-I767 PolarHBondContact O-N 2.69Å; L764-I768 HydrophobicContact CD1-CD1 3.77Å; L764-I768 HydrophobicContact CD1-CG1 4.01Å; L764-I768 HydrophobicContact CG-CD1 3.84Å; L764-I768 HydrophobicContact CG-CG1 4.42Å; L764-I768 WeakPolarHBondContact O-CB 3.44Å; L764-I768 WeakPolarHBondContact O-CG1 3.5Å; L764-I768 PolarHBondContact O-N 3.18Å; L764-F812 HydrophobicContact CD2-CD1 4.09Å; L764-F812 HydrophobicContact CD2-CD2 4.23Å; L764-F812 HydrophobicContact CD2-CE1 3.89Å; L764-F812 HydrophobicContact CD2-CE2 4.05Å; L764-F812 HydrophobicContact CD2-CG 4.27Å; L764-F812 HydrophobicContact CD2-CZ 3.88Å
765	A	92.6	Very high	90.8	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-61.3	-42.8	176.5	0	0	0	0	0	112	F592 F596 G761 V762 A763 F769 Q798	F592-A765 HydrophobicContact CB-CB 3.8Å; F596-A765 HydrophobicContact CE2-CB 4.22Å; G761-A765 WeakPolarHBondContact O-CB 3.33Å; G761-A765 PolarHBondContact O-N 2.95Å; V762-A765 PolarHBondContact O-N 2.75Å; A763-A765 PolarHBondContact O-N 2.81Å; A765-F769 WeakPolarHBondContact O-CB 3.39Å; A765-F769 PolarHBondContact O-N 2.84Å; A765-Q798 PolarHBondContact O-NE2 2.72Å
766	I	90.4	Very high	90.7	Very high	37 Å²	37	15 Å²	15	19%	0.19	9%	0.094	C	C	.	.	H	α-helix	trans	-66.6	-39.8	176.6	-64.4	168.5	0	0	0	111.2	F596 V762 A763 L764 F769 T770 P956	F596-I766 HydrophobicContact CZ-CG1 4.24Å; V762-I766 HydrophobicContact CG1-CD1 3.9Å; V762-I766 WeakPolarHBondContact O-CG1 2.96Å; V762-I766 PolarHBondContact O-N 3.33Å; A763-I766 PolarHBondContact O-N 3.27Å; L764-I766 PolarHBondContact O-N 3.48Å; I766-F769 WeakPolarHBondContact O-CB 3.49Å; I766-F769 PolarHBondContact O-N 3.22Å; I766-T770 WeakPolarHBondContact O-CB 2.97Å; I766-T770 PolarHBondContact O-N 3.18Å; I766-T770 PolarHBondContact O-OG1 2.87Å; I766-P956 HydrophobicContact CG2-CB 4.19Å
767	I	90.9	Very high	90.5	Very high	1 Å²	1	13.5 Å²	13.5	1%	0.005	9%	0.085	C	C	.	.	H	α-helix	trans	-59	-57.3	175.1	-68.5	162.6	0	0	0	109.9	P559 M560 V563 A763 L764 F769 T770 E771 F955 P956	P559-I767 HydrophobicContact CB-CG2 3.65Å; M560-I767 HydrophobicContact CE-CB 4.13Å; M560-I767 HydrophobicContact CE-CG2 3.23Å; V563-I767 HydrophobicContact CG2-CD1 3.45Å; V563-I767 VanDerWaalsContact CG2-CD1 3.45Å; A763-I767 WeakPolarHBondContact O-CD1 3.07Å; A763-I767 WeakPolarHBondContact O-CG1 3.27Å; A763-I767 PolarHBondContact O-N 2.67Å; L764-I767 WeakPolarHBondContact O-CB 2.98Å; L764-I767 PolarHBondContact O-N 2.69Å; I767-F769 PolarHBondContact O-N 3.06Å; I767-T770 PolarHBondContact O-N 3.5Å; I767-T770 VanDerWaalsContact O-N 3.08Å; I767-E771 HydrophobicContact CG2-CG 4.39Å; I767-E771 PolarHBondContact O-N 3.41Å; I767-F955 HydrophobicContact CD1-CZ 4.42Å; I767-F955 HydrophobicContact CG1-CZ 4.22Å; I767-F955 HydrophobicContact CG2-CZ 4.41Å; I767-P956 HydrophobicContact CB-CG 4.27Å; I767-P956 HydrophobicContact CD1-CG 3.94Å; I767-P956 HydrophobicContact CG1-CB 3.92Å; I767-P956 HydrophobicContact CG1-CG 3.13Å
768	I	92.3	Very high	90.2	Very high	1 Å²	1	13.5 Å²	13.5	1%	0.005	9%	0.085	C	C	.	.	H	α-helix	trans	-62	-37.5	-176.4	-66.6	174.2	0	0	0	110.1	M560 L764 T770 A772 L797 Q798 P802	M560-I768 HydrophobicContact CE-CG1 4.07Å; M560-I768 HydrophobicContact SD-CG1 4.22Å; L764-I768 HydrophobicContact CD1-CD1 3.77Å; L764-I768 HydrophobicContact CD1-CG1 4.01Å; L764-I768 HydrophobicContact CG-CD1 3.84Å; L764-I768 HydrophobicContact CG-CG1 4.42Å; L764-I768 WeakPolarHBondContact O-CB 3.44Å; L764-I768 WeakPolarHBondContact O-CG1 3.5Å; L764-I768 PolarHBondContact O-N 3.18Å; I768-T770 PolarHBondContact O-N 3.06Å; I768-A772 WeakPolarHBondContact O-CB 3.28Å; I768-A772 PolarHBondContact O-N 3Å; I768-L797 HydrophobicContact CG2-CB 3.81Å; I768-L797 WeakPolarHBondContact CG2-O 3.23Å; I768-Q798 HydrophobicContact CB-CG 4.11Å; I768-Q798 HydrophobicContact CG2-CG 3.58Å; I768-P802 HydrophobicContact CD1-CG 4.11Å
769	F	91.2	Very high	89.8	Confident	13 Å²	13	10.4 Å²	10.4	6%	0.057	7%	0.069	C	C	.	.	H	α-helix	trans	-56	-52.5	173.3	-177	-105.6	0	0	0	111.4	F596 I601 I604 A765 I766 I767 A772 A773 F790 L794	F596-F769 HydrophobicContact CD2-CD2 4.35Å; F596-F769 HydrophobicContact CE2-CB 4.36Å; I601-F769 HydrophobicContact CG2-CE1 4.35Å; I601-F769 HydrophobicContact CG2-CE2 3.75Å; I601-F769 HydrophobicContact CG2-CZ 3.66Å; I604-F769 HydrophobicContact CB-CZ 4.35Å; A765-F769 WeakPolarHBondContact O-CB 3.39Å; A765-F769 PolarHBondContact O-N 2.84Å; I766-F769 WeakPolarHBondContact O-CB 3.49Å; I766-F769 PolarHBondContact O-N 3.22Å; I767-F769 PolarHBondContact O-N 3.06Å; F769-A772 PolarHBondContact O-N 3.06Å; F769-A773 WeakPolarHBondContact O-CB 3.38Å; F769-A773 PolarHBondContact O-N 3.04Å; F769-F790 AromaticContact CE2-CE1 3.99Å; F769-F790 HydrophobicContact CE2-CE1 3.99Å; F769-F790 HydrophobicContact CE2-CZ 4.46Å; F769-F790 HydrophobicContact CZ-CE1 4.49Å; F769-L794 HydrophobicContact CD2-CD1 3.75Å; F769-L794 HydrophobicContact CD2-CD2 4.46Å; F769-L794 HydrophobicContact CE2-CD1 4.38Å; F769-L794 HydrophobicContact CE2-CD2 4.43Å
770	T	88.4	Confident	89.4	Confident	12 Å²	12	8.2 Å²	8.2	7%	0.074	5%	0.048	C	C	.	.	H	α-helix	trans	-65.7	-46.1	-174.7	-56.1	0	0	0	0	110.4	I766 I767 I768 A773 L774 I959	I766-T770 WeakPolarHBondContact O-CB 2.97Å; I766-T770 PolarHBondContact O-N 3.18Å; I766-T770 PolarHBondContact O-OG1 2.87Å; I767-T770 PolarHBondContact O-N 3.5Å; I767-T770 VanDerWaalsContact O-N 3.08Å; I768-T770 PolarHBondContact O-N 3.06Å; T770-A773 PolarHBondContact O-N 3.12Å; T770-L774 HydrophobicContact CG2-CD1 3.95Å; T770-L774 WeakPolarHBondContact O-CB 3.49Å; T770-L774 VanDerWaalsContact O-CG 3.23Å; T770-L774 WeakPolarHBondContact O-CG 3.42Å; T770-L774 PolarHBondContact O-N 2.57Å; T770-I959 HydrophobicContact CG2-CG2 4.1Å
771	E	90.1	Very high	88.8	Confident	2 Å²	2	10.2 Å²	10.2	1%	0.009	6%	0.056	C	C	.	.	H	α-helix	trans	-64.4	-43.3	176.7	-73.6	-169	120.8	0	0	112.3	S557 P559 Y616 I767 A773 L774 N775 S814	S557-E771 WeakPolarHBondContact CB-OE1 3.48Å; S557-E771 PolarHBondContact OG-OE1 3.17Å; S557-E771 PolarHBondContact OG-OE2 3.01Å; P559-E771 VanDerWaalsContact CG-OE1 3.25Å; P559-E771 WeakPolarHBondContact CG-OE1 3.19Å; Y616-E771 WeakPolarHBondContact OH-CG 3.15Å; Y616-E771 PolarHBondContact OH-OE1 2.91Å; I767-E771 HydrophobicContact CG2-CG 4.39Å; I767-E771 PolarHBondContact O-N 3.41Å; E771-A773 VanDerWaalsContact C-N 3.34Å; E771-A773 PolarHBondContact O-N 3.22Å; E771-L774 PolarHBondContact O-N 3.16Å; E771-N775 WeakPolarHBondContact O-CB 3.2Å; E771-N775 PolarHBondContact O-N 3.04Å; E771-S814 PolarHBondContact OE1-OG 3.43Å; E771-S814 WeakPolarHBondContact OE2-CB 3.31Å; E771-S814 PolarHBondContact OE2-OG 2.97Å
772	A	91.1	Very high	87.8	Confident	2 Å²	2	11.1 Å²	11.1	2%	0.017	6%	0.061	C	C	.	.	H	α-helix	trans	-59.1	-46.9	176	0	0	0	0	0	111	I768 F769 N775 G776 F790 L797	I768-A772 WeakPolarHBondContact O-CB 3.28Å; I768-A772 PolarHBondContact O-N 3Å; F769-A772 PolarHBondContact O-N 3.06Å; A772-N775 PolarHBondContact O-N 3.2Å; A772-G776 PolarHBondContact O-N 2.7Å; A772-F790 VanDerWaalsContact C-CE2 3.47Å; A772-F790 HydrophobicContact CB-CE2 4.01Å; A772-F790 HydrophobicContact CB-CZ 4.12Å; A772-F790 WeakPolarHBondContact O-CE2 3.44Å; A772-L797 HydrophobicContact CB-CD1 3.57Å
773	A	89.1	Confident	86.8	Confident	5 Å²	5	13 Å²	13	4%	0.041	7%	0.065	C	C	.	.	H	α-helix	trans	-65.2	-44.6	-177.6	0	0	0	0	0	112	A605 I608 F769 T770 E771 N775 G776 L777 F790	A605-A773 HydrophobicContact CB-CB 4.07Å; I608-A773 HydrophobicContact CD1-CB 3.4Å; I608-A773 VanDerWaalsContact CD1-CB 3.4Å; F769-A773 WeakPolarHBondContact O-CB 3.38Å; F769-A773 PolarHBondContact O-N 3.04Å; T770-A773 PolarHBondContact O-N 3.12Å; E771-A773 VanDerWaalsContact C-N 3.34Å; E771-A773 PolarHBondContact O-N 3.22Å; A773-N775 VanDerWaalsContact C-N 3.35Å; A773-G776 PolarHBondContact O-N 3.37Å; A773-L777 WeakPolarHBondContact O-CB 3.38Å; A773-L777 PolarHBondContact O-N 3.01Å; A773-F790 VanDerWaalsContact CA-CZ 3.49Å; A773-F790 HydrophobicContact CB-CE1 4.31Å; A773-F790 HydrophobicContact CB-CE2 3.95Å; A773-F790 HydrophobicContact CB-CZ 3.58Å
774	L	88.4	Confident	86	Confident	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-65.7	-37.2	175.6	-68.2	174.9	0	0	0	112.2	I608 V612 E613 Y616 T770 E771 L777 T778 T817	I608-L774 HydrophobicContact CG2-CD2 3.71Å; V612-L774 HydrophobicContact CG1-CD2 4.41Å; E613-L774 HydrophobicContact CB-CD2 3.89Å; E613-L774 HydrophobicContact CG-CD2 4.01Å; Y616-L774 HydrophobicContact CD1-CB 4.46Å; Y616-L774 HydrophobicContact CD1-CD1 3.47Å; Y616-L774 VanDerWaalsContact CD1-CD1 3.47Å; Y616-L774 HydrophobicContact CD2-CD1 4.06Å; Y616-L774 HydrophobicContact CE1-CD1 4.13Å; Y616-L774 HydrophobicContact CG-CD1 3.41Å; Y616-L774 VanDerWaalsContact CG-CD1 3.41Å; T770-L774 HydrophobicContact CG2-CD1 3.95Å; T770-L774 WeakPolarHBondContact O-CB 3.49Å; T770-L774 VanDerWaalsContact O-CG 3.23Å; T770-L774 WeakPolarHBondContact O-CG 3.42Å; T770-L774 PolarHBondContact O-N 2.57Å; E771-L774 PolarHBondContact O-N 3.16Å; L774-L777 PolarHBondContact O-N 3.19Å; L774-T778 WeakPolarHBondContact O-CB 3.38Å; L774-T778 PolarHBondContact O-N 3.41Å; L774-T778 PolarHBondContact O-OG1 3.46Å; L774-T817 HydrophobicContact CB-CG2 3.98Å
775	N	90.4	Very high	85.3	Confident	2 Å²	2	17.6 Å²	17.6	1%	0.011	9%	0.093	C	C	.	.	H	α-helix	trans	-67.7	-44.5	178	-161.5	35.1	0	0	0	111.9	I553 E771 A772 A773 L777 T778 A779 G815 T816 T820	I553-N775 PolarHBondContact O-ND2 3.39Å; E771-N775 WeakPolarHBondContact O-CB 3.2Å; E771-N775 PolarHBondContact O-N 3.04Å; A772-N775 PolarHBondContact O-N 3.2Å; A773-N775 VanDerWaalsContact C-N 3.35Å; N775-L777 VanDerWaalsContact C-N 3.32Å; N775-L777 PolarHBondContact O-N 3.29Å; N775-T778 PolarHBondContact O-N 2.53Å; N775-A779 PolarHBondContact O-N 3.49Å; N775-G815 WeakPolarHBondContact ND2-CA 3.26Å; N775-T816 PolarHBondContact OD1-O 3.49Å; N775-T820 WeakPolarHBondContact OD1-CB 3.49Å; N775-T820 PolarHBondContact OD1-OG1 3.43Å
776	G	88.5	Confident	84.9	Confident	1 Å²	1	19.4 Å²	19.4	1%	0.01	10%	0.101	C	C	.	.	H	α-helix	trans	-62.6	-36.4	174.9	0	0	0	0	0	113	A772 A773 M780 N788	A772-G776 PolarHBondContact O-N 2.7Å; A773-G776 PolarHBondContact O-N 3.37Å; G776-M780 WeakPolarHBondContact O-CG 3.06Å; G776-N788 VanDerWaalsContact C-ND2 3.35Å; G776-N788 WeakPolarHBondContact CA-ND2 3.36Å; G776-N788 PolarHBondContact O-ND2 3.32Å; G776-N788 VanDerWaalsContact O-ND2 3.1Å
777	L	84.3	Confident	84.4	Confident	6 Å²	6	19.9 Å²	19.9	3%	0.031	11%	0.106	C	C	.	.	H	α-helix	trans	-67.8	-45.3	174.4	-171	64.3	0	0	0	111.9	I608 A773 L774 N775 A779 M780 Y987	I608-L777 HydrophobicContact CG2-CD2 4.05Å; A773-L777 WeakPolarHBondContact O-CB 3.38Å; A773-L777 PolarHBondContact O-N 3.01Å; L774-L777 PolarHBondContact O-N 3.19Å; N775-L777 VanDerWaalsContact C-N 3.32Å; N775-L777 PolarHBondContact O-N 3.29Å; L777-A779 PolarHBondContact O-N 3.26Å; L777-M780 PolarHBondContact O-N 2.88Å; L777-Y987 HydrophobicContact CD1-CD2 3.52Å; L777-Y987 HydrophobicContact CD1-CE2 4.44Å; L777-Y987 HydrophobicContact CD1-CG 3.78Å; L777-Y987 HydrophobicContact CD2-CD2 3.77Å; L777-Y987 HydrophobicContact CD2-CE2 4.09Å; L777-Y987 HydrophobicContact CG-CD2 3.66Å; L777-Y987 HydrophobicContact CG-CE2 4.11Å; L777-Y987 HydrophobicContact CG-CG 4.31Å
778	T	84.8	Confident	84	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-58.3	-37.8	177.9	-56.4	0	0	0	0	111	E613 L774 N775 M780 K781 T820 L821 L824	E613-T778 PolarHBondContact OE1-OG1 2.86Å; L774-T778 WeakPolarHBondContact O-CB 3.38Å; L774-T778 PolarHBondContact O-N 3.41Å; L774-T778 PolarHBondContact O-OG1 3.46Å; N775-T778 PolarHBondContact O-N 2.53Å; T778-M780 PolarHBondContact O-N 3.42Å; T778-K781 WeakPolarHBondContact O-CG 3.4Å; T778-K781 PolarHBondContact O-N 3.06Å; T778-T820 HydrophobicContact CG2-CG2 4.31Å; T778-L821 HydrophobicContact CG2-CB 4.02Å; T778-L824 WeakPolarHBondContact O-CD1 3.42Å
779	A	86.2	Confident	83.8	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-11.8	177.5	0	0	0	0	0	114.5	Q549 L551 A552 N775 L777 T820 L824	Q549-A779 HydrophobicContact CG-CB 3.56Å; Q549-A779 PolarHBondContact NE2-O 3.21Å; L551-A779 HydrophobicContact CB-CB 4.36Å; A552-A779 HydrophobicContact CB-CB 4.44Å; N775-A779 PolarHBondContact O-N 3.49Å; L777-A779 PolarHBondContact O-N 3.26Å; A779-T820 HydrophobicContact CB-CG2 3.9Å; A779-L824 VanDerWaalsContact C-CD1 3.47Å; A779-L824 VanDerWaalsContact O-CD1 3.23Å; A779-L824 WeakPolarHBondContact O-CD1 3.29Å
780	M	82.8	Confident	83.6	Confident	17 Å²	17	21 Å²	21	8%	0.084	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-1.8	-178.7	-65.5	-62.2	-69.1	0	0	114	Q549 G776 L777 T778 N782 A784 K786 N788	Q549-M780 PolarHBondContact NE2-SD 3.24Å; Q549-M780 VanDerWaalsContact NE2-SD 3.37Å; G776-M780 WeakPolarHBondContact O-CG 3.06Å; L777-M780 PolarHBondContact O-N 2.88Å; T778-M780 PolarHBondContact O-N 3.42Å; M780-N782 PolarHBondContact O-N 3.02Å; M780-A784 HydrophobicContact CE-CB 3.66Å; M780-A784 HydrophobicContact SD-CB 3.59Å; M780-A784 VanDerWaalsContact SD-CB 3.59Å; M780-K786 WeakPolarHBondContact CE-O 3.41Å; M780-N788 HydrophobicContact CG-CB 4.09Å; M780-N788 HydrophobicContact SD-CB 3.97Å
781	K	76.7	Confident	83.7	Confident	52 Å²	52	20.8 Å²	20.8	23%	0.226	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-39	-170.1	-73.5	-171.8	179.9	-170.7	0	116	E613 T778 K783 Y987	E613-K781 WeakPolarHBondContact OE1-CE 3.25Å; E613-K781 IonicContact OE1-NZ 3.32Å; E613-K781 PolarHBondContact OE1-NZ 2.99Å; E613-K781 WeakPolarHBondContact OE2-CE 3.39Å; E613-K781 IonicContact OE2-NZ 3.18Å; E613-K781 PolarHBondContact OE2-NZ 3Å; E613-K781 VanDerWaalsContact OE2-NZ 3.16Å; T778-K781 WeakPolarHBondContact O-CG 3.4Å; T778-K781 PolarHBondContact O-N 3.06Å; K781-K783 PolarHBondContact O-N 3.43Å; K781-Y987 VanDerWaalsContact CE-OH 3.28Å; K781-Y987 WeakPolarHBondContact CE-OH 3.47Å; K781-Y987 HydrophobicContact CG-CE1 3.91Å
782	N	72.1	Confident	83.7	Confident	20 Å²	20	21.5 Å²	21.5	11%	0.107	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	53.8	-171.5	-68.5	-4.8	0	0	0	113.1	M780 L824 V828 T845 R1055	M780-N782 PolarHBondContact O-N 3.02Å; N782-L824 HydrophobicContact CB-CD2 3.49Å; N782-L824 VanDerWaalsContact CB-CD2 3.49Å; N782-L824 HydrophobicContact CB-CG 4.43Å; N782-L824 WeakPolarHBondContact ND2-CD2 3.02Å; N782-V828 HydrophobicContact CB-CG2 4.08Å; N782-V828 WeakPolarHBondContact ND2-CG2 3.33Å; N782-T845 VanDerWaalsContact CB-OG1 3.3Å; N782-T845 WeakPolarHBondContact CB-OG1 3.26Å; N782-T845 PolarHBondContact O-N 3.36Å; N782-T845 PolarHBondContact O-OG1 2.91Å; N782-R1055 PolarHBondContact ND2-NH2 3.1Å
783	K	69.8	Low	83.8	Confident	83 Å²	83	21.5 Å²	21.5	36%	0.361	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	54.6	175	-55.7	179.9	-177.2	177.4	0	112.6	K781	K781-K783 PolarHBondContact O-N 3.43Å
784	A	74.1	Confident	84	Confident	9 Å²	9	21.3 Å²	21.3	7%	0.074	11%	0.112	C	C	.	.			trans	-63.6	137.4	166.9	0	0	0	0	0	109.7	M780 E847	M780-A784 HydrophobicContact CE-CB 3.66Å; M780-A784 HydrophobicContact SD-CB 3.59Å; M780-A784 VanDerWaalsContact SD-CB 3.59Å; A784-E847 VanDerWaalsContact CA-OE1 3.29Å; A784-E847 WeakPolarHBondContact CA-OE1 2.98Å; A784-E847 WeakPolarHBondContact CB-OE1 3.13Å
785	V	76.3	Confident	84.2	Confident	107 Å²	107	22.5 Å²	22.5	65%	0.648	12%	0.119	S	C	*	.			trans	-97.5	-28.9	-174.7	180	0	0	0	0	111.1	E847 P991	V785-E847 PolarHBondContact N-OE1 3.21Å; V785-P991 WeakPolarHBondContact O-CG 3.5Å
786	K	85.3	Confident	84.4	Confident	38 Å²	38	22.7 Å²	22.7	17%	0.165	12%	0.12	C	C	.	.	S	Bend	trans	-91	140.7	179.2	-67.3	165.2	-162.9	168.9	0	110.1	R480 D484 D487 M780 E847	R480-K786 HydrophobicContact CG-CD 4.05Å; D484-K786 IonicContact OD1-NZ 3.02Å; D484-K786 PolarHBondContact OD1-NZ 3.23Å; D487-K786 WeakPolarHBondContact OD2-CE 3.33Å; D487-K786 IonicContact OD2-NZ 2.84Å; D487-K786 PolarHBondContact OD2-NZ 3.09Å; M780-K786 WeakPolarHBondContact CE-O 3.41Å; K786-E847 WeakPolarHBondContact CB-OE2 3.45Å; K786-E847 HydrophobicContact CD-CB 4.24Å; K786-E847 WeakPolarHBondContact CD-OE2 3.33Å; K786-E847 WeakPolarHBondContact CE-OE2 3.41Å; K786-E847 WeakPolarHBondContact CG-OE2 3.38Å; K786-E847 PolarHBondContact N-OE1 2.86Å; K786-E847 PolarHBondContact N-OE2 3.3Å; K786-E847 VanDerWaalsContact N-OE2 3.13Å
787	P	78.6	Confident	84.7	Confident	46 Å²	46	22.7 Å²	22.7	30%	0.299	12%	0.12	S	C	.	.	P	Polyproline II helix	trans	-66.7	144.3	179.5	29.1	-35.5	0	0	0	111.2	R480 H990	R480-P787 PolarHBondContact NH1-O 3.1Å; P787-H990 WeakPolarHBondContact CB-ND1 3.49Å
788	N	82.7	Confident	85.1	Confident	11 Å²	11	22.4 Å²	22.4	6%	0.059	12%	0.119	C	C	.	.	P	Polyproline II helix	trans	-76	123.1	172.4	-175.7	-2.3	0	0	0	110.3	Q549 G776 M780 F790	Q549-N788 WeakPolarHBondContact CB-OD1 3.34Å; G776-N788 VanDerWaalsContact C-ND2 3.35Å; G776-N788 WeakPolarHBondContact CA-ND2 3.36Å; G776-N788 PolarHBondContact O-ND2 3.32Å; G776-N788 VanDerWaalsContact O-ND2 3.1Å; M780-N788 HydrophobicContact CG-CB 4.09Å; M780-N788 HydrophobicContact SD-CB 3.97Å; N788-F790 PolarHBondContact O-N 3.3Å
789	I	87.9	Confident	85.6	Confident	15 Å²	15	23 Å²	23	8%	0.077	12%	0.122	C	C	.	.			trans	-97.5	76.4	177.7	-51.4	172.3	0	0	0	108.4	P476 W477 V791 M792	P476-I789 HydrophobicContact CB-CD1 3.9Å; W477-I789 HydrophobicContact CB-CD1 3.67Å; W477-I789 VanDerWaalsContact N-CD1 3.32Å; I789-V791 VanDerWaalsContact C-N 3.3Å; I789-V791 HydrophobicContact CG2-CG1 4.12Å; I789-V791 PolarHBondContact O-N 3.34Å; I789-M792 HydrophobicContact CG2-CB 4.48Å; I789-M792 HydrophobicContact CG2-CG 3.8Å; I789-M792 PolarHBondContact O-N 3.48Å
790	F	87.7	Confident	86	Confident	14 Å²	14	26.1 Å²	26.1	6%	0.061	14%	0.137	C	C	.	.	H	α-helix	trans	-60	-35	-169.3	-176.4	-114.8	0	0	0	114.3	A605 F769 A772 A773 N788 M792 D793 L794	A605-F790 HydrophobicContact CB-CD1 3.54Å; A605-F790 HydrophobicContact CB-CE1 3.61Å; A605-F790 HydrophobicContact CB-CG 4.06Å; A605-F790 HydrophobicContact CB-CZ 4.19Å; F769-F790 AromaticContact CE2-CE1 3.99Å; F769-F790 HydrophobicContact CE2-CE1 3.99Å; F769-F790 HydrophobicContact CE2-CZ 4.46Å; F769-F790 HydrophobicContact CZ-CE1 4.49Å; A772-F790 VanDerWaalsContact C-CE2 3.47Å; A772-F790 HydrophobicContact CB-CE2 4.01Å; A772-F790 HydrophobicContact CB-CZ 4.12Å; A772-F790 WeakPolarHBondContact O-CE2 3.44Å; A773-F790 VanDerWaalsContact CA-CZ 3.49Å; A773-F790 HydrophobicContact CB-CE1 4.31Å; A773-F790 HydrophobicContact CB-CE2 3.95Å; A773-F790 HydrophobicContact CB-CZ 3.58Å; N788-F790 PolarHBondContact O-N 3.3Å; F790-M792 PolarHBondContact O-N 3.1Å; F790-D793 WeakPolarHBondContact O-CB 3.2Å; F790-D793 PolarHBondContact O-N 2.81Å; F790-D793 VanDerWaalsContact O-N 3.1Å; F790-L794 PolarHBondContact O-N 3.32Å; F790-L794 VanDerWaalsContact O-N 3.08Å
791	V	90.5	Very high	86.6	Confident	6 Å²	6	25.5 Å²	25.5	4%	0.036	13%	0.134	C	C	.	.	H	α-helix	trans	-59.3	-33.1	-179	70	0	0	0	0	113	L470 V597 I789 L794 V795	L470-V791 HydrophobicContact CB-CG2 4.02Å; L470-V791 HydrophobicContact CD1-CG1 4.49Å; L470-V791 HydrophobicContact CD1-CG2 4.11Å; V597-V791 HydrophobicContact CG1-CG2 4.27Å; I789-V791 VanDerWaalsContact C-N 3.3Å; I789-V791 HydrophobicContact CG2-CG1 4.12Å; I789-V791 PolarHBondContact O-N 3.34Å; V791-L794 WeakPolarHBondContact O-CB 3.49Å; V791-L794 PolarHBondContact O-N 2.91Å; V791-V795 WeakPolarHBondContact O-CG2 3.47Å; V791-V795 PolarHBondContact O-N 2.96Å; V791-V795 VanDerWaalsContact O-N 3.07Å
792	M	91.3	Very high	87.5	Confident	17 Å²	17	23 Å²	23	8%	0.084	12%	0.124	C	C	.	.	H	α-helix	trans	-70.3	-38.4	178.4	-66.9	-53.9	-55.9	0	0	111.4	L470 I474 W477 I789 F790 L794 V795 L796	L470-M792 HydrophobicContact CD1-SD 3.98Å; I474-M792 HydrophobicContact CG1-SD 4.11Å; W477-M792 HydrophobicContact CB-CG 4.19Å; W477-M792 HydrophobicContact CD2-CE 3.83Å; W477-M792 HydrophobicContact CD2-CG 4.19Å; W477-M792 HydrophobicContact CD2-SD 4.3Å; W477-M792 HydrophobicContact CE3-CE 3.87Å; W477-M792 HydrophobicContact CE3-SD 4.36Å; W477-M792 HydrophobicContact CG-CG 3.9Å; W477-M792 HydrophobicContact CH2-CE 3.87Å; W477-M792 HydrophobicContact CZ2-CE 3.78Å; W477-M792 HydrophobicContact CZ3-CE 3.91Å; I789-M792 HydrophobicContact CG2-CB 4.48Å; I789-M792 HydrophobicContact CG2-CG 3.8Å; I789-M792 PolarHBondContact O-N 3.48Å; F790-M792 PolarHBondContact O-N 3.1Å; M792-L794 VanDerWaalsContact C-N 3.29Å; M792-L794 PolarHBondContact O-N 3.27Å; M792-V795 PolarHBondContact O-N 2.9Å; M792-L796 WeakPolarHBondContact O-CG 3.44Å; M792-L796 PolarHBondContact O-N 2.88Å
793	D	92.6	Very high	88.6	Confident	3 Å²	3	25.3 Å²	25.3	2%	0.016	14%	0.135	C	C	.	.	H	α-helix	trans	-64.7	-38.8	175.8	-62.1	-10.6	0	0	0	110.3	F543 S547 G548 Q549 F790 L796 L797	F543-D793 HydrophobicContact CE2-CB 4.21Å; F543-D793 HydrophobicContact CZ-CB 4.43Å; S547-D793 WeakPolarHBondContact CA-OD1 3.24Å; S547-D793 VanDerWaalsContact CB-OD1 3.25Å; S547-D793 WeakPolarHBondContact CB-OD1 3.29Å; G548-D793 WeakPolarHBondContact CA-OD1 3.36Å; G548-D793 PolarHBondContact N-OD1 3.03Å; Q549-D793 PolarHBondContact N-OD1 2.9Å; F790-D793 WeakPolarHBondContact O-CB 3.2Å; F790-D793 PolarHBondContact O-N 2.81Å; F790-D793 VanDerWaalsContact O-N 3.1Å; D793-L796 PolarHBondContact O-N 3.5Å; D793-L797 VanDerWaalsContact O-CB 3.24Å; D793-L797 WeakPolarHBondContact O-CB 3.18Å; D793-L797 WeakPolarHBondContact O-CG 3.48Å; D793-L797 PolarHBondContact O-N 3.08Å
794	L	92.3	Very high	89.8	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-63.7	-44.8	177.7	-169.8	65.6	0	0	0	112.4	V597 F769 F790 V791 M792 L796 L797 Q798	V597-L794 HydrophobicContact CG2-CD2 3.73Å; V597-L794 HydrophobicContact CG2-CG 3.99Å; F769-L794 HydrophobicContact CD2-CD1 3.75Å; F769-L794 HydrophobicContact CD2-CD2 4.46Å; F769-L794 HydrophobicContact CE2-CD1 4.38Å; F769-L794 HydrophobicContact CE2-CD2 4.43Å; F790-L794 PolarHBondContact O-N 3.32Å; F790-L794 VanDerWaalsContact O-N 3.08Å; V791-L794 WeakPolarHBondContact O-CB 3.49Å; V791-L794 PolarHBondContact O-N 2.91Å; M792-L794 VanDerWaalsContact C-N 3.29Å; M792-L794 PolarHBondContact O-N 3.27Å; L794-L796 VanDerWaalsContact C-N 3.34Å; L794-L796 PolarHBondContact O-N 3.48Å; L794-L797 PolarHBondContact O-N 3.39Å; L794-Q798 HydrophobicContact CD1-CB 4.41Å; L794-Q798 HydrophobicContact CD1-CG 3.78Å; L794-Q798 VanDerWaalsContact CD1-NE2 3.34Å; L794-Q798 WeakPolarHBondContact O-CB 3.12Å; L794-Q798 PolarHBondContact O-N 3.1Å
795	V	93.7	Very high	90.7	Very high	26 Å²	26	23 Å²	23	16%	0.158	13%	0.125	C	C	.	.	I	π-helix	trans	-59.9	-44.9	176.8	170.1	0	0	0	0	111	L470 V597 V791 M792 I799 I800	L470-V795 HydrophobicContact CD1-CG2 3.93Å; V597-V795 HydrophobicContact CG1-CG2 4.23Å; V597-V795 HydrophobicContact CG2-CG2 4.08Å; V791-V795 WeakPolarHBondContact O-CG2 3.47Å; V791-V795 PolarHBondContact O-N 2.96Å; V791-V795 VanDerWaalsContact O-N 3.07Å; M792-V795 PolarHBondContact O-N 2.9Å; V795-I799 HydrophobicContact CG2-CD1 4.48Å; V795-I799 VanDerWaalsContact O-CB 3.31Å; V795-I799 WeakPolarHBondContact O-CB 3.48Å; V795-I799 PolarHBondContact O-N 3.5Å; V795-I800 HydrophobicContact CG1-CD1 4.46Å; V795-I800 PolarHBondContact O-N 2.96Å; V795-I800 VanDerWaalsContact O-N 3.17Å
796	L	94.4	Very high	91.4	Very high	5 Å²	5	18.2 Å²	18.2	3%	0.026	10%	0.098	C	C	.	.	I	π-helix	trans	-64.9	-51	178	-65.8	177.9	0	0	0	111.7	F543 L546 M792 D793 L794 I800 F801	F543-L796 HydrophobicContact CD2-CB 4.38Å; F543-L796 HydrophobicContact CD2-CD1 3.82Å; F543-L796 HydrophobicContact CE2-CD1 4.33Å; L546-L796 HydrophobicContact CB-CD1 3.74Å; L546-L796 HydrophobicContact CB-CD2 3.96Å; L546-L796 HydrophobicContact CB-CG 4.45Å; L546-L796 HydrophobicContact CD1-CD2 4.16Å; M792-L796 WeakPolarHBondContact O-CG 3.44Å; M792-L796 PolarHBondContact O-N 2.88Å; D793-L796 PolarHBondContact O-N 3.5Å; L794-L796 VanDerWaalsContact C-N 3.34Å; L794-L796 PolarHBondContact O-N 3.48Å; L796-I800 HydrophobicContact CD2-CD1 3.92Å; L796-I800 PolarHBondContact O-N 3.37Å; L796-F801 HydrophobicContact CB-CE1 4.46Å; L796-F801 WeakPolarHBondContact O-CB 3.33Å; L796-F801 VanDerWaalsContact O-CD1 3.31Å; L796-F801 WeakPolarHBondContact O-CD1 3.26Å; L796-F801 WeakPolarHBondContact O-CG 3.37Å; L796-F801 PolarHBondContact O-N 3.14Å
797	L	94.3	Very high	91.7	Very high	2 Å²	2	20.2 Å²	20.2	1%	0.01	11%	0.109	C	C	.	.	I	π-helix	trans	-75.6	-35.6	-170.7	-78.1	173	0	0	0	114	F543 I554 I768 A772 D793 L794 F801 P802	F543-L797 HydrophobicContact CE2-CD1 4.24Å; F543-L797 HydrophobicContact CE2-CG 4.28Å; I554-L797 HydrophobicContact CD1-CD1 4.35Å; I554-L797 HydrophobicContact CD1-CD2 3.36Å; I554-L797 HydrophobicContact CD1-CG 4.07Å; I554-L797 HydrophobicContact CG1-CD2 4.26Å; I768-L797 HydrophobicContact CG2-CB 3.81Å; I768-L797 WeakPolarHBondContact CG2-O 3.23Å; A772-L797 HydrophobicContact CB-CD1 3.57Å; D793-L797 VanDerWaalsContact O-CB 3.24Å; D793-L797 WeakPolarHBondContact O-CB 3.18Å; D793-L797 WeakPolarHBondContact O-CG 3.48Å; D793-L797 PolarHBondContact O-N 3.08Å; L794-L797 PolarHBondContact O-N 3.39Å; L797-F801 HydrophobicContact CD2-CD2 3.86Å; L797-F801 HydrophobicContact CD2-CE2 4.17Å; L797-P802 VanDerWaalsContact O-CD 3.25Å; L797-P802 WeakPolarHBondContact O-CD 3.32Å
798	Q	93.3	Very high	92.4	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.101	C	C	.	.	I	π-helix	trans	-97.9	-28.8	-177.6	-78.7	-171.6	-0.2	0	0	114.8	S590 G593 A765 I768 L794 P802	S590-Q798 WeakPolarHBondContact CA-O 3.35Å; G593-Q798 VanDerWaalsContact CA-OE1 3.24Å; A765-Q798 PolarHBondContact O-NE2 2.72Å; I768-Q798 HydrophobicContact CB-CG 4.11Å; I768-Q798 HydrophobicContact CG2-CG 3.58Å; L794-Q798 HydrophobicContact CD1-CB 4.41Å; L794-Q798 HydrophobicContact CD1-CG 3.78Å; L794-Q798 VanDerWaalsContact CD1-NE2 3.34Å; L794-Q798 WeakPolarHBondContact O-CB 3.12Å; L794-Q798 PolarHBondContact O-N 3.1Å; Q798-P802 WeakPolarHBondContact O-CG 3.46Å
799	I	94.3	Very high	92.7	Very high	12 Å²	12	19 Å²	19	6%	0.062	10%	0.103	C	C	.	.	I	π-helix	trans	-102.6	-60.3	-175.9	-56.7	173.1	0	0	0	109.2	S590 F594 V597 V795 I803	S590-I799 PolarHBondContact OG-O 3.21Å; F594-I799 HydrophobicContact CD1-CD1 4.36Å; F594-I799 HydrophobicContact CD2-CD1 3.81Å; F594-I799 HydrophobicContact CD2-CG1 4.1Å; F594-I799 HydrophobicContact CD2-CG2 3.75Å; F594-I799 HydrophobicContact CE2-CD1 4.03Å; F594-I799 HydrophobicContact CE2-CG1 4.45Å; F594-I799 HydrophobicContact CE2-CG2 3.4Å; F594-I799 VanDerWaalsContact CE2-CG2 3.4Å; F594-I799 HydrophobicContact CG-CD1 4Å; F594-I799 HydrophobicContact CZ-CD1 4.39Å; F594-I799 HydrophobicContact CZ-CG2 4.3Å; V597-I799 HydrophobicContact CG2-CD1 4.17Å; V795-I799 HydrophobicContact CG2-CD1 4.48Å; V795-I799 VanDerWaalsContact O-CB 3.31Å; V795-I799 WeakPolarHBondContact O-CB 3.48Å; V795-I799 PolarHBondContact O-N 3.5Å; I799-I803 HydrophobicContact CG2-CD1 4.2Å; I799-I803 VanDerWaalsContact O-CD1 3.29Å; I799-I803 WeakPolarHBondContact O-CD1 3.49Å; I799-I803 WeakPolarHBondContact O-CG1 3.43Å; I799-I803 PolarHBondContact O-N 2.49Å
800	I	95.4	Very high	93	Very high	65 Å²	65	19.5 Å²	19.5	33%	0.333	10%	0.104	S	C	.	.	I	π-helix	trans	-73.5	-47.5	-169.4	-58.4	-171.4	0	0	0	111.7	V795 L796 I803 I804	V795-I800 HydrophobicContact CG1-CD1 4.46Å; V795-I800 PolarHBondContact O-N 2.96Å; V795-I800 VanDerWaalsContact O-N 3.17Å; L796-I800 HydrophobicContact CD2-CD1 3.92Å; L796-I800 PolarHBondContact O-N 3.37Å; I800-I803 PolarHBondContact O-N 3.14Å; I800-I804 HydrophobicContact CG2-CD1 3.69Å; I800-I804 HydrophobicContact CG2-CG1 4.34Å; I800-I804 WeakPolarHBondContact O-CG1 3.42Å; I800-I804 PolarHBondContact O-N 3.18Å
801	F	95.8	Very high	93.3	Very high	4 Å²	4	18.9 Å²	18.9	2%	0.018	10%	0.101	C	C	.	.	H	α-helix	trans	-67.6	-41.8	-173.3	-75.2	13.7	0	0	0	113.3	F539 I542 F543 I554 L796 L797 I804 S805 M813	F539-F801 HydrophobicContact CB-CE2 4.05Å; F539-F801 HydrophobicContact CB-CZ 4.31Å; F539-F801 HydrophobicContact CD1-CB 4.37Å; F539-F801 AromaticContact CD1-CD1 3.71Å; F539-F801 HydrophobicContact CD1-CD1 3.71Å; F539-F801 AromaticContact CD1-CD2 3.7Å; F539-F801 HydrophobicContact CD1-CD2 3.7Å; F539-F801 AromaticContact CD1-CE1 3.8Å; F539-F801 HydrophobicContact CD1-CE1 3.8Å; F539-F801 AromaticContact CD1-CE2 3.77Å; F539-F801 HydrophobicContact CD1-CE2 3.77Å; F539-F801 AromaticContact CD1-CG 3.66Å; F539-F801 HydrophobicContact CD1-CG 3.66Å; F539-F801 AromaticContact CD1-CZ 3.82Å; F539-F801 HydrophobicContact CD1-CZ 3.82Å; F539-F801 HydrophobicContact CE1-CB 3.97Å; F539-F801 AromaticContact CE1-CD1 3.83Å; F539-F801 HydrophobicContact CE1-CD1 3.83Å; F539-F801 HydrophobicContact CE1-CD2 4.16Å; F539-F801 HydrophobicContact CE1-CE1 4.34Å; F539-F801 AromaticContact CE1-CG 3.72Å; F539-F801 HydrophobicContact CE1-CG 3.72Å; F539-F801 HydrophobicContact CG-CD2 4.34Å; F539-F801 HydrophobicContact CG-CE2 4.26Å; F539-F801 WeakPolarHBondContact O-CZ 3.47Å; I542-F801 HydrophobicContact CB-CE1 4.33Å; I542-F801 HydrophobicContact CB-CZ 4.42Å; I542-F801 HydrophobicContact CG2-CE1 3.82Å; I542-F801 HydrophobicContact CG2-CZ 4.29Å; F543-F801 HydrophobicContact CB-CE2 4.26Å; F543-F801 HydrophobicContact CB-CZ 3.91Å; I554-F801 HydrophobicContact CD1-CD2 4.47Å; I554-F801 HydrophobicContact CD1-CE2 3.7Å; I554-F801 HydrophobicContact CG2-CE2 4.29Å; L796-F801 HydrophobicContact CB-CE1 4.46Å; L796-F801 WeakPolarHBondContact O-CB 3.33Å; L796-F801 VanDerWaalsContact O-CD1 3.31Å; L796-F801 WeakPolarHBondContact O-CD1 3.26Å; L796-F801 WeakPolarHBondContact O-CG 3.37Å; L796-F801 PolarHBondContact O-N 3.14Å; L797-F801 HydrophobicContact CD2-CD2 3.86Å; L797-F801 HydrophobicContact CD2-CE2 4.17Å; F801-I804 PolarHBondContact O-N 3.04Å; F801-S805 WeakPolarHBondContact O-CB 3.19Å; F801-S805 PolarHBondContact O-N 3.05Å; F801-M813 HydrophobicContact CD2-CB 4.47Å
802	P	95.2	Very high	93.4	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.006	10%	0.1	C	C	.	.	H	α-helix	trans	-64.4	-38.6	174.7	-26.2	39.1	0	0	0	112.3	A586 C589 I768 L797 Q798 S805 G806 F812	A586-P802 HydrophobicContact CB-CB 4.46Å; A586-P802 WeakPolarHBondContact CB-O 3.3Å; C589-P802 HydrophobicContact CB-CB 4.49Å; I768-P802 HydrophobicContact CD1-CG 4.11Å; L797-P802 VanDerWaalsContact O-CD 3.25Å; L797-P802 WeakPolarHBondContact O-CD 3.32Å; Q798-P802 WeakPolarHBondContact O-CG 3.46Å; P802-S805 WeakPolarHBondContact O-CB 3.45Å; P802-S805 PolarHBondContact O-N 3.38Å; P802-G806 PolarHBondContact O-N 3.13Å; P802-F812 HydrophobicContact CB-CE1 4.49Å
803	I	94.5	Very high	93.5	Very high	68 Å²	68	18.2 Å²	18.2	35%	0.349	10%	0.097	S	C	.	.	H	α-helix	trans	-59.6	-49.7	173.9	-67.8	170.2	0	0	0	110.9	S590 I799 I800 S805 G806 I807	S590-I803 WeakPolarHBondContact OG-CG1 3.49Å; I799-I803 HydrophobicContact CG2-CD1 4.2Å; I799-I803 VanDerWaalsContact O-CD1 3.29Å; I799-I803 WeakPolarHBondContact O-CD1 3.49Å; I799-I803 WeakPolarHBondContact O-CG1 3.43Å; I799-I803 PolarHBondContact O-N 2.49Å; I800-I803 PolarHBondContact O-N 3.14Å; I803-S805 VanDerWaalsContact C-N 3.35Å; I803-S805 PolarHBondContact O-N 2.99Å; I803-G806 PolarHBondContact O-N 3.11Å; I803-I807 HydrophobicContact CG2-CD1 3.69Å; I803-I807 WeakPolarHBondContact O-CG1 3.38Å; I803-I807 PolarHBondContact O-N 3.42Å
804	I	94.7	Very high	93.5	Very high	43 Å²	43	18.1 Å²	18.1	22%	0.221	10%	0.097	C	C	.	.	H	α-helix	trans	-59.1	-49.4	178.3	-66.8	171.1	0	0	0	109.8	F539 I800 F801 G806 I807 T808 W810	F539-I804 HydrophobicContact CE1-CB 4Å; F539-I804 HydrophobicContact CE1-CD1 4.28Å; F539-I804 HydrophobicContact CE1-CG2 3.82Å; F539-I804 HydrophobicContact CZ-CB 4.14Å; F539-I804 HydrophobicContact CZ-CG2 3.75Å; I800-I804 HydrophobicContact CG2-CD1 3.69Å; I800-I804 HydrophobicContact CG2-CG1 4.34Å; I800-I804 WeakPolarHBondContact O-CG1 3.42Å; I800-I804 PolarHBondContact O-N 3.18Å; F801-I804 PolarHBondContact O-N 3.04Å; I804-G806 VanDerWaalsContact C-N 3.31Å; I804-G806 PolarHBondContact O-N 2.84Å; I804-I807 PolarHBondContact O-N 3.27Å; I804-T808 HydrophobicContact CG2-CG2 4.17Å; I804-T808 WeakPolarHBondContact O-CG2 3.46Å; I804-T808 PolarHBondContact O-N 3.27Å; I804-T808 PolarHBondContact O-OG1 3.15Å; I804-W810 HydrophobicContact CG2-CE3 4.04Å; I804-W810 HydrophobicContact CG2-CZ3 4.22Å
805	S	93.6	Very high	93.5	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.007	10%	0.097	C	C	.	.	H	α-helix	trans	-55.5	-42.7	177.5	172.2	0	0	0	0	112.7	R582 F801 P802 I803 G809 W810 F812	R582-S805 PolarHBondContact NH2-OG 3.38Å; F801-S805 WeakPolarHBondContact O-CB 3.19Å; F801-S805 PolarHBondContact O-N 3.05Å; P802-S805 WeakPolarHBondContact O-CB 3.45Å; P802-S805 PolarHBondContact O-N 3.38Å; I803-S805 VanDerWaalsContact C-N 3.35Å; I803-S805 PolarHBondContact O-N 2.99Å; S805-G809 WeakPolarHBondContact O-CA 3.33Å; S805-G809 PolarHBondContact O-N 3.23Å; S805-W810 WeakPolarHBondContact CA-O 3.29Å; S805-W810 WeakPolarHBondContact CB-O 3.41Å; S805-W810 PolarHBondContact O-N 3.41Å; S805-W810 PolarHBondContact OG-O 2.83Å; S805-F812 WeakPolarHBondContact OG-CD1 3.45Å; S805-F812 VanDerWaalsContact OG-CE1 3.29Å; S805-F812 WeakPolarHBondContact OG-CE1 3.38Å
806	G	91.6	Very high	93.3	Very high	6 Å²	6	17.6 Å²	17.6	6%	0.062	9%	0.094	C	C	.	.	H	α-helix	trans	-68	-38.6	178.7	0	0	0	0	0	113.1	P802 I803 I804	P802-G806 PolarHBondContact O-N 3.13Å; I803-G806 PolarHBondContact O-N 3.11Å; I804-G806 VanDerWaalsContact C-N 3.31Å; I804-G806 PolarHBondContact O-N 2.84Å
807	I	92.1	Very high	92.9	Very high	79 Å²	79	17.5 Å²	17.5	41%	0.405	9%	0.094	S	C	.	.	H	α-helix	trans	-77.4	-44	-179	-66.3	169.8	0	0	0	111.6	F583 P736 F739 I803 I804	F583-I807 HydrophobicContact CE2-CG1 4.46Å; P736-I807 WeakPolarHBondContact CA-O 3.33Å; P736-I807 WeakPolarHBondContact CB-O 3.49Å; F739-I807 HydrophobicContact CZ-CG2 4.32Å; I803-I807 HydrophobicContact CG2-CD1 3.69Å; I803-I807 WeakPolarHBondContact O-CG1 3.38Å; I803-I807 PolarHBondContact O-N 3.42Å; I804-I807 PolarHBondContact O-N 3.27Å
808	T	91.7	Very high	92.2	Very high	23 Å²	23	19.2 Å²	19.2	14%	0.141	10%	0.104	C	C	.	.	H	α-helix	trans	-88.8	-15.9	-173.9	63.7	0	0	0	0	113.6	V734 N735 I804 W810	V734-T808 HydrophobicContact CG1-CG2 4.44Å; V734-T808 WeakPolarHBondContact CG1-O 3.41Å; N735-T808 CarbonylContact C-O 3.54Å; N735-T808 PolarHBondContact N-O 3.13Å; I804-T808 HydrophobicContact CG2-CG2 4.17Å; I804-T808 WeakPolarHBondContact O-CG2 3.46Å; I804-T808 PolarHBondContact O-N 3.27Å; I804-T808 PolarHBondContact O-OG1 3.15Å; T808-W810 PolarHBondContact O-N 3.24Å; T808-W810 WeakPolarHBondContact OG1-CB 3.33Å; T808-W810 PolarHBondContact OG1-N 3.22Å
809	G	89.7	Confident	91.9	Very high	8 Å²	8	19.9 Å²	19.9	8%	0.082	11%	0.106	C	C	.	.			trans	74.3	11.7	-170.6	0	0	0	0	0	113.8	R582 N735 S805	R582-G809 PolarHBondContact NH1-O 3.25Å; N735-G809 WeakPolarHBondContact O-CA 3.39Å; S805-G809 WeakPolarHBondContact O-CA 3.33Å; S805-G809 PolarHBondContact O-N 3.23Å
810	W	93.6	Very high	91.7	Very high	26 Å²	26	19.3 Å²	19.3	10%	0.098	10%	0.104	C	C	.	.	P	Polyproline II helix	trans	-70.8	143.4	175	-70	-1.7	0	0	0	111.8	L534 A535 V538 F539 R582 W733 I804 S805 T808	L534-W810 HydrophobicContact CD2-CZ2 4.36Å; A535-W810 HydrophobicContact CB-CB 3.76Å; A535-W810 HydrophobicContact CB-CD2 3.66Å; A535-W810 HydrophobicContact CB-CE3 3.91Å; A535-W810 HydrophobicContact CB-CG 3.62Å; V538-W810 HydrophobicContact CB-CH2 4.02Å; V538-W810 HydrophobicContact CB-CZ3 3.99Å; V538-W810 HydrophobicContact CG1-CH2 3.89Å; V538-W810 HydrophobicContact CG1-CZ3 3.8Å; V538-W810 HydrophobicContact CG2-CH2 4.18Å; F539-W810 HydrophobicContact CD2-CE3 4.14Å; F539-W810 HydrophobicContact CE2-CB 4.03Å; F539-W810 HydrophobicContact CE2-CD2 4.44Å; F539-W810 AromaticContact CE2-CE3 3.6Å; F539-W810 HydrophobicContact CE2-CE3 3.6Å; F539-W810 HydrophobicContact CE2-CZ3 4.45Å; F539-W810 AromaticContact CZ-CE3 3.84Å; F539-W810 HydrophobicContact CZ-CE3 3.84Å; R582-W810 VanDerWaalsContact NH2-C 3.25Å; R582-W810 PolarHBondContact NH2-O 2.89Å; W733-W810 PolarHBondContact O-NE1 3.16Å; I804-W810 HydrophobicContact CG2-CE3 4.04Å; I804-W810 HydrophobicContact CG2-CZ3 4.22Å; S805-W810 WeakPolarHBondContact CA-O 3.29Å; S805-W810 WeakPolarHBondContact CB-O 3.41Å; S805-W810 PolarHBondContact O-N 3.41Å; S805-W810 PolarHBondContact OG-O 2.83Å; T808-W810 PolarHBondContact O-N 3.24Å; T808-W810 WeakPolarHBondContact OG1-CB 3.33Å; T808-W810 PolarHBondContact OG1-N 3.22Å
811	P	94	Very high	91.1	Very high	1 Å²	1	19 Å²	19	1%	0.006	10%	0.102	C	C	.	.	P	Polyproline II helix	trans	-57.3	149.1	-178.3	22.7	-31.9	0	0	0	113	L519 Y527 T532 I556 M813	L519-P811 HydrophobicContact CD1-CB 3.92Å; L519-P811 HydrophobicContact CD1-CG 4.35Å; Y527-P811 HydrophobicContact CD1-CB 4.4Å; Y527-P811 HydrophobicContact CE1-CB 3.97Å; Y527-P811 HydrophobicContact CE1-CG 4.46Å; T532-P811 HydrophobicContact CG2-CG 4.08Å; I556-P811 HydrophobicContact CD1-CB 4.42Å; I556-P811 HydrophobicContact CD1-CG 4.04Å; I556-P811 HydrophobicContact CG1-CG 4.35Å; P811-M813 HydrophobicContact CB-CE 4.4Å; P811-M813 HydrophobicContact CG-CE 3.65Å; P811-M813 PolarHBondContact O-N 2.98Å
812	F	94.3	Very high	90.4	Very high	4 Å²	4	20.5 Å²	20.5	2%	0.018	11%	0.113	C	C	.	.	P	Polyproline II helix	trans	-61.5	138.1	173.9	-64.4	-62.9	0	0	0	111.2	M560 E564 L567 R582 A586 L764 P802 S805	M560-F812 HydrophobicContact CB-CB 4.37Å; M560-F812 WeakPolarHBondContact CB-O 3.12Å; M560-F812 HydrophobicContact CG-CB 4.29Å; M560-F812 HydrophobicContact SD-CB 3.6Å; M560-F812 VanDerWaalsContact SD-CB 3.6Å; E564-F812 VanDerWaalsContact CD-CD2 3.49Å; E564-F812 HydrophobicContact CG-CD2 4.17Å; E564-F812 WeakPolarHBondContact OE1-CD2 3.39Å; E564-F812 PolarHBondContact OE1-N 3.44Å; L567-F812 HydrophobicContact CD1-CE2 3.85Å; R582-F812 HydrophobicContact CG-CE2 4.2Å; R582-F812 HydrophobicContact CG-CZ 4.11Å; A586-F812 HydrophobicContact CB-CE1 3.67Å; A586-F812 HydrophobicContact CB-CZ 3.84Å; L764-F812 HydrophobicContact CD2-CD1 4.09Å; L764-F812 HydrophobicContact CD2-CD2 4.23Å; L764-F812 HydrophobicContact CD2-CE1 3.89Å; L764-F812 HydrophobicContact CD2-CE2 4.05Å; L764-F812 HydrophobicContact CD2-CG 4.27Å; L764-F812 HydrophobicContact CD2-CZ 3.88Å; P802-F812 HydrophobicContact CB-CE1 4.49Å; S805-F812 WeakPolarHBondContact OG-CD1 3.45Å; S805-F812 VanDerWaalsContact OG-CE1 3.29Å; S805-F812 WeakPolarHBondContact OG-CE1 3.38Å
813	M	93.5	Very high	90	Very high	5 Å²	5	20.6 Å²	20.6	3%	0.025	11%	0.114	C	C	.	.			trans	-120.3	147.2	-177.8	-61.5	-61.3	173.1	0	0	110.9	A535 V536 F539 I554 I556 F801 P811	A535-M813 HydrophobicContact CB-CE 3.92Å; V536-M813 HydrophobicContact CB-CE 4.38Å; V536-M813 HydrophobicContact CG2-CE 3.49Å; V536-M813 VanDerWaalsContact CG2-CE 3.49Å; V536-M813 HydrophobicContact CG2-SD 3.97Å; F539-M813 HydrophobicContact CB-CG 4.23Å; F539-M813 HydrophobicContact CD2-CB 4.33Å; F539-M813 HydrophobicContact CD2-CE 3.95Å; F539-M813 HydrophobicContact CD2-CG 3.33Å; F539-M813 HydrophobicContact CD2-SD 4.46Å; F539-M813 HydrophobicContact CE2-CE 4.34Å; F539-M813 HydrophobicContact CE2-CG 3.75Å; F539-M813 HydrophobicContact CG-CG 3.92Å; I554-M813 HydrophobicContact CG2-CB 3.74Å; I556-M813 HydrophobicContact CB-SD 4.42Å; I556-M813 HydrophobicContact CD1-CE 4.38Å; I556-M813 HydrophobicContact CG1-CE 3.76Å; I556-M813 HydrophobicContact CG1-SD 3.57Å; I556-M813 VanDerWaalsContact CG1-SD 3.57Å; I556-M813 PolarHBondContact N-SD 2.86Å; I556-M813 VanDerWaalsContact N-SD 3.37Å; F801-M813 HydrophobicContact CD2-CB 4.47Å; P811-M813 HydrophobicContact CB-CE 4.4Å; P811-M813 HydrophobicContact CG-CE 3.65Å; P811-M813 PolarHBondContact O-N 2.98Å
814	S	92.4	Very high	89.5	Confident	1 Å²	1	17.4 Å²	17.4	1%	0.007	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	174.5	176.6	69.5	0	0	0	0	112.3	I554 G555 S557 E771 T816	I554-S814 WeakPolarHBondContact CA-O 3.29Å; G555-S814 PolarHBondContact N-O 3.28Å; G555-S814 PolarHBondContact O-N 2.7Å; G555-S814 VanDerWaalsContact O-O 3.1Å; S557-S814 WeakPolarHBondContact CB-OG 3.43Å; S557-S814 PolarHBondContact OG-OG 3.01Å; E771-S814 PolarHBondContact OE1-OG 3.43Å; E771-S814 WeakPolarHBondContact OE2-CB 3.31Å; E771-S814 PolarHBondContact OE2-OG 2.97Å; S814-T816 PolarHBondContact O-N 3.36Å
815	G	90.6	Very high	88.8	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	127.6	178.6	0	0	0	0	0	112.3	N775	N775-G815 WeakPolarHBondContact ND2-CA 3.26Å
816	T	90.4	Very high	88.1	Confident	16 Å²	16	17.8 Å²	17.8	10%	0.098	10%	0.104	C	C	.	.			trans	-112	105.6	-179.3	47.4	0	0	0	0	113.1	I553 N775 S814 V818 R819 T820	I553-T816 PolarHBondContact O-N 3.22Å; I553-T816 PolarHBondContact O-OG1 2.93Å; N775-T816 PolarHBondContact OD1-O 3.49Å; S814-T816 PolarHBondContact O-N 3.36Å; T816-V818 PolarHBondContact O-N 2.89Å; T816-R819 PolarHBondContact O-N 3.37Å; T816-R819 PolarHBondContact OG1-NE 3.45Å; T816-R819 PolarHBondContact OG1-NH2 3.37Å; T816-T820 PolarHBondContact O-N 3.48Å; T816-T820 PolarHBondContact O-OG1 3.35Å; T816-T820 VanDerWaalsContact O-OG1 3.12Å
817	T	86.2	Confident	87.8	Confident	3 Å²	3	17.5 Å²	17.5	2%	0.018	10%	0.101	C	C	.	.	H	α-helix	trans	-57.2	-44.8	-174.4	55.2	0	0	0	0	113.3	Y616 N617 L774 R819 T820 L821	Y616-T817 HydrophobicContact CD1-CG2 4.03Å; Y616-T817 HydrophobicContact CE1-CG2 3.89Å; N617-T817 WeakPolarHBondContact OD1-CB 3.32Å; N617-T817 PolarHBondContact OD1-OG1 3.19Å; L774-T817 HydrophobicContact CB-CG2 3.98Å; T817-R819 PolarHBondContact O-N 2.64Å; T817-T820 PolarHBondContact O-N 3.47Å; T817-L821 WeakPolarHBondContact O-CB 3.47Å; T817-L821 PolarHBondContact O-N 3.05Å
818	V	80	Confident	87.4	Confident	38 Å²	38	14.3 Å²	14.3	23%	0.23	9%	0.086	C	C	.	.	H	α-helix	trans	-65.4	-38.8	-178.9	-177.6	0	0	0	0	112.1	I620 T816 S822	I620-V818 HydrophobicContact CG2-CG2 4.41Å; T816-V818 PolarHBondContact O-N 2.89Å; V818-S822 PolarHBondContact O-N 3.14Å; V818-S822 PolarHBondContact O-OG 3.41Å
819	R	86.5	Confident	86.9	Confident	13 Å²	13	15.8 Å²	15.8	5%	0.049	9%	0.09	C	C	.	.	H	α-helix	trans	-72	-42.2	176.7	-65.3	-169.5	-72.5	-163	-15.3	111.1	V507 N508 I553 G555 I556 T816 T817 L821 S822 N823	V507-R819 HydrophobicContact CG1-CG 4.41Å; N508-R819 WeakPolarHBondContact OD1-CD 3.28Å; I553-R819 HydrophobicContact CB-CB 4.21Å; I553-R819 HydrophobicContact CG2-CB 3.92Å; G555-R819 VanDerWaalsContact N-NH2 3.15Å; G555-R819 PolarHBondContact O-NH2 3.45Å; I556-R819 PolarHBondContact O-NH2 2.89Å; T816-R819 PolarHBondContact O-N 3.37Å; T816-R819 PolarHBondContact OG1-NE 3.45Å; T816-R819 PolarHBondContact OG1-NH2 3.37Å; T817-R819 PolarHBondContact O-N 2.64Å; R819-L821 VanDerWaalsContact C-N 3.35Å; R819-L821 PolarHBondContact O-N 3.29Å; R819-S822 WeakPolarHBondContact O-CB 3.4Å; R819-S822 PolarHBondContact O-N 3.28Å; R819-N823 PolarHBondContact O-N 2.72Å
820	T	90	Very high	86.3	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-60.3	-42.1	174	-64.4	0	0	0	0	112.3	A552 I553 N775 T778 A779 T816 T817 S822 N823 L824	A552-T820 HydrophobicContact CB-CG2 4.41Å; I553-T820 PolarHBondContact N-OG1 2.88Å; N775-T820 WeakPolarHBondContact OD1-CB 3.49Å; N775-T820 PolarHBondContact OD1-OG1 3.43Å; T778-T820 HydrophobicContact CG2-CG2 4.31Å; A779-T820 HydrophobicContact CB-CG2 3.9Å; T816-T820 PolarHBondContact O-N 3.48Å; T816-T820 PolarHBondContact O-OG1 3.35Å; T816-T820 VanDerWaalsContact O-OG1 3.12Å; T817-T820 PolarHBondContact O-N 3.47Å; T820-S822 VanDerWaalsContact C-N 3.33Å; T820-S822 PolarHBondContact O-N 3.3Å; T820-N823 WeakPolarHBondContact O-CB 3.44Å; T820-N823 PolarHBondContact O-N 3.44Å; T820-L824 VanDerWaalsContact O-CB 3.23Å; T820-L824 WeakPolarHBondContact O-CB 3.17Å; T820-L824 PolarHBondContact O-N 3.3Å
821	L	83.2	Confident	85.2	Confident	58 Å²	58	19.5 Å²	19.5	30%	0.304	11%	0.109	S	C	.	.	H	α-helix	trans	-61.6	-43.5	176.1	-179.4	61.1	0	0	0	111.4	T778 T817 R819 L824 V825	T778-L821 HydrophobicContact CG2-CB 4.02Å; T817-L821 WeakPolarHBondContact O-CB 3.47Å; T817-L821 PolarHBondContact O-N 3.05Å; R819-L821 VanDerWaalsContact C-N 3.35Å; R819-L821 PolarHBondContact O-N 3.29Å; L821-L824 PolarHBondContact O-N 3.5Å; L821-V825 HydrophobicContact CD1-CG2 4.48Å; L821-V825 WeakPolarHBondContact O-CB 3.35Å; L821-V825 VanDerWaalsContact O-CG2 3.25Å; L821-V825 WeakPolarHBondContact O-CG2 3.45Å; L821-V825 PolarHBondContact O-N 3.49Å
822	S	79.8	Confident	84.1	Confident	36 Å²	36	27.7 Å²	27.7	25%	0.252	15%	0.147	S	C	.	.	H	α-helix	trans	-63.3	-42.1	177.5	-60.6	0	0	0	0	111.8	V818 R819 T820 V825 A826	V818-S822 PolarHBondContact O-N 3.14Å; V818-S822 PolarHBondContact O-OG 3.41Å; R819-S822 WeakPolarHBondContact O-CB 3.4Å; R819-S822 PolarHBondContact O-N 3.28Å; T820-S822 VanDerWaalsContact C-N 3.33Å; T820-S822 PolarHBondContact O-N 3.3Å; S822-V825 PolarHBondContact O-N 3.28Å; S822-A826 PolarHBondContact O-N 2.85Å
823	N	86.7	Confident	83.1	Confident	4 Å²	4	32.4 Å²	32.4	2%	0.021	18%	0.181	C	C	.	.	H	α-helix	trans	-60.6	-49.1	173.7	-175.7	29.3	0	0	0	112.4	I504 L551 I553 R819 T820 V825 A826 L827	I504-N823 WeakPolarHBondContact CD1-OD1 3.37Å; I504-N823 WeakPolarHBondContact CG1-OD1 3.41Å; L551-N823 PolarHBondContact O-ND2 3.39Å; I553-N823 HydrophobicContact CD1-CB 3.45Å; I553-N823 VanDerWaalsContact CD1-CB 3.45Å; I553-N823 HydrophobicContact CG1-CB 4.03Å; R819-N823 PolarHBondContact O-N 2.72Å; T820-N823 WeakPolarHBondContact O-CB 3.44Å; T820-N823 PolarHBondContact O-N 3.44Å; N823-V825 VanDerWaalsContact C-N 3.28Å; N823-V825 PolarHBondContact O-N 2.98Å; N823-A826 WeakPolarHBondContact O-CA 3.3Å; N823-A826 WeakPolarHBondContact O-CB 3.33Å; N823-A826 PolarHBondContact O-N 3.46Å; N823-L827 PolarHBondContact O-N 2.83Å; N823-L827 VanDerWaalsContact O-N 3.17Å
824	L	84.7	Confident	81.9	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.8	-40.4	-178.1	179.8	159.4	0	0	0	110.7	T778 A779 N782 T820 L821 A826 L827 V828 T845	T778-L824 WeakPolarHBondContact O-CD1 3.42Å; A779-L824 VanDerWaalsContact C-CD1 3.47Å; A779-L824 VanDerWaalsContact O-CD1 3.23Å; A779-L824 WeakPolarHBondContact O-CD1 3.29Å; N782-L824 HydrophobicContact CB-CD2 3.49Å; N782-L824 VanDerWaalsContact CB-CD2 3.49Å; N782-L824 HydrophobicContact CB-CG 4.43Å; N782-L824 WeakPolarHBondContact ND2-CD2 3.02Å; T820-L824 VanDerWaalsContact O-CB 3.23Å; T820-L824 WeakPolarHBondContact O-CB 3.17Å; T820-L824 PolarHBondContact O-N 3.3Å; L821-L824 PolarHBondContact O-N 3.5Å; L824-A826 VanDerWaalsContact C-N 3.28Å; L824-A826 PolarHBondContact O-N 2.89Å; L824-L827 PolarHBondContact O-N 2.69Å; L824-L827 VanDerWaalsContact O-N 3.14Å; L824-V828 HydrophobicContact CD2-CG2 4.37Å; L824-V828 WeakPolarHBondContact O-CG2 3.39Å; L824-V828 PolarHBondContact O-N 3.16Å; L824-T845 HydrophobicContact CG-CG2 4.42Å
825	V	79.2	Confident	80.9	Confident	27 Å²	27	36.9 Å²	36.9	16%	0.164	22%	0.215	C	C	.	.	H	α-helix	trans	-60.1	-35.5	173.3	166.9	0	0	0	0	112.6	L821 S822 N823 L827 W1058	L821-V825 HydrophobicContact CD1-CG2 4.48Å; L821-V825 WeakPolarHBondContact O-CB 3.35Å; L821-V825 VanDerWaalsContact O-CG2 3.25Å; L821-V825 WeakPolarHBondContact O-CG2 3.45Å; L821-V825 PolarHBondContact O-N 3.49Å; S822-V825 PolarHBondContact O-N 3.28Å; N823-V825 VanDerWaalsContact C-N 3.28Å; N823-V825 PolarHBondContact O-N 2.98Å; V825-L827 VanDerWaalsContact C-N 3.29Å; V825-L827 PolarHBondContact O-N 3.05Å; V825-W1058 HydrophobicContact CG1-CE3 3.72Å; V825-W1058 HydrophobicContact CG1-CH2 3.77Å; V825-W1058 HydrophobicContact CG1-CZ3 3.18Å
826	A	79.7	Confident	79.3	Confident	25 Å²	25	43.5 Å²	43.5	21%	0.207	26%	0.258	C	S	.	.	H	α-helix	trans	-71.9	-24.2	177.6	0	0	0	0	0	113	F503 I504 S822 N823 L824	F503-A826 HydrophobicContact CD1-CB 3.66Å; F503-A826 HydrophobicContact CE1-CB 3.98Å; I504-A826 HydrophobicContact CG1-CB 4.37Å; S822-A826 PolarHBondContact O-N 2.85Å; N823-A826 WeakPolarHBondContact O-CA 3.3Å; N823-A826 WeakPolarHBondContact O-CB 3.33Å; N823-A826 PolarHBondContact O-N 3.46Å; L824-A826 VanDerWaalsContact C-N 3.28Å; L824-A826 PolarHBondContact O-N 2.89Å
827	L	86.2	Confident	78	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	7.7	-177.8	-65.1	170.8	0	0	0	113.7	V497 L551 N823 L824 V825 T845 V846 Q848	V497-L827 HydrophobicContact CG2-CD2 4.33Å; L551-L827 HydrophobicContact CD2-CD1 3.5Å; L551-L827 VanDerWaalsContact CD2-CD1 3.5Å; N823-L827 PolarHBondContact O-N 2.83Å; N823-L827 VanDerWaalsContact O-N 3.17Å; L824-L827 PolarHBondContact O-N 2.69Å; L824-L827 VanDerWaalsContact O-N 3.14Å; V825-L827 VanDerWaalsContact C-N 3.29Å; V825-L827 PolarHBondContact O-N 3.05Å; L827-T845 HydrophobicContact CB-CG2 4.13Å; L827-V846 PolarHBondContact O-N 3.4Å; L827-Q848 HydrophobicContact CD2-CG 4.46Å
828	V	83	Confident	76.3	Confident	13 Å²	13	51.3 Å²	51.3	8%	0.079	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	130.2	177.8	179.5	0	0	0	0	111.4	N782 L824 M830 I842	N782-V828 HydrophobicContact CB-CG2 4.08Å; N782-V828 WeakPolarHBondContact ND2-CG2 3.33Å; L824-V828 HydrophobicContact CD2-CG2 4.37Å; L824-V828 WeakPolarHBondContact O-CG2 3.39Å; L824-V828 PolarHBondContact O-N 3.16Å; V828-M830 HydrophobicContact CB-CE 4.42Å; V828-M830 HydrophobicContact CG1-CE 3.79Å; V828-M830 HydrophobicContact CG1-CG 4.48Å; V828-M830 HydrophobicContact CG1-SD 3.98Å; V828-I842 HydrophobicContact CG1-CB 4.22Å; V828-I842 HydrophobicContact CG1-CD1 4.38Å; V828-I842 HydrophobicContact CG1-CG1 3.88Å; V828-I842 HydrophobicContact CG1-CG2 3.58Å
829	K	81	Confident	75	Confident	53 Å²	53	52.1 Å²	52.1	23%	0.23	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	119.8	164.5	-61.8	-171.6	179.9	-169.9	0	110.2	E492 N493 I496 V843 G844 V846	E492-K829 IonicContact OE2-NZ 3.46Å; N493-K829 WeakPolarHBondContact OD1-CE 3.43Å; N493-K829 PolarHBondContact OD1-NZ 3.33Å; I496-K829 HydrophobicContact CD1-CG 4.02Å; K829-V843 HydrophobicContact CB-CB 4.37Å; K829-V843 PolarHBondContact O-N 3.35Å; K829-G844 WeakPolarHBondContact CB-O 3.48Å; K829-G844 PolarHBondContact N-O 3.21Å; K829-V846 HydrophobicContact CD-CG2 4.24Å; K829-V846 VanDerWaalsContact CE-CG2 3.45Å; K829-V846 HydrophobicContact CG-CG2 3.78Å
830	M	76.3	Confident	74	Confident	48 Å²	48	53 Å²	53	24%	0.236	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	143.1	170.6	-62.7	-63.4	-174.8	0	0	109.5	V828 Q832 H840 I842 R1055 W1058	V828-M830 HydrophobicContact CB-CE 4.42Å; V828-M830 HydrophobicContact CG1-CE 3.79Å; V828-M830 HydrophobicContact CG1-CG 4.48Å; V828-M830 HydrophobicContact CG1-SD 3.98Å; M830-Q832 PolarHBondContact O-N 3.04Å; M830-H840 HydrophobicContact CB-CB 4.38Å; M830-I842 HydrophobicContact CE-CG1 4.08Å; M830-I842 HydrophobicContact SD-CG1 3.84Å; M830-R1055 VanDerWaalsContact CE-NH1 3.27Å; M830-W1058 WeakPolarHBondContact CE-O 3.37Å
831	D	72.4	Confident	72.8	Confident	64 Å²	64	56.7 Å²	56.7	34%	0.342	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-58.7	129.6	171.8	-170	1.3	0	0	0	110	S833 H840 K841 V843	D831-S833 PolarHBondContact OD1-N 3.34Å; D831-H840 PolarHBondContact O-ND1 3.19Å; D831-K841 PolarHBondContact N-O 2.88Å; D831-V843 HydrophobicContact CB-CG2 3.93Å
832	Q	70.6	Confident	72.3	Confident	174 Å²	174	55.1 Å²	55.1	81%	0.813	34%	0.336	S	S	*	.	S	Bend	trans	-84	-24.1	-174.1	-66.8	-173.6	-4.8	0	0	112.4	M830	M830-Q832 PolarHBondContact O-N 3.04Å
833	S	72	Confident	72	Confident	103 Å²	103	57.9 Å²	57.9	72%	0.72	35%	0.351	S	S	*	.	S	Bend	trans	-130.3	63.6	-173.3	-56.5	0	0	0	0	110.9	D831	D831-S833 PolarHBondContact OD1-N 3.34Å
834	P	69.6	Low	71.8	Confident	37 Å²	37	58.1 Å²	58.1	24%	0.24	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-62.8	146.6	172.1	31	-35.1	0	0	0	109.3	M838 H840	P834-M838 HydrophobicContact CB-CB 4.49Å; P834-M838 WeakPolarHBondContact CB-O 3.34Å; P834-H840 WeakPolarHBondContact CD-ND1 3.25Å; P834-H840 WeakPolarHBondContact CG-ND1 2.98Å
835	A	70.2	Confident	71.8	Confident	62 Å²	62	58.7 Å²	58.7	51%	0.512	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-54.4	145.2	170.2	0	0	0	0	0	110.3	G837 M838	A835-G837 PolarHBondContact O-N 3.37Å; A835-M838 HydrophobicContact CB-CG 4.38Å; A835-M838 PolarHBondContact O-N 3.18Å
836	P	58.2	Low	72.3	Confident	140 Å²	140	57.5 Å²	57.5	91%	0.909	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.1	126.5	176.5	-25.3	33	0	0	0	111.2
837	G	63	Low	72.8	Confident	86 Å²	86	56.8 Å²	56.8	89%	0.887	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	91	-12.8	-178.2	0	0	0	0	0	116.2	A835	A835-G837 PolarHBondContact O-N 3.37Å
838	M	51.1	Low	73.1	Confident	97 Å²	97	56.8 Å²	56.8	48%	0.478	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-93.7	139	177.1	-69	-65.3	-75.3	0	0	112.1	P834 A835	P834-M838 HydrophobicContact CB-CB 4.49Å; P834-M838 WeakPolarHBondContact CB-O 3.34Å; A835-M838 HydrophobicContact CB-CG 4.38Å; A835-M838 PolarHBondContact O-N 3.18Å
839	P	52.4	Low	73.5	Confident	54 Å²	54	56.1 Å²	56.1	35%	0.351	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-68.5	151.6	174	29.3	-33.9	0	0	0	111.1	K841 A1059	P839-K841 PolarHBondContact O-N 2.67Å; P839-K841 VanDerWaalsContact O-N 3.13Å; P839-A1059 HydrophobicContact CB-CB 4.26Å
840	H	65.2	Low	74.1	Confident	31 Å²	31	54.7 Å²	54.7	14%	0.144	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-59	117.6	176	-66.1	-83.1	0	0	0	111.3	M830 D831 P834 A1059	M830-H840 HydrophobicContact CB-CB 4.38Å; D831-H840 PolarHBondContact O-ND1 3.19Å; P834-H840 WeakPolarHBondContact CD-ND1 3.25Å; P834-H840 WeakPolarHBondContact CG-ND1 2.98Å; H840-A1059 HydrophobicContact CB-CB 3.92Å; H840-A1059 PolarHBondContact CD2-O 3.13Å; H840-A1059 WeakPolarHBondContact O-CB 3.31Å
841	K	65.3	Low	74.9	Confident	78 Å²	78	52.4 Å²	52.4	34%	0.339	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-78.9	144	178.8	-169.8	172.3	178.8	177.1	0	111	D831 P839 V843	D831-K841 PolarHBondContact N-O 2.88Å; P839-K841 PolarHBondContact O-N 2.67Å; P839-K841 VanDerWaalsContact O-N 3.13Å; K841-V843 PolarHBondContact O-N 2.94Å
842	I	71.1	Confident	75.9	Confident	25 Å²	25	49.8 Å²	49.8	13%	0.128	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	115	168.1	-60.9	171.5	0	0	0	108.5	V828 M830	V828-I842 HydrophobicContact CG1-CB 4.22Å; V828-I842 HydrophobicContact CG1-CD1 4.38Å; V828-I842 HydrophobicContact CG1-CG1 3.88Å; V828-I842 HydrophobicContact CG1-CG2 3.58Å; M830-I842 HydrophobicContact CE-CG1 4.08Å; M830-I842 HydrophobicContact SD-CG1 3.84Å
843	V	75	Confident	77	Confident	95 Å²	95	43 Å²	43	58%	0.576	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	-39.8	176.7	179.9	0	0	0	0	110.5	K829 D831 K841	K829-V843 HydrophobicContact CB-CB 4.37Å; K829-V843 PolarHBondContact O-N 3.35Å; D831-V843 HydrophobicContact CB-CG2 3.93Å; K841-V843 PolarHBondContact O-N 2.94Å
844	G	82.1	Confident	78.1	Confident	8 Å²	8	42.3 Å²	42.3	8%	0.082	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.5	-176.4	179.7	0	0	0	0	0	111.9	K829	K829-G844 WeakPolarHBondContact CB-O 3.48Å; K829-G844 PolarHBondContact N-O 3.21Å
845	T	83.9	Confident	79.3	Confident	12 Å²	12	40.5 Å²	40.5	7%	0.074	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	140.4	175.8	-60.2	0	0	0	0	110.6	L551 N782 L824 L827 E847	L551-T845 HydrophobicContact CD1-CG2 3.83Å; N782-T845 VanDerWaalsContact CB-OG1 3.3Å; N782-T845 WeakPolarHBondContact CB-OG1 3.26Å; N782-T845 PolarHBondContact O-N 3.36Å; N782-T845 PolarHBondContact O-OG1 2.91Å; L824-T845 HydrophobicContact CG-CG2 4.42Å; L827-T845 HydrophobicContact CB-CG2 4.13Å; T845-E847 PolarHBondContact O-N 3.09Å
846	V	89.1	Confident	80.5	Confident	3 Å²	3	37.6 Å²	37.6	2%	0.018	23%	0.23	C	C	.	.			trans	-74.5	107.6	172	-178.1	0	0	0	0	109	N493 I496 V497 L827 K829 Q848	N493-V846 HydrophobicContact CB-CG1 3.93Å; N493-V846 HydrophobicContact CB-CG2 4.29Å; I496-V846 HydrophobicContact CD1-CG2 4.4Å; I496-V846 HydrophobicContact CG2-CG2 4.43Å; V497-V846 HydrophobicContact CG2-CG1 3.76Å; L827-V846 PolarHBondContact O-N 3.4Å; K829-V846 HydrophobicContact CD-CG2 4.24Å; K829-V846 VanDerWaalsContact CE-CG2 3.45Å; K829-V846 HydrophobicContact CG-CG2 3.78Å; V846-Q848 HydrophobicContact CG1-CB 4.42Å; V846-Q848 HydrophobicContact CG1-CG 4.11Å
847	E	90.1	Very high	82.3	Confident	9 Å²	9	34.3 Å²	34.3	4%	0.042	20%	0.204	C	C	.	.			trans	-88.5	111.9	178.1	-67.4	170.1	156.9	0	0	110.9	L551 A784 V785 K786 T845	L551-E847 HydrophobicContact CD1-CG 4.01Å; A784-E847 VanDerWaalsContact CA-OE1 3.29Å; A784-E847 WeakPolarHBondContact CA-OE1 2.98Å; A784-E847 WeakPolarHBondContact CB-OE1 3.13Å; V785-E847 PolarHBondContact N-OE1 3.21Å; K786-E847 WeakPolarHBondContact CB-OE2 3.45Å; K786-E847 HydrophobicContact CD-CB 4.24Å; K786-E847 WeakPolarHBondContact CD-OE2 3.33Å; K786-E847 WeakPolarHBondContact CE-OE2 3.41Å; K786-E847 WeakPolarHBondContact CG-OE2 3.38Å; K786-E847 PolarHBondContact N-OE1 2.86Å; K786-E847 PolarHBondContact N-OE2 3.3Å; K786-E847 VanDerWaalsContact N-OE2 3.13Å; T845-E847 PolarHBondContact O-N 3.09Å
848	Q	92.6	Very high	83.8	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.178	C	C	.	.			trans	-151.3	166.1	-171	58	74	40.3	0	0	111.9	A488 V497 L827 V846 S851	A488-Q848 HydrophobicContact CB-CB 3.98Å; V497-Q848 HydrophobicContact CG1-CG 4.38Å; V497-Q848 HydrophobicContact CG2-CG 4Å; L827-Q848 HydrophobicContact CD2-CG 4.46Å; V846-Q848 HydrophobicContact CG1-CB 4.42Å; V846-Q848 HydrophobicContact CG1-CG 4.11Å; Q848-S851 PolarHBondContact NE2-OG 2.99Å
849	R	93.2	Very high	85.8	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.155	C	C	.	.	S	Bend	trans	-113.2	-16.8	177.2	-70.1	176.9	-174.9	-89.2	0.6	114.3	D484 Y485 T544 V545 S547 P550 V853	D484-R849 HydrophobicContact CB-CG 3.96Å; D484-R849 IonicContact OD2-CZ 3.35Å; D484-R849 IonicContact OD2-NE 3.5Å; D484-R849 PolarHBondContact OD2-NE 3.44Å; D484-R849 IonicContact OD2-NH2 2.64Å; D484-R849 PolarHBondContact OD2-NH2 2.84Å; Y485-R849 HydrophobicContact CE1-CB 4Å; T544-R849 HydrophobicContact CG2-CB 4.27Å; T544-R849 WeakPolarHBondContact CG2-O 3.34Å; T544-R849 PolarHBondContact O-NH1 2.88Å; V545-R849 PolarHBondContact O-NH1 3.48Å; V545-R849 VanDerWaalsContact O-NH1 3.09Å; S547-R849 PolarHBondContact O-NH1 3.14Å; S547-R849 PolarHBondContact O-NH2 3.09Å; P550-R849 HydrophobicContact CB-CB 4.4Å; P550-R849 HydrophobicContact CB-CG 3.49Å; P550-R849 VanDerWaalsContact CB-CG 3.49Å; P550-R849 HydrophobicContact CG-CG 3.63Å; R849-V853 WeakPolarHBondContact O-CG2 3.24Å; R849-V853 PolarHBondContact O-N 3.04Å
850	V	93.5	Very high	87.7	Confident	22 Å²	22	26.9 Å²	26.9	13%	0.133	15%	0.145	C	C	.	.	H	α-helix	trans	-68	-45	-169.3	177.1	0	0	0	0	112.8	Y485 A488 F498 G852 V853 F854	Y485-V850 HydrophobicContact CD1-CG2 3.79Å; Y485-V850 HydrophobicContact CE1-CG2 4.29Å; A488-V850 HydrophobicContact CB-CB 3.94Å; A488-V850 HydrophobicContact CB-CG2 3.5Å; F498-V850 HydrophobicContact CZ-CG1 4.35Å; V850-G852 PolarHBondContact O-N 2.79Å; V850-V853 PolarHBondContact O-N 3.5Å; V850-F854 HydrophobicContact CG1-CD2 3.56Å; V850-F854 HydrophobicContact CG1-CE2 3.41Å; V850-F854 VanDerWaalsContact CG1-CE2 3.41Å; V850-F854 VanDerWaalsContact O-CD2 3.29Å; V850-F854 WeakPolarHBondContact O-CD2 3.44Å; V850-F854 PolarHBondContact O-N 3.41Å
851	S	92.7	Very high	88.9	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-64.7	-39.9	-176.5	78.8	0	0	0	0	112.4	Q848 V853 F854 V855	Q848-S851 PolarHBondContact NE2-OG 2.99Å; S851-V853 VanDerWaalsContact C-N 3.33Å; S851-V853 PolarHBondContact O-N 3.31Å; S851-F854 PolarHBondContact O-N 3.41Å; S851-V855 WeakPolarHBondContact O-CB 3.49Å; S851-V855 WeakPolarHBondContact O-CG2 3.47Å; S851-V855 PolarHBondContact O-N 2.72Å
852	G	92.2	Very high	90.1	Very high	9 Å²	9	26 Å²	26	9%	0.093	15%	0.145	C	C	.	.	H	α-helix	trans	-65.9	-36.5	178.9	0	0	0	0	0	112.2	V850 V855 G856	V850-G852 PolarHBondContact O-N 2.79Å; G852-V855 PolarHBondContact O-N 3.41Å; G852-G856 PolarHBondContact O-N 3.43Å
853	V	95	Very high	90.9	Very high	32 Å²	32	24.9 Å²	24.9	19%	0.194	14%	0.139	C	C	.	.	H	α-helix	trans	-64.8	-49.3	173.3	174.2	0	0	0	0	111	T544 V545 R849 V850 S851 V855 G856 I857	T544-V853 HydrophobicContact CG2-CG2 4.11Å; V545-V853 HydrophobicContact CG2-CG2 3.86Å; R849-V853 WeakPolarHBondContact O-CG2 3.24Å; R849-V853 PolarHBondContact O-N 3.04Å; V850-V853 PolarHBondContact O-N 3.5Å; S851-V853 VanDerWaalsContact C-N 3.33Å; S851-V853 PolarHBondContact O-N 3.31Å; V853-V855 VanDerWaalsContact C-N 3.3Å; V853-V855 PolarHBondContact O-N 2.92Å; V853-G856 PolarHBondContact O-N 3.21Å; V853-I857 HydrophobicContact CG1-CD1 3.88Å; V853-I857 WeakPolarHBondContact O-CG1 3.5Å; V853-I857 PolarHBondContact O-N 3.44Å
854	F	95.1	Very high	91.4	Very high	88 Å²	88	25.7 Å²	25.7	39%	0.386	14%	0.135	S	C	.	.	H	α-helix	trans	-58.3	-42.9	176.2	-85.2	-69.9	0	0	0	112.1	F498 V501 V850 S851 I857 L858	F498-F854 HydrophobicContact CE1-CD2 4.33Å; F498-F854 AromaticContact CE1-CE2 3.69Å; F498-F854 HydrophobicContact CE1-CE2 3.69Å; F498-F854 HydrophobicContact CE1-CZ 4.06Å; F498-F854 HydrophobicContact CZ-CE2 4.08Å; V501-F854 HydrophobicContact CG1-CB 3.87Å; V501-F854 HydrophobicContact CG2-CB 4.35Å; V850-F854 HydrophobicContact CG1-CD2 3.56Å; V850-F854 HydrophobicContact CG1-CE2 3.41Å; V850-F854 VanDerWaalsContact CG1-CE2 3.41Å; V850-F854 VanDerWaalsContact O-CD2 3.29Å; V850-F854 WeakPolarHBondContact O-CD2 3.44Å; V850-F854 PolarHBondContact O-N 3.41Å; S851-F854 PolarHBondContact O-N 3.41Å; F854-I857 PolarHBondContact O-N 3.49Å; F854-L858 WeakPolarHBondContact O-CB 3.33Å; F854-L858 VanDerWaalsContact O-CG 3.27Å; F854-L858 WeakPolarHBondContact O-CG 3.49Å; F854-L858 PolarHBondContact O-N 3.45Å
855	V	94.2	Very high	91.5	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-65.4	-42.9	178.3	173	0	0	0	0	111.2	V501 I504 N508 L540 S851 G852 V853 I857 L858 V859	V501-V855 HydrophobicContact CG1-CG2 4.24Å; I504-V855 HydrophobicContact CB-CG2 3.79Å; I504-V855 HydrophobicContact CG2-CB 4.4Å; I504-V855 HydrophobicContact CG2-CG1 4.19Å; I504-V855 HydrophobicContact CG2-CG2 3.72Å; N508-V855 HydrophobicContact CB-CG1 4.26Å; N508-V855 VanDerWaalsContact ND2-CG1 3.26Å; N508-V855 WeakPolarHBondContact ND2-CG1 3.43Å; L540-V855 HydrophobicContact CD2-CB 4.4Å; L540-V855 HydrophobicContact CD2-CG1 3.91Å; S851-V855 WeakPolarHBondContact O-CB 3.49Å; S851-V855 WeakPolarHBondContact O-CG2 3.47Å; S851-V855 PolarHBondContact O-N 2.72Å; G852-V855 PolarHBondContact O-N 3.41Å; V853-V855 VanDerWaalsContact C-N 3.3Å; V853-V855 PolarHBondContact O-N 2.92Å; V855-I857 VanDerWaalsContact C-N 3.33Å; V855-I857 PolarHBondContact O-N 3.1Å; V855-L858 PolarHBondContact O-N 3.26Å; V855-V859 HydrophobicContact CG1-CG2 4.21Å; V855-V859 WeakPolarHBondContact O-CB 3.49Å; V855-V859 VanDerWaalsContact O-CG2 3.29Å; V855-V859 WeakPolarHBondContact O-CG2 3.34Å; V855-V859 PolarHBondContact O-N 3.46Å
856	G	94.9	Very high	91.2	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60.9	-41.3	176	0	0	0	0	0	112.7	G537 G852 V853 V859 A860	G537-G856 VanDerWaalsContact CA-O 3.3Å; G537-G856 WeakPolarHBondContact CA-O 3.21Å; G852-G856 PolarHBondContact O-N 3.43Å; V853-G856 PolarHBondContact O-N 3.21Å; G856-V859 PolarHBondContact O-N 2.97Å; G856-A860 WeakPolarHBondContact O-CB 3.48Å; G856-A860 PolarHBondContact O-N 3.43Å
857	I	96.1	Very high	90.8	Very high	71 Å²	71	30.8 Å²	30.8	36%	0.364	16%	0.164	S	C	.	.	H	α-helix	trans	-62.7	-48.8	173.9	-67.1	166.6	0	0	0	110.6	I541 V853 F854 V855 V859 A860 L861	I541-I857 HydrophobicContact CD1-CG1 3.81Å; I541-I857 HydrophobicContact CG1-CG1 4.36Å; V853-I857 HydrophobicContact CG1-CD1 3.88Å; V853-I857 WeakPolarHBondContact O-CG1 3.5Å; V853-I857 PolarHBondContact O-N 3.44Å; F854-I857 PolarHBondContact O-N 3.49Å; V855-I857 VanDerWaalsContact C-N 3.33Å; V855-I857 PolarHBondContact O-N 3.1Å; I857-V859 VanDerWaalsContact C-N 3.34Å; I857-V859 PolarHBondContact O-N 3.31Å; I857-A860 PolarHBondContact O-N 3.47Å; I857-L861 HydrophobicContact CG2-CD1 3.72Å; I857-L861 HydrophobicContact CG2-CG 4.21Å; I857-L861 WeakPolarHBondContact O-CB 3.41Å; I857-L861 VanDerWaalsContact O-CG 3.29Å; I857-L861 WeakPolarHBondContact O-CG 3.44Å; I857-L861 PolarHBondContact O-N 3.23Å
858	L	94.6	Very high	90.5	Very high	64 Å²	64	35.2 Å²	35.2	34%	0.335	19%	0.187	S	C	.	.	H	α-helix	trans	-62	-40.5	179.7	-72.5	171.8	0	0	0	112.3	V501 Y505 F854 V855 L861 S862	V501-L858 HydrophobicContact CG1-CD1 3.86Å; Y505-L858 HydrophobicContact CD2-CB 3.49Å; Y505-L858 VanDerWaalsContact CD2-CB 3.49Å; Y505-L858 HydrophobicContact CD2-CD1 4.4Å; Y505-L858 HydrophobicContact CE2-CB 3.71Å; Y505-L858 HydrophobicContact CG-CB 4.22Å; Y505-L858 HydrophobicContact CG-CD1 4.32Å; F854-L858 WeakPolarHBondContact O-CB 3.33Å; F854-L858 VanDerWaalsContact O-CG 3.27Å; F854-L858 WeakPolarHBondContact O-CG 3.49Å; F854-L858 PolarHBondContact O-N 3.45Å; V855-L858 PolarHBondContact O-N 3.26Å; L858-L861 PolarHBondContact O-N 3.1Å; L858-S862 PolarHBondContact O-N 3.19Å; L858-S862 PolarHBondContact O-OG 3.37Å
859	V	93.3	Very high	90	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-65	-42.7	175.7	172.5	0	0	0	0	110.9	Y505 N508 V536 V855 G856 I857 S862	Y505-V859 HydrophobicContact CD2-CG2 3.93Å; Y505-V859 HydrophobicContact CE2-CG2 4.19Å; N508-V859 HydrophobicContact CB-CG2 4.33Å; V536-V859 HydrophobicContact CB-CG1 4.42Å; V536-V859 HydrophobicContact CG1-CG1 4.14Å; V855-V859 HydrophobicContact CG1-CG2 4.21Å; V855-V859 WeakPolarHBondContact O-CB 3.49Å; V855-V859 VanDerWaalsContact O-CG2 3.29Å; V855-V859 WeakPolarHBondContact O-CG2 3.34Å; V855-V859 PolarHBondContact O-N 3.46Å; G856-V859 PolarHBondContact O-N 2.97Å; I857-V859 VanDerWaalsContact C-N 3.34Å; I857-V859 PolarHBondContact O-N 3.31Å; V859-S862 WeakPolarHBondContact O-CB 3.41Å; V859-S862 PolarHBondContact O-N 2.87Å; V859-S862 PolarHBondContact O-OG 3.08Å
860	A	92.2	Very high	89.5	Confident	17 Å²	17	37.3 Å²	37.3	14%	0.14	20%	0.201	C	C	.	.	H	α-helix	trans	-63.9	-42	174.9	0	0	0	0	0	112.1	L534 G856 I857 S862 I863	L534-A860 HydrophobicContact CD1-CB 4.41Å; G856-A860 WeakPolarHBondContact O-CB 3.48Å; G856-A860 PolarHBondContact O-N 3.43Å; I857-A860 PolarHBondContact O-N 3.47Å; A860-S862 PolarHBondContact O-N 3.45Å; A860-I863 WeakPolarHBondContact O-CD1 3.49Å; A860-I863 VanDerWaalsContact O-CG1 3.24Å; A860-I863 WeakPolarHBondContact O-CG1 3.44Å; A860-I863 PolarHBondContact O-N 3.07Å
861	L	91.7	Very high	89.2	Confident	90 Å²	90	39.1 Å²	39.1	47%	0.471	21%	0.21	S	C	.	.	H	α-helix	trans	-70	-15.8	176.8	-68.6	176.8	0	0	0	113.3	I857 L858 I863 F864	I857-L861 HydrophobicContact CG2-CD1 3.72Å; I857-L861 HydrophobicContact CG2-CG 4.21Å; I857-L861 WeakPolarHBondContact O-CB 3.41Å; I857-L861 VanDerWaalsContact O-CG 3.29Å; I857-L861 WeakPolarHBondContact O-CG 3.44Å; I857-L861 PolarHBondContact O-N 3.23Å; L858-L861 PolarHBondContact O-N 3.1Å; L861-I863 PolarHBondContact O-N 3.22Å; L861-I863 VanDerWaalsContact O-N 3.1Å; L861-F864 HydrophobicContact CD2-CD2 4.23Å; L861-F864 HydrophobicContact CD2-CE2 4.15Å; L861-F864 PolarHBondContact O-N 3.23Å; L861-F864 VanDerWaalsContact O-N 3.08Å
862	S	89.5	Confident	88.9	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-63.5	-15.2	177.4	-59	0	0	0	0	113.2	Y505 L858 V859 A860 F864 L865 L869	Y505-S862 WeakPolarHBondContact CE2-OG 3.49Å; Y505-S862 PolarHBondContact OH-OG 3.13Å; L858-S862 PolarHBondContact O-N 3.19Å; L858-S862 PolarHBondContact O-OG 3.37Å; V859-S862 WeakPolarHBondContact O-CB 3.41Å; V859-S862 PolarHBondContact O-N 2.87Å; V859-S862 PolarHBondContact O-OG 3.08Å; A860-S862 PolarHBondContact O-N 3.45Å; S862-F864 PolarHBondContact O-N 2.9Å; S862-L865 WeakPolarHBondContact O-CB 3.38Å; S862-L865 PolarHBondContact O-N 3.24Å; S862-L869 WeakPolarHBondContact O-CD1 3.42Å
863	I	87.9	Confident	88.7	Confident	3 Å²	3	39.4 Å²	39.4	2%	0.015	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-58.6	-36.7	172.5	-60.7	165.2	0	0	0	110.8	T530 L533 L534 V728 W733 A860 L861 L865 G866	T530-I863 HydrophobicContact CG2-CG2 3.94Å; L533-I863 HydrophobicContact CB-CG1 4.19Å; L534-I863 HydrophobicContact CB-CD1 3.58Å; L534-I863 HydrophobicContact CD1-CD1 3.71Å; L534-I863 HydrophobicContact CG-CD1 4.18Å; V728-I863 HydrophobicContact CG1-CG2 4.1Å; W733-I863 HydrophobicContact CZ2-CG2 4.06Å; A860-I863 WeakPolarHBondContact O-CD1 3.49Å; A860-I863 VanDerWaalsContact O-CG1 3.24Å; A860-I863 WeakPolarHBondContact O-CG1 3.44Å; A860-I863 PolarHBondContact O-N 3.07Å; L861-I863 PolarHBondContact O-N 3.22Å; L861-I863 VanDerWaalsContact O-N 3.1Å; I863-L865 VanDerWaalsContact C-N 3.25Å; I863-L865 PolarHBondContact O-N 2.98Å; I863-G866 PolarHBondContact O-N 3.49Å
864	F	85.9	Confident	88.2	Confident	112 Å²	112	39.1 Å²	39.1	49%	0.491	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-75.1	-14.9	177.9	-61.7	-68.1	0	0	0	113.3	L861 S862 G866	L861-F864 HydrophobicContact CD2-CD2 4.23Å; L861-F864 HydrophobicContact CD2-CE2 4.15Å; L861-F864 PolarHBondContact O-N 3.23Å; L861-F864 VanDerWaalsContact O-N 3.08Å; S862-F864 PolarHBondContact O-N 2.9Å; F864-G866 PolarHBondContact O-N 3.11Å
865	L	83.3	Confident	87.9	Confident	70 Å²	70	35 Å²	35	37%	0.366	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-80.2	12.2	171.9	-58.2	174.6	0	0	0	112.2	S862 I863 S867 I868 L869	S862-L865 WeakPolarHBondContact O-CB 3.38Å; S862-L865 PolarHBondContact O-N 3.24Å; I863-L865 VanDerWaalsContact C-N 3.25Å; I863-L865 PolarHBondContact O-N 2.98Å; L865-S867 PolarHBondContact O-N 3.42Å; L865-S867 VanDerWaalsContact O-N 3.14Å; L865-I868 HydrophobicContact CD2-CD1 4.21Å; L865-I868 PolarHBondContact O-N 3.24Å; L865-L869 HydrophobicContact CB-CD1 4.14Å; L865-L869 HydrophobicContact CB-CG 4.18Å; L865-L869 WeakPolarHBondContact O-CG 2.92Å; L865-L869 PolarHBondContact O-N 3.48Å
866	G	78.2	Confident	87.7	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-52.1	-35.9	-178.7	0	0	0	0	0	114.2	I722 I863 F864 I868 L869 S870	I722-G866 VanDerWaalsContact CG2-CA 3.48Å; I863-G866 PolarHBondContact O-N 3.49Å; F864-G866 PolarHBondContact O-N 3.11Å; G866-I868 VanDerWaalsContact C-N 3.28Å; G866-I868 PolarHBondContact O-N 2.91Å; G866-L869 PolarHBondContact O-N 3.26Å; G866-S870 WeakPolarHBondContact O-CB 3.28Å; G866-S870 PolarHBondContact O-N 3.02Å; G866-S870 PolarHBondContact O-OG 2.95Å; G866-S870 VanDerWaalsContact O-OG 3.12Å
867	S	81.4	Confident	87.2	Confident	59 Å²	59	35 Å²	35	41%	0.413	19%	0.188	S	C	.	.	H	α-helix	trans	-64.7	-28.5	176	56.4	0	0	0	0	114	L865 S870 N871	L865-S867 PolarHBondContact O-N 3.42Å; L865-S867 VanDerWaalsContact O-N 3.14Å; S867-S870 PolarHBondContact O-OG 3.47Å; S867-N871 PolarHBondContact O-ND2 2.98Å
868	I	83.7	Confident	86.8	Confident	103 Å²	103	32.7 Å²	32.7	53%	0.528	18%	0.175	S	C	.	.	H	α-helix	trans	-88.5	-45.9	177.3	-63.6	169.2	0	0	0	109.5	L865 G866 S870 N871	L865-I868 HydrophobicContact CD2-CD1 4.21Å; L865-I868 PolarHBondContact O-N 3.24Å; G866-I868 VanDerWaalsContact C-N 3.28Å; G866-I868 PolarHBondContact O-N 2.91Å; I868-S870 VanDerWaalsContact C-N 3.31Å; I868-S870 PolarHBondContact O-N 3.43Å; I868-N871 WeakPolarHBondContact O-CB 3.36Å; I868-N871 PolarHBondContact O-N 2.83Å
869	L	81	Confident	86.5	Confident	14 Å²	14	29.7 Å²	29.7	7%	0.073	16%	0.159	C	C	.	.	H	α-helix	trans	-67.6	-29.2	-176.4	-65.7	175.6	0	0	0	112.9	I513 I722 S862 L865 G866 N871 I872	I513-L869 HydrophobicContact CD1-CD1 4.31Å; I513-L869 HydrophobicContact CD1-CD2 3.85Å; I722-L869 HydrophobicContact CD1-CB 3.53Å; I722-L869 HydrophobicContact CD1-CD1 4.12Å; I722-L869 HydrophobicContact CD1-CG 4.48Å; S862-L869 WeakPolarHBondContact O-CD1 3.42Å; L865-L869 HydrophobicContact CB-CD1 4.14Å; L865-L869 HydrophobicContact CB-CG 4.18Å; L865-L869 WeakPolarHBondContact O-CG 2.92Å; L865-L869 PolarHBondContact O-N 3.48Å; G866-L869 PolarHBondContact O-N 3.26Å; L869-N871 PolarHBondContact O-N 3.27Å; L869-I872 HydrophobicContact CD2-CD1 3.76Å; L869-I872 WeakPolarHBondContact O-CB 3.31Å; L869-I872 PolarHBondContact O-N 3.47Å; L869-I872 VanDerWaalsContact O-N 3.15Å
870	S	84.3	Confident	86.2	Confident	30 Å²	30	29.7 Å²	29.7	21%	0.21	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-18.2	176.7	65.4	0	0	0	0	113.9	T719 V720 G866 S867 I868 I872	T719-S870 WeakPolarHBondContact CB-O 3.21Å; T719-S870 PolarHBondContact OG1-O 3.48Å; V720-S870 WeakPolarHBondContact O-CA 3.41Å; G866-S870 WeakPolarHBondContact O-CB 3.28Å; G866-S870 PolarHBondContact O-N 3.02Å; G866-S870 PolarHBondContact O-OG 2.95Å; G866-S870 VanDerWaalsContact O-OG 3.12Å; S867-S870 PolarHBondContact O-OG 3.47Å; I868-S870 VanDerWaalsContact C-N 3.31Å; I868-S870 PolarHBondContact O-N 3.43Å; S870-I872 VanDerWaalsContact C-N 3.3Å
871	N	85.6	Confident	85.9	Confident	60 Å²	60	29 Å²	29	32%	0.321	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-5.3	177.2	-62	-52.2	0	0	0	113.3	T705 R709 S867 I868 L869 P873	T705-N871 HydrophobicContact CG2-CB 4.31Å; T705-N871 WeakPolarHBondContact CG2-O 3.5Å; T705-N871 PolarHBondContact OG1-O 3.4Å; R709-N871 PolarHBondContact NH2-ND2 3.42Å; R709-N871 PolarHBondContact NH2-OD1 3.36Å; S867-N871 PolarHBondContact O-ND2 2.98Å; I868-N871 WeakPolarHBondContact O-CB 3.36Å; I868-N871 PolarHBondContact O-N 2.83Å; L869-N871 PolarHBondContact O-N 3.27Å; N871-P873 WeakPolarHBondContact O-CD 3.49Å
872	I	86.1	Confident	85.8	Confident	14 Å²	14	25 Å²	25	7%	0.072	13%	0.132	C	C	.	.	S	Bend	trans	-81.8	119.8	-178.1	-59	175.1	0	0	0	108.2	M701 T719 V720 L869 S870 A876 L877	M701-I872 HydrophobicContact SD-CD1 4.22Å; T719-I872 WeakPolarHBondContact CA-O 3.31Å; T719-I872 WeakPolarHBondContact CB-O 3.34Å; V720-I872 HydrophobicContact CG2-CB 4.42Å; V720-I872 PolarHBondContact N-O 3.2Å; V720-I872 VanDerWaalsContact N-O 3.13Å; L869-I872 HydrophobicContact CD2-CD1 3.76Å; L869-I872 WeakPolarHBondContact O-CB 3.31Å; L869-I872 PolarHBondContact O-N 3.47Å; L869-I872 VanDerWaalsContact O-N 3.15Å; S870-I872 VanDerWaalsContact C-N 3.3Å; I872-A876 HydrophobicContact CG2-CB 4.01Å; I872-L877 HydrophobicContact CG2-CD2 4.35Å
873	P	88.3	Confident	85.7	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.137	C	C	.	.	B	Isolated β-bridge	trans	-70	143.6	174.9	29.2	-33.9	0	0	0	110.2	I704 T705 E708 L717 N871 A875 A876	I704-P873 HydrophobicContact CG2-CG 3.7Å; T705-P873 VanDerWaalsContact OG1-CD 3.31Å; T705-P873 WeakPolarHBondContact OG1-CD 3.28Å; E708-P873 HydrophobicContact CB-CG 4.42Å; E708-P873 HydrophobicContact CG-CB 4.47Å; E708-P873 HydrophobicContact CG-CG 4.5Å; L717-P873 HydrophobicContact CD2-CB 4.48Å; N871-P873 WeakPolarHBondContact O-CD 3.49Å; P873-A875 HydrophobicContact CB-CB 4.5Å; P873-A875 PolarHBondContact O-N 3.39Å; P873-A875 VanDerWaalsContact O-N 3.08Å; P873-A876 HydrophobicContact CG-CB 4.35Å; P873-A876 WeakPolarHBondContact O-CB 3.4Å; P873-A876 PolarHBondContact O-N 3.32Å
874	L	85	Confident	85.5	Confident	26 Å²	26	27.5 Å²	27.5	14%	0.136	14%	0.143	C	C	.	.	H	α-helix	trans	-56.7	-27.8	176.8	-69.6	178.9	0	0	0	112.3	A517 P718 V720 A876 L877 Y878	A517-L874 HydrophobicContact CB-CD2 4.27Å; P718-L874 HydrophobicContact CB-CD1 3.76Å; P718-L874 HydrophobicContact CB-CG 4.39Å; P718-L874 HydrophobicContact CG-CB 4.48Å; P718-L874 HydrophobicContact CG-CD1 4Å; P718-L874 WeakPolarHBondContact O-CB 3.35Å; P718-L874 WeakPolarHBondContact O-CG 3.39Å; P718-L874 PolarHBondContact O-N 2.84Å; V720-L874 HydrophobicContact CG2-CD2 4.15Å; L874-A876 VanDerWaalsContact C-N 3.26Å; L874-A876 PolarHBondContact O-N 3.25Å; L874-L877 HydrophobicContact CD2-CD1 3.89Å; L874-L877 WeakPolarHBondContact O-CB 3.17Å; L874-L877 PolarHBondContact O-N 3.49Å; L874-Y878 HydrophobicContact CB-CE2 4.06Å; L874-Y878 WeakPolarHBondContact O-CD2 3.39Å; L874-Y878 PolarHBondContact O-N 3.08Å
875	A	88.8	Confident	85.5	Confident	1 Å²	1	22.2 Å²	22.2	1%	0.008	12%	0.12	C	C	.	.	H	α-helix	trans	-53.4	-40.1	173.1	0	0	0	0	0	113	T661 L664 A665 L717 P873 L877 Y878 G879	T661-A875 HydrophobicContact CG2-CB 4.44Å; T661-A875 WeakPolarHBondContact O-CB 3.46Å; L664-A875 HydrophobicContact CB-CB 3.92Å; A665-A875 WeakPolarHBondContact CA-O 3.49Å; A665-A875 VanDerWaalsContact CB-O 3.3Å; A665-A875 WeakPolarHBondContact CB-O 3.21Å; L717-A875 HydrophobicContact CD2-CB 4.36Å; P873-A875 HydrophobicContact CB-CB 4.5Å; P873-A875 PolarHBondContact O-N 3.39Å; P873-A875 VanDerWaalsContact O-N 3.08Å; A875-L877 VanDerWaalsContact C-N 3.31Å; A875-L877 PolarHBondContact O-N 2.99Å; A875-Y878 PolarHBondContact O-N 2.83Å; A875-G879 PolarHBondContact O-N 3.22Å
876	A	89.1	Confident	85.8	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-65	-37.2	176.8	0	0	0	0	0	111.6	I704 I872 P873 L874 M880	I704-A876 HydrophobicContact CB-CB 3.92Å; I704-A876 HydrophobicContact CG1-CB 4.29Å; I704-A876 HydrophobicContact CG2-CB 3.85Å; I872-A876 HydrophobicContact CG2-CB 4.01Å; P873-A876 HydrophobicContact CG-CB 4.35Å; P873-A876 WeakPolarHBondContact O-CB 3.4Å; P873-A876 PolarHBondContact O-N 3.32Å; L874-A876 VanDerWaalsContact C-N 3.26Å; L874-A876 PolarHBondContact O-N 3.25Å; A876-M880 WeakPolarHBondContact O-CB 3.22Å; A876-M880 PolarHBondContact O-N 3.24Å
877	L	85.6	Confident	86	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-68.9	-41.7	178.4	-57.7	-174.2	0	0	0	111.8	I513 T514 M701 V720 I872 L874 A875 M880 F881	I513-L877 HydrophobicContact CG2-CD1 3.92Å; I513-L877 HydrophobicContact CG2-CD2 4.14Å; T514-L877 HydrophobicContact CG2-CB 3.96Å; M701-L877 HydrophobicContact CE-CD2 3.88Å; V720-L877 HydrophobicContact CG2-CD1 3.65Å; V720-L877 HydrophobicContact CG2-CG 4.42Å; I872-L877 HydrophobicContact CG2-CD2 4.35Å; L874-L877 HydrophobicContact CD2-CD1 3.89Å; L874-L877 WeakPolarHBondContact O-CB 3.17Å; L874-L877 PolarHBondContact O-N 3.49Å; A875-L877 VanDerWaalsContact C-N 3.31Å; A875-L877 PolarHBondContact O-N 2.99Å; L877-M880 WeakPolarHBondContact O-CB 3.27Å; L877-M880 PolarHBondContact O-N 3.34Å; L877-F881 PolarHBondContact O-N 3.46Å
878	Y	87.6	Confident	85.9	Confident	23 Å²	23	20.5 Å²	20.5	9%	0.09	11%	0.111	C	C	.	.	H	α-helix	trans	-66.7	-40.3	177	-57.9	-45	0	0	0	112.2	T631 M632 L874 A875 M880 F881 L882	T631-Y878 HydrophobicContact CG2-CD1 4.49Å; T631-Y878 HydrophobicContact CG2-CE1 3.56Å; T631-Y878 HydrophobicContact CG2-CE2 4.46Å; T631-Y878 WeakPolarHBondContact CG2-OH 3.37Å; M632-Y878 HydrophobicContact CE-CG 4.34Å; M632-Y878 HydrophobicContact CG-CD2 4.22Å; M632-Y878 HydrophobicContact CG-CG 4.35Å; L874-Y878 HydrophobicContact CB-CE2 4.06Å; L874-Y878 WeakPolarHBondContact O-CD2 3.39Å; L874-Y878 PolarHBondContact O-N 3.08Å; A875-Y878 PolarHBondContact O-N 2.83Å; Y878-M880 VanDerWaalsContact C-N 3.26Å; Y878-M880 PolarHBondContact O-N 3.46Å; Y878-F881 WeakPolarHBondContact O-CB 3.43Å; Y878-F881 PolarHBondContact O-N 2.79Å; Y878-L882 PolarHBondContact O-N 3.33Å
879	G	89.1	Confident	86.1	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-62.7	-33.7	172.7	0	0	0	0	0	113	A665 A875 L882 Y883	A665-G879 VanDerWaalsContact O-CA 3.22Å; A665-G879 WeakPolarHBondContact O-CA 3.21Å; A875-G879 PolarHBondContact O-N 3.22Å; G879-L882 PolarHBondContact O-N 3.36Å; G879-Y883 WeakPolarHBondContact O-CB 3.46Å; G879-Y883 PolarHBondContact O-N 3.34Å
880	M	86.6	Confident	86.1	Confident	1 Å²	1	18.9 Å²	18.9	1%	0.005	10%	0.099	C	C	.	.	H	α-helix	trans	-69.9	-38.2	173.4	-176.3	-84.5	-56.2	0	0	112.5	S510 T514 M668 V697 M701 A876 L877 Y878 Y883 M884	S510-M880 VanDerWaalsContact O-CE 3.27Å; S510-M880 WeakPolarHBondContact O-CE 3.43Å; S510-M880 WeakPolarHBondContact OG-CE 3.46Å; S510-M880 VanDerWaalsContact OG-CG 3.25Å; S510-M880 WeakPolarHBondContact OG-CG 3.29Å; S510-M880 PolarHBondContact OG-SD 2.96Å; T514-M880 WeakPolarHBondContact OG1-CE 3.29Å; M668-M880 HydrophobicContact CE-CB 4.13Å; V697-M880 HydrophobicContact CG1-CG 3.7Å; V697-M880 HydrophobicContact CG2-CG 4.41Å; M701-M880 HydrophobicContact CE-CG 4.45Å; A876-M880 WeakPolarHBondContact O-CB 3.22Å; A876-M880 PolarHBondContact O-N 3.24Å; L877-M880 WeakPolarHBondContact O-CB 3.27Å; L877-M880 PolarHBondContact O-N 3.34Å; Y878-M880 VanDerWaalsContact C-N 3.26Å; Y878-M880 PolarHBondContact O-N 3.46Å; M880-Y883 WeakPolarHBondContact O-CB 3.37Å; M880-Y883 PolarHBondContact O-N 2.89Å; M880-M884 HydrophobicContact CE-CE 4.06Å; M880-M884 WeakPolarHBondContact O-CG 3.45Å; M880-M884 PolarHBondContact O-N 3.12Å; M880-M884 HydrophobicContact SD-CE 3.27Å; M880-M884 WeakPolarHBondContact SD-CE 2.97Å; M880-M884 HydrophobicContact SD-CG 3.87Å; M880-M884 HydrophobicContact SD-SD 3.56Å
881	F	84.8	Confident	85.7	Confident	2 Å²	2	21.1 Å²	21.1	1%	0.009	11%	0.108	C	C	.	.	H	α-helix	trans	-61.3	-43.5	170.6	-91	20.1	0	0	0	112.5	T514 F515 L518 F624 A628 L877 Y878 Y883 M884 G885	T514-F881 HydrophobicContact CG2-CD1 3.59Å; T514-F881 HydrophobicContact CG2-CD2 4.04Å; T514-F881 HydrophobicContact CG2-CE1 3.19Å; T514-F881 HydrophobicContact CG2-CE2 3.65Å; T514-F881 HydrophobicContact CG2-CG 4.03Å; T514-F881 HydrophobicContact CG2-CZ 3.22Å; F515-F881 HydrophobicContact CD2-CZ 4.47Å; F515-F881 HydrophobicContact CE1-CZ 4.42Å; F515-F881 HydrophobicContact CE2-CZ 4.39Å; F515-F881 HydrophobicContact CZ-CZ 4.37Å; L518-F881 HydrophobicContact CD1-CE2 3.66Å; L518-F881 HydrophobicContact CD1-CZ 4.2Å; F624-F881 HydrophobicContact CD1-CD1 4.45Å; F624-F881 HydrophobicContact CD1-CD2 4.2Å; F624-F881 HydrophobicContact CD1-CE1 4.36Å; F624-F881 HydrophobicContact CD1-CE2 4.16Å; F624-F881 HydrophobicContact CD1-CG 4.33Å; F624-F881 HydrophobicContact CD1-CZ 4.23Å; F624-F881 HydrophobicContact CE1-CE1 4.24Å; F624-F881 HydrophobicContact CE1-CE2 4.43Å; F624-F881 HydrophobicContact CE1-CZ 4.1Å; A628-F881 HydrophobicContact CB-CB 3.73Å; L877-F881 PolarHBondContact O-N 3.46Å; Y878-F881 WeakPolarHBondContact O-CB 3.43Å; Y878-F881 PolarHBondContact O-N 2.79Å; F881-Y883 VanDerWaalsContact C-N 3.3Å; F881-Y883 PolarHBondContact O-N 3.05Å; F881-M884 HydrophobicContact CD1-CE 3.38Å; F881-M884 HydrophobicContact CE1-CE 3.6Å; F881-M884 HydrophobicContact CG-CE 4.4Å; F881-M884 PolarHBondContact O-N 2.91Å; F881-G885 PolarHBondContact O-N 2.92Å
882	L	90	Very high	85.6	Confident	5 Å²	5	18.9 Å²	18.9	3%	0.026	10%	0.096	C	C	.	.	H	α-helix	trans	-58.1	-46.2	173	-70.2	178.2	0	0	0	111	L625 A628 L629 M632 F666 L669 Y878 G879 M884 G885 V886	L625-L882 HydrophobicContact CD2-CD2 4.09Å; A628-L882 HydrophobicContact CB-CD2 3.9Å; A628-L882 HydrophobicContact CB-CG 4.01Å; L629-L882 HydrophobicContact CD2-CD2 3.98Å; L629-L882 HydrophobicContact CG-CD2 3.9Å; M632-L882 HydrophobicContact CE-CD1 3.59Å; M632-L882 HydrophobicContact CE-CG 4.06Å; M632-L882 HydrophobicContact SD-CD1 4.42Å; F666-L882 HydrophobicContact CE1-CD1 4.36Å; L669-L882 HydrophobicContact CB-CB 4.48Å; L669-L882 HydrophobicContact CD1-CB 4.09Å; L669-L882 HydrophobicContact CD2-CB 4.15Å; L669-L882 HydrophobicContact CD2-CD1 4.26Å; L669-L882 HydrophobicContact CG-CB 4.47Å; Y878-L882 PolarHBondContact O-N 3.33Å; G879-L882 PolarHBondContact O-N 3.36Å; L882-M884 PolarHBondContact O-N 3.37Å; L882-G885 PolarHBondContact O-N 3.28Å; L882-V886 WeakPolarHBondContact O-CG2 3.3Å; L882-V886 PolarHBondContact O-N 3.46Å
883	Y	87.8	Confident	85.5	Confident	28 Å²	28	19 Å²	19	11%	0.11	10%	0.097	C	C	.	.	H	α-helix	trans	-60.3	-46.2	178.7	170.1	-97.1	0	0	0	112.4	C672 A676 N696 V697 G879 M880 F881 G885 V886 M887	C672-Y883 HydrophobicContact CB-CD1 4.36Å; C672-Y883 HydrophobicContact CB-CD2 3.26Å; C672-Y883 HydrophobicContact CB-CE2 3.58Å; C672-Y883 HydrophobicContact CB-CG 3.71Å; A676-Y883 HydrophobicContact CB-CE2 4.47Å; N696-Y883 PolarHBondContact ND2-OH 3.19Å; V697-Y883 HydrophobicContact CG2-CD1 4.2Å; V697-Y883 HydrophobicContact CG2-CE1 4.09Å; G879-Y883 WeakPolarHBondContact O-CB 3.46Å; G879-Y883 PolarHBondContact O-N 3.34Å; M880-Y883 WeakPolarHBondContact O-CB 3.37Å; M880-Y883 PolarHBondContact O-N 2.89Å; F881-Y883 VanDerWaalsContact C-N 3.3Å; F881-Y883 PolarHBondContact O-N 3.05Å; Y883-G885 VanDerWaalsContact C-N 3.33Å; Y883-G885 PolarHBondContact O-N 2.9Å; Y883-V886 PolarHBondContact O-N 3.39Å; Y883-M887 HydrophobicContact CD1-CG 4.48Å; Y883-M887 HydrophobicContact CD2-CE 4.13Å; Y883-M887 HydrophobicContact CD2-CG 4.11Å; Y883-M887 HydrophobicContact CE1-CG 3.96Å; Y883-M887 HydrophobicContact CE2-CE 3.3Å; Y883-M887 HydrophobicContact CE2-CG 3.6Å; Y883-M887 HydrophobicContact CE2-SD 4.29Å; Y883-M887 VanDerWaalsContact CZ-CG 3.45Å; Y883-M887 WeakPolarHBondContact O-CB 3.45Å; Y883-M887 WeakPolarHBondContact O-CG 3.33Å; Y883-M887 PolarHBondContact O-N 3.47Å
884	M	82.6	Confident	85.4	Confident	29 Å²	29	19.4 Å²	19.4	14%	0.143	10%	0.099	C	C	.	.	H	α-helix	trans	-64.5	-37.8	177.2	-71	-165.9	-58.6	0	0	112.6	P511 F624 M880 F881 L882 G888	P511-M884 HydrophobicContact CB-CE 4.22Å; P511-M884 HydrophobicContact CB-SD 4.39Å; P511-M884 HydrophobicContact CG-CE 4.06Å; P511-M884 HydrophobicContact CG-SD 3.61Å; F624-M884 HydrophobicContact CE1-CE 4.33Å; M880-M884 HydrophobicContact CE-CE 4.06Å; M880-M884 WeakPolarHBondContact O-CG 3.45Å; M880-M884 PolarHBondContact O-N 3.12Å; M880-M884 HydrophobicContact SD-CE 3.27Å; M880-M884 WeakPolarHBondContact SD-CE 2.97Å; M880-M884 HydrophobicContact SD-CG 3.87Å; M880-M884 HydrophobicContact SD-SD 3.56Å; F881-M884 HydrophobicContact CD1-CE 3.38Å; F881-M884 HydrophobicContact CE1-CE 3.6Å; F881-M884 HydrophobicContact CG-CE 4.4Å; F881-M884 PolarHBondContact O-N 2.91Å; L882-M884 PolarHBondContact O-N 3.37Å; M884-G888 PolarHBondContact O-N 3.35Å
885	G	86.6	Confident	85.5	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-60.8	-50.3	174.1	0	0	0	0	0	112.2	G621 F881 L882 Y883 M887 G888 L889	G621-G885 WeakPolarHBondContact O-CA 3.25Å; F881-G885 PolarHBondContact O-N 2.92Å; L882-G885 PolarHBondContact O-N 3.28Å; Y883-G885 VanDerWaalsContact C-N 3.33Å; Y883-G885 PolarHBondContact O-N 2.9Å; G885-M887 PolarHBondContact O-N 2.89Å; G885-G888 PolarHBondContact O-N 2.9Å; G885-L889 WeakPolarHBondContact O-CG 3.45Å; G885-L889 PolarHBondContact O-N 3.14Å
886	V	89.3	Confident	85.4	Confident	52 Å²	52	21.9 Å²	21.9	32%	0.315	11%	0.114	S	C	.	.	H	α-helix	trans	-62.6	-44.8	177.5	175.9	0	0	0	0	111.6	L625 L669 L673 L882 Y883 G888 L889 R890	L625-V886 HydrophobicContact CD2-CG2 3.89Å; L669-V886 HydrophobicContact CD1-CG2 4.38Å; L673-V886 HydrophobicContact CD2-CG1 4.19Å; L882-V886 WeakPolarHBondContact O-CG2 3.3Å; L882-V886 PolarHBondContact O-N 3.46Å; Y883-V886 PolarHBondContact O-N 3.39Å; V886-G888 VanDerWaalsContact C-N 3.35Å; V886-L889 PolarHBondContact O-N 2.87Å; V886-R890 PolarHBondContact O-N 2.98Å; V886-R890 VanDerWaalsContact O-N 3.16Å
887	M	83.6	Confident	85.3	Confident	29 Å²	29	22.1 Å²	22.1	14%	0.143	11%	0.114	C	C	.	.	H	α-helix	trans	-68.7	-33.3	179.8	-72.7	-60.8	169.6	0	0	113.2	L673 A676 Y883 G885 L889 R890	L673-M887 HydrophobicContact CD2-CE 3.56Å; A676-M887 HydrophobicContact CB-CE 3.49Å; A676-M887 VanDerWaalsContact CB-CE 3.49Å; Y883-M887 HydrophobicContact CD1-CG 4.48Å; Y883-M887 HydrophobicContact CD2-CE 4.13Å; Y883-M887 HydrophobicContact CD2-CG 4.11Å; Y883-M887 HydrophobicContact CE1-CG 3.96Å; Y883-M887 HydrophobicContact CE2-CE 3.3Å; Y883-M887 HydrophobicContact CE2-CG 3.6Å; Y883-M887 HydrophobicContact CE2-SD 4.29Å; Y883-M887 VanDerWaalsContact CZ-CG 3.45Å; Y883-M887 WeakPolarHBondContact O-CB 3.45Å; Y883-M887 WeakPolarHBondContact O-CG 3.33Å; Y883-M887 PolarHBondContact O-N 3.47Å; G885-M887 PolarHBondContact O-N 2.89Å; M887-L889 PolarHBondContact O-N 3.35Å; M887-R890 PolarHBondContact SD-NH1 3.29Å
888	G	78.3	Confident	85.4	Confident	13 Å²	13	25 Å²	25	13%	0.134	13%	0.129	C	C	.	.	H	α-helix	trans	-63.1	-28.7	174.6	0	0	0	0	0	113.1	M884 G885 V886 L892	M884-G888 PolarHBondContact O-N 3.35Å; G885-G888 PolarHBondContact O-N 2.9Å; V886-G888 VanDerWaalsContact C-N 3.35Å; G888-L892 WeakPolarHBondContact O-CD1 3.36Å; G888-L892 WeakPolarHBondContact O-CG 3.22Å
889	L	87.5	Confident	85.4	Confident	22 Å²	22	26.4 Å²	26.4	12%	0.115	14%	0.142	C	C	.	.	H	α-helix	trans	-89.3	-31.9	179.8	-64.2	177.8	0	0	0	113.9	F622 L625 G885 V886 M887 D891 L892 V895	F622-L889 HydrophobicContact CD1-CD1 4.28Å; F622-L889 HydrophobicContact CD2-CD2 4.3Å; F622-L889 HydrophobicContact CE1-CD1 4.04Å; F622-L889 HydrophobicContact CE2-CD1 4.39Å; F622-L889 HydrophobicContact CE2-CD2 4.22Å; F622-L889 HydrophobicContact CZ-CD1 4.09Å; L625-L889 HydrophobicContact CD1-CD1 3.75Å; G885-L889 WeakPolarHBondContact O-CG 3.45Å; G885-L889 PolarHBondContact O-N 3.14Å; V886-L889 PolarHBondContact O-N 2.87Å; M887-L889 PolarHBondContact O-N 3.35Å; L889-D891 PolarHBondContact O-N 2.72Å; L889-L892 HydrophobicContact CD2-CD1 4.22Å; L889-L892 PolarHBondContact O-N 3.4Å; L889-V895 WeakPolarHBondContact O-CG2 3.35Å
890	R	82.8	Confident	85.2	Confident	61 Å²	61	26.4 Å²	26.4	23%	0.23	14%	0.142	C	C	.	.	H	α-helix	trans	-58.9	-39	-167	-169.6	-175.4	69.1	-160.5	-11.7	114.9	V886 M887	V886-R890 PolarHBondContact O-N 2.98Å; V886-R890 VanDerWaalsContact O-N 3.16Å; M887-R890 PolarHBondContact SD-NH1 3.29Å
891	D	74	Confident	85.2	Confident	76 Å²	76	28.7 Å²	28.7	41%	0.406	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	14.1	-168.9	-60.1	-23.4	0	0	0	112.7	L889	L889-D891 PolarHBondContact O-N 2.72Å
892	L	83.5	Confident	85.3	Confident	13 Å²	13	36.3 Å²	36.3	7%	0.068	19%	0.191	C	C	.	.			trans	-80.9	130.9	177.1	-63.3	177.3	0	0	0	111.5	N617 G888 L889 F894 V895 L896	N617-L892 HydrophobicContact CB-CD1 4.19Å; N617-L892 HydrophobicContact CB-CD2 3.68Å; G888-L892 WeakPolarHBondContact O-CD1 3.36Å; G888-L892 WeakPolarHBondContact O-CG 3.22Å; L889-L892 HydrophobicContact CD2-CD1 4.22Å; L889-L892 PolarHBondContact O-N 3.4Å; L892-F894 PolarHBondContact O-N 3.21Å; L892-V895 HydrophobicContact CB-CB 4.34Å; L892-V895 HydrophobicContact CB-CG2 4.1Å; L892-V895 HydrophobicContact CD1-CG2 4.44Å; L892-V895 PolarHBondContact O-N 2.9Å; L892-L896 WeakPolarHBondContact O-CG 3.3Å; L892-L896 PolarHBondContact O-N 3.24Å
893	T	84.2	Confident	85.2	Confident	16 Å²	16	41 Å²	41	10%	0.098	21%	0.212	C	C	.	.	H	α-helix	trans	-59.3	-35.1	178.4	-30.5	0	0	0	0	112.3	R610 E614 L896 R897 C913	R610-T893 VanDerWaalsContact CZ-OG1 3.31Å; R610-T893 PolarHBondContact NE-OG1 3.42Å; R610-T893 PolarHBondContact NH2-OG1 3.48Å; E614-T893 WeakPolarHBondContact OE1-CB 3.35Å; E614-T893 PolarHBondContact OE1-OG1 2.87Å; E614-T893 WeakPolarHBondContact OE2-CB 3.29Å; T893-L896 PolarHBondContact O-N 3.38Å; T893-R897 WeakPolarHBondContact O-CB 3.21Å; T893-R897 VanDerWaalsContact O-CG 3.28Å; T893-R897 WeakPolarHBondContact O-CG 3.11Å; T893-R897 PolarHBondContact O-N 3.14Å; T893-R897 PolarHBondContact O-NE 3.4Å; T893-C913 HydrophobicContact CG2-CB 3.42Å; T893-C913 VanDerWaalsContact CG2-CB 3.42Å
894	F	87.5	Confident	85.1	Confident	9 Å²	9	49.8 Å²	49.8	4%	0.039	25%	0.245	C	C	.	.	H	α-helix	trans	-51.5	-53	169.1	166.9	-115.8	0	0	0	112.5	E614 L892 R897 I898 S926 Q929 A930 V933	E614-F894 HydrophobicContact CB-CB 4.22Å; E614-F894 PolarHBondContact OE2-N 3.28Å; L892-F894 PolarHBondContact O-N 3.21Å; F894-R897 PolarHBondContact O-N 3.47Å; F894-I898 HydrophobicContact CD2-CD1 4.11Å; F894-I898 HydrophobicContact CE1-CD1 4.03Å; F894-I898 HydrophobicContact CE2-CD1 3.4Å; F894-I898 HydrophobicContact CE2-CG1 4.22Å; F894-I898 HydrophobicContact CZ-CD1 3.35Å; F894-I898 PolarHBondContact O-N 3.02Å; F894-I898 VanDerWaalsContact O-N 3.08Å; F894-S926 WeakPolarHBondContact CE2-O 3.34Å; F894-Q929 HydrophobicContact CD2-CB 3.51Å; F894-Q929 HydrophobicContact CD2-CG 4.33Å; F894-Q929 HydrophobicContact CE2-CB 3.47Å; F894-Q929 VanDerWaalsContact CE2-CB 3.47Å; F894-Q929 HydrophobicContact CG-CB 4.44Å; F894-Q929 HydrophobicContact CZ-CB 4.4Å; F894-A930 HydrophobicContact CE2-CB 4.01Å; F894-A930 HydrophobicContact CZ-CB 3.86Å; F894-V933 HydrophobicContact CE1-CG2 4.26Å; F894-V933 HydrophobicContact CZ-CG2 4.5Å
895	V	86.2	Confident	85	Confident	35 Å²	35	56.8 Å²	56.8	21%	0.212	27%	0.269	C	S	.	.	H	α-helix	trans	-65.6	-42.2	178.3	176.5	0	0	0	0	110.7	L889 L892 R897 I898 C899	L889-V895 WeakPolarHBondContact O-CG2 3.35Å; L892-V895 HydrophobicContact CB-CB 4.34Å; L892-V895 HydrophobicContact CB-CG2 4.1Å; L892-V895 HydrophobicContact CD1-CG2 4.44Å; L892-V895 PolarHBondContact O-N 2.9Å; V895-R897 VanDerWaalsContact C-N 3.31Å; V895-R897 PolarHBondContact O-N 2.85Å; V895-I898 PolarHBondContact O-N 3.46Å; V895-C899 WeakPolarHBondContact O-CB 3.45Å; V895-C899 PolarHBondContact O-N 2.96Å; V895-C899 PolarHBondContact O-SG 2.98Å
896	L	86.3	Confident	84.7	Confident	45 Å²	45	65.7 Å²	65.7	24%	0.236	31%	0.308	C	S	.	.	H	α-helix	trans	-62.4	-37.3	177.1	-62.5	-179.2	0	0	0	112.4	L892 T893 C899 S900 W911	L892-L896 WeakPolarHBondContact O-CG 3.3Å; L892-L896 PolarHBondContact O-N 3.24Å; T893-L896 PolarHBondContact O-N 3.38Å; L896-C899 PolarHBondContact O-N 3.23Å; L896-S900 VanDerWaalsContact O-CB 3.3Å; L896-S900 WeakPolarHBondContact O-CB 3.46Å; L896-S900 PolarHBondContact O-N 3.08Å; L896-S900 PolarHBondContact O-OG 3.45Å; L896-W911 HydrophobicContact CB-CE3 4.22Å; L896-W911 HydrophobicContact CB-CZ3 3.97Å; L896-W911 HydrophobicContact CD1-CE3 4.42Å; L896-W911 HydrophobicContact CD1-CZ3 3.95Å; L896-W911 HydrophobicContact CD2-CE3 4.49Å; L896-W911 HydrophobicContact CD2-CH2 3.91Å; L896-W911 HydrophobicContact CD2-CZ3 3.46Å; L896-W911 VanDerWaalsContact CD2-CZ3 3.46Å; L896-W911 HydrophobicContact CG-CZ3 3.96Å
897	R	87.7	Confident	84.3	Confident	5 Å²	5	67.7 Å²	67.7	2%	0.019	31%	0.314	C	S	.	.	H	α-helix	trans	-64	-47.3	173.7	-78.8	-179.3	-72.7	-164.1	-5.3	111.2	E614 T893 F894 V895 C899 S900 L901 C913 I922 L983	E614-R897 IonicContact OE2-NH2 3.2Å; E614-R897 PolarHBondContact OE2-NH2 2.98Å; T893-R897 WeakPolarHBondContact O-CB 3.21Å; T893-R897 VanDerWaalsContact O-CG 3.28Å; T893-R897 WeakPolarHBondContact O-CG 3.11Å; T893-R897 PolarHBondContact O-N 3.14Å; T893-R897 PolarHBondContact O-NE 3.4Å; F894-R897 PolarHBondContact O-N 3.47Å; V895-R897 VanDerWaalsContact C-N 3.31Å; V895-R897 PolarHBondContact O-N 2.85Å; R897-C899 PolarHBondContact O-N 3.45Å; R897-S900 WeakPolarHBondContact CA-OG 3.3Å; R897-S900 PolarHBondContact O-N 3.17Å; R897-S900 PolarHBondContact O-OG 2.97Å; R897-L901 WeakPolarHBondContact O-CG 3.33Å; R897-L901 PolarHBondContact O-N 3.42Å; R897-C913 HydrophobicContact CG-CB 4.44Å; R897-I922 HydrophobicContact CB-CG2 4.37Å; R897-I922 HydrophobicContact CG-CG2 4.31Å; R897-L983 PolarHBondContact NH1-O 2.88Å
898	I	88.1	Confident	84	Confident	60 Å²	60	67.5 Å²	67.5	31%	0.308	31%	0.311	S	S	.	.	H	α-helix	trans	-58.2	-48.3	174.1	-67.4	173.7	0	0	0	110.8	F894 V895 S900 L901 M902	F894-I898 HydrophobicContact CD2-CD1 4.11Å; F894-I898 HydrophobicContact CE1-CD1 4.03Å; F894-I898 HydrophobicContact CE2-CD1 3.4Å; F894-I898 HydrophobicContact CE2-CG1 4.22Å; F894-I898 HydrophobicContact CZ-CD1 3.35Å; F894-I898 PolarHBondContact O-N 3.02Å; F894-I898 VanDerWaalsContact O-N 3.08Å; V895-I898 PolarHBondContact O-N 3.46Å; I898-S900 VanDerWaalsContact C-N 3.28Å; I898-S900 PolarHBondContact O-N 3.05Å; I898-L901 PolarHBondContact O-N 3.23Å; I898-M902 WeakPolarHBondContact O-CG 3.45Å; I898-M902 PolarHBondContact O-N 3.01Å
899	C	88.1	Confident	83.3	Confident	53 Å²	53	73.2 Å²	73.2	36%	0.358	34%	0.335	S	S	.	.	H	α-helix	trans	-61.6	-35.3	177.5	-68	0	0	0	0	112.7	V895 L896 R897 M902 K903	V895-C899 WeakPolarHBondContact O-CB 3.45Å; V895-C899 PolarHBondContact O-N 2.96Å; V895-C899 PolarHBondContact O-SG 2.98Å; L896-C899 PolarHBondContact O-N 3.23Å; R897-C899 PolarHBondContact O-N 3.45Å; C899-M902 PolarHBondContact O-N 3.45Å; C899-K903 PolarHBondContact O-N 2.88Å
900	S	84.1	Confident	82.3	Confident	0 Å²	0	76.8 Å²	76.8	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-70	-36.6	177.3	74.3	0	0	0	0	112.6	L896 R897 I898 M902 K903 W908 V914	L896-S900 VanDerWaalsContact O-CB 3.3Å; L896-S900 WeakPolarHBondContact O-CB 3.46Å; L896-S900 PolarHBondContact O-N 3.08Å; L896-S900 PolarHBondContact O-OG 3.45Å; R897-S900 WeakPolarHBondContact CA-OG 3.3Å; R897-S900 PolarHBondContact O-N 3.17Å; R897-S900 PolarHBondContact O-OG 2.97Å; I898-S900 VanDerWaalsContact C-N 3.28Å; I898-S900 PolarHBondContact O-N 3.05Å; S900-M902 PolarHBondContact O-N 3.39Å; S900-K903 WeakPolarHBondContact O-CB 3.42Å; S900-K903 PolarHBondContact O-N 3.07Å; S900-W908 PolarHBondContact O-NE1 3.23Å; S900-V914 WeakPolarHBondContact OG-CG2 3.42Å
901	L	86.2	Confident	81.4	Confident	50 Å²	50	76.9 Å²	76.9	26%	0.262	35%	0.354	S	S	.	.	H	α-helix	trans	-65	-29.5	174.9	-70.2	165.9	0	0	0	111.9	R897 I898 K903 W908 I922 L923	R897-L901 WeakPolarHBondContact O-CG 3.33Å; R897-L901 PolarHBondContact O-N 3.42Å; I898-L901 PolarHBondContact O-N 3.23Å; L901-K903 VanDerWaalsContact C-N 3.33Å; L901-W908 HydrophobicContact CD2-CH2 3.86Å; L901-W908 HydrophobicContact CD2-CZ2 4Å; L901-I922 HydrophobicContact CD1-CG2 4.24Å; L901-I922 HydrophobicContact CD2-CB 4.49Å; L901-I922 HydrophobicContact CD2-CG2 4.14Å; L901-I922 HydrophobicContact CG-CG2 4.27Å; L901-L923 HydrophobicContact CD1-CB 4.34Å; L901-L923 HydrophobicContact CD1-CD1 3.88Å; L901-L923 HydrophobicContact CD2-CB 4.22Å
902	M	87.5	Confident	80.9	Confident	162 Å²	162	76.9 Å²	76.9	80%	0.798	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-14.4	172.5	-62.1	179	74.5	0	0	113.4	I898 C899 S900	I898-M902 WeakPolarHBondContact O-CG 3.45Å; I898-M902 PolarHBondContact O-N 3.01Å; C899-M902 PolarHBondContact O-N 3.45Å; S900-M902 PolarHBondContact O-N 3.39Å
903	K	86.5	Confident	80	Confident	104 Å²	104	77.6 Å²	77.6	45%	0.452	36%	0.358	S	S	.	.	S	Bend	trans	-91.4	150.7	177.5	-76.2	-172.7	177.2	-168.8	0	111.6	C899 S900 L901 W908	C899-K903 PolarHBondContact O-N 2.88Å; S900-K903 WeakPolarHBondContact O-CB 3.42Å; S900-K903 PolarHBondContact O-N 3.07Å; L901-K903 VanDerWaalsContact C-N 3.33Å; K903-W908 PolarHBondContact O-NE1 3.18Å
904	R	86	Confident	79.5	Confident	212 Å²	212	77 Å²	77	80%	0.8	35%	0.354	S	S	*	.			trans	-58	138.3	172.8	-69.9	-175.7	-179.6	177.1	0.4	110.9	K906 H907	R904-K906 PolarHBondContact O-N 3.34Å; R904-H907 PolarHBondContact O-N 2.99Å
905	R	80.6	Confident	78.6	Confident	176 Å²	176	82.4 Å²	82.4	66%	0.664	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-53.5	-31	-175.9	-162.8	173.6	-177.6	-176.9	-2.3	114.6	H907 W908	R905-H907 PolarHBondContact O-N 3.47Å; R905-H907 VanDerWaalsContact O-N 3.12Å; R905-W908 VanDerWaalsContact CA-CD1 3.5Å; R905-W908 HydrophobicContact CG-CD2 4.09Å; R905-W908 HydrophobicContact CG-CE3 4.33Å; R905-W908 HydrophobicContact CG-CG 4.3Å; R905-W908 VanDerWaalsContact O-CB 3.27Å; R905-W908 WeakPolarHBondContact O-CB 3.35Å; R905-W908 PolarHBondContact O-N 3.4Å
906	K	81.1	Confident	77.8	Confident	187 Å²	187	84.3 Å²	84.3	81%	0.813	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-53.6	-30.6	175.6	-175.1	178.3	178.2	-179.4	0	113.6	R904	R904-K906 PolarHBondContact O-N 3.34Å
907	H	80.4	Confident	77.3	Confident	93 Å²	93	82.8 Å²	82.8	43%	0.431	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-97.2	12.2	-177.9	-55.9	92.1	0	0	0	113.1	R904 R905 W911	R904-H907 PolarHBondContact O-N 2.99Å; R905-H907 PolarHBondContact O-N 3.47Å; R905-H907 VanDerWaalsContact O-N 3.12Å; H907-W911 VanDerWaalsContact O-CD1 3.31Å
908	W	76.8	Confident	77	Confident	25 Å²	25	84.1 Å²	84.1	10%	0.095	40%	0.402	C	S	.	.	S	Bend	trans	-73.8	-29.7	-177.7	-78.7	23.3	0	0	0	112.6	S900 L901 K903 R905 D910 W911 V914 S919 I922	S900-W908 PolarHBondContact O-NE1 3.23Å; L901-W908 HydrophobicContact CD2-CH2 3.86Å; L901-W908 HydrophobicContact CD2-CZ2 4Å; K903-W908 PolarHBondContact O-NE1 3.18Å; R905-W908 VanDerWaalsContact CA-CD1 3.5Å; R905-W908 HydrophobicContact CG-CD2 4.09Å; R905-W908 HydrophobicContact CG-CE3 4.33Å; R905-W908 HydrophobicContact CG-CG 4.3Å; R905-W908 VanDerWaalsContact O-CB 3.27Å; R905-W908 WeakPolarHBondContact O-CB 3.35Å; R905-W908 PolarHBondContact O-N 3.4Å; W908-D910 PolarHBondContact O-N 3.05Å; W908-W911 PolarHBondContact O-N 2.92Å; W908-V914 HydrophobicContact CB-CG1 3.95Å; W908-V914 HydrophobicContact CD2-CG1 3.43Å; W908-V914 VanDerWaalsContact CD2-CG1 3.43Å; W908-V914 HydrophobicContact CE3-CG1 3.04Å; W908-V914 HydrophobicContact CG-CG1 3.86Å; W908-V914 HydrophobicContact CH2-CG1 4.33Å; W908-V914 HydrophobicContact CZ3-CG1 3.54Å; W908-S919 VanDerWaalsContact CH2-CB 3.41Å; W908-I922 HydrophobicContact CH2-CD1 4.36Å; W908-I922 HydrophobicContact CZ3-CD1 3.81Å
909	E	64.4	Low	76.8	Confident	133 Å²	133	83.3 Å²	83.3	62%	0.621	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-22	-178.9	-65	179.3	-178.3	0	0	113.2	W911 R915	E909-W911 PolarHBondContact O-N 3.04Å; E909-R915 PolarHBondContact O-NE 3.35Å; E909-R915 PolarHBondContact O-NH2 2.78Å
910	D	65.4	Low	76.8	Confident	98 Å²	98	89.8 Å²	89.8	52%	0.524	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-22.1	172.9	-66.5	-37.4	0	0	0	112.8	W908	W908-D910 PolarHBondContact O-N 3.05Å
911	W	63.8	Low	77	Confident	63 Å²	63	90.7 Å²	90.7	24%	0.239	42%	0.423	C	S	.	.			trans	-107.9	112.8	-174.4	-60.7	83.3	0	0	0	111.2	L896 H907 W908 E909 C913 V914 R915	L896-W911 HydrophobicContact CB-CE3 4.22Å; L896-W911 HydrophobicContact CB-CZ3 3.97Å; L896-W911 HydrophobicContact CD1-CE3 4.42Å; L896-W911 HydrophobicContact CD1-CZ3 3.95Å; L896-W911 HydrophobicContact CD2-CE3 4.49Å; L896-W911 HydrophobicContact CD2-CH2 3.91Å; L896-W911 HydrophobicContact CD2-CZ3 3.46Å; L896-W911 VanDerWaalsContact CD2-CZ3 3.46Å; L896-W911 HydrophobicContact CG-CZ3 3.96Å; H907-W911 VanDerWaalsContact O-CD1 3.31Å; W908-W911 PolarHBondContact O-N 2.92Å; E909-W911 PolarHBondContact O-N 3.04Å; W911-C913 PolarHBondContact O-N 2.98Å; W911-V914 HydrophobicContact CB-CB 4.44Å; W911-V914 PolarHBondContact O-N 3.06Å; W911-V914 VanDerWaalsContact O-N 3.12Å; W911-R915 PolarHBondContact O-N 3.11Å
912	E	63.5	Low	77	Confident	75 Å²	75	88.3 Å²	88.3	35%	0.35	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-29.9	179.2	-64.4	165.2	150.3	0	0	113	V914 V1053 V1054	E912-V914 PolarHBondContact O-N 3.2Å; E912-V1053 WeakPolarHBondContact OE1-CA 3.13Å; E912-V1053 VanDerWaalsContact OE1-CB 3.24Å; E912-V1053 WeakPolarHBondContact OE1-CB 3.29Å; E912-V1054 VanDerWaalsContact CD-CG2 3.4Å; E912-V1054 WeakPolarHBondContact OE1-CA 3.13Å; E912-V1054 WeakPolarHBondContact OE1-CG2 3.31Å; E912-V1054 PolarHBondContact OE1-N 3.5Å; E912-V1054 WeakPolarHBondContact OE2-CA 3.33Å; E912-V1054 WeakPolarHBondContact OE2-CB 3.41Å; E912-V1054 WeakPolarHBondContact OE2-CG1 3.18Å; E912-V1054 WeakPolarHBondContact OE2-CG2 3.42Å
913	C	64.9	Low	77.1	Confident	29 Å²	29	84.4 Å²	84.4	20%	0.196	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-8.4	-179.5	57	0	0	0	0	114.7	T893 R897 W911	T893-C913 HydrophobicContact CG2-CB 3.42Å; T893-C913 VanDerWaalsContact CG2-CB 3.42Å; R897-C913 HydrophobicContact CG-CB 4.44Å; W911-C913 PolarHBondContact O-N 2.98Å
914	V	73.5	Confident	77.3	Confident	2 Å²	2	81.4 Å²	81.4	1%	0.012	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.2	-11.6	-172.3	173.2	0	0	0	0	112.4	S900 W908 W911 E912 G916 L917 I922	S900-V914 WeakPolarHBondContact OG-CG2 3.42Å; W908-V914 HydrophobicContact CB-CG1 3.95Å; W908-V914 HydrophobicContact CD2-CG1 3.43Å; W908-V914 VanDerWaalsContact CD2-CG1 3.43Å; W908-V914 HydrophobicContact CE3-CG1 3.04Å; W908-V914 HydrophobicContact CG-CG1 3.86Å; W908-V914 HydrophobicContact CH2-CG1 4.33Å; W908-V914 HydrophobicContact CZ3-CG1 3.54Å; W911-V914 HydrophobicContact CB-CB 4.44Å; W911-V914 PolarHBondContact O-N 3.06Å; W911-V914 VanDerWaalsContact O-N 3.12Å; E912-V914 PolarHBondContact O-N 3.2Å; V914-G916 PolarHBondContact O-N 2.9Å; V914-L917 PolarHBondContact O-N 3.3Å; V914-I922 HydrophobicContact CB-CD1 4.26Å; V914-I922 HydrophobicContact CG1-CD1 3.7Å; V914-I922 HydrophobicContact CG2-CD1 4.25Å
915	R	70.1	Confident	77.6	Confident	123 Å²	123	71.3 Å²	71.3	46%	0.464	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	128.2	-177	-168.2	179.8	-68.1	165.9	-0.3	111.4	E909 W911 L917	E909-R915 PolarHBondContact O-NE 3.35Å; E909-R915 PolarHBondContact O-NH2 2.78Å; W911-R915 PolarHBondContact O-N 3.11Å; R915-L917 PolarHBondContact O-N 3.29Å
916	G	69	Low	78	Confident	75 Å²	75	63.1 Å²	63.1	77%	0.773	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.7	1.2	177.5	0	0	0	0	0	115.7	V914	V914-G916 PolarHBondContact O-N 2.9Å
917	L	74.7	Confident	78.6	Confident	13 Å²	13	59.1 Å²	59.1	7%	0.068	30%	0.301	C	S	.	.			trans	-100	137.3	-174.4	-74.9	164	0	0	0	112.3	V914 R915 S919 I922 Y979 Q982 L983	V914-L917 PolarHBondContact O-N 3.3Å; R915-L917 PolarHBondContact O-N 3.29Å; L917-S919 PolarHBondContact O-N 3.03Å; L917-I922 HydrophobicContact CB-CD1 3.62Å; L917-I922 HydrophobicContact CB-CG1 3.98Å; L917-I922 HydrophobicContact CD1-CG1 4.46Å; L917-Y979 HydrophobicContact CD2-CD1 3.57Å; L917-Y979 HydrophobicContact CD2-CE1 4.49Å; L917-Y979 HydrophobicContact CD2-CG 3.97Å; L917-Q982 HydrophobicContact CD2-CB 4.12Å; L917-Q982 VanDerWaalsContact CD2-OE1 3.28Å; L917-L983 HydrophobicContact CD1-CD2 3.82Å; L917-L983 HydrophobicContact CD1-CG 4.28Å; L917-L983 HydrophobicContact CD2-CG 4.37Å
918	P	82.3	Confident	79.2	Confident	34 Å²	34	56.8 Å²	56.8	22%	0.221	29%	0.291	C	S	.	.			trans	-65.3	133.2	173.4	25	-33.8	0	0	0	112	R920 H921 I922 Y979	P918-R920 VanDerWaalsContact C-N 3.32Å; P918-R920 PolarHBondContact O-N 3.47Å; P918-H921 WeakPolarHBondContact CB-ND1 3.47Å; P918-H921 HydrophobicContact CG-CB 4.2Å; P918-H921 WeakPolarHBondContact CG-ND1 3.32Å; P918-H921 PolarHBondContact O-N 3.48Å; P918-H921 VanDerWaalsContact O-N 3.17Å; P918-I922 PolarHBondContact O-N 3.23Å; P918-Y979 HydrophobicContact CG-CD1 4.38Å; P918-Y979 HydrophobicContact CG-CD2 3.85Å; P918-Y979 HydrophobicContact CG-CE1 4.03Å; P918-Y979 HydrophobicContact CG-CE2 3.47Å; P918-Y979 VanDerWaalsContact CG-CE2 3.47Å; P918-Y979 HydrophobicContact CG-CG 4.28Å
919	S	84.1	Confident	79.9	Confident	42 Å²	42	55.6 Å²	55.6	29%	0.294	29%	0.287	S	S	.	.	H	α-helix	trans	-56.3	-40.1	-173.7	57.9	0	0	0	0	114.4	W908 L917 H921 I922 L923	W908-S919 VanDerWaalsContact CH2-CB 3.41Å; L917-S919 PolarHBondContact O-N 3.03Å; S919-H921 VanDerWaalsContact C-N 3.31Å; S919-H921 PolarHBondContact O-N 3.36Å; S919-I922 PolarHBondContact O-N 3.42Å; S919-L923 PolarHBondContact O-N 2.88Å
920	R	87.5	Confident	81.3	Confident	190 Å²	190	50.7 Å²	50.7	72%	0.717	27%	0.269	S	S	*	.	H	α-helix	trans	-60.3	-40.1	-178.7	-63.5	-177.2	-178.8	171.3	0.4	112.1	P918 L923 V924 W975	P918-R920 VanDerWaalsContact C-N 3.32Å; P918-R920 PolarHBondContact O-N 3.47Å; R920-L923 PolarHBondContact O-N 3.4Å; R920-V924 WeakPolarHBondContact O-CG2 3.36Å; R920-V924 PolarHBondContact O-N 3.14Å; R920-W975 HydrophobicContact CB-CH2 4.06Å; R920-W975 HydrophobicContact CB-CZ2 4Å
921	H	88	Confident	82.7	Confident	19 Å²	19	48.3 Å²	48.3	9%	0.088	26%	0.263	C	S	.	.	H	α-helix	trans	-72.7	-39.1	-177.1	-59.8	76.3	0	0	0	111.1	P918 S919 L923 F925 W975 L976 Y979	P918-H921 WeakPolarHBondContact CB-ND1 3.47Å; P918-H921 HydrophobicContact CG-CB 4.2Å; P918-H921 WeakPolarHBondContact CG-ND1 3.32Å; P918-H921 PolarHBondContact O-N 3.48Å; P918-H921 VanDerWaalsContact O-N 3.17Å; S919-H921 VanDerWaalsContact C-N 3.31Å; S919-H921 PolarHBondContact O-N 3.36Å; H921-L923 VanDerWaalsContact C-N 3.34Å; H921-F925 WeakPolarHBondContact O-CB 3.46Å; H921-F925 PolarHBondContact O-N 3.43Å; H921-W975 HydrophobicContact CB-CH2 4.39Å; H921-W975 AromaticContact CD2-CD2 3.75Å; H921-W975 AromaticContact CD2-CE2 3.67Å; H921-W975 AromaticContact CD2-CE3 3.8Å; H921-W975 AromaticContact CD2-CH2 3.77Å; H921-W975 AromaticContact CD2-CZ2 3.7Å; H921-W975 AromaticContact CD2-CZ3 3.81Å; H921-W975 PolarHBondContact CD2-O 3.08Å; H921-W975 VanDerWaalsContact CD2-O 3.26Å; H921-W975 AromaticContact CE1-CE2 3.57Å; H921-W975 AromaticContact CE1-CZ2 3.49Å; H921-W975 VanDerWaalsContact CE1-CZ2 3.49Å; H921-W975 WeakPolarHBondContact CE1-CZ2 3.47Å; H921-W975 AromaticContact CE1-NE1 3.73Å; H921-W975 AromaticContact CG-CH2 3.8Å; H921-W975 AromaticContact CG-CZ2 3.87Å; H921-W975 AromaticContact ND1-CZ2 3.71Å; H921-W975 AromaticContact NE2-CD1 3.86Å; H921-W975 AromaticContact NE2-CD2 3.54Å; H921-W975 AromaticContact NE2-CE2 3.17Å; H921-W975 AromaticContact NE2-CG 3.98Å; H921-W975 AromaticContact NE2-CZ2 3.47Å; H921-W975 WeakPolarHBondContact NE2-CZ2 3.49Å; H921-W975 AromaticContact NE2-NE1 3.39Å; H921-W975 PolarHBondContact NE2-NE1 2.73Å; H921-W975 PolarHBondContact NE2-O 3.19Å; H921-L976 HydrophobicContact CB-CD1 4.27Å; H921-Y979 HydrophobicContact CB-CD2 4.49Å; H921-Y979 AromaticContact CD2-CD2 3.63Å; H921-Y979 AromaticContact CE1-CE2 3.93Å; H921-Y979 AromaticContact CG-CD2 3.94Å; H921-Y979 AromaticContact NE2-CD2 3.79Å; H921-Y979 AromaticContact NE2-CE2 3.82Å
922	I	86.7	Confident	84.2	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.2	-43.9	173.8	-62.8	158	0	0	0	110.7	R897 L901 W908 V914 L917 P918 S919 S926 L983	R897-I922 HydrophobicContact CB-CG2 4.37Å; R897-I922 HydrophobicContact CG-CG2 4.31Å; L901-I922 HydrophobicContact CD1-CG2 4.24Å; L901-I922 HydrophobicContact CD2-CB 4.49Å; L901-I922 HydrophobicContact CD2-CG2 4.14Å; L901-I922 HydrophobicContact CG-CG2 4.27Å; W908-I922 HydrophobicContact CH2-CD1 4.36Å; W908-I922 HydrophobicContact CZ3-CD1 3.81Å; V914-I922 HydrophobicContact CB-CD1 4.26Å; V914-I922 HydrophobicContact CG1-CD1 3.7Å; V914-I922 HydrophobicContact CG2-CD1 4.25Å; L917-I922 HydrophobicContact CB-CD1 3.62Å; L917-I922 HydrophobicContact CB-CG1 3.98Å; L917-I922 HydrophobicContact CD1-CG1 4.46Å; P918-I922 PolarHBondContact O-N 3.23Å; S919-I922 PolarHBondContact O-N 3.42Å; I922-S926 VanDerWaalsContact O-CB 3.29Å; I922-S926 WeakPolarHBondContact O-CB 3.25Å; I922-S926 PolarHBondContact O-N 3.02Å; I922-S926 PolarHBondContact O-OG 3.35Å; I922-L983 HydrophobicContact CG1-CD2 3.96Å
923	L	89.9	Confident	85.6	Confident	79 Å²	79	43 Å²	43	41%	0.414	24%	0.243	S	C	.	.	H	α-helix	trans	-60.9	-52.9	178.4	179.4	66.5	0	0	0	111	L901 S919 R920 H921 F925 S926 L927	L901-L923 HydrophobicContact CD1-CB 4.34Å; L901-L923 HydrophobicContact CD1-CD1 3.88Å; L901-L923 HydrophobicContact CD2-CB 4.22Å; S919-L923 PolarHBondContact O-N 2.88Å; R920-L923 PolarHBondContact O-N 3.4Å; H921-L923 VanDerWaalsContact C-N 3.34Å; L923-F925 VanDerWaalsContact C-N 3.34Å; L923-F925 PolarHBondContact O-N 2.89Å; L923-S926 PolarHBondContact O-N 2.98Å; L923-L927 HydrophobicContact CD1-CD1 4.01Å; L923-L927 HydrophobicContact CD1-CG 4.08Å; L923-L927 HydrophobicContact CG-CD1 3.87Å; L923-L927 HydrophobicContact CG-CG 4.31Å; L923-L927 WeakPolarHBondContact O-CB 3.37Å; L923-L927 VanDerWaalsContact O-CG 3.29Å; L923-L927 WeakPolarHBondContact O-CG 3.31Å; L923-L927 PolarHBondContact O-N 2.86Å
924	V	91.5	Very high	87	Confident	41 Å²	41	47 Å²	47	25%	0.248	26%	0.262	C	S	.	.	H	α-helix	trans	-58.4	-46.6	-179.8	171.3	0	0	0	0	111	R920 S926 L927 I928 W973 W975	R920-V924 WeakPolarHBondContact O-CG2 3.36Å; R920-V924 PolarHBondContact O-N 3.14Å; V924-S926 PolarHBondContact O-N 3.13Å; V924-L927 PolarHBondContact O-N 3.36Å; V924-I928 HydrophobicContact CG1-CD1 4Å; V924-I928 VanDerWaalsContact O-CG1 3.31Å; V924-I928 WeakPolarHBondContact O-CG1 3.38Å; V924-I928 PolarHBondContact O-N 3.08Å; V924-W973 HydrophobicContact CG1-CH2 4.17Å; V924-W973 HydrophobicContact CG1-CZ3 4.35Å; V924-W975 HydrophobicContact CB-CH2 4.44Å; V924-W975 HydrophobicContact CB-CZ3 4.08Å; V924-W975 HydrophobicContact CG1-CZ3 4.24Å; V924-W975 HydrophobicContact CG2-CH2 3.93Å; V924-W975 HydrophobicContact CG2-CZ3 3.9Å
925	F	90.9	Very high	88	Confident	1 Å²	1	51.1 Å²	51.1	0%	0.004	28%	0.283	C	S	.	.	H	α-helix	trans	-62.1	-43.6	178.5	-172.4	-90.1	0	0	0	112.5	H921 L923 I928 Q929 L970 L976 L980 L983 D984	H921-F925 WeakPolarHBondContact O-CB 3.46Å; H921-F925 PolarHBondContact O-N 3.43Å; L923-F925 VanDerWaalsContact C-N 3.34Å; L923-F925 PolarHBondContact O-N 2.89Å; F925-I928 PolarHBondContact O-N 2.92Å; F925-Q929 HydrophobicContact CD1-CG 4.42Å; F925-Q929 VanDerWaalsContact CE1-CD 3.43Å; F925-Q929 HydrophobicContact CE1-CG 4.04Å; F925-Q929 PolarHBondContact O-N 3.43Å; F925-Q929 VanDerWaalsContact O-N 3.15Å; F925-L970 HydrophobicContact CE2-CD1 4.24Å; F925-L976 HydrophobicContact CD2-CD2 4.4Å; F925-L980 HydrophobicContact CD2-CD1 4.13Å; F925-L980 HydrophobicContact CE2-CD1 3.79Å; F925-L983 HydrophobicContact CB-CD1 4.31Å; F925-L983 HydrophobicContact CG-CD1 4.44Å; F925-D984 HydrophobicContact CZ-CB 4.24Å
926	S	90.7	Very high	89	Confident	3 Å²	3	45.3 Å²	45.3	2%	0.021	26%	0.261	C	S	.	.	H	α-helix	trans	-68.4	-35.5	179.2	-53.7	0	0	0	0	111.7	F894 I922 L923 V924 Q929 A930	F894-S926 WeakPolarHBondContact CE2-O 3.34Å; I922-S926 VanDerWaalsContact O-CB 3.29Å; I922-S926 WeakPolarHBondContact O-CB 3.25Å; I922-S926 PolarHBondContact O-N 3.02Å; I922-S926 PolarHBondContact O-OG 3.35Å; L923-S926 PolarHBondContact O-N 2.98Å; V924-S926 PolarHBondContact O-N 3.13Å; S926-Q929 PolarHBondContact O-N 3.34Å; S926-A930 WeakPolarHBondContact O-CB 3.33Å; S926-A930 PolarHBondContact O-N 2.92Å
927	L	92.7	Very high	90.1	Very high	104 Å²	104	42.6 Å²	42.6	55%	0.545	23%	0.229	S	C	.	.	H	α-helix	trans	-66.4	-40.3	175.1	-74.3	175.5	0	0	0	112	L923 V924 Q929 A930 A931	L923-L927 HydrophobicContact CD1-CD1 4.01Å; L923-L927 HydrophobicContact CD1-CG 4.08Å; L923-L927 HydrophobicContact CG-CD1 3.87Å; L923-L927 HydrophobicContact CG-CG 4.31Å; L923-L927 WeakPolarHBondContact O-CB 3.37Å; L923-L927 VanDerWaalsContact O-CG 3.29Å; L923-L927 WeakPolarHBondContact O-CG 3.31Å; L923-L927 PolarHBondContact O-N 2.86Å; V924-L927 PolarHBondContact O-N 3.36Å; L927-Q929 VanDerWaalsContact C-N 3.34Å; L927-Q929 PolarHBondContact O-N 2.91Å; L927-A930 PolarHBondContact O-N 3.19Å; L927-A931 WeakPolarHBondContact O-CB 3.45Å; L927-A931 PolarHBondContact O-N 2.96Å
928	I	92.4	Very high	90.9	Very high	43 Å²	43	44.4 Å²	44.4	22%	0.221	24%	0.243	C	C	.	.	H	α-helix	trans	-59.9	-46.3	174.2	-67.4	164.8	0	0	0	110.2	V924 F925 A931 V932 Y962 L970 W973	V924-I928 HydrophobicContact CG1-CD1 4Å; V924-I928 VanDerWaalsContact O-CG1 3.31Å; V924-I928 WeakPolarHBondContact O-CG1 3.38Å; V924-I928 PolarHBondContact O-N 3.08Å; F925-I928 PolarHBondContact O-N 2.92Å; I928-A931 PolarHBondContact O-N 3.44Å; I928-V932 WeakPolarHBondContact O-CG2 3.36Å; I928-V932 PolarHBondContact O-N 2.69Å; I928-Y962 HydrophobicContact CG2-CE2 4.15Å; I928-L970 HydrophobicContact CD1-CD2 4.25Å; I928-W973 HydrophobicContact CD1-CZ3 4.26Å
929	Q	93	Very high	91.2	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62	-44.6	176	-73	-174.3	-57	0	0	112.2	S611 V615 F894 F925 S926 L927 A931 V932 V933 Y962	S611-Q929 PolarHBondContact O-NE2 3.19Å; V615-Q929 HydrophobicContact CG2-CB 4.1Å; V615-Q929 HydrophobicContact CG2-CG 4.04Å; F894-Q929 HydrophobicContact CD2-CB 3.51Å; F894-Q929 HydrophobicContact CD2-CG 4.33Å; F894-Q929 HydrophobicContact CE2-CB 3.47Å; F894-Q929 VanDerWaalsContact CE2-CB 3.47Å; F894-Q929 HydrophobicContact CG-CB 4.44Å; F894-Q929 HydrophobicContact CZ-CB 4.4Å; F925-Q929 HydrophobicContact CD1-CG 4.42Å; F925-Q929 VanDerWaalsContact CE1-CD 3.43Å; F925-Q929 HydrophobicContact CE1-CG 4.04Å; F925-Q929 PolarHBondContact O-N 3.43Å; F925-Q929 VanDerWaalsContact O-N 3.15Å; S926-Q929 PolarHBondContact O-N 3.34Å; L927-Q929 VanDerWaalsContact C-N 3.34Å; L927-Q929 PolarHBondContact O-N 2.91Å; Q929-A931 VanDerWaalsContact C-N 3.34Å; Q929-A931 PolarHBondContact O-N 2.8Å; Q929-V932 PolarHBondContact O-N 3.32Å; Q929-V933 WeakPolarHBondContact O-CG2 3.38Å; Q929-V933 PolarHBondContact O-N 3.3Å; Q929-Y962 WeakPolarHBondContact CG-OH 3.3Å
930	A	93.4	Very high	91.2	Very high	31 Å²	31	42.5 Å²	42.5	26%	0.256	23%	0.227	S	C	.	.	H	α-helix	trans	-62.6	-39.7	179.1	0	0	0	0	0	112.3	F894 S926 L927 V932 V933 L934	F894-A930 HydrophobicContact CE2-CB 4.01Å; F894-A930 HydrophobicContact CZ-CB 3.86Å; S926-A930 WeakPolarHBondContact O-CB 3.33Å; S926-A930 PolarHBondContact O-N 2.92Å; L927-A930 PolarHBondContact O-N 3.19Å; A930-V932 PolarHBondContact O-N 2.87Å; A930-V933 PolarHBondContact O-N 3.17Å; A930-L934 WeakPolarHBondContact O-CB 3.43Å; A930-L934 PolarHBondContact O-N 3.45Å
931	A	94.8	Very high	91.2	Very high	48 Å²	48	36.3 Å²	36.3	40%	0.397	21%	0.208	S	C	.	.	H	α-helix	trans	-61.1	-43.8	175.8	0	0	0	0	0	111.7	L927 I928 Q929 L934 I935	L927-A931 WeakPolarHBondContact O-CB 3.45Å; L927-A931 PolarHBondContact O-N 2.96Å; I928-A931 PolarHBondContact O-N 3.44Å; Q929-A931 VanDerWaalsContact C-N 3.34Å; Q929-A931 PolarHBondContact O-N 2.8Å; A931-L934 PolarHBondContact O-N 3.49Å; A931-I935 VanDerWaalsContact O-CG1 3.31Å; A931-I935 WeakPolarHBondContact O-CG1 3.39Å; A931-I935 PolarHBondContact O-N 3.41Å
932	V	94.1	Very high	91.2	Very high	20 Å²	20	38.9 Å²	38.9	12%	0.121	22%	0.222	C	C	.	.	H	α-helix	trans	-66.1	-43.3	177.6	177.9	0	0	0	0	111.4	V615 I928 Q929 A930 L934 I935 L936 V958 Y962	V615-V932 HydrophobicContact CG1-CB 4.39Å; V615-V932 HydrophobicContact CG1-CG1 3.76Å; I928-V932 WeakPolarHBondContact O-CG2 3.36Å; I928-V932 PolarHBondContact O-N 2.69Å; Q929-V932 PolarHBondContact O-N 3.32Å; A930-V932 PolarHBondContact O-N 2.87Å; V932-L934 VanDerWaalsContact C-N 3.31Å; V932-L934 PolarHBondContact O-N 3.27Å; V932-I935 PolarHBondContact O-N 2.87Å; V932-L936 HydrophobicContact CG1-CD1 4.15Å; V932-L936 WeakPolarHBondContact O-CG 3.2Å; V932-L936 PolarHBondContact O-N 2.84Å; V932-V958 HydrophobicContact CG1-CG1 4.39Å; V932-Y962 HydrophobicContact CB-CD2 4.44Å; V932-Y962 HydrophobicContact CG1-CD2 4.41Å; V932-Y962 HydrophobicContact CG1-CG 4.13Å; V932-Y962 HydrophobicContact CG2-CD2 3.64Å; V932-Y962 HydrophobicContact CG2-CE2 4.15Å; V932-Y962 HydrophobicContact CG2-CG 4.19Å
933	V	93.4	Very high	91	Very high	7 Å²	7	39.3 Å²	39.3	4%	0.042	22%	0.224	C	C	.	.	H	α-helix	trans	-60.9	-41.9	174.9	174	0	0	0	0	110.9	V615 F622 F894 Q929 A930 I935 L936 V937	V615-V933 HydrophobicContact CB-CG2 4.37Å; V615-V933 HydrophobicContact CG1-CG2 3.96Å; V615-V933 HydrophobicContact CG2-CG2 4.33Å; F622-V933 HydrophobicContact CD2-CG1 3.76Å; F622-V933 HydrophobicContact CE2-CG1 3.79Å; F894-V933 HydrophobicContact CE1-CG2 4.26Å; F894-V933 HydrophobicContact CZ-CG2 4.5Å; Q929-V933 WeakPolarHBondContact O-CG2 3.38Å; Q929-V933 PolarHBondContact O-N 3.3Å; A930-V933 PolarHBondContact O-N 3.17Å; V933-I935 PolarHBondContact O-N 2.83Å; V933-L936 PolarHBondContact O-N 3.2Å; V933-V937 HydrophobicContact CG1-CG2 4.19Å; V933-V937 WeakPolarHBondContact O-CB 3.32Å; V933-V937 VanDerWaalsContact O-CG2 3.29Å; V933-V937 WeakPolarHBondContact O-CG2 3.39Å; V933-V937 PolarHBondContact O-N 2.98Å
934	L	94.3	Very high	90.4	Very high	113 Å²	113	38.1 Å²	38.1	59%	0.592	22%	0.219	S	C	*	.	H	α-helix	trans	-61.1	-43.9	177.1	-178.2	65.9	0	0	0	111.5	A930 A931 V932 V937 S938	A930-L934 WeakPolarHBondContact O-CB 3.43Å; A930-L934 PolarHBondContact O-N 3.45Å; A931-L934 PolarHBondContact O-N 3.49Å; V932-L934 VanDerWaalsContact C-N 3.31Å; V932-L934 PolarHBondContact O-N 3.27Å; L934-V937 PolarHBondContact O-N 2.97Å; L934-S938 WeakPolarHBondContact O-CB 3.41Å; L934-S938 PolarHBondContact O-N 3.11Å; L934-S938 PolarHBondContact O-OG 3Å
935	I	93.9	Very high	89.9	Confident	88 Å²	88	42.4 Å²	42.4	45%	0.451	23%	0.234	S	C	.	.	H	α-helix	trans	-59.4	-49.2	175.7	-68.4	163.7	0	0	0	110.2	A931 V932 V933 V937 S938 L939 V958	A931-I935 VanDerWaalsContact O-CG1 3.31Å; A931-I935 WeakPolarHBondContact O-CG1 3.39Å; A931-I935 PolarHBondContact O-N 3.41Å; V932-I935 PolarHBondContact O-N 2.87Å; V933-I935 PolarHBondContact O-N 2.83Å; I935-V937 PolarHBondContact O-N 2.95Å; I935-S938 PolarHBondContact O-N 3.29Å; I935-L939 HydrophobicContact CG2-CD1 4.22Å; I935-L939 WeakPolarHBondContact O-CG 3.18Å; I935-L939 PolarHBondContact O-N 3.4Å; I935-V958 HydrophobicContact CG2-CG1 4.23Å
936	L	92.2	Very high	89.3	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.9	-43.3	179.1	-67.8	168.5	0	0	0	112.3	V615 F619 V932 V933 L939 N940 F955 V958 I959	V615-L936 HydrophobicContact CG1-CD1 3.86Å; F619-L936 HydrophobicContact CB-CB 4.44Å; F619-L936 HydrophobicContact CB-CD1 4.09Å; F619-L936 HydrophobicContact CD2-CB 3.53Å; F619-L936 HydrophobicContact CE2-CB 3.99Å; F619-L936 WeakPolarHBondContact CE2-O 3.24Å; F619-L936 HydrophobicContact CG-CB 4.12Å; F619-L936 HydrophobicContact CG-CD1 4.33Å; V932-L936 HydrophobicContact CG1-CD1 4.15Å; V932-L936 WeakPolarHBondContact O-CG 3.2Å; V932-L936 PolarHBondContact O-N 2.84Å; V933-L936 PolarHBondContact O-N 3.2Å; L936-L939 PolarHBondContact O-N 2.81Å; L936-N940 PolarHBondContact O-N 3.16Å; L936-N940 VanDerWaalsContact O-N 3.1Å; L936-F955 HydrophobicContact CD2-CB 3.72Å; L936-V958 HydrophobicContact CD2-CB 3.82Å; L936-V958 HydrophobicContact CD2-CG1 3.78Å; L936-V958 HydrophobicContact CG-CG1 4.17Å; L936-I959 HydrophobicContact CD1-CD1 4.27Å; L936-I959 HydrophobicContact CD1-CG1 3.92Å; L936-I959 HydrophobicContact CD2-CD1 4.47Å; L936-I959 HydrophobicContact CD2-CG1 4.01Å
937	V	91.1	Very high	88.3	Confident	19 Å²	19	51.6 Å²	51.6	12%	0.115	29%	0.29	C	S	.	.	H	α-helix	trans	-64.9	-40.8	176.8	169.2	0	0	0	0	111.1	F622 L626 V933 L934 I935 L939 N940 I941	F622-V937 HydrophobicContact CB-CG2 3.69Å; F622-V937 HydrophobicContact CD2-CG2 4Å; F622-V937 HydrophobicContact CG-CG2 3.95Å; L626-V937 HydrophobicContact CD1-CG1 3.65Å; V933-V937 HydrophobicContact CG1-CG2 4.19Å; V933-V937 WeakPolarHBondContact O-CB 3.32Å; V933-V937 VanDerWaalsContact O-CG2 3.29Å; V933-V937 WeakPolarHBondContact O-CG2 3.39Å; V933-V937 PolarHBondContact O-N 2.98Å; L934-V937 PolarHBondContact O-N 2.97Å; I935-V937 PolarHBondContact O-N 2.95Å; V937-L939 PolarHBondContact O-N 3.16Å; V937-N940 WeakPolarHBondContact O-CB 3.48Å; V937-N940 PolarHBondContact O-N 3.45Å; V937-I941 HydrophobicContact CG1-CD1 3.96Å; V937-I941 HydrophobicContact CG1-CG1 4.49Å; V937-I941 WeakPolarHBondContact O-CG1 3.13Å; V937-I941 PolarHBondContact O-N 3.27Å
938	S	91.1	Very high	87.2	Confident	50 Å²	50	47.7 Å²	47.7	35%	0.35	27%	0.272	S	S	.	.	H	α-helix	trans	-62.8	-43.5	177.6	-56.6	0	0	0	0	111.2	L934 I935 N940 I941 I942	L934-S938 WeakPolarHBondContact O-CB 3.41Å; L934-S938 PolarHBondContact O-N 3.11Å; L934-S938 PolarHBondContact O-OG 3Å; I935-S938 PolarHBondContact O-N 3.29Å; S938-N940 VanDerWaalsContact C-N 3.31Å; S938-N940 PolarHBondContact O-N 3.36Å; S938-I941 PolarHBondContact O-N 2.81Å; S938-I942 WeakPolarHBondContact O-CD1 3.49Å; S938-I942 VanDerWaalsContact O-CG1 3.26Å; S938-I942 WeakPolarHBondContact O-CG1 3.47Å; S938-I942 PolarHBondContact O-N 3.49Å
939	L	88.9	Confident	86.2	Confident	31 Å²	31	47.9 Å²	47.9	16%	0.162	27%	0.274	C	S	.	.	H	α-helix	trans	-60.2	-39.9	174.7	-69.9	172.9	0	0	0	112.2	I935 L936 V937 I942 S943 V951 V958	I935-L939 HydrophobicContact CG2-CD1 4.22Å; I935-L939 WeakPolarHBondContact O-CG 3.18Å; I935-L939 PolarHBondContact O-N 3.4Å; L936-L939 PolarHBondContact O-N 2.81Å; V937-L939 PolarHBondContact O-N 3.16Å; L939-I942 PolarHBondContact O-N 3Å; L939-S943 WeakPolarHBondContact O-CB 3.42Å; L939-S943 PolarHBondContact O-N 3.44Å; L939-V951 HydrophobicContact CD2-CG1 3.64Å; L939-V958 HydrophobicContact CD1-CG2 3.93Å
940	N	85.3	Confident	85.4	Confident	6 Å²	6	54.5 Å²	54.5	3%	0.032	30%	0.3	C	S	.	.	H	α-helix	trans	-65.2	-44.5	176.5	-175.8	17	0	0	0	112.1	F619 F623 L936 V937 S938 I942 S943 D944	F619-N940 HydrophobicContact CE2-CB 4.1Å; F623-N940 WeakPolarHBondContact CD2-ND2 3.46Å; L936-N940 PolarHBondContact O-N 3.16Å; L936-N940 VanDerWaalsContact O-N 3.1Å; V937-N940 WeakPolarHBondContact O-CB 3.48Å; V937-N940 PolarHBondContact O-N 3.45Å; S938-N940 VanDerWaalsContact C-N 3.31Å; S938-N940 PolarHBondContact O-N 3.36Å; N940-I942 VanDerWaalsContact C-N 3.35Å; N940-I942 PolarHBondContact O-N 3.03Å; N940-S943 WeakPolarHBondContact O-CB 3.24Å; N940-S943 PolarHBondContact O-N 3.37Å; N940-D944 PolarHBondContact O-N 3.25Å; N940-D944 VanDerWaalsContact O-N 3.11Å
941	I	87.4	Confident	84.8	Confident	60 Å²	60	54.1 Å²	54.1	31%	0.308	29%	0.294	S	S	.	.	H	α-helix	trans	-60.4	-46.6	176.2	-65.3	168.8	0	0	0	110.2	L626 F630 V937 S938 S943 D944 F945	L626-I941 HydrophobicContact CD1-CD1 4.25Å; L626-I941 HydrophobicContact CD1-CG1 4.08Å; F630-I941 HydrophobicContact CE2-CG1 4.22Å; F630-I941 HydrophobicContact CZ-CG1 4.15Å; V937-I941 HydrophobicContact CG1-CD1 3.96Å; V937-I941 HydrophobicContact CG1-CG1 4.49Å; V937-I941 WeakPolarHBondContact O-CG1 3.13Å; V937-I941 PolarHBondContact O-N 3.27Å; S938-I941 PolarHBondContact O-N 2.81Å; I941-S943 VanDerWaalsContact C-N 3.28Å; I941-S943 PolarHBondContact O-N 3.23Å; I941-D944 PolarHBondContact O-N 3.27Å; I941-F945 HydrophobicContact CG2-CD2 3.78Å; I941-F945 HydrophobicContact CG2-CE2 4.1Å; I941-F945 VanDerWaalsContact O-CD2 3.32Å; I941-F945 WeakPolarHBondContact O-CD2 3.14Å; I941-F945 PolarHBondContact O-N 3.08Å; I941-F945 VanDerWaalsContact O-N 3.13Å
942	I	87.4	Confident	83.9	Confident	73 Å²	73	52 Å²	52	37%	0.374	28%	0.277	S	S	.	.	H	α-helix	trans	-59.3	-42.6	177.1	-67.2	164.3	0	0	0	110.7	S938 L939 N940 D944 F945 T946 V951	S938-I942 WeakPolarHBondContact O-CD1 3.49Å; S938-I942 VanDerWaalsContact O-CG1 3.26Å; S938-I942 WeakPolarHBondContact O-CG1 3.47Å; S938-I942 PolarHBondContact O-N 3.49Å; L939-I942 PolarHBondContact O-N 3Å; N940-I942 VanDerWaalsContact C-N 3.35Å; N940-I942 PolarHBondContact O-N 3.03Å; I942-D944 VanDerWaalsContact C-N 3.28Å; I942-D944 PolarHBondContact O-N 3.4Å; I942-F945 PolarHBondContact O-N 3.1Å; I942-T946 HydrophobicContact CG2-CG2 3.94Å; I942-T946 WeakPolarHBondContact O-CB 3.39Å; I942-T946 WeakPolarHBondContact O-CG2 3.36Å; I942-T946 PolarHBondContact O-N 3.46Å; I942-T946 PolarHBondContact O-OG1 2.84Å; I942-V951 HydrophobicContact CG2-CG1 4.29Å; I942-V951 HydrophobicContact CG2-CG2 4.48Å
943	S	81.6	Confident	83.3	Confident	8 Å²	8	52 Å²	52	6%	0.056	28%	0.277	C	S	.	.	H	α-helix	trans	-63.6	-29.4	179.7	-172.8	0	0	0	0	113.8	L939 N940 I941 N949	L939-S943 WeakPolarHBondContact O-CB 3.42Å; L939-S943 PolarHBondContact O-N 3.44Å; N940-S943 WeakPolarHBondContact O-CB 3.24Å; N940-S943 PolarHBondContact O-N 3.37Å; I941-S943 VanDerWaalsContact C-N 3.28Å; I941-S943 PolarHBondContact O-N 3.23Å; S943-N949 PolarHBondContact O-OD1 3.33Å; S943-N949 PolarHBondContact OG-O 3.32Å; S943-N949 VanDerWaalsContact OG-O 3.1Å
944	D	78.8	Confident	82.9	Confident	55 Å²	55	55.4 Å²	55.4	29%	0.294	29%	0.293	S	S	.	.	H	α-helix	trans	-87.5	-30.5	179.7	-95.2	-7.6	0	0	0	112.3	K627 N940 I941 I942	K627-D944 IonicContact NZ-OD1 2.81Å; K627-D944 PolarHBondContact NZ-OD1 3.19Å; K627-D944 IonicContact NZ-OD2 3.43Å; K627-D944 PolarHBondContact NZ-OD2 3.04Å; N940-D944 PolarHBondContact O-N 3.25Å; N940-D944 VanDerWaalsContact O-N 3.11Å; I941-D944 PolarHBondContact O-N 3.27Å; I942-D944 VanDerWaalsContact C-N 3.28Å; I942-D944 PolarHBondContact O-N 3.4Å
945	F	79.5	Confident	82.4	Confident	130 Å²	130	50.4 Å²	50.4	57%	0.57	27%	0.267	S	S	*	.	H	α-helix	trans	-101.2	-19.7	-173.9	-75.4	-74.5	0	0	0	115.6	F630 I941 I942	F630-F945 HydrophobicContact CD1-CE2 4.2Å; F630-F945 AromaticContact CD1-CZ 4Å; F630-F945 HydrophobicContact CD1-CZ 4Å; F630-F945 HydrophobicContact CD2-CE2 4Å; F630-F945 HydrophobicContact CD2-CZ 4.36Å; F630-F945 AromaticContact CE1-CE2 3.92Å; F630-F945 HydrophobicContact CE1-CE2 3.92Å; F630-F945 HydrophobicContact CE1-CZ 4.06Å; F630-F945 AromaticContact CE2-CE2 3.71Å; F630-F945 HydrophobicContact CE2-CE2 3.71Å; F630-F945 HydrophobicContact CE2-CZ 4.41Å; F630-F945 HydrophobicContact CG-CE2 4.25Å; F630-F945 HydrophobicContact CG-CZ 4.17Å; F630-F945 AromaticContact CZ-CE2 3.67Å; F630-F945 HydrophobicContact CZ-CE2 3.67Å; F630-F945 HydrophobicContact CZ-CZ 4.27Å; I941-F945 HydrophobicContact CG2-CD2 3.78Å; I941-F945 HydrophobicContact CG2-CE2 4.1Å; I941-F945 VanDerWaalsContact O-CD2 3.32Å; I941-F945 WeakPolarHBondContact O-CD2 3.14Å; I941-F945 PolarHBondContact O-N 3.08Å; I941-F945 VanDerWaalsContact O-N 3.13Å; I942-F945 PolarHBondContact O-N 3.1Å
946	T	78.7	Confident	81.6	Confident	58 Å²	58	46.3 Å²	46.3	36%	0.356	25%	0.246	S	C	.	.	S	Bend	trans	-101.5	155.5	-179.1	68.2	0	0	0	0	111.2	I942 A948 N949	I942-T946 HydrophobicContact CG2-CG2 3.94Å; I942-T946 WeakPolarHBondContact O-CB 3.39Å; I942-T946 WeakPolarHBondContact O-CG2 3.36Å; I942-T946 PolarHBondContact O-N 3.46Å; I942-T946 PolarHBondContact O-OG1 2.84Å; T946-A948 PolarHBondContact O-N 3.17Å; T946-A948 PolarHBondContact OG1-N 3.3Å; T946-N949 PolarHBondContact O-OD1 3.1Å; T946-N949 VanDerWaalsContact O-OD1 3.06Å
947	V	69.9	Low	81.3	Confident	140 Å²	140	49.9 Å²	49.9	85%	0.848	27%	0.265	S	S	*	.	S	Bend	trans	-60.6	-16.8	171.1	-175.3	0	0	0	0	111.4	N949	V947-N949 PolarHBondContact O-N 3.31Å
948	A	70.5	Confident	81.3	Confident	21 Å²	21	50.3 Å²	50.3	17%	0.174	27%	0.267	C	S	.	.			trans	-81	54.1	177.8	0	0	0	0	0	113	T946 Y950 V951	T946-A948 PolarHBondContact O-N 3.17Å; T946-A948 PolarHBondContact OG1-N 3.3Å; A948-Y950 HydrophobicContact CB-CD1 4.4Å; A948-Y950 HydrophobicContact CB-CE1 3.75Å; A948-Y950 HydrophobicContact CB-CE2 4.36Å; A948-Y950 PolarHBondContact O-N 3.07Å; A948-V951 HydrophobicContact CB-CG2 3.95Å; A948-V951 WeakPolarHBondContact O-CB 3.35Å; A948-V951 WeakPolarHBondContact O-CG2 3.37Å; A948-V951 PolarHBondContact O-N 3.22Å
949	N	70.2	Confident	81.1	Confident	48 Å²	48	48 Å²	48	26%	0.257	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-54.1	-24.2	177.8	-70.4	-11.2	0	0	0	113.4	S566 S943 T946 V947 V951 G952	S566-N949 PolarHBondContact OG-O 3.01Å; S943-N949 PolarHBondContact O-OD1 3.33Å; S943-N949 PolarHBondContact OG-O 3.32Å; S943-N949 VanDerWaalsContact OG-O 3.1Å; T946-N949 PolarHBondContact O-OD1 3.1Å; T946-N949 VanDerWaalsContact O-OD1 3.06Å; V947-N949 PolarHBondContact O-N 3.31Å; N949-V951 PolarHBondContact O-N 2.87Å; N949-G952 PolarHBondContact O-N 3.12Å
950	Y	76.9	Confident	81	Confident	138 Å²	138	49.9 Å²	49.9	54%	0.541	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-69	-14.8	178.6	58.3	-95.9	0	0	0	114.2	A948 G952 L953	A948-Y950 HydrophobicContact CB-CD1 4.4Å; A948-Y950 HydrophobicContact CB-CE1 3.75Å; A948-Y950 HydrophobicContact CB-CE2 4.36Å; A948-Y950 PolarHBondContact O-N 3.07Å; Y950-G952 PolarHBondContact O-N 2.92Å; Y950-L953 WeakPolarHBondContact O-CB 3Å; Y950-L953 PolarHBondContact O-N 2.89Å
951	V	80.6	Confident	81.2	Confident	23 Å²	23	53.7 Å²	53.7	14%	0.139	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-59.6	-30	174.8	174.3	0	0	0	0	110.9	L939 I942 A948 N949 L953 I954	L939-V951 HydrophobicContact CD2-CG1 3.64Å; I942-V951 HydrophobicContact CG2-CG1 4.29Å; I942-V951 HydrophobicContact CG2-CG2 4.48Å; A948-V951 HydrophobicContact CB-CG2 3.95Å; A948-V951 WeakPolarHBondContact O-CB 3.35Å; A948-V951 WeakPolarHBondContact O-CG2 3.37Å; A948-V951 PolarHBondContact O-N 3.22Å; N949-V951 PolarHBondContact O-N 2.87Å; V951-L953 PolarHBondContact O-N 3.29Å; V951-L953 VanDerWaalsContact O-N 3.1Å; V951-I954 WeakPolarHBondContact O-CB 3.39Å; V951-I954 PolarHBondContact O-N 2.85Å; V951-I954 VanDerWaalsContact O-N 3.09Å
952	G	75.6	Confident	81.4	Confident	3 Å²	3	51 Å²	51	3%	0.031	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-60.6	-13.4	172.7	0	0	0	0	0	114.5	N949 Y950 I954 F955	N949-G952 PolarHBondContact O-N 3.12Å; Y950-G952 PolarHBondContact O-N 2.92Å; G952-I954 VanDerWaalsContact C-N 3.29Å; G952-I954 PolarHBondContact O-N 2.89Å; G952-F955 WeakPolarHBondContact O-CD1 3.49Å; G952-F955 WeakPolarHBondContact O-CE1 3.21Å
953	L	81.1	Confident	81.3	Confident	22 Å²	22	48.5 Å²	48.5	12%	0.115	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-79	-11.7	174.9	-62.1	175.5	0	0	0	113.3	V563 I760 A763 Y950 V951 P956	V563-L953 HydrophobicContact CB-CD2 4.36Å; V563-L953 HydrophobicContact CG2-CD2 3.74Å; I760-L953 HydrophobicContact CG1-CD1 4.3Å; A763-L953 HydrophobicContact CB-CB 4.45Å; Y950-L953 WeakPolarHBondContact O-CB 3Å; Y950-L953 PolarHBondContact O-N 2.89Å; V951-L953 PolarHBondContact O-N 3.29Å; V951-L953 VanDerWaalsContact O-N 3.1Å; L953-P956 VanDerWaalsContact O-CD 3.24Å; L953-P956 WeakPolarHBondContact O-CD 3.35Å
954	I	85.3	Confident	81.6	Confident	77 Å²	77	52.3 Å²	52.3	40%	0.395	28%	0.278	S	S	.	.	S	Bend	trans	-86.7	-24.2	-172.2	-60.8	174.2	0	0	0	112.9	V951 G952 P956 I957 V958	V951-I954 WeakPolarHBondContact O-CB 3.39Å; V951-I954 PolarHBondContact O-N 2.85Å; V951-I954 VanDerWaalsContact O-N 3.09Å; G952-I954 VanDerWaalsContact C-N 3.29Å; G952-I954 PolarHBondContact O-N 2.89Å; I954-P956 VanDerWaalsContact C-N 3.32Å; I954-P956 WeakPolarHBondContact O-CD 3.46Å; I954-P956 VanDerWaalsContact O-N 3.12Å; I954-I957 WeakPolarHBondContact O-CB 3.48Å; I954-I957 PolarHBondContact O-N 2.91Å; I954-V958 HydrophobicContact CG2-CG2 4.22Å; I954-V958 PolarHBondContact O-N 2.53Å
955	F	83.9	Confident	82	Confident	8 Å²	8	53.3 Å²	53.3	4%	0.035	28%	0.282	C	S	.	.	H	α-helix	trans	-52.5	-35.3	-175.8	81.3	-101.4	0	0	0	115.6	P559 I562 F619 I767 L936 G952 I957 V958 I959	P559-F955 HydrophobicContact CB-CE1 4.29Å; P559-F955 HydrophobicContact CB-CE2 4.27Å; P559-F955 HydrophobicContact CB-CZ 3.51Å; P559-F955 HydrophobicContact CG-CE1 4.34Å; P559-F955 HydrophobicContact CG-CE2 3.78Å; P559-F955 HydrophobicContact CG-CZ 3.46Å; P559-F955 VanDerWaalsContact CG-CZ 3.46Å; I562-F955 HydrophobicContact CD1-CD1 4.31Å; I562-F955 HydrophobicContact CD1-CE1 4.11Å; F619-F955 AromaticContact CE1-CD2 3.9Å; F619-F955 HydrophobicContact CE1-CD2 3.9Å; F619-F955 HydrophobicContact CE1-CE2 4.33Å; F619-F955 HydrophobicContact CE1-CG 4.1Å; F619-F955 HydrophobicContact CZ-CB 4.39Å; F619-F955 HydrophobicContact CZ-CD1 4.39Å; F619-F955 HydrophobicContact CZ-CD2 4.38Å; F619-F955 HydrophobicContact CZ-CG 4.11Å; I767-F955 HydrophobicContact CD1-CZ 4.42Å; I767-F955 HydrophobicContact CG1-CZ 4.22Å; I767-F955 HydrophobicContact CG2-CZ 4.41Å; L936-F955 HydrophobicContact CD2-CB 3.72Å; G952-F955 WeakPolarHBondContact O-CD1 3.49Å; G952-F955 WeakPolarHBondContact O-CE1 3.21Å; F955-I957 VanDerWaalsContact C-N 3.31Å; F955-I957 PolarHBondContact O-N 2.72Å; F955-V958 WeakPolarHBondContact O-CB 3.36Å; F955-V958 PolarHBondContact O-N 2.65Å; F955-I959 HydrophobicContact CD2-CD1 4.24Å; F955-I959 WeakPolarHBondContact O-CG1 3.37Å; F955-I959 PolarHBondContact O-N 3.24Å; F955-I959 VanDerWaalsContact O-N 3.1Å
956	P	78.5	Confident	82.4	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.013	26%	0.256	C	S	.	.	H	α-helix	trans	-67.6	-35.1	179.9	-13.9	28	0	0	0	111.8	I766 I767 L953 I954 V958 I959 L960	I766-P956 HydrophobicContact CG2-CB 4.19Å; I767-P956 HydrophobicContact CB-CG 4.27Å; I767-P956 HydrophobicContact CD1-CG 3.94Å; I767-P956 HydrophobicContact CG1-CB 3.92Å; I767-P956 HydrophobicContact CG1-CG 3.13Å; L953-P956 VanDerWaalsContact O-CD 3.24Å; L953-P956 WeakPolarHBondContact O-CD 3.35Å; I954-P956 VanDerWaalsContact C-N 3.32Å; I954-P956 WeakPolarHBondContact O-CD 3.46Å; I954-P956 VanDerWaalsContact O-N 3.12Å; P956-V958 VanDerWaalsContact C-N 3.31Å; P956-I959 PolarHBondContact O-N 2.78Å; P956-L960 WeakPolarHBondContact O-CB 3.42Å; P956-L960 PolarHBondContact O-N 3.47Å
957	I	85.2	Confident	82.6	Confident	76 Å²	76	46.5 Å²	46.5	39%	0.39	25%	0.248	S	C	.	.	H	α-helix	trans	-65.3	-41.1	176.3	-60.1	172.7	0	0	0	109.1	I954 F955 I959 L960 I961	I954-I957 WeakPolarHBondContact O-CB 3.48Å; I954-I957 PolarHBondContact O-N 2.91Å; F955-I957 VanDerWaalsContact C-N 3.31Å; F955-I957 PolarHBondContact O-N 2.72Å; I957-I959 VanDerWaalsContact C-N 3.31Å; I957-I959 PolarHBondContact O-N 3.36Å; I957-L960 PolarHBondContact O-N 3.47Å; I957-I961 HydrophobicContact CG2-CD1 3.8Å; I957-I961 HydrophobicContact CG2-CG1 4.31Å; I957-I961 WeakPolarHBondContact O-CB 3.5Å; I957-I961 VanDerWaalsContact O-CG1 3.25Å; I957-I961 WeakPolarHBondContact O-CG1 3.16Å; I957-I961 PolarHBondContact O-N 2.82Å
958	V	90.4	Very high	83.3	Confident	28 Å²	28	46 Å²	46	17%	0.17	23%	0.234	C	C	.	.	H	α-helix	trans	-60.5	-42.1	175.6	178.4	0	0	0	0	111.2	V932 I935 L936 L939 I954 F955 P956 I961 Y962	V932-V958 HydrophobicContact CG1-CG1 4.39Å; I935-V958 HydrophobicContact CG2-CG1 4.23Å; L936-V958 HydrophobicContact CD2-CB 3.82Å; L936-V958 HydrophobicContact CD2-CG1 3.78Å; L936-V958 HydrophobicContact CG-CG1 4.17Å; L939-V958 HydrophobicContact CD1-CG2 3.93Å; I954-V958 HydrophobicContact CG2-CG2 4.22Å; I954-V958 PolarHBondContact O-N 2.53Å; F955-V958 WeakPolarHBondContact O-CB 3.36Å; F955-V958 PolarHBondContact O-N 2.65Å; P956-V958 VanDerWaalsContact C-N 3.31Å; V958-I961 PolarHBondContact O-N 3.35Å; V958-Y962 WeakPolarHBondContact O-CB 3.34Å; V958-Y962 PolarHBondContact O-N 3.36Å
959	I	87.9	Confident	84	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-67	-41.1	176.7	-64.6	178.3	0	0	0	111.4	V612 Y616 T770 L936 F955 P956 I957 Y962 G963	V612-I959 HydrophobicContact CG1-CG2 3.79Å; Y616-I959 HydrophobicContact CD2-CD1 3.51Å; Y616-I959 HydrophobicContact CE2-CD1 4.27Å; Y616-I959 HydrophobicContact CG-CD1 4.43Å; T770-I959 HydrophobicContact CG2-CG2 4.1Å; L936-I959 HydrophobicContact CD1-CD1 4.27Å; L936-I959 HydrophobicContact CD1-CG1 3.92Å; L936-I959 HydrophobicContact CD2-CD1 4.47Å; L936-I959 HydrophobicContact CD2-CG1 4.01Å; F955-I959 HydrophobicContact CD2-CD1 4.24Å; F955-I959 WeakPolarHBondContact O-CG1 3.37Å; F955-I959 PolarHBondContact O-N 3.24Å; F955-I959 VanDerWaalsContact O-N 3.1Å; P956-I959 PolarHBondContact O-N 2.78Å; I957-I959 VanDerWaalsContact C-N 3.31Å; I957-I959 PolarHBondContact O-N 3.36Å; I959-Y962 PolarHBondContact O-N 2.87Å; I959-G963 PolarHBondContact O-N 2.64Å
960	L	85.6	Confident	84.8	Confident	70 Å²	70	45.5 Å²	45.5	37%	0.366	24%	0.235	S	C	.	.	H	α-helix	trans	-62.5	-46.8	176.3	-174.2	71.4	0	0	0	111.2	P956 I957 Y962 G963 L964	P956-L960 WeakPolarHBondContact O-CB 3.42Å; P956-L960 PolarHBondContact O-N 3.47Å; I957-L960 PolarHBondContact O-N 3.47Å; L960-Y962 VanDerWaalsContact C-N 3.31Å; L960-Y962 PolarHBondContact O-N 3.46Å; L960-G963 WeakPolarHBondContact O-CA 3.19Å; L960-G963 PolarHBondContact O-N 3.45Å; L960-G963 VanDerWaalsContact O-N 3.11Å; L960-L964 WeakPolarHBondContact O-CG 3.45Å; L960-L964 PolarHBondContact O-N 3.26Å
961	I	89.7	Confident	85	Confident	86 Å²	86	41.6 Å²	41.6	44%	0.441	23%	0.227	S	C	.	.	H	α-helix	trans	-58.5	-45.2	175.6	-70.6	167.4	0	0	0	110.1	I957 V958 G963 L964 I965	I957-I961 HydrophobicContact CG2-CD1 3.8Å; I957-I961 HydrophobicContact CG2-CG1 4.31Å; I957-I961 WeakPolarHBondContact O-CB 3.5Å; I957-I961 VanDerWaalsContact O-CG1 3.25Å; I957-I961 WeakPolarHBondContact O-CG1 3.16Å; I957-I961 PolarHBondContact O-N 2.82Å; V958-I961 PolarHBondContact O-N 3.35Å; I961-G963 VanDerWaalsContact C-N 3.33Å; I961-G963 PolarHBondContact O-N 2.87Å; I961-L964 PolarHBondContact O-N 3.45Å; I961-I965 HydrophobicContact CG2-CD1 3.7Å; I961-I965 HydrophobicContact CG2-CG1 4.27Å; I961-I965 VanDerWaalsContact O-CG1 3.28Å; I961-I965 WeakPolarHBondContact O-CG1 3.36Å; I961-I965 PolarHBondContact O-N 3.13Å
962	Y	91.4	Very high	85.3	Confident	4 Å²	4	48.4 Å²	48.4	2%	0.016	26%	0.255	C	S	.	.	H	α-helix	trans	-59.5	-43.5	175.1	175.1	-112.3	0	0	0	112.1	V612 V615 I928 Q929 V932 V958 I959 L960 L964 I965 R966	V612-Y962 HydrophobicContact CG2-CD1 4.06Å; V612-Y962 HydrophobicContact CG2-CE1 4.05Å; V615-Y962 HydrophobicContact CB-CD1 4.48Å; V615-Y962 HydrophobicContact CB-CE1 4.23Å; V615-Y962 HydrophobicContact CG2-CD1 4.31Å; V615-Y962 HydrophobicContact CG2-CE1 3.71Å; I928-Y962 HydrophobicContact CG2-CE2 4.15Å; Q929-Y962 WeakPolarHBondContact CG-OH 3.3Å; V932-Y962 HydrophobicContact CB-CD2 4.44Å; V932-Y962 HydrophobicContact CG1-CD2 4.41Å; V932-Y962 HydrophobicContact CG1-CG 4.13Å; V932-Y962 HydrophobicContact CG2-CD2 3.64Å; V932-Y962 HydrophobicContact CG2-CE2 4.15Å; V932-Y962 HydrophobicContact CG2-CG 4.19Å; V958-Y962 WeakPolarHBondContact O-CB 3.34Å; V958-Y962 PolarHBondContact O-N 3.36Å; I959-Y962 PolarHBondContact O-N 2.87Å; L960-Y962 VanDerWaalsContact C-N 3.31Å; L960-Y962 PolarHBondContact O-N 3.46Å; Y962-L964 VanDerWaalsContact C-N 3.33Å; Y962-L964 PolarHBondContact O-N 3.35Å; Y962-I965 PolarHBondContact O-N 3.02Å; Y962-R966 VanDerWaalsContact O-CB 3.23Å; Y962-R966 WeakPolarHBondContact O-CB 3.24Å; Y962-R966 PolarHBondContact O-N 3.36Å
963	G	86.2	Confident	85.8	Confident	20 Å²	20	54.2 Å²	54.2	21%	0.206	28%	0.276	C	S	.	.	H	α-helix	trans	-58.5	-42.4	174.1	0	0	0	0	0	113	I959 L960 I961 R966 E967	I959-G963 PolarHBondContact O-N 2.64Å; L960-G963 WeakPolarHBondContact O-CA 3.19Å; L960-G963 PolarHBondContact O-N 3.45Å; L960-G963 VanDerWaalsContact O-N 3.11Å; I961-G963 VanDerWaalsContact C-N 3.33Å; I961-G963 PolarHBondContact O-N 2.87Å; G963-R966 PolarHBondContact O-N 3.44Å; G963-E967 PolarHBondContact O-N 3.43Å
964	L	86.9	Confident	85.9	Confident	88 Å²	88	61.1 Å²	61.1	46%	0.461	31%	0.307	S	S	.	.	H	α-helix	trans	-67.5	-45.2	176.6	-67.4	173.1	0	0	0	112.3	L960 I961 Y962 R966 E967 F968	L960-L964 WeakPolarHBondContact O-CG 3.45Å; L960-L964 PolarHBondContact O-N 3.26Å; I961-L964 PolarHBondContact O-N 3.45Å; Y962-L964 VanDerWaalsContact C-N 3.33Å; Y962-L964 PolarHBondContact O-N 3.35Å; L964-R966 PolarHBondContact O-N 3Å; L964-E967 PolarHBondContact O-N 3.42Å; L964-F968 HydrophobicContact CB-CD2 4.43Å; L964-F968 HydrophobicContact CD2-CD2 4.18Å; L964-F968 HydrophobicContact CD2-CE2 3.8Å; L964-F968 WeakPolarHBondContact O-CB 3.49Å; L964-F968 WeakPolarHBondContact O-CD2 3.29Å; L964-F968 PolarHBondContact O-N 2.99Å
965	I	88.8	Confident	85.8	Confident	76 Å²	76	62.2 Å²	62.2	39%	0.39	31%	0.307	S	S	.	.	I	π-helix	trans	-57	-43.2	174.4	-70.3	169	0	0	0	109.7	I961 Y962 E967 A969 L970	I961-I965 HydrophobicContact CG2-CD1 3.7Å; I961-I965 HydrophobicContact CG2-CG1 4.27Å; I961-I965 VanDerWaalsContact O-CG1 3.28Å; I961-I965 WeakPolarHBondContact O-CG1 3.36Å; I961-I965 PolarHBondContact O-N 3.13Å; Y962-I965 PolarHBondContact O-N 3.02Å; I965-E967 VanDerWaalsContact C-N 3.35Å; I965-E967 PolarHBondContact O-N 3.24Å; I965-A969 HydrophobicContact CG2-CB 4.09Å; I965-A969 WeakPolarHBondContact O-CA 3.46Å; I965-A969 VanDerWaalsContact O-CB 3.29Å; I965-A969 WeakPolarHBondContact O-CB 3Å; I965-A969 PolarHBondContact O-N 3.32Å; I965-L970 PolarHBondContact O-N 2.95Å
966	R	86.8	Confident	85.7	Confident	4 Å²	4	61.9 Å²	61.9	2%	0.015	31%	0.305	C	S	.	.	I	π-helix	trans	-66.5	-33.1	-179.6	-179.4	-93.7	174.1	-120.8	-7.2	113.3	R609 Y962 G963 L964 L970 P971 D984	R609-R966 VanDerWaalsContact CB-CZ 3.43Å; R609-R966 VanDerWaalsContact CD-NH2 3.3Å; R609-R966 VanDerWaalsContact CG-NH1 3.31Å; Y962-R966 VanDerWaalsContact O-CB 3.23Å; Y962-R966 WeakPolarHBondContact O-CB 3.24Å; Y962-R966 PolarHBondContact O-N 3.36Å; G963-R966 PolarHBondContact O-N 3.44Å; L964-R966 PolarHBondContact O-N 3Å; R966-L970 HydrophobicContact CB-CD1 4.2Å; R966-L970 HydrophobicContact CG-CD1 4.14Å; R966-P971 WeakPolarHBondContact O-CD 3.44Å; R966-D984 IonicContact CZ-OD2 3.33Å; R966-D984 IonicContact NE-OD2 3.39Å; R966-D984 PolarHBondContact NE-OD2 2.84Å; R966-D984 VanDerWaalsContact NH2-CG 3.29Å; R966-D984 PolarHBondContact NH2-O 3.27Å; R966-D984 IonicContact NH2-OD2 3.27Å; R966-D984 PolarHBondContact NH2-OD2 2.89Å
967	E	82.7	Confident	85.6	Confident	41 Å²	41	63.4 Å²	63.4	19%	0.192	32%	0.318	C	S	.	.	I	π-helix	trans	-88	-33.2	179.7	-163.9	64.8	-170.9	0	0	113.3	R609 G963 L964 I965 P971	R609-E967 IonicContact CZ-OE1 2.78Å; R609-E967 IonicContact CZ-OE2 2.89Å; R609-E967 IonicContact NE-OE2 2.72Å; R609-E967 PolarHBondContact NE-OE2 3.35Å; R609-E967 VanDerWaalsContact NE-OE2 3.16Å; R609-E967 VanDerWaalsContact NH2-CD 3.33Å; R609-E967 IonicContact NH2-OE1 2.72Å; R609-E967 PolarHBondContact NH2-OE1 2.96Å; R609-E967 IonicContact NH2-OE2 2.89Å; R609-E967 PolarHBondContact NH2-OE2 2.93Å; G963-E967 PolarHBondContact O-N 3.43Å; L964-E967 PolarHBondContact O-N 3.42Å; I965-E967 VanDerWaalsContact C-N 3.35Å; I965-E967 PolarHBondContact O-N 3.24Å; E967-P971 WeakPolarHBondContact O-CG 3.4Å
968	F	84.8	Confident	85	Confident	129 Å²	129	66.3 Å²	66.3	57%	0.566	33%	0.334	S	S	*	.	I	π-helix	trans	-107.1	-37.2	-173.8	-66.7	-66.7	0	0	0	114.8	L964 K972	L964-F968 HydrophobicContact CB-CD2 4.43Å; L964-F968 HydrophobicContact CD2-CD2 4.18Å; L964-F968 HydrophobicContact CD2-CE2 3.8Å; L964-F968 WeakPolarHBondContact O-CB 3.49Å; L964-F968 WeakPolarHBondContact O-CD2 3.29Å; L964-F968 PolarHBondContact O-N 2.99Å; F968-K972 VanDerWaalsContact O-CD 3.31Å; F968-K972 WeakPolarHBondContact O-CD 3.17Å; F968-K972 WeakPolarHBondContact O-CE 3.48Å; F968-K972 WeakPolarHBondContact O-CG 3.46Å
969	A	86.3	Confident	84.4	Confident	49 Å²	49	68.5 Å²	68.5	41%	0.405	34%	0.339	S	S	.	.	I	π-helix	trans	-92.3	-47.9	-173.9	0	0	0	0	0	112	I965 K972 W973	I965-A969 HydrophobicContact CG2-CB 4.09Å; I965-A969 WeakPolarHBondContact O-CA 3.46Å; I965-A969 VanDerWaalsContact O-CB 3.29Å; I965-A969 WeakPolarHBondContact O-CB 3Å; I965-A969 PolarHBondContact O-N 3.32Å; A969-K972 PolarHBondContact O-N 2.79Å; A969-W973 PolarHBondContact O-N 2.99Å
970	L	85.6	Confident	84	Confident	9 Å²	9	68.9 Å²	68.9	5%	0.047	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-61.7	-39.4	-178	-63.4	-176	0	0	0	113.9	F925 I928 I965 R966 K972 W973 L976 L980	F925-L970 HydrophobicContact CE2-CD1 4.24Å; I928-L970 HydrophobicContact CD1-CD2 4.25Å; I965-L970 PolarHBondContact O-N 2.95Å; R966-L970 HydrophobicContact CB-CD1 4.2Å; R966-L970 HydrophobicContact CG-CD1 4.14Å; L970-K972 VanDerWaalsContact C-N 3.27Å; L970-K972 PolarHBondContact O-N 3.27Å; L970-W973 HydrophobicContact CD2-CE3 4.33Å; L970-W973 WeakPolarHBondContact O-CB 3.34Å; L970-W973 PolarHBondContact O-N 3.3Å; L970-L976 HydrophobicContact CD2-CD2 3.98Å; L970-L980 HydrophobicContact CB-CD1 4.45Å; L970-L980 HydrophobicContact CB-CD2 3.88Å; L970-L980 HydrophobicContact CD1-CD1 4.42Å
971	P	82.4	Confident	83.3	Confident	56 Å²	56	71.9 Å²	71.9	36%	0.364	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-70.2	-21.9	177.7	-23	37.1	0	0	0	113.9	R966 E967 W973 A977 L980	R966-P971 WeakPolarHBondContact O-CD 3.44Å; E967-P971 WeakPolarHBondContact O-CG 3.4Å; P971-W973 VanDerWaalsContact C-N 3.28Å; P971-A977 WeakPolarHBondContact O-CB 3.45Å; P971-L980 HydrophobicContact CB-CD2 4.38Å; P971-L980 HydrophobicContact CG-CD2 3.88Å
972	K	86.1	Confident	82.5	Confident	167 Å²	167	73.2 Å²	73.2	73%	0.726	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-78	-16.6	174.5	-68.9	-179	-177.9	-176.5	0	112.5	F968 A969 L970 E974	F968-K972 VanDerWaalsContact O-CD 3.31Å; F968-K972 WeakPolarHBondContact O-CD 3.17Å; F968-K972 WeakPolarHBondContact O-CE 3.48Å; F968-K972 WeakPolarHBondContact O-CG 3.46Å; A969-K972 PolarHBondContact O-N 2.79Å; L970-K972 VanDerWaalsContact C-N 3.27Å; L970-K972 PolarHBondContact O-N 3.27Å; K972-E974 PolarHBondContact O-N 3.44Å; K972-E974 VanDerWaalsContact O-N 3.13Å
973	W	86	Confident	81.5	Confident	124 Å²	124	73.8 Å²	73.8	47%	0.47	36%	0.361	S	S	.	.			trans	-81.4	92.4	178.6	-166	2.1	0	0	0	109.5	V924 I928 A969 L970 P971 W975 L976 A977	V924-W973 HydrophobicContact CG1-CH2 4.17Å; V924-W973 HydrophobicContact CG1-CZ3 4.35Å; I928-W973 HydrophobicContact CD1-CZ3 4.26Å; A969-W973 PolarHBondContact O-N 2.99Å; L970-W973 HydrophobicContact CD2-CE3 4.33Å; L970-W973 WeakPolarHBondContact O-CB 3.34Å; L970-W973 PolarHBondContact O-N 3.3Å; P971-W973 VanDerWaalsContact C-N 3.28Å; W973-W975 PolarHBondContact O-N 3.47Å; W973-L976 HydrophobicContact CD2-CB 4.44Å; W973-L976 HydrophobicContact CE3-CB 4.46Å; W973-L976 HydrophobicContact CE3-CD2 4.3Å; W973-L976 HydrophobicContact CG-CB 4.48Å; W973-L976 PolarHBondContact O-N 2.84Å; W973-A977 WeakPolarHBondContact O-CB 3.39Å; W973-A977 PolarHBondContact O-N 3.44Å
974	E	82.5	Confident	80.8	Confident	167 Å²	167	72.9 Å²	72.9	78%	0.78	35%	0.351	S	S	*	.	H	α-helix	trans	-47.7	-40.5	-171.8	-64.3	-177.9	168.7	0	0	113.8	K972 L976	K972-E974 PolarHBondContact O-N 3.44Å; K972-E974 VanDerWaalsContact O-N 3.13Å; E974-L976 PolarHBondContact O-N 3.48Å
975	W	83.9	Confident	79.7	Confident	101 Å²	101	74.3 Å²	74.3	38%	0.383	35%	0.351	S	S	.	.	H	α-helix	trans	-61.2	-44.2	178.5	-174.7	76.7	0	0	0	113.3	R920 H921 V924 W973	R920-W975 HydrophobicContact CB-CH2 4.06Å; R920-W975 HydrophobicContact CB-CZ2 4Å; H921-W975 HydrophobicContact CB-CH2 4.39Å; H921-W975 AromaticContact CD2-CD2 3.75Å; H921-W975 AromaticContact CD2-CE2 3.67Å; H921-W975 AromaticContact CD2-CE3 3.8Å; H921-W975 AromaticContact CD2-CH2 3.77Å; H921-W975 AromaticContact CD2-CZ2 3.7Å; H921-W975 AromaticContact CD2-CZ3 3.81Å; H921-W975 PolarHBondContact CD2-O 3.08Å; H921-W975 VanDerWaalsContact CD2-O 3.26Å; H921-W975 AromaticContact CE1-CE2 3.57Å; H921-W975 AromaticContact CE1-CZ2 3.49Å; H921-W975 VanDerWaalsContact CE1-CZ2 3.49Å; H921-W975 WeakPolarHBondContact CE1-CZ2 3.47Å; H921-W975 AromaticContact CE1-NE1 3.73Å; H921-W975 AromaticContact CG-CH2 3.8Å; H921-W975 AromaticContact CG-CZ2 3.87Å; H921-W975 AromaticContact ND1-CZ2 3.71Å; H921-W975 AromaticContact NE2-CD1 3.86Å; H921-W975 AromaticContact NE2-CD2 3.54Å; H921-W975 AromaticContact NE2-CE2 3.17Å; H921-W975 AromaticContact NE2-CG 3.98Å; H921-W975 AromaticContact NE2-CZ2 3.47Å; H921-W975 WeakPolarHBondContact NE2-CZ2 3.49Å; H921-W975 AromaticContact NE2-NE1 3.39Å; H921-W975 PolarHBondContact NE2-NE1 2.73Å; H921-W975 PolarHBondContact NE2-O 3.19Å; V924-W975 HydrophobicContact CB-CH2 4.44Å; V924-W975 HydrophobicContact CB-CZ3 4.08Å; V924-W975 HydrophobicContact CG1-CZ3 4.24Å; V924-W975 HydrophobicContact CG2-CH2 3.93Å; V924-W975 HydrophobicContact CG2-CZ3 3.9Å; W973-W975 PolarHBondContact O-N 3.47Å
976	L	81.3	Confident	78.2	Confident	0 Å²	0	76.7 Å²	76.7	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-86.4	-28.6	-179.7	-169.7	66.9	0	0	0	112.2	H921 F925 L970 W973 E974 L978 Y979 L980 L983	H921-L976 HydrophobicContact CB-CD1 4.27Å; F925-L976 HydrophobicContact CD2-CD2 4.4Å; L970-L976 HydrophobicContact CD2-CD2 3.98Å; W973-L976 HydrophobicContact CD2-CB 4.44Å; W973-L976 HydrophobicContact CE3-CB 4.46Å; W973-L976 HydrophobicContact CE3-CD2 4.3Å; W973-L976 HydrophobicContact CG-CB 4.48Å; W973-L976 PolarHBondContact O-N 2.84Å; E974-L976 PolarHBondContact O-N 3.48Å; L976-L978 VanDerWaalsContact C-N 3.27Å; L976-L978 PolarHBondContact O-N 3.45Å; L976-Y979 PolarHBondContact O-N 3.07Å; L976-Y979 VanDerWaalsContact O-N 3.14Å; L976-L980 HydrophobicContact CD2-CD1 4.39Å; L976-L980 HydrophobicContact CG-CD1 4.45Å; L976-L980 WeakPolarHBondContact O-CB 3.35Å; L976-L980 PolarHBondContact O-N 2.68Å; L976-L983 HydrophobicContact CD1-CD1 4.21Å
977	A	77.8	Confident	76.7	Confident	34 Å²	34	78.6 Å²	78.6	28%	0.281	37%	0.366	S	S	.	.	H	α-helix	trans	-57.3	-38.2	-174.6	0	0	0	0	0	112.8	P971 W973 Y979 L980	P971-A977 WeakPolarHBondContact O-CB 3.45Å; W973-A977 WeakPolarHBondContact O-CB 3.39Å; W973-A977 PolarHBondContact O-N 3.44Å; A977-Y979 PolarHBondContact O-N 2.93Å; A977-L980 PolarHBondContact O-N 2.93Å
978	L	72.1	Confident	75.2	Confident	137 Å²	137	82.4 Å²	82.4	72%	0.717	38%	0.381	S	S	*	.	H	α-helix	trans	-52.5	-39.3	177.1	-81.7	153.7	0	0	0	113.2	L976	L976-L978 VanDerWaalsContact C-N 3.27Å; L976-L978 PolarHBondContact O-N 3.45Å
979	Y	78.3	Confident	73.3	Confident	74 Å²	74	77.4 Å²	77.4	29%	0.29	36%	0.361	S	S	.	.	H	α-helix	trans	-107.8	-5.6	-175.7	-61.4	-72	0	0	0	113.6	L917 P918 H921 L976 A977 H981 Q982 L983	L917-Y979 HydrophobicContact CD2-CD1 3.57Å; L917-Y979 HydrophobicContact CD2-CE1 4.49Å; L917-Y979 HydrophobicContact CD2-CG 3.97Å; P918-Y979 HydrophobicContact CG-CD1 4.38Å; P918-Y979 HydrophobicContact CG-CD2 3.85Å; P918-Y979 HydrophobicContact CG-CE1 4.03Å; P918-Y979 HydrophobicContact CG-CE2 3.47Å; P918-Y979 VanDerWaalsContact CG-CE2 3.47Å; P918-Y979 HydrophobicContact CG-CG 4.28Å; H921-Y979 HydrophobicContact CB-CD2 4.49Å; H921-Y979 AromaticContact CD2-CD2 3.63Å; H921-Y979 AromaticContact CE1-CE2 3.93Å; H921-Y979 AromaticContact CG-CD2 3.94Å; H921-Y979 AromaticContact NE2-CD2 3.79Å; H921-Y979 AromaticContact NE2-CE2 3.82Å; L976-Y979 PolarHBondContact O-N 3.07Å; L976-Y979 VanDerWaalsContact O-N 3.14Å; A977-Y979 PolarHBondContact O-N 2.93Å; Y979-H981 VanDerWaalsContact C-N 3.27Å; Y979-H981 PolarHBondContact O-N 3.11Å; Y979-Q982 PolarHBondContact O-N 3.04Å; Y979-Q982 VanDerWaalsContact O-N 3.1Å; Y979-L983 WeakPolarHBondContact O-CG 3.47Å; Y979-L983 PolarHBondContact O-N 3.47Å
980	L	78.7	Confident	71.3	Confident	11 Å²	11	80.5 Å²	80.5	6%	0.058	37%	0.367	C	S	.	.	H	α-helix	trans	-62.3	-33.6	-173.7	-169.1	64.6	0	0	0	112.5	F925 L970 P971 L976 A977 D984	F925-L980 HydrophobicContact CD2-CD1 4.13Å; F925-L980 HydrophobicContact CE2-CD1 3.79Å; L970-L980 HydrophobicContact CB-CD1 4.45Å; L970-L980 HydrophobicContact CB-CD2 3.88Å; L970-L980 HydrophobicContact CD1-CD1 4.42Å; P971-L980 HydrophobicContact CB-CD2 4.38Å; P971-L980 HydrophobicContact CG-CD2 3.88Å; L976-L980 HydrophobicContact CD2-CD1 4.39Å; L976-L980 HydrophobicContact CG-CD1 4.45Å; L976-L980 WeakPolarHBondContact O-CB 3.35Å; L976-L980 PolarHBondContact O-N 2.68Å; A977-L980 PolarHBondContact O-N 2.93Å; L980-D984 PolarHBondContact O-N 3.26Å
981	H	71.9	Confident	69.2	Low	132 Å²	132	82 Å²	82	61%	0.611	38%	0.377	S	S	*	.	H	α-helix	trans	-67.1	-35.7	177	-169.1	77.1	0	0	0	112.6	Y979 R985	Y979-H981 VanDerWaalsContact C-N 3.27Å; Y979-H981 PolarHBondContact O-N 3.11Å; H981-R985 PolarHBondContact O-N 3.12Å
982	Q	71.1	Confident	66.7	Low	115 Å²	115	83 Å²	83	54%	0.537	39%	0.385	S	S	.	.	H	α-helix	trans	-76.7	-40.2	176.6	-67.9	-178.9	-8.6	0	0	111.6	L917 Y979 D984	L917-Q982 HydrophobicContact CD2-CB 4.12Å; L917-Q982 VanDerWaalsContact CD2-OE1 3.28Å; Y979-Q982 PolarHBondContact O-N 3.04Å; Y979-Q982 VanDerWaalsContact O-N 3.1Å; Q982-D984 VanDerWaalsContact C-N 3.33Å; Q982-D984 PolarHBondContact O-N 2.95Å
983	L	71.7	Confident	64	Low	15 Å²	15	81.3 Å²	81.3	8%	0.079	39%	0.389	C	S	.	.	H	α-helix	trans	-68.5	-28.8	178.8	-74.4	166.9	0	0	0	113.5	R897 L917 I922 F925 L976 Y979	R897-L983 PolarHBondContact NH1-O 2.88Å; L917-L983 HydrophobicContact CD1-CD2 3.82Å; L917-L983 HydrophobicContact CD1-CG 4.28Å; L917-L983 HydrophobicContact CD2-CG 4.37Å; I922-L983 HydrophobicContact CG1-CD2 3.96Å; F925-L983 HydrophobicContact CB-CD1 4.31Å; F925-L983 HydrophobicContact CG-CD1 4.44Å; L976-L983 HydrophobicContact CD1-CD1 4.21Å; Y979-L983 WeakPolarHBondContact O-CG 3.47Å; Y979-L983 PolarHBondContact O-N 3.47Å
984	D	71.5	Confident	61.2	Low	2 Å²	2	82.4 Å²	82.4	1%	0.011	40%	0.401	C	S	.	.	S	Bend	trans	-147.6	75.6	-174.5	-167.5	21.7	0	0	0	112.1	R610 S611 F925 R966 L980 Q982	R610-D984 VanDerWaalsContact CB-OD1 3.31Å; R610-D984 WeakPolarHBondContact CB-OD1 3.39Å; R610-D984 PolarHBondContact N-OD1 3.32Å; S611-D984 VanDerWaalsContact CB-OD2 3.31Å; S611-D984 WeakPolarHBondContact CB-OD2 3.27Å; S611-D984 PolarHBondContact N-OD1 2.88Å; S611-D984 PolarHBondContact OG-OD2 2.8Å; F925-D984 HydrophobicContact CZ-CB 4.24Å; R966-D984 IonicContact CZ-OD2 3.33Å; R966-D984 IonicContact NE-OD2 3.39Å; R966-D984 PolarHBondContact NE-OD2 2.84Å; R966-D984 VanDerWaalsContact NH2-CG 3.29Å; R966-D984 PolarHBondContact NH2-O 3.27Å; R966-D984 IonicContact NH2-OD2 3.27Å; R966-D984 PolarHBondContact NH2-OD2 2.89Å; L980-D984 PolarHBondContact O-N 3.26Å; Q982-D984 VanDerWaalsContact C-N 3.33Å; Q982-D984 PolarHBondContact O-N 2.95Å
985	R	63.4	Low	58.3	Low	118 Å²	118	85.1 Å²	85.1	45%	0.445	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-58.8	139.7	178.7	-65.2	-176.4	-178.8	-177.2	-1.7	111.5	H981 D1051	H981-R985 PolarHBondContact O-N 3.12Å; R985-D1051 IonicContact NH1-OD1 3.67Å; R985-D1051 PolarHBondContact NH1-OD1 2.92Å
986	K	58	Low	55.4	Low	126 Å²	126	89.4 Å²	89.4	55%	0.548	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-66.7	136.4	169.1	-74.9	-173.2	174.3	177.8	0	109.8	R609	R609-K986 VanDerWaalsContact CZ-CG 3.48Å
987	Y	55.2	Low	52.6	Low	44 Å²	44	94.6 Å²	94.6	17%	0.173	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-75.4	131.7	162.3	-70.4	-69.7	0	0	0	109.4	R610 L777 K781 L989	R610-Y987 HydrophobicContact CB-CD2 4.3Å; R610-Y987 HydrophobicContact CB-CE2 3.5Å; R610-Y987 WeakPolarHBondContact CD-OH 3.43Å; R610-Y987 HydrophobicContact CG-CE2 3.92Å; R610-Y987 WeakPolarHBondContact CG-OH 3.47Å; L777-Y987 HydrophobicContact CD1-CD2 3.52Å; L777-Y987 HydrophobicContact CD1-CE2 4.44Å; L777-Y987 HydrophobicContact CD1-CG 3.78Å; L777-Y987 HydrophobicContact CD2-CD2 3.77Å; L777-Y987 HydrophobicContact CD2-CE2 4.09Å; L777-Y987 HydrophobicContact CG-CD2 3.66Å; L777-Y987 HydrophobicContact CG-CE2 4.11Å; L777-Y987 HydrophobicContact CG-CG 4.31Å; K781-Y987 VanDerWaalsContact CE-OH 3.28Å; K781-Y987 WeakPolarHBondContact CE-OH 3.47Å; K781-Y987 HydrophobicContact CG-CE1 3.91Å; Y987-L989 PolarHBondContact O-N 2.67Å
988	K	50.1	Low	50.1	Low	120 Å²	120	98.6 Å²	98.6	52%	0.522	48%	0.482	S	S	.	.			trans	-74.9	103.9	171.1	-66.2	-176.1	-178.8	179.7	0	108.3	H990	K988-H990 VanDerWaalsContact C-N 3.25Å
989	L	46.1	Very low	47.9	Very low	25 Å²	25	97.3 Å²	97.3	13%	0.131	48%	0.484	C	S	.	.	S	Bend	trans	-71	-22.8	173.7	-79.6	99.8	0	0	0	112.8	K606 Y987	K606-L989 HydrophobicContact CB-CD1 4.41Å; K606-L989 HydrophobicContact CG-CD2 4.42Å; Y987-L989 PolarHBondContact O-N 2.67Å
990	H	43	Very low	45.4	Very low	114 Å²	114	100.3 Å²	100.3	53%	0.528	51%	0.511	S	S	.	.	S	Bend	trans	-117.9	107.5	171.8	-69.4	-78	0	0	0	108.5	P787 K988 S992	P787-H990 WeakPolarHBondContact CB-ND1 3.49Å; K988-H990 VanDerWaalsContact C-N 3.25Å; H990-S992 PolarHBondContact O-N 3.07Å
991	P	42	Very low	42.9	Very low	40 Å²	40	105.2 Å²	105.2	26%	0.26	54%	0.54	S	S	.	.			trans	-65.3	133.8	169.8	25.2	-29.6	0	0	0	108.8	V785 V993	V785-P991 WeakPolarHBondContact O-CG 3.5Å; P991-V993 PolarHBondContact O-N 2.87Å
992	S	29.5	Very low	40.6	Very low	76 Å²	76	109.4 Å²	109.4	53%	0.531	55%	0.551	S	S	.	*			trans	-55.1	129.2	168.1	34.6	0	0	0	0	107.8	H990 M994	H990-S992 PolarHBondContact O-N 3.07Å; S992-M994 PolarHBondContact O-N 3.18Å
993	V	30.5	Very low	38.4	Very low	133 Å²	133	111 Å²	111	81%	0.806	56%	0.563	S	S	*	*			trans	-61.6	104.2	174	177.7	0	0	0	0	106.3	P991 R995	P991-V993 PolarHBondContact O-N 2.87Å; V993-R995 VanDerWaalsContact C-N 3.3Å; V993-R995 PolarHBondContact O-N 3.02Å
994	M	26.1	Very low	36.3	Very low	147 Å²	147	116.7 Å²	116.7	72%	0.724	59%	0.593	S	S	*	*			trans	-59.1	102.6	164.8	-86.3	-163.7	-173.8	0	0	106.3	S992 K996	S992-M994 PolarHBondContact O-N 3.18Å; M994-K996 PolarHBondContact O-N 3.4Å; M994-K996 VanDerWaalsContact O-N 3.1Å
995	R	22.3	Very low	34.1	Very low	223 Å²	223	122.1 Å²	122.1	84%	0.842	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-57.4	119.5	162.4	-79.5	-177.5	176.7	171.1	0	104.8	V993	V993-R995 VanDerWaalsContact C-N 3.3Å; V993-R995 PolarHBondContact O-N 3.02Å
996	K	23.2	Very low	32.6	Very low	192 Å²	192	121.9 Å²	121.9	84%	0.835	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-48.9	130.2	162.5	-80.9	-177.9	175.4	-179.6	0	105.9	M994	M994-K996 PolarHBondContact O-N 3.4Å; M994-K996 VanDerWaalsContact O-N 3.1Å
997	P	22.4	Very low	31.1	Very low	109 Å²	109	123.3 Å²	123.3	71%	0.708	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-52.1	137.6	168	23.5	-31	0	0	0	106.3	S999	P997-S999 PolarHBondContact O-N 2.89Å
998	P	25.2	Very low	29.7	Very low	118 Å²	118	131 Å²	131	77%	0.766	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-50.8	119	176.5	22.1	-31	0	0	0	105.9	T1000	P998-T1000 VanDerWaalsContact C-N 3.33Å; P998-T1000 PolarHBondContact O-N 2.84Å
999	S	26.2	Very low	28.7	Very low	110 Å²	110	131.8 Å²	131.8	77%	0.769	69%	0.687	S	S	*	*			trans	-54.6	106	177.1	47.4	0	0	0	0	106.1	P997 V1001	P997-S999 PolarHBondContact O-N 2.89Å; S999-V1001 PolarHBondContact O-N 3.24Å
1000	T	25.7	Very low	27.9	Very low	137 Å²	137	138.2 Å²	138.2	84%	0.84	72%	0.716	S	S	*	*			trans	-55.4	116.5	169.2	-35.9	0	0	0	0	104.8	P998 R1002	P998-T1000 VanDerWaalsContact C-N 3.33Å; P998-T1000 PolarHBondContact O-N 2.84Å; T1000-R1002 PolarHBondContact O-N 3.36Å
1001	V	25.8	Very low	27.2	Very low	113 Å²	113	137.5 Å²	137.5	69%	0.685	72%	0.724	S	S	*	*			trans	-43.8	114.5	-177.4	174.1	0	0	0	0	107.8	S999 N1003	S999-V1001 PolarHBondContact O-N 3.24Å; V1001-N1003 VanDerWaalsContact C-N 3.28Å; V1001-N1003 PolarHBondContact O-N 3.37Å
1002	R	24.6	Very low	26.6	Very low	221 Å²	221	142.4 Å²	142.4	83%	0.834	75%	0.753	S	S	*	*			trans	-59.7	102.8	161.2	-84.9	-178.1	-178.8	165.5	-1	105.2	T1000 L1004	T1000-R1002 PolarHBondContact O-N 3.36Å; R1002-L1004 PolarHBondContact O-N 2.88Å
1003	N	24.9	Very low	26.5	Very low	147 Å²	147	142.5 Å²	142.5	79%	0.786	77%	0.766	S	S	*	*			trans	-62.3	85.2	157.7	-77.6	-20.1	0	0	0	106.8	V1001 S1005	V1001-N1003 VanDerWaalsContact C-N 3.28Å; V1001-N1003 PolarHBondContact O-N 3.37Å; N1003-S1005 VanDerWaalsContact C-N 3.31Å; N1003-S1005 PolarHBondContact O-N 3.02Å
1004	L	25.7	Very low	26.3	Very low	135 Å²	135	141 Å²	141	71%	0.707	76%	0.762	S	S	*	*			trans	-80.2	88.6	163.8	-136.5	91.1	0	0	0	105.8	R1002 T1006	R1002-L1004 PolarHBondContact O-N 2.88Å; L1004-T1006 PolarHBondContact O-N 3.22Å
1005	S	26.9	Very low	26.3	Very low	116 Å²	116	143.6 Å²	143.6	81%	0.811	77%	0.769	S	S	*	*			trans	-68.9	90.8	158.1	53.3	0	0	0	0	107.4	N1003	N1003-S1005 VanDerWaalsContact C-N 3.31Å; N1003-S1005 PolarHBondContact O-N 3.02Å
1006	T	30.9	Very low	26.6	Very low	113 Å²	113	137.5 Å²	137.5	69%	0.693	77%	0.767	S	S	*	*			trans	-139.2	90.6	158	-35.8	0	0	0	0	107.9	L1004 R1008	L1004-T1006 PolarHBondContact O-N 3.22Å; T1006-R1008 PolarHBondContact O-N 3.47Å
1007	I	27.1	Very low	26.7	Very low	156 Å²	156	134.2 Å²	134.2	80%	0.8	77%	0.768	S	S	*	*			trans	-29.8	125.9	154.8	-63.1	158	0	0	0	109.9
1008	R	25.9	Very low	27	Very low	206 Å²	206	132.9 Å²	132.9	78%	0.777	77%	0.774	S	S	*	*				166.4	127.4	107.5	-160.4	156.1	-157.5	-171.5	6.2	113.6	T1006	T1006-R1008 PolarHBondContact O-N 3.47Å
1009	K	29.2	Very low	26.9	Very low	136 Å²	136	130.7 Å²	130.7	59%	0.591	77%	0.773	S	S	*	*			trans	79.3	107.8	148.5	-79.8	-179.9	174.2	-155.9	0	119.5
1010	E	28.8	Very low	26.9	Very low	160 Å²	160	133.5 Å²	133.5	75%	0.748	78%	0.778	S	S	*	*				88.3	128.2	102.2	-77.8	170	-153.7	0	0	109
1011	S	29	Very low	26.8	Very low	100 Å²	100	133.1 Å²	133.1	70%	0.699	78%	0.776	S	S	*	*			cis	-173.9	147	20.4	55.7	0	0	0	0	109
1012	V	28.3	Very low	26.9	Very low	143 Å²	143	134 Å²	134	87%	0.867	78%	0.782	S	S	*	*			trans	63.6	106.2	143.3	-176	0	0	0	0	117
1013	G	27.1	Very low	26.9	Very low	78 Å²	78	129.9 Å²	129.9	80%	0.804	78%	0.781	S	S	*	*				108.1	147.4	81.8	0	0	0	0	0	107.7
1014	S	27.4	Very low	26.9	Very low	102 Å²	102	128.2 Å²	128.2	71%	0.713	78%	0.781	S	S	*	*			cis	-171.6	143.7	9.8	179.7	0	0	0	0	106
1015	F	25	Very low	26.8	Very low	200 Å²	200	130.2 Å²	130.2	88%	0.877	79%	0.786	S	S	*	*			trans	42.4	126.3	144.5	-77.7	-108.7	0	0	0	121.4
1016	A	29.8	Very low	26.7	Very low	96 Å²	96	131.5 Å²	131.5	79%	0.793	78%	0.783	S	S	*	*				169.8	141.5	95	0	0	0	0	0	113
1017	S	24.7	Very low	26.4	Very low	123 Å²	123	134.5 Å²	134.5	86%	0.86	79%	0.787	S	S	*	*			trans	-68.1	153.4	172.8	50.1	0	0	0	0	114.5
1018	G	28.7	Very low	26.3	Very low	80 Å²	80	132.8 Å²	132.8	83%	0.825	78%	0.784	S	S	*	*			trans	173.2	103.2	160.6	0	0	0	0	0	112.3
1019	G	24	Very low	26.2	Very low	73 Å²	73	130.1 Å²	130.1	75%	0.753	79%	0.785	S	S	*	*			trans	-77.3	157.7	174.1	0	0	0	0	0	112.8
1020	L	25.8	Very low	26.2	Very low	168 Å²	168	131.6 Å²	131.6	88%	0.88	80%	0.799	S	S	*	*			trans	-161.8	126.9	140.3	-139	83.6	0	0	0	111
1021	T	23.3	Very low	26	Very low	129 Å²	129	133 Å²	133	79%	0.791	80%	0.804	S	S	*	*			trans	-61.8	135.2	166	33	0	0	0	0	112.6
1022	V	27.8	Very low	26	Very low	133 Å²	133	135 Å²	135	81%	0.806	81%	0.805	S	S	*	*			trans	-137.4	111.6	149.9	178.9	0	0	0	0	109.3
1023	T	23.9	Very low	25.9	Very low	133 Å²	133	135 Å²	135	82%	0.816	80%	0.796	S	S	*	*			trans	-67.8	129.2	162.3	41.9	0	0	0	0	110.7
1024	S	26.4	Very low	25.9	Very low	112 Å²	112	140.8 Å²	140.8	78%	0.783	79%	0.794	S	S	*	*			trans	-161.3	126.3	141.3	54.6	0	0	0	0	112.2
1025	Q	23.3	Very low	26	Very low	177 Å²	177	141.8 Å²	141.8	83%	0.827	79%	0.791	S	S	*	*			trans	-26.9	139.1	163.9	-58.5	175.2	-16.7	0	0	115.2
1026	L	24.4	Very low	26.1	Very low	143 Å²	143	138.5 Å²	138.5	75%	0.749	78%	0.778	S	S	*	*				172.1	122.5	117.6	-90.8	149.8	0	0	0	112.3
1027	K	24.4	Very low	26.1	Very low	176 Å²	176	139.9 Å²	139.9	77%	0.765	77%	0.772	S	S	*	*			trans	76.4	85.7	146.6	-69.7	172.7	178.6	176.2	0	118.7
1028	T	24.3	Very low	26.2	Very low	121 Å²	121	140.9 Å²	140.9	74%	0.742	76%	0.763	S	S	*	*				-4.2	128.1	120.9	39.9	0	0	0	0	116.5
1029	N	25.1	Very low	26.1	Very low	149 Å²	149	145.3 Å²	145.3	80%	0.797	76%	0.762	S	S	*	*			trans	133.7	79.8	154.7	-71.8	-15	0	0	0	110.7
1030	N	27.7	Very low	26.3	Very low	167 Å²	167	146.5 Å²	146.5	89%	0.893	76%	0.755	S	S	*	*			trans	-166	18.8	160.8	-92.8	-24.2	0	0	0	114.5
1031	F	26.2	Very low	26.4	Very low	191 Å²	191	140.6 Å²	140.6	84%	0.838	73%	0.73	S	S	*	*	S	Bend	trans	-110.3	8.4	-169.8	-116.5	-89.9	0	0	0	115.9
1032	I	28.2	Very low	26.5	Very low	142 Å²	142	137 Å²	137	73%	0.728	71%	0.71	S	S	*	*	S	Bend	trans	-106	-10.5	-172.5	-62.8	-179.7	0	0	0	113.6	Y1034	I1032-Y1034 PolarHBondContact O-N 2.71Å
1033	E	27.2	Very low	26.5	Very low	143 Å²	143	139.4 Å²	139.4	67%	0.668	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	12.4	-177	-137.1	167.5	-151.1	0	0	114.2	R461	R461-E1033 IonicContact CZ-OE1 3.58Å; R461-E1033 IonicContact NH1-OE1 3.51Å; R461-E1033 PolarHBondContact NH1-OE1 3.21Å; R461-E1033 IonicContact NH2-OE1 3.35Å; R461-E1033 PolarHBondContact NH2-OE1 3.14Å
1034	Y	27.3	Very low	26.8	Very low	198 Å²	198	134.9 Å²	134.9	78%	0.776	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115	-0.6	-171.6	-121.3	-90	0	0	0	115.8	I1032	I1032-Y1034 PolarHBondContact O-N 2.71Å
1035	I	28.2	Very low	26.9	Very low	124 Å²	124	135.1 Å²	135.1	64%	0.636	67%	0.672	S	S	*	*	S	Bend	trans	-104.6	-16.4	-173.2	-63.1	-179.4	0	0	0	112.3	D1037	I1035-D1037 VanDerWaalsContact C-N 3.33Å; I1035-D1037 PolarHBondContact O-N 3.18Å
1036	H	27.1	Very low	27.1	Very low	131 Å²	131	129.8 Å²	129.8	61%	0.606	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-7.2	-176.3	-141.4	-52.7	0	0	0	114.9
1037	D	29.9	Very low	27.4	Very low	125 Å²	125	125.6 Å²	125.6	67%	0.668	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	-2.9	179.9	-83	-18.3	0	0	0	113.6	I1035	I1035-D1037 VanDerWaalsContact C-N 3.33Å; I1035-D1037 PolarHBondContact O-N 3.18Å
1038	Q	27.9	Very low	27.8	Very low	144 Å²	144	120.8 Å²	120.8	67%	0.673	61%	0.612	S	S	*	*	S	Bend	trans	-83.7	-26.3	-177	-78.2	-168.7	-19.2	0	0	114.3	T1040 A1041	Q1038-T1040 PolarHBondContact O-N 3.01Å; Q1038-A1041 WeakPolarHBondContact O-CB 3.33Å; Q1038-A1041 PolarHBondContact O-N 3.32Å
1039	E	25.4	Very low	28.1	Very low	172 Å²	172	120 Å²	120	80%	0.804	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-11.5	-179.7	-76.3	178.8	158.7	0	0	114.1
1040	T	29.3	Very low	28.5	Very low	99 Å²	99	119.3 Å²	119.3	61%	0.607	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	-3.5	169.2	54.3	0	0	0	0	112.8	Q1038	Q1038-T1040 PolarHBondContact O-N 3.01Å
1041	A	27.1	Very low	28.7	Very low	43 Å²	43	114.8 Å²	114.8	36%	0.355	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.5	-29.4	-177	0	0	0	0	0	113.1	Q1038 Y1043 S1044	Q1038-A1041 WeakPolarHBondContact O-CB 3.33Å; Q1038-A1041 PolarHBondContact O-N 3.32Å; A1041-Y1043 PolarHBondContact O-N 2.9Å; A1041-S1044 WeakPolarHBondContact CA-OG 3.27Å; A1041-S1044 PolarHBondContact O-N 3.28Å; A1041-S1044 PolarHBondContact O-OG 3.3Å
1042	S	25.2	Very low	28.8	Very low	54 Å²	54	106.6 Å²	106.6	38%	0.378	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-27.5	-179.2	63.8	0	0	0	0	113.8	S1044	S1042-S1044 VanDerWaalsContact C-N 3.33Å
1043	Y	28.4	Very low	28.8	Very low	183 Å²	183	102.9 Å²	102.9	72%	0.718	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-10.4	171.8	-89.3	-91.1	0	0	0	113.7	A1041	A1041-Y1043 PolarHBondContact O-N 2.9Å
1044	S	29.5	Very low	28.9	Very low	38 Å²	38	99.9 Å²	99.9	27%	0.266	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-28.6	-165.8	75.2	0	0	0	0	114	A1041 S1042 I1046 S1047	A1041-S1044 WeakPolarHBondContact CA-OG 3.27Å; A1041-S1044 PolarHBondContact O-N 3.28Å; A1041-S1044 PolarHBondContact O-OG 3.3Å; S1042-S1044 VanDerWaalsContact C-N 3.33Å; S1044-I1046 VanDerWaalsContact C-N 3.27Å; S1044-I1046 PolarHBondContact O-N 3.45Å; S1044-S1047 PolarHBondContact O-N 3.14Å; S1044-S1047 PolarHBondContact O-OG 3.14Å
1045	D	28.5	Very low	29.1	Very low	117 Å²	117	92.3 Å²	92.3	63%	0.626	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-15.5	175.4	-72.1	-20.3	0	0	0	113.3	S1047	D1045-S1047 VanDerWaalsContact C-N 3.33Å
1046	I	28.1	Very low	29.1	Very low	65 Å²	65	96.8 Å²	96.8	33%	0.333	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-20.6	-179.9	-57.6	172.3	0	0	0	111.1	Q379 S1044	Q379-I1046 HydrophobicContact CG-CD1 4.27Å; Q379-I1046 HydrophobicContact CG-CG2 4.22Å; S1044-I1046 VanDerWaalsContact C-N 3.27Å; S1044-I1046 PolarHBondContact O-N 3.45Å
1047	S	31.1	Very low	29.2	Very low	55 Å²	55	94.3 Å²	94.3	39%	0.385	49%	0.485	S	S	.	.	S	Bend	trans	-92.5	-14.5	-176.1	68.3	0	0	0	0	114.9	S1044 D1045 H1049	S1044-S1047 PolarHBondContact O-N 3.14Å; S1044-S1047 PolarHBondContact O-OG 3.14Å; D1045-S1047 VanDerWaalsContact C-N 3.33Å; S1047-H1049 VanDerWaalsContact C-N 3.3Å; S1047-H1049 PolarHBondContact O-N 3.01Å
1048	E	32	Very low	29	Very low	76 Å²	76	91.7 Å²	91.7	36%	0.355	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-8.7	-170.5	-62.1	-159.9	153	0	0	114.6
1049	H	30.9	Very low	28.9	Very low	105 Å²	105	85.3 Å²	85.3	49%	0.486	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-13.1	-178	-103.2	-91.5	0	0	0	115.8	R378 S1047	R378-H1049 PolarHBondContact NH1-CD2 3.38Å; R378-H1049 PolarHBondContact NH1-CE1 3.01Å; R378-H1049 VanDerWaalsContact NH1-CE1 3.32Å; R378-H1049 PolarHBondContact NH1-ND1 3.25Å; R378-H1049 PolarHBondContact NH1-NE2 3.43Å; R378-H1049 PolarHBondContact NH2-CE1 3.18Å; R378-H1049 VanDerWaalsContact NH2-CE1 3.26Å; R378-H1049 PolarHBondContact NH2-NE2 3.13Å; S1047-H1049 VanDerWaalsContact C-N 3.3Å; S1047-H1049 PolarHBondContact O-N 3.01Å
1050	E	32.6	Very low	29.1	Very low	133 Å²	133	81.9 Å²	81.9	62%	0.621	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-21.2	-178.7	-67.1	-163.9	144.9	0	0	114.2	G1052	E1050-G1052 PolarHBondContact O-N 2.92Å
1051	D	32.6	Very low	29	Very low	72 Å²	72	81.1 Å²	81.1	39%	0.385	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	27.6	-178.4	-72.1	-12.9	0	0	0	113.8	R985	R985-D1051 IonicContact NH1-OD1 3.67Å; R985-D1051 PolarHBondContact NH1-OD1 2.92Å
1052	G	28.9	Very low	29.2	Very low	20 Å²	20	83.1 Å²	83.1	21%	0.206	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	-11.4	-178.5	0	0	0	0	0	115.5	E1050	E1050-G1052 PolarHBondContact O-N 2.92Å
1053	V	28.7	Very low	29.4	Very low	63 Å²	63	84.7 Å²	84.7	38%	0.382	43%	0.426	S	S	.	.	S	Bend	trans	-97.4	-9.7	-176.4	-177.7	0	0	0	0	112.2	E912 R1055	E912-V1053 WeakPolarHBondContact OE1-CA 3.13Å; E912-V1053 VanDerWaalsContact OE1-CB 3.24Å; E912-V1053 WeakPolarHBondContact OE1-CB 3.29Å; V1053-R1055 PolarHBondContact O-N 2.99Å
1054	V	28.3	Very low	29.4	Very low	80 Å²	80	78.9 Å²	78.9	49%	0.485	41%	0.409	S	S	.	.			trans	-77.1	81.7	179.1	-168.3	0	0	0	0	109.5	E912	E912-V1054 VanDerWaalsContact CD-CG2 3.4Å; E912-V1054 WeakPolarHBondContact OE1-CA 3.13Å; E912-V1054 WeakPolarHBondContact OE1-CG2 3.31Å; E912-V1054 PolarHBondContact OE1-N 3.5Å; E912-V1054 WeakPolarHBondContact OE2-CA 3.33Å; E912-V1054 WeakPolarHBondContact OE2-CB 3.41Å; E912-V1054 WeakPolarHBondContact OE2-CG1 3.18Å; E912-V1054 WeakPolarHBondContact OE2-CG2 3.42Å
1055	R	31.2	Very low	29.4	Very low	40 Å²	40	81.4 Å²	81.4	15%	0.151	42%	0.418	C	S	.	.			trans	170.8	63.6	145	-91.7	175.3	178.2	-159.8	16.8	111.3	N782 M830 V1053 T1057 W1058 A1059	N782-R1055 PolarHBondContact ND2-NH2 3.1Å; M830-R1055 VanDerWaalsContact CE-NH1 3.27Å; V1053-R1055 PolarHBondContact O-N 2.99Å; R1055-T1057 PolarHBondContact O-N 3.3Å; R1055-W1058 HydrophobicContact CB-CB 4.07Å; R1055-W1058 HydrophobicContact CG-CB 3.64Å; R1055-W1058 PolarHBondContact O-N 2.95Å; R1055-A1059 HydrophobicContact CB-CB 4.25Å
1056	R	28.7	Very low	29.5	Very low	217 Å²	217	79.1 Å²	79.1	82%	0.819	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	10.9	158.1	-93.9	-174.6	179.8	173.2	0.8	114
1057	T	29	Very low	29.6	Very low	80 Å²	80	80.1 Å²	80.1	49%	0.491	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.6	-1.8	172.6	43	0	0	0	0	115.5	R1055	R1055-T1057 PolarHBondContact O-N 3.3Å
1058	W	25.7	Very low	29.5	Very low	70 Å²	70	82 Å²	82	27%	0.265	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147.2	22.9	-172.5	-76.4	90.1	0	0	0	115.5	K679 V825 M830 R1055	K679-W1058 VanDerWaalsContact NZ-CH2 3.26Å; V825-W1058 HydrophobicContact CG1-CE3 3.72Å; V825-W1058 HydrophobicContact CG1-CH2 3.77Å; V825-W1058 HydrophobicContact CG1-CZ3 3.18Å; M830-W1058 WeakPolarHBondContact CE-O 3.37Å; R1055-W1058 HydrophobicContact CB-CB 4.07Å; R1055-W1058 HydrophobicContact CG-CB 3.64Å; R1055-W1058 PolarHBondContact O-N 2.95Å
1059	A	25.9	Very low	29.3	Very low	9 Å²	9	82.5 Å²	82.5	7%	0.074	42%	0.415	C	S	.	.			trans	-128.9	53.1	178.2	0	0	0	0	0	111.1	P839 H840 R1055	P839-A1059 HydrophobicContact CB-CB 4.26Å; H840-A1059 HydrophobicContact CB-CB 3.92Å; H840-A1059 PolarHBondContact CD2-O 3.13Å; H840-A1059 WeakPolarHBondContact O-CB 3.31Å; R1055-A1059 HydrophobicContact CB-CB 4.25Å
1060	T	28.9	Very low	29.1	Very low	101 Å²	101	80.5 Å²	80.5	62%	0.62	41%	0.409	S	S	*	.			trans	-159.2	0	154.7	15.5	0	0	0	0	110.2	R686 R689	R686-T1060 PolarHBondContact NE-OXT 3.25Å; R686-T1060 PolarHBondContact NH2-OXT 3.17Å; R689-T1060 VanDerWaalsContact NH2-C 3.28Å; R689-T1060 PolarHBondContact NH2-O 3.3Å

Retrieved 1,060 of 1,060 residues in 1359.4 ms (Link to these results)

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