A0A096M2T7_POEFO Loading...

Calmodulin regulated spectrin-associated protein family, member 2a

AlphaFold DB , UniProt , Accession A0A096M2T7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,237 aa.

						>A0A096M2T7_POEFO|A0A096M2T7
MGEVQDVRDAKKSFVAPAIKSFEHYDFSRAKICCSLRWLVSKAYGTENSIPAELKDPFYTDQYEQEHLKPPVTSLLLSADLYCRAGSLILKSDAAKPLLGHDAVIQALAQRGLYVTDQDRLVTERDLRKRPLQMGAHLAMIDTLMMAYTVETVNVEKLPVCCKSLQHKPLCKRTQLIIYLDFSNESPAVVRVAPLIVPNFASHLYQQARYRKEQASTQLAPWIPPVDNLLKDSTDGSALGALLHFYCPQLLPLDDVCLKENMSLADRLYNLQLIQDFCKDNLNSCCHFSLEDMLYASSTIKNNYLVFMAELFWWFEVVKPSFVKPRMLDNEGTEPSSILKSMPFIPISKATKRSFMERPPSPERPSLPLRPQPRNTGDIKRSSSMSFVDGNLGTWPKEKRSGPYGVSFDIPFDKGDSAPAVPSSTRGMVRSISTDEEGCPERLAGVESCRQAYPNGHGSVLASAPSMEETLQIIHNPTRQPVEGINSGFFLHSQDPGSGAGVLDPLPESDSKELLSTADTTEVDTGIHIRTEDMLDEDSSLKDLSVNMDLDVDTPSPSPSNQSKSPSGVKLTSFAEQKMRKLSPSAPDSGRGSSSSMKTTPEVMATEMVQLRIRLEEKRKAIEAQKKKVEAAFTRHRQKMGHSAFLNVVKRKADGAASGDEGGQTDGEGKLKTPGSGDEGGQSHAQITEADLSEYTRSIEKLNHSLAFLQAEMQRLAQQQEVIMAMREQQHQQTWVIPPPHTNPSPQKHPRPGAVTRSSGPSSPADSPRNPRTARPSELKLAPYSRVLTAPQSVDSIPRLRRFSPCQPVLAHPVVETFTVTPSELPPKPEPSGQAKSSLIEVPLMATKSTEDLTIDDGLEMEQDSTESADEEQMLCRGFFFKEDGKAEENMAQRRAALLEKRMRREKESQMRKMELEAELEQKKEGARYANLQLSFVKIKSQYKNKKFPEYTKLKAEEERVKKEEEKARKEFIKQEYLRRKQLKLMEDMDTIIKPRPAKQKRGRPKSIHRDSMDSPKTPVRAPTGSRQRFFSVSSLSLASLTLGDSDSVHSDKRAPSRPDSANGFLSPTRSSSRNGEKDWENASTTSSVTSNTEYTGPRLYKEPSAKSNKHIIQNALAHCCLAGKVNEGQKNKILEEMEKSEANNFLVLFRDSGCQFRSLYTYCPETQEINKLTGIGPKSITRKMIDGLYKYNSDKKQFSQIPAKTMSASVDAVTIHNHLWQTKKPATPKKVVPAQS
					

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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	36.9	Very low	30.5	Very low	258 Å²	258	146.6 Å²	146.6	100%	1.271	78%	0.783	S	S	*	*				0	144.8	0	-63.5	176.3	-177.9	0	0	107.3
2	G	31.3	Very low	31.3	Very low	64 Å²	64	150 Å²	150	66%	0.66	79%	0.785	S	S	*	*			trans	-158.6	132	170.3	0	0	0	0	0	106.5
3	E	26.9	Very low	31.8	Very low	198 Å²	198	146.8 Å²	146.8	93%	0.925	78%	0.783	S	S	*	*			trans	-73.5	135.7	-174.9	-68	-179.2	109.6	0	0	110.5	Q5	E3-Q5 PolarHBondContact O-N 2.98Å
4	V	29.2	Very low	33.1	Very low	107 Å²	107	141.4 Å²	141.4	65%	0.648	75%	0.749	S	S	*	*			trans	-84.9	97.9	173.9	177.8	0	0	0	0	107	D6	V4-D6 PolarHBondContact O-N 3.46Å
5	Q	28.9	Very low	34.3	Very low	177 Å²	177	139.9 Å²	139.9	83%	0.827	75%	0.748	S	S	*	*			trans	-71.6	116.6	173.3	-158.6	119	27.5	0	0	109	E3 V7	E3-Q5 PolarHBondContact O-N 2.98Å; Q5-V7 PolarHBondContact O-N 3.31Å; Q5-V7 VanDerWaalsContact O-N 3.11Å
6	D	26.1	Very low	35.3	Very low	104 Å²	104	134.6 Å²	134.6	56%	0.556	73%	0.729	S	S	*	*			trans	-76.4	94.2	-173.4	-164.5	-12.9	0	0	0	110.4	V4 R8	V4-D6 PolarHBondContact O-N 3.46Å; D6-R8 PolarHBondContact O-N 2.97Å; D6-R8 IonicContact OD1-CZ 3.44Å; D6-R8 IonicContact OD1-NE 3.57Å; D6-R8 PolarHBondContact OD1-NE 3.46Å; D6-R8 IonicContact OD1-NH2 2.71Å; D6-R8 PolarHBondContact OD1-NH2 2.73Å; D6-R8 IonicContact OD2-CZ 3.5Å; D6-R8 IonicContact OD2-NE 3.54Å; D6-R8 IonicContact OD2-NH2 2.74Å; D6-R8 PolarHBondContact OD2-NH2 3.29Å
7	V	30	Very low	37	Very low	141 Å²	141	129.7 Å²	129.7	86%	0.855	71%	0.706	S	S	*	*			trans	-81.4	84.4	178.3	-174.8	0	0	0	0	109.5	Q5	Q5-V7 PolarHBondContact O-N 3.31Å; Q5-V7 VanDerWaalsContact O-N 3.11Å
8	R	28.8	Very low	38.1	Very low	177 Å²	177	128.6 Å²	128.6	67%	0.668	72%	0.717	S	S	*	*			trans	-120.9	144.9	168.8	-87.2	-175.4	-83.3	-177.6	0.6	112	D6 A10	D6-R8 PolarHBondContact O-N 2.97Å; D6-R8 IonicContact OD1-CZ 3.44Å; D6-R8 IonicContact OD1-NE 3.57Å; D6-R8 PolarHBondContact OD1-NE 3.46Å; D6-R8 IonicContact OD1-NH2 2.71Å; D6-R8 PolarHBondContact OD1-NH2 2.73Å; D6-R8 IonicContact OD2-CZ 3.5Å; D6-R8 IonicContact OD2-NE 3.54Å; D6-R8 IonicContact OD2-NH2 2.74Å; D6-R8 PolarHBondContact OD2-NH2 3.29Å; R8-A10 PolarHBondContact O-N 2.95Å
9	D	32.3	Very low	39.9	Very low	131 Å²	131	124 Å²	124	70%	0.701	69%	0.69	S	S	*	*			trans	59.8	43.8	156.1	-52.6	-35.7	0	0	0	118.4	K11	D9-K11 PolarHBondContact O-N 3.25Å
10	A	29.5	Very low	41.5	Very low	98 Å²	98	123.4 Å²	123.4	81%	0.81	68%	0.68	S	S	*	*			trans	-70.1	70.2	144.6	0	0	0	0	0	109.7	R8 K12	R8-A10 PolarHBondContact O-N 2.95Å; A10-K12 PolarHBondContact O-N 2.98Å
11	K	35.8	Very low	42.7	Very low	158 Å²	158	120.3 Å²	120.3	69%	0.687	67%	0.667	S	S	*	*			trans	-59.8	110.2	173.3	-75.2	-164.7	172.7	-163.1	0	108.6	D9 S13	D9-K11 PolarHBondContact O-N 3.25Å; K11-S13 PolarHBondContact O-N 3.25Å; K11-S13 VanDerWaalsContact O-N 3.12Å
12	K	40.4	Very low	44.3	Very low	187 Å²	187	114 Å²	114	81%	0.813	63%	0.633	S	S	*	*			trans	-51.5	120.5	174.2	-70.3	178.9	-179.6	173.9	0	108.3	A10 F14	A10-K12 PolarHBondContact O-N 2.98Å; K12-F14 PolarHBondContact O-N 3Å
13	S	37.4	Very low	45.6	Very low	108 Å²	108	119.1 Å²	119.1	76%	0.755	64%	0.64	S	S	*	*			trans	-62.8	106.4	175.3	51.7	0	0	0	0	109.1	K11 V15	K11-S13 PolarHBondContact O-N 3.25Å; K11-S13 VanDerWaalsContact O-N 3.12Å; S13-V15 PolarHBondContact O-N 3.3Å
14	F	50.2	Low	47.4	Very low	71 Å²	71	116.1 Å²	116.1	31%	0.311	63%	0.625	S	S	.	*			trans	-69.2	96.3	177.4	178.5	-105.3	0	0	0	109.7	K12 A16 L268 Y269 Q272	K12-F14 PolarHBondContact O-N 3Å; F14-A16 HydrophobicContact CE1-CB 3.94Å; F14-A16 HydrophobicContact CZ-CB 4.44Å; F14-A16 PolarHBondContact O-N 3.48Å; F14-L268 HydrophobicContact CZ-CB 4.02Å; F14-Y269 HydrophobicContact CB-CD2 4.06Å; F14-Y269 HydrophobicContact CD1-CD2 4.4Å; F14-Y269 AromaticContact CD2-CD2 3.82Å; F14-Y269 HydrophobicContact CD2-CD2 3.82Å; F14-Y269 HydrophobicContact CE2-CD2 4.36Å; F14-Y269 AromaticContact CG-CD2 3.83Å; F14-Y269 HydrophobicContact CG-CD2 3.83Å; F14-Q272 HydrophobicContact CE2-CB 4.29Å
15	V	51.1	Low	49.8	Very low	120 Å²	120	112.3 Å²	112.3	73%	0.727	60%	0.599	S	S	*	*			trans	-78	114.1	163.3	-178.1	0	0	0	0	106.3	S13 P17	S13-V15 PolarHBondContact O-N 3.3Å; V15-P17 WeakPolarHBondContact O-CD 3.35Å
16	A	51	Low	52.1	Low	55 Å²	55	107.6 Å²	107.6	46%	0.455	58%	0.58	S	S	.	*			trans	-60	123.2	179.4	0	0	0	0	0	110	F14	F14-A16 HydrophobicContact CE1-CB 3.94Å; F14-A16 HydrophobicContact CZ-CB 4.44Å; F14-A16 PolarHBondContact O-N 3.48Å
17	P	63.5	Low	54.8	Low	51 Å²	51	105.9 Å²	105.9	33%	0.331	57%	0.568	S	S	.	*			trans	-60.3	143.2	-179.8	-28.2	38.4	0	0	0	112.6	V15 I19 L290	V15-P17 WeakPolarHBondContact O-CD 3.35Å; P17-I19 WeakPolarHBondContact O-CG1 3.49Å; P17-I19 PolarHBondContact O-N 3.18Å; P17-L290 HydrophobicContact CB-CD1 4.18Å; P17-L290 HydrophobicContact CG-CD1 3.72Å
18	A	56.8	Low	57.3	Low	109 Å²	109	102.4 Å²	102.4	90%	0.901	55%	0.55	S	S	*	.			trans	-73	95	178.8	0	0	0	0	0	110.6
19	I	71.4	Confident	59.8	Low	42 Å²	42	98.3 Å²	98.3	22%	0.215	53%	0.534	C	S	.	.	P	Polyproline II helix	trans	-89.2	133.3	-173.8	-73.9	148.8	0	0	0	111.1	P17 S21 L268 E291	P17-I19 WeakPolarHBondContact O-CG1 3.49Å; P17-I19 PolarHBondContact O-N 3.18Å; I19-S21 PolarHBondContact O-N 3.46Å; I19-L268 HydrophobicContact CD1-CD1 3.19Å; I19-L268 HydrophobicContact CD1-CD2 3.37Å; I19-L268 HydrophobicContact CD1-CG 3.87Å; I19-E291 HydrophobicContact CB-CG 4.39Å; I19-E291 HydrophobicContact CG1-CG 4.08Å; I19-E291 HydrophobicContact CG2-CG 3.82Å
20	K	71.9	Confident	62.2	Low	112 Å²	112	92.2 Å²	92.2	49%	0.487	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-59.8	132.8	172.3	-60.8	-168.7	178.5	-167.2	0	109.3	Y295	K20-Y295 PolarHBondContact O-OH 3.31Å
21	S	68.4	Low	65	Low	58 Å²	58	88.4 Å²	88.4	41%	0.406	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-62.9	157.3	177.1	75.4	0	0	0	0	110.9	I19 E23 H24 Y25	I19-S21 PolarHBondContact O-N 3.46Å; S21-E23 PolarHBondContact O-N 2.94Å; S21-H24 CarbonylContact O-C 3.55Å; S21-H24 WeakPolarHBondContact O-CA 3.46Å; S21-H24 PolarHBondContact O-N 3.43Å; S21-H24 PolarHBondContact OG-ND1 3.07Å; S21-Y25 PolarHBondContact O-N 2.84Å
22	F	69.1	Low	67.4	Low	127 Å²	127	82.1 Å²	82.1	56%	0.557	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-53.2	-32.5	-177.2	-179.8	-95	0	0	0	113.5	H24 Y25 F27 Y295	F22-H24 VanDerWaalsContact C-N 3.29Å; F22-H24 PolarHBondContact O-N 2.87Å; F22-Y25 PolarHBondContact O-N 2.78Å; F22-F27 HydrophobicContact CD2-CZ 4.36Å; F22-F27 HydrophobicContact CE2-CE1 4.39Å; F22-F27 AromaticContact CE2-CZ 3.71Å; F22-F27 HydrophobicContact CE2-CZ 3.71Å; F22-F27 AromaticContact CZ-CZ 3.91Å; F22-F27 HydrophobicContact CZ-CZ 3.91Å; F22-Y295 HydrophobicContact CB-CE1 4.19Å; F22-Y295 AromaticContact CD2-CD1 3.86Å; F22-Y295 HydrophobicContact CD2-CD1 3.86Å; F22-Y295 AromaticContact CD2-CE1 3.9Å; F22-Y295 HydrophobicContact CD2-CE1 3.9Å; F22-Y295 HydrophobicContact CD2-CG 4.5Å; F22-Y295 PolarHBondContact N-OH 3.23Å
23	E	58.9	Low	69.5	Low	171 Å²	171	73.8 Å²	73.8	80%	0.799	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-71.2	-21.6	178.2	-60.4	177.2	149.9	0	0	113.4	S21	S21-E23 PolarHBondContact O-N 2.94Å
24	H	65.4	Low	71.8	Confident	134 Å²	134	68.7 Å²	68.7	62%	0.62	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-107.3	16	179.3	-58.6	83.5	0	0	0	112.2	S21 F22	S21-H24 CarbonylContact O-C 3.55Å; S21-H24 WeakPolarHBondContact O-CA 3.46Å; S21-H24 PolarHBondContact O-N 3.43Å; S21-H24 PolarHBondContact OG-ND1 3.07Å; F22-H24 VanDerWaalsContact C-N 3.29Å; F22-H24 PolarHBondContact O-N 2.87Å
25	Y	78.1	Confident	73.6	Confident	27 Å²	27	65.3 Å²	65.3	11%	0.106	36%	0.356	C	S	.	.			trans	-100.8	106.4	-177.9	-173.5	-94.9	0	0	0	112.1	S21 F22 F27 A30 E291 D292 Y295	S21-Y25 PolarHBondContact O-N 2.84Å; F22-Y25 PolarHBondContact O-N 2.78Å; Y25-F27 AromaticContact CD1-CD1 3.67Å; Y25-F27 HydrophobicContact CD1-CD1 3.67Å; Y25-F27 AromaticContact CD1-CE1 3.58Å; Y25-F27 HydrophobicContact CD1-CE1 3.58Å; Y25-F27 HydrophobicContact CD1-CE2 4.43Å; Y25-F27 HydrophobicContact CD1-CG 4.17Å; Y25-F27 AromaticContact CD1-CZ 3.97Å; Y25-F27 HydrophobicContact CD1-CZ 3.97Å; Y25-F27 AromaticContact CE1-CD1 3.65Å; Y25-F27 HydrophobicContact CE1-CD1 3.65Å; Y25-F27 AromaticContact CE1-CE1 3.86Å; Y25-F27 HydrophobicContact CE1-CE1 3.86Å; Y25-F27 HydrophobicContact CE1-CG 4.33Å; Y25-F27 PolarHBondContact O-N 3.46Å; Y25-A30 HydrophobicContact CE1-CB 4.05Å; Y25-A30 VanDerWaalsContact OH-CB 3.22Å; Y25-A30 WeakPolarHBondContact OH-CB 3.48Å; Y25-E291 HydrophobicContact CD2-CB 4.06Å; Y25-E291 HydrophobicContact CE2-CB 3.52Å; Y25-D292 VanDerWaalsContact OH-CA 3.32Å; Y25-D292 WeakPolarHBondContact OH-CA 3.46Å; Y25-D292 PolarHBondContact OH-N 3.38Å; Y25-D292 PolarHBondContact OH-OD1 3.05Å; Y25-D292 VanDerWaalsContact OH-OD1 3.07Å; Y25-Y295 AromaticContact CD1-CD2 3.97Å; Y25-Y295 HydrophobicContact CD1-CD2 3.97Å; Y25-Y295 AromaticContact CD2-CD2 3.68Å; Y25-Y295 HydrophobicContact CD2-CD2 3.68Å; Y25-Y295 AromaticContact CD2-CE2 3.83Å; Y25-Y295 HydrophobicContact CD2-CE2 3.83Å; Y25-Y295 HydrophobicContact CE1-CD2 4.15Å; Y25-Y295 AromaticContact CE2-CD2 3.9Å; Y25-Y295 HydrophobicContact CE2-CD2 3.9Å; Y25-Y295 HydrophobicContact CE2-CE2 4.39Å; Y25-Y295 AromaticContact CG-CD2 3.72Å; Y25-Y295 HydrophobicContact CG-CD2 3.72Å; Y25-Y295 AromaticContact CG-CE2 3.95Å; Y25-Y295 HydrophobicContact CG-CE2 3.95Å
26	D	78.9	Confident	75.3	Confident	79 Å²	79	59.6 Å²	59.6	42%	0.422	32%	0.321	S	S	.	.			trans	-81.6	102	177.4	179.9	4.7	0	0	0	112.4	S28 R29 A30	D26-S28 PolarHBondContact O-N 3.47Å; D26-S28 WeakPolarHBondContact OD1-CA 3.45Å; D26-S28 VanDerWaalsContact OD1-CB 3.3Å; D26-S28 WeakPolarHBondContact OD1-CB 3.4Å; D26-S28 PolarHBondContact OD1-N 2.86Å; D26-S28 PolarHBondContact OD1-OG 3.03Å; D26-S28 PolarHBondContact OD2-OG 3.25Å; D26-R29 HydrophobicContact CB-CB 3.9Å; D26-R29 PolarHBondContact OD1-N 3.09Å; D26-R29 WeakPolarHBondContact OD2-CB 3.49Å; D26-R29 PolarHBondContact OD2-N 3.3Å; D26-A30 VanDerWaalsContact O-CB 3.23Å; D26-A30 WeakPolarHBondContact O-CB 3.5Å; D26-A30 PolarHBondContact O-N 2.96Å
27	F	82.1	Confident	77	Confident	67 Å²	67	60.3 Å²	60.3	29%	0.294	31%	0.312	S	S	.	.	H	α-helix	trans	-59.8	-22.9	174.9	-57.9	-77.3	0	0	0	114.9	F22 Y25 K31 S297	F22-F27 HydrophobicContact CD2-CZ 4.36Å; F22-F27 HydrophobicContact CE2-CE1 4.39Å; F22-F27 AromaticContact CE2-CZ 3.71Å; F22-F27 HydrophobicContact CE2-CZ 3.71Å; F22-F27 AromaticContact CZ-CZ 3.91Å; F22-F27 HydrophobicContact CZ-CZ 3.91Å; Y25-F27 AromaticContact CD1-CD1 3.67Å; Y25-F27 HydrophobicContact CD1-CD1 3.67Å; Y25-F27 AromaticContact CD1-CE1 3.58Å; Y25-F27 HydrophobicContact CD1-CE1 3.58Å; Y25-F27 HydrophobicContact CD1-CE2 4.43Å; Y25-F27 HydrophobicContact CD1-CG 4.17Å; Y25-F27 AromaticContact CD1-CZ 3.97Å; Y25-F27 HydrophobicContact CD1-CZ 3.97Å; Y25-F27 AromaticContact CE1-CD1 3.65Å; Y25-F27 HydrophobicContact CE1-CD1 3.65Å; Y25-F27 AromaticContact CE1-CE1 3.86Å; Y25-F27 HydrophobicContact CE1-CE1 3.86Å; Y25-F27 HydrophobicContact CE1-CG 4.33Å; Y25-F27 PolarHBondContact O-N 3.46Å; F27-K31 WeakPolarHBondContact O-CB 3.49Å; F27-K31 PolarHBondContact O-N 3.38Å; F27-S297 WeakPolarHBondContact CD1-OG 3.42Å
28	S	82	Confident	78.1	Confident	69 Å²	69	58.2 Å²	58.2	48%	0.483	30%	0.298	S	S	.	.	H	α-helix	trans	-83.8	-49.5	-179.6	78	0	0	0	0	111.2	D26 A30 K31 I32	D26-S28 PolarHBondContact O-N 3.47Å; D26-S28 WeakPolarHBondContact OD1-CA 3.45Å; D26-S28 VanDerWaalsContact OD1-CB 3.3Å; D26-S28 WeakPolarHBondContact OD1-CB 3.4Å; D26-S28 PolarHBondContact OD1-N 2.86Å; D26-S28 PolarHBondContact OD1-OG 3.03Å; D26-S28 PolarHBondContact OD2-OG 3.25Å; S28-A30 VanDerWaalsContact C-N 3.33Å; S28-A30 PolarHBondContact O-N 3.41Å; S28-K31 WeakPolarHBondContact O-CB 3.47Å; S28-K31 PolarHBondContact O-N 3.4Å; S28-I32 VanDerWaalsContact O-CG1 3.32Å; S28-I32 WeakPolarHBondContact O-CG1 3.45Å; S28-I32 PolarHBondContact O-N 3.31Å
29	R	82.6	Confident	79.6	Confident	90 Å²	90	53 Å²	53	34%	0.34	26%	0.255	S	S	.	.	H	α-helix	trans	-54.2	-46.8	167.7	173.7	-169.7	179	-82.5	0.9	112	D26 K31 I32 C33 E66	D26-R29 HydrophobicContact CB-CB 3.9Å; D26-R29 PolarHBondContact OD1-N 3.09Å; D26-R29 WeakPolarHBondContact OD2-CB 3.49Å; D26-R29 PolarHBondContact OD2-N 3.3Å; R29-K31 PolarHBondContact O-N 3.2Å; R29-I32 PolarHBondContact O-N 3.27Å; R29-C33 WeakPolarHBondContact O-CB 3.48Å; R29-C33 PolarHBondContact O-N 2.94Å; R29-E66 IonicContact CZ-OE1 2.85Å; R29-E66 VanDerWaalsContact CZ-OE1 3.29Å; R29-E66 IonicContact CZ-OE2 3.56Å; R29-E66 IonicContact NE-OE1 2.66Å; R29-E66 PolarHBondContact NE-OE1 3.24Å; R29-E66 IonicContact NE-OE2 2.68Å; R29-E66 PolarHBondContact NE-OE2 3.26Å; R29-E66 IonicContact NH2-OE1 2.6Å; R29-E66 PolarHBondContact NH2-OE1 3.46Å; R29-E66 IonicContact NH2-OE2 2.67Å; R29-E66 PolarHBondContact NH2-OE2 2.69Å
30	A	82.8	Confident	80.3	Confident	4 Å²	4	51.2 Å²	51.2	3%	0.033	25%	0.246	C	C	.	.	H	α-helix	trans	-53	-51.4	175.2	0	0	0	0	0	112.2	Y25 D26 S28 I32 C33 C34 D292	Y25-A30 HydrophobicContact CE1-CB 4.05Å; Y25-A30 VanDerWaalsContact OH-CB 3.22Å; Y25-A30 WeakPolarHBondContact OH-CB 3.48Å; D26-A30 VanDerWaalsContact O-CB 3.23Å; D26-A30 WeakPolarHBondContact O-CB 3.5Å; D26-A30 PolarHBondContact O-N 2.96Å; S28-A30 VanDerWaalsContact C-N 3.33Å; S28-A30 PolarHBondContact O-N 3.41Å; A30-I32 PolarHBondContact O-N 3.45Å; A30-C33 PolarHBondContact O-N 3.35Å; A30-C34 WeakPolarHBondContact O-CB 3.46Å; A30-C34 PolarHBondContact O-N 3.46Å; A30-C34 PolarHBondContact O-SG 2.65Å; A30-D292 WeakPolarHBondContact CB-OD1 3.44Å
31	K	87.2	Confident	80.9	Confident	17 Å²	17	46.8 Å²	46.8	7%	0.074	23%	0.229	C	C	.	.	H	α-helix	trans	-58.2	-48.8	175.4	171.5	56.7	173.4	-179.5	0	112.1	F27 S28 R29 S35 L138 D142 T299 I300	F27-K31 WeakPolarHBondContact O-CB 3.49Å; F27-K31 PolarHBondContact O-N 3.38Å; S28-K31 WeakPolarHBondContact O-CB 3.47Å; S28-K31 PolarHBondContact O-N 3.4Å; R29-K31 PolarHBondContact O-N 3.2Å; K31-S35 PolarHBondContact NZ-OG 2.94Å; K31-S35 VanDerWaalsContact O-CB 3.28Å; K31-S35 WeakPolarHBondContact O-CB 3.48Å; K31-S35 PolarHBondContact O-N 3.38Å; K31-S35 PolarHBondContact O-OG 3.06Å; K31-S35 VanDerWaalsContact O-OG 3.1Å; K31-L138 HydrophobicContact CG-CD1 4.38Å; K31-L138 HydrophobicContact CG-CD2 4.46Å; K31-D142 IonicContact NZ-OD1 2.57Å; K31-D142 PolarHBondContact NZ-OD1 2.98Å; K31-D142 IonicContact NZ-OD2 3.42Å; K31-D142 PolarHBondContact NZ-OD2 3.44Å; K31-T299 WeakPolarHBondContact CD-O 3.34Å; K31-I300 HydrophobicContact CB-CG2 4.39Å
32	I	86.8	Confident	81.6	Confident	27 Å²	27	45.7 Å²	45.7	14%	0.138	22%	0.217	C	C	.	.	H	α-helix	trans	-61.2	-46.7	179.3	-64.2	159.8	0	0	0	110.8	S28 R29 A30 S35 L36 F58 M134 L138	S28-I32 VanDerWaalsContact O-CG1 3.32Å; S28-I32 WeakPolarHBondContact O-CG1 3.45Å; S28-I32 PolarHBondContact O-N 3.31Å; R29-I32 PolarHBondContact O-N 3.27Å; A30-I32 PolarHBondContact O-N 3.45Å; I32-S35 PolarHBondContact O-N 2.73Å; I32-L36 HydrophobicContact CG2-CD1 3.63Å; I32-L36 HydrophobicContact CG2-CG 4.21Å; I32-L36 WeakPolarHBondContact O-CB 3.27Å; I32-L36 VanDerWaalsContact O-CG 3.3Å; I32-L36 WeakPolarHBondContact O-CG 3.14Å; I32-L36 PolarHBondContact O-N 3.29Å; I32-F58 HydrophobicContact CB-CZ 4.19Å; I32-F58 HydrophobicContact CG2-CE2 4.31Å; I32-F58 HydrophobicContact CG2-CZ 3.69Å; I32-M134 HydrophobicContact CD1-CG 3.82Å; I32-M134 HydrophobicContact CG1-CG 3.93Å; I32-M134 HydrophobicContact CG1-SD 4.24Å; I32-M134 HydrophobicContact CG2-CE 4.16Å; I32-M134 HydrophobicContact CG2-SD 4.13Å; I32-L138 HydrophobicContact CG1-CD1 3.94Å; I32-L138 HydrophobicContact CG1-CD2 4.21Å; I32-L138 HydrophobicContact CG1-CG 4.49Å
33	C	84.1	Confident	82.2	Confident	11 Å²	11	40.1 Å²	40.1	7%	0.074	19%	0.194	C	C	.	.	H	α-helix	trans	-60.6	-53	-178.7	-165.7	0	0	0	0	112	R29 A30 S35 L36 R37 F58	R29-C33 WeakPolarHBondContact O-CB 3.48Å; R29-C33 PolarHBondContact O-N 2.94Å; A30-C33 PolarHBondContact O-N 3.35Å; C33-S35 PolarHBondContact O-N 3.38Å; C33-L36 PolarHBondContact O-N 3.38Å; C33-R37 WeakPolarHBondContact O-CB 3.37Å; C33-R37 WeakPolarHBondContact O-CG 3.24Å; C33-R37 PolarHBondContact O-N 3.49Å; C33-F58 HydrophobicContact CB-CD2 4.47Å; C33-F58 HydrophobicContact CB-CE2 3.83Å
34	C	85.9	Confident	83.1	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.007	17%	0.166	C	C	.	.	H	α-helix	trans	-58.1	-47.5	177.4	-72.7	0	0	0	0	112.1	A30 W38 F288 D292	A30-C34 WeakPolarHBondContact O-CB 3.46Å; A30-C34 PolarHBondContact O-N 3.46Å; A30-C34 PolarHBondContact O-SG 2.65Å; C34-W38 WeakPolarHBondContact O-CB 3.45Å; C34-W38 PolarHBondContact O-N 3.01Å; C34-F288 HydrophobicContact CB-CD1 4.45Å; C34-F288 HydrophobicContact CB-CE1 4.48Å; C34-F288 VanDerWaalsContact SG-CD1 3.5Å; C34-D292 PolarHBondContact SG-OD1 3.2Å; C34-D292 VanDerWaalsContact SG-OD1 3.34Å; C34-D292 PolarHBondContact SG-OD2 3.45Å; C34-D292 VanDerWaalsContact SG-OD2 3.4Å
35	S	87.8	Confident	83.1	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-72.1	-31.5	-174.7	-63.8	0	0	0	0	113.2	K31 I32 C33 L39 N303	K31-S35 PolarHBondContact NZ-OG 2.94Å; K31-S35 VanDerWaalsContact O-CB 3.28Å; K31-S35 WeakPolarHBondContact O-CB 3.48Å; K31-S35 PolarHBondContact O-N 3.38Å; K31-S35 PolarHBondContact O-OG 3.06Å; K31-S35 VanDerWaalsContact O-OG 3.1Å; I32-S35 PolarHBondContact O-N 2.73Å; C33-S35 PolarHBondContact O-N 3.38Å; S35-L39 WeakPolarHBondContact O-CB 3.16Å; S35-L39 PolarHBondContact O-N 2.87Å; S35-L39 VanDerWaalsContact O-N 3.14Å; S35-N303 WeakPolarHBondContact CA-OD1 3.29Å; S35-N303 PolarHBondContact OG-ND2 3.33Å; S35-N303 PolarHBondContact OG-OD1 2.96Å
36	L	87.4	Confident	82.1	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-76.1	-42.4	172.7	-68.8	179.8	0	0	0	112.7	I32 C33 W38 L39 V40 P57 L68 V72 L76 I141	I32-L36 HydrophobicContact CG2-CD1 3.63Å; I32-L36 HydrophobicContact CG2-CG 4.21Å; I32-L36 WeakPolarHBondContact O-CB 3.27Å; I32-L36 VanDerWaalsContact O-CG 3.3Å; I32-L36 WeakPolarHBondContact O-CG 3.14Å; I32-L36 PolarHBondContact O-N 3.29Å; C33-L36 PolarHBondContact O-N 3.38Å; L36-W38 VanDerWaalsContact C-N 3.29Å; L36-W38 PolarHBondContact O-N 3.34Å; L36-L39 HydrophobicContact CD2-CD2 4.5Å; L36-L39 PolarHBondContact O-N 3.17Å; L36-L39 VanDerWaalsContact O-N 3.14Å; L36-V40 WeakPolarHBondContact O-CG2 3.09Å; L36-V40 PolarHBondContact O-N 3.14Å; L36-P57 HydrophobicContact CB-CB 4.23Å; L36-P57 HydrophobicContact CB-CG 4.28Å; L36-P57 HydrophobicContact CD1-CB 4.15Å; L36-L68 HydrophobicContact CD1-CD1 3.5Å; L36-L68 HydrophobicContact CD1-CD2 4.32Å; L36-V72 HydrophobicContact CD1-CG1 4.37Å; L36-L76 HydrophobicContact CD2-CD1 3.88Å; L36-L76 HydrophobicContact CD2-CD2 3.91Å; L36-L76 HydrophobicContact CD2-CG 4.44Å; L36-I141 HydrophobicContact CD2-CD1 3.82Å
37	R	85.5	Confident	80.9	Confident	69 Å²	69	31.2 Å²	31.2	26%	0.26	17%	0.167	S	C	.	.	H	α-helix	trans	-57.4	-43.4	174.2	-79.1	175.9	169	162.2	-2.5	111.4	C33 S41 D56 P57 H287	C33-R37 WeakPolarHBondContact O-CB 3.37Å; C33-R37 WeakPolarHBondContact O-CG 3.24Å; C33-R37 PolarHBondContact O-N 3.49Å; R37-S41 VanDerWaalsContact O-CB 3.24Å; R37-S41 WeakPolarHBondContact O-CB 3.35Å; R37-S41 PolarHBondContact O-N 2.93Å; R37-D56 IonicContact CZ-OD1 3.55Å; R37-D56 IonicContact NE-OD1 3.64Å; R37-D56 IonicContact NH2-OD1 2.86Å; R37-D56 PolarHBondContact NH2-OD1 3.39Å; R37-P57 HydrophobicContact CG-CG 4.41Å; R37-H287 HydrophobicContact CB-CB 4.04Å
38	W	87.9	Confident	79.4	Confident	7 Å²	7	35.9 Å²	35.9	3%	0.027	20%	0.195	C	C	.	.	H	α-helix	trans	-61.8	-45.6	172.9	179.6	82.2	0	0	0	113	C34 L36 V40 S41 K42 I89 I141 L144 M145 Y148 H287 V306 E310	C34-W38 WeakPolarHBondContact O-CB 3.45Å; C34-W38 PolarHBondContact O-N 3.01Å; L36-W38 VanDerWaalsContact C-N 3.29Å; L36-W38 PolarHBondContact O-N 3.34Å; W38-V40 PolarHBondContact O-N 3.46Å; W38-S41 WeakPolarHBondContact O-CB 3.29Å; W38-S41 PolarHBondContact O-N 2.94Å; W38-K42 HydrophobicContact CD2-CG 3.99Å; W38-K42 VanDerWaalsContact CE2-CG 3.47Å; W38-K42 HydrophobicContact CE3-CG 4.46Å; W38-K42 HydrophobicContact CH2-CG 4.15Å; W38-K42 HydrophobicContact CZ2-CD 4.45Å; W38-K42 HydrophobicContact CZ2-CG 3.58Å; W38-K42 PolarHBondContact O-N 3.45Å; W38-I89 HydrophobicContact CH2-CD1 3.74Å; W38-I89 HydrophobicContact CZ2-CD1 4.38Å; W38-I141 HydrophobicContact CE3-CG2 4.29Å; W38-I141 HydrophobicContact CZ3-CG2 4.42Å; W38-L144 HydrophobicContact CZ3-CB 4.44Å; W38-M145 HydrophobicContact CB-CE 3.89Å; W38-M145 HydrophobicContact CD2-CE 3.61Å; W38-M145 HydrophobicContact CD2-CG 4.04Å; W38-M145 HydrophobicContact CE3-CE 3.39Å; W38-M145 HydrophobicContact CE3-CG 3.67Å; W38-M145 HydrophobicContact CE3-SD 4.45Å; W38-M145 HydrophobicContact CG-CE 3.83Å; W38-M145 HydrophobicContact CH2-CB 4.31Å; W38-M145 HydrophobicContact CH2-CG 3.65Å; W38-M145 HydrophobicContact CZ2-CG 4.03Å; W38-M145 HydrophobicContact CZ3-CB 4.48Å; W38-M145 HydrophobicContact CZ3-CE 4.12Å; W38-M145 HydrophobicContact CZ3-CG 3.46Å; W38-M145 VanDerWaalsContact CZ3-CG 3.46Å; W38-Y148 AromaticContact CZ2-CD1 3.8Å; W38-Y148 HydrophobicContact CZ2-CD1 3.8Å; W38-Y148 HydrophobicContact CZ2-CG 4.08Å; W38-H287 AromaticContact CD1-CD2 3.75Å; W38-V306 HydrophobicContact CZ2-CG1 3.92Å; W38-E310 PolarHBondContact NE1-OE1 2.86Å
39	L	87.4	Confident	78.1	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61.7	-43.7	-179.8	179.9	71	0	0	0	111.7	S35 L36 K42 A43 L76 L81 Y82 A85 I141 L144	S35-L39 WeakPolarHBondContact O-CB 3.16Å; S35-L39 PolarHBondContact O-N 2.87Å; S35-L39 VanDerWaalsContact O-N 3.14Å; L36-L39 HydrophobicContact CD2-CD2 4.5Å; L36-L39 PolarHBondContact O-N 3.17Å; L36-L39 VanDerWaalsContact O-N 3.14Å; L39-K42 PolarHBondContact O-N 2.95Å; L39-A43 VanDerWaalsContact O-CB 3.26Å; L39-A43 WeakPolarHBondContact O-CB 3.44Å; L39-A43 PolarHBondContact O-N 3.49Å; L39-L76 HydrophobicContact CD2-CD2 3.94Å; L39-L81 HydrophobicContact CD2-CB 3.79Å; L39-L81 HydrophobicContact CD2-CD1 4.19Å; L39-L81 HydrophobicContact CG-CB 4.05Å; L39-Y82 HydrophobicContact CD1-CD1 3.89Å; L39-Y82 HydrophobicContact CD1-CE1 4.2Å; L39-Y82 HydrophobicContact CD2-CD1 3.85Å; L39-Y82 HydrophobicContact CD2-CE1 3.5Å; L39-A85 HydrophobicContact CD1-CB 3.89Å; L39-I141 HydrophobicContact CD2-CD1 4.09Å; L39-I141 HydrophobicContact CD2-CG1 4.08Å; L39-L144 HydrophobicContact CD1-CD1 4.29Å
40	V	85.8	Confident	77.4	Confident	4 Å²	4	32.2 Å²	32.2	2%	0.024	18%	0.18	C	C	.	.	H	α-helix	trans	-63.8	-48.5	176	173.4	0	0	0	0	110.4	L36 W38 K42 A43 Y44 I50 L54 L81	L36-V40 WeakPolarHBondContact O-CG2 3.09Å; L36-V40 PolarHBondContact O-N 3.14Å; W38-V40 PolarHBondContact O-N 3.46Å; V40-K42 VanDerWaalsContact C-N 3.33Å; V40-K42 PolarHBondContact O-N 2.93Å; V40-A43 PolarHBondContact O-N 3.46Å; V40-A43 VanDerWaalsContact O-N 3.1Å; V40-Y44 HydrophobicContact CG1-CD2 3.91Å; V40-Y44 HydrophobicContact CG1-CE2 4.2Å; V40-Y44 WeakPolarHBondContact O-CD2 3.24Å; V40-Y44 PolarHBondContact O-N 3.41Å; V40-Y44 VanDerWaalsContact O-N 3.08Å; V40-I50 HydrophobicContact CG1-CD1 4.45Å; V40-I50 HydrophobicContact CG1-CG1 4.32Å; V40-I50 HydrophobicContact CG1-CG2 3.77Å; V40-L54 HydrophobicContact CG1-CB 4.14Å; V40-L81 HydrophobicContact CG2-CD1 4.46Å; V40-L81 HydrophobicContact CG2-CD2 4.16Å
41	S	84	Confident	76.7	Confident	19 Å²	19	34.9 Å²	34.9	13%	0.133	20%	0.197	C	C	.	.	H	α-helix	trans	-50.4	-49.1	173.4	169.1	0	0	0	0	112.4	R37 W38 G45 H287	R37-S41 VanDerWaalsContact O-CB 3.24Å; R37-S41 WeakPolarHBondContact O-CB 3.35Å; R37-S41 PolarHBondContact O-N 2.93Å; W38-S41 WeakPolarHBondContact O-CB 3.29Å; W38-S41 PolarHBondContact O-N 2.94Å; S41-G45 WeakPolarHBondContact O-CA 3.36Å; S41-G45 PolarHBondContact O-N 3.02Å; S41-H287 WeakPolarHBondContact CB-CE1 3.35Å; S41-H287 VanDerWaalsContact CB-NE2 3.29Å; S41-H287 WeakPolarHBondContact CB-NE2 3.47Å; S41-H287 PolarHBondContact OG-CE1 3.37Å; S41-H287 PolarHBondContact OG-NE2 2.72Å
42	K	83.8	Confident	75.5	Confident	35 Å²	35	38.2 Å²	38.2	15%	0.152	23%	0.228	C	C	.	.	H	α-helix	trans	-70.8	-32.1	176.5	-67.4	-44.6	-167.3	-155.9	0	114.6	W38 L39 V40 A85 L88 Y148 E310	W38-K42 HydrophobicContact CD2-CG 3.99Å; W38-K42 VanDerWaalsContact CE2-CG 3.47Å; W38-K42 HydrophobicContact CE3-CG 4.46Å; W38-K42 HydrophobicContact CH2-CG 4.15Å; W38-K42 HydrophobicContact CZ2-CD 4.45Å; W38-K42 HydrophobicContact CZ2-CG 3.58Å; W38-K42 PolarHBondContact O-N 3.45Å; L39-K42 PolarHBondContact O-N 2.95Å; V40-K42 VanDerWaalsContact C-N 3.33Å; V40-K42 PolarHBondContact O-N 2.93Å; K42-A85 HydrophobicContact CB-CB 4.14Å; K42-L88 WeakPolarHBondContact O-CD1 3.42Å; K42-Y148 PolarHBondContact NZ-OH 3.18Å; K42-E310 WeakPolarHBondContact CE-OE1 3.45Å; K42-E310 IonicContact NZ-OE1 2.83Å; K42-E310 PolarHBondContact NZ-OE1 3.43Å; K42-E310 IonicContact NZ-OE2 3.37Å; K42-E310 PolarHBondContact NZ-OE2 3.45Å
43	A	82.2	Confident	74.1	Confident	10 Å²	10	42.9 Å²	42.9	8%	0.083	25%	0.249	C	C	.	.	H	α-helix	trans	-72	-29.2	-179.8	0	0	0	0	0	113.3	L39 V40 L81 R84 A85	L39-A43 VanDerWaalsContact O-CB 3.26Å; L39-A43 WeakPolarHBondContact O-CB 3.44Å; L39-A43 PolarHBondContact O-N 3.49Å; V40-A43 PolarHBondContact O-N 3.46Å; V40-A43 VanDerWaalsContact O-N 3.1Å; A43-L81 HydrophobicContact CB-CD2 3.61Å; A43-R84 HydrophobicContact CB-CB 3.91Å; A43-A85 HydrophobicContact CB-CB 4.48Å
44	Y	77.9	Confident	73.3	Confident	52 Å²	52	42.6 Å²	42.6	20%	0.204	25%	0.247	C	C	.	.	H	α-helix	trans	-107.6	-19.1	-178.6	-68	-81.9	0	0	0	114.3	V40 T46 S49 I50 L54 L81	V40-Y44 HydrophobicContact CG1-CD2 3.91Å; V40-Y44 HydrophobicContact CG1-CE2 4.2Å; V40-Y44 WeakPolarHBondContact O-CD2 3.24Å; V40-Y44 PolarHBondContact O-N 3.41Å; V40-Y44 VanDerWaalsContact O-N 3.08Å; Y44-T46 PolarHBondContact O-N 2.87Å; Y44-S49 WeakPolarHBondContact CD1-O 3.36Å; Y44-S49 PolarHBondContact O-OG 2.84Å; Y44-I50 HydrophobicContact CD2-CG1 4.43Å; Y44-I50 HydrophobicContact CG-CG1 4.32Å; Y44-L54 HydrophobicContact CE2-CD1 3.91Å; Y44-L81 HydrophobicContact CE2-CD2 3.88Å
45	G	64.6	Low	72.2	Confident	48 Å²	48	47.2 Å²	47.2	50%	0.495	27%	0.267	S	S	.	.			trans	77.6	-21	166.9	0	0	0	0	0	117	S41	S41-G45 WeakPolarHBondContact O-CA 3.36Å; S41-G45 PolarHBondContact O-N 3.02Å
46	T	57.8	Low	71.4	Confident	67 Å²	67	50.9 Å²	50.9	41%	0.411	29%	0.286	S	S	.	.	S	Bend	trans	-146.8	143.6	178.1	32	0	0	0	0	110.7	Y44 N48 S49	Y44-T46 PolarHBondContact O-N 2.87Å; T46-N48 VanDerWaalsContact C-N 3.27Å; T46-N48 PolarHBondContact O-N 2.61Å; T46-S49 PolarHBondContact O-N 2.81Å; T46-S49 PolarHBondContact O-OG 3.48Å; T46-S49 PolarHBondContact OG1-OG 3.34Å
47	E	52.3	Low	70.6	Confident	58 Å²	58	51 Å²	51	27%	0.271	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-49	-47.1	174.2	-89.8	-90.4	-168.4	0	0	112.4	S49 I50 K55 S284	E47-S49 PolarHBondContact O-N 3.35Å; E47-I50 PolarHBondContact O-N 3.12Å; E47-I50 VanDerWaalsContact O-N 3.07Å; E47-K55 IonicContact OE1-NZ 3.98Å; E47-K55 PolarHBondContact OE1-NZ 2.73Å; E47-K55 IonicContact OE2-NZ 3.42Å; E47-K55 PolarHBondContact OE2-NZ 2.69Å; E47-S284 VanDerWaalsContact OE1-CB 3.26Å; E47-S284 WeakPolarHBondContact OE1-CB 3.46Å; E47-S284 PolarHBondContact OE1-OG 2.67Å
48	N	51.5	Low	70	Confident	165 Å²	165	49.5 Å²	49.5	88%	0.882	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-63.8	-10.4	-179	-58.8	64.3	0	0	0	115.3	T46	T46-N48 VanDerWaalsContact C-N 3.27Å; T46-N48 PolarHBondContact O-N 2.61Å
49	S	55.5	Low	69.4	Low	49 Å²	49	53.6 Å²	53.6	34%	0.343	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-110.2	3	177	49	0	0	0	0	113.5	Y44 T46 E47 P51	Y44-S49 WeakPolarHBondContact CD1-O 3.36Å; Y44-S49 PolarHBondContact O-OG 2.84Å; T46-S49 PolarHBondContact O-N 2.81Å; T46-S49 PolarHBondContact O-OG 3.48Å; T46-S49 PolarHBondContact OG1-OG 3.34Å; E47-S49 PolarHBondContact O-N 3.35Å; S49-P51 WeakPolarHBondContact O-CD 3.33Å
50	I	67.3	Low	68.6	Low	33 Å²	33	58 Å²	58	17%	0.169	33%	0.326	C	S	.	.	S	Bend	trans	-87.4	120.1	172.4	-61.6	169.5	0	0	0	108.8	V40 Y44 E47 A52 L54 K55	V40-I50 HydrophobicContact CG1-CD1 4.45Å; V40-I50 HydrophobicContact CG1-CG1 4.32Å; V40-I50 HydrophobicContact CG1-CG2 3.77Å; Y44-I50 HydrophobicContact CD2-CG1 4.43Å; Y44-I50 HydrophobicContact CG-CG1 4.32Å; E47-I50 PolarHBondContact O-N 3.12Å; E47-I50 VanDerWaalsContact O-N 3.07Å; I50-A52 PolarHBondContact O-N 3.33Å; I50-L54 HydrophobicContact CG2-CB 4.37Å; I50-K55 HydrophobicContact CG2-CB 4.43Å
51	P	68.7	Low	67.9	Low	59 Å²	59	60.1 Å²	60.1	38%	0.383	34%	0.337	S	S	.	.			trans	-57.7	135.1	169.9	-22.4	32.4	0	0	0	111.2	S49 E53 L54 K55	S49-P51 WeakPolarHBondContact O-CD 3.33Å; P51-E53 PolarHBondContact O-N 3.41Å; P51-E53 VanDerWaalsContact O-N 3.09Å; P51-L54 HydrophobicContact CB-CD1 4.39Å; P51-L54 HydrophobicContact CB-CG 4.28Å; P51-L54 HydrophobicContact CG-CD1 4Å; P51-L54 HydrophobicContact CG-CG 4.44Å; P51-L54 PolarHBondContact O-N 3.45Å; P51-K55 PolarHBondContact O-N 3.49Å
52	A	60.5	Low	67.1	Low	88 Å²	88	66.8 Å²	66.8	73%	0.727	37%	0.366	S	S	*	.	H	α-helix	trans	-54.7	-34.2	-176.9	0	0	0	0	0	113.1	I50 L54 K55	I50-A52 PolarHBondContact O-N 3.33Å; A52-L54 PolarHBondContact O-N 3.42Å; A52-K55 PolarHBondContact O-N 3.07Å
53	E	58.9	Low	66.4	Low	124 Å²	124	70.7 Å²	70.7	58%	0.579	38%	0.381	S	S	*	.	H	α-helix	trans	-55.7	-35.9	173.6	-66.6	174.5	-157.4	0	0	113.4	P51 K69 P71	P51-E53 PolarHBondContact O-N 3.41Å; P51-E53 VanDerWaalsContact O-N 3.09Å; E53-K69 WeakPolarHBondContact O-CD 3.5Å; E53-K69 PolarHBondContact O-NZ 2.73Å; E53-P71 WeakPolarHBondContact OE2-CG 3.44Å
54	L	65.8	Low	65.4	Low	6 Å²	6	78.6 Å²	78.6	3%	0.031	42%	0.416	C	S	.	.	H	α-helix	trans	-91.6	-8.2	-175.1	-57.1	-177.4	0	0	0	114	V40 Y44 I50 P51 A52 D56 P71 V72 L75	V40-L54 HydrophobicContact CG1-CB 4.14Å; Y44-L54 HydrophobicContact CE2-CD1 3.91Å; I50-L54 HydrophobicContact CG2-CB 4.37Å; P51-L54 HydrophobicContact CB-CD1 4.39Å; P51-L54 HydrophobicContact CB-CG 4.28Å; P51-L54 HydrophobicContact CG-CD1 4Å; P51-L54 HydrophobicContact CG-CG 4.44Å; P51-L54 PolarHBondContact O-N 3.45Å; A52-L54 PolarHBondContact O-N 3.42Å; L54-D56 VanDerWaalsContact C-N 3.35Å; L54-P71 HydrophobicContact CD2-CB 3.85Å; L54-V72 HydrophobicContact CD2-CG2 3.6Å; L54-L75 HydrophobicContact CD1-CD1 3.62Å; L54-L75 HydrophobicContact CD2-CD1 4.02Å
55	K	63.8	Low	64.6	Low	98 Å²	98	80.6 Å²	80.6	43%	0.426	43%	0.427	S	S	.	.	H	α-helix	trans	-66.6	-37.5	-178	-173.5	162.1	-175.4	160.4	0	112.3	E47 I50 P51 A52	E47-K55 IonicContact OE1-NZ 3.98Å; E47-K55 PolarHBondContact OE1-NZ 2.73Å; E47-K55 IonicContact OE2-NZ 3.42Å; E47-K55 PolarHBondContact OE2-NZ 2.69Å; I50-K55 HydrophobicContact CG2-CB 4.43Å; P51-K55 PolarHBondContact O-N 3.49Å; A52-K55 PolarHBondContact O-N 3.07Å
56	D	69.8	Low	64.9	Low	76 Å²	76	81.8 Å²	81.8	41%	0.406	42%	0.42	S	S	.	.	S	Bend	trans	-113.5	116.4	169.6	-71.9	-61.6	0	0	0	109.4	R37 L54 F58 K69	R37-D56 IonicContact CZ-OD1 3.55Å; R37-D56 IonicContact NE-OD1 3.64Å; R37-D56 IonicContact NH2-OD1 2.86Å; R37-D56 PolarHBondContact NH2-OD1 3.39Å; L54-D56 VanDerWaalsContact C-N 3.35Å; D56-F58 VanDerWaalsContact C-N 3.3Å; D56-F58 PolarHBondContact O-N 3.5Å; D56-K69 WeakPolarHBondContact O-CD 3.25Å; D56-K69 WeakPolarHBondContact O-CE 3.39Å; D56-K69 PolarHBondContact O-NZ 2.95Å
57	P	70.9	Confident	65.7	Low	3 Å²	3	82 Å²	82	2%	0.019	42%	0.416	C	S	.	.			trans	-73.7	-19	-170.5	25	-31.5	0	0	0	114.4	L36 R37 L68 K69 V72	L36-P57 HydrophobicContact CB-CB 4.23Å; L36-P57 HydrophobicContact CB-CG 4.28Å; L36-P57 HydrophobicContact CD1-CB 4.15Å; R37-P57 HydrophobicContact CG-CG 4.41Å; P57-L68 HydrophobicContact CB-CD1 3.93Å; P57-L68 WeakPolarHBondContact O-CD1 3.28Å; P57-K69 PolarHBondContact O-N 2.92Å; P57-V72 HydrophobicContact CB-CG2 4.43Å
58	F	74.3	Confident	67.1	Low	39 Å²	39	80.6 Å²	80.6	17%	0.171	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	157.8	-178.7	-64.7	-86.8	0	0	0	112.5	I32 C33 D56 E66 H67 L68 K69	I32-F58 HydrophobicContact CB-CZ 4.19Å; I32-F58 HydrophobicContact CG2-CE2 4.31Å; I32-F58 HydrophobicContact CG2-CZ 3.69Å; C33-F58 HydrophobicContact CB-CD2 4.47Å; C33-F58 HydrophobicContact CB-CE2 3.83Å; D56-F58 VanDerWaalsContact C-N 3.3Å; D56-F58 PolarHBondContact O-N 3.5Å; F58-E66 HydrophobicContact CD1-CB 4.41Å; F58-H67 CarbonylContact C-O 3.56Å; F58-H67 VanDerWaalsContact CA-O 3.29Å; F58-H67 WeakPolarHBondContact CA-O 3.47Å; F58-L68 HydrophobicContact CE1-CD1 4.41Å; F58-K69 VanDerWaalsContact O-CE 3.24Å; F58-K69 WeakPolarHBondContact O-CE 3.47Å
59	Y	74.3	Confident	68.5	Low	93 Å²	93	74.9 Å²	74.9	37%	0.365	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	144.6	161.1	69.5	-74.9	0	0	0	108.5	D61 E66 H67 K69	Y59-D61 HydrophobicContact CE2-CB 4.31Å; Y59-E66 WeakPolarHBondContact O-CA 3.45Å; Y59-H67 HydrophobicContact CD1-CB 4.13Å; Y59-H67 WeakPolarHBondContact CD1-O 3.2Å; Y59-H67 HydrophobicContact CE1-CB 3.48Å; Y59-H67 VanDerWaalsContact CE1-CB 3.48Å; Y59-H67 HydrophobicContact CE2-CB 4.24Å; Y59-H67 PolarHBondContact N-O 2.94Å; Y59-H67 PolarHBondContact O-N 3.26Å; Y59-K69 HydrophobicContact CD1-CB 4.25Å; Y59-K69 HydrophobicContact CD1-CG 3.63Å; Y59-K69 HydrophobicContact CG-CG 4.25Å
60	T	70.4	Confident	69.7	Low	93 Å²	93	76.5 Å²	76.5	57%	0.571	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	137.6	162.4	47	0	0	0	0	108.6	Q65 E66	T60-Q65 WeakPolarHBondContact CA-O 3.5Å; T60-E66 HydrophobicContact CG2-CG 3.92Å
61	D	70.9	Confident	70.3	Confident	47 Å²	47	77.1 Å²	77.1	25%	0.251	39%	0.393	S	S	.	.			trans	-86.6	-165.3	167.9	76.8	-7.6	0	0	0	111.9	Y59 Y63 E64 Q65 H67	Y59-D61 HydrophobicContact CE2-CB 4.31Å; D61-Y63 PolarHBondContact O-N 2.76Å; D61-Y63 WeakPolarHBondContact OD1-CA 3.42Å; D61-Y63 PolarHBondContact OD1-N 3.27Å; D61-E64 PolarHBondContact OD1-N 2.77Å; D61-Q65 PolarHBondContact N-O 2.96Å; D61-Q65 WeakPolarHBondContact OD1-CB 3.35Å; D61-Q65 PolarHBondContact OD1-N 2.64Å; D61-H67 IonicContact OD2-CD2 2.73Å; D61-H67 IonicContact OD2-NE2 2.61Å
62	Q	67.1	Low	70.9	Confident	160 Å²	160	74.4 Å²	74.4	75%	0.748	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-7.3	179.3	70.8	-168.7	25.5	0	0	114.4
63	Y	69.2	Low	72	Confident	116 Å²	116	72 Å²	72	46%	0.455	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	18.3	178.9	-56.3	-79.4	0	0	0	111.7	D61 Q65	D61-Y63 PolarHBondContact O-N 2.76Å; D61-Y63 WeakPolarHBondContact OD1-CA 3.42Å; D61-Y63 PolarHBondContact OD1-N 3.27Å; Y63-Q65 PolarHBondContact O-N 3.05Å; Y63-Q65 VanDerWaalsContact O-N 3.11Å
64	E	61.8	Low	73.2	Confident	176 Å²	176	69.3 Å²	69.3	82%	0.822	35%	0.347	S	S	*	.	S	Bend	trans	58.3	12.3	-171.5	-53.9	-164.6	152.1	0	0	114.9	D61	D61-E64 PolarHBondContact OD1-N 2.77Å
65	Q	61.8	Low	74.2	Confident	95 Å²	95	70.6 Å²	70.6	44%	0.444	35%	0.353	S	S	.	.			trans	-78.4	127.4	179.7	-61.5	-168.6	41.4	0	0	110.8	T60 D61 Y63 H67	T60-Q65 WeakPolarHBondContact CA-O 3.5Å; D61-Q65 PolarHBondContact N-O 2.96Å; D61-Q65 WeakPolarHBondContact OD1-CB 3.35Å; D61-Q65 PolarHBondContact OD1-N 2.64Å; Y63-Q65 PolarHBondContact O-N 3.05Å; Y63-Q65 VanDerWaalsContact O-N 3.11Å; Q65-H67 WeakPolarHBondContact CB-NE2 3.29Å; Q65-H67 PolarHBondContact O-CD2 3.08Å; Q65-H67 PolarHBondContact O-N 2.89Å
66	E	70.6	Confident	75.2	Confident	73 Å²	73	66 Å²	66	34%	0.341	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	104.5	179.3	-75.7	-165.3	-143.9	0	0	112	R29 F58 Y59 T60	R29-E66 IonicContact CZ-OE1 2.85Å; R29-E66 VanDerWaalsContact CZ-OE1 3.29Å; R29-E66 IonicContact CZ-OE2 3.56Å; R29-E66 IonicContact NE-OE1 2.66Å; R29-E66 PolarHBondContact NE-OE1 3.24Å; R29-E66 IonicContact NE-OE2 2.68Å; R29-E66 PolarHBondContact NE-OE2 3.26Å; R29-E66 IonicContact NH2-OE1 2.6Å; R29-E66 PolarHBondContact NH2-OE1 3.46Å; R29-E66 IonicContact NH2-OE2 2.67Å; R29-E66 PolarHBondContact NH2-OE2 2.69Å; F58-E66 HydrophobicContact CD1-CB 4.41Å; Y59-E66 WeakPolarHBondContact O-CA 3.45Å; T60-E66 HydrophobicContact CG2-CG 3.92Å
67	H	75.3	Confident	76	Confident	71 Å²	71	63.2 Å²	63.2	33%	0.329	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	151.4	178	-67.2	-70.4	0	0	0	112.5	F58 Y59 D61 Q65 K69	F58-H67 CarbonylContact C-O 3.56Å; F58-H67 VanDerWaalsContact CA-O 3.29Å; F58-H67 WeakPolarHBondContact CA-O 3.47Å; Y59-H67 HydrophobicContact CD1-CB 4.13Å; Y59-H67 WeakPolarHBondContact CD1-O 3.2Å; Y59-H67 HydrophobicContact CE1-CB 3.48Å; Y59-H67 VanDerWaalsContact CE1-CB 3.48Å; Y59-H67 HydrophobicContact CE2-CB 4.24Å; Y59-H67 PolarHBondContact N-O 2.94Å; Y59-H67 PolarHBondContact O-N 3.26Å; D61-H67 IonicContact OD2-CD2 2.73Å; D61-H67 IonicContact OD2-NE2 2.61Å; Q65-H67 WeakPolarHBondContact CB-NE2 3.29Å; Q65-H67 PolarHBondContact O-CD2 3.08Å; Q65-H67 PolarHBondContact O-N 2.89Å; H67-K69 PolarHBondContact O-N 3.39Å
68	L	80	Confident	76.7	Confident	29 Å²	29	65.7 Å²	65.7	15%	0.152	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	122.3	175.1	-168.5	75.2	0	0	0	110	L36 P57 F58 V72 T73 L76 L132 M134	L36-L68 HydrophobicContact CD1-CD1 3.5Å; L36-L68 HydrophobicContact CD1-CD2 4.32Å; P57-L68 HydrophobicContact CB-CD1 3.93Å; P57-L68 WeakPolarHBondContact O-CD1 3.28Å; F58-L68 HydrophobicContact CE1-CD1 4.41Å; L68-V72 HydrophobicContact CD1-CG1 4.13Å; L68-V72 HydrophobicContact CD2-CG1 4.15Å; L68-V72 HydrophobicContact CG-CB 4.24Å; L68-V72 HydrophobicContact CG-CG1 4.18Å; L68-T73 PolarHBondContact O-OG1 3.2Å; L68-L76 HydrophobicContact CD2-CD1 3.86Å; L68-L132 HydrophobicContact CD2-CD1 3.97Å; L68-M134 HydrophobicContact CD2-CE 4.08Å
69	K	81.3	Confident	77.3	Confident	45 Å²	45	63.9 Å²	63.9	20%	0.196	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-51.2	133.8	-174	-77.6	179.4	178	158.2	0	112.2	E53 D56 P57 F58 Y59 H67 P71 V72 T73	E53-K69 WeakPolarHBondContact O-CD 3.5Å; E53-K69 PolarHBondContact O-NZ 2.73Å; D56-K69 WeakPolarHBondContact O-CD 3.25Å; D56-K69 WeakPolarHBondContact O-CE 3.39Å; D56-K69 PolarHBondContact O-NZ 2.95Å; P57-K69 PolarHBondContact O-N 2.92Å; F58-K69 VanDerWaalsContact O-CE 3.24Å; F58-K69 WeakPolarHBondContact O-CE 3.47Å; Y59-K69 HydrophobicContact CD1-CB 4.25Å; Y59-K69 HydrophobicContact CD1-CG 3.63Å; Y59-K69 HydrophobicContact CG-CG 4.25Å; H67-K69 PolarHBondContact O-N 3.39Å; K69-P71 VanDerWaalsContact C-CD 3.48Å; K69-P71 VanDerWaalsContact C-N 3.33Å; K69-V72 HydrophobicContact CB-CG2 4.07Å; K69-V72 WeakPolarHBondContact O-CB 3.28Å; K69-V72 PolarHBondContact O-N 3.33Å; K69-T73 PolarHBondContact O-N 3.39Å
70	P	80.9	Confident	77.8	Confident	82 Å²	82	62 Å²	62	53%	0.532	32%	0.324	S	S	.	.	H	α-helix	trans	-53.6	-37.1	-176.6	-26.4	33.9	0	0	0	115.5	V72 T73 S74	P70-V72 PolarHBondContact O-N 2.92Å; P70-T73 PolarHBondContact O-N 2.99Å; P70-S74 WeakPolarHBondContact O-CB 3.25Å; P70-S74 PolarHBondContact O-N 2.9Å
71	P	81.1	Confident	78.6	Confident	46 Å²	46	57.6 Å²	57.6	30%	0.299	30%	0.297	S	S	.	.	H	α-helix	trans	-58.6	-43.4	171.4	-27.9	36.9	0	0	0	114	E53 L54 K69 S74 L75	E53-P71 WeakPolarHBondContact OE2-CG 3.44Å; L54-P71 HydrophobicContact CD2-CB 3.85Å; K69-P71 VanDerWaalsContact C-CD 3.48Å; K69-P71 VanDerWaalsContact C-N 3.33Å; P71-S74 PolarHBondContact O-N 3.1Å; P71-L75 WeakPolarHBondContact O-CB 3.26Å; P71-L75 VanDerWaalsContact O-CG 3.29Å; P71-L75 WeakPolarHBondContact O-CG 3.25Å; P71-L75 PolarHBondContact O-N 2.87Å
72	V	81.4	Confident	79.4	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.012	29%	0.285	C	S	.	.	H	α-helix	trans	-64.8	-46.7	177.3	-174.5	0	0	0	0	109.9	L36 L54 P57 L68 K69 P70 S74 L75 L76	L36-V72 HydrophobicContact CD1-CG1 4.37Å; L54-V72 HydrophobicContact CD2-CG2 3.6Å; P57-V72 HydrophobicContact CB-CG2 4.43Å; L68-V72 HydrophobicContact CD1-CG1 4.13Å; L68-V72 HydrophobicContact CD2-CG1 4.15Å; L68-V72 HydrophobicContact CG-CB 4.24Å; L68-V72 HydrophobicContact CG-CG1 4.18Å; K69-V72 HydrophobicContact CB-CG2 4.07Å; K69-V72 WeakPolarHBondContact O-CB 3.28Å; K69-V72 PolarHBondContact O-N 3.33Å; P70-V72 PolarHBondContact O-N 2.92Å; V72-S74 VanDerWaalsContact C-N 3.31Å; V72-S74 PolarHBondContact O-N 2.83Å; V72-L75 PolarHBondContact O-N 2.8Å; V72-L76 HydrophobicContact CG1-CD1 4.06Å; V72-L76 HydrophobicContact CG1-CG 4.42Å; V72-L76 WeakPolarHBondContact O-CB 3.14Å; V72-L76 WeakPolarHBondContact O-CG 3.29Å; V72-L76 PolarHBondContact O-N 3.11Å
73	T	83.4	Confident	80.3	Confident	39 Å²	39	48.5 Å²	48.5	24%	0.239	26%	0.255	C	S	.	.	H	α-helix	trans	-55.5	-44.6	174.8	-69.9	0	0	0	0	111.9	L68 K69 P70 L77 L132	L68-T73 PolarHBondContact O-OG1 3.2Å; K69-T73 PolarHBondContact O-N 3.39Å; P70-T73 PolarHBondContact O-N 2.99Å; T73-L77 HydrophobicContact CG2-CD1 4.13Å; T73-L77 VanDerWaalsContact O-CG 3.28Å; T73-L77 WeakPolarHBondContact O-CG 3.37Å; T73-L77 PolarHBondContact O-N 2.82Å; T73-L77 VanDerWaalsContact O-N 3.14Å; T73-L132 HydrophobicContact CG2-CD1 3.85Å; T73-L132 HydrophobicContact CG2-CG 4.35Å
74	S	83.8	Confident	81.1	Confident	67 Å²	67	48.2 Å²	48.2	47%	0.469	25%	0.253	S	S	.	.	H	α-helix	trans	-64.3	-46.1	178.4	-164.8	0	0	0	0	112.3	P70 P71 V72 L76 L77 S78	P70-S74 WeakPolarHBondContact O-CB 3.25Å; P70-S74 PolarHBondContact O-N 2.9Å; P71-S74 PolarHBondContact O-N 3.1Å; V72-S74 VanDerWaalsContact C-N 3.31Å; V72-S74 PolarHBondContact O-N 2.83Å; S74-L76 PolarHBondContact O-N 3.19Å; S74-L77 PolarHBondContact O-N 3.33Å; S74-L77 VanDerWaalsContact O-N 3.17Å; S74-S78 PolarHBondContact O-N 2.95Å
75	L	85.4	Confident	82.2	Confident	33 Å²	33	39.9 Å²	39.9	17%	0.173	21%	0.214	C	C	.	.	H	α-helix	trans	-69.5	-28.2	-179.9	-70.9	169.6	0	0	0	113.9	L54 P71 V72 S78 D80 L81	L54-L75 HydrophobicContact CD1-CD1 3.62Å; L54-L75 HydrophobicContact CD2-CD1 4.02Å; P71-L75 WeakPolarHBondContact O-CB 3.26Å; P71-L75 VanDerWaalsContact O-CG 3.29Å; P71-L75 WeakPolarHBondContact O-CG 3.25Å; P71-L75 PolarHBondContact O-N 2.87Å; V72-L75 PolarHBondContact O-N 2.8Å; L75-S78 PolarHBondContact O-OG 2.99Å; L75-D80 HydrophobicContact CD2-CB 3.7Å; L75-D80 PolarHBondContact O-N 3.34Å; L75-L81 HydrophobicContact CB-CD1 3.73Å; L75-L81 HydrophobicContact CB-CG 3.93Å
76	L	85.9	Confident	83.2	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-71.9	-35.9	170.3	-72.1	171.8	0	0	0	111.6	L36 L39 L68 V72 S74 L81 Y82 H101	L36-L76 HydrophobicContact CD2-CD1 3.88Å; L36-L76 HydrophobicContact CD2-CD2 3.91Å; L36-L76 HydrophobicContact CD2-CG 4.44Å; L39-L76 HydrophobicContact CD2-CD2 3.94Å; L68-L76 HydrophobicContact CD2-CD1 3.86Å; V72-L76 HydrophobicContact CG1-CD1 4.06Å; V72-L76 HydrophobicContact CG1-CG 4.42Å; V72-L76 WeakPolarHBondContact O-CB 3.14Å; V72-L76 WeakPolarHBondContact O-CG 3.29Å; V72-L76 PolarHBondContact O-N 3.11Å; S74-L76 PolarHBondContact O-N 3.19Å; L76-L81 HydrophobicContact CD2-CD1 4.25Å; L76-L81 HydrophobicContact CG-CD1 4.42Å; L76-Y82 HydrophobicContact CD2-CE1 4.23Å; L76-Y82 HydrophobicContact CD2-CE2 4.47Å; L76-H101 PolarHBondContact O-CE1 3.39Å
77	L	86.5	Confident	83.8	Confident	19 Å²	19	34.7 Å²	34.7	10%	0.099	20%	0.196	C	C	.	.	H	α-helix	trans	-73.7	-37.9	177.2	-71.4	167.5	0	0	0	112.8	T73 S74 A79 H101 K129 R130 L132	T73-L77 HydrophobicContact CG2-CD1 4.13Å; T73-L77 VanDerWaalsContact O-CG 3.28Å; T73-L77 WeakPolarHBondContact O-CG 3.37Å; T73-L77 PolarHBondContact O-N 2.82Å; T73-L77 VanDerWaalsContact O-N 3.14Å; S74-L77 PolarHBondContact O-N 3.33Å; S74-L77 VanDerWaalsContact O-N 3.17Å; L77-A79 PolarHBondContact O-N 2.93Å; L77-H101 PolarHBondContact O-NE2 3.35Å; L77-K129 WeakPolarHBondContact CD2-O 3.42Å; L77-R130 HydrophobicContact CD1-CG 4.16Å; L77-R130 HydrophobicContact CD2-CG 4.46Å; L77-L132 HydrophobicContact CD2-CD2 3.69Å; L77-L132 HydrophobicContact CG-CD2 3.89Å
78	S	85.1	Confident	84	Confident	55 Å²	55	35.4 Å²	35.4	39%	0.385	20%	0.202	S	C	.	.	S	Bend	trans	-74.6	-11.4	-179.4	76.1	0	0	0	0	114.4	S74 L75 D80	S74-S78 PolarHBondContact O-N 2.95Å; L75-S78 PolarHBondContact O-OG 2.99Å; S78-D80 WeakPolarHBondContact CB-OD1 3.42Å; S78-D80 PolarHBondContact O-N 3.2Å; S78-D80 WeakPolarHBondContact OG-CB 3.45Å; S78-D80 PolarHBondContact OG-N 2.89Å; S78-D80 PolarHBondContact OG-OD1 3.21Å
79	A	86.6	Confident	84	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.196	C	C	.	.			trans	70.1	1.1	-167.8	0	0	0	0	0	115.8	L77 L81 Y82 C83 H101	L77-A79 PolarHBondContact O-N 2.93Å; A79-L81 VanDerWaalsContact C-N 3.33Å; A79-L81 PolarHBondContact O-N 3.29Å; A79-Y82 HydrophobicContact CB-CD2 4.45Å; A79-Y82 CarbonylContact O-C 3.51Å; A79-Y82 WeakPolarHBondContact O-CA 3.4Å; A79-Y82 WeakPolarHBondContact O-CB 3.46Å; A79-Y82 PolarHBondContact O-N 3.32Å; A79-C83 PolarHBondContact O-N 2.85Å; A79-C83 PolarHBondContact O-SG 2.9Å; A79-C83 VanDerWaalsContact O-SG 3.38Å; A79-H101 HydrophobicContact CB-CB 4.49Å
80	D	85.4	Confident	83.7	Confident	54 Å²	54	32.5 Å²	32.5	29%	0.289	19%	0.189	S	C	.	.	H	α-helix	trans	-50.9	-48.1	-173.6	-95.8	74.9	0	0	0	113.8	L75 S78 Y82 C83 R84	L75-D80 HydrophobicContact CD2-CB 3.7Å; L75-D80 PolarHBondContact O-N 3.34Å; S78-D80 WeakPolarHBondContact CB-OD1 3.42Å; S78-D80 PolarHBondContact O-N 3.2Å; S78-D80 WeakPolarHBondContact OG-CB 3.45Å; S78-D80 PolarHBondContact OG-N 2.89Å; S78-D80 PolarHBondContact OG-OD1 3.21Å; D80-Y82 VanDerWaalsContact C-N 3.31Å; D80-Y82 PolarHBondContact O-N 3.24Å; D80-C83 PolarHBondContact O-N 3.22Å; D80-R84 WeakPolarHBondContact O-CB 3.32Å; D80-R84 VanDerWaalsContact O-CD 3.27Å; D80-R84 WeakPolarHBondContact O-CD 3.36Å; D80-R84 WeakPolarHBondContact O-CG 3.29Å; D80-R84 PolarHBondContact O-N 3.03Å; D80-R84 IonicContact OD2-CZ 3.45Å; D80-R84 IonicContact OD2-NE 3.3Å; D80-R84 PolarHBondContact OD2-NE 3.11Å; D80-R84 IonicContact OD2-NH2 2.73Å; D80-R84 PolarHBondContact OD2-NH2 2.88Å
81	L	86.3	Confident	82.9	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-63.4	-39	179.5	-70.8	165.7	0	0	0	111.6	L39 V40 A43 Y44 L75 L76 A79 A85	L39-L81 HydrophobicContact CD2-CB 3.79Å; L39-L81 HydrophobicContact CD2-CD1 4.19Å; L39-L81 HydrophobicContact CG-CB 4.05Å; V40-L81 HydrophobicContact CG2-CD1 4.46Å; V40-L81 HydrophobicContact CG2-CD2 4.16Å; A43-L81 HydrophobicContact CB-CD2 3.61Å; Y44-L81 HydrophobicContact CE2-CD2 3.88Å; L75-L81 HydrophobicContact CB-CD1 3.73Å; L75-L81 HydrophobicContact CB-CG 3.93Å; L76-L81 HydrophobicContact CD2-CD1 4.25Å; L76-L81 HydrophobicContact CG-CD1 4.42Å; A79-L81 VanDerWaalsContact C-N 3.33Å; A79-L81 PolarHBondContact O-N 3.29Å; L81-A85 VanDerWaalsContact O-CB 3.25Å; L81-A85 WeakPolarHBondContact O-CB 3.41Å; L81-A85 PolarHBondContact O-N 2.88Å
82	Y	88.4	Confident	81.6	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-71.8	-39.2	178.6	-57.4	-40.4	0	0	0	112.5	L39 L76 A79 D80 G86 H101 H137 M140 I141 L144	L39-Y82 HydrophobicContact CD1-CD1 3.89Å; L39-Y82 HydrophobicContact CD1-CE1 4.2Å; L39-Y82 HydrophobicContact CD2-CD1 3.85Å; L39-Y82 HydrophobicContact CD2-CE1 3.5Å; L76-Y82 HydrophobicContact CD2-CE1 4.23Å; L76-Y82 HydrophobicContact CD2-CE2 4.47Å; A79-Y82 HydrophobicContact CB-CD2 4.45Å; A79-Y82 CarbonylContact O-C 3.51Å; A79-Y82 WeakPolarHBondContact O-CA 3.4Å; A79-Y82 WeakPolarHBondContact O-CB 3.46Å; A79-Y82 PolarHBondContact O-N 3.32Å; D80-Y82 VanDerWaalsContact C-N 3.31Å; D80-Y82 PolarHBondContact O-N 3.24Å; Y82-G86 VanDerWaalsContact O-CA 3.25Å; Y82-G86 WeakPolarHBondContact O-CA 3.37Å; Y82-G86 PolarHBondContact O-N 2.88Å; Y82-H101 AromaticContact CD2-CE1 3.78Å; Y82-H101 AromaticContact CD2-ND1 3.57Å; Y82-H101 AromaticContact CE2-CE1 3.85Å; Y82-H101 AromaticContact CE2-ND1 3.86Å; Y82-H137 AromaticContact CE2-ND1 3.76Å; Y82-H137 AromaticContact CZ-ND1 3.76Å; Y82-H137 WeakPolarHBondContact OH-CA 3.42Å; Y82-H137 WeakPolarHBondContact OH-CB 3.49Å; Y82-H137 PolarHBondContact OH-ND1 3.15Å; Y82-H137 PolarHBondContact OH-O 3.14Å; Y82-M140 HydrophobicContact CD1-CE 3.2Å; Y82-M140 HydrophobicContact CD2-CE 3.71Å; Y82-M140 HydrophobicContact CE1-CE 3.59Å; Y82-M140 HydrophobicContact CE2-CE 4.05Å; Y82-M140 HydrophobicContact CG-CE 3.25Å; Y82-I141 HydrophobicContact CE1-CD1 4.36Å; Y82-I141 HydrophobicContact CE1-CG1 3.71Å; Y82-L144 HydrophobicContact CD1-CD1 4.05Å
83	C	86.8	Confident	80.1	Confident	16 Å²	16	44.3 Å²	44.3	11%	0.108	24%	0.243	C	C	.	.	H	α-helix	trans	-64.3	-43	174	-69.1	0	0	0	0	111.4	A79 D80 S87 L98 G100	A79-C83 PolarHBondContact O-N 2.85Å; A79-C83 PolarHBondContact O-SG 2.9Å; A79-C83 VanDerWaalsContact O-SG 3.38Å; D80-C83 PolarHBondContact O-N 3.22Å; C83-S87 VanDerWaalsContact O-CB 3.29Å; C83-S87 WeakPolarHBondContact O-CB 3.37Å; C83-S87 PolarHBondContact O-N 3.26Å; C83-S87 PolarHBondContact O-OG 3Å; C83-L98 VanDerWaalsContact CB-O 3.24Å; C83-L98 WeakPolarHBondContact CB-O 3.47Å; C83-L98 PolarHBondContact SG-O 3.35Å; C83-G100 PolarHBondContact SG-N 3.42Å; C83-G100 VanDerWaalsContact SG-N 3.4Å
84	R	85.4	Confident	78.2	Confident	110 Å²	110	45.7 Å²	45.7	42%	0.415	26%	0.258	S	S	.	.	H	α-helix	trans	-68.3	-56.2	178.8	-68.7	161.9	-162.8	-92.2	-1.1	111.9	A43 D80 G86 S87 L88	A43-R84 HydrophobicContact CB-CB 3.91Å; D80-R84 WeakPolarHBondContact O-CB 3.32Å; D80-R84 VanDerWaalsContact O-CD 3.27Å; D80-R84 WeakPolarHBondContact O-CD 3.36Å; D80-R84 WeakPolarHBondContact O-CG 3.29Å; D80-R84 PolarHBondContact O-N 3.03Å; D80-R84 IonicContact OD2-CZ 3.45Å; D80-R84 IonicContact OD2-NE 3.3Å; D80-R84 PolarHBondContact OD2-NE 3.11Å; D80-R84 IonicContact OD2-NH2 2.73Å; D80-R84 PolarHBondContact OD2-NH2 2.88Å; R84-G86 PolarHBondContact O-N 3.39Å; R84-S87 PolarHBondContact O-N 3.39Å; R84-L88 PolarHBondContact O-N 3.34Å
85	A	85.8	Confident	76.5	Confident	0 Å²	0	48 Å²	48	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-61.8	-43.6	177.3	0	0	0	0	0	111.2	L39 K42 A43 L81 S87 L88 I89	L39-A85 HydrophobicContact CD1-CB 3.89Å; K42-A85 HydrophobicContact CB-CB 4.14Å; A43-A85 HydrophobicContact CB-CB 4.48Å; L81-A85 VanDerWaalsContact O-CB 3.25Å; L81-A85 WeakPolarHBondContact O-CB 3.41Å; L81-A85 PolarHBondContact O-N 2.88Å; A85-S87 VanDerWaalsContact C-N 3.35Å; A85-S87 PolarHBondContact O-N 3.17Å; A85-L88 PolarHBondContact O-N 3.38Å; A85-L88 VanDerWaalsContact O-N 3.13Å; A85-I89 HydrophobicContact CB-CD1 4.23Å; A85-I89 WeakPolarHBondContact O-CB 3.39Å; A85-I89 WeakPolarHBondContact O-CD1 3.38Å; A85-I89 WeakPolarHBondContact O-CG1 3.45Å; A85-I89 PolarHBondContact O-N 3.28Å
86	G	82.4	Confident	75.2	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-57.9	-41.4	175.2	0	0	0	0	0	113	Y82 R84 L88 I89 L90	Y82-G86 VanDerWaalsContact O-CA 3.25Å; Y82-G86 WeakPolarHBondContact O-CA 3.37Å; Y82-G86 PolarHBondContact O-N 2.88Å; R84-G86 PolarHBondContact O-N 3.39Å; G86-L88 VanDerWaalsContact C-N 3.29Å; G86-L88 PolarHBondContact O-N 2.9Å; G86-I89 PolarHBondContact O-N 2.85Å; G86-L90 WeakPolarHBondContact O-CA 3.37Å; G86-L90 WeakPolarHBondContact O-CB 3.42Å; G86-L90 WeakPolarHBondContact O-CG 3.44Å; G86-L90 PolarHBondContact O-N 3.47Å
87	S	83.2	Confident	74.3	Confident	59 Å²	59	59.8 Å²	59.8	41%	0.413	34%	0.342	S	S	.	.	H	α-helix	trans	-68.3	-27.1	177.3	-60.3	0	0	0	0	113.3	C83 R84 A85	C83-S87 VanDerWaalsContact O-CB 3.29Å; C83-S87 WeakPolarHBondContact O-CB 3.37Å; C83-S87 PolarHBondContact O-N 3.26Å; C83-S87 PolarHBondContact O-OG 3Å; R84-S87 PolarHBondContact O-N 3.39Å; A85-S87 VanDerWaalsContact C-N 3.35Å; A85-S87 PolarHBondContact O-N 3.17Å
88	L	79.6	Confident	73.8	Confident	87 Å²	87	60.6 Å²	60.6	46%	0.455	35%	0.346	S	S	.	.	H	α-helix	trans	-84.8	-33.2	177.2	-71.7	167.3	0	0	0	113.1	K42 R84 A85 G86 K91	K42-L88 WeakPolarHBondContact O-CD1 3.42Å; R84-L88 PolarHBondContact O-N 3.34Å; A85-L88 PolarHBondContact O-N 3.38Å; A85-L88 VanDerWaalsContact O-N 3.13Å; G86-L88 VanDerWaalsContact C-N 3.29Å; G86-L88 PolarHBondContact O-N 2.9Å; L88-K91 WeakPolarHBondContact O-CE 3.49Å
89	I	79.6	Confident	73.5	Confident	6 Å²	6	65 Å²	65	3%	0.031	37%	0.365	C	S	.	.	H	α-helix	trans	-83.7	-56.5	179.8	-65.7	163.6	0	0	0	111	W38 A85 G86 K91 L144 A147 Y148	W38-I89 HydrophobicContact CH2-CD1 3.74Å; W38-I89 HydrophobicContact CZ2-CD1 4.38Å; A85-I89 HydrophobicContact CB-CD1 4.23Å; A85-I89 WeakPolarHBondContact O-CB 3.39Å; A85-I89 WeakPolarHBondContact O-CD1 3.38Å; A85-I89 WeakPolarHBondContact O-CG1 3.45Å; A85-I89 PolarHBondContact O-N 3.28Å; G86-I89 PolarHBondContact O-N 2.85Å; I89-K91 PolarHBondContact O-N 3.24Å; I89-L144 HydrophobicContact CD1-CB 4.47Å; I89-L144 HydrophobicContact CD1-CD2 4.43Å; I89-A147 HydrophobicContact CG2-CB 4.18Å; I89-Y148 HydrophobicContact CG1-CD2 3.91Å; I89-Y148 HydrophobicContact CG1-CG 4.27Å; I89-Y148 HydrophobicContact CG2-CD2 4.4Å
90	L	75.3	Confident	73.4	Confident	7 Å²	7	65.7 Å²	65.7	4%	0.037	37%	0.372	C	S	.	.	S	Bend	trans	-85.8	37.9	-165.5	-54.7	172.3	0	0	0	112.5	G86 S92 L98 A107 L108 R111 L144 A147	G86-L90 WeakPolarHBondContact O-CA 3.37Å; G86-L90 WeakPolarHBondContact O-CB 3.42Å; G86-L90 WeakPolarHBondContact O-CG 3.44Å; G86-L90 PolarHBondContact O-N 3.47Å; L90-S92 PolarHBondContact O-N 3.39Å; L90-S92 PolarHBondContact O-OG 3.02Å; L90-L98 HydrophobicContact CD1-CD1 4.19Å; L90-A107 HydrophobicContact CD1-CB 3.93Å; L90-L108 HydrophobicContact CD1-CD2 4.15Å; L90-L108 HydrophobicContact CD1-CG 4.14Å; L90-L108 HydrophobicContact CD2-CD2 3.73Å; L90-R111 PolarHBondContact O-NH1 2.94Å; L90-R111 VanDerWaalsContact O-NH1 3.1Å; L90-R111 PolarHBondContact O-NH2 2.86Å; L90-R111 VanDerWaalsContact O-NH2 3.15Å; L90-L144 HydrophobicContact CD1-CD2 4.09Å; L90-L144 HydrophobicContact CG-CD2 4.42Å; L90-A147 HydrophobicContact CD2-CB 3.63Å
91	K	64.4	Low	73.4	Confident	139 Å²	139	63.2 Å²	63.2	60%	0.604	36%	0.359	S	S	*	.			trans	-57	91.9	-173.6	-73.5	171.9	175	162.4	0	112.3	L88 I89 R111	L88-K91 WeakPolarHBondContact O-CE 3.49Å; I89-K91 PolarHBondContact O-N 3.24Å; K91-R111 PolarHBondContact O-NH2 2.76Å
92	S	53	Low	73.4	Confident	60 Å²	60	67.4 Å²	67.4	42%	0.42	38%	0.381	S	S	.	.			trans	-127.2	152.2	179.6	42.7	0	0	0	0	110.4	L90 A94 R111	L90-S92 PolarHBondContact O-N 3.39Å; L90-S92 PolarHBondContact O-OG 3.02Å; S92-A94 PolarHBondContact O-N 3.11Å; S92-R111 PolarHBondContact OG-NH1 2.64Å
93	D	49.3	Very low	73.2	Confident	179 Å²	179	68.7 Å²	68.7	96%	0.957	39%	0.392	S	S	*	.	S	Bend	trans	-72.1	65.7	-166.1	-165	19.6	0	0	0	113.5
94	A	43.5	Very low	73.2	Confident	68 Å²	68	68 Å²	68	56%	0.562	39%	0.387	S	S	*	.			trans	-131.6	116	-178.1	0	0	0	0	0	110.1	S92 K96	S92-A94 PolarHBondContact O-N 3.11Å; A94-K96 PolarHBondContact O-N 3.17Å
95	A	49.7	Very low	73.3	Confident	115 Å²	115	64 Å²	64	95%	0.95	37%	0.374	S	S	*	.	S	Bend	trans	-74.5	39	177.4	0	0	0	0	0	113.4
96	K	57.6	Low	73.3	Confident	173 Å²	173	69.4 Å²	69.4	75%	0.752	40%	0.399	S	S	*	.	S	Bend	trans	-135.7	127.4	179.6	-67	-175	178.1	-177.2	0	109.5	A94	A94-K96 PolarHBondContact O-N 3.17Å
97	P	67.2	Low	73.4	Confident	107 Å²	107	69.7 Å²	69.7	70%	0.695	40%	0.401	S	S	*	.			trans	-65.8	145.6	173.2	29.1	-34.3	0	0	0	110.4	L99	P97-L99 PolarHBondContact O-N 3.31Å
98	L	75.9	Confident	73.5	Confident	37 Å²	37	66.9 Å²	66.9	19%	0.194	38%	0.381	C	S	.	.			trans	-69.8	114.4	169.1	-59.3	179.1	0	0	0	108.1	C83 L90 A103 V104 A107	C83-L98 VanDerWaalsContact CB-O 3.24Å; C83-L98 WeakPolarHBondContact CB-O 3.47Å; C83-L98 PolarHBondContact SG-O 3.35Å; L90-L98 HydrophobicContact CD1-CD1 4.19Å; L98-A103 HydrophobicContact CB-CB 4.49Å; L98-A103 HydrophobicContact CD2-CB 4.42Å; L98-V104 HydrophobicContact CB-CG2 4.23Å; L98-V104 HydrophobicContact CD1-CG2 4.37Å; L98-A107 HydrophobicContact CD1-CB 4.42Å; L98-A107 HydrophobicContact CD2-CB 3.84Å
99	L	78.7	Confident	73.8	Confident	147 Å²	147	64.3 Å²	64.3	77%	0.77	37%	0.373	S	S	*	.			trans	-127.9	118.7	-175.8	-161.4	77.1	0	0	0	110	P97 A103	P97-L99 PolarHBondContact O-N 3.31Å; L99-A103 WeakPolarHBondContact O-CB 3.46Å
100	G	83.1	Confident	73.9	Confident	15 Å²	15	70.5 Å²	70.5	16%	0.155	40%	0.401	C	S	.	.	S	Bend	trans	80	170.9	-173.5	0	0	0	0	0	114	C83	C83-G100 PolarHBondContact SG-N 3.42Å; C83-G100 VanDerWaalsContact SG-N 3.4Å
101	H	85.9	Confident	73.8	Confident	2 Å²	2	74 Å²	74	1%	0.009	41%	0.414	C	S	.	.	H	α-helix	trans	-68.1	-41.2	-174.2	-63.1	-80.7	0	0	0	112.3	L76 L77 A79 Y82 A103 V104 I105 E124 L127	L76-H101 PolarHBondContact O-CE1 3.39Å; L77-H101 PolarHBondContact O-NE2 3.35Å; A79-H101 HydrophobicContact CB-CB 4.49Å; Y82-H101 AromaticContact CD2-CE1 3.78Å; Y82-H101 AromaticContact CD2-ND1 3.57Å; Y82-H101 AromaticContact CE2-CE1 3.85Å; Y82-H101 AromaticContact CE2-ND1 3.86Å; H101-A103 VanDerWaalsContact C-N 3.3Å; H101-A103 PolarHBondContact O-N 3.45Å; H101-V104 PolarHBondContact O-N 3.15Å; H101-V104 VanDerWaalsContact O-N 3.11Å; H101-I105 WeakPolarHBondContact O-CG1 3.26Å; H101-I105 PolarHBondContact O-N 2.88Å; H101-E124 HydrophobicContact CB-CB 4.02Å; H101-E124 HydrophobicContact CB-CG 3.88Å; H101-E124 WeakPolarHBondContact CB-OE1 3.16Å; H101-E124 IonicContact CD2-OE1 2.69Å; H101-E124 IonicContact CG-OE1 2.65Å; H101-E124 PolarHBondContact N-OE1 2.78Å; H101-L127 HydrophobicContact CB-CD1 4.02Å
102	D	86.1	Confident	74.3	Confident	89 Å²	89	69.6 Å²	69.6	48%	0.476	41%	0.408	S	S	.	.	H	α-helix	trans	-60.6	-38.9	-176.3	-168	70.2	0	0	0	112.2	V104 I105 Q106	D102-V104 VanDerWaalsContact C-N 3.33Å; D102-V104 PolarHBondContact O-N 3.1Å; D102-I105 PolarHBondContact O-N 3.13Å; D102-Q106 VanDerWaalsContact O-CB 3.27Å; D102-Q106 WeakPolarHBondContact O-CB 3.18Å; D102-Q106 PolarHBondContact O-N 2.95Å
103	A	85.8	Confident	75.8	Confident	27 Å²	27	68.4 Å²	68.4	22%	0.223	40%	0.396	C	S	.	.	H	α-helix	trans	-61.5	-39.1	175.8	0	0	0	0	0	112.6	L98 L99 H101 A107	L98-A103 HydrophobicContact CB-CB 4.49Å; L98-A103 HydrophobicContact CD2-CB 4.42Å; L99-A103 WeakPolarHBondContact O-CB 3.46Å; H101-A103 VanDerWaalsContact C-N 3.3Å; H101-A103 PolarHBondContact O-N 3.45Å; A103-A107 WeakPolarHBondContact O-CB 3.21Å; A103-A107 PolarHBondContact O-N 3.23Å
104	V	86	Confident	77.5	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-71.9	-43.7	177.6	-177.1	0	0	0	0	110.8	L98 H101 D102 Q106 A107 L108 M140 L144	L98-V104 HydrophobicContact CB-CG2 4.23Å; L98-V104 HydrophobicContact CD1-CG2 4.37Å; H101-V104 PolarHBondContact O-N 3.15Å; H101-V104 VanDerWaalsContact O-N 3.11Å; D102-V104 VanDerWaalsContact C-N 3.33Å; D102-V104 PolarHBondContact O-N 3.1Å; V104-Q106 VanDerWaalsContact C-N 3.32Å; V104-Q106 PolarHBondContact O-N 3.18Å; V104-A107 PolarHBondContact O-N 2.97Å; V104-L108 HydrophobicContact CG1-CD1 4.31Å; V104-L108 WeakPolarHBondContact O-CG 3.37Å; V104-L108 PolarHBondContact O-N 3.43Å; V104-M140 HydrophobicContact CG1-CE 4.07Å; V104-M140 HydrophobicContact CG1-SD 4.03Å; V104-L144 HydrophobicContact CG1-CD2 4.14Å
105	I	88.4	Confident	79.6	Confident	28 Å²	28	64.1 Å²	64.1	14%	0.144	35%	0.354	C	S	.	.	H	α-helix	trans	-60.5	-42.9	175.6	-65.5	166.7	0	0	0	110.6	H101 D102 L108 A109 V115 L127	H101-I105 WeakPolarHBondContact O-CG1 3.26Å; H101-I105 PolarHBondContact O-N 2.88Å; D102-I105 PolarHBondContact O-N 3.13Å; I105-L108 PolarHBondContact O-N 2.89Å; I105-A109 WeakPolarHBondContact O-CB 3.45Å; I105-A109 PolarHBondContact O-N 2.98Å; I105-V115 HydrophobicContact CG1-CG2 4.44Å; I105-L127 HydrophobicContact CD1-CD1 4Å
106	Q	85.8	Confident	81.2	Confident	112 Å²	112	61.9 Å²	61.9	52%	0.523	33%	0.329	S	S	.	.	H	α-helix	trans	-66.9	-40.8	177.5	-170.7	179	82.6	0	0	112.1	D102 V104 L108 A109 Q110	D102-Q106 VanDerWaalsContact O-CB 3.27Å; D102-Q106 WeakPolarHBondContact O-CB 3.18Å; D102-Q106 PolarHBondContact O-N 2.95Å; V104-Q106 VanDerWaalsContact C-N 3.32Å; V104-Q106 PolarHBondContact O-N 3.18Å; Q106-L108 VanDerWaalsContact C-N 3.33Å; Q106-L108 PolarHBondContact O-N 3.33Å; Q106-A109 PolarHBondContact O-N 3.02Å; Q106-Q110 WeakPolarHBondContact O-CG 3.24Å; Q106-Q110 PolarHBondContact O-N 2.95Å
107	A	83.6	Confident	82.4	Confident	6 Å²	6	55 Å²	55	5%	0.05	30%	0.3	C	S	.	.	H	α-helix	trans	-66.7	-31.7	176.6	0	0	0	0	0	113.2	L90 L98 A103 V104	L90-A107 HydrophobicContact CD1-CB 3.93Å; L98-A107 HydrophobicContact CD1-CB 4.42Å; L98-A107 HydrophobicContact CD2-CB 3.84Å; A103-A107 WeakPolarHBondContact O-CB 3.21Å; A103-A107 PolarHBondContact O-N 3.23Å; V104-A107 PolarHBondContact O-N 2.97Å
108	L	84.8	Confident	83	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-69.2	-46.3	169.5	-73.1	169.4	0	0	0	111.4	L90 V104 I105 Q106 Q110 R111 G112 L113 V115 M140 T143 L144 A147	L90-L108 HydrophobicContact CD1-CD2 4.15Å; L90-L108 HydrophobicContact CD1-CG 4.14Å; L90-L108 HydrophobicContact CD2-CD2 3.73Å; V104-L108 HydrophobicContact CG1-CD1 4.31Å; V104-L108 WeakPolarHBondContact O-CG 3.37Å; V104-L108 PolarHBondContact O-N 3.43Å; I105-L108 PolarHBondContact O-N 2.89Å; Q106-L108 VanDerWaalsContact C-N 3.33Å; Q106-L108 PolarHBondContact O-N 3.33Å; L108-Q110 VanDerWaalsContact C-N 3.28Å; L108-Q110 PolarHBondContact O-N 3.45Å; L108-R111 CarbonylContact O-C 3.32Å; L108-R111 WeakPolarHBondContact O-CA 3.29Å; L108-R111 PolarHBondContact O-N 2.92Å; L108-G112 PolarHBondContact O-N 3.45Å; L108-L113 CarbonylContact C-O 3.37Å; L108-L113 HydrophobicContact CB-CB 4.44Å; L108-L113 WeakPolarHBondContact CB-O 3.43Å; L108-L113 HydrophobicContact CD2-CD1 4.41Å; L108-L113 PolarHBondContact O-N 2.93Å; L108-V115 HydrophobicContact CD1-CG2 3.9Å; L108-M140 HydrophobicContact CD1-SD 3.81Å; L108-T143 HydrophobicContact CD1-CG2 3.94Å; L108-T143 HydrophobicContact CD2-CG2 4.2Å; L108-T143 HydrophobicContact CG-CG2 4.47Å; L108-L144 HydrophobicContact CD1-CD2 4.32Å; L108-L144 HydrophobicContact CD1-CG 4.4Å; L108-L144 HydrophobicContact CD2-CD2 4.28Å; L108-A147 HydrophobicContact CD2-CB 3.68Å
109	A	85.5	Confident	82.9	Confident	33 Å²	33	64 Å²	64	27%	0.273	34%	0.337	S	S	.	.	H	α-helix	trans	-62.2	-33	178.2	0	0	0	0	0	112.8	I105 Q106 R111 G112 L113 Y114	I105-A109 WeakPolarHBondContact O-CB 3.45Å; I105-A109 PolarHBondContact O-N 2.98Å; Q106-A109 PolarHBondContact O-N 3.02Å; A109-R111 VanDerWaalsContact C-N 3.29Å; A109-R111 PolarHBondContact O-N 3.27Å; A109-G112 WeakPolarHBondContact O-CA 3.28Å; A109-G112 PolarHBondContact O-N 3.47Å; A109-L113 WeakPolarHBondContact CA-O 3.43Å; A109-L113 PolarHBondContact N-O 3.41Å; A109-Y114 HydrophobicContact CB-CD1 4.28Å; A109-Y114 HydrophobicContact CB-CE1 4.12Å
110	Q	82.5	Confident	83.1	Confident	136 Å²	136	63.6 Å²	63.6	64%	0.636	33%	0.325	S	S	*	.	H	α-helix	trans	-62.7	-32.2	171.7	-75.3	172.5	17.9	0	0	113	Q106 L108 G112	Q106-Q110 WeakPolarHBondContact O-CG 3.24Å; Q106-Q110 PolarHBondContact O-N 2.95Å; L108-Q110 VanDerWaalsContact C-N 3.28Å; L108-Q110 PolarHBondContact O-N 3.45Å; Q110-G112 PolarHBondContact O-N 3.3Å
111	R	72.4	Confident	83.1	Confident	82 Å²	82	67.9 Å²	67.9	31%	0.309	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	5.1	170.7	-76.1	177.5	166.8	73.7	-5.1	113.1	L90 K91 S92 L108 A109 L113 E151	L90-R111 PolarHBondContact O-NH1 2.94Å; L90-R111 VanDerWaalsContact O-NH1 3.1Å; L90-R111 PolarHBondContact O-NH2 2.86Å; L90-R111 VanDerWaalsContact O-NH2 3.15Å; K91-R111 PolarHBondContact O-NH2 2.76Å; S92-R111 PolarHBondContact OG-NH1 2.64Å; L108-R111 CarbonylContact O-C 3.32Å; L108-R111 WeakPolarHBondContact O-CA 3.29Å; L108-R111 PolarHBondContact O-N 2.92Å; A109-R111 VanDerWaalsContact C-N 3.29Å; A109-R111 PolarHBondContact O-N 3.27Å; R111-L113 VanDerWaalsContact C-N 3.32Å; R111-E151 IonicContact CZ-OE2 3.82Å; R111-E151 IonicContact NE-OE2 2.63Å; R111-E151 PolarHBondContact NE-OE2 3.13Å; R111-E151 IonicContact NH2-OE2 3.22Å; R111-E151 PolarHBondContact NH2-OE2 3.04Å
112	G	76.7	Confident	83.1	Confident	45 Å²	45	68.3 Å²	68.3	46%	0.464	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	79	9.1	-178.3	0	0	0	0	0	114.9	L108 A109 Q110	L108-G112 PolarHBondContact O-N 3.45Å; A109-G112 WeakPolarHBondContact O-CA 3.28Å; A109-G112 PolarHBondContact O-N 3.47Å; Q110-G112 PolarHBondContact O-N 3.3Å
113	L	83.8	Confident	83.1	Confident	35 Å²	35	67 Å²	67	18%	0.183	34%	0.342	C	S	.	.			trans	-98.5	111.4	179.7	-63.4	174.5	0	0	0	109.6	L108 A109 R111 T143 A147	L108-L113 CarbonylContact C-O 3.37Å; L108-L113 HydrophobicContact CB-CB 4.44Å; L108-L113 WeakPolarHBondContact CB-O 3.43Å; L108-L113 HydrophobicContact CD2-CD1 4.41Å; L108-L113 PolarHBondContact O-N 2.93Å; A109-L113 WeakPolarHBondContact CA-O 3.43Å; A109-L113 PolarHBondContact N-O 3.41Å; R111-L113 VanDerWaalsContact C-N 3.32Å; L113-T143 HydrophobicContact CB-CG2 3.86Å; L113-A147 HydrophobicContact CD1-CB 3.62Å
114	Y	84.3	Confident	83	Confident	153 Å²	153	68 Å²	68	60%	0.6	34%	0.342	S	S	*	.			trans	-99.4	127.9	179.2	-61.1	-84.6	0	0	0	110.1	A109 T116	A109-Y114 HydrophobicContact CB-CD1 4.28Å; A109-Y114 HydrophobicContact CB-CE1 4.12Å; Y114-T116 PolarHBondContact O-N 2.68Å
115	V	87	Confident	82.9	Confident	4 Å²	4	78.1 Å²	78.1	2%	0.024	38%	0.38	C	S	.	.			trans	-75.3	115.4	178.8	-171.6	0	0	0	0	109.9	I105 L108 L121 V122 A139 M140 T143	I105-V115 HydrophobicContact CG1-CG2 4.44Å; L108-V115 HydrophobicContact CD1-CG2 3.9Å; V115-L121 WeakPolarHBondContact O-CA 3.4Å; V115-V122 HydrophobicContact CB-CB 4.23Å; V115-V122 HydrophobicContact CG1-CB 3.73Å; V115-V122 HydrophobicContact CG1-CG1 4.34Å; V115-V122 HydrophobicContact CG1-CG2 3.81Å; V115-V122 PolarHBondContact O-N 2.92Å; V115-A139 HydrophobicContact CG1-CB 4.13Å; V115-M140 HydrophobicContact CG1-CB 4.08Å; V115-M140 HydrophobicContact CG1-CG 4.03Å; V115-M140 HydrophobicContact CG2-CG 4.15Å; V115-M140 HydrophobicContact CG2-SD 4.3Å; V115-T143 HydrophobicContact CG2-CG2 4.01Å
116	T	83.5	Confident	82.7	Confident	69 Å²	69	77 Å²	77	42%	0.423	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	126.4	179.5	53.5	0	0	0	0	112.6	Y114 R120 L121 A139	Y114-T116 PolarHBondContact O-N 2.68Å; T116-R120 CarbonylContact C-O 3.58Å; T116-R120 VanDerWaalsContact CA-O 3.25Å; T116-R120 WeakPolarHBondContact CA-O 3.4Å; T116-L121 HydrophobicContact CG2-CD2 3.9Å; T116-A139 WeakPolarHBondContact O-CB 3.46Å
117	D	84.4	Confident	82.7	Confident	27 Å²	27	71.7 Å²	71.7	14%	0.144	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	116.4	168.6	177.2	13	0	0	0	107.1	D119 R120 V122 Q133 G135 A136 A139	D117-D119 PolarHBondContact O-N 3.14Å; D117-R120 PolarHBondContact N-O 2.94Å; D117-R120 WeakPolarHBondContact O-CB 3.32Å; D117-R120 PolarHBondContact O-N 3.14Å; D117-V122 HydrophobicContact CB-CG2 3.65Å; D117-Q133 PolarHBondContact OD2-NE2 3.39Å; D117-G135 VanDerWaalsContact OD2-C 3.31Å; D117-A136 PolarHBondContact OD2-N 2.69Å; D117-A139 HydrophobicContact CB-CB 4Å
118	Q	78.3	Confident	82.7	Confident	173 Å²	173	78.2 Å²	78.2	81%	0.808	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.7	57.1	179.9	-64.7	165	66.3	0	0	113.6	R120	Q118-R120 PolarHBondContact O-N 3.03Å
119	D	75	Confident	82.6	Confident	162 Å²	162	82 Å²	82	87%	0.866	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	1.3	-175.7	-64.2	-38.1	0	0	0	116.3	D117	D117-D119 PolarHBondContact O-N 3.14Å
120	R	82.2	Confident	82.2	Confident	137 Å²	137	90 Å²	90	52%	0.517	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	133.8	173.5	176.5	-178.8	162.4	-149.3	-14.6	110.7	T116 D117 Q118 V122 D126	T116-R120 CarbonylContact C-O 3.58Å; T116-R120 VanDerWaalsContact CA-O 3.25Å; T116-R120 WeakPolarHBondContact CA-O 3.4Å; D117-R120 PolarHBondContact N-O 2.94Å; D117-R120 WeakPolarHBondContact O-CB 3.32Å; D117-R120 PolarHBondContact O-N 3.14Å; Q118-R120 PolarHBondContact O-N 3.03Å; R120-V122 PolarHBondContact O-N 3.47Å; R120-D126 IonicContact CZ-OD1 3.63Å; R120-D126 IonicContact CZ-OD2 3.01Å; R120-D126 IonicContact NH1-OD1 2.67Å; R120-D126 IonicContact NH2-OD1 2.77Å; R120-D126 PolarHBondContact NH2-OD1 3.47Å; R120-D126 IonicContact NH2-OD2 2.67Å; R120-D126 PolarHBondContact NH2-OD2 2.73Å
121	L	83.9	Confident	81.8	Confident	106 Å²	106	89.4 Å²	89.4	56%	0.555	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.6	127.4	171.3	-70.5	168.2	0	0	0	111.1	V115 T116	V115-L121 WeakPolarHBondContact O-CA 3.4Å; T116-L121 HydrophobicContact CG2-CD2 3.9Å
122	V	86.1	Confident	82.3	Confident	10 Å²	10	87.5 Å²	87.5	6%	0.061	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-76.3	133.7	175.2	175.1	0	0	0	0	109.5	V115 D117 R120 L127 A136 A139	V115-V122 HydrophobicContact CB-CB 4.23Å; V115-V122 HydrophobicContact CG1-CB 3.73Å; V115-V122 HydrophobicContact CG1-CG1 4.34Å; V115-V122 HydrophobicContact CG1-CG2 3.81Å; V115-V122 PolarHBondContact O-N 2.92Å; D117-V122 HydrophobicContact CB-CG2 3.65Å; R120-V122 PolarHBondContact O-N 3.47Å; V122-L127 HydrophobicContact CG1-CD1 4.02Å; V122-L127 HydrophobicContact CG1-CD2 4.09Å; V122-L127 HydrophobicContact CG1-CG 3.85Å; V122-A136 HydrophobicContact CG1-CB 3.85Å; V122-A136 HydrophobicContact CG2-CB 4.2Å; V122-A139 HydrophobicContact CG2-CB 4.19Å
123	T	85.1	Confident	82.7	Confident	62 Å²	62	87.8 Å²	87.8	38%	0.38	41%	0.406	S	S	.	.			trans	-112.4	160	175.1	73.2	0	0	0	0	111.3	R125 D126 L127	T123-R125 PolarHBondContact O-N 2.84Å; T123-R125 VanDerWaalsContact O-N 3.14Å; T123-R125 PolarHBondContact OG1-N 3.06Å; T123-D126 WeakPolarHBondContact CB-OD2 3.44Å; T123-D126 PolarHBondContact N-OD2 2.77Å; T123-D126 VanDerWaalsContact N-OD2 3.1Å; T123-D126 WeakPolarHBondContact O-CB 3.27Å; T123-D126 PolarHBondContact O-N 3.44Å; T123-D126 PolarHBondContact OG1-OD2 3.05Å; T123-L127 PolarHBondContact O-N 3.42Å
124	E	84.6	Confident	82.8	Confident	49 Å²	49	88.1 Å²	88.1	23%	0.229	41%	0.407	C	S	.	.	H	α-helix	trans	-54.6	-31.5	171.3	172.4	163.8	-116.8	0	0	112.5	H101 D126 L127 R128	H101-E124 HydrophobicContact CB-CB 4.02Å; H101-E124 HydrophobicContact CB-CG 3.88Å; H101-E124 WeakPolarHBondContact CB-OE1 3.16Å; H101-E124 IonicContact CD2-OE1 2.69Å; H101-E124 IonicContact CG-OE1 2.65Å; H101-E124 PolarHBondContact N-OE1 2.78Å; E124-D126 PolarHBondContact O-N 3.36Å; E124-L127 PolarHBondContact O-N 3.34Å; E124-R128 VanDerWaalsContact CD-NH2 3.29Å; E124-R128 HydrophobicContact CG-CG 4.04Å; E124-R128 VanDerWaalsContact CG-NE 3.33Å; E124-R128 WeakPolarHBondContact O-CG 3.25Å; E124-R128 PolarHBondContact O-N 3.2Å; E124-R128 IonicContact OE1-CZ 3.26Å; E124-R128 VanDerWaalsContact OE1-CZ 3.26Å; E124-R128 IonicContact OE1-NE 2.95Å; E124-R128 PolarHBondContact OE1-NE 3.38Å; E124-R128 IonicContact OE1-NH2 2.72Å; E124-R128 PolarHBondContact OE1-NH2 2.99Å; E124-R128 IonicContact OE2-CZ 3.88Å; E124-R128 IonicContact OE2-NE 3.7Å; E124-R128 IonicContact OE2-NH2 3.45Å; E124-R128 PolarHBondContact OE2-NH2 2.97Å
125	R	83.3	Confident	82.9	Confident	212 Å²	212	82.3 Å²	82.3	80%	0.8	39%	0.393	S	S	*	.	H	α-helix	trans	-67.2	-19.9	175.5	-65	-179.3	-180	157.3	-0.1	113.4	T123 K129	T123-R125 PolarHBondContact O-N 2.84Å; T123-R125 VanDerWaalsContact O-N 3.14Å; T123-R125 PolarHBondContact OG1-N 3.06Å; R125-K129 WeakPolarHBondContact O-CE 3.36Å; R125-K129 WeakPolarHBondContact O-CG 3.38Å
126	D	83.9	Confident	83	Confident	5 Å²	5	82.1 Å²	82.1	3%	0.027	39%	0.392	C	S	.	.	H	α-helix	trans	-84.7	-34.7	173.3	-57.5	-68	0	0	0	111.5	R120 T123 E124 K129 A136	R120-D126 IonicContact CZ-OD1 3.63Å; R120-D126 IonicContact CZ-OD2 3.01Å; R120-D126 IonicContact NH1-OD1 2.67Å; R120-D126 IonicContact NH2-OD1 2.77Å; R120-D126 PolarHBondContact NH2-OD1 3.47Å; R120-D126 IonicContact NH2-OD2 2.67Å; R120-D126 PolarHBondContact NH2-OD2 2.73Å; T123-D126 WeakPolarHBondContact CB-OD2 3.44Å; T123-D126 PolarHBondContact N-OD2 2.77Å; T123-D126 VanDerWaalsContact N-OD2 3.1Å; T123-D126 WeakPolarHBondContact O-CB 3.27Å; T123-D126 PolarHBondContact O-N 3.44Å; T123-D126 PolarHBondContact OG1-OD2 3.05Å; E124-D126 PolarHBondContact O-N 3.36Å; D126-K129 IonicContact OD1-NZ 3.71Å; D126-K129 PolarHBondContact OD1-NZ 2.88Å; D126-A136 HydrophobicContact CB-CB 4.21Å
127	L	85.1	Confident	83.3	Confident	0 Å²	0	78.8 Å²	78.8	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-80.8	-13.8	179.5	-63	169.7	0	0	0	114.7	H101 I105 V122 T123 E124 A136 H137 M140	H101-L127 HydrophobicContact CB-CD1 4.02Å; I105-L127 HydrophobicContact CD1-CD1 4Å; V122-L127 HydrophobicContact CG1-CD1 4.02Å; V122-L127 HydrophobicContact CG1-CD2 4.09Å; V122-L127 HydrophobicContact CG1-CG 3.85Å; T123-L127 PolarHBondContact O-N 3.42Å; E124-L127 PolarHBondContact O-N 3.34Å; L127-A136 HydrophobicContact CD2-CB 3.93Å; L127-H137 HydrophobicContact CD2-CB 4.44Å; L127-H137 PolarHBondContact O-CE1 3.38Å; L127-H137 PolarHBondContact O-NE2 3.1Å; L127-M140 HydrophobicContact CD1-CG 4.05Å; L127-M140 HydrophobicContact CD2-CB 4.45Å
128	R	85.3	Confident	83.5	Confident	143 Å²	143	78.9 Å²	78.9	54%	0.54	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	5.4	176.1	-68.7	-176.1	-178.3	-138.5	13.3	114.1	E124	E124-R128 VanDerWaalsContact CD-NH2 3.29Å; E124-R128 HydrophobicContact CG-CG 4.04Å; E124-R128 VanDerWaalsContact CG-NE 3.33Å; E124-R128 WeakPolarHBondContact O-CG 3.25Å; E124-R128 PolarHBondContact O-N 3.2Å; E124-R128 IonicContact OE1-CZ 3.26Å; E124-R128 VanDerWaalsContact OE1-CZ 3.26Å; E124-R128 IonicContact OE1-NE 2.95Å; E124-R128 PolarHBondContact OE1-NE 3.38Å; E124-R128 IonicContact OE1-NH2 2.72Å; E124-R128 PolarHBondContact OE1-NH2 2.99Å; E124-R128 IonicContact OE2-CZ 3.88Å; E124-R128 IonicContact OE2-NE 3.7Å; E124-R128 IonicContact OE2-NH2 3.45Å; E124-R128 PolarHBondContact OE2-NH2 2.97Å
129	K	82.5	Confident	84	Confident	79 Å²	79	71.3 Å²	71.3	34%	0.343	34%	0.339	S	S	.	.			trans	-70.4	148.8	-177.8	-73	174	-172.6	160.6	0	112.8	L77 R125 D126 P131 Q133	L77-K129 WeakPolarHBondContact CD2-O 3.42Å; R125-K129 WeakPolarHBondContact O-CE 3.36Å; R125-K129 WeakPolarHBondContact O-CG 3.38Å; D126-K129 IonicContact OD1-NZ 3.71Å; D126-K129 PolarHBondContact OD1-NZ 2.88Å; K129-P131 CarbonylContact C-O 3.59Å; K129-P131 CarbonylContact O-C 3.56Å; K129-Q133 HydrophobicContact CD-CB 4.43Å
130	R	76.5	Confident	84.7	Confident	201 Å²	201	63.7 Å²	63.7	76%	0.758	30%	0.298	S	S	*	.	S	Bend	trans	-124	124.7	164.1	-64.7	-176	178.7	-164.3	-4.2	107.5	L77	L77-R130 HydrophobicContact CD1-CG 4.16Å; L77-R130 HydrophobicContact CD2-CG 4.46Å
131	P	75	Confident	85.1	Confident	124 Å²	124	57.2 Å²	57.2	81%	0.805	27%	0.274	S	S	*	.	S	Bend	cis	-61.2	162.3	-5.8	28.6	-36.3	0	0	0	113.4	K129 Q133	K129-P131 CarbonylContact C-O 3.59Å; K129-P131 CarbonylContact O-C 3.56Å; P131-Q133 PolarHBondContact O-N 3.25Å
132	L	81.5	Confident	85.4	Confident	42 Å²	42	53.4 Å²	53.4	22%	0.22	25%	0.254	C	S	.	.			trans	-61.8	125.3	-177.9	-84.1	172.2	0	0	0	111.9	L68 T73 L77 M134 H137	L68-L132 HydrophobicContact CD2-CD1 3.97Å; T73-L132 HydrophobicContact CG2-CD1 3.85Å; T73-L132 HydrophobicContact CG2-CG 4.35Å; L77-L132 HydrophobicContact CD2-CD2 3.69Å; L77-L132 HydrophobicContact CG-CD2 3.89Å; L132-M134 VanDerWaalsContact C-N 3.32Å; L132-M134 PolarHBondContact O-N 2.86Å; L132-H137 WeakPolarHBondContact CD2-NE2 3.3Å
133	Q	84.9	Confident	85.5	Confident	51 Å²	51	53.9 Å²	53.9	24%	0.238	26%	0.257	C	S	.	.			trans	-80.1	79	170.7	-172.1	-177.8	-35.6	0	0	110.1	D117 K129 P131 G135 A136 H137	D117-Q133 PolarHBondContact OD2-NE2 3.39Å; K129-Q133 HydrophobicContact CD-CB 4.43Å; P131-Q133 PolarHBondContact O-N 3.25Å; Q133-G135 PolarHBondContact O-N 3.1Å; Q133-G135 VanDerWaalsContact O-N 3.1Å; Q133-A136 HydrophobicContact CB-CB 4.33Å; Q133-A136 HydrophobicContact CG-CB 4.07Å; Q133-A136 WeakPolarHBondContact O-CB 3.34Å; Q133-A136 PolarHBondContact O-N 2.73Å; Q133-H137 PolarHBondContact O-CD2 3.34Å; Q133-H137 PolarHBondContact O-N 3.48Å
134	M	86.9	Confident	85.6	Confident	42 Å²	42	50.9 Å²	50.9	21%	0.207	24%	0.239	C	C	.	.	H	α-helix	trans	-53.5	-35.8	-172.1	-171.8	56.6	70.4	0	0	113.9	I32 L68 L132 A136 H137 L138	I32-M134 HydrophobicContact CD1-CG 3.82Å; I32-M134 HydrophobicContact CG1-CG 3.93Å; I32-M134 HydrophobicContact CG1-SD 4.24Å; I32-M134 HydrophobicContact CG2-CE 4.16Å; I32-M134 HydrophobicContact CG2-SD 4.13Å; L68-M134 HydrophobicContact CD2-CE 4.08Å; L132-M134 VanDerWaalsContact C-N 3.32Å; L132-M134 PolarHBondContact O-N 2.86Å; M134-A136 VanDerWaalsContact C-N 3.35Å; M134-A136 PolarHBondContact O-N 2.65Å; M134-H137 PolarHBondContact O-N 3.11Å; M134-H137 HydrophobicContact SD-CB 4.41Å; M134-L138 HydrophobicContact CG-CD1 4.03Å; M134-L138 HydrophobicContact CG-CG 4.13Å; M134-L138 WeakPolarHBondContact O-CB 3.33Å; M134-L138 WeakPolarHBondContact O-CG 3.49Å; M134-L138 PolarHBondContact O-N 2.86Å; M134-L138 HydrophobicContact SD-CG 4.18Å
135	G	87	Confident	85.8	Confident	30 Å²	30	48.6 Å²	48.6	31%	0.309	23%	0.228	S	C	.	.	H	α-helix	trans	-56.9	-42.6	174.8	0	0	0	0	0	113.9	D117 Q133 L138 A139	D117-G135 VanDerWaalsContact OD2-C 3.31Å; Q133-G135 PolarHBondContact O-N 3.1Å; Q133-G135 VanDerWaalsContact O-N 3.1Å; G135-L138 PolarHBondContact O-N 3.48Å; G135-A139 WeakPolarHBondContact O-CB 3.48Å; G135-A139 PolarHBondContact O-N 3.48Å
136	A	88.6	Confident	85.8	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-66.9	-41.6	176.6	0	0	0	0	0	111.7	D117 V122 D126 L127 Q133 M134 A139 M140	D117-A136 PolarHBondContact OD2-N 2.69Å; V122-A136 HydrophobicContact CG1-CB 3.85Å; V122-A136 HydrophobicContact CG2-CB 4.2Å; D126-A136 HydrophobicContact CB-CB 4.21Å; L127-A136 HydrophobicContact CD2-CB 3.93Å; Q133-A136 HydrophobicContact CB-CB 4.33Å; Q133-A136 HydrophobicContact CG-CB 4.07Å; Q133-A136 WeakPolarHBondContact O-CB 3.34Å; Q133-A136 PolarHBondContact O-N 2.73Å; M134-A136 VanDerWaalsContact C-N 3.35Å; M134-A136 PolarHBondContact O-N 2.65Å; A136-A139 PolarHBondContact O-N 3.35Å; A136-M140 PolarHBondContact O-N 3.12Å
137	H	88.8	Confident	85.8	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64.7	-42.3	176.4	-73.4	-81	0	0	0	112	Y82 L127 L132 Q133 M134 M140 I141	Y82-H137 AromaticContact CE2-ND1 3.76Å; Y82-H137 AromaticContact CZ-ND1 3.76Å; Y82-H137 WeakPolarHBondContact OH-CA 3.42Å; Y82-H137 WeakPolarHBondContact OH-CB 3.49Å; Y82-H137 PolarHBondContact OH-ND1 3.15Å; Y82-H137 PolarHBondContact OH-O 3.14Å; L127-H137 HydrophobicContact CD2-CB 4.44Å; L127-H137 PolarHBondContact O-CE1 3.38Å; L127-H137 PolarHBondContact O-NE2 3.1Å; L132-H137 WeakPolarHBondContact CD2-NE2 3.3Å; Q133-H137 PolarHBondContact O-CD2 3.34Å; Q133-H137 PolarHBondContact O-N 3.48Å; M134-H137 PolarHBondContact O-N 3.11Å; M134-H137 HydrophobicContact SD-CB 4.41Å; H137-M140 PolarHBondContact O-N 3.29Å; H137-I141 WeakPolarHBondContact O-CD1 3.32Å; H137-I141 VanDerWaalsContact O-CG1 3.25Å; H137-I141 WeakPolarHBondContact O-CG1 3.47Å; H137-I141 PolarHBondContact O-N 3.17Å
138	L	90.1	Very high	85.7	Confident	29 Å²	29	41.4 Å²	41.4	15%	0.152	20%	0.203	C	C	.	.	H	α-helix	trans	-65.3	-42.8	175.4	-71.3	175.2	0	0	0	112.1	K31 I32 M134 G135 M140 I141 D142	K31-L138 HydrophobicContact CG-CD1 4.38Å; K31-L138 HydrophobicContact CG-CD2 4.46Å; I32-L138 HydrophobicContact CG1-CD1 3.94Å; I32-L138 HydrophobicContact CG1-CD2 4.21Å; I32-L138 HydrophobicContact CG1-CG 4.49Å; M134-L138 HydrophobicContact CG-CD1 4.03Å; M134-L138 HydrophobicContact CG-CG 4.13Å; M134-L138 WeakPolarHBondContact O-CB 3.33Å; M134-L138 WeakPolarHBondContact O-CG 3.49Å; M134-L138 PolarHBondContact O-N 2.86Å; M134-L138 HydrophobicContact SD-CG 4.18Å; G135-L138 PolarHBondContact O-N 3.48Å; L138-M140 VanDerWaalsContact C-N 3.29Å; L138-M140 PolarHBondContact O-N 3.08Å; L138-I141 PolarHBondContact O-N 3.04Å; L138-D142 WeakPolarHBondContact O-CB 3.44Å; L138-D142 PolarHBondContact O-N 3.25Å
139	A	88.6	Confident	85.5	Confident	14 Å²	14	34.9 Å²	34.9	12%	0.116	18%	0.179	C	C	.	.	H	α-helix	trans	-60.4	-39.2	175.1	0	0	0	0	0	112	V115 T116 D117 V122 G135 A136 T143	V115-A139 HydrophobicContact CG1-CB 4.13Å; T116-A139 WeakPolarHBondContact O-CB 3.46Å; D117-A139 HydrophobicContact CB-CB 4Å; V122-A139 HydrophobicContact CG2-CB 4.19Å; G135-A139 WeakPolarHBondContact O-CB 3.48Å; G135-A139 PolarHBondContact O-N 3.48Å; A136-A139 PolarHBondContact O-N 3.35Å; A139-T143 WeakPolarHBondContact O-CB 3.26Å; A139-T143 PolarHBondContact O-N 2.99Å; A139-T143 PolarHBondContact O-OG1 3.11Å
140	M	88.9	Confident	85.2	Confident	2 Å²	2	34.1 Å²	34.1	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-66.6	-43.4	175.7	-137.4	-60.8	-65.7	0	0	111.6	Y82 V104 L108 V115 L127 A136 H137 L138 T143 L144	Y82-M140 HydrophobicContact CD1-CE 3.2Å; Y82-M140 HydrophobicContact CD2-CE 3.71Å; Y82-M140 HydrophobicContact CE1-CE 3.59Å; Y82-M140 HydrophobicContact CE2-CE 4.05Å; Y82-M140 HydrophobicContact CG-CE 3.25Å; V104-M140 HydrophobicContact CG1-CE 4.07Å; V104-M140 HydrophobicContact CG1-SD 4.03Å; L108-M140 HydrophobicContact CD1-SD 3.81Å; V115-M140 HydrophobicContact CG1-CB 4.08Å; V115-M140 HydrophobicContact CG1-CG 4.03Å; V115-M140 HydrophobicContact CG2-CG 4.15Å; V115-M140 HydrophobicContact CG2-SD 4.3Å; L127-M140 HydrophobicContact CD1-CG 4.05Å; L127-M140 HydrophobicContact CD2-CB 4.45Å; A136-M140 PolarHBondContact O-N 3.12Å; H137-M140 PolarHBondContact O-N 3.29Å; L138-M140 VanDerWaalsContact C-N 3.29Å; L138-M140 PolarHBondContact O-N 3.08Å; M140-T143 PolarHBondContact O-N 3.29Å; M140-L144 HydrophobicContact CE-CD1 3.51Å; M140-L144 HydrophobicContact CE-CG 4.04Å; M140-L144 PolarHBondContact O-N 3.31Å; M140-L144 HydrophobicContact SD-CD1 4.39Å; M140-L144 HydrophobicContact SD-CG 4.28Å
141	I	90.3	Very high	85.1	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-62.4	-47.2	174.9	-66.3	162.2	0	0	0	111.2	L36 W38 L39 Y82 H137 L138 T143 L144 M145	L36-I141 HydrophobicContact CD2-CD1 3.82Å; W38-I141 HydrophobicContact CE3-CG2 4.29Å; W38-I141 HydrophobicContact CZ3-CG2 4.42Å; L39-I141 HydrophobicContact CD2-CD1 4.09Å; L39-I141 HydrophobicContact CD2-CG1 4.08Å; Y82-I141 HydrophobicContact CE1-CD1 4.36Å; Y82-I141 HydrophobicContact CE1-CG1 3.71Å; H137-I141 WeakPolarHBondContact O-CD1 3.32Å; H137-I141 VanDerWaalsContact O-CG1 3.25Å; H137-I141 WeakPolarHBondContact O-CG1 3.47Å; H137-I141 PolarHBondContact O-N 3.17Å; L138-I141 PolarHBondContact O-N 3.04Å; I141-T143 PolarHBondContact O-N 3.29Å; I141-L144 CarbonylContact O-C 3.59Å; I141-L144 WeakPolarHBondContact O-CB 3.4Å; I141-L144 PolarHBondContact O-N 2.88Å; I141-L144 VanDerWaalsContact O-N 3.12Å; I141-M145 HydrophobicContact CG2-CE 3.53Å; I141-M145 HydrophobicContact CG2-CG 4.33Å; I141-M145 HydrophobicContact CG2-SD 4.23Å; I141-M145 WeakPolarHBondContact O-CB 3.32Å; I141-M145 WeakPolarHBondContact O-CG 3.37Å; I141-M145 PolarHBondContact O-N 3.29Å
142	D	89.9	Confident	84.7	Confident	27 Å²	27	20.4 Å²	20.4	14%	0.144	12%	0.116	C	C	.	.	H	α-helix	trans	-64.1	-31.3	179.1	-84.3	17.7	0	0	0	112	K31 L138 M145 M146 N302	K31-D142 IonicContact NZ-OD1 2.57Å; K31-D142 PolarHBondContact NZ-OD1 2.98Å; K31-D142 IonicContact NZ-OD2 3.42Å; K31-D142 PolarHBondContact NZ-OD2 3.44Å; L138-D142 WeakPolarHBondContact O-CB 3.44Å; L138-D142 PolarHBondContact O-N 3.25Å; D142-M145 WeakPolarHBondContact O-CB 3.43Å; D142-M146 WeakPolarHBondContact O-CB 3.29Å; D142-M146 PolarHBondContact O-N 2.84Å; D142-N302 PolarHBondContact OD2-ND2 3.25Å
143	T	88.9	Confident	83.6	Confident	19 Å²	19	19.5 Å²	19.5	12%	0.117	11%	0.112	C	C	.	.	H	α-helix	trans	-72.3	-37.5	173.7	-48.4	0	0	0	0	111.8	L108 L113 V115 A139 M140 I141 M146 A147	L108-T143 HydrophobicContact CD1-CG2 3.94Å; L108-T143 HydrophobicContact CD2-CG2 4.2Å; L108-T143 HydrophobicContact CG-CG2 4.47Å; L113-T143 HydrophobicContact CB-CG2 3.86Å; V115-T143 HydrophobicContact CG2-CG2 4.01Å; A139-T143 WeakPolarHBondContact O-CB 3.26Å; A139-T143 PolarHBondContact O-N 2.99Å; A139-T143 PolarHBondContact O-OG1 3.11Å; M140-T143 PolarHBondContact O-N 3.29Å; I141-T143 PolarHBondContact O-N 3.29Å; T143-M146 WeakPolarHBondContact O-CB 3.44Å; T143-M146 PolarHBondContact O-N 2.68Å; T143-A147 PolarHBondContact O-N 2.68Å
144	L	87.8	Confident	82.3	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-65.4	-41.4	170.5	-81.5	176.3	0	0	0	112.4	W38 L39 Y82 I89 L90 V104 L108 M140 I141 M146 A147 Y148	W38-L144 HydrophobicContact CZ3-CB 4.44Å; L39-L144 HydrophobicContact CD1-CD1 4.29Å; Y82-L144 HydrophobicContact CD1-CD1 4.05Å; I89-L144 HydrophobicContact CD1-CB 4.47Å; I89-L144 HydrophobicContact CD1-CD2 4.43Å; L90-L144 HydrophobicContact CD1-CD2 4.09Å; L90-L144 HydrophobicContact CG-CD2 4.42Å; V104-L144 HydrophobicContact CG1-CD2 4.14Å; L108-L144 HydrophobicContact CD1-CD2 4.32Å; L108-L144 HydrophobicContact CD1-CG 4.4Å; L108-L144 HydrophobicContact CD2-CD2 4.28Å; M140-L144 HydrophobicContact CE-CD1 3.51Å; M140-L144 HydrophobicContact CE-CG 4.04Å; M140-L144 PolarHBondContact O-N 3.31Å; M140-L144 HydrophobicContact SD-CD1 4.39Å; M140-L144 HydrophobicContact SD-CG 4.28Å; I141-L144 CarbonylContact O-C 3.59Å; I141-L144 WeakPolarHBondContact O-CB 3.4Å; I141-L144 PolarHBondContact O-N 2.88Å; I141-L144 VanDerWaalsContact O-N 3.12Å; L144-M146 VanDerWaalsContact C-N 3.3Å; L144-M146 PolarHBondContact O-N 3.42Å; L144-A147 PolarHBondContact O-N 2.85Å; L144-Y148 WeakPolarHBondContact O-CB 3.43Å; L144-Y148 PolarHBondContact O-N 3.18Å
145	M	87.3	Confident	80.4	Confident	1 Å²	1	22.5 Å²	22.5	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-58.9	-41.9	172.1	-77.7	-177.1	-177.6	0	0	111.6	W38 I141 D142 Y148 T149 N303 V306	W38-M145 HydrophobicContact CB-CE 3.89Å; W38-M145 HydrophobicContact CD2-CE 3.61Å; W38-M145 HydrophobicContact CD2-CG 4.04Å; W38-M145 HydrophobicContact CE3-CE 3.39Å; W38-M145 HydrophobicContact CE3-CG 3.67Å; W38-M145 HydrophobicContact CE3-SD 4.45Å; W38-M145 HydrophobicContact CG-CE 3.83Å; W38-M145 HydrophobicContact CH2-CB 4.31Å; W38-M145 HydrophobicContact CH2-CG 3.65Å; W38-M145 HydrophobicContact CZ2-CG 4.03Å; W38-M145 HydrophobicContact CZ3-CB 4.48Å; W38-M145 HydrophobicContact CZ3-CE 4.12Å; W38-M145 HydrophobicContact CZ3-CG 3.46Å; W38-M145 VanDerWaalsContact CZ3-CG 3.46Å; I141-M145 HydrophobicContact CG2-CE 3.53Å; I141-M145 HydrophobicContact CG2-CG 4.33Å; I141-M145 HydrophobicContact CG2-SD 4.23Å; I141-M145 WeakPolarHBondContact O-CB 3.32Å; I141-M145 WeakPolarHBondContact O-CG 3.37Å; I141-M145 PolarHBondContact O-N 3.29Å; D142-M145 WeakPolarHBondContact O-CB 3.43Å; M145-Y148 PolarHBondContact O-N 3.07Å; M145-T149 WeakPolarHBondContact O-CB 3.22Å; M145-T149 PolarHBondContact O-N 2.76Å; M145-T149 PolarHBondContact O-OG1 2.72Å; M145-N303 WeakPolarHBondContact CE-OD1 3.22Å; M145-V306 HydrophobicContact CB-CG2 3.57Å; M145-V306 HydrophobicContact CG-CG2 3.87Å; M145-V306 WeakPolarHBondContact O-CG2 3.41Å; M145-V306 HydrophobicContact SD-CG2 4.46Å
146	M	85	Confident	78.2	Confident	35 Å²	35	28.5 Å²	28.5	17%	0.172	15%	0.153	C	C	.	.	H	α-helix	trans	-63.8	-48.1	175.7	-146.9	65.2	74.3	0	0	111.3	D142 T143 L144 Y148 T149 V150 F182	D142-M146 WeakPolarHBondContact O-CB 3.29Å; D142-M146 PolarHBondContact O-N 2.84Å; T143-M146 WeakPolarHBondContact O-CB 3.44Å; T143-M146 PolarHBondContact O-N 2.68Å; L144-M146 VanDerWaalsContact C-N 3.3Å; L144-M146 PolarHBondContact O-N 3.42Å; M146-Y148 VanDerWaalsContact C-N 3.31Å; M146-Y148 PolarHBondContact O-N 3.03Å; M146-T149 PolarHBondContact O-N 3.2Å; M146-V150 WeakPolarHBondContact O-CG2 3.15Å; M146-V150 PolarHBondContact O-N 3.5Å; M146-F182 HydrophobicContact CE-CD1 4.41Å; M146-F182 HydrophobicContact CE-CE1 4.29Å; M146-F182 HydrophobicContact CG-CD1 4.14Å; M146-F182 HydrophobicContact CG-CD2 4.19Å; M146-F182 HydrophobicContact CG-CE1 4.15Å; M146-F182 HydrophobicContact CG-CE2 4.16Å; M146-F182 HydrophobicContact CG-CG 4.16Å; M146-F182 HydrophobicContact CG-CZ 4.11Å; M146-F182 HydrophobicContact SD-CD1 3.54Å; M146-F182 VanDerWaalsContact SD-CD1 3.54Å; M146-F182 HydrophobicContact SD-CD2 4.4Å; M146-F182 HydrophobicContact SD-CE1 3.14Å; M146-F182 WeakPolarHBondContact SD-CE1 3.34Å; M146-F182 HydrophobicContact SD-CE2 4.04Å; M146-F182 HydrophobicContact SD-CG 4.15Å; M146-F182 HydrophobicContact SD-CZ 3.39Å; M146-F182 WeakPolarHBondContact SD-CZ 3.46Å
147	A	83.4	Confident	76.1	Confident	3 Å²	3	33.1 Å²	33.1	3%	0.025	17%	0.173	C	C	.	.	H	α-helix	trans	-59.4	-41.1	176.6	0	0	0	0	0	112.3	I89 L90 L108 L113 T143 L144 V150 E151	I89-A147 HydrophobicContact CG2-CB 4.18Å; L90-A147 HydrophobicContact CD2-CB 3.63Å; L108-A147 HydrophobicContact CD2-CB 3.68Å; L113-A147 HydrophobicContact CD1-CB 3.62Å; T143-A147 PolarHBondContact O-N 2.68Å; L144-A147 PolarHBondContact O-N 2.85Å; A147-V150 PolarHBondContact O-N 2.91Å; A147-E151 WeakPolarHBondContact O-CB 3.45Å; A147-E151 PolarHBondContact O-N 3.26Å
148	Y	82.4	Confident	74	Confident	27 Å²	27	36.4 Å²	36.4	11%	0.106	19%	0.191	C	C	.	.	H	α-helix	trans	-66.3	-42.4	175.5	179	-112.2	0	0	0	112.5	W38 K42 I89 L144 M145 M146 E151 T152 V306 E310	W38-Y148 AromaticContact CZ2-CD1 3.8Å; W38-Y148 HydrophobicContact CZ2-CD1 3.8Å; W38-Y148 HydrophobicContact CZ2-CG 4.08Å; K42-Y148 PolarHBondContact NZ-OH 3.18Å; I89-Y148 HydrophobicContact CG1-CD2 3.91Å; I89-Y148 HydrophobicContact CG1-CG 4.27Å; I89-Y148 HydrophobicContact CG2-CD2 4.4Å; L144-Y148 WeakPolarHBondContact O-CB 3.43Å; L144-Y148 PolarHBondContact O-N 3.18Å; M145-Y148 PolarHBondContact O-N 3.07Å; M146-Y148 VanDerWaalsContact C-N 3.31Å; M146-Y148 PolarHBondContact O-N 3.03Å; Y148-E151 PolarHBondContact O-N 3.46Å; Y148-T152 WeakPolarHBondContact CD2-OG1 3.41Å; Y148-T152 WeakPolarHBondContact CE2-OG1 2.98Å; Y148-T152 WeakPolarHBondContact O-CB 3.41Å; Y148-T152 PolarHBondContact O-N 3.12Å; Y148-T152 PolarHBondContact O-OG1 2.78Å; Y148-V306 HydrophobicContact CD1-CG1 3.66Å; Y148-V306 HydrophobicContact CE1-CG1 3.83Å; Y148-E310 HydrophobicContact CE1-CG 3.68Å
149	T	80.7	Confident	71.5	Confident	6 Å²	6	38.1 Å²	38.1	4%	0.037	20%	0.203	C	C	.	.	H	α-helix	trans	-59.9	-48.3	175.5	-55.5	0	0	0	0	110.4	M145 M146 V153 L180 F182 V306 A309	M145-T149 WeakPolarHBondContact O-CB 3.22Å; M145-T149 PolarHBondContact O-N 2.76Å; M145-T149 PolarHBondContact O-OG1 2.72Å; M146-T149 PolarHBondContact O-N 3.2Å; T149-V153 WeakPolarHBondContact O-CB 3.34Å; T149-V153 WeakPolarHBondContact O-CG2 3.39Å; T149-V153 PolarHBondContact O-N 2.77Å; T149-L180 HydrophobicContact CG2-CD1 3.9Å; T149-F182 HydrophobicContact CG2-CZ 4.48Å; T149-V306 VanDerWaalsContact OG1-CG2 3.31Å; T149-V306 WeakPolarHBondContact OG1-CG2 3.43Å; T149-A309 HydrophobicContact CG2-CB 4.37Å
150	V	77.3	Confident	68.8	Low	63 Å²	63	43.3 Å²	43.3	38%	0.382	23%	0.233	S	C	.	.	H	α-helix	trans	-59	-50.7	175.9	172.7	0	0	0	0	111.5	M146 A147 T152 V153 N154 F182	M146-V150 WeakPolarHBondContact O-CG2 3.15Å; M146-V150 PolarHBondContact O-N 3.5Å; A147-V150 PolarHBondContact O-N 2.91Å; V150-T152 PolarHBondContact O-N 2.84Å; V150-V153 PolarHBondContact O-N 3.31Å; V150-N154 WeakPolarHBondContact O-CB 3.36Å; V150-N154 PolarHBondContact O-N 3.39Å; V150-F182 HydrophobicContact CG2-CD2 3.76Å; V150-F182 HydrophobicContact CG2-CE2 3.5Å; V150-F182 VanDerWaalsContact CG2-CE2 3.5Å
151	E	73.9	Confident	66.2	Low	27 Å²	27	45.8 Å²	45.8	13%	0.126	25%	0.25	C	S	.	.	H	α-helix	trans	-76.6	-22.5	-173.2	177.6	160.5	159.3	0	0	113.9	R111 A147 Y148 V153 K157	R111-E151 IonicContact CZ-OE2 3.82Å; R111-E151 IonicContact NE-OE2 2.63Å; R111-E151 PolarHBondContact NE-OE2 3.13Å; R111-E151 IonicContact NH2-OE2 3.22Å; R111-E151 PolarHBondContact NH2-OE2 3.04Å; A147-E151 WeakPolarHBondContact O-CB 3.45Å; A147-E151 PolarHBondContact O-N 3.26Å; Y148-E151 PolarHBondContact O-N 3.46Å; E151-V153 VanDerWaalsContact C-N 3.34Å; E151-K157 PolarHBondContact O-NZ 2.69Å; E151-K157 IonicContact OE1-NZ 3.16Å; E151-K157 PolarHBondContact OE1-NZ 3.3Å
152	T	66.4	Low	63.6	Low	10 Å²	10	48.4 Å²	48.4	6%	0.061	27%	0.268	C	S	.	.	H	α-helix	trans	-72.5	-31.6	171.1	-62.4	0	0	0	0	111.6	Y148 V150 A309 W313	Y148-T152 WeakPolarHBondContact CD2-OG1 3.41Å; Y148-T152 WeakPolarHBondContact CE2-OG1 2.98Å; Y148-T152 WeakPolarHBondContact O-CB 3.41Å; Y148-T152 PolarHBondContact O-N 3.12Å; Y148-T152 PolarHBondContact O-OG1 2.78Å; V150-T152 PolarHBondContact O-N 2.84Å; T152-A309 HydrophobicContact CG2-CB 4.13Å; T152-A309 WeakPolarHBondContact CG2-O 3.41Å; T152-W313 HydrophobicContact CG2-CB 3.88Å; T152-W313 HydrophobicContact CG2-CE3 3.99Å
153	V	59.5	Low	60.7	Low	23 Å²	23	55.4 Å²	55.4	14%	0.139	30%	0.297	C	S	.	.	H	α-helix	trans	-89.1	-26.5	-178.9	165.8	0	0	0	0	113.2	T149 V150 E151 V155 I178	T149-V153 WeakPolarHBondContact O-CB 3.34Å; T149-V153 WeakPolarHBondContact O-CG2 3.39Å; T149-V153 PolarHBondContact O-N 2.77Å; V150-V153 PolarHBondContact O-N 3.31Å; E151-V153 VanDerWaalsContact C-N 3.34Å; V153-V155 PolarHBondContact O-N 3.42Å; V153-I178 HydrophobicContact CB-CG2 4.48Å; V153-I178 HydrophobicContact CG1-CB 3.61Å; V153-I178 HydrophobicContact CG1-CD1 4.3Å; V153-I178 HydrophobicContact CG1-CG2 3.62Å; V153-I178 WeakPolarHBondContact CG1-O 3.43Å; V153-I178 HydrophobicContact CG2-CB 4.42Å; V153-I178 HydrophobicContact CG2-CD1 3.67Å; V153-I178 HydrophobicContact CG2-CG2 4.13Å
154	N	56.7	Low	57.9	Low	65 Å²	65	59.7 Å²	59.7	35%	0.348	33%	0.328	S	S	.	.			trans	-55.7	127.6	-167.5	-174.2	20.4	0	0	0	113.7	V150 E156 K157	V150-N154 WeakPolarHBondContact O-CB 3.36Å; V150-N154 PolarHBondContact O-N 3.39Å; N154-E156 PolarHBondContact ND2-OE2 3.48Å; N154-E156 VanDerWaalsContact ND2-OE2 3.11Å; N154-E156 PolarHBondContact O-N 2.86Å; N154-K157 PolarHBondContact O-N 2.85Å; N154-K157 VanDerWaalsContact O-N 3.16Å
155	V	47.9	Very low	55.4	Low	91 Å²	91	63.1 Å²	63.1	55%	0.552	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-57.5	-24.8	-172.5	176.4	0	0	0	0	113.2	V153 K157 L158	V153-V155 PolarHBondContact O-N 3.42Å; V155-K157 PolarHBondContact O-N 2.97Å; V155-K157 VanDerWaalsContact O-N 3.13Å; V155-L158 HydrophobicContact CG1-CD1 4.33Å; V155-L158 VanDerWaalsContact O-CB 3.32Å; V155-L158 WeakPolarHBondContact O-CB 3.43Å; V155-L158 PolarHBondContact O-N 3.45Å
156	E	41	Very low	52.6	Low	156 Å²	156	71.1 Å²	71.1	73%	0.729	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-64.5	-16.2	-179.9	-62.4	-177.5	134.7	0	0	113.9	N154 P159	N154-E156 PolarHBondContact ND2-OE2 3.48Å; N154-E156 VanDerWaalsContact ND2-OE2 3.11Å; N154-E156 PolarHBondContact O-N 2.86Å; E156-P159 WeakPolarHBondContact O-CD 3.46Å
157	K	43.6	Very low	50	Low	97 Å²	97	77.8 Å²	77.8	42%	0.422	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-89.8	-2.6	171.7	-67.9	174.8	-175.4	167.2	0	114.1	E151 N154 V155	E151-K157 PolarHBondContact O-NZ 2.69Å; E151-K157 IonicContact OE1-NZ 3.16Å; E151-K157 PolarHBondContact OE1-NZ 3.3Å; N154-K157 PolarHBondContact O-N 2.85Å; N154-K157 VanDerWaalsContact O-N 3.16Å; V155-K157 PolarHBondContact O-N 2.97Å; V155-K157 VanDerWaalsContact O-N 3.13Å
158	L	44.8	Very low	47.2	Very low	70 Å²	70	83.7 Å²	83.7	37%	0.366	44%	0.439	S	S	.	.			trans	-83.9	-5.2	176.7	-60.5	176.6	0	0	0	118.3	V155 V160 C161 C162	V155-L158 HydrophobicContact CG1-CD1 4.33Å; V155-L158 VanDerWaalsContact O-CB 3.32Å; V155-L158 WeakPolarHBondContact O-CB 3.43Å; V155-L158 PolarHBondContact O-N 3.45Å; L158-V160 PolarHBondContact O-N 3.04Å; L158-V160 VanDerWaalsContact O-N 3.15Å; L158-C161 PolarHBondContact O-N 2.81Å; L158-C162 PolarHBondContact O-N 3.48Å
159	P	36.6	Very low	44.6	Very low	64 Å²	64	88.5 Å²	88.5	42%	0.416	47%	0.473	S	S	.	.	H	α-helix	trans	-73	-11.7	-170.9	30.8	-35.7	0	0	0	114.3	E156 K163	E156-P159 WeakPolarHBondContact O-CD 3.46Å; P159-K163 WeakPolarHBondContact O-CD 3.49Å; P159-K163 VanDerWaalsContact O-CG 3.3Å; P159-K163 WeakPolarHBondContact O-CG 3.49Å
160	V	32.7	Very low	42.2	Very low	123 Å²	123	94.2 Å²	94.2	75%	0.745	50%	0.503	S	S	*	.	H	α-helix	trans	-74.8	-44.1	172.4	-175.6	0	0	0	0	110.5	L158	L158-V160 PolarHBondContact O-N 3.04Å; L158-V160 VanDerWaalsContact O-N 3.15Å
161	C	34	Very low	40.2	Very low	54 Å²	54	92.5 Å²	92.5	37%	0.365	49%	0.494	S	S	.	.	H	α-helix	trans	-66.5	-48	177.9	-166.9	0	0	0	0	111.2	L158 K163 S164 L165	L158-C161 PolarHBondContact O-N 2.81Å; C161-K163 VanDerWaalsContact C-N 3.25Å; C161-K163 PolarHBondContact O-N 3.32Å; C161-K163 VanDerWaalsContact O-N 3.16Å; C161-S164 PolarHBondContact O-N 2.95Å; C161-L165 VanDerWaalsContact SG-CD1 3.56Å
162	C	35	Very low	37.9	Very low	56 Å²	56	100 Å²	100	38%	0.378	53%	0.526	S	S	.	.	H	α-helix	trans	-64	-22.8	-176.4	-66.2	0	0	0	0	114.9	L158	L158-C162 PolarHBondContact O-N 3.48Å
163	K	29.6	Very low	36.2	Very low	173 Å²	173	109.7 Å²	109.7	75%	0.752	56%	0.561	S	S	*	*	H	α-helix	trans	-77.1	-20.7	178.9	-77.4	174.8	-177.6	176.4	0	114	P159 C161	P159-K163 WeakPolarHBondContact O-CD 3.49Å; P159-K163 VanDerWaalsContact O-CG 3.3Å; P159-K163 WeakPolarHBondContact O-CG 3.49Å; C161-K163 VanDerWaalsContact C-N 3.25Å; C161-K163 PolarHBondContact O-N 3.32Å; C161-K163 VanDerWaalsContact O-N 3.16Å
164	S	31.2	Very low	34.9	Very low	110 Å²	110	112.1 Å²	112.1	77%	0.769	58%	0.576	S	S	*	*	H	α-helix	trans	-92	-11.2	177.6	-159.7	0	0	0	0	113.5	C161	C161-S164 PolarHBondContact O-N 2.95Å
165	L	33.8	Very low	33.7	Very low	71 Å²	71	115.5 Å²	115.5	37%	0.372	59%	0.59	S	S	.	*			trans	-107.9	27.9	-164.9	-77.2	167.6	0	0	0	115.4	C161 H167 C171	C161-L165 VanDerWaalsContact SG-CD1 3.56Å; L165-H167 PolarHBondContact O-N 3.36Å; L165-C171 HydrophobicContact CB-CB 4.45Å; L165-C171 HydrophobicContact CD1-CB 4.48Å
166	Q	29.6	Very low	32.9	Very low	169 Å²	169	118 Å²	118	79%	0.79	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-12.6	176.6	-68.4	-164.7	-6.8	0	0	114.4
167	H	30.4	Very low	32.6	Very low	176 Å²	176	112.9 Å²	112.9	82%	0.815	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129	63.2	-179.1	-73.5	-88.3	0	0	0	114.2	L165	L165-H167 PolarHBondContact O-N 3.36Å
168	K	24.6	Very low	32.1	Very low	126 Å²	126	110 Å²	110	55%	0.548	57%	0.566	S	S	.	*			trans	-162.2	138.6	151.4	-109.1	165.6	-172.7	-169.5	0	110.5	L170 M327	K168-L170 VanDerWaalsContact C-N 3.28Å; K168-L170 PolarHBondContact O-N 3.43Å; K168-M327 HydrophobicContact CD-CE 4.41Å
169	P	28.5	Very low	31.4	Very low	128 Å²	128	117.3 Å²	117.3	83%	0.831	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-5.8	-166.6	29.2	-36.1	0	0	0	115.7
170	L	29.1	Very low	31.3	Very low	126 Å²	126	116.6 Å²	116.6	66%	0.66	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-35.1	-174.5	-153.4	69.7	0	0	0	113.3	K168 K172 R173	K168-L170 VanDerWaalsContact C-N 3.28Å; K168-L170 PolarHBondContact O-N 3.43Å; L170-K172 VanDerWaalsContact C-N 3.26Å; L170-K172 PolarHBondContact O-N 2.97Å; L170-K172 VanDerWaalsContact O-N 3.13Å; L170-R173 PolarHBondContact O-N 3.31Å
171	C	34.7	Very low	31.1	Very low	28 Å²	28	117 Å²	117	19%	0.189	58%	0.58	C	S	.	*	H	α-helix	trans	-64.4	-23	-169.3	-172.2	0	0	0	0	114.6	L165 R173 T174	L165-C171 HydrophobicContact CB-CB 4.45Å; L165-C171 HydrophobicContact CD1-CB 4.48Å; C171-R173 PolarHBondContact O-N 3.22Å; C171-T174 PolarHBondContact O-N 2.96Å; C171-T174 PolarHBondContact O-OG1 3.02Å
172	K	27.3	Very low	31.5	Very low	184 Å²	184	117.6 Å²	117.6	80%	0.8	58%	0.577	S	S	*	*	H	α-helix	trans	-75.5	-6.9	179.8	-69.8	-173.2	177.9	-179.2	0	114.1	L170	L170-K172 VanDerWaalsContact C-N 3.26Å; L170-K172 PolarHBondContact O-N 2.97Å; L170-K172 VanDerWaalsContact O-N 3.13Å
173	R	29.7	Very low	31.3	Very low	213 Å²	213	118.5 Å²	118.5	80%	0.804	58%	0.584	S	S	*	*	H	α-helix	trans	-94.2	-20.3	168.7	-81.8	-174	165.4	101.2	-5.3	113.5	L170 C171 Q175	L170-R173 PolarHBondContact O-N 3.31Å; C171-R173 PolarHBondContact O-N 3.22Å; R173-Q175 VanDerWaalsContact C-N 3.32Å
174	T	32.9	Very low	31.9	Very low	74 Å²	74	116.9 Å²	116.9	45%	0.454	58%	0.583	S	S	.	*	H	α-helix	trans	-79.3	-13.5	-179.6	-15	0	0	0	0	113.5	C171 L176 I177	C171-T174 PolarHBondContact O-N 2.96Å; C171-T174 PolarHBondContact O-OG1 3.02Å; T174-L176 PolarHBondContact O-N 2.94Å; T174-I177 HydrophobicContact CG2-CD1 3.86Å
175	Q	31.6	Very low	31.9	Very low	136 Å²	136	114.8 Å²	114.8	64%	0.636	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	15	-179.5	-67.6	-176.2	-39.1	0	0	114.9	R173	R173-Q175 VanDerWaalsContact C-N 3.32Å
176	L	31.1	Very low	31.6	Very low	143 Å²	143	116 Å²	116	75%	0.749	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.2	24.5	-179.2	-118.6	166.9	0	0	0	112.3	T174	T174-L176 PolarHBondContact O-N 2.94Å
177	I	34.2	Very low	31.7	Very low	50 Å²	50	113.1 Å²	113.1	26%	0.256	57%	0.572	S	S	.	*	S	Bend	trans	-91.7	113.1	176.7	-73.2	-172.2	0	0	0	109.2	T174 V192 F312	T174-I177 HydrophobicContact CG2-CD1 3.86Å; I177-V192 HydrophobicContact CB-CG1 4.12Å; I177-V192 HydrophobicContact CG1-CG1 4.1Å; I177-V192 HydrophobicContact CG2-CG1 3.94Å; I177-F312 HydrophobicContact CG2-CE2 4.48Å
178	I	33.5	Very low	31.6	Very low	37 Å²	37	108.4 Å²	108.4	19%	0.19	56%	0.563	C	S	.	*			trans	67.5	83.9	170.5	-40.6	163.9	0	0	0	116	V153 L180 V192	V153-I178 HydrophobicContact CB-CG2 4.48Å; V153-I178 HydrophobicContact CG1-CB 3.61Å; V153-I178 HydrophobicContact CG1-CD1 4.3Å; V153-I178 HydrophobicContact CG1-CG2 3.62Å; V153-I178 WeakPolarHBondContact CG1-O 3.43Å; V153-I178 HydrophobicContact CG2-CB 4.42Å; V153-I178 HydrophobicContact CG2-CD1 3.67Å; V153-I178 HydrophobicContact CG2-CG2 4.13Å; I178-L180 HydrophobicContact CG2-CB 4.47Å; I178-L180 HydrophobicContact CG2-CD1 3.26Å; I178-L180 HydrophobicContact CG2-CG 3.47Å; I178-L180 VanDerWaalsContact CG2-CG 3.47Å; I178-V192 HydrophobicContact CG1-CB 4.27Å; I178-V192 HydrophobicContact CG1-CG1 3.86Å; I178-V192 HydrophobicContact CG1-CG2 4.1Å
179	Y	28.9	Very low	31.9	Very low	222 Å²	222	104.7 Å²	104.7	87%	0.871	55%	0.551	S	S	*	*			trans	-92.6	119	139.4	-100.7	-89.6	0	0	0	108.1
180	L	36.2	Very low	32.1	Very low	50 Å²	50	100.4 Å²	100.4	26%	0.262	52%	0.523	S	S	.	.			trans	-102.9	108.6	170	-74.7	148.4	0	0	0	108.3	T149 I178 F182	T149-L180 HydrophobicContact CG2-CD1 3.9Å; I178-L180 HydrophobicContact CG2-CB 4.47Å; I178-L180 HydrophobicContact CG2-CD1 3.26Å; I178-L180 HydrophobicContact CG2-CG 3.47Å; I178-L180 VanDerWaalsContact CG2-CG 3.47Å; L180-F182 HydrophobicContact CB-CD2 3.89Å; L180-F182 HydrophobicContact CB-CE1 4.27Å; L180-F182 HydrophobicContact CB-CE2 3.39Å; L180-F182 HydrophobicContact CB-CZ 3.63Å; L180-F182 HydrophobicContact CD1-CE2 3.87Å; L180-F182 HydrophobicContact CD1-CZ 3.67Å; L180-F182 HydrophobicContact CD2-CE1 4.09Å; L180-F182 HydrophobicContact CD2-CE2 4.47Å; L180-F182 HydrophobicContact CD2-CZ 3.82Å; L180-F182 HydrophobicContact CG-CE2 4.09Å; L180-F182 HydrophobicContact CG-CZ 3.89Å; L180-F182 PolarHBondContact O-N 2.88Å
181	D	27.8	Very low	32.3	Very low	130 Å²	130	104.7 Å²	104.7	70%	0.695	53%	0.53	S	S	*	.			trans	-80.5	110.9	162	-171.4	-2.1	0	0	0	107.8	S183	D181-S183 VanDerWaalsContact C-N 3.28Å; D181-S183 WeakPolarHBondContact OD1-CB 3.46Å; D181-S183 PolarHBondContact OD1-N 3.3Å; D181-S183 PolarHBondContact OD1-OG 2.85Å
182	F	43	Very low	32.3	Very low	68 Å²	68	105.5 Å²	105.5	30%	0.298	53%	0.534	S	S	.	.			trans	-90.1	9.9	177.3	-74	-61.5	0	0	0	113.1	M146 T149 V150 L180 N184	M146-F182 HydrophobicContact CE-CD1 4.41Å; M146-F182 HydrophobicContact CE-CE1 4.29Å; M146-F182 HydrophobicContact CG-CD1 4.14Å; M146-F182 HydrophobicContact CG-CD2 4.19Å; M146-F182 HydrophobicContact CG-CE1 4.15Å; M146-F182 HydrophobicContact CG-CE2 4.16Å; M146-F182 HydrophobicContact CG-CG 4.16Å; M146-F182 HydrophobicContact CG-CZ 4.11Å; M146-F182 HydrophobicContact SD-CD1 3.54Å; M146-F182 VanDerWaalsContact SD-CD1 3.54Å; M146-F182 HydrophobicContact SD-CD2 4.4Å; M146-F182 HydrophobicContact SD-CE1 3.14Å; M146-F182 WeakPolarHBondContact SD-CE1 3.34Å; M146-F182 HydrophobicContact SD-CE2 4.04Å; M146-F182 HydrophobicContact SD-CG 4.15Å; M146-F182 HydrophobicContact SD-CZ 3.39Å; M146-F182 WeakPolarHBondContact SD-CZ 3.46Å; T149-F182 HydrophobicContact CG2-CZ 4.48Å; V150-F182 HydrophobicContact CG2-CD2 3.76Å; V150-F182 HydrophobicContact CG2-CE2 3.5Å; V150-F182 VanDerWaalsContact CG2-CE2 3.5Å; L180-F182 HydrophobicContact CB-CD2 3.89Å; L180-F182 HydrophobicContact CB-CE1 4.27Å; L180-F182 HydrophobicContact CB-CE2 3.39Å; L180-F182 HydrophobicContact CB-CZ 3.63Å; L180-F182 HydrophobicContact CD1-CE2 3.87Å; L180-F182 HydrophobicContact CD1-CZ 3.67Å; L180-F182 HydrophobicContact CD2-CE1 4.09Å; L180-F182 HydrophobicContact CD2-CE2 4.47Å; L180-F182 HydrophobicContact CD2-CZ 3.82Å; L180-F182 HydrophobicContact CG-CE2 4.09Å; L180-F182 HydrophobicContact CG-CZ 3.89Å; L180-F182 PolarHBondContact O-N 2.88Å; F182-N184 PolarHBondContact O-N 3.34Å
183	S	28.9	Very low	32.4	Very low	74 Å²	74	97.4 Å²	97.4	52%	0.517	50%	0.502	S	S	.	.	S	Bend	trans	-67.8	110.1	169.5	-53.4	0	0	0	0	110.3	D181 E185	D181-S183 VanDerWaalsContact C-N 3.28Å; D181-S183 WeakPolarHBondContact OD1-CB 3.46Å; D181-S183 PolarHBondContact OD1-N 3.3Å; D181-S183 PolarHBondContact OD1-OG 2.85Å; S183-E185 PolarHBondContact O-N 3.44Å
184	N	43	Very low	32.2	Very low	139 Å²	139	90.7 Å²	90.7	74%	0.743	49%	0.485	S	S	*	.	S	Bend	trans	-52.1	103.9	173.7	-110.6	-16.7	0	0	0	111.4	F182 F936 K940	F182-N184 PolarHBondContact O-N 3.34Å; N184-F936 VanDerWaalsContact O-CE1 3.26Å; N184-F936 WeakPolarHBondContact O-CE1 3.49Å; N184-K940 PolarHBondContact O-NZ 2.92Å
185	E	30.5	Very low	32.2	Very low	66 Å²	66	92 Å²	92	31%	0.308	49%	0.489	S	S	.	.	S	Bend	trans	-174	119.3	150	-106.9	-175	138.3	0	0	108.3	S183 Q933 F936 K940	S183-E185 PolarHBondContact O-N 3.44Å; E185-Q933 PolarHBondContact OE1-NE2 3.01Å; E185-F936 HydrophobicContact CG-CD1 4.01Å; E185-F936 HydrophobicContact CG-CE1 4.32Å; E185-K940 WeakPolarHBondContact OE2-CE 3.41Å; E185-K940 IonicContact OE2-NZ 3.77Å; E185-K940 PolarHBondContact OE2-NZ 2.91Å
186	S	27.7	Very low	32.4	Very low	98 Å²	98	88 Å²	88	69%	0.685	47%	0.472	S	S	*	.	S	Bend	trans	65.3	132	-166.9	79.9	0	0	0	0	115.1	A188	S186-A188 PolarHBondContact O-N 3.4Å
187	P	31.5	Very low	32.6	Very low	108 Å²	108	82.8 Å²	82.8	70%	0.701	45%	0.446	S	S	*	.			trans	-81.2	59.6	175.8	35.1	-36.2	0	0	0	111.3	V189	P187-V189 PolarHBondContact O-N 2.66Å
188	A	28.3	Very low	32.4	Very low	76 Å²	76	82.9 Å²	82.9	63%	0.628	45%	0.449	S	S	*	.			trans	-71.9	40.5	172.9	0	0	0	0	0	112.7	S186	S186-A188 PolarHBondContact O-N 3.4Å
189	V	31.6	Very low	32.4	Very low	49 Å²	49	86.1 Å²	86.1	30%	0.297	47%	0.467	S	S	.	.			trans	-85.2	119.8	-174.5	177.6	0	0	0	0	108.8	P187 L305	P187-V189 PolarHBondContact O-N 2.66Å; V189-L305 HydrophobicContact CG1-CD1 3.95Å; V189-L305 HydrophobicContact CG1-CD2 3.72Å; V189-L305 HydrophobicContact CG1-CG 4.37Å
190	V	33.1	Very low	32.8	Very low	38 Å²	38	78 Å²	78	23%	0.23	44%	0.436	C	S	.	.			trans	69.6	92.2	-168.5	-169.8	0	0	0	0	114.1	A193 L229 L305	V190-A193 HydrophobicContact CG1-CB 4.36Å; V190-L229 HydrophobicContact CG2-CB 4.03Å; V190-L229 HydrophobicContact CG2-CD1 4.35Å; V190-L229 HydrophobicContact CG2-CD2 3.82Å; V190-L229 HydrophobicContact CG2-CG 4.28Å; V190-L305 HydrophobicContact CG2-CD2 4.32Å
191	R	32	Very low	32.6	Very low	215 Å²	215	77 Å²	77	81%	0.811	44%	0.435	S	S	*	.			trans	-108.8	43	144.9	-77.3	-168	163.1	-146	-8.2	111.1
192	V	35.9	Very low	32.8	Very low	45 Å²	45	74 Å²	74	27%	0.273	43%	0.425	S	S	.	.			trans	-129.2	22.4	-174.2	-148.9	0	0	0	0	113.6	I177 I178	I177-V192 HydrophobicContact CB-CG1 4.12Å; I177-V192 HydrophobicContact CG1-CG1 4.1Å; I177-V192 HydrophobicContact CG2-CG1 3.94Å; I178-V192 HydrophobicContact CG1-CB 4.27Å; I178-V192 HydrophobicContact CG1-CG1 3.86Å; I178-V192 HydrophobicContact CG1-CG2 4.1Å
193	A	28.8	Very low	32.5	Very low	15 Å²	15	75 Å²	75	12%	0.124	43%	0.43	C	S	.	.	S	Bend	trans	-98.9	-30.7	163.2	0	0	0	0	0	115.8	V190 L195 I196 V197 V226	V190-A193 HydrophobicContact CG1-CB 4.36Å; A193-L195 PolarHBondContact O-N 3.02Å; A193-I196 PolarHBondContact O-N 3.42Å; A193-V197 PolarHBondContact O-N 2.65Å; A193-V226 HydrophobicContact CB-CB 3.89Å; A193-V226 HydrophobicContact CB-CG1 4.16Å; A193-V226 VanDerWaalsContact CB-O 3.28Å; A193-V226 WeakPolarHBondContact CB-O 3.47Å
194	P	26.5	Very low	32.6	Very low	71 Å²	71	75.3 Å²	75.3	46%	0.461	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	13	-166.3	32.9	-37.5	0	0	0	115.1	P198	P194-P198 HydrophobicContact CB-CG 4.49Å; P194-P198 WeakPolarHBondContact O-CD 3.48Å; P194-P198 WeakPolarHBondContact O-CG 3.45Å
195	L	31.7	Very low	32	Very low	101 Å²	101	76.7 Å²	76.7	53%	0.529	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.7	-15.2	174.5	-64.6	179.7	0	0	0	113.8	A193 N199	A193-L195 PolarHBondContact O-N 3.02Å; L195-N199 PolarHBondContact O-ND2 2.69Å
196	I	36.6	Very low	32	Very low	54 Å²	54	80.2 Å²	80.2	28%	0.277	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-57	176.2	-58	178.5	0	0	0	109.2	A193 F200 L242	A193-I196 PolarHBondContact O-N 3.42Å; I196-F200 PolarHBondContact O-N 3.44Å; I196-L242 HydrophobicContact CG2-CD1 4.48Å
197	V	35.7	Very low	32.1	Very low	33 Å²	33	83.3 Å²	83.3	20%	0.2	44%	0.442	C	S	.	.	H	α-helix	trans	-67.1	-46.4	-172.1	-172.6	0	0	0	0	113.6	A193 N199 F200 A201 I223	A193-V197 PolarHBondContact O-N 2.65Å; V197-N199 VanDerWaalsContact C-N 3.31Å; V197-N199 PolarHBondContact O-N 3.32Å; V197-F200 WeakPolarHBondContact O-CA 3.49Å; V197-F200 WeakPolarHBondContact O-CB 3.05Å; V197-F200 PolarHBondContact O-N 3.32Å; V197-A201 PolarHBondContact O-N 2.97Å; V197-I223 HydrophobicContact CG1-CG2 3.95Å
198	P	29.9	Very low	32	Very low	52 Å²	52	82.3 Å²	82.3	34%	0.338	44%	0.442	S	S	.	.	H	α-helix	trans	-66.1	-31.2	-177.3	-25.5	38.5	0	0	0	113.8	P194 F200 S202	P194-P198 HydrophobicContact CB-CG 4.49Å; P194-P198 WeakPolarHBondContact O-CD 3.48Å; P194-P198 WeakPolarHBondContact O-CG 3.45Å; P198-F200 VanDerWaalsContact C-N 3.32Å; P198-S202 VanDerWaalsContact O-CB 3.27Å; P198-S202 WeakPolarHBondContact O-CB 3.43Å; P198-S202 PolarHBondContact O-N 2.83Å; P198-S202 PolarHBondContact O-OG 3.12Å
199	N	33.5	Very low	32	Very low	104 Å²	104	89 Å²	89	56%	0.556	45%	0.451	S	S	*	.	H	α-helix	trans	-67.3	-34.3	172.5	-77.2	-38.1	0	0	0	111.7	L195 V197 H203	L195-N199 PolarHBondContact O-ND2 2.69Å; V197-N199 VanDerWaalsContact C-N 3.31Å; V197-N199 PolarHBondContact O-N 3.32Å; N199-H203 PolarHBondContact O-N 2.99Å
200	F	35.9	Very low	32.1	Very low	51 Å²	51	97.5 Å²	97.5	22%	0.224	48%	0.48	C	S	.	.	H	α-helix	trans	-68.2	-50.5	177.9	-141.4	-112.7	0	0	0	111.6	I196 V197 P198 S202 H203 L204 I223 F245	I196-F200 PolarHBondContact O-N 3.44Å; V197-F200 WeakPolarHBondContact O-CA 3.49Å; V197-F200 WeakPolarHBondContact O-CB 3.05Å; V197-F200 PolarHBondContact O-N 3.32Å; P198-F200 VanDerWaalsContact C-N 3.32Å; F200-S202 PolarHBondContact O-N 3.01Å; F200-H203 PolarHBondContact O-N 3.24Å; F200-L204 PolarHBondContact O-N 3.02Å; F200-I223 HydrophobicContact CD1-CD1 4.38Å; F200-F245 HydrophobicContact CD2-CD2 4.28Å; F200-F245 HydrophobicContact CE2-CB 4.21Å; F200-F245 AromaticContact CE2-CD2 3.54Å; F200-F245 HydrophobicContact CE2-CD2 3.54Å; F200-F245 HydrophobicContact CE2-CE2 4.3Å; F200-F245 HydrophobicContact CE2-CG 4.17Å; F200-F245 HydrophobicContact CZ-CB 4.22Å; F200-F245 HydrophobicContact CZ-CD2 4.23Å
201	A	32.8	Very low	31.8	Very low	30 Å²	30	107.5 Å²	107.5	25%	0.248	51%	0.513	C	S	.	.	H	α-helix	trans	-59.6	-45	175.5	0	0	0	0	0	111.9	V197 H203 L204 Y205	V197-A201 PolarHBondContact O-N 2.97Å; A201-H203 VanDerWaalsContact C-N 3.27Å; A201-H203 PolarHBondContact O-N 2.56Å; A201-L204 PolarHBondContact O-N 3.37Å; A201-Y205 VanDerWaalsContact O-CD2 3.24Å; A201-Y205 WeakPolarHBondContact O-CD2 3.38Å; A201-Y205 PolarHBondContact O-N 2.83Å; A201-Y205 VanDerWaalsContact O-N 3.16Å
202	S	32.7	Very low	31.8	Very low	67 Å²	67	106.7 Å²	106.7	47%	0.469	52%	0.516	S	S	.	.	H	α-helix	trans	-59.8	-34.7	-179	-62.2	0	0	0	0	113.4	P198 F200 Q206	P198-S202 VanDerWaalsContact O-CB 3.27Å; P198-S202 WeakPolarHBondContact O-CB 3.43Å; P198-S202 PolarHBondContact O-N 2.83Å; P198-S202 PolarHBondContact O-OG 3.12Å; F200-S202 PolarHBondContact O-N 3.01Å; S202-Q206 PolarHBondContact O-N 3.3Å
203	H	35.7	Very low	31.3	Very low	90 Å²	90	113.7 Å²	113.7	42%	0.417	55%	0.545	S	S	.	.	H	α-helix	trans	-75.3	-39.9	-179.6	-123.7	-80.4	0	0	0	112.7	N199 F200 A201 Y205 Q206 Q207	N199-H203 PolarHBondContact O-N 2.99Å; F200-H203 PolarHBondContact O-N 3.24Å; A201-H203 VanDerWaalsContact C-N 3.27Å; A201-H203 PolarHBondContact O-N 2.56Å; H203-Y205 VanDerWaalsContact C-N 3.3Å; H203-Y205 PolarHBondContact O-N 3.45Å; H203-Q206 PolarHBondContact O-N 3.23Å; H203-Q206 VanDerWaalsContact O-N 3.12Å; H203-Q207 PolarHBondContact O-N 2.94Å; H203-Q207 VanDerWaalsContact O-N 3.12Å
204	L	30.9	Very low	31.3	Very low	80 Å²	80	122 Å²	122	42%	0.419	58%	0.582	S	S	.	*	H	α-helix	trans	-57.8	-42.6	172.1	-84.4	158.6	0	0	0	111.4	F200 A201 Q206	F200-L204 PolarHBondContact O-N 3.02Å; A201-L204 PolarHBondContact O-N 3.37Å; L204-Q206 VanDerWaalsContact C-N 3.3Å; L204-Q206 PolarHBondContact O-N 3.5Å
205	Y	31.3	Very low	31.4	Very low	167 Å²	167	123.5 Å²	123.5	66%	0.655	60%	0.6	S	S	*	*	H	α-helix	trans	-68.7	-20.7	176.1	-79.7	-65.2	0	0	0	115	A201 H203	A201-Y205 VanDerWaalsContact O-CD2 3.24Å; A201-Y205 WeakPolarHBondContact O-CD2 3.38Å; A201-Y205 PolarHBondContact O-N 2.83Å; A201-Y205 VanDerWaalsContact O-N 3.16Å; H203-Y205 VanDerWaalsContact C-N 3.3Å; H203-Y205 PolarHBondContact O-N 3.45Å
206	Q	29.7	Very low	31.1	Very low	141 Å²	141	124.2 Å²	124.2	66%	0.659	61%	0.613	S	S	*	*	H	α-helix	trans	-86.6	-35.3	175.6	-78.7	-170	-7	0	0	113.3	S202 H203 L204 A208 R209	S202-Q206 PolarHBondContact O-N 3.3Å; H203-Q206 PolarHBondContact O-N 3.23Å; H203-Q206 VanDerWaalsContact O-N 3.12Å; L204-Q206 VanDerWaalsContact C-N 3.3Å; L204-Q206 PolarHBondContact O-N 3.5Å; Q206-A208 PolarHBondContact O-N 3.1Å; Q206-R209 WeakPolarHBondContact O-CB 3.45Å; Q206-R209 PolarHBondContact O-N 3.35Å
207	Q	29.5	Very low	30.9	Very low	162 Å²	162	128.3 Å²	128.3	76%	0.757	64%	0.641	S	S	*	*	H	α-helix	trans	-68.3	-24	-176.3	-163.1	162.1	-2.8	0	0	113.1	H203 R209	H203-Q207 PolarHBondContact O-N 2.94Å; H203-Q207 VanDerWaalsContact O-N 3.12Å; Q207-R209 PolarHBondContact O-N 3.24Å
208	A	29.2	Very low	30.6	Very low	87 Å²	87	135.5 Å²	135.5	72%	0.719	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	-0.6	175.8	0	0	0	0	0	115.4	Q206	Q206-A208 PolarHBondContact O-N 3.1Å
209	R	28.6	Very low	30.7	Very low	217 Å²	217	140.8 Å²	140.8	82%	0.819	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	3.3	-170.8	-75.6	-78.5	-168.4	128.3	4.8	116.1	Q206 Q207	Q206-R209 WeakPolarHBondContact O-CB 3.45Å; Q206-R209 PolarHBondContact O-N 3.35Å; Q207-R209 PolarHBondContact O-N 3.24Å
210	Y	33.9	Very low	30.7	Very low	228 Å²	228	139 Å²	139	89%	0.894	70%	0.697	S	S	*	*	S	Bend	trans	-135.8	42.8	-173.7	-125.9	-82.2	0	0	0	116.7
211	R	26.1	Very low	31.2	Very low	248 Å²	248	139.7 Å²	139.7	94%	0.936	71%	0.707	S	S	*	*			trans	-144.1	143.1	155.9	-155.8	170.3	-176.2	127.6	-0.9	110.1
212	K	33.8	Very low	31.7	Very low	198 Å²	198	143.5 Å²	143.5	86%	0.861	72%	0.715	S	S	*	*			trans	-122.9	95.5	-177.6	178.5	-151.7	169.6	-168.5	0	110
213	E	24.5	Very low	32.8	Very low	191 Å²	191	141.5 Å²	141.5	89%	0.893	70%	0.698	S	S	*	*			trans	-160.6	176.3	152.3	-120.2	163.7	176.4	0	0	110.8
214	Q	28.6	Very low	33.6	Very low	190 Å²	190	138.1 Å²	138.1	89%	0.888	68%	0.684	S	S	*	*			trans	-104.2	162.4	-157.6	-64.5	174.7	-84.6	0	0	114.6
215	A	28	Very low	34.6	Very low	102 Å²	102	137.8 Å²	137.8	84%	0.843	69%	0.687	S	S	*	*			trans	72.2	75.1	158.3	0	0	0	0	0	119.5
216	S	26.3	Very low	35.8	Very low	116 Å²	116	130.9 Å²	130.9	81%	0.811	66%	0.662	S	S	*	*				-163.9	139.5	129.3	-172.2	0	0	0	0	110.4	Q218	S216-Q218 PolarHBondContact O-N 3.39Å
217	T	32.2	Very low	36.8	Very low	140 Å²	140	129.1 Å²	129.1	86%	0.859	66%	0.657	S	S	*	*			trans	-94.9	83.9	-175.7	-50.8	0	0	0	0	111.1
218	Q	28.4	Very low	38.4	Very low	185 Å²	185	126 Å²	126	86%	0.864	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-89.7	125.9	162.2	-79.1	-167.9	-19.4	0	0	110.6	S216	S216-Q218 PolarHBondContact O-N 3.39Å
219	L	32.5	Very low	40.2	Very low	162 Å²	162	123.2 Å²	123.2	85%	0.848	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-68.4	135.2	166.7	-75.4	158.6	0	0	0	109.1
220	A	33.2	Very low	42.1	Very low	67 Å²	67	114.3 Å²	114.3	55%	0.554	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-68.3	139.7	173	0	0	0	0	0	109.9	W222	A220-W222 PolarHBondContact O-N 2.92Å
221	P	47.4	Very low	43.7	Very low	66 Å²	66	110.3 Å²	110.3	43%	0.429	57%	0.574	S	S	.	*	P	Polyproline II helix	trans	-58.5	122.3	-178.6	-24.6	33.8	0	0	0	112	I223 L258	P221-I223 PolarHBondContact O-N 2.97Å; P221-L258 HydrophobicContact CB-CB 4.06Å; P221-L258 HydrophobicContact CB-CD1 3.71Å
222	W	42.8	Very low	45.7	Very low	110 Å²	110	99.9 Å²	99.9	42%	0.417	54%	0.537	S	S	.	.			trans	-84.3	108.4	-177.9	-173.1	86.3	0	0	0	110	A220 P224	A220-W222 PolarHBondContact O-N 2.92Å; W222-P224 HydrophobicContact CE3-CG 4.29Å; W222-P224 HydrophobicContact CH2-CB 3.69Å; W222-P224 HydrophobicContact CH2-CG 4.05Å; W222-P224 HydrophobicContact CZ2-CB 4.09Å; W222-P224 HydrophobicContact CZ3-CB 3.92Å; W222-P224 HydrophobicContact CZ3-CG 3.76Å
223	I	55.3	Low	47.6	Very low	25 Å²	25	90.7 Å²	90.7	13%	0.128	50%	0.498	C	S	.	.			trans	-109.9	109.4	174	-57.7	169.2	0	0	0	107.1	V197 F200 P221 A241 L258	V197-I223 HydrophobicContact CG1-CG2 3.95Å; F200-I223 HydrophobicContact CD1-CD1 4.38Å; P221-I223 PolarHBondContact O-N 2.97Å; I223-A241 HydrophobicContact CD1-CB 3.91Å; I223-A241 HydrophobicContact CG1-CB 4.32Å; I223-A241 HydrophobicContact CG2-CB 4.14Å; I223-L258 HydrophobicContact CG1-CD1 4.15Å; I223-L258 HydrophobicContact CG1-CD2 4.37Å
224	P	53.2	Low	50.2	Low	18 Å²	18	82.8 Å²	82.8	12%	0.117	46%	0.462	C	S	.	.			trans	-66.9	150.7	177.6	25.6	-31.3	0	0	0	111.3	W222	W222-P224 HydrophobicContact CE3-CG 4.29Å; W222-P224 HydrophobicContact CH2-CB 3.69Å; W222-P224 HydrophobicContact CH2-CG 4.05Å; W222-P224 HydrophobicContact CZ2-CB 4.09Å; W222-P224 HydrophobicContact CZ3-CB 3.92Å; W222-P224 HydrophobicContact CZ3-CG 3.76Å
225	P	51.8	Low	52.5	Low	73 Å²	73	75.2 Å²	75.2	47%	0.474	43%	0.428	S	S	.	.			trans	-61.8	143.7	162.9	30.2	-33.9	0	0	0	109.4
226	V	56.7	Low	54.9	Low	22 Å²	22	70.4 Å²	70.4	13%	0.133	39%	0.388	C	S	.	.			trans	-95.6	101.6	175	176.4	0	0	0	0	108.2	A193 D232 A238	A193-V226 HydrophobicContact CB-CB 3.89Å; A193-V226 HydrophobicContact CB-CG1 4.16Å; A193-V226 VanDerWaalsContact CB-O 3.28Å; A193-V226 WeakPolarHBondContact CB-O 3.47Å; V226-D232 HydrophobicContact CG1-CB 4.31Å; V226-D232 HydrophobicContact CG2-CB 4.31Å; V226-A238 HydrophobicContact CG2-CB 3.52Å
227	D	51.4	Low	57.4	Low	104 Å²	104	65 Å²	65	56%	0.556	35%	0.351	S	S	*	.	S	Bend	trans	-103.5	-26.4	178.6	-64.9	-44.8	0	0	0	111.1	D232	D227-D232 PolarHBondContact N-OD2 3.37Å
228	N	61.9	Low	59.6	Low	96 Å²	96	59.1 Å²	59.1	51%	0.513	32%	0.316	S	S	.	.	S	Bend	trans	-130.3	97.5	177.8	-76	-89.8	0	0	0	110.7	L230 K231 D232	N228-L230 VanDerWaalsContact C-N 3.25Å; N228-L230 PolarHBondContact O-N 2.96Å; N228-K231 HydrophobicContact CB-CB 3.91Å; N228-K231 PolarHBondContact O-N 3.44Å; N228-D232 PolarHBondContact N-OD2 3.27Å; N228-D232 PolarHBondContact O-N 3.36Å
229	L	66.9	Low	61.9	Low	29 Å²	29	50.7 Å²	50.7	15%	0.152	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.2	-41.8	-171.7	-173.6	71.9	0	0	0	115.4	V190 S233 Y304 L305 M308	V190-L229 HydrophobicContact CG2-CB 4.03Å; V190-L229 HydrophobicContact CG2-CD1 4.35Å; V190-L229 HydrophobicContact CG2-CD2 3.82Å; V190-L229 HydrophobicContact CG2-CG 4.28Å; L229-S233 WeakPolarHBondContact O-CB 3.28Å; L229-S233 PolarHBondContact O-OG 2.89Å; L229-Y304 HydrophobicContact CD1-CD1 4.48Å; L229-Y304 HydrophobicContact CD1-CE1 3.93Å; L229-Y304 HydrophobicContact CD2-CD1 3.56Å; L229-Y304 HydrophobicContact CD2-CE1 3.88Å; L229-Y304 HydrophobicContact CG-CD1 3.78Å; L229-Y304 HydrophobicContact CG-CE1 3.63Å; L229-L305 HydrophobicContact CD2-CD2 3.86Å; L229-M308 HydrophobicContact CD1-CE 4.44Å; L229-M308 HydrophobicContact CD1-CG 4.18Å; L229-M308 HydrophobicContact CD1-SD 4.46Å; L229-M308 HydrophobicContact CD2-CG 4.29Å
230	L	68.7	Low	64	Low	30 Å²	30	43 Å²	43	16%	0.157	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-39	-179.9	-73.8	172.8	0	0	0	113.1	N228 S233 T234 A296 K301 Y304	N228-L230 VanDerWaalsContact C-N 3.25Å; N228-L230 PolarHBondContact O-N 2.96Å; L230-S233 PolarHBondContact O-OG 2.98Å; L230-T234 WeakPolarHBondContact O-CG2 3.31Å; L230-A296 HydrophobicContact CB-CB 4.18Å; L230-A296 HydrophobicContact CD2-CB 4.39Å; L230-A296 WeakPolarHBondContact O-CB 3.39Å; L230-K301 HydrophobicContact CD1-CB 3.98Å; L230-K301 HydrophobicContact CD1-CD 4.35Å; L230-K301 HydrophobicContact CD1-CG 4.07Å; L230-Y304 HydrophobicContact CD2-CD2 4.25Å; L230-Y304 HydrophobicContact CD2-CG 3.99Å
231	K	68.6	Low	66	Low	145 Å²	145	40.2 Å²	40.2	63%	0.63	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-49.1	-174.8	-173.9	-168	175	-162.7	0	110.1	N228 S233 T234	N228-K231 HydrophobicContact CB-CB 3.91Å; N228-K231 PolarHBondContact O-N 3.44Å; K231-S233 PolarHBondContact O-N 3.36Å; K231-T234 WeakPolarHBondContact O-CB 3.35Å; K231-T234 WeakPolarHBondContact O-CG2 3.32Å; K231-T234 PolarHBondContact O-N 3.39Å; K231-T234 PolarHBondContact O-OG1 3.24Å
232	D	68.7	Low	67.3	Low	29 Å²	29	38.8 Å²	38.8	16%	0.155	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-0.9	-170.1	-43.8	-28.1	0	0	0	112	V226 D227 N228 A238	V226-D232 HydrophobicContact CG1-CB 4.31Å; V226-D232 HydrophobicContact CG2-CB 4.31Å; D227-D232 PolarHBondContact N-OD2 3.37Å; N228-D232 PolarHBondContact N-OD2 3.27Å; N228-D232 PolarHBondContact O-N 3.36Å; D232-A238 WeakPolarHBondContact O-CB 3.4Å
233	S	72.2	Confident	68.8	Low	4 Å²	4	33.6 Å²	33.6	3%	0.028	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-18.6	168.2	59.6	0	0	0	0	114.8	L229 L230 K231 D235 G236 Y304	L229-S233 WeakPolarHBondContact O-CB 3.28Å; L229-S233 PolarHBondContact O-OG 2.89Å; L230-S233 PolarHBondContact O-OG 2.98Å; K231-S233 PolarHBondContact O-N 3.36Å; S233-D235 PolarHBondContact O-N 2.66Å; S233-D235 VanDerWaalsContact O-N 3.16Å; S233-G236 PolarHBondContact O-N 3.15Å; S233-Y304 WeakPolarHBondContact CB-OH 3.24Å; S233-Y304 PolarHBondContact OG-OH 3.01Å
234	T	78.8	Confident	69.7	Low	25 Å²	25	32.8 Å²	32.8	15%	0.153	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-29.1	-176.6	55.8	0	0	0	0	113.4	L230 K231 G236 L294 A296	L230-T234 WeakPolarHBondContact O-CG2 3.31Å; K231-T234 WeakPolarHBondContact O-CB 3.35Å; K231-T234 WeakPolarHBondContact O-CG2 3.32Å; K231-T234 PolarHBondContact O-N 3.39Å; K231-T234 PolarHBondContact O-OG1 3.24Å; T234-G236 VanDerWaalsContact C-N 3.31Å; T234-L294 WeakPolarHBondContact CG2-O 3.14Å; T234-A296 HydrophobicContact CG2-CB 3.56Å
235	D	78.3	Confident	70.5	Confident	32 Å²	32	34.2 Å²	34.2	17%	0.171	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-6.6	179.3	-63.1	-34.5	0	0	0	113.8	S233 S237 R267 N270	S233-D235 PolarHBondContact O-N 2.66Å; S233-D235 VanDerWaalsContact O-N 3.16Å; D235-S237 PolarHBondContact O-N 3.05Å; D235-S237 PolarHBondContact O-OG 3.15Å; D235-R267 HydrophobicContact CB-CG 4.36Å; D235-R267 WeakPolarHBondContact OD1-CD 3.18Å; D235-R267 WeakPolarHBondContact OD1-CG 3.38Å; D235-R267 IonicContact OD1-CZ 2.74Å; D235-R267 IonicContact OD1-NE 2.97Å; D235-R267 PolarHBondContact OD1-NE 2.77Å; D235-R267 IonicContact OD1-NH1 2.69Å; D235-R267 PolarHBondContact OD1-NH1 3.11Å; D235-N270 PolarHBondContact O-ND2 2.93Å
236	G	77.7	Confident	71.2	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.164	C	C	.	.	S	Bend	trans	67.8	-27.7	-171.8	0	0	0	0	0	114.9	S233 T234 A238 L239 G240 I274	S233-G236 PolarHBondContact O-N 3.15Å; T234-G236 VanDerWaalsContact C-N 3.31Å; G236-A238 VanDerWaalsContact C-N 3.32Å; G236-A238 PolarHBondContact O-N 3.38Å; G236-A238 VanDerWaalsContact O-N 3.12Å; G236-L239 WeakPolarHBondContact O-CB 3.49Å; G236-L239 PolarHBondContact O-N 3.24Å; G236-G240 PolarHBondContact O-N 3.04Å; G236-I274 WeakPolarHBondContact O-CD1 3.23Å
237	S	79.3	Confident	72	Confident	4 Å²	4	30.8 Å²	30.8	3%	0.028	16%	0.158	C	C	.	.	H	α-helix	trans	-45	-47.4	-175.4	-54.7	0	0	0	0	114.5	D235 G240 A241 M262	D235-S237 PolarHBondContact O-N 3.05Å; D235-S237 PolarHBondContact O-OG 3.15Å; S237-G240 PolarHBondContact O-N 3.33Å; S237-A241 WeakPolarHBondContact O-CB 3.47Å; S237-A241 PolarHBondContact O-N 2.99Å; S237-M262 WeakPolarHBondContact OG-CE 3.28Å
238	A	77.9	Confident	72.9	Confident	16 Å²	16	27.4 Å²	27.4	13%	0.132	14%	0.142	C	C	.	.	H	α-helix	trans	-68.8	-37.2	-179.2	0	0	0	0	0	113.3	V226 D232 G236 L242	V226-A238 HydrophobicContact CG2-CB 3.52Å; D232-A238 WeakPolarHBondContact O-CB 3.4Å; G236-A238 VanDerWaalsContact C-N 3.32Å; G236-A238 PolarHBondContact O-N 3.38Å; G236-A238 VanDerWaalsContact O-N 3.12Å; A238-L242 WeakPolarHBondContact O-CB 3.47Å; A238-L242 PolarHBondContact O-N 3.48Å
239	L	76.4	Confident	72.9	Confident	7 Å²	7	29.7 Å²	29.7	4%	0.037	15%	0.15	C	C	.	.	H	α-helix	trans	-71.5	-44.1	174.1	-76	-179.5	0	0	0	111	G236 A241 L242 L243 I274 M293 Y304 F307 M308 L311	G236-L239 WeakPolarHBondContact O-CB 3.49Å; G236-L239 PolarHBondContact O-N 3.24Å; L239-A241 VanDerWaalsContact C-N 3.34Å; L239-A241 PolarHBondContact O-N 2.99Å; L239-L242 WeakPolarHBondContact O-CB 3.1Å; L239-L242 PolarHBondContact O-N 3.48Å; L239-L242 VanDerWaalsContact O-N 3.11Å; L239-L243 WeakPolarHBondContact O-CG 3.32Å; L239-L243 PolarHBondContact O-N 3.03Å; L239-I274 HydrophobicContact CB-CD1 3.51Å; L239-I274 HydrophobicContact CB-CG1 4.16Å; L239-I274 HydrophobicContact CD1-CD1 4.05Å; L239-I274 HydrophobicContact CD1-CG2 4.14Å; L239-I274 HydrophobicContact CG-CD1 4.45Å; L239-M293 HydrophobicContact CD1-CE 3.67Å; L239-Y304 WeakPolarHBondContact CD1-OH 3.25Å; L239-F307 HydrophobicContact CD1-CE1 4.15Å; L239-F307 HydrophobicContact CD2-CE1 4.37Å; L239-M308 HydrophobicContact CD2-SD 3.9Å; L239-L311 HydrophobicContact CD2-CD1 4.35Å
240	G	76.9	Confident	73.1	Confident	1 Å²	1	32 Å²	32	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-58.5	-43.7	176.6	0	0	0	0	0	112.4	G236 S237 L242 L243 H244 L251	G236-G240 PolarHBondContact O-N 3.04Å; S237-G240 PolarHBondContact O-N 3.33Å; G240-L242 PolarHBondContact O-N 3.35Å; G240-L243 PolarHBondContact O-N 2.96Å; G240-H244 WeakPolarHBondContact O-CB 3.39Å; G240-H244 PolarHBondContact O-N 2.84Å; G240-L251 WeakPolarHBondContact O-CD2 3.41Å
241	A	74.7	Confident	73.4	Confident	8 Å²	8	30.7 Å²	30.7	7%	0.066	16%	0.155	C	C	.	.	H	α-helix	trans	-62.6	-39.6	173.5	0	0	0	0	0	113	I223 S237 L239 F245	I223-A241 HydrophobicContact CD1-CB 3.91Å; I223-A241 HydrophobicContact CG1-CB 4.32Å; I223-A241 HydrophobicContact CG2-CB 4.14Å; S237-A241 WeakPolarHBondContact O-CB 3.47Å; S237-A241 PolarHBondContact O-N 2.99Å; L239-A241 VanDerWaalsContact C-N 3.34Å; L239-A241 PolarHBondContact O-N 2.99Å; A241-F245 PolarHBondContact O-N 2.68Å; A241-F245 VanDerWaalsContact O-N 3.14Å
242	L	74.3	Confident	73.5	Confident	36 Å²	36	26 Å²	26	19%	0.188	14%	0.139	C	C	.	.	H	α-helix	trans	-65.3	-44.7	175.7	-176.5	66.8	0	0	0	111.7	I196 A238 L239 G240 F245 Y246 M308	I196-L242 HydrophobicContact CG2-CD1 4.48Å; A238-L242 WeakPolarHBondContact O-CB 3.47Å; A238-L242 PolarHBondContact O-N 3.48Å; L239-L242 WeakPolarHBondContact O-CB 3.1Å; L239-L242 PolarHBondContact O-N 3.48Å; L239-L242 VanDerWaalsContact O-N 3.11Å; G240-L242 PolarHBondContact O-N 3.35Å; L242-F245 PolarHBondContact O-N 3.42Å; L242-Y246 HydrophobicContact CD1-CD2 4.27Å; L242-Y246 HydrophobicContact CD1-CE2 3.85Å; L242-Y246 HydrophobicContact CG-CD2 4.5Å; L242-Y246 HydrophobicContact CG-CE2 4.45Å; L242-Y246 WeakPolarHBondContact O-CD2 3.42Å; L242-Y246 PolarHBondContact O-N 2.86Å; L242-M308 HydrophobicContact CD2-CE 3.94Å
243	L	74.8	Confident	73.4	Confident	2 Å²	2	26.4 Å²	26.4	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-62.5	-43.4	176.3	-69.8	-176.4	0	0	0	111.4	L239 G240 F245 Y246 C247 L251 I274 F277 L311 F315	L239-L243 WeakPolarHBondContact O-CG 3.32Å; L239-L243 PolarHBondContact O-N 3.03Å; G240-L243 PolarHBondContact O-N 2.96Å; L243-F245 VanDerWaalsContact C-N 3.32Å; L243-F245 PolarHBondContact O-N 2.99Å; L243-Y246 PolarHBondContact O-N 2.87Å; L243-C247 WeakPolarHBondContact O-CB 3.3Å; L243-C247 PolarHBondContact O-N 3.2Å; L243-L251 HydrophobicContact CB-CD2 3.51Å; L243-L251 HydrophobicContact CD1-CD2 4.06Å; L243-L251 HydrophobicContact CG-CD2 4.43Å; L243-I274 HydrophobicContact CD1-CB 4.38Å; L243-I274 HydrophobicContact CD1-CG1 4.01Å; L243-I274 HydrophobicContact CD1-CG2 4.24Å; L243-F277 HydrophobicContact CD1-CB 4.36Å; L243-F277 HydrophobicContact CD1-CD1 3.69Å; L243-F277 HydrophobicContact CD1-CE1 4.27Å; L243-F277 HydrophobicContact CD1-CG 4.07Å; L243-F277 HydrophobicContact CD2-CD1 3.85Å; L243-F277 HydrophobicContact CD2-CE1 3.64Å; L243-F277 HydrophobicContact CD2-CZ 4.48Å; L243-F277 HydrophobicContact CG-CD1 4.34Å; L243-F277 HydrophobicContact CG-CE1 4.45Å; L243-L311 HydrophobicContact CD2-CD2 4.46Å; L243-F315 HydrophobicContact CD2-CE2 3.95Å; L243-F315 HydrophobicContact CD2-CZ 3.53Å
244	H	75.2	Confident	73.1	Confident	8 Å²	8	33.5 Å²	33.5	4%	0.037	18%	0.179	C	C	.	.	H	α-helix	trans	-59.7	-39	175.1	179.1	78.3	0	0	0	112.7	G240 Y246 P248 L251 L253 R326	G240-H244 WeakPolarHBondContact O-CB 3.39Å; G240-H244 PolarHBondContact O-N 2.84Å; H244-Y246 VanDerWaalsContact C-N 3.32Å; H244-Y246 PolarHBondContact O-N 3.35Å; H244-P248 VanDerWaalsContact O-CA 3.31Å; H244-P248 WeakPolarHBondContact O-CA 3.36Å; H244-P248 VanDerWaalsContact O-CB 3.3Å; H244-P248 WeakPolarHBondContact O-CB 3.45Å; H244-P248 VanDerWaalsContact O-CD 3.24Å; H244-P248 WeakPolarHBondContact O-CD 3.42Å; H244-P248 VanDerWaalsContact O-N 3.13Å; H244-L251 PolarHBondContact ND1-O 3.19Å; H244-L253 HydrophobicContact CB-CG 4.31Å; H244-R326 PolarHBondContact NE2-NH1 2.95Å
245	F	69.9	Low	73	Confident	48 Å²	48	35 Å²	35	21%	0.211	19%	0.186	C	C	.	.	H	α-helix	trans	-61.9	-39.1	179.8	170.5	-116.2	0	0	0	113	F200 A241 L242 L243 P325 R326	F200-F245 HydrophobicContact CD2-CD2 4.28Å; F200-F245 HydrophobicContact CE2-CB 4.21Å; F200-F245 AromaticContact CE2-CD2 3.54Å; F200-F245 HydrophobicContact CE2-CD2 3.54Å; F200-F245 HydrophobicContact CE2-CE2 4.3Å; F200-F245 HydrophobicContact CE2-CG 4.17Å; F200-F245 HydrophobicContact CZ-CB 4.22Å; F200-F245 HydrophobicContact CZ-CD2 4.23Å; A241-F245 PolarHBondContact O-N 2.68Å; A241-F245 VanDerWaalsContact O-N 3.14Å; L242-F245 PolarHBondContact O-N 3.42Å; L243-F245 VanDerWaalsContact C-N 3.32Å; L243-F245 PolarHBondContact O-N 2.99Å; F245-P325 HydrophobicContact CZ-CB 4.28Å; F245-R326 HydrophobicContact CD2-CB 4.36Å; F245-R326 HydrophobicContact CE2-CB 4.5Å; F245-R326 PolarHBondContact O-N 2.6Å
246	Y	66.2	Low	72.9	Confident	21 Å²	21	34 Å²	34	8%	0.082	18%	0.181	C	C	.	.	H	α-helix	trans	-86.2	-34	179.4	-75.9	-71.7	0	0	0	113.5	L242 L243 H244 P248 F315 V323 K324 P325	L242-Y246 HydrophobicContact CD1-CD2 4.27Å; L242-Y246 HydrophobicContact CD1-CE2 3.85Å; L242-Y246 HydrophobicContact CG-CD2 4.5Å; L242-Y246 HydrophobicContact CG-CE2 4.45Å; L242-Y246 WeakPolarHBondContact O-CD2 3.42Å; L242-Y246 PolarHBondContact O-N 2.86Å; L243-Y246 PolarHBondContact O-N 2.87Å; H244-Y246 VanDerWaalsContact C-N 3.32Å; H244-Y246 PolarHBondContact O-N 3.35Å; Y246-P248 VanDerWaalsContact C-CD 3.46Å; Y246-F315 HydrophobicContact CD1-CB 3.69Å; Y246-F315 HydrophobicContact CD1-CD2 4.41Å; Y246-F315 HydrophobicContact CD1-CG 4.04Å; Y246-F315 HydrophobicContact CD2-CB 4.31Å; Y246-F315 AromaticContact CD2-CD2 3.53Å; Y246-F315 HydrophobicContact CD2-CD2 3.53Å; Y246-F315 HydrophobicContact CD2-CE2 4.03Å; Y246-F315 AromaticContact CD2-CG 3.98Å; Y246-F315 HydrophobicContact CD2-CG 3.98Å; Y246-F315 HydrophobicContact CE1-CB 3.85Å; Y246-F315 HydrophobicContact CE2-CB 4.44Å; Y246-F315 AromaticContact CE2-CD2 3.95Å; Y246-F315 HydrophobicContact CE2-CD2 3.95Å; Y246-F315 HydrophobicContact CE2-CG 4.47Å; Y246-F315 HydrophobicContact CG-CB 3.94Å; Y246-F315 HydrophobicContact CG-CD1 4.28Å; Y246-F315 AromaticContact CG-CD2 3.8Å; Y246-F315 HydrophobicContact CG-CD2 3.8Å; Y246-F315 HydrophobicContact CG-CE2 4.4Å; Y246-F315 AromaticContact CG-CG 3.75Å; Y246-F315 HydrophobicContact CG-CG 3.75Å; Y246-V323 HydrophobicContact CD1-CG1 4.11Å; Y246-V323 CarbonylContact O-C 3.59Å; Y246-V323 WeakPolarHBondContact O-CA 3.34Å; Y246-K324 CarbonylContact O-C 3.56Å; Y246-K324 PolarHBondContact O-N 3.21Å; Y246-P325 HydrophobicContact CD1-CB 4.49Å; Y246-P325 HydrophobicContact CD1-CG 4.03Å; Y246-P325 HydrophobicContact CE1-CG 4.31Å
247	C	74.3	Confident	72.8	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.007	19%	0.19	C	C	.	.			trans	-130.9	54.7	-171.4	-57.1	0	0	0	0	112.8	L243 Q249 L250 L251 F277	L243-C247 WeakPolarHBondContact O-CB 3.3Å; L243-C247 PolarHBondContact O-N 3.2Å; C247-Q249 PolarHBondContact O-N 3.15Å; C247-L250 HydrophobicContact CB-CB 4.33Å; C247-L250 HydrophobicContact CB-CD1 4.42Å; C247-L250 PolarHBondContact O-N 2.94Å; C247-L251 PolarHBondContact O-N 3.03Å; C247-L251 VanDerWaalsContact O-N 3.15Å; C247-F277 HydrophobicContact CB-CE2 4.09Å; C247-F277 HydrophobicContact CB-CZ 3.92Å
248	P	69.6	Low	72.5	Confident	34 Å²	34	36.3 Å²	36.3	22%	0.221	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-4.3	-172.3	28.5	-36.3	0	0	0	114.8	H244 Y246	H244-P248 VanDerWaalsContact O-CA 3.31Å; H244-P248 WeakPolarHBondContact O-CA 3.36Å; H244-P248 VanDerWaalsContact O-CB 3.3Å; H244-P248 WeakPolarHBondContact O-CB 3.45Å; H244-P248 VanDerWaalsContact O-CD 3.24Å; H244-P248 WeakPolarHBondContact O-CD 3.42Å; H244-P248 VanDerWaalsContact O-N 3.13Å; Y246-P248 VanDerWaalsContact C-CD 3.46Å
249	Q	62.1	Low	72.2	Confident	144 Å²	144	40.3 Å²	40.3	67%	0.673	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-10.5	176	-59.8	-170.3	-41.4	0	0	113.2	C247 K324	C247-Q249 PolarHBondContact O-N 3.15Å; Q249-K324 VanDerWaalsContact OE1-NZ 3.11Å
250	L	71.1	Confident	71.3	Confident	76 Å²	76	46.4 Å²	46.4	40%	0.398	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.6	-26.7	-179.2	-67.9	174.8	0	0	0	112.6	C247 F277 N281 F322	C247-L250 HydrophobicContact CB-CB 4.33Å; C247-L250 HydrophobicContact CB-CD1 4.42Å; C247-L250 PolarHBondContact O-N 2.94Å; L250-F277 HydrophobicContact CB-CD2 4.4Å; L250-F277 HydrophobicContact CB-CE2 3.78Å; L250-F277 HydrophobicContact CD1-CE2 3.97Å; L250-N281 WeakPolarHBondContact CD1-OD1 3.43Å; L250-F322 HydrophobicContact CD1-CB 3.66Å; L250-F322 HydrophobicContact CD1-CD1 4.48Å; L250-F322 HydrophobicContact CD1-CD2 3.64Å; L250-F322 HydrophobicContact CD1-CE2 4.4Å; L250-F322 HydrophobicContact CD1-CG 3.7Å; L250-F322 HydrophobicContact CG-CB 4.49Å
251	L	75.4	Confident	70.5	Confident	4 Å²	4	53.4 Å²	53.4	2%	0.021	28%	0.275	C	S	.	.	S	Bend	trans	-130.4	95.5	173.1	-172.5	69.8	0	0	0	109.6	G240 L243 H244 C247 V256 L273	G240-L251 WeakPolarHBondContact O-CD2 3.41Å; L243-L251 HydrophobicContact CB-CD2 3.51Å; L243-L251 HydrophobicContact CD1-CD2 4.06Å; L243-L251 HydrophobicContact CG-CD2 4.43Å; H244-L251 PolarHBondContact ND1-O 3.19Å; C247-L251 PolarHBondContact O-N 3.03Å; C247-L251 VanDerWaalsContact O-N 3.15Å; L251-V256 HydrophobicContact CD1-CG2 3.99Å; L251-V256 HydrophobicContact CD2-CG2 3.91Å; L251-V256 HydrophobicContact CG-CG2 3.91Å; L251-L273 HydrophobicContact CD1-CD1 3.99Å; L251-L273 HydrophobicContact CD1-CD2 3.62Å; L251-L273 HydrophobicContact CD1-CG 3.61Å
252	P	69.8	Low	70.4	Confident	45 Å²	45	53.9 Å²	53.9	29%	0.292	28%	0.276	S	S	.	.			trans	-60.4	152.1	169	-24.5	37.1	0	0	0	112	D254 D255	P252-D254 PolarHBondContact O-N 2.96Å; P252-D255 WeakPolarHBondContact CD-OD2 3.42Å; P252-D255 VanDerWaalsContact CG-OD2 3.24Å; P252-D255 WeakPolarHBondContact CG-OD2 3.49Å
253	L	66.6	Low	70.8	Confident	38 Å²	38	54.8 Å²	54.8	20%	0.199	29%	0.285	C	S	.	.	S	Bend	trans	-69	-26.6	171.4	-89.1	162.9	0	0	0	111.8	H244 D255 V256 L258	H244-L253 HydrophobicContact CB-CG 4.31Å; L253-D255 VanDerWaalsContact C-N 3.28Å; L253-D255 PolarHBondContact O-N 2.93Å; L253-V256 PolarHBondContact O-N 3.05Å; L253-V256 VanDerWaalsContact O-O 3.11Å; L253-L258 HydrophobicContact CD2-CD1 3.65Å
254	D	65.8	Low	71.1	Confident	153 Å²	153	59.4 Å²	59.4	82%	0.818	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-19.4	-178.1	-48.1	-73.7	0	0	0	113.1	P252	P252-D254 PolarHBondContact O-N 2.96Å
255	D	76.9	Confident	71.4	Confident	58 Å²	58	61.1 Å²	61.1	31%	0.31	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-11	173.8	-67.5	-44.9	0	0	0	112.6	P252 L253 Y269 L273	P252-D255 WeakPolarHBondContact CD-OD2 3.42Å; P252-D255 VanDerWaalsContact CG-OD2 3.24Å; P252-D255 WeakPolarHBondContact CG-OD2 3.49Å; L253-D255 VanDerWaalsContact C-N 3.28Å; L253-D255 PolarHBondContact O-N 2.93Å; D255-Y269 VanDerWaalsContact O-CE1 3.25Å; D255-Y269 WeakPolarHBondContact O-CE1 3.48Å; D255-Y269 PolarHBondContact O-OH 3.42Å; D255-L273 HydrophobicContact CB-CD2 4.35Å; D255-L273 WeakPolarHBondContact O-CD2 3.48Å
256	V	76.3	Confident	72	Confident	10 Å²	10	59.9 Å²	59.9	6%	0.061	32%	0.321	C	S	.	.	S	Bend	trans	-96.3	121.7	174.1	-177.9	0	0	0	0	108.6	L251 L253 L258 L273	L251-V256 HydrophobicContact CD1-CG2 3.99Å; L251-V256 HydrophobicContact CD2-CG2 3.91Å; L251-V256 HydrophobicContact CG-CG2 3.91Å; L253-V256 PolarHBondContact O-N 3.05Å; L253-V256 VanDerWaalsContact O-O 3.11Å; V256-L258 HydrophobicContact CG1-CD2 4.1Å; V256-L258 HydrophobicContact CG1-CG 4.12Å; V256-L258 PolarHBondContact O-N 3.44Å; V256-L273 HydrophobicContact CG2-CD2 4.21Å
257	C	75.3	Confident	72.9	Confident	28 Å²	28	62.7 Å²	62.7	19%	0.189	33%	0.331	C	S	.	.			trans	-64.5	126.4	170.7	-80.4	0	0	0	0	109.2	M262 D266 N270	C257-M262 VanDerWaalsContact C-CE 3.43Å; C257-M262 HydrophobicContact CB-CE 4.05Å; C257-M262 HydrophobicContact CB-SD 4.28Å; C257-M262 WeakPolarHBondContact O-CE 3.09Å; C257-D266 HydrophobicContact CB-CB 4.33Å; C257-N270 WeakPolarHBondContact CB-OD1 3.49Å; C257-N270 PolarHBondContact N-OD1 2.88Å; C257-N270 PolarHBondContact O-ND2 2.98Å
258	L	72.2	Confident	73.3	Confident	25 Å²	25	62.9 Å²	62.9	13%	0.131	33%	0.332	C	S	.	.			trans	-132	54.9	176.6	-67.4	176.5	0	0	0	111	P221 I223 L253 V256	P221-L258 HydrophobicContact CB-CB 4.06Å; P221-L258 HydrophobicContact CB-CD1 3.71Å; I223-L258 HydrophobicContact CG1-CD1 4.15Å; I223-L258 HydrophobicContact CG1-CD2 4.37Å; L253-L258 HydrophobicContact CD2-CD1 3.65Å; V256-L258 HydrophobicContact CG1-CD2 4.1Å; V256-L258 HydrophobicContact CG1-CG 4.12Å; V256-L258 PolarHBondContact O-N 3.44Å
259	K	71.8	Confident	74	Confident	99 Å²	99	64.6 Å²	64.6	43%	0.43	34%	0.335	S	S	.	.			trans	-85.3	143.9	175.3	-55.7	171	-179.4	173.8	0	110.3	M262 D266	K259-M262 HydrophobicContact CB-CE 4.22Å; K259-M262 HydrophobicContact CB-SD 3.85Å; K259-M262 HydrophobicContact CD-SD 4.36Å; K259-M262 HydrophobicContact CG-SD 4.33Å; K259-M262 VanDerWaalsContact N-CE 3.27Å; K259-D266 IonicContact NZ-OD1 3.14Å; K259-D266 PolarHBondContact NZ-OD1 3.11Å; K259-D266 IonicContact NZ-OD2 2.68Å; K259-D266 PolarHBondContact NZ-OD2 3.48Å
260	E	58.3	Low	75.2	Confident	136 Å²	136	57.9 Å²	57.9	64%	0.636	30%	0.303	S	S	*	.	S	Bend	trans	-66.6	-39.9	174.9	-172	170.1	-159.2	0	0	111.9
261	N	59.2	Low	75.8	Confident	148 Å²	148	54.3 Å²	54.3	79%	0.791	28%	0.284	S	S	*	.	S	Bend	trans	-108.3	93	172.5	-72.4	-27.9	0	0	0	110.4
262	M	73.2	Confident	76.3	Confident	17 Å²	17	56 Å²	56	8%	0.084	29%	0.292	C	S	.	.			trans	-76.3	125.4	177.8	-73.1	-62.5	-172.5	0	0	113.1	S237 C257 K259 D266 R267	S237-M262 WeakPolarHBondContact OG-CE 3.28Å; C257-M262 VanDerWaalsContact C-CE 3.43Å; C257-M262 HydrophobicContact CB-CE 4.05Å; C257-M262 HydrophobicContact CB-SD 4.28Å; C257-M262 WeakPolarHBondContact O-CE 3.09Å; K259-M262 HydrophobicContact CB-CE 4.22Å; K259-M262 HydrophobicContact CB-SD 3.85Å; K259-M262 HydrophobicContact CD-SD 4.36Å; K259-M262 HydrophobicContact CG-SD 4.33Å; K259-M262 VanDerWaalsContact N-CE 3.27Å; M262-D266 HydrophobicContact SD-CB 3.61Å; M262-R267 HydrophobicContact CB-CG 3.75Å; M262-R267 HydrophobicContact CG-CG 4.35Å; M262-R267 PolarHBondContact O-NE 3.21Å; M262-R267 PolarHBondContact O-NH2 2.85Å
263	S	82.1	Confident	76.9	Confident	55 Å²	55	55.9 Å²	55.9	39%	0.385	29%	0.289	S	S	.	.			trans	-68.1	161.1	162.8	76.4	0	0	0	0	110.7	A265 D266 R267	S263-A265 VanDerWaalsContact C-N 3.27Å; S263-A265 PolarHBondContact O-N 2.94Å; S263-D266 WeakPolarHBondContact CB-OD2 3.3Å; S263-D266 PolarHBondContact N-OD2 3.39Å; S263-D266 PolarHBondContact O-N 3.13Å; S263-D266 PolarHBondContact OG-N 3.16Å; S263-D266 PolarHBondContact OG-OD2 2.88Å; S263-R267 WeakPolarHBondContact O-CG 3.44Å; S263-R267 PolarHBondContact O-N 2.8Å
264	L	82.3	Confident	77.7	Confident	99 Å²	99	54.2 Å²	54.2	52%	0.518	28%	0.28	S	S	.	.	H	α-helix	trans	-59.6	-40.1	175.4	177.1	57.3	0	0	0	111.6	D266 R267 L268 L294	L264-D266 VanDerWaalsContact C-N 3.35Å; L264-D266 PolarHBondContact O-N 3.04Å; L264-R267 PolarHBondContact O-N 3.35Å; L264-L268 HydrophobicContact CD1-CD1 3.9Å; L264-L268 HydrophobicContact CD1-CG 4.07Å; L264-L268 HydrophobicContact CG-CD1 3.79Å; L264-L268 HydrophobicContact CG-CG 4.43Å; L264-L268 WeakPolarHBondContact O-CD1 3.37Å; L264-L268 VanDerWaalsContact O-CG 3.24Å; L264-L268 WeakPolarHBondContact O-CG 3.09Å; L264-L268 PolarHBondContact O-N 3.14Å; L264-L294 HydrophobicContact CD1-CD1 3.68Å; L264-L294 HydrophobicContact CD1-CD2 3.8Å; L264-L294 HydrophobicContact CD1-CG 4.39Å
265	A	81	Confident	78.5	Confident	44 Å²	44	48.2 Å²	48.2	36%	0.364	25%	0.247	S	C	.	.	H	α-helix	trans	-62.2	-38.5	177.5	0	0	0	0	0	112.7	S263 L268 Y269	S263-A265 VanDerWaalsContact C-N 3.27Å; S263-A265 PolarHBondContact O-N 2.94Å; A265-L268 PolarHBondContact O-N 3.46Å; A265-Y269 WeakPolarHBondContact O-CB 3.43Å; A265-Y269 PolarHBondContact O-N 3.1Å
266	D	83.1	Confident	78.8	Confident	23 Å²	23	47.6 Å²	47.6	12%	0.123	24%	0.244	C	C	.	.	H	α-helix	trans	-63.9	-42.8	176.3	-66	-59.2	0	0	0	112.3	C257 K259 M262 S263 L264 Y269 N270	C257-D266 HydrophobicContact CB-CB 4.33Å; K259-D266 IonicContact NZ-OD1 3.14Å; K259-D266 PolarHBondContact NZ-OD1 3.11Å; K259-D266 IonicContact NZ-OD2 2.68Å; K259-D266 PolarHBondContact NZ-OD2 3.48Å; M262-D266 HydrophobicContact SD-CB 3.61Å; S263-D266 WeakPolarHBondContact CB-OD2 3.3Å; S263-D266 PolarHBondContact N-OD2 3.39Å; S263-D266 PolarHBondContact O-N 3.13Å; S263-D266 PolarHBondContact OG-N 3.16Å; S263-D266 PolarHBondContact OG-OD2 2.88Å; L264-D266 VanDerWaalsContact C-N 3.35Å; L264-D266 PolarHBondContact O-N 3.04Å; D266-Y269 PolarHBondContact O-N 2.99Å; D266-N270 PolarHBondContact O-N 3.42Å
267	R	85	Confident	79	Confident	79 Å²	79	47.7 Å²	47.7	30%	0.298	24%	0.243	S	C	.	.	H	α-helix	trans	-62.8	-45.4	177.8	-58.2	170.4	-158.9	-130.3	4.3	110.5	D235 M262 S263 L264 N270 L271	D235-R267 HydrophobicContact CB-CG 4.36Å; D235-R267 WeakPolarHBondContact OD1-CD 3.18Å; D235-R267 WeakPolarHBondContact OD1-CG 3.38Å; D235-R267 IonicContact OD1-CZ 2.74Å; D235-R267 IonicContact OD1-NE 2.97Å; D235-R267 PolarHBondContact OD1-NE 2.77Å; D235-R267 IonicContact OD1-NH1 2.69Å; D235-R267 PolarHBondContact OD1-NH1 3.11Å; M262-R267 HydrophobicContact CB-CG 3.75Å; M262-R267 HydrophobicContact CG-CG 4.35Å; M262-R267 PolarHBondContact O-NE 3.21Å; M262-R267 PolarHBondContact O-NH2 2.85Å; S263-R267 WeakPolarHBondContact O-CG 3.44Å; S263-R267 PolarHBondContact O-N 2.8Å; L264-R267 PolarHBondContact O-N 3.35Å; R267-N270 WeakPolarHBondContact O-CB 3.37Å; R267-N270 PolarHBondContact O-N 3.48Å; R267-L271 WeakPolarHBondContact O-CB 3.25Å; R267-L271 VanDerWaalsContact O-CG 3.3Å; R267-L271 WeakPolarHBondContact O-CG 3.33Å; R267-L271 PolarHBondContact O-N 3.2Å
268	L	83.1	Confident	79.3	Confident	5 Å²	5	46.3 Å²	46.3	3%	0.026	23%	0.234	C	C	.	.	H	α-helix	trans	-66.7	-37.7	179.9	-67.9	167.7	0	0	0	112.6	F14 I19 L264 A265 L271 Q272 L290 L294	F14-L268 HydrophobicContact CZ-CB 4.02Å; I19-L268 HydrophobicContact CD1-CD1 3.19Å; I19-L268 HydrophobicContact CD1-CD2 3.37Å; I19-L268 HydrophobicContact CD1-CG 3.87Å; L264-L268 HydrophobicContact CD1-CD1 3.9Å; L264-L268 HydrophobicContact CD1-CG 4.07Å; L264-L268 HydrophobicContact CG-CD1 3.79Å; L264-L268 HydrophobicContact CG-CG 4.43Å; L264-L268 WeakPolarHBondContact O-CD1 3.37Å; L264-L268 VanDerWaalsContact O-CG 3.24Å; L264-L268 WeakPolarHBondContact O-CG 3.09Å; L264-L268 PolarHBondContact O-N 3.14Å; A265-L268 PolarHBondContact O-N 3.46Å; L268-L271 PolarHBondContact O-N 2.85Å; L268-Q272 VanDerWaalsContact O-CB 3.27Å; L268-Q272 WeakPolarHBondContact O-CB 3.38Å; L268-Q272 PolarHBondContact O-N 3.43Å; L268-L290 HydrophobicContact CD2-CB 4.42Å; L268-L294 HydrophobicContact CD2-CD1 4.33Å; L268-L294 HydrophobicContact CD2-CD2 4.26Å
269	Y	84.3	Confident	79.6	Confident	71 Å²	71	49 Å²	49	28%	0.278	25%	0.245	S	C	.	.	H	α-helix	trans	-61.6	-47.2	171.7	173.2	-106.2	0	0	0	111.3	F14 D255 A265 D266 L271 Q272 L273	F14-Y269 HydrophobicContact CB-CD2 4.06Å; F14-Y269 HydrophobicContact CD1-CD2 4.4Å; F14-Y269 AromaticContact CD2-CD2 3.82Å; F14-Y269 HydrophobicContact CD2-CD2 3.82Å; F14-Y269 HydrophobicContact CE2-CD2 4.36Å; F14-Y269 AromaticContact CG-CD2 3.83Å; F14-Y269 HydrophobicContact CG-CD2 3.83Å; D255-Y269 VanDerWaalsContact O-CE1 3.25Å; D255-Y269 WeakPolarHBondContact O-CE1 3.48Å; D255-Y269 PolarHBondContact O-OH 3.42Å; A265-Y269 WeakPolarHBondContact O-CB 3.43Å; A265-Y269 PolarHBondContact O-N 3.1Å; D266-Y269 PolarHBondContact O-N 2.99Å; Y269-L271 PolarHBondContact O-N 2.92Å; Y269-Q272 PolarHBondContact O-N 3.47Å; Y269-L273 VanDerWaalsContact O-CB 3.31Å; Y269-L273 WeakPolarHBondContact O-CB 3.22Å; Y269-L273 PolarHBondContact O-N 3.24Å
270	N	86.1	Confident	79.9	Confident	3 Å²	3	50.3 Å²	50.3	2%	0.016	26%	0.257	C	S	.	.	H	α-helix	trans	-58.6	-46.1	173.8	-77.7	-10.8	0	0	0	112.3	D235 C257 D266 R267 L273 I274	D235-N270 PolarHBondContact O-ND2 2.93Å; C257-N270 WeakPolarHBondContact CB-OD1 3.49Å; C257-N270 PolarHBondContact N-OD1 2.88Å; C257-N270 PolarHBondContact O-ND2 2.98Å; D266-N270 PolarHBondContact O-N 3.42Å; R267-N270 WeakPolarHBondContact O-CB 3.37Å; R267-N270 PolarHBondContact O-N 3.48Å; N270-L273 PolarHBondContact O-N 2.92Å; N270-I274 VanDerWaalsContact O-CD1 3.29Å; N270-I274 WeakPolarHBondContact O-CD1 3.42Å; N270-I274 VanDerWaalsContact O-CG1 3.32Å; N270-I274 WeakPolarHBondContact O-CG1 3.11Å; N270-I274 PolarHBondContact O-N 3.49Å
271	L	84.9	Confident	80.2	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.5	-41.9	179	-71.4	177.2	0	0	0	112.4	R267 L268 Y269 I274 Q275 L290 M293 L294	R267-L271 WeakPolarHBondContact O-CB 3.25Å; R267-L271 VanDerWaalsContact O-CG 3.3Å; R267-L271 WeakPolarHBondContact O-CG 3.33Å; R267-L271 PolarHBondContact O-N 3.2Å; L268-L271 PolarHBondContact O-N 2.85Å; Y269-L271 PolarHBondContact O-N 2.92Å; L271-I274 PolarHBondContact O-N 2.87Å; L271-Q275 WeakPolarHBondContact O-CB 3.37Å; L271-Q275 PolarHBondContact O-N 3.12Å; L271-L290 HydrophobicContact CB-CD2 4.21Å; L271-M293 HydrophobicContact CD1-CB 4Å; L271-M293 HydrophobicContact CD2-CB 3.78Å; L271-M293 HydrophobicContact CD2-CE 3.87Å; L271-M293 HydrophobicContact CD2-SD 4.26Å; L271-M293 HydrophobicContact CG-CB 4.44Å; L271-L294 HydrophobicContact CD1-CB 4.15Å; L271-L294 HydrophobicContact CD1-CD1 4.48Å
272	Q	84.7	Confident	80.8	Confident	39 Å²	39	38.7 Å²	38.7	18%	0.182	20%	0.199	C	C	.	.	H	α-helix	trans	-61.2	-45.2	174.5	-178.5	63.9	45.6	0	0	111.2	F14 L268 Y269 I274 Q275 D276 L290	F14-Q272 HydrophobicContact CE2-CB 4.29Å; L268-Q272 VanDerWaalsContact O-CB 3.27Å; L268-Q272 WeakPolarHBondContact O-CB 3.38Å; L268-Q272 PolarHBondContact O-N 3.43Å; Y269-Q272 PolarHBondContact O-N 3.47Å; Q272-I274 VanDerWaalsContact C-N 3.3Å; Q272-I274 PolarHBondContact O-N 2.85Å; Q272-Q275 PolarHBondContact O-N 3.4Å; Q272-Q275 VanDerWaalsContact O-N 3.09Å; Q272-D276 PolarHBondContact NE2-OD1 3.28Å; Q272-D276 PolarHBondContact NE2-OD2 3.34Å; Q272-D276 PolarHBondContact O-N 3.48Å; Q272-L290 HydrophobicContact CB-CD2 4.25Å
273	L	83.3	Confident	80.5	Confident	43 Å²	43	41.7 Å²	41.7	23%	0.225	22%	0.215	C	C	.	.	H	α-helix	trans	-61.3	-37.5	178.8	-175.2	60.2	0	0	0	112.1	L251 D255 V256 Y269 N270 F277	L251-L273 HydrophobicContact CD1-CD1 3.99Å; L251-L273 HydrophobicContact CD1-CD2 3.62Å; L251-L273 HydrophobicContact CD1-CG 3.61Å; D255-L273 HydrophobicContact CB-CD2 4.35Å; D255-L273 WeakPolarHBondContact O-CD2 3.48Å; V256-L273 HydrophobicContact CG2-CD2 4.21Å; Y269-L273 VanDerWaalsContact O-CB 3.31Å; Y269-L273 WeakPolarHBondContact O-CB 3.22Å; Y269-L273 PolarHBondContact O-N 3.24Å; N270-L273 PolarHBondContact O-N 2.92Å; L273-F277 VanDerWaalsContact O-CB 3.3Å; L273-F277 WeakPolarHBondContact O-CB 3.14Å; L273-F277 PolarHBondContact O-N 2.96Å
274	I	82.4	Confident	79.8	Confident	4 Å²	4	40 Å²	40	2%	0.021	20%	0.204	C	C	.	.	H	α-helix	trans	-67.1	-45.7	170.9	-67.9	154	0	0	0	111.3	G236 L239 L243 N270 L271 Q272 D276 F277 C278 M293	G236-I274 WeakPolarHBondContact O-CD1 3.23Å; L239-I274 HydrophobicContact CB-CD1 3.51Å; L239-I274 HydrophobicContact CB-CG1 4.16Å; L239-I274 HydrophobicContact CD1-CD1 4.05Å; L239-I274 HydrophobicContact CD1-CG2 4.14Å; L239-I274 HydrophobicContact CG-CD1 4.45Å; L243-I274 HydrophobicContact CD1-CB 4.38Å; L243-I274 HydrophobicContact CD1-CG1 4.01Å; L243-I274 HydrophobicContact CD1-CG2 4.24Å; N270-I274 VanDerWaalsContact O-CD1 3.29Å; N270-I274 WeakPolarHBondContact O-CD1 3.42Å; N270-I274 VanDerWaalsContact O-CG1 3.32Å; N270-I274 WeakPolarHBondContact O-CG1 3.11Å; N270-I274 PolarHBondContact O-N 3.49Å; L271-I274 PolarHBondContact O-N 2.87Å; Q272-I274 VanDerWaalsContact C-N 3.3Å; Q272-I274 PolarHBondContact O-N 2.85Å; I274-D276 PolarHBondContact O-N 3.15Å; I274-F277 PolarHBondContact O-N 3.45Å; I274-C278 PolarHBondContact O-N 3.42Å; I274-C278 PolarHBondContact O-SG 3.01Å; I274-C278 VanDerWaalsContact O-SG 3.36Å; I274-M293 HydrophobicContact CG2-CE 4.35Å
275	Q	83.6	Confident	79.2	Confident	26 Å²	26	35.5 Å²	35.5	12%	0.121	18%	0.18	C	C	.	.	H	α-helix	trans	-62.7	-43.3	-178.3	-155.3	-158.7	50.8	0	0	111.1	L271 Q272 C278 K279 C286 F288	L271-Q275 WeakPolarHBondContact O-CB 3.37Å; L271-Q275 PolarHBondContact O-N 3.12Å; Q272-Q275 PolarHBondContact O-N 3.4Å; Q272-Q275 VanDerWaalsContact O-N 3.09Å; Q275-C278 PolarHBondContact O-N 3.16Å; Q275-K279 WeakPolarHBondContact O-CG 3.49Å; Q275-K279 PolarHBondContact O-N 2.84Å; Q275-K279 VanDerWaalsContact OE1-CE 3.24Å; Q275-C286 HydrophobicContact CG-CB 4.44Å; Q275-F288 PolarHBondContact NE2-O 3.04Å
276	D	82.6	Confident	78.9	Confident	45 Å²	45	34.1 Å²	34.1	24%	0.241	17%	0.168	C	C	.	.	H	α-helix	trans	-69	-42.3	177.1	-70.1	-20.9	0	0	0	111.8	Q272 I274 C278 K279 D280	Q272-D276 PolarHBondContact NE2-OD1 3.28Å; Q272-D276 PolarHBondContact NE2-OD2 3.34Å; Q272-D276 PolarHBondContact O-N 3.48Å; I274-D276 PolarHBondContact O-N 3.15Å; D276-C278 PolarHBondContact O-N 3.36Å; D276-K279 PolarHBondContact O-N 2.99Å; D276-K279 VanDerWaalsContact O-N 3.13Å; D276-K279 IonicContact OD1-NZ 2.73Å; D276-K279 PolarHBondContact OD1-NZ 2.95Å; D276-D280 WeakPolarHBondContact O-CB 3.39Å; D276-D280 PolarHBondContact O-N 3.28Å
277	F	81.4	Confident	78.6	Confident	12 Å²	12	34.3 Å²	34.3	5%	0.053	17%	0.168	C	C	.	.	H	α-helix	trans	-54.3	-42.5	171.2	177.9	-88.7	0	0	0	111.9	L243 C247 L250 L273 I274 N281 L282 F315	L243-F277 HydrophobicContact CD1-CB 4.36Å; L243-F277 HydrophobicContact CD1-CD1 3.69Å; L243-F277 HydrophobicContact CD1-CE1 4.27Å; L243-F277 HydrophobicContact CD1-CG 4.07Å; L243-F277 HydrophobicContact CD2-CD1 3.85Å; L243-F277 HydrophobicContact CD2-CE1 3.64Å; L243-F277 HydrophobicContact CD2-CZ 4.48Å; L243-F277 HydrophobicContact CG-CD1 4.34Å; L243-F277 HydrophobicContact CG-CE1 4.45Å; C247-F277 HydrophobicContact CB-CE2 4.09Å; C247-F277 HydrophobicContact CB-CZ 3.92Å; L250-F277 HydrophobicContact CB-CD2 4.4Å; L250-F277 HydrophobicContact CB-CE2 3.78Å; L250-F277 HydrophobicContact CD1-CE2 3.97Å; L273-F277 VanDerWaalsContact O-CB 3.3Å; L273-F277 WeakPolarHBondContact O-CB 3.14Å; L273-F277 PolarHBondContact O-N 2.96Å; I274-F277 PolarHBondContact O-N 3.45Å; F277-N281 HydrophobicContact CE2-CB 4.31Å; F277-N281 HydrophobicContact CZ-CB 4.24Å; F277-N281 WeakPolarHBondContact O-CB 3.44Å; F277-N281 PolarHBondContact O-N 2.7Å; F277-N281 PolarHBondContact O-ND2 3.21Å; F277-L282 HydrophobicContact CD1-CD1 4.19Å; F277-L282 HydrophobicContact CE1-CD1 3.7Å; F277-L282 HydrophobicContact CE1-CG 4.07Å; F277-F315 HydrophobicContact CE1-CZ 4.38Å
278	C	80.6	Confident	78.6	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-69.9	-33.5	178.2	-72.7	0	0	0	0	114	I274 Q275 D276 L282 S284 C286	I274-C278 PolarHBondContact O-N 3.42Å; I274-C278 PolarHBondContact O-SG 3.01Å; I274-C278 VanDerWaalsContact O-SG 3.36Å; Q275-C278 PolarHBondContact O-N 3.16Å; D276-C278 PolarHBondContact O-N 3.36Å; C278-L282 CarbonylContact O-C 3.56Å; C278-L282 VanDerWaalsContact O-C 3.31Å; C278-L282 WeakPolarHBondContact O-CA 3.3Å; C278-L282 PolarHBondContact O-N 3.39Å; C278-S284 PolarHBondContact O-N 3.5Å; C278-S284 VanDerWaalsContact O-N 3.11Å; C278-C286 HydrophobicContact CB-CB 3.62Å
279	K	79.6	Confident	78.5	Confident	81 Å²	81	32.1 Å²	32.1	35%	0.352	16%	0.164	S	C	.	.	H	α-helix	trans	-66.4	-55.1	172.2	-67.3	165	-156.6	161.2	0	110.5	Q275 D276 N281	Q275-K279 WeakPolarHBondContact O-CG 3.49Å; Q275-K279 PolarHBondContact O-N 2.84Å; Q275-K279 VanDerWaalsContact OE1-CE 3.24Å; D276-K279 PolarHBondContact O-N 2.99Å; D276-K279 VanDerWaalsContact O-N 3.13Å; D276-K279 IonicContact OD1-NZ 2.73Å; D276-K279 PolarHBondContact OD1-NZ 2.95Å; K279-N281 PolarHBondContact O-N 2.87Å
280	D	76.3	Confident	78.3	Confident	126 Å²	126	29.2 Å²	29.2	67%	0.674	15%	0.153	S	C	*	.	H	α-helix	trans	-72.5	-30.4	-168.8	-67.8	-9.5	0	0	0	112.8	D276	D276-D280 WeakPolarHBondContact O-CB 3.39Å; D276-D280 PolarHBondContact O-N 3.28Å
281	N	66.3	Low	78.1	Confident	41 Å²	41	31.3 Å²	31.3	22%	0.219	16%	0.163	C	C	.	.	H	α-helix	trans	-119.3	-18.9	-171.4	-54.4	-88.8	0	0	0	114.9	L250 F277 K279 F322	L250-N281 WeakPolarHBondContact CD1-OD1 3.43Å; F277-N281 HydrophobicContact CE2-CB 4.31Å; F277-N281 HydrophobicContact CZ-CB 4.24Å; F277-N281 WeakPolarHBondContact O-CB 3.44Å; F277-N281 PolarHBondContact O-N 2.7Å; F277-N281 PolarHBondContact O-ND2 3.21Å; K279-N281 PolarHBondContact O-N 2.87Å; N281-F322 HydrophobicContact CB-CE1 4.44Å; N281-F322 HydrophobicContact CB-CE2 4.37Å; N281-F322 HydrophobicContact CB-CZ 4.03Å; N281-F322 VanDerWaalsContact O-CZ 3.29Å; N281-F322 WeakPolarHBondContact O-CZ 3.49Å
282	L	70.3	Confident	78.1	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.164	C	C	.	.	S	Bend	trans	-130.2	36.7	-168.2	-59.3	179.4	0	0	0	114.4	F277 C278 S284 C285 L311 W314 F315 F322	F277-L282 HydrophobicContact CD1-CD1 4.19Å; F277-L282 HydrophobicContact CE1-CD1 3.7Å; F277-L282 HydrophobicContact CE1-CG 4.07Å; C278-L282 CarbonylContact O-C 3.56Å; C278-L282 VanDerWaalsContact O-C 3.31Å; C278-L282 WeakPolarHBondContact O-CA 3.3Å; C278-L282 PolarHBondContact O-N 3.39Å; L282-S284 VanDerWaalsContact C-N 3.25Å; L282-S284 PolarHBondContact O-N 2.93Å; L282-S284 VanDerWaalsContact O-N 3.17Å; L282-C285 WeakPolarHBondContact O-CB 3.4Å; L282-C285 PolarHBondContact O-N 2.68Å; L282-C285 VanDerWaalsContact O-N 3.12Å; L282-L311 HydrophobicContact CD1-CD2 3.59Å; L282-W314 HydrophobicContact CD2-CB 3.78Å; L282-W314 HydrophobicContact CD2-CD2 4.15Å; L282-W314 HydrophobicContact CD2-CG 3.76Å; L282-F315 HydrophobicContact CD1-CE1 4.27Å; L282-F315 HydrophobicContact CD1-CZ 4.08Å; L282-F315 HydrophobicContact CD2-CE1 4.25Å; L282-F322 HydrophobicContact CD2-CE2 4.28Å; L282-F322 HydrophobicContact CD2-CZ 4.05Å
283	N	67.3	Low	78	Confident	80 Å²	80	29.9 Å²	29.9	43%	0.428	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	39.6	177	-69.1	9.5	0	0	0	114	C285 W314	N283-C285 VanDerWaalsContact C-N 3.31Å; N283-C285 PolarHBondContact O-N 2.9Å; N283-W314 HydrophobicContact CB-CZ2 3.92Å
284	S	68.7	Low	78	Confident	20 Å²	20	28.9 Å²	28.9	14%	0.14	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	34.1	-178.8	-58	0	0	0	0	114.8	E47 C278 L282 C286 H287	E47-S284 VanDerWaalsContact OE1-CB 3.26Å; E47-S284 WeakPolarHBondContact OE1-CB 3.46Å; E47-S284 PolarHBondContact OE1-OG 2.67Å; C278-S284 PolarHBondContact O-N 3.5Å; C278-S284 VanDerWaalsContact O-N 3.11Å; L282-S284 VanDerWaalsContact C-N 3.25Å; L282-S284 PolarHBondContact O-N 2.93Å; L282-S284 VanDerWaalsContact O-N 3.17Å; S284-C286 PolarHBondContact O-N 3Å; S284-H287 PolarHBondContact O-CE1 2.85Å; S284-H287 PolarHBondContact O-ND1 2.96Å
285	C	68.9	Low	78.1	Confident	4 Å²	4	31.6 Å²	31.6	3%	0.027	16%	0.162	C	C	.	.			trans	-61.7	-14.6	179.9	72.1	0	0	0	0	114.8	L282 N283 H287 F307 E310	L282-C285 WeakPolarHBondContact O-CB 3.4Å; L282-C285 PolarHBondContact O-N 2.68Å; L282-C285 VanDerWaalsContact O-N 3.12Å; N283-C285 VanDerWaalsContact C-N 3.31Å; N283-C285 PolarHBondContact O-N 2.9Å; C285-H287 PolarHBondContact O-N 2.94Å; C285-F307 WeakPolarHBondContact O-CD2 3.38Å; C285-E310 HydrophobicContact CB-CB 4.35Å
286	C	73.6	Confident	77.9	Confident	14 Å²	14	31 Å²	31	10%	0.095	16%	0.161	C	C	.	.			trans	-85.3	102.8	170.8	-170.8	0	0	0	0	110	Q275 C278 S284 F307	Q275-C286 HydrophobicContact CG-CB 4.44Å; C278-C286 HydrophobicContact CB-CB 3.62Å; S284-C286 PolarHBondContact O-N 3Å; C286-F307 HydrophobicContact CB-CE2 3.84Å; C286-F307 HydrophobicContact CB-CZ 4.43Å
287	H	78.4	Confident	77.7	Confident	28 Å²	28	30 Å²	30	13%	0.13	16%	0.158	C	C	.	.			trans	-94.5	8.4	-180	-61.4	-50	0	0	0	114.3	R37 W38 S41 S284 C285	R37-H287 HydrophobicContact CB-CB 4.04Å; W38-H287 AromaticContact CD1-CD2 3.75Å; S41-H287 WeakPolarHBondContact CB-CE1 3.35Å; S41-H287 VanDerWaalsContact CB-NE2 3.29Å; S41-H287 WeakPolarHBondContact CB-NE2 3.47Å; S41-H287 PolarHBondContact OG-CE1 3.37Å; S41-H287 PolarHBondContact OG-NE2 2.72Å; S284-H287 PolarHBondContact O-CE1 2.85Å; S284-H287 PolarHBondContact O-ND1 2.96Å; C285-H287 PolarHBondContact O-N 2.94Å
288	F	83.8	Confident	77.5	Confident	8 Å²	8	34 Å²	34	4%	0.035	19%	0.187	C	C	.	.			trans	-89.6	148.9	-177.7	-58.9	-70.1	0	0	0	112.5	C34 Q275 D292 M293 I300 N303 Y304 F307	C34-F288 HydrophobicContact CB-CD1 4.45Å; C34-F288 HydrophobicContact CB-CE1 4.48Å; C34-F288 VanDerWaalsContact SG-CD1 3.5Å; Q275-F288 PolarHBondContact NE2-O 3.04Å; F288-D292 HydrophobicContact CB-CB 3.9Å; F288-D292 HydrophobicContact CD1-CB 3.9Å; F288-D292 HydrophobicContact CG-CB 4.35Å; F288-M293 HydrophobicContact CB-CG 3.59Å; F288-M293 HydrophobicContact CB-SD 4.16Å; F288-M293 HydrophobicContact CD2-CG 4.22Å; F288-M293 HydrophobicContact CD2-SD 4.48Å; F288-M293 HydrophobicContact CG-CG 4Å; F288-I300 HydrophobicContact CD1-CD1 4.31Å; F288-I300 HydrophobicContact CE1-CD1 4.15Å; F288-N303 HydrophobicContact CE1-CB 3.7Å; F288-N303 HydrophobicContact CZ-CB 3.76Å; F288-Y304 HydrophobicContact CE2-CD2 4.29Å; F288-Y304 HydrophobicContact CZ-CD2 4.18Å; F288-F307 HydrophobicContact CE2-CB 3.79Å; F288-F307 HydrophobicContact CE2-CD1 4.2Å; F288-F307 AromaticContact CE2-CG 3.93Å; F288-F307 HydrophobicContact CE2-CG 3.93Å; F288-F307 HydrophobicContact CZ-CB 4.38Å
289	S	80.8	Confident	77.5	Confident	29 Å²	29	36.8 Å²	36.8	20%	0.203	20%	0.204	C	C	.	.			trans	-72.8	172.9	155.7	66.7	0	0	0	0	111.2	E291 D292 M293	S289-E291 VanDerWaalsContact C-N 3.28Å; S289-E291 WeakPolarHBondContact CB-OE2 3.21Å; S289-D292 VanDerWaalsContact CB-OD2 3.31Å; S289-D292 WeakPolarHBondContact CB-OD2 3.39Å; S289-D292 PolarHBondContact N-OD2 3.09Å; S289-D292 PolarHBondContact OG-N 3.35Å; S289-D292 PolarHBondContact OG-OD2 3.38Å; S289-M293 PolarHBondContact O-N 2.85Å
290	L	79.9	Confident	77.6	Confident	11 Å²	11	33 Å²	33	6%	0.058	19%	0.188	C	C	.	.	H	α-helix	trans	-68.6	-36.2	174.9	-60.5	175.2	0	0	0	110.2	P17 L268 L271 Q272 M293 L294	P17-L290 HydrophobicContact CB-CD1 4.18Å; P17-L290 HydrophobicContact CG-CD1 3.72Å; L268-L290 HydrophobicContact CD2-CB 4.42Å; L271-L290 HydrophobicContact CB-CD2 4.21Å; Q272-L290 HydrophobicContact CB-CD2 4.25Å; L290-M293 PolarHBondContact O-N 2.94Å; L290-L294 VanDerWaalsContact O-CB 3.29Å; L290-L294 WeakPolarHBondContact O-CB 3.27Å; L290-L294 PolarHBondContact O-N 2.91Å
291	E	83.3	Confident	78	Confident	46 Å²	46	29.9 Å²	29.9	22%	0.215	17%	0.168	C	C	.	.	H	α-helix	trans	-66.2	-39.8	178.6	-56.1	95.8	128.8	0	0	111.7	I19 Y25 S289 M293 L294 Y295	I19-E291 HydrophobicContact CB-CG 4.39Å; I19-E291 HydrophobicContact CG1-CG 4.08Å; I19-E291 HydrophobicContact CG2-CG 3.82Å; Y25-E291 HydrophobicContact CD2-CB 4.06Å; Y25-E291 HydrophobicContact CE2-CB 3.52Å; S289-E291 VanDerWaalsContact C-N 3.28Å; S289-E291 WeakPolarHBondContact CB-OE2 3.21Å; E291-M293 VanDerWaalsContact C-N 3.32Å; E291-M293 PolarHBondContact O-N 3.32Å; E291-L294 PolarHBondContact O-N 3.26Å; E291-Y295 HydrophobicContact CB-CD2 4.25Å; E291-Y295 HydrophobicContact CB-CE2 4.3Å; E291-Y295 WeakPolarHBondContact O-CB 3.48Å; E291-Y295 VanDerWaalsContact O-CD2 3.3Å; E291-Y295 WeakPolarHBondContact O-CD2 3.31Å; E291-Y295 PolarHBondContact O-N 3.42Å
292	D	84.5	Confident	78.8	Confident	5 Å²	5	29.8 Å²	29.8	3%	0.027	17%	0.168	C	C	.	.	H	α-helix	trans	-56.3	-46.3	170.8	-75.2	-68.6	0	0	0	111.4	Y25 A30 C34 F288 S289 A296 I300	Y25-D292 VanDerWaalsContact OH-CA 3.32Å; Y25-D292 WeakPolarHBondContact OH-CA 3.46Å; Y25-D292 PolarHBondContact OH-N 3.38Å; Y25-D292 PolarHBondContact OH-OD1 3.05Å; Y25-D292 VanDerWaalsContact OH-OD1 3.07Å; A30-D292 WeakPolarHBondContact CB-OD1 3.44Å; C34-D292 PolarHBondContact SG-OD1 3.2Å; C34-D292 VanDerWaalsContact SG-OD1 3.34Å; C34-D292 PolarHBondContact SG-OD2 3.45Å; C34-D292 VanDerWaalsContact SG-OD2 3.4Å; F288-D292 HydrophobicContact CB-CB 3.9Å; F288-D292 HydrophobicContact CD1-CB 3.9Å; F288-D292 HydrophobicContact CG-CB 4.35Å; S289-D292 VanDerWaalsContact CB-OD2 3.31Å; S289-D292 WeakPolarHBondContact CB-OD2 3.39Å; S289-D292 PolarHBondContact N-OD2 3.09Å; S289-D292 PolarHBondContact OG-N 3.35Å; S289-D292 PolarHBondContact OG-OD2 3.38Å; D292-A296 WeakPolarHBondContact O-CA 3.47Å; D292-A296 PolarHBondContact O-N 3.06Å; D292-I300 HydrophobicContact CB-CD1 4.17Å; D292-I300 VanDerWaalsContact O-CD1 3.24Å; D292-I300 WeakPolarHBondContact O-CD1 3.5Å
293	M	82.6	Confident	79.5	Confident	4 Å²	4	30.2 Å²	30.2	2%	0.02	17%	0.17	C	C	.	.	H	α-helix	trans	-75.2	-33.8	-178.6	-61.6	-174	75.6	0	0	112.9	L239 L271 I274 F288 S289 L290 E291	L239-M293 HydrophobicContact CD1-CE 3.67Å; L271-M293 HydrophobicContact CD1-CB 4Å; L271-M293 HydrophobicContact CD2-CB 3.78Å; L271-M293 HydrophobicContact CD2-CE 3.87Å; L271-M293 HydrophobicContact CD2-SD 4.26Å; L271-M293 HydrophobicContact CG-CB 4.44Å; I274-M293 HydrophobicContact CG2-CE 4.35Å; F288-M293 HydrophobicContact CB-CG 3.59Å; F288-M293 HydrophobicContact CB-SD 4.16Å; F288-M293 HydrophobicContact CD2-CG 4.22Å; F288-M293 HydrophobicContact CD2-SD 4.48Å; F288-M293 HydrophobicContact CG-CG 4Å; S289-M293 PolarHBondContact O-N 2.85Å; L290-M293 PolarHBondContact O-N 2.94Å; E291-M293 VanDerWaalsContact C-N 3.32Å; E291-M293 PolarHBondContact O-N 3.32Å
294	L	83.8	Confident	80.3	Confident	23 Å²	23	26.6 Å²	26.6	12%	0.12	15%	0.15	C	C	.	.	H	α-helix	trans	-70.9	-45.3	178.3	-178.5	75.6	0	0	0	111.9	T234 L264 L268 L271 L290 E291	T234-L294 WeakPolarHBondContact CG2-O 3.14Å; L264-L294 HydrophobicContact CD1-CD1 3.68Å; L264-L294 HydrophobicContact CD1-CD2 3.8Å; L264-L294 HydrophobicContact CD1-CG 4.39Å; L268-L294 HydrophobicContact CD2-CD1 4.33Å; L268-L294 HydrophobicContact CD2-CD2 4.26Å; L271-L294 HydrophobicContact CD1-CB 4.15Å; L271-L294 HydrophobicContact CD1-CD1 4.48Å; L290-L294 VanDerWaalsContact O-CB 3.29Å; L290-L294 WeakPolarHBondContact O-CB 3.27Å; L290-L294 PolarHBondContact O-N 2.91Å; E291-L294 PolarHBondContact O-N 3.26Å
295	Y	83.6	Confident	80.9	Confident	61 Å²	61	26.4 Å²	26.4	24%	0.239	15%	0.148	C	C	.	.	H	α-helix	trans	-86.9	-19.3	-178.1	-63.8	-51.1	0	0	0	113.3	K20 F22 Y25 E291 S297	K20-Y295 PolarHBondContact O-OH 3.31Å; F22-Y295 HydrophobicContact CB-CE1 4.19Å; F22-Y295 AromaticContact CD2-CD1 3.86Å; F22-Y295 HydrophobicContact CD2-CD1 3.86Å; F22-Y295 AromaticContact CD2-CE1 3.9Å; F22-Y295 HydrophobicContact CD2-CE1 3.9Å; F22-Y295 HydrophobicContact CD2-CG 4.5Å; F22-Y295 PolarHBondContact N-OH 3.23Å; Y25-Y295 AromaticContact CD1-CD2 3.97Å; Y25-Y295 HydrophobicContact CD1-CD2 3.97Å; Y25-Y295 AromaticContact CD2-CD2 3.68Å; Y25-Y295 HydrophobicContact CD2-CD2 3.68Å; Y25-Y295 AromaticContact CD2-CE2 3.83Å; Y25-Y295 HydrophobicContact CD2-CE2 3.83Å; Y25-Y295 HydrophobicContact CE1-CD2 4.15Å; Y25-Y295 AromaticContact CE2-CD2 3.9Å; Y25-Y295 HydrophobicContact CE2-CD2 3.9Å; Y25-Y295 HydrophobicContact CE2-CE2 4.39Å; Y25-Y295 AromaticContact CG-CD2 3.72Å; Y25-Y295 HydrophobicContact CG-CD2 3.72Å; Y25-Y295 AromaticContact CG-CE2 3.95Å; Y25-Y295 HydrophobicContact CG-CE2 3.95Å; E291-Y295 HydrophobicContact CB-CD2 4.25Å; E291-Y295 HydrophobicContact CB-CE2 4.3Å; E291-Y295 WeakPolarHBondContact O-CB 3.48Å; E291-Y295 VanDerWaalsContact O-CD2 3.3Å; E291-Y295 WeakPolarHBondContact O-CD2 3.31Å; E291-Y295 PolarHBondContact O-N 3.42Å; Y295-S297 PolarHBondContact O-N 2.79Å
296	A	78.6	Confident	81.6	Confident	13 Å²	13	26.2 Å²	26.2	11%	0.107	15%	0.146	C	C	.	.			trans	42.3	43.3	168.4	0	0	0	0	0	115.5	L230 T234 D292	L230-A296 HydrophobicContact CB-CB 4.18Å; L230-A296 HydrophobicContact CD2-CB 4.39Å; L230-A296 WeakPolarHBondContact O-CB 3.39Å; T234-A296 HydrophobicContact CG2-CB 3.56Å; D292-A296 WeakPolarHBondContact O-CA 3.47Å; D292-A296 PolarHBondContact O-N 3.06Å
297	S	78.8	Confident	82	Confident	24 Å²	24	25.8 Å²	25.8	17%	0.168	14%	0.143	C	C	.	.			trans	-60.9	149.5	-171.6	-174.1	0	0	0	0	113	F27 Y295 T299 I300	F27-S297 WeakPolarHBondContact CD1-OG 3.42Å; Y295-S297 PolarHBondContact O-N 2.79Å; S297-T299 PolarHBondContact O-N 2.92Å; S297-T299 VanDerWaalsContact O-N 3.08Å; S297-T299 PolarHBondContact OG-OG1 3.4Å; S297-I300 WeakPolarHBondContact O-CG1 3.31Å; S297-I300 PolarHBondContact O-N 3.44Å
298	S	78.3	Confident	82.1	Confident	96 Å²	96	26.9 Å²	26.9	67%	0.671	15%	0.149	S	C	*	.	G	3₁₀ helix	trans	-59.1	-23.3	178	59.1	0	0	0	0	113.2	K301	S298-K301 VanDerWaalsContact O-CB 3.28Å; S298-K301 WeakPolarHBondContact O-CB 3.45Å; S298-K301 PolarHBondContact O-N 3.09Å
299	T	79.5	Confident	81.9	Confident	58 Å²	58	26.8 Å²	26.8	36%	0.356	15%	0.149	S	C	.	.	G	3₁₀ helix	trans	-64.8	-37.2	175.2	59.9	0	0	0	0	112.8	K31 S297 K301	K31-T299 WeakPolarHBondContact CD-O 3.34Å; S297-T299 PolarHBondContact O-N 2.92Å; S297-T299 VanDerWaalsContact O-N 3.08Å; S297-T299 PolarHBondContact OG-OG1 3.4Å; T299-K301 VanDerWaalsContact C-N 3.33Å; T299-K301 PolarHBondContact O-N 3.48Å
300	I	83.3	Confident	81.8	Confident	2 Å²	2	25.6 Å²	25.6	1%	0.01	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-87.3	1	-177.5	63.5	163	0	0	0	113.7	K31 F288 D292 S297 N302 N303 Y304	K31-I300 HydrophobicContact CB-CG2 4.39Å; F288-I300 HydrophobicContact CD1-CD1 4.31Å; F288-I300 HydrophobicContact CE1-CD1 4.15Å; D292-I300 HydrophobicContact CB-CD1 4.17Å; D292-I300 VanDerWaalsContact O-CD1 3.24Å; D292-I300 WeakPolarHBondContact O-CD1 3.5Å; S297-I300 WeakPolarHBondContact O-CG1 3.31Å; S297-I300 PolarHBondContact O-N 3.44Å; I300-N302 VanDerWaalsContact C-N 3.26Å; I300-N302 PolarHBondContact O-N 3.26Å; I300-N302 VanDerWaalsContact O-N 3.1Å; I300-N303 WeakPolarHBondContact O-CA 3.5Å; I300-N303 VanDerWaalsContact O-CB 3.31Å; I300-N303 WeakPolarHBondContact O-CB 3.32Å; I300-N303 PolarHBondContact O-N 3.44Å; I300-Y304 PolarHBondContact O-N 3.1Å; I300-Y304 VanDerWaalsContact O-N 3.09Å
301	K	82.8	Confident	81.7	Confident	60 Å²	60	25.3 Å²	25.3	26%	0.261	14%	0.139	S	C	.	.	H	α-helix	trans	-47	-42.8	-178.7	-172.3	171.3	178.5	173.7	0	114.3	L230 S298 T299 Y304 L305	L230-K301 HydrophobicContact CD1-CB 3.98Å; L230-K301 HydrophobicContact CD1-CD 4.35Å; L230-K301 HydrophobicContact CD1-CG 4.07Å; S298-K301 VanDerWaalsContact O-CB 3.28Å; S298-K301 WeakPolarHBondContact O-CB 3.45Å; S298-K301 PolarHBondContact O-N 3.09Å; T299-K301 VanDerWaalsContact C-N 3.33Å; T299-K301 PolarHBondContact O-N 3.48Å; K301-Y304 PolarHBondContact O-N 2.77Å; K301-L305 WeakPolarHBondContact O-CG 3.16Å; K301-L305 PolarHBondContact O-N 3.04Å
302	N	83.4	Confident	81.3	Confident	40 Å²	40	25.4 Å²	25.4	21%	0.214	14%	0.139	C	C	.	.	H	α-helix	trans	-68.9	-38.3	-179.4	-67.2	-21.3	0	0	0	112.3	D142 I300 Y304 V306	D142-N302 PolarHBondContact OD2-ND2 3.25Å; I300-N302 VanDerWaalsContact C-N 3.26Å; I300-N302 PolarHBondContact O-N 3.26Å; I300-N302 VanDerWaalsContact O-N 3.1Å; N302-Y304 VanDerWaalsContact C-N 3.29Å; N302-Y304 PolarHBondContact O-N 3.33Å; N302-V306 WeakPolarHBondContact O-CG2 3.46Å; N302-V306 PolarHBondContact O-N 3.44Å
303	N	86.6	Confident	80.9	Confident	8 Å²	8	29 Å²	29	4%	0.043	15%	0.152	C	C	.	.	H	α-helix	trans	-60.4	-42.8	171.3	-56.1	-63.3	0	0	0	110.4	S35 M145 F288 I300 V306 F307	S35-N303 WeakPolarHBondContact CA-OD1 3.29Å; S35-N303 PolarHBondContact OG-ND2 3.33Å; S35-N303 PolarHBondContact OG-OD1 2.96Å; M145-N303 WeakPolarHBondContact CE-OD1 3.22Å; F288-N303 HydrophobicContact CE1-CB 3.7Å; F288-N303 HydrophobicContact CZ-CB 3.76Å; I300-N303 WeakPolarHBondContact O-CA 3.5Å; I300-N303 VanDerWaalsContact O-CB 3.31Å; I300-N303 WeakPolarHBondContact O-CB 3.32Å; I300-N303 PolarHBondContact O-N 3.44Å; N303-V306 PolarHBondContact O-N 2.84Å; N303-F307 PolarHBondContact O-N 2.85Å
304	Y	83.4	Confident	80.4	Confident	4 Å²	4	31.2 Å²	31.2	2%	0.016	16%	0.16	C	C	.	.	H	α-helix	trans	-69.8	-38.8	-175.8	-161.5	-74.6	0	0	0	112.3	L229 L230 S233 L239 F288 I300 K301 N302 V306 F307 M308	L229-Y304 HydrophobicContact CD1-CD1 4.48Å; L229-Y304 HydrophobicContact CD1-CE1 3.93Å; L229-Y304 HydrophobicContact CD2-CD1 3.56Å; L229-Y304 HydrophobicContact CD2-CE1 3.88Å; L229-Y304 HydrophobicContact CG-CD1 3.78Å; L229-Y304 HydrophobicContact CG-CE1 3.63Å; L230-Y304 HydrophobicContact CD2-CD2 4.25Å; L230-Y304 HydrophobicContact CD2-CG 3.99Å; S233-Y304 WeakPolarHBondContact CB-OH 3.24Å; S233-Y304 PolarHBondContact OG-OH 3.01Å; L239-Y304 WeakPolarHBondContact CD1-OH 3.25Å; F288-Y304 HydrophobicContact CE2-CD2 4.29Å; F288-Y304 HydrophobicContact CZ-CD2 4.18Å; I300-Y304 PolarHBondContact O-N 3.1Å; I300-Y304 VanDerWaalsContact O-N 3.09Å; K301-Y304 PolarHBondContact O-N 2.77Å; N302-Y304 VanDerWaalsContact C-N 3.29Å; N302-Y304 PolarHBondContact O-N 3.33Å; Y304-V306 VanDerWaalsContact C-N 3.28Å; Y304-V306 PolarHBondContact O-N 3.07Å; Y304-F307 PolarHBondContact O-N 3.45Å; Y304-M308 HydrophobicContact CD1-CG 3.98Å; Y304-M308 HydrophobicContact CE1-CG 3.67Å; Y304-M308 HydrophobicContact CE1-SD 3.89Å; Y304-M308 WeakPolarHBondContact O-CG 3.23Å; Y304-M308 PolarHBondContact O-N 2.76Å
305	L	80.6	Confident	79.9	Confident	17 Å²	17	30.2 Å²	30.2	9%	0.089	16%	0.155	C	C	.	.	H	α-helix	trans	-59.1	-40.7	171.4	-73.1	171.4	0	0	0	112	V189 V190 L229 K301 M308 A309	V189-L305 HydrophobicContact CG1-CD1 3.95Å; V189-L305 HydrophobicContact CG1-CD2 3.72Å; V189-L305 HydrophobicContact CG1-CG 4.37Å; V190-L305 HydrophobicContact CG2-CD2 4.32Å; L229-L305 HydrophobicContact CD2-CD2 3.86Å; K301-L305 WeakPolarHBondContact O-CG 3.16Å; K301-L305 PolarHBondContact O-N 3.04Å; L305-M308 PolarHBondContact O-N 3.25Å; L305-A309 PolarHBondContact O-N 3.47Å
306	V	83.3	Confident	79.2	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-67.3	-45	176.2	173	0	0	0	0	111.7	W38 M145 Y148 T149 N302 N303 Y304 M308 A309 E310	W38-V306 HydrophobicContact CZ2-CG1 3.92Å; M145-V306 HydrophobicContact CB-CG2 3.57Å; M145-V306 HydrophobicContact CG-CG2 3.87Å; M145-V306 WeakPolarHBondContact O-CG2 3.41Å; M145-V306 HydrophobicContact SD-CG2 4.46Å; Y148-V306 HydrophobicContact CD1-CG1 3.66Å; Y148-V306 HydrophobicContact CE1-CG1 3.83Å; T149-V306 VanDerWaalsContact OG1-CG2 3.31Å; T149-V306 WeakPolarHBondContact OG1-CG2 3.43Å; N302-V306 WeakPolarHBondContact O-CG2 3.46Å; N302-V306 PolarHBondContact O-N 3.44Å; N303-V306 PolarHBondContact O-N 2.84Å; Y304-V306 VanDerWaalsContact C-N 3.28Å; Y304-V306 PolarHBondContact O-N 3.07Å; V306-M308 VanDerWaalsContact C-N 3.27Å; V306-M308 PolarHBondContact O-N 3.06Å; V306-A309 CarbonylContact O-C 3.59Å; V306-A309 WeakPolarHBondContact O-CA 3.49Å; V306-A309 WeakPolarHBondContact O-CB 3.39Å; V306-A309 PolarHBondContact O-N 3.49Å; V306-E310 HydrophobicContact CG1-CG 4.23Å; V306-E310 WeakPolarHBondContact CG1-OE1 3.36Å; V306-E310 WeakPolarHBondContact O-CG 3.36Å; V306-E310 PolarHBondContact O-N 3.06Å
307	F	83.6	Confident	78.5	Confident	5 Å²	5	32.8 Å²	32.8	2%	0.022	17%	0.171	C	C	.	.	H	α-helix	trans	-53.8	-43.9	174.6	172.8	-114.2	0	0	0	112.1	L239 C285 C286 F288 N303 Y304 A309 E310 L311	L239-F307 HydrophobicContact CD1-CE1 4.15Å; L239-F307 HydrophobicContact CD2-CE1 4.37Å; C285-F307 WeakPolarHBondContact O-CD2 3.38Å; C286-F307 HydrophobicContact CB-CE2 3.84Å; C286-F307 HydrophobicContact CB-CZ 4.43Å; F288-F307 HydrophobicContact CE2-CB 3.79Å; F288-F307 HydrophobicContact CE2-CD1 4.2Å; F288-F307 AromaticContact CE2-CG 3.93Å; F288-F307 HydrophobicContact CE2-CG 3.93Å; F288-F307 HydrophobicContact CZ-CB 4.38Å; N303-F307 PolarHBondContact O-N 2.85Å; Y304-F307 PolarHBondContact O-N 3.45Å; F307-A309 VanDerWaalsContact C-N 3.34Å; F307-A309 PolarHBondContact O-N 3.17Å; F307-E310 PolarHBondContact O-N 3.24Å; F307-E310 VanDerWaalsContact O-N 3.16Å; F307-L311 HydrophobicContact CD1-CD1 4.35Å; F307-L311 HydrophobicContact CE1-CD1 3.81Å; F307-L311 HydrophobicContact CE1-CG 4.46Å; F307-L311 HydrophobicContact CE2-CD1 4.39Å; F307-L311 HydrophobicContact CE2-CD2 4.2Å; F307-L311 HydrophobicContact CE2-CG 4.23Å; F307-L311 HydrophobicContact CZ-CD1 3.84Å; F307-L311 HydrophobicContact CZ-CD2 4.24Å; F307-L311 HydrophobicContact CZ-CG 4.18Å; F307-L311 WeakPolarHBondContact O-CG 3.42Å; F307-L311 PolarHBondContact O-N 3.36Å
308	M	80.5	Confident	78	Confident	50 Å²	50	34.8 Å²	34.8	25%	0.246	18%	0.182	C	C	.	.	H	α-helix	trans	-64.1	-36.1	174.2	-66.1	-60.3	-61.3	0	0	113.1	L229 L239 L242 Y304 L305 V306 E310 L311 F312	L229-M308 HydrophobicContact CD1-CE 4.44Å; L229-M308 HydrophobicContact CD1-CG 4.18Å; L229-M308 HydrophobicContact CD1-SD 4.46Å; L229-M308 HydrophobicContact CD2-CG 4.29Å; L239-M308 HydrophobicContact CD2-SD 3.9Å; L242-M308 HydrophobicContact CD2-CE 3.94Å; Y304-M308 HydrophobicContact CD1-CG 3.98Å; Y304-M308 HydrophobicContact CE1-CG 3.67Å; Y304-M308 HydrophobicContact CE1-SD 3.89Å; Y304-M308 WeakPolarHBondContact O-CG 3.23Å; Y304-M308 PolarHBondContact O-N 2.76Å; L305-M308 PolarHBondContact O-N 3.25Å; V306-M308 VanDerWaalsContact C-N 3.27Å; V306-M308 PolarHBondContact O-N 3.06Å; M308-E310 VanDerWaalsContact C-N 3.34Å; M308-L311 HydrophobicContact SD-CD1 4.22Å; M308-F312 WeakPolarHBondContact O-CB 3.34Å; M308-F312 PolarHBondContact O-N 3.06Å; M308-F312 VanDerWaalsContact O-N 3.08Å
309	A	78.6	Confident	77.5	Confident	6 Å²	6	34.5 Å²	34.5	5%	0.05	17%	0.169	C	C	.	.	H	α-helix	trans	-68.5	-31.7	173.2	0	0	0	0	0	112.5	T149 T152 L305 V306 F307 F312 W313	T149-A309 HydrophobicContact CG2-CB 4.37Å; T152-A309 HydrophobicContact CG2-CB 4.13Å; T152-A309 WeakPolarHBondContact CG2-O 3.41Å; L305-A309 PolarHBondContact O-N 3.47Å; V306-A309 CarbonylContact O-C 3.59Å; V306-A309 WeakPolarHBondContact O-CA 3.49Å; V306-A309 WeakPolarHBondContact O-CB 3.39Å; V306-A309 PolarHBondContact O-N 3.49Å; F307-A309 VanDerWaalsContact C-N 3.34Å; F307-A309 PolarHBondContact O-N 3.17Å; A309-F312 PolarHBondContact O-N 2.96Å; A309-W313 WeakPolarHBondContact O-CB 3.3Å; A309-W313 PolarHBondContact O-N 3.06Å
310	E	79.1	Confident	77.1	Confident	5 Å²	5	32.9 Å²	32.9	2%	0.023	16%	0.159	C	C	.	.	H	α-helix	trans	-72.4	-43.1	175.7	-68.2	-173.3	-157.6	0	0	112.3	W38 K42 Y148 C285 V306 F307 M308 F312 W313 W314	W38-E310 PolarHBondContact NE1-OE1 2.86Å; K42-E310 WeakPolarHBondContact CE-OE1 3.45Å; K42-E310 IonicContact NZ-OE1 2.83Å; K42-E310 PolarHBondContact NZ-OE1 3.43Å; K42-E310 IonicContact NZ-OE2 3.37Å; K42-E310 PolarHBondContact NZ-OE2 3.45Å; Y148-E310 HydrophobicContact CE1-CG 3.68Å; C285-E310 HydrophobicContact CB-CB 4.35Å; V306-E310 HydrophobicContact CG1-CG 4.23Å; V306-E310 WeakPolarHBondContact CG1-OE1 3.36Å; V306-E310 WeakPolarHBondContact O-CG 3.36Å; V306-E310 PolarHBondContact O-N 3.06Å; F307-E310 PolarHBondContact O-N 3.24Å; F307-E310 VanDerWaalsContact O-N 3.16Å; M308-E310 VanDerWaalsContact C-N 3.34Å; E310-F312 VanDerWaalsContact C-N 3.29Å; E310-F312 PolarHBondContact O-N 3.37Å; E310-W313 PolarHBondContact O-N 3.41Å; E310-W314 PolarHBondContact O-N 2.9Å
311	L	77.1	Confident	75.6	Confident	4 Å²	4	38.1 Å²	38.1	2%	0.021	20%	0.196	C	C	.	.	H	α-helix	trans	-56.3	-45.7	169.7	-67	-178.8	0	0	0	110.6	L239 L243 L282 F307 M308 W314 F315	L239-L311 HydrophobicContact CD2-CD1 4.35Å; L243-L311 HydrophobicContact CD2-CD2 4.46Å; L282-L311 HydrophobicContact CD1-CD2 3.59Å; F307-L311 HydrophobicContact CD1-CD1 4.35Å; F307-L311 HydrophobicContact CE1-CD1 3.81Å; F307-L311 HydrophobicContact CE1-CG 4.46Å; F307-L311 HydrophobicContact CE2-CD1 4.39Å; F307-L311 HydrophobicContact CE2-CD2 4.2Å; F307-L311 HydrophobicContact CE2-CG 4.23Å; F307-L311 HydrophobicContact CZ-CD1 3.84Å; F307-L311 HydrophobicContact CZ-CD2 4.24Å; F307-L311 HydrophobicContact CZ-CG 4.18Å; F307-L311 WeakPolarHBondContact O-CG 3.42Å; F307-L311 PolarHBondContact O-N 3.36Å; M308-L311 HydrophobicContact SD-CD1 4.22Å; L311-W314 PolarHBondContact O-N 2.83Å; L311-F315 HydrophobicContact CB-CD2 4.26Å; L311-F315 HydrophobicContact CB-CE2 3.94Å; L311-F315 HydrophobicContact CD2-CE2 4.13Å; L311-F315 HydrophobicContact CD2-CZ 4.19Å; L311-F315 WeakPolarHBondContact O-CB 3.32Å; L311-F315 WeakPolarHBondContact O-CD2 3.36Å; L311-F315 VanDerWaalsContact O-CG 3.23Å; L311-F315 WeakPolarHBondContact O-CG 3.46Å; L311-F315 PolarHBondContact O-N 3.21Å
312	F	74.8	Confident	74.9	Confident	48 Å²	48	37.7 Å²	37.7	21%	0.211	19%	0.194	C	C	.	.	H	α-helix	trans	-61.8	-43.6	174.9	176.9	-99.4	0	0	0	112.7	I177 M308 A309 E310 W314 F315 E316	I177-F312 HydrophobicContact CG2-CE2 4.48Å; M308-F312 WeakPolarHBondContact O-CB 3.34Å; M308-F312 PolarHBondContact O-N 3.06Å; M308-F312 VanDerWaalsContact O-N 3.08Å; A309-F312 PolarHBondContact O-N 2.96Å; E310-F312 VanDerWaalsContact C-N 3.29Å; E310-F312 PolarHBondContact O-N 3.37Å; F312-W314 PolarHBondContact O-N 3.34Å; F312-F315 PolarHBondContact O-N 2.99Å; F312-E316 HydrophobicContact CD2-CB 4.15Å; F312-E316 HydrophobicContact CD2-CG 4.09Å; F312-E316 HydrophobicContact CE2-CB 3.85Å; F312-E316 HydrophobicContact CE2-CG 3.82Å; F312-E316 HydrophobicContact CZ-CB 4.13Å; F312-E316 WeakPolarHBondContact O-CB 3.24Å; F312-E316 PolarHBondContact O-N 2.89Å
313	W	75.6	Confident	73.9	Confident	82 Å²	82	36.4 Å²	36.4	31%	0.311	19%	0.188	S	C	.	.	I	π-helix	trans	-59.3	-47.1	176.5	178.9	-96.9	0	0	0	111.8	T152 A309 E310 V317 V318	T152-W313 HydrophobicContact CG2-CB 3.88Å; T152-W313 HydrophobicContact CG2-CE3 3.99Å; A309-W313 WeakPolarHBondContact O-CB 3.3Å; A309-W313 PolarHBondContact O-N 3.06Å; E310-W313 PolarHBondContact O-N 3.41Å; W313-V317 HydrophobicContact CD2-CB 4.02Å; W313-V317 HydrophobicContact CD2-CG1 4.27Å; W313-V317 HydrophobicContact CD2-CG2 4.38Å; W313-V317 HydrophobicContact CE3-CB 3.79Å; W313-V317 HydrophobicContact CE3-CG1 3.84Å; W313-V317 HydrophobicContact CE3-CG2 3.77Å; W313-V317 HydrophobicContact CH2-CG1 3.85Å; W313-V317 HydrophobicContact CZ2-CG1 4.25Å; W313-V317 HydrophobicContact CZ3-CB 4.14Å; W313-V317 HydrophobicContact CZ3-CG1 3.65Å; W313-V317 HydrophobicContact CZ3-CG2 4.21Å; W313-V317 CarbonylContact O-C 3.6Å; W313-V317 WeakPolarHBondContact O-CA 3.31Å; W313-V317 WeakPolarHBondContact O-CB 3.5Å; W313-V317 PolarHBondContact O-N 3.19Å; W313-V318 HydrophobicContact CG-CG2 4.41Å; W313-V318 VanDerWaalsContact NE1-CG2 3.32Å; W313-V318 PolarHBondContact O-N 2.92Å
314	W	74.1	Confident	72.5	Confident	50 Å²	50	41.1 Å²	41.1	19%	0.189	21%	0.208	C	C	.	.	I	π-helix	trans	-64.3	-48.2	177	-77.4	114.5	0	0	0	112.4	L282 N283 E310 L311 F312 V318 K319 P320	L282-W314 HydrophobicContact CD2-CB 3.78Å; L282-W314 HydrophobicContact CD2-CD2 4.15Å; L282-W314 HydrophobicContact CD2-CG 3.76Å; N283-W314 HydrophobicContact CB-CZ2 3.92Å; E310-W314 PolarHBondContact O-N 2.9Å; L311-W314 PolarHBondContact O-N 2.83Å; F312-W314 PolarHBondContact O-N 3.34Å; W314-V318 HydrophobicContact CE3-CB 3.91Å; W314-V318 HydrophobicContact CE3-CG1 3.84Å; W314-V318 HydrophobicContact CE3-CG2 4.05Å; W314-V318 HydrophobicContact CZ3-CB 4.34Å; W314-V318 HydrophobicContact CZ3-CG1 3.79Å; W314-V318 HydrophobicContact CZ3-CG2 4.39Å; W314-K319 PolarHBondContact O-N 3.44Å; W314-P320 HydrophobicContact CE3-CG 3.84Å; W314-P320 HydrophobicContact CZ3-CG 4.21Å; W314-P320 VanDerWaalsContact O-CD 3.25Å; W314-P320 WeakPolarHBondContact O-CD 3.32Å
315	F	71.9	Confident	71.2	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.009	22%	0.22	C	C	.	.	I	π-helix	trans	-77.3	-31.8	-173.9	-60	-34.5	0	0	0	114.6	L243 Y246 F277 L282 L311 F312 K319 V323	L243-F315 HydrophobicContact CD2-CE2 3.95Å; L243-F315 HydrophobicContact CD2-CZ 3.53Å; Y246-F315 HydrophobicContact CD1-CB 3.69Å; Y246-F315 HydrophobicContact CD1-CD2 4.41Å; Y246-F315 HydrophobicContact CD1-CG 4.04Å; Y246-F315 HydrophobicContact CD2-CB 4.31Å; Y246-F315 AromaticContact CD2-CD2 3.53Å; Y246-F315 HydrophobicContact CD2-CD2 3.53Å; Y246-F315 HydrophobicContact CD2-CE2 4.03Å; Y246-F315 AromaticContact CD2-CG 3.98Å; Y246-F315 HydrophobicContact CD2-CG 3.98Å; Y246-F315 HydrophobicContact CE1-CB 3.85Å; Y246-F315 HydrophobicContact CE2-CB 4.44Å; Y246-F315 AromaticContact CE2-CD2 3.95Å; Y246-F315 HydrophobicContact CE2-CD2 3.95Å; Y246-F315 HydrophobicContact CE2-CG 4.47Å; Y246-F315 HydrophobicContact CG-CB 3.94Å; Y246-F315 HydrophobicContact CG-CD1 4.28Å; Y246-F315 AromaticContact CG-CD2 3.8Å; Y246-F315 HydrophobicContact CG-CD2 3.8Å; Y246-F315 HydrophobicContact CG-CE2 4.4Å; Y246-F315 AromaticContact CG-CG 3.75Å; Y246-F315 HydrophobicContact CG-CG 3.75Å; F277-F315 HydrophobicContact CE1-CZ 4.38Å; L282-F315 HydrophobicContact CD1-CE1 4.27Å; L282-F315 HydrophobicContact CD1-CZ 4.08Å; L282-F315 HydrophobicContact CD2-CE1 4.25Å; L311-F315 HydrophobicContact CB-CD2 4.26Å; L311-F315 HydrophobicContact CB-CE2 3.94Å; L311-F315 HydrophobicContact CD2-CE2 4.13Å; L311-F315 HydrophobicContact CD2-CZ 4.19Å; L311-F315 WeakPolarHBondContact O-CB 3.32Å; L311-F315 WeakPolarHBondContact O-CD2 3.36Å; L311-F315 VanDerWaalsContact O-CG 3.23Å; L311-F315 WeakPolarHBondContact O-CG 3.46Å; L311-F315 PolarHBondContact O-N 3.21Å; F312-F315 PolarHBondContact O-N 2.99Å; F315-K319 WeakPolarHBondContact O-CG 3.4Å; F315-V323 HydrophobicContact CB-CG1 4.27Å; F315-V323 HydrophobicContact CD1-CG1 4.09Å; F315-V323 HydrophobicContact CD1-CG2 3.8Å; F315-V323 HydrophobicContact CE1-CG2 4.36Å
316	E	69.7	Low	69.7	Low	62 Å²	62	49.3 Å²	49.3	29%	0.29	24%	0.243	S	C	.	.	I	π-helix	trans	-110.5	-28.9	-176.1	-75.9	-65	157.8	0	0	114.6	F312 K319	F312-E316 HydrophobicContact CD2-CB 4.15Å; F312-E316 HydrophobicContact CD2-CG 4.09Å; F312-E316 HydrophobicContact CE2-CB 3.85Å; F312-E316 HydrophobicContact CE2-CG 3.82Å; F312-E316 HydrophobicContact CZ-CB 4.13Å; F312-E316 WeakPolarHBondContact O-CB 3.24Å; F312-E316 PolarHBondContact O-N 2.89Å; E316-K319 PolarHBondContact O-NZ 3.39Å; E316-K319 IonicContact OE2-NZ 3.57Å; E316-K319 PolarHBondContact OE2-NZ 3.47Å
317	V	64.5	Low	67.3	Low	65 Å²	65	54.5 Å²	54.5	39%	0.394	27%	0.269	S	S	.	.	I	π-helix	trans	-101	-46.8	-177	-170.3	0	0	0	0	112.7	W313	W313-V317 HydrophobicContact CD2-CB 4.02Å; W313-V317 HydrophobicContact CD2-CG1 4.27Å; W313-V317 HydrophobicContact CD2-CG2 4.38Å; W313-V317 HydrophobicContact CE3-CB 3.79Å; W313-V317 HydrophobicContact CE3-CG1 3.84Å; W313-V317 HydrophobicContact CE3-CG2 3.77Å; W313-V317 HydrophobicContact CH2-CG1 3.85Å; W313-V317 HydrophobicContact CZ2-CG1 4.25Å; W313-V317 HydrophobicContact CZ3-CB 4.14Å; W313-V317 HydrophobicContact CZ3-CG1 3.65Å; W313-V317 HydrophobicContact CZ3-CG2 4.21Å; W313-V317 CarbonylContact O-C 3.6Å; W313-V317 WeakPolarHBondContact O-CA 3.31Å; W313-V317 WeakPolarHBondContact O-CB 3.5Å; W313-V317 PolarHBondContact O-N 3.19Å
318	V	67.4	Low	64.9	Low	67 Å²	67	59.7 Å²	59.7	41%	0.406	30%	0.296	S	S	.	.	I	π-helix	trans	-80.8	-41.7	179.6	-175.5	0	0	0	0	111.7	W313 W314 P320	W313-V318 HydrophobicContact CG-CG2 4.41Å; W313-V318 VanDerWaalsContact NE1-CG2 3.32Å; W313-V318 PolarHBondContact O-N 2.92Å; W314-V318 HydrophobicContact CE3-CB 3.91Å; W314-V318 HydrophobicContact CE3-CG1 3.84Å; W314-V318 HydrophobicContact CE3-CG2 4.05Å; W314-V318 HydrophobicContact CZ3-CB 4.34Å; W314-V318 HydrophobicContact CZ3-CG1 3.79Å; W314-V318 HydrophobicContact CZ3-CG2 4.39Å; V318-P320 HydrophobicContact CG1-CG 4.24Å
319	K	68.4	Low	62.4	Low	90 Å²	90	63.7 Å²	63.7	39%	0.391	32%	0.318	S	S	.	.			trans	45.2	64.8	-176.4	-74.1	-173.2	169.6	98.7	0	114.3	W314 F315 E316	W314-K319 PolarHBondContact O-N 3.44Å; F315-K319 WeakPolarHBondContact O-CG 3.4Å; E316-K319 PolarHBondContact O-NZ 3.39Å; E316-K319 IonicContact OE2-NZ 3.57Å; E316-K319 PolarHBondContact OE2-NZ 3.47Å
320	P	70	Confident	60.1	Low	23 Å²	23	70 Å²	70	15%	0.149	35%	0.352	C	S	.	.			trans	-50.4	152.1	166.4	-25.1	33.9	0	0	0	112.5	W314 V318 F322 V323	W314-P320 HydrophobicContact CE3-CG 3.84Å; W314-P320 HydrophobicContact CZ3-CG 4.21Å; W314-P320 VanDerWaalsContact O-CD 3.25Å; W314-P320 WeakPolarHBondContact O-CD 3.32Å; V318-P320 HydrophobicContact CG1-CG 4.24Å; P320-F322 HydrophobicContact CB-CD1 3.71Å; P320-F322 HydrophobicContact CB-CD2 4.45Å; P320-F322 HydrophobicContact CB-CE1 3.32Å; P320-F322 HydrophobicContact CB-CE2 4.12Å; P320-F322 HydrophobicContact CB-CG 4.27Å; P320-F322 HydrophobicContact CB-CZ 3.54Å; P320-F322 HydrophobicContact CG-CE1 3.99Å; P320-F322 HydrophobicContact CG-CE2 4.41Å; P320-F322 HydrophobicContact CG-CZ 3.78Å; P320-F322 PolarHBondContact O-N 3.48Å; P320-V323 HydrophobicContact CB-CG2 4.27Å; P320-V323 HydrophobicContact CG-CG2 4.31Å; P320-V323 WeakPolarHBondContact O-CB 3.45Å; P320-V323 PolarHBondContact O-N 3.2Å
321	S	52.4	Low	57.8	Low	113 Å²	113	79.4 Å²	79.4	79%	0.79	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-14.7	-173.4	53.2	0	0	0	0	115.6	K324	S321-K324 VanDerWaalsContact O-CE 3.3Å; S321-K324 WeakPolarHBondContact O-CE 3.24Å
322	F	67.2	Low	55.6	Low	50 Å²	50	82.5 Å²	82.5	22%	0.219	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-21.1	171.5	59.9	-105.7	0	0	0	113.6	L250 N281 L282 P320 K324	L250-F322 HydrophobicContact CD1-CB 3.66Å; L250-F322 HydrophobicContact CD1-CD1 4.48Å; L250-F322 HydrophobicContact CD1-CD2 3.64Å; L250-F322 HydrophobicContact CD1-CE2 4.4Å; L250-F322 HydrophobicContact CD1-CG 3.7Å; L250-F322 HydrophobicContact CG-CB 4.49Å; N281-F322 HydrophobicContact CB-CE1 4.44Å; N281-F322 HydrophobicContact CB-CE2 4.37Å; N281-F322 HydrophobicContact CB-CZ 4.03Å; N281-F322 VanDerWaalsContact O-CZ 3.29Å; N281-F322 WeakPolarHBondContact O-CZ 3.49Å; L282-F322 HydrophobicContact CD2-CE2 4.28Å; L282-F322 HydrophobicContact CD2-CZ 4.05Å; P320-F322 HydrophobicContact CB-CD1 3.71Å; P320-F322 HydrophobicContact CB-CD2 4.45Å; P320-F322 HydrophobicContact CB-CE1 3.32Å; P320-F322 HydrophobicContact CB-CE2 4.12Å; P320-F322 HydrophobicContact CB-CG 4.27Å; P320-F322 HydrophobicContact CB-CZ 3.54Å; P320-F322 HydrophobicContact CG-CE1 3.99Å; P320-F322 HydrophobicContact CG-CE2 4.41Å; P320-F322 HydrophobicContact CG-CZ 3.78Å; P320-F322 PolarHBondContact O-N 3.48Å; F322-K324 PolarHBondContact O-N 2.8Å
323	V	63.6	Low	53.3	Low	14 Å²	14	86.7 Å²	86.7	9%	0.085	46%	0.458	C	S	.	.			trans	-77.3	104.7	178.2	-175.7	0	0	0	0	108.9	Y246 F315 P320	Y246-V323 HydrophobicContact CD1-CG1 4.11Å; Y246-V323 CarbonylContact O-C 3.59Å; Y246-V323 WeakPolarHBondContact O-CA 3.34Å; F315-V323 HydrophobicContact CB-CG1 4.27Å; F315-V323 HydrophobicContact CD1-CG1 4.09Å; F315-V323 HydrophobicContact CD1-CG2 3.8Å; F315-V323 HydrophobicContact CE1-CG2 4.36Å; P320-V323 HydrophobicContact CB-CG2 4.27Å; P320-V323 HydrophobicContact CG-CG2 4.31Å; P320-V323 WeakPolarHBondContact O-CB 3.45Å; P320-V323 PolarHBondContact O-N 3.2Å
324	K	57.2	Low	51.1	Low	106 Å²	106	90.9 Å²	90.9	46%	0.461	48%	0.481	S	S	.	.			trans	-130.4	87.4	178.7	-66.9	174.5	-167.1	158.8	0	107.9	Y246 Q249 S321 F322 R326	Y246-K324 CarbonylContact O-C 3.56Å; Y246-K324 PolarHBondContact O-N 3.21Å; Q249-K324 VanDerWaalsContact OE1-NZ 3.11Å; S321-K324 VanDerWaalsContact O-CE 3.3Å; S321-K324 WeakPolarHBondContact O-CE 3.24Å; F322-K324 PolarHBondContact O-N 2.8Å; K324-R326 PolarHBondContact O-N 3.16Å
325	P	56.1	Low	49.8	Very low	40 Å²	40	93.3 Å²	93.3	26%	0.26	50%	0.503	S	S	.	.			trans	-52	130.8	174.6	-22	31.7	0	0	0	109.3	F245 Y246 M327	F245-P325 HydrophobicContact CZ-CB 4.28Å; Y246-P325 HydrophobicContact CD1-CB 4.49Å; Y246-P325 HydrophobicContact CD1-CG 4.03Å; Y246-P325 HydrophobicContact CE1-CG 4.31Å; P325-M327 VanDerWaalsContact C-N 3.27Å; P325-M327 PolarHBondContact O-N 3.28Å
326	R	48.3	Very low	47.6	Very low	154 Å²	154	98.5 Å²	98.5	58%	0.581	54%	0.54	S	S	*	.			trans	-71.3	79.8	-170.3	-159	170.6	-175.3	172.7	-1.6	111.6	H244 F245 K324 L328	H244-R326 PolarHBondContact NE2-NH1 2.95Å; F245-R326 HydrophobicContact CD2-CB 4.36Å; F245-R326 HydrophobicContact CE2-CB 4.5Å; F245-R326 PolarHBondContact O-N 2.6Å; K324-R326 PolarHBondContact O-N 3.16Å; R326-L328 PolarHBondContact O-N 2.85Å
327	M	33.9	Very low	45.5	Very low	108 Å²	108	101.4 Å²	101.4	53%	0.532	57%	0.567	S	S	.	*			trans	-64.9	126.3	178.5	-70.3	-65.5	-68.8	0	0	110.4	K168 P325 D329	K168-M327 HydrophobicContact CD-CE 4.41Å; P325-M327 VanDerWaalsContact C-N 3.27Å; P325-M327 PolarHBondContact O-N 3.28Å; M327-D329 PolarHBondContact O-N 2.66Å; M327-D329 VanDerWaalsContact O-N 3.12Å
328	L	32.6	Very low	43.6	Very low	115 Å²	115	106.4 Å²	106.4	60%	0.602	59%	0.589	S	S	*	*			trans	-79.9	89	175.9	-170	84.4	0	0	0	109.7	R326	R326-L328 PolarHBondContact O-N 2.85Å
329	D	27.4	Very low	41.8	Very low	133 Å²	133	110.5 Å²	110.5	71%	0.711	61%	0.608	S	S	*	*			trans	-74	133.4	164.7	-72.3	-40.8	0	0	0	109.5	M327	M327-D329 PolarHBondContact O-N 2.66Å; M327-D329 VanDerWaalsContact O-N 3.12Å
330	N	31.9	Very low	39.8	Very low	140 Å²	140	114.9 Å²	114.9	75%	0.749	63%	0.627	S	S	*	*			trans	-132.1	87.6	-168	179.2	103.7	0	0	0	110.1
331	E	29.3	Very low	37.5	Very low	201 Å²	201	118.9 Å²	118.9	94%	0.939	66%	0.656	S	S	*	*			trans	-156.5	157.6	147.5	-79.6	-141.8	122.8	0	0	108
332	G	31.7	Very low	36.1	Very low	69 Å²	69	121.2 Å²	121.2	71%	0.711	66%	0.656	S	S	*	*			trans	-137.2	124.9	177.1	0	0	0	0	0	111.5
333	T	27.1	Very low	34.9	Very low	136 Å²	136	123.6 Å²	123.6	83%	0.834	68%	0.677	S	S	*	*			trans	-159.5	88.4	161.3	-67.1	0	0	0	0	109.1
334	E	29.1	Very low	32.9	Very low	171 Å²	171	131.5 Å²	131.5	80%	0.799	71%	0.71	S	S	*	*			trans	59.8	159.5	146.5	-65.9	-48.1	94.6	0	0	121.5
335	P	45.8	Very low	31.8	Very low	101 Å²	101	133.8 Å²	133.8	66%	0.656	73%	0.726	S	S	*	*			trans	-130.5	-168.5	-138.7	44.3	-29.8	0	0	0	115.2
336	S	25.3	Very low	30.5	Very low	110 Å²	110	136.1 Å²	136.1	77%	0.769	74%	0.741	S	S	*	*			trans	113.2	105.2	154.6	-50.4	0	0	0	0	116.3
337	S	25.4	Very low	29.3	Very low	123 Å²	123	135.8 Å²	135.8	86%	0.86	75%	0.749	S	S	*	*			trans	-178.4	85	132.8	39.6	0	0	0	0	112
338	I	26.4	Very low	29.6	Very low	170 Å²	170	136 Å²	136	87%	0.872	76%	0.762	S	S	*	*			trans	-118.4	100.5	161.8	-60.8	178	0	0	0	108.1
339	L	27.9	Very low	29.2	Very low	153 Å²	153	139.9 Å²	139.9	80%	0.801	77%	0.773	S	S	*	*			trans	-158.3	134.6	155.8	-90.5	-164	0	0	0	111.3
340	K	28.1	Very low	29.1	Very low	183 Å²	183	137.8 Å²	137.8	80%	0.796	78%	0.775	S	S	*	*			trans	81.2	106.9	157	-64.1	171.1	-179.1	179.6	0	120.3
341	S	21.8	Very low	28.7	Very low	106 Å²	106	136.8 Å²	136.8	74%	0.741	77%	0.774	S	S	*	*				57.6	114.2	129.8	63.5	0	0	0	0	121.8
342	M	22.8	Very low	28.6	Very low	162 Å²	162	135.2 Å²	135.2	80%	0.798	76%	0.764	S	S	*	*			trans	-70.7	177	146.4	-75.4	-69.8	178.7	0	0	111.7
343	P	41.5	Very low	28.4	Very low	101 Å²	101	142.8 Å²	142.8	66%	0.656	77%	0.771	S	S	*	*			cis	-129.8	171.5	-22.1	30.8	-12.8	0	0	0	113.4
344	F	21.7	Very low	28.3	Very low	180 Å²	180	140.5 Å²	140.5	79%	0.789	76%	0.76	S	S	*	*				-173	148.2	116.9	-153.3	-116.4	0	0	0	111.6	P346	F344-P346 HydrophobicContact CD1-CG 4.1Å; F344-P346 HydrophobicContact CE1-CB 4.44Å; F344-P346 HydrophobicContact CE1-CG 4.11Å
345	I	33	Very low	28.2	Very low	153 Å²	153	141.2 Å²	141.2	79%	0.785	76%	0.761	S	S	*	*			trans	-123	133.7	170.3	-62.1	165.9	0	0	0	107.6
346	P	30	Very low	27.4	Very low	90 Å²	90	144.2 Å²	144.2	58%	0.584	77%	0.769	S	S	*	*			trans	-140.2	131.5	141	30.6	-13.3	0	0	0	115	F344	F344-P346 HydrophobicContact CD1-CG 4.1Å; F344-P346 HydrophobicContact CE1-CB 4.44Å; F344-P346 HydrophobicContact CE1-CG 4.11Å
347	I	22	Very low	27.3	Very low	147 Å²	147	145.5 Å²	145.5	75%	0.754	76%	0.763	S	S	*	*			trans	67.1	102.6	138.7	-56.1	169.8	0	0	0	117.2
348	S	40.2	Very low	27.4	Very low	113 Å²	113	149.8 Å²	149.8	79%	0.79	76%	0.76	S	S	*	*			trans	-69.6	151.9	157.5	50.3	0	0	0	0	112.3
349	K	25.7	Very low	28.6	Very low	195 Å²	195	147.2 Å²	147.2	85%	0.848	75%	0.754	S	S	*	*			trans	-158.9	129.4	156.1	-120.4	166.4	-173.2	173.5	0	113.3
350	A	24	Very low	29	Very low	89 Å²	89	145.1 Å²	145.1	74%	0.736	75%	0.75	S	S	*	*			trans	38.9	131	155.6	0	0	0	0	0	119.1
351	T	24.5	Very low	28.8	Very low	120 Å²	120	141.9 Å²	141.9	74%	0.736	75%	0.75	S	S	*	*				-170.2	141.1	70.3	-73.9	0	0	0	0	113.3
352	K	25.6	Very low	30.1	Very low	168 Å²	168	142.6 Å²	142.6	73%	0.73	75%	0.752	S	S	*	*			trans	11.8	144.4	153.3	-57.8	170.2	-179.9	170.1	0	120.7
353	R	28	Very low	30.2	Very low	228 Å²	228	144.3 Å²	144.3	86%	0.86	76%	0.758	S	S	*	*			trans	71.3	143.6	152.4	-69.7	161.3	179	177.5	-3.8	115.3
354	S	24.6	Very low	29.4	Very low	87 Å²	87	150.3 Å²	150.3	61%	0.608	77%	0.768	S	S	*	*			cis	-179.2	163.3	-5.4	43.6	0	0	0	0	109.8
355	F	28.8	Very low	30.5	Very low	187 Å²	187	147 Å²	147	82%	0.82	77%	0.765	S	S	*	*			trans	67	129.3	174.1	-60	-93.7	0	0	0	116.1
356	M	27.6	Very low	30.1	Very low	164 Å²	164	145.6 Å²	145.6	81%	0.808	77%	0.768	S	S	*	*			cis	-144.8	159.8	-13.7	-84.1	-136.8	72.5	0	0	110.5
357	E	24.2	Very low	29.9	Very low	137 Å²	137	149.4 Å²	149.4	64%	0.64	78%	0.783	S	S	*	*			trans	-123.5	127	171.3	-174.7	-171.8	161.8	0	0	110.9
358	R	27	Very low	30.7	Very low	212 Å²	212	147.5 Å²	147.5	80%	0.8	78%	0.78	S	S	*	*			trans	59.7	-146.4	165.6	-62.9	167.6	167.9	144.7	-10.8	114.9
359	P	51.9	Low	29.9	Very low	117 Å²	117	148.9 Å²	148.9	76%	0.76	78%	0.778	S	S	*	*				-124.8	-161.2	-114.3	44.5	-26.4	0	0	0	112.9
360	P	35.7	Very low	30.1	Very low	108 Å²	108	149.3 Å²	149.3	70%	0.701	77%	0.774	S	S	*	*			cis	-138.6	180	-2.9	43.4	-26.5	0	0	0	117.3
361	S	24.2	Very low	30.9	Very low	115 Å²	115	150.6 Å²	150.6	80%	0.804	78%	0.775	S	S	*	*			trans	79.4	172.6	147.3	87.4	0	0	0	0	119.4
362	P	50.1	Low	31.1	Very low	121 Å²	121	151.5 Å²	151.5	79%	0.786	77%	0.771	S	S	*	*			trans	-123	161.4	-153.2	43.6	-34	0	0	0	117.9
363	E	23.6	Very low	31.9	Very low	199 Å²	199	148.1 Å²	148.1	93%	0.93	77%	0.766	S	S	*	*			trans	-154.5	177.2	154.2	-136.6	163.7	-146.2	0	0	114.6
364	R	24.7	Very low	31.8	Very low	226 Å²	226	147.7 Å²	147.7	85%	0.853	76%	0.764	S	S	*	*			trans	-120.7	-178.3	-177.5	-103.1	-171.5	174	-175	-0.3	108.2
365	P	44.8	Very low	32	Very low	112 Å²	112	149.3 Å²	149.3	73%	0.727	77%	0.766	S	S	*	*				-138.2	153.8	-51.9	38.5	-21.8	0	0	0	113.7
366	S	24.3	Very low	31.9	Very low	122 Å²	122	146.8 Å²	146.8	85%	0.853	77%	0.766	S	S	*	*			trans	-167.4	128.9	152.8	53	0	0	0	0	115.3
367	L	26.6	Very low	32	Very low	170 Å²	170	142.4 Å²	142.4	89%	0.89	76%	0.763	S	S	*	*			trans	-106.3	179.6	154.4	-62.6	171.3	0	0	0	107.5
368	P	37.8	Very low	32.2	Very low	108 Å²	108	143.3 Å²	143.3	70%	0.701	77%	0.772	S	S	*	*			cis	-118.4	-169.7	-13.6	21.5	4.4	0	0	0	110.4
369	L	25.3	Very low	32.4	Very low	141 Å²	141	141.2 Å²	141.2	74%	0.738	78%	0.775	S	S	*	*				-170.7	141.1	58.5	-77.4	162.5	0	0	0	107.2
370	R	28.6	Very low	31.5	Very low	205 Å²	205	144.1 Å²	144.1	77%	0.774	78%	0.776	S	S	*	*				65.2	133	66.1	-171.1	-178.6	-178.5	147.6	2.6	112.4
371	P	41.1	Very low	31.2	Very low	116 Å²	116	150.6 Å²	150.6	75%	0.753	79%	0.786	S	S	*	*			cis	-110.5	162.3	22.5	10.6	14.9	0	0	0	115.1
372	Q	27.7	Very low	31.5	Very low	138 Å²	138	150.4 Å²	150.4	65%	0.645	79%	0.785	S	S	*	*				70.4	154	50.6	-74.1	-95.4	13.5	0	0	114
373	P	43.4	Very low	30.5	Very low	97 Å²	97	149.8 Å²	149.8	63%	0.63	78%	0.783	S	S	*	*			cis	-141.6	161.6	3.5	29.7	-6	0	0	0	120.1
374	R	26	Very low	30.9	Very low	220 Å²	220	145.4 Å²	145.4	83%	0.83	78%	0.775	S	S	*	*			trans	69.6	159.3	144.2	-72.1	172.5	-177.3	178.5	-1.4	119.6
375	N	27.9	Very low	31	Very low	121 Å²	121	143.2 Å²	143.2	65%	0.647	78%	0.776	S	S	*	*			cis	-157.4	152.7	4.2	-134.2	18	0	0	0	114.2
376	T	28.1	Very low	30.4	Very low	134 Å²	134	141.7 Å²	141.7	82%	0.822	77%	0.769	S	S	*	*			trans	54.8	154	151.4	49.1	0	0	0	0	121.1
377	G	29.7	Very low	30.4	Very low	71 Å²	71	145.1 Å²	145.1	73%	0.732	77%	0.768	S	S	*	*			cis	179.2	170.1	-1.7	0	0	0	0	0	112.1
378	D	28.4	Very low	30.6	Very low	157 Å²	157	142.7 Å²	142.7	84%	0.84	76%	0.76	S	S	*	*			trans	-73.8	166.7	-173.7	-50.2	-102.6	0	0	0	116.2
379	I	31	Very low	30.3	Very low	167 Å²	167	145 Å²	145	86%	0.856	77%	0.767	S	S	*	*				177.8	158.1	117.7	-91	158.6	0	0	0	114.7
380	K	32.2	Very low	30.4	Very low	179 Å²	179	141.9 Å²	141.9	78%	0.778	77%	0.768	S	S	*	*			trans	-92.2	154.9	-173.6	-44.7	140.7	-178	172	0	113.1
381	R	30.1	Very low	30.5	Very low	244 Å²	244	139.4 Å²	139.4	92%	0.921	77%	0.77	S	S	*	*				166.7	169.4	113	-98.9	173	168.3	135.7	-5.3	115.4
382	S	30.4	Very low	30	Very low	111 Å²	111	141.4 Å²	141.4	78%	0.776	77%	0.774	S	S	*	*			trans	-105.9	161.6	-174.7	-18.1	0	0	0	0	113.3
383	S	29.7	Very low	30.2	Very low	107 Å²	107	138.3 Å²	138.3	75%	0.748	78%	0.779	S	S	*	*				165.5	123.4	120.8	-73.1	0	0	0	0	116.3
384	S	30.6	Very low	29.5	Very low	108 Å²	108	139.5 Å²	139.5	76%	0.755	78%	0.784	S	S	*	*				59.3	152.2	120.6	-45.9	0	0	0	0	125.4
385	M	28	Very low	29.6	Very low	179 Å²	179	140.6 Å²	140.6	88%	0.882	79%	0.789	S	S	*	*			trans	76.2	155.6	156.1	-70.9	172.2	69.3	0	0	119.4
386	S	30.8	Very low	30.4	Very low	81 Å²	81	139.8 Å²	139.8	57%	0.566	79%	0.79	S	S	*	*			cis	-178.3	174.4	-29.5	56.9	0	0	0	0	111.1
387	F	24.3	Very low	30.4	Very low	194 Å²	194	143 Å²	143	85%	0.851	79%	0.793	S	S	*	*			trans	74.7	156.4	162.4	-94.3	-138.5	0	0	0	117.4
388	V	30.5	Very low	30.3	Very low	118 Å²	118	147.3 Å²	147.3	72%	0.715	79%	0.794	S	S	*	*			cis	-160.1	-172	-11.9	71.3	0	0	0	0	111.8
389	D	31.7	Very low	30.2	Very low	158 Å²	158	147.9 Å²	147.9	85%	0.845	79%	0.789	S	S	*	*			trans	-61.3	168.1	-179.3	-88	-62.1	0	0	0	119.8
390	G	29.1	Very low	29.9	Very low	74 Å²	74	151.3 Å²	151.3	76%	0.763	79%	0.791	S	S	*	*			trans	177.7	136.9	158.5	0	0	0	0	0	113.7
391	N	29.5	Very low	29.7	Very low	154 Å²	154	147.9 Å²	147.9	82%	0.824	79%	0.789	S	S	*	*			trans	-153.9	159.3	-171.1	-155	3.4	0	0	0	115.3
392	L	31.4	Very low	29.9	Very low	158 Å²	158	139.7 Å²	139.7	83%	0.827	78%	0.781	S	S	*	*			trans	72.4	143.6	174.1	-87.4	74.8	0	0	0	121.2
393	G	30.6	Very low	30.7	Very low	73 Å²	73	139.7 Å²	139.7	75%	0.753	78%	0.778	S	S	*	*			trans	172.6	142.5	168	0	0	0	0	0	112
394	T	29.1	Very low	30.7	Very low	121 Å²	121	145.6 Å²	145.6	74%	0.742	79%	0.786	S	S	*	*			trans	-148.8	127.8	-161.3	52.7	0	0	0	0	118.1
395	W	28.4	Very low	30.7	Very low	243 Å²	243	143.8 Å²	143.8	92%	0.92	78%	0.784	S	S	*	*			trans	54.7	-173.3	149.6	-68.4	111.8	0	0	0	117.8
396	P	45.8	Very low	30.9	Very low	104 Å²	104	142.5 Å²	142.5	68%	0.675	79%	0.786	S	S	*	*			cis	-132.6	-175.9	-9.9	30.3	-7	0	0	0	116.7
397	K	27	Very low	30.8	Very low	203 Å²	203	143.8 Å²	143.8	88%	0.883	80%	0.795	S	S	*	*			trans	123	165.2	147	-62.4	-152.3	174	-175.1	0	118.9
398	E	27.2	Very low	31.2	Very low	161 Å²	161	143.9 Å²	143.9	75%	0.752	80%	0.795	S	S	*	*			trans	-157.8	160	-134.8	-152.8	-158.3	167	0	0	114
399	K	26.8	Very low	30.9	Very low	169 Å²	169	145.8 Å²	145.8	74%	0.735	80%	0.802	S	S	*	*			trans	68.4	116.2	161.7	-49.5	-165.3	-175	-175.6	0	122.2
400	R	25.6	Very low	31.2	Very low	239 Å²	239	145.2 Å²	145.2	90%	0.902	80%	0.797	S	S	*	*				-179.1	112.4	127.8	-101.7	176.4	-168.6	-113.5	3.3	108.8
401	S	27.6	Very low	32.3	Very low	106 Å²	106	145.9 Å²	145.9	74%	0.741	79%	0.788	S	S	*	*				88.9	118.2	81.2	69.6	0	0	0	0	114.2
402	G	33.4	Very low	32.3	Very low	72 Å²	72	147.6 Å²	147.6	74%	0.742	79%	0.788	S	S	*	*			trans	-81.1	-164.4	-179.8	0	0	0	0	0	115.4
403	P	46.8	Very low	32.2	Very low	111 Å²	111	145.7 Å²	145.7	72%	0.721	78%	0.779	S	S	*	*				-143.9	-164.5	73.7	41.4	-24.2	0	0	0	116.1
404	Y	30.6	Very low	32.3	Very low	232 Å²	232	151 Å²	151	91%	0.91	78%	0.781	S	S	*	*			trans	76.1	125.6	-175.5	-53.6	-77	0	0	0	116.6
405	G	30.3	Very low	32.2	Very low	69 Å²	69	148.7 Å²	148.7	71%	0.711	78%	0.781	S	S	*	*			cis	155.2	107.9	-26.5	0	0	0	0	0	117.8
406	V	32.1	Very low	32.2	Very low	153 Å²	153	144.7 Å²	144.7	93%	0.927	78%	0.778	S	S	*	*			trans	69.2	142.6	144.4	177.1	0	0	0	0	117.9
407	S	28.2	Very low	31.2	Very low	108 Å²	108	145 Å²	145	76%	0.755	78%	0.783	S	S	*	*			cis	-166.5	174	-19.5	178.7	0	0	0	0	110
408	F	33.6	Very low	31.5	Very low	195 Å²	195	139.9 Å²	139.9	86%	0.855	78%	0.778	S	S	*	*			trans	-81	167.2	164.4	-71.6	-99.4	0	0	0	112.8
409	D	24	Very low	31.9	Very low	159 Å²	159	138.6 Å²	138.6	85%	0.85	78%	0.784	S	S	*	*			trans	-141.8	155.2	172.1	-123	-37	0	0	0	112.5
410	I	37	Very low	31.7	Very low	146 Å²	146	134.5 Å²	134.5	75%	0.749	78%	0.781	S	S	*	*			trans	-160.6	167.3	-166.6	-35.2	169.2	0	0	0	110.1
411	P	53.3	Low	31.9	Very low	88 Å²	88	129.5 Å²	129.5	57%	0.571	78%	0.777	S	S	*	*				-112.1	-162.5	-59.4	39.4	-24	0	0	0	112.5
412	F	28.6	Very low	32.6	Very low	189 Å²	189	129.7 Å²	129.7	83%	0.829	78%	0.776	S	S	*	*				169	116.7	116.2	-92.5	-65.3	0	0	0	116.4
413	D	29.9	Very low	32.4	Very low	119 Å²	119	131.3 Å²	131.3	64%	0.636	78%	0.776	S	S	*	*				51.8	150.4	128.7	-157.2	29.2	0	0	0	126.2
414	K	31.9	Very low	31.6	Very low	184 Å²	184	131 Å²	131	80%	0.8	78%	0.776	S	S	*	*			trans	68.4	129.7	161.2	-85.7	173.8	-171	77.1	0	123.1
415	G	28.6	Very low	31.6	Very low	72 Å²	72	125.8 Å²	125.8	74%	0.742	77%	0.769	S	S	*	*				129.7	70.5	105.9	0	0	0	0	0	122.3
416	D	27.2	Very low	31.7	Very low	160 Å²	160	133.9 Å²	133.9	86%	0.856	78%	0.778	S	S	*	*			trans	64.6	152.6	136.3	-131.9	-23.6	0	0	0	124.3
417	S	26.3	Very low	31.5	Very low	110 Å²	110	130 Å²	130	77%	0.769	77%	0.768	S	S	*	*			trans	69.8	151.8	158.8	77	0	0	0	0	121.9
418	A	33.5	Very low	31.6	Very low	95 Å²	95	132.9 Å²	132.9	79%	0.785	77%	0.772	S	S	*	*			trans	-127.5	145.6	169.1	0	0	0	0	0	110
419	P	34.7	Very low	31.3	Very low	134 Å²	134	129.6 Å²	129.6	87%	0.87	77%	0.768	S	S	*	*				-147	-160.6	125.5	38.5	-21.4	0	0	0	113.9
420	A	22.8	Very low	31.6	Very low	83 Å²	83	132.3 Å²	132.3	69%	0.686	77%	0.766	S	S	*	*			trans	-96.9	158.6	-158.1	0	0	0	0	0	117.4
421	V	29.8	Very low	31.6	Very low	135 Å²	135	130.4 Å²	130.4	82%	0.818	77%	0.766	S	S	*	*				32.9	123.7	127.1	-179.7	0	0	0	0	117.5
422	P	42.4	Very low	30.3	Very low	110 Å²	110	133.4 Å²	133.4	71%	0.714	78%	0.775	S	S	*	*				-155.4	164.3	94.3	40	-21.1	0	0	0	120.5
423	S	28	Very low	30.1	Very low	105 Å²	105	128.3 Å²	128.3	73%	0.734	76%	0.763	S	S	*	*			trans	67.1	124.6	157.3	52.3	0	0	0	0	119.1
424	S	30.8	Very low	29.9	Very low	105 Å²	105	127.7 Å²	127.7	73%	0.734	76%	0.764	S	S	*	*				88.7	137.8	51.5	-164.2	0	0	0	0	111.8
425	T	30.9	Very low	29.5	Very low	123 Å²	123	125.6 Å²	125.6	76%	0.755	76%	0.761	S	S	*	*			cis	-150.8	145.7	28	-36.7	0	0	0	0	108.4
426	R	32.2	Very low	29.4	Very low	239 Å²	239	130.6 Å²	130.6	90%	0.902	77%	0.766	S	S	*	*				160.6	130.8	80.1	-173.3	-175.4	-159.2	179.8	6	105.9
427	G	28.1	Very low	29.3	Very low	70 Å²	70	131.9 Å²	131.9	72%	0.722	77%	0.767	S	S	*	*			cis	-165.2	-152.7	-6.7	0	0	0	0	0	106.2
428	M	29.3	Very low	29.1	Very low	169 Å²	169	130.6 Å²	130.6	83%	0.833	77%	0.77	S	S	*	*			cis	171.7	145.2	-22.9	-98	167.2	65.1	0	0	105.9
429	V	28.2	Very low	28.5	Very low	126 Å²	126	132.1 Å²	132.1	76%	0.764	77%	0.774	S	S	*	*			cis	-169.3	153.6	-18.8	94.9	0	0	0	0	105.1
430	R	29.7	Very low	29.4	Very low	216 Å²	216	130.8 Å²	130.8	82%	0.815	77%	0.765	S	S	*	*			cis	-149.2	-171.4	18.1	-147.5	-165.1	-166.6	111.1	-0.1	109.7
431	S	37.3	Very low	29.5	Very low	107 Å²	107	133.5 Å²	133.5	75%	0.748	76%	0.764	S	S	*	*			trans	-147	152.9	165.6	50	0	0	0	0	111.2
432	I	25.5	Very low	29.5	Very low	150 Å²	150	136.7 Å²	136.7	77%	0.769	76%	0.761	S	S	*	*			trans	173.5	154.8	175.3	-108.3	156.8	0	0	0	108.4
433	S	24.9	Very low	29	Very low	83 Å²	83	138.9 Å²	138.9	58%	0.58	77%	0.766	S	S	*	*			cis	-170.2	175.2	-33.3	61.8	0	0	0	0	109.9
434	T	25.6	Very low	29.1	Very low	105 Å²	105	138.5 Å²	138.5	64%	0.644	77%	0.769	S	S	*	*			trans	59.2	124.4	148.6	47.6	0	0	0	0	122.4
435	D	24.8	Very low	29	Very low	140 Å²	140	137 Å²	137	75%	0.749	77%	0.77	S	S	*	*				62.1	140.5	124.6	-47.3	-22.8	0	0	0	124.6
436	E	24.7	Very low	29.1	Very low	178 Å²	178	137.5 Å²	137.5	83%	0.832	77%	0.773	S	S	*	*			trans	64.5	165.5	142.7	-67.6	-81.7	77.3	0	0	122.5
437	E	25.4	Very low	28.8	Very low	187 Å²	187	134.3 Å²	134.3	87%	0.874	77%	0.768	S	S	*	*			trans	-42.7	149.7	-168.4	-49.5	-173	120.4	0	0	119.6
438	G	22.3	Very low	28.8	Very low	82 Å²	82	136 Å²	136	85%	0.845	77%	0.769	S	S	*	*			trans	166.8	127.3	160.5	0	0	0	0	0	117.9
439	C	20.6	Very low	28.7	Very low	128 Å²	128	132.5 Å²	132.5	87%	0.865	76%	0.76	S	S	*	*			trans	-119.3	174.1	167.8	-125.7	0	0	0	0	108.6
440	P	54.5	Low	28.7	Very low	106 Å²	106	136.5 Å²	136.5	69%	0.688	76%	0.761	S	S	*	*			cis	-141	-163.7	-10.5	40	-18.8	0	0	0	115.3
441	E	24.2	Very low	28.4	Very low	140 Å²	140	132.8 Å²	132.8	65%	0.654	75%	0.753	S	S	*	*			trans	86	108.1	149.2	-75.8	-161.5	106.2	0	0	126.3
442	R	30.6	Very low	27.6	Very low	201 Å²	201	132.4 Å²	132.4	76%	0.758	76%	0.757	S	S	*	*				69.2	118	121.3	-72.6	-171.4	171	141.1	-10.1	126
443	L	31.7	Very low	28	Very low	156 Å²	156	135 Å²	135	82%	0.817	76%	0.758	S	S	*	*				71.5	149.4	126	-62.4	175.8	0	0	0	121.2
444	A	30.2	Very low	29.3	Very low	98 Å²	98	136.3 Å²	136.3	81%	0.81	77%	0.765	S	S	*	*			cis	-167.3	168.4	-7.9	0	0	0	0	0	114.6
445	G	28.6	Very low	29.6	Very low	72 Å²	72	139 Å²	139	74%	0.742	78%	0.775	S	S	*	*			trans	110	155.2	158.1	0	0	0	0	0	117.9
446	V	32.7	Very low	29.8	Very low	134 Å²	134	135.1 Å²	135.1	81%	0.812	77%	0.769	S	S	*	*			cis	-161.6	138.1	-5.6	125.5	0	0	0	0	113.2
447	E	26.8	Very low	29.9	Very low	172 Å²	172	136.6 Å²	136.6	80%	0.804	78%	0.775	S	S	*	*			trans	50.2	149	151.4	-59.9	-166.8	133.6	0	0	129.9
448	S	27.6	Very low	30	Very low	107 Å²	107	131.5 Å²	131.5	75%	0.748	77%	0.773	S	S	*	*			trans	70.5	145.5	156.3	-76.1	0	0	0	0	120.2
449	C	26.2	Very low	30.2	Very low	95 Å²	95	133.6 Å²	133.6	64%	0.642	78%	0.775	S	S	*	*			cis	-170.9	178.3	-4.2	-103.1	0	0	0	0	106.7
450	R	28.2	Very low	30.7	Very low	210 Å²	210	133.4 Å²	133.4	79%	0.792	77%	0.769	S	S	*	*			cis	-176.5	175.6	-13.8	-103.7	179.7	143	126.1	-2.3	107.1
451	Q	24.2	Very low	29.5	Very low	138 Å²	138	136.7 Å²	136.7	65%	0.645	78%	0.78	S	S	*	*			cis	179.2	115.3	-33.9	173.1	-176.9	-0.3	0	0	110.1
452	A	21	Very low	29.8	Very low	99 Å²	99	134.1 Å²	134.1	82%	0.818	78%	0.783	S	S	*	*			trans	-159.3	167.8	172	0	0	0	0	0	113.9
453	Y	33	Very low	29.8	Very low	203 Å²	203	130.6 Å²	130.6	80%	0.796	79%	0.789	S	S	*	*			trans	-134	173	-163.9	-85.3	-68.6	0	0	0	112.9
454	P	51.8	Low	29.7	Very low	111 Å²	111	127.3 Å²	127.3	72%	0.721	78%	0.784	S	S	*	*			cis	-144.2	171.5	26.7	43	-22.7	0	0	0	120.7
455	N	32.4	Very low	29.8	Very low	161 Å²	161	128.8 Å²	128.8	86%	0.861	79%	0.786	S	S	*	*			trans	30.6	139	155.8	-62	2.3	0	0	0	122.9
456	G	28.4	Very low	30.1	Very low	60 Å²	60	131 Å²	131	62%	0.619	79%	0.79	S	S	*	*			cis	169.1	164.1	-3.4	0	0	0	0	0	114.4
457	H	28.2	Very low	30.3	Very low	209 Å²	209	132 Å²	132	97%	0.968	79%	0.787	S	S	*	*			trans	62.2	137.4	-173.9	-52.9	-91	0	0	0	114.8
458	G	26.8	Very low	30.8	Very low	80 Å²	80	130.7 Å²	130.7	83%	0.825	78%	0.781	S	S	*	*			cis	128.4	129.2	12	0	0	0	0	0	108.3
459	S	26	Very low	31	Very low	126 Å²	126	134.6 Å²	134.6	88%	0.881	79%	0.788	S	S	*	*			cis	-139.7	-179.9	15.7	-166.8	0	0	0	0	112.3
460	V	30.7	Very low	31.3	Very low	124 Å²	124	135.9 Å²	135.9	75%	0.752	79%	0.793	S	S	*	*			trans	-106.6	152.3	-172.2	173.8	0	0	0	0	112.5
461	L	30.2	Very low	31.7	Very low	175 Å²	175	132.5 Å²	132.5	92%	0.916	79%	0.79	S	S	*	*			trans	-137.2	144.3	148.3	-106.5	173.7	0	0	0	110.3
462	A	30.3	Very low	32.3	Very low	86 Å²	86	133.7 Å²	133.7	71%	0.711	80%	0.795	S	S	*	*			trans	-141.4	172.3	179.7	0	0	0	0	0	110.1
463	S	30.6	Very low	32.9	Very low	126 Å²	126	136 Å²	136	88%	0.881	79%	0.793	S	S	*	*			trans	-75.3	169.1	-169.2	-154.1	0	0	0	0	115.1
464	A	29.3	Very low	32.7	Very low	88 Å²	88	133.3 Å²	133.3	73%	0.727	79%	0.79	S	S	*	*			trans	-84.8	160.8	-168.4	0	0	0	0	0	115.6
465	P	33	Very low	31.7	Very low	129 Å²	129	136.6 Å²	136.6	84%	0.838	80%	0.795	S	S	*	*			trans	-98.9	-177	166.8	39.5	-33.6	0	0	0	113.4
466	S	34.4	Very low	31.9	Very low	119 Å²	119	136 Å²	136	83%	0.832	79%	0.792	S	S	*	*			trans	-90.7	169.7	-165.2	-168.6	0	0	0	0	116.3
467	M	37.5	Very low	32.5	Very low	153 Å²	153	138.2 Å²	138.2	75%	0.754	80%	0.796	S	S	*	*	S	Bend	trans	-71	163.6	170.9	-174.2	167.5	65.7	0	0	113.6
468	E	37.4	Very low	32.2	Very low	146 Å²	146	134.6 Å²	134.6	68%	0.682	79%	0.788	S	S	*	*			trans	79.4	47.7	158	-130.7	69.7	-102.3	0	0	121.5
469	E	32.2	Very low	32.2	Very low	188 Å²	188	141.1 Å²	141.1	88%	0.879	79%	0.788	S	S	*	*			trans	-146.9	38.6	161.7	-146.5	177.7	-148.2	0	0	116.8
470	T	31.6	Very low	32.2	Very low	122 Å²	122	142.6 Å²	142.6	75%	0.748	78%	0.781	S	S	*	*			trans	-152.3	61	163.1	-31.4	0	0	0	0	114.8
471	L	37.5	Very low	32.4	Very low	139 Å²	139	142.6 Å²	142.6	73%	0.728	78%	0.784	S	S	*	*			trans	-71.5	149.9	147.2	-80.7	175.5	0	0	0	109.4
472	Q	35.5	Very low	32.4	Very low	164 Å²	164	140.1 Å²	140.1	77%	0.766	78%	0.776	S	S	*	*			trans	53.8	102.6	-171.7	-65.6	88.8	19.6	0	0	116.4
473	I	33.6	Very low	32.1	Very low	148 Å²	148	145.4 Å²	145.4	76%	0.759	79%	0.786	S	S	*	*				-146.6	110	123	-103.4	150.4	0	0	0	110.2
474	I	29.5	Very low	31.9	Very low	145 Å²	145	142.7 Å²	142.7	74%	0.744	78%	0.778	S	S	*	*			trans	53.3	98.5	141.2	-50.4	179.8	0	0	0	118.4
475	H	30	Very low	31.9	Very low	180 Å²	180	145.9 Å²	145.9	83%	0.833	78%	0.781	S	S	*	*				53.8	131.6	120.9	-104.9	-98.8	0	0	0	122.3
476	N	36.3	Very low	31.4	Very low	148 Å²	148	147.2 Å²	147.2	79%	0.791	78%	0.781	S	S	*	*			trans	-52.4	149	144.8	-97	-57.2	0	0	0	110.6
477	P	42.1	Very low	31.2	Very low	108 Å²	108	147.4 Å²	147.4	70%	0.701	78%	0.782	S	S	*	*			cis	-130.6	-176.6	23.6	33.5	-11.2	0	0	0	113.9
478	T	22.6	Very low	30.8	Very low	132 Å²	132	143.3 Å²	143.3	81%	0.81	78%	0.779	S	S	*	*				176.1	158.9	82.5	-56.5	0	0	0	0	111.3
479	R	25.9	Very low	30.4	Very low	217 Å²	217	145.1 Å²	145.1	82%	0.819	79%	0.785	S	S	*	*			trans	-93.6	149	177.3	-68.8	176.5	169.9	174.3	-4.3	113.8
480	Q	26.6	Very low	30.3	Very low	158 Å²	158	144.9 Å²	144.9	74%	0.738	78%	0.782	S	S	*	*			trans	51	145.8	143	-68.5	-179.1	-32	0	0	120.6
481	P	34.8	Very low	30.1	Very low	124 Å²	124	146.3 Å²	146.3	81%	0.805	78%	0.784	S	S	*	*				-120.5	164.3	85.2	0.8	21.6	0	0	0	112.1
482	V	29.1	Very low	30.4	Very low	123 Å²	123	148 Å²	148	75%	0.745	79%	0.788	S	S	*	*			cis	95.8	114.4	24.1	175.9	0	0	0	0	115.2
483	E	25.6	Very low	30	Very low	196 Å²	196	145.2 Å²	145.2	92%	0.916	79%	0.787	S	S	*	*			trans	-164.2	149.2	130.2	-108.6	178.3	-176.5	0	0	109.3
484	G	26	Very low	29.5	Very low	70 Å²	70	146.3 Å²	146.3	72%	0.722	79%	0.788	S	S	*	*			trans	173.8	-18.7	-173.4	0	0	0	0	0	120.8
485	I	27.7	Very low	29.6	Very low	155 Å²	155	147.3 Å²	147.3	80%	0.795	80%	0.795	S	S	*	*			trans	72.5	143.2	163.2	-54.8	174	0	0	0	118.3
486	N	23.6	Very low	29.7	Very low	157 Å²	157	144.1 Å²	144.1	84%	0.84	79%	0.79	S	S	*	*			trans	71.1	135.8	174.7	-68.4	-16.6	0	0	0	118.4
487	S	30.8	Very low	29.1	Very low	122 Å²	122	141 Å²	141	85%	0.853	79%	0.794	S	S	*	*			trans	-157.7	138.1	-161.4	58.4	0	0	0	0	115.5
488	G	29.2	Very low	28.3	Very low	67 Å²	67	142.2 Å²	142.2	69%	0.691	81%	0.805	S	S	*	*			trans	110.9	152.4	154.8	0	0	0	0	0	117.7
489	F	29.2	Very low	28.5	Very low	185 Å²	185	139.1 Å²	139.1	81%	0.811	80%	0.799	S	S	*	*			cis	-163.4	124	-10.3	-125.2	-90	0	0	0	109.5
490	F	29.3	Very low	28.6	Very low	183 Å²	183	134.1 Å²	134.1	80%	0.803	80%	0.804	S	S	*	*			trans	64.2	170.1	169.1	-78.4	-124.5	0	0	0	115.8
491	L	28	Very low	28.6	Very low	151 Å²	151	129.9 Å²	129.9	79%	0.791	80%	0.803	S	S	*	*			cis	-145.6	178.1	19.3	-160.8	103.7	0	0	0	111.1
492	H	44	Very low	28.2	Very low	174 Å²	174	130.4 Å²	130.4	81%	0.806	80%	0.804	S	S	*	*			trans	-74.3	140	167.2	-68.6	-92.4	0	0	0	112.1
493	S	25.5	Very low	28	Very low	107 Å²	107	132.6 Å²	132.6	75%	0.748	81%	0.81	S	S	*	*			trans	165.2	155	136.1	-79.3	0	0	0	0	114.8
494	Q	24.7	Very low	27.7	Very low	170 Å²	170	129.6 Å²	129.6	79%	0.794	80%	0.8	S	S	*	*			trans	38.1	132.8	143.8	-67.5	177.8	-20.3	0	0	122.6
495	D	30.2	Very low	28.5	Very low	167 Å²	167	132 Å²	132	89%	0.893	80%	0.803	S	S	*	*			trans	-63.5	130	139.3	-86.8	-55.3	0	0	0	109.3
496	P	32.3	Very low	28.3	Very low	112 Å²	112	131.5 Å²	131.5	73%	0.727	80%	0.802	S	S	*	*				-150.5	168.2	114.3	39.2	-24.6	0	0	0	115.1
497	G	24.9	Very low	29.4	Very low	84 Å²	84	128.6 Å²	128.6	87%	0.866	79%	0.791	S	S	*	*			trans	105.8	138.8	150.2	0	0	0	0	0	116.3
498	S	24.6	Very low	29	Very low	132 Å²	132	131.1 Å²	131.1	92%	0.923	79%	0.79	S	S	*	*			trans	-132.4	155.9	176.7	-178.5	0	0	0	0	110
499	G	26.6	Very low	28.9	Very low	68 Å²	68	132.7 Å²	132.7	70%	0.701	79%	0.79	S	S	*	*			trans	115.5	155.4	170.1	0	0	0	0	0	115
500	A	28.9	Very low	28.6	Very low	111 Å²	111	130.8 Å²	130.8	92%	0.917	79%	0.788	S	S	*	*			cis	-156.7	156.7	-3	0	0	0	0	0	112.8
501	G	25.2	Very low	28.5	Very low	70 Å²	70	126 Å²	126	72%	0.722	78%	0.777	S	S	*	*			trans	136.4	121.4	173.2	0	0	0	0	0	111.9
502	V	26	Very low	28.5	Very low	134 Å²	134	126.5 Å²	126.5	81%	0.812	77%	0.773	S	S	*	*	S	Bend	cis	-150.5	138.4	6.1	166.8	0	0	0	0	110.5
503	L	25.5	Very low	27.6	Very low	169 Å²	169	125 Å²	125	89%	0.885	77%	0.767	S	S	*	*			trans	81.2	140.9	165	-74.8	164.7	0	0	0	122.4
504	D	20.7	Very low	27.5	Very low	133 Å²	133	127.1 Å²	127.1	71%	0.711	77%	0.769	S	S	*	*			trans	-77.9	176.2	-179.5	-102.2	-64.5	0	0	0	114.3
505	P	41.1	Very low	27.4	Very low	120 Å²	120	126.6 Å²	126.6	78%	0.779	77%	0.771	S	S	*	*			cis	-141.6	168.1	29.1	40.4	-19.6	0	0	0	121.3
506	L	24.2	Very low	27.1	Very low	145 Å²	145	123.6 Å²	123.6	76%	0.759	76%	0.763	S	S	*	*			trans	-36.6	171.2	157.7	-108.8	61.7	0	0	0	117.7
507	P	47.2	Very low	26.7	Very low	96 Å²	96	124.1 Å²	124.1	62%	0.623	76%	0.764	S	S	*	*			cis	-141.4	165.1	9.1	36	-14.7	0	0	0	120.3
508	E	21.9	Very low	26.6	Very low	176 Å²	176	123.2 Å²	123.2	82%	0.822	75%	0.749	S	S	*	*			trans	59.7	153.4	145.9	-70.3	177.9	-135.5	0	0	120.8
509	S	27.5	Very low	26.6	Very low	100 Å²	100	124.1 Å²	124.1	70%	0.699	74%	0.743	S	S	*	*			cis	-174.3	176.6	-12	-89.4	0	0	0	0	108
510	D	23	Very low	26.6	Very low	144 Å²	144	126.2 Å²	126.2	77%	0.77	74%	0.742	S	S	*	*			cis	-164.9	162.9	-49.4	-176.5	28.5	0	0	0	109.4
511	S	27.3	Very low	26.8	Very low	82 Å²	82	126.5 Å²	126.5	57%	0.573	73%	0.733	S	S	*	*			trans	85.6	124.7	150.4	83	0	0	0	0	123
512	K	27.6	Very low	26.9	Very low	162 Å²	162	130.2 Å²	130.2	70%	0.704	73%	0.732	S	S	*	*			trans	71.4	145.9	135.4	-66.7	171.1	165.1	-76.4	0	120.3
513	E	25.1	Very low	27.1	Very low	143 Å²	143	129.9 Å²	129.9	67%	0.668	73%	0.73	S	S	*	*			cis	-159.8	-179.2	-9.7	-120	153.8	-178.7	0	0	107.6
514	L	23.6	Very low	27.1	Very low	151 Å²	151	128 Å²	128	79%	0.791	72%	0.72	S	S	*	*			cis	-156.8	-165.8	18.7	-135.3	178.3	0	0	0	110.1
515	L	23.1	Very low	27.6	Very low	160 Å²	160	127.4 Å²	127.4	84%	0.838	72%	0.722	S	S	*	*			trans	-129.3	-168.3	174.7	-72.7	151.8	0	0	0	109.3
516	S	23.7	Very low	26.9	Very low	104 Å²	104	124.9 Å²	124.9	73%	0.727	72%	0.717	S	S	*	*			cis	-164.4	-178.7	11.6	55.6	0	0	0	0	107.5
517	T	22.3	Very low	27.5	Very low	122 Å²	122	125.4 Å²	125.4	75%	0.748	72%	0.719	S	S	*	*			cis	-133.7	-163.6	1.1	45	0	0	0	0	108.3
518	A	24.4	Very low	26.4	Very low	66 Å²	66	129 Å²	129	55%	0.545	73%	0.727	S	S	.	*			cis	69.2	151.3	19.7	0	0	0	0	0	116.8
519	D	24.2	Very low	27.1	Very low	150 Å²	150	127 Å²	127	80%	0.802	72%	0.721	S	S	*	*			cis	-163.7	170.6	-19.8	-86.9	-27.3	0	0	0	106.8
520	T	25.8	Very low	26.9	Very low	113 Å²	113	132.3 Å²	132.3	69%	0.693	73%	0.726	S	S	*	*			cis	-133.2	-148.2	-0	-13.8	0	0	0	0	108.5	E522	T520-E522 WeakPolarHBondContact CG2-OE2 3.49Å
521	T	32.6	Very low	27.1	Very low	117 Å²	117	129.9 Å²	129.9	72%	0.718	72%	0.716	S	S	*	*			cis	-136.2	-179	9.8	57.1	0	0	0	0	108.7
522	E	28.8	Very low	27.1	Very low	148 Å²	148	134.1 Å²	134.1	69%	0.692	73%	0.727	S	S	*	*			cis	71.6	143.5	27.3	-42.3	157.5	107	0	0	113.1	T520	T520-E522 WeakPolarHBondContact CG2-OE2 3.49Å
523	V	28.8	Very low	27	Very low	127 Å²	127	133.8 Å²	133.8	77%	0.77	73%	0.733	S	S	*	*			cis	-130.6	136.4	18	153.3	0	0	0	0	108.8
524	D	26	Very low	27.2	Very low	128 Å²	128	135.2 Å²	135.2	68%	0.684	74%	0.741	S	S	*	*			cis	87.2	140.3	45.2	177.1	81.5	0	0	0	113.7
525	T	32.5	Very low	27.8	Very low	122 Å²	122	135 Å²	135	75%	0.748	74%	0.74	S	S	*	*			cis	-151.6	-176.2	-35	34.1	0	0	0	0	109.7
526	G	25.7	Very low	28.2	Very low	66 Å²	66	133.7 Å²	133.7	68%	0.68	73%	0.734	S	S	*	*			trans	102.9	116.5	165.8	0	0	0	0	0	114
527	I	36	Very low	29	Very low	157 Å²	157	134.6 Å²	134.6	81%	0.805	73%	0.727	S	S	*	*			cis	68.3	100.5	19	-44.6	179	0	0	0	114.9
528	H	24.5	Very low	29.3	Very low	171 Å²	171	134.8 Å²	134.8	79%	0.792	72%	0.724	S	S	*	*			trans	-147.3	144.8	139.8	-148.2	-68.2	0	0	0	110.7
529	I	37.7	Very low	29.9	Very low	135 Å²	135	135.8 Å²	135.8	69%	0.692	73%	0.726	S	S	*	*			trans	-111.8	146.7	179.3	-63.5	169	0	0	0	109.7
530	R	22.3	Very low	30.4	Very low	211 Å²	211	133.9 Å²	133.9	80%	0.796	73%	0.725	S	S	*	*			trans	-158.8	122	151.1	-91.8	-146.6	141.7	84.3	2.4	107.5
531	T	26.3	Very low	30.7	Very low	93 Å²	93	134.7 Å²	134.7	57%	0.571	72%	0.724	S	S	*	*				50.5	130.7	84	66.2	0	0	0	0	112
532	E	27.8	Very low	30.6	Very low	170 Å²	170	137.4 Å²	137.4	79%	0.794	73%	0.726	S	S	*	*			cis	-175.6	-153.7	-5.8	-118.4	164.2	164.6	0	0	103.3
533	D	26.7	Very low	30.5	Very low	155 Å²	155	138.7 Å²	138.7	83%	0.829	74%	0.738	S	S	*	*			trans	76.2	125.3	-176.1	-54.3	-24.8	0	0	0	114.7
534	M	29.6	Very low	30.4	Very low	173 Å²	173	140.1 Å²	140.1	85%	0.852	74%	0.74	S	S	*	*			cis	-147.1	171.9	-7.5	-102	-178	75.6	0	0	110.4
535	L	35	Very low	30.8	Very low	147 Å²	147	138.7 Å²	138.7	77%	0.77	74%	0.74	S	S	*	*			trans	-67.3	176.4	173.6	-45.6	169.5	0	0	0	111.3
536	D	32.3	Very low	30.5	Very low	133 Å²	133	139.5 Å²	139.5	71%	0.711	75%	0.745	S	S	*	*			cis	-145.6	149.6	18.7	-85.1	-66.5	0	0	0	108.1
537	E	39.4	Very low	30.8	Very low	122 Å²	122	143.1 Å²	143.1	57%	0.57	75%	0.748	S	S	*	*				70.1	135.7	78.5	-86.7	-53.9	149.5	0	0	119.1
538	D	28.7	Very low	30.6	Very low	127 Å²	127	144.1 Å²	144.1	68%	0.679	75%	0.752	S	S	*	*			trans	58.1	144.3	165.9	-150.8	23.5	0	0	0	125.7
539	S	37.6	Very low	31.1	Very low	86 Å²	86	142.3 Å²	142.3	60%	0.601	75%	0.748	S	S	*	*			trans	61.5	102.6	144.2	-85.9	0	0	0	0	125
540	S	34.9	Very low	31	Very low	111 Å²	111	142.5 Å²	142.5	78%	0.776	75%	0.75	S	S	*	*				76.7	158.8	104.7	-156.7	0	0	0	0	122.3
541	L	31.8	Very low	31.4	Very low	129 Å²	129	138.9 Å²	138.9	68%	0.675	75%	0.746	S	S	*	*			trans	109.5	110.3	139.4	-154.1	139.9	0	0	0	120.1
542	K	30.4	Very low	31.7	Very low	174 Å²	174	141.4 Å²	141.4	76%	0.757	76%	0.761	S	S	*	*			trans	18.3	111.3	145.3	-49.3	162	-167.8	165.8	0	118.4	L544	K542-L544 PolarHBondContact O-N 2.75Å; K542-L544 VanDerWaalsContact O-N 3.15Å
543	D	26.9	Very low	31.7	Very low	175 Å²	175	139.7 Å²	139.7	94%	0.936	76%	0.757	S	S	*	*			trans	-77.3	94.9	156.1	-91.5	-46.8	0	0	0	111.4
544	L	26.9	Very low	31.8	Very low	158 Å²	158	137.9 Å²	137.9	83%	0.827	75%	0.752	S	S	*	*			trans	-128.8	89.1	160.4	-105.8	175.6	0	0	0	110	K542	K542-L544 PolarHBondContact O-N 2.75Å; K542-L544 VanDerWaalsContact O-N 3.15Å
545	S	32.7	Very low	32.2	Very low	97 Å²	97	135.1 Å²	135.1	68%	0.678	75%	0.747	S	S	*	*			trans	37.5	116.1	146.7	170.3	0	0	0	0	119.1
546	V	26.4	Very low	31.7	Very low	140 Å²	140	133.4 Å²	133.4	85%	0.848	75%	0.748	S	S	*	*				-157	163.3	114.8	-100	0	0	0	0	111.7
547	N	32.4	Very low	32	Very low	141 Å²	141	133.1 Å²	133.1	75%	0.754	75%	0.753	S	S	*	*			trans	-79.8	167.5	177.8	-41.8	-74	0	0	0	112.1
548	M	32.5	Very low	31.3	Very low	178 Å²	178	132.7 Å²	132.7	88%	0.877	76%	0.763	S	S	*	*			trans	-114.3	110.1	141.2	-77.2	-135.6	68.4	0	0	109.4
549	D	34.3	Very low	31.6	Very low	134 Å²	134	132.7 Å²	132.7	72%	0.717	77%	0.77	S	S	*	*			trans	-96.2	-164.9	155.4	-132.1	-53.4	0	0	0	107.5
550	L	36.6	Very low	31	Very low	139 Å²	139	133.1 Å²	133.1	73%	0.728	77%	0.773	S	S	*	*			trans	81.6	139.2	177.2	-48.6	175.1	0	0	0	114.3
551	D	29.6	Very low	30.5	Very low	135 Å²	135	134 Å²	134	72%	0.722	77%	0.769	S	S	*	*			cis	-147.3	150.1	5.1	-106.8	-36.8	0	0	0	112.1
552	V	32.7	Very low	30.3	Very low	146 Å²	146	135.8 Å²	135.8	89%	0.885	77%	0.774	S	S	*	*				169.2	153	109.1	74.6	0	0	0	0	112.6
553	D	28.5	Very low	30.2	Very low	133 Å²	133	132.2 Å²	132.2	71%	0.711	77%	0.771	S	S	*	*			trans	-77.4	145.4	-161.4	-106	-62.1	0	0	0	118.9
554	T	28.1	Very low	30.2	Very low	117 Å²	117	132.8 Å²	132.8	72%	0.718	77%	0.765	S	S	*	*				39.9	142.4	118.8	-58.2	0	0	0	0	120.8
555	P	38	Very low	30.3	Very low	116 Å²	116	130.8 Å²	130.8	75%	0.753	76%	0.764	S	S	*	*			cis	-132	178.6	12.7	25.6	-1.1	0	0	0	117.1
556	S	26.1	Very low	31	Very low	111 Å²	111	131.4 Å²	131.4	78%	0.776	77%	0.766	S	S	*	*			trans	-66	161.8	165.1	-45.6	0	0	0	0	113.6
557	P	36.6	Very low	31.2	Very low	127 Å²	127	130.8 Å²	130.8	83%	0.825	77%	0.768	S	S	*	*				-144	162.3	89.9	39.2	-25.1	0	0	0	116.2
558	S	24.9	Very low	31	Very low	112 Å²	112	127.1 Å²	127.1	78%	0.783	76%	0.764	S	S	*	*			trans	-77.4	164.4	171	-41.7	0	0	0	0	111.8
559	P	35.7	Very low	31.1	Very low	128 Å²	128	125.3 Å²	125.3	83%	0.831	76%	0.762	S	S	*	*				-145.3	174.2	83.3	38.5	-21	0	0	0	116.5
560	S	24.8	Very low	31.1	Very low	94 Å²	94	127.5 Å²	127.5	66%	0.657	77%	0.765	S	S	*	*			trans	-65.7	155	-178	55.5	0	0	0	0	116.5
561	N	24.6	Very low	31.1	Very low	130 Å²	130	128.4 Å²	128.4	70%	0.695	77%	0.77	S	S	*	*				-168.7	133.6	112.1	-99.9	-50.5	0	0	0	115
562	Q	27.2	Very low	32.2	Very low	166 Å²	166	128.5 Å²	128.5	78%	0.776	78%	0.776	S	S	*	*			trans	31.6	138	138.7	-54	177.2	60.8	0	0	120
563	S	28.3	Very low	32.5	Very low	99 Å²	99	126.6 Å²	126.6	69%	0.692	77%	0.769	S	S	*	*			cis	-170.6	153.4	45	59.9	0	0	0	0	116.4
564	K	28.1	Very low	33	Very low	187 Å²	187	130.7 Å²	130.7	81%	0.813	78%	0.781	S	S	*	*			trans	48	102.7	142.3	-62.4	170	-176.4	174.8	0	121.8
565	S	27.5	Very low	33.4	Very low	116 Å²	116	129 Å²	129	81%	0.811	78%	0.779	S	S	*	*				29.1	160.1	114.2	-51.2	0	0	0	0	123
566	P	48.8	Very low	33.1	Very low	111 Å²	111	132.3 Å²	132.3	72%	0.721	78%	0.784	S	S	*	*			cis	-143.9	180	-32.4	40.2	-22.4	0	0	0	115.6
567	S	30.1	Very low	33.5	Very low	127 Å²	127	136.7 Å²	136.7	89%	0.888	79%	0.793	S	S	*	*			trans	67.6	159	163	76.9	0	0	0	0	118.2
568	G	29.3	Very low	33.3	Very low	64 Å²	64	140.2 Å²	140.2	66%	0.66	80%	0.795	S	S	*	*			cis	159.2	148.4	-12.6	0	0	0	0	0	113.5
569	V	33.4	Very low	33.6	Very low	139 Å²	139	143.4 Å²	143.4	84%	0.842	80%	0.8	S	S	*	*			trans	71.5	139.4	169.8	-171.5	0	0	0	0	113.1
570	K	33.8	Very low	33.5	Very low	180 Å²	180	148.6 Å²	148.6	78%	0.783	80%	0.803	S	S	*	*			cis	-166	144.7	44.5	-146.8	155.7	-164.4	170.6	0	113.8
571	L	37.4	Very low	33.9	Very low	158 Å²	158	153.7 Å²	153.7	83%	0.827	81%	0.813	S	S	*	*			trans	30	156.5	145.6	-60.7	175.6	0	0	0	125.5
572	T	52.9	Low	34.1	Very low	137 Å²	137	155.9 Å²	155.9	84%	0.84	82%	0.824	S	S	*	*			trans	-65.3	158.8	-179.3	54	0	0	0	0	117.5
573	S	38.1	Very low	33.9	Very low	106 Å²	106	153 Å²	153	74%	0.741	82%	0.822	S	S	*	*			trans	-140	144.1	156.8	-173.5	0	0	0	0	112.8
574	F	39.6	Very low	35.1	Very low	219 Å²	219	154 Å²	154	96%	0.961	83%	0.826	S	S	*	*			trans	-139	66.7	176.3	-176.4	-93.7	0	0	0	107.7
575	A	36.7	Very low	35	Very low	83 Å²	83	151.1 Å²	151.1	69%	0.686	83%	0.83	S	S	*	*			trans	-141.8	-4.1	-161.3	0	0	0	0	0	117.7
576	E	31.3	Very low	35	Very low	185 Å²	185	150 Å²	150	86%	0.864	83%	0.827	S	S	*	*			trans	-124.3	96.3	-178.3	-67.5	-153.6	134.4	0	0	114.1
577	Q	35.3	Very low	35.1	Very low	203 Å²	203	150.5 Å²	150.5	95%	0.949	83%	0.83	S	S	*	*				177.5	100.4	123.1	-98.1	-176.1	-4.1	0	0	110.7
578	K	32.1	Very low	34.8	Very low	201 Å²	201	151.1 Å²	151.1	87%	0.874	82%	0.824	S	S	*	*			trans	-155	84.1	168.4	-175.7	-158.3	169.5	-172.5	0	110.8
579	M	31.7	Very low	35	Very low	179 Å²	179	152.9 Å²	152.9	88%	0.882	83%	0.826	S	S	*	*			trans	-149.1	151.7	165.3	-97.7	-53.6	-175.6	0	0	113.2
580	R	32.2	Very low	34.8	Very low	236 Å²	236	150.3 Å²	150.3	89%	0.891	83%	0.827	S	S	*	*			trans	65.2	99.2	168.2	-65.7	177.3	179.6	172.1	0.5	118
581	K	32.7	Very low	34.7	Very low	202 Å²	202	153.6 Å²	153.6	88%	0.878	84%	0.835	S	S	*	*			trans	-59.6	156.1	141.7	-66.8	177.1	171.9	-177.4	0	109.8
582	L	30.2	Very low	34.3	Very low	175 Å²	175	149.4 Å²	149.4	92%	0.916	83%	0.83	S	S	*	*				-159.2	175.1	125.4	-107.4	169.9	0	0	0	109.8
583	S	23.5	Very low	33.2	Very low	105 Å²	105	149.1 Å²	149.1	73%	0.734	83%	0.834	S	S	*	*			trans	-136.5	-167.4	-171.1	62	0	0	0	0	111.6
584	P	53.3	Low	33.1	Very low	120 Å²	120	149.8 Å²	149.8	78%	0.779	84%	0.839	S	S	*	*				-103.2	160.6	-115.3	39.5	-27.6	0	0	0	115.2
585	S	25.2	Very low	32.6	Very low	128 Å²	128	145 Å²	145	90%	0.895	83%	0.832	S	S	*	*			trans	-142.4	143.1	167	-60	0	0	0	0	112.2
586	A	27.8	Very low	32.7	Very low	92 Å²	92	146.3 Å²	146.3	76%	0.76	84%	0.836	S	S	*	*			trans	-124.6	-177.6	157.4	0	0	0	0	0	106.3
587	P	50.1	Low	32.8	Very low	121 Å²	121	145.7 Å²	145.7	79%	0.786	84%	0.836	S	S	*	*			cis	-133.7	-161	-1.2	33.4	-9.7	0	0	0	113.2
588	D	25.4	Very low	33.3	Very low	140 Å²	140	145.4 Å²	145.4	75%	0.749	83%	0.831	S	S	*	*			trans	113.7	144.5	130.9	-151.4	20.5	0	0	0	120.6
589	S	32.2	Very low	33.5	Very low	102 Å²	102	141.6 Å²	141.6	71%	0.713	83%	0.825	S	S	*	*			trans	24.7	107	156.4	-67.2	0	0	0	0	119.7
590	G	30	Very low	34.3	Very low	84 Å²	84	136.6 Å²	136.6	87%	0.866	81%	0.805	S	S	*	*			trans	-88.3	-177.6	170.4	0	0	0	0	0	114.9
591	R	30.4	Very low	35.3	Very low	249 Å²	249	130.4 Å²	130.4	94%	0.94	80%	0.795	S	S	*	*			trans	-151.6	127.7	162.9	-165.9	170.9	-174.2	-124.7	3.1	107.8
592	G	29	Very low	35.9	Very low	71 Å²	71	127.7 Å²	127.7	73%	0.732	79%	0.785	S	S	*	*			trans	-84.2	158.6	-176.2	0	0	0	0	0	113.5
593	S	29.7	Very low	36.8	Very low	130 Å²	130	122.5 Å²	122.5	91%	0.909	76%	0.761	S	S	*	*			trans	-156.6	149.3	152	-94.2	0	0	0	0	109.4
594	S	36.7	Very low	38.1	Very low	121 Å²	121	123.1 Å²	123.1	85%	0.846	75%	0.753	S	S	*	*			trans	-82.1	140.1	-177.9	53.4	0	0	0	0	113.1
595	S	30.1	Very low	38.2	Very low	118 Å²	118	120 Å²	120	83%	0.825	74%	0.737	S	S	*	*			trans	-144	136.8	143.7	59.4	0	0	0	0	109.9
596	S	38.3	Very low	40.2	Very low	111 Å²	111	117.9 Å²	117.9	78%	0.776	72%	0.719	S	S	*	*			trans	-95.2	119.7	174.4	176.1	0	0	0	0	108.7
597	M	32.3	Very low	42	Very low	172 Å²	172	119 Å²	119	85%	0.847	71%	0.709	S	S	*	*			trans	-145.1	147.4	160.6	-79.1	-55.9	156.2	0	0	111.2
598	K	46.8	Very low	42.7	Very low	197 Å²	197	119 Å²	119	86%	0.857	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-54.5	131.1	-173.8	-55.1	162.3	-176.1	175.6	0	112.5
599	T	35.2	Very low	45	Very low	120 Å²	120	116.4 Å²	116.4	74%	0.736	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-90.6	128.7	160.5	43.9	0	0	0	0	109.9
600	T	49.4	Very low	46.9	Very low	75 Å²	75	116.1 Å²	116.1	46%	0.46	68%	0.676	S	S	.	*	P	Polyproline II helix	trans	-82.5	153.4	178.1	45.2	0	0	0	0	111.5	E602 V603	T600-E602 PolarHBondContact O-N 2.94Å; T600-E602 VanDerWaalsContact O-N 3.11Å; T600-V603 PolarHBondContact O-N 3.15Å; T600-V603 VanDerWaalsContact O-N 3.15Å
601	P	52.8	Low	49	Very low	105 Å²	105	116.4 Å²	116.4	68%	0.682	66%	0.658	S	S	*	*	H	α-helix	trans	-60.8	-23	-178.9	24	-34.6	0	0	0	113.7	V603 M604 A605	P601-V603 VanDerWaalsContact C-N 3.27Å; P601-V603 PolarHBondContact O-N 3.21Å; P601-M604 PolarHBondContact O-N 2.99Å; P601-A605 PolarHBondContact O-N 2.82Å
602	E	46.2	Very low	50.9	Low	145 Å²	145	113.6 Å²	113.6	68%	0.678	65%	0.647	S	S	*	*	H	α-helix	trans	-61.3	-30.2	176.9	-166.2	170.8	-151.1	0	0	113.5	T600 A605 T606	T600-E602 PolarHBondContact O-N 2.94Å; T600-E602 VanDerWaalsContact O-N 3.11Å; E602-A605 PolarHBondContact O-N 3.3Å; E602-T606 WeakPolarHBondContact O-CG2 3.44Å; E602-T606 PolarHBondContact O-N 2.84Å; E602-T606 PolarHBondContact O-OG1 3.08Å
603	V	49.5	Very low	53.6	Low	67 Å²	67	115.2 Å²	115.2	41%	0.406	64%	0.638	S	S	.	*	H	α-helix	trans	-69.4	-44.8	176.7	-174.9	0	0	0	0	110.8	T600 P601 A605 T606 E607	T600-V603 PolarHBondContact O-N 3.15Å; T600-V603 VanDerWaalsContact O-N 3.15Å; P601-V603 VanDerWaalsContact C-N 3.27Å; P601-V603 PolarHBondContact O-N 3.21Å; V603-A605 VanDerWaalsContact C-N 3.34Å; V603-A605 PolarHBondContact O-N 2.77Å; V603-T606 WeakPolarHBondContact CA-OG1 3.4Å; V603-T606 PolarHBondContact O-N 3.38Å; V603-T606 PolarHBondContact O-OG1 3.08Å; V603-E607 WeakPolarHBondContact O-CG 3.48Å; V603-E607 PolarHBondContact O-N 2.86Å
604	M	49.4	Very low	55.8	Low	117 Å²	117	115.1 Å²	115.1	58%	0.576	62%	0.617	S	S	*	*	H	α-helix	trans	-68.3	-34.3	175.9	-68.8	-176.8	-73.4	0	0	112	P601 M608	P601-M604 PolarHBondContact O-N 2.99Å; M604-M608 WeakPolarHBondContact O-CB 3.39Å; M604-M608 WeakPolarHBondContact O-CG 3.41Å; M604-M608 PolarHBondContact O-N 3.49Å
605	A	56.5	Low	57.7	Low	54 Å²	54	115.1 Å²	115.1	45%	0.446	61%	0.607	S	S	.	*	H	α-helix	trans	-63.9	-44.2	173.8	0	0	0	0	0	111.9	P601 E602 V603 M608 V609	P601-A605 PolarHBondContact O-N 2.82Å; E602-A605 PolarHBondContact O-N 3.3Å; V603-A605 VanDerWaalsContact C-N 3.34Å; V603-A605 PolarHBondContact O-N 2.77Å; A605-M608 PolarHBondContact O-N 3.14Å; A605-V609 WeakPolarHBondContact O-CG2 3.43Å; A605-V609 PolarHBondContact O-N 3.38Å
606	T	66.4	Low	59.9	Low	84 Å²	84	113.9 Å²	113.9	52%	0.515	59%	0.588	S	S	.	*	H	α-helix	trans	-69.5	-36.1	177.5	46.1	0	0	0	0	112.7	E602 V603 V609 Q610	E602-T606 WeakPolarHBondContact O-CG2 3.44Å; E602-T606 PolarHBondContact O-N 2.84Å; E602-T606 PolarHBondContact O-OG1 3.08Å; V603-T606 WeakPolarHBondContact CA-OG1 3.4Å; V603-T606 PolarHBondContact O-N 3.38Å; V603-T606 PolarHBondContact O-OG1 3.08Å; T606-V609 PolarHBondContact O-N 3.27Å; T606-Q610 WeakPolarHBondContact O-CB 3.34Å; T606-Q610 PolarHBondContact O-N 3.07Å
607	E	66.1	Low	61.9	Low	117 Å²	117	114.9 Å²	114.9	55%	0.547	58%	0.581	S	S	.	*	H	α-helix	trans	-61.3	-44.4	169.5	-75.5	-170.3	155.3	0	0	112.4	V603 V609 Q610 L611	V603-E607 WeakPolarHBondContact O-CG 3.48Å; V603-E607 PolarHBondContact O-N 2.86Å; E607-V609 PolarHBondContact O-N 3.05Å; E607-Q610 CarbonylContact O-C 3.59Å; E607-Q610 PolarHBondContact O-N 3.45Å; E607-L611 WeakPolarHBondContact O-CB 3.31Å; E607-L611 WeakPolarHBondContact O-CG 3.25Å; E607-L611 PolarHBondContact O-N 3.06Å
608	M	64.3	Low	64.4	Low	121 Å²	121	113.8 Å²	113.8	60%	0.596	57%	0.571	S	S	*	*	H	α-helix	trans	-62.1	-40.2	175.8	-82.5	-70.1	-158.1	0	0	112.8	M604 A605 L611 R612	M604-M608 WeakPolarHBondContact O-CB 3.39Å; M604-M608 WeakPolarHBondContact O-CG 3.41Å; M604-M608 PolarHBondContact O-N 3.49Å; A605-M608 PolarHBondContact O-N 3.14Å; M608-L611 PolarHBondContact O-N 3.19Å; M608-R612 WeakPolarHBondContact O-CG 3.32Å; M608-R612 PolarHBondContact O-N 2.89Å
609	V	74.4	Confident	66.2	Low	84 Å²	84	111.6 Å²	111.6	51%	0.509	56%	0.558	S	S	.	*	H	α-helix	trans	-64.8	-43.1	172.8	170.3	0	0	0	0	110.8	A605 T606 E607 L611 R612 I613	A605-V609 WeakPolarHBondContact O-CG2 3.43Å; A605-V609 PolarHBondContact O-N 3.38Å; T606-V609 PolarHBondContact O-N 3.27Å; E607-V609 PolarHBondContact O-N 3.05Å; V609-L611 VanDerWaalsContact C-N 3.34Å; V609-L611 PolarHBondContact O-N 2.9Å; V609-R612 PolarHBondContact O-N 3Å; V609-I613 HydrophobicContact CG1-CD1 3.91Å; V609-I613 WeakPolarHBondContact O-CG1 3.18Å; V609-I613 PolarHBondContact O-N 3.39Å
610	Q	71.3	Confident	68.8	Low	97 Å²	97	113 Å²	113	45%	0.453	55%	0.554	S	S	.	*	H	α-helix	trans	-67.6	-32.9	179.1	-156.3	-179.7	84.4	0	0	112.3	T606 E607 R614	T606-Q610 WeakPolarHBondContact O-CB 3.34Å; T606-Q610 PolarHBondContact O-N 3.07Å; E607-Q610 CarbonylContact O-C 3.59Å; E607-Q610 PolarHBondContact O-N 3.45Å; Q610-R614 WeakPolarHBondContact O-CB 3.5Å; Q610-R614 WeakPolarHBondContact O-CG 3.29Å; Q610-R614 PolarHBondContact O-N 2.87Å
611	L	74.4	Confident	70	Confident	90 Å²	90	112 Å²	112	47%	0.471	55%	0.552	S	S	.	*	H	α-helix	trans	-65.6	-45.3	169.5	-78.6	167.4	0	0	0	111.8	E607 M608 V609 I613 R614 L615	E607-L611 WeakPolarHBondContact O-CB 3.31Å; E607-L611 WeakPolarHBondContact O-CG 3.25Å; E607-L611 PolarHBondContact O-N 3.06Å; M608-L611 PolarHBondContact O-N 3.19Å; V609-L611 VanDerWaalsContact C-N 3.34Å; V609-L611 PolarHBondContact O-N 2.9Å; L611-I613 VanDerWaalsContact C-N 3.35Å; L611-I613 PolarHBondContact O-N 3.07Å; L611-R614 PolarHBondContact O-N 3.41Å; L611-L615 WeakPolarHBondContact O-CB 3.46Å; L611-L615 VanDerWaalsContact O-CG 3.31Å; L611-L615 WeakPolarHBondContact O-CG 3.39Å; L611-L615 PolarHBondContact O-N 3.46Å
612	R	70.8	Confident	71.2	Confident	189 Å²	189	112.8 Å²	112.8	71%	0.713	55%	0.55	S	S	*	*	H	α-helix	trans	-59.4	-43.8	174.6	-73.1	175.8	-177.7	-155.8	1.4	111.8	M608 V609 L615 E616	M608-R612 WeakPolarHBondContact O-CG 3.32Å; M608-R612 PolarHBondContact O-N 2.89Å; V609-R612 PolarHBondContact O-N 3Å; R612-L615 PolarHBondContact O-N 3.27Å; R612-E616 PolarHBondContact O-N 3.47Å
613	I	84.4	Confident	72.5	Confident	106 Å²	106	111.6 Å²	111.6	54%	0.544	55%	0.545	S	S	.	.	H	α-helix	trans	-61.4	-47.9	175.6	-68.4	166.9	0	0	0	110.8	V609 L611 L615 E616 E617	V609-I613 HydrophobicContact CG1-CD1 3.91Å; V609-I613 WeakPolarHBondContact O-CG1 3.18Å; V609-I613 PolarHBondContact O-N 3.39Å; L611-I613 VanDerWaalsContact C-N 3.35Å; L611-I613 PolarHBondContact O-N 3.07Å; I613-L615 VanDerWaalsContact C-N 3.31Å; I613-L615 PolarHBondContact O-N 2.97Å; I613-E616 PolarHBondContact O-N 3.08Å; I613-E617 WeakPolarHBondContact O-CB 3.34Å; I613-E617 PolarHBondContact O-N 2.93Å
614	R	76.9	Confident	74	Confident	128 Å²	128	111.3 Å²	111.3	48%	0.483	55%	0.549	S	S	.	.	H	α-helix	trans	-61.7	-36	176.7	-75.3	177.8	-178.3	117.4	4.8	113	Q610 L611 K618	Q610-R614 WeakPolarHBondContact O-CB 3.5Å; Q610-R614 WeakPolarHBondContact O-CG 3.29Å; Q610-R614 PolarHBondContact O-N 2.87Å; L611-R614 PolarHBondContact O-N 3.41Å; R614-K618 WeakPolarHBondContact O-CB 3.41Å; R614-K618 WeakPolarHBondContact O-CG 3.35Å; R614-K618 PolarHBondContact O-N 3.4Å
615	L	75.1	Confident	75.2	Confident	120 Å²	120	112.5 Å²	112.5	63%	0.628	55%	0.553	S	S	*	*	H	α-helix	trans	-70.9	-42.6	177.4	-74.4	169.2	0	0	0	112	L611 R612 I613 K618 R619	L611-L615 WeakPolarHBondContact O-CB 3.46Å; L611-L615 VanDerWaalsContact O-CG 3.31Å; L611-L615 WeakPolarHBondContact O-CG 3.39Å; L611-L615 PolarHBondContact O-N 3.46Å; R612-L615 PolarHBondContact O-N 3.27Å; I613-L615 VanDerWaalsContact C-N 3.31Å; I613-L615 PolarHBondContact O-N 2.97Å; L615-K618 PolarHBondContact O-N 3.07Å; L615-R619 WeakPolarHBondContact O-CB 3.43Å; L615-R619 PolarHBondContact O-N 2.92Å
616	E	76.8	Confident	76.5	Confident	92 Å²	92	116.9 Å²	116.9	43%	0.43	56%	0.562	S	S	.	*	H	α-helix	trans	-68.5	-35.4	175.3	-171.5	57.7	-149.3	0	0	111.5	R612 I613 R619 K620	R612-E616 PolarHBondContact O-N 3.47Å; I613-E616 PolarHBondContact O-N 3.08Å; E616-R619 VanDerWaalsContact CD-NH1 3.29Å; E616-R619 WeakPolarHBondContact O-CB 3.44Å; E616-R619 PolarHBondContact O-N 3.4Å; E616-R619 IonicContact OE1-CZ 2.68Å; E616-R619 IonicContact OE1-NE 2.73Å; E616-R619 IonicContact OE1-NH1 3.21Å; E616-R619 PolarHBondContact OE1-NH1 3.08Å; E616-R619 WeakPolarHBondContact OE2-CD 3.48Å; E616-R619 IonicContact OE2-CZ 3.59Å; E616-R619 IonicContact OE2-NE 2.88Å; E616-R619 IonicContact OE2-NH1 3.68Å; E616-R619 PolarHBondContact OE2-NH1 3.44Å; E616-K620 VanDerWaalsContact O-CB 3.24Å; E616-K620 WeakPolarHBondContact O-CB 3.02Å; E616-K620 PolarHBondContact O-N 3.1Å
617	E	80.3	Confident	77.4	Confident	132 Å²	132	120.1 Å²	120.1	62%	0.617	57%	0.569	S	S	*	*	H	α-helix	trans	-65.1	-43.2	171.4	-173.5	174.8	-145.4	0	0	112	I613 R619 K620 A621	I613-E617 WeakPolarHBondContact O-CB 3.34Å; I613-E617 PolarHBondContact O-N 2.93Å; E617-R619 PolarHBondContact O-N 2.99Å; E617-K620 PolarHBondContact O-N 3.43Å; E617-A621 WeakPolarHBondContact O-CB 3.43Å; E617-A621 PolarHBondContact O-N 3.44Å
618	K	84.8	Confident	78.2	Confident	150 Å²	150	122.3 Å²	122.3	65%	0.652	58%	0.577	S	S	*	*	H	α-helix	trans	-59.2	-45	172.4	-72.6	-97.2	-175.5	169.2	0	111.5	R614 L615 A621 I622	R614-K618 WeakPolarHBondContact O-CB 3.41Å; R614-K618 WeakPolarHBondContact O-CG 3.35Å; R614-K618 PolarHBondContact O-N 3.4Å; L615-K618 PolarHBondContact O-N 3.07Å; K618-A621 PolarHBondContact O-N 3.2Å; K618-I622 VanDerWaalsContact O-CG1 3.29Å; K618-I622 WeakPolarHBondContact O-CG1 3.49Å; K618-I622 PolarHBondContact O-N 2.94Å
619	R	85	Confident	78.6	Confident	151 Å²	151	121.4 Å²	121.4	57%	0.57	58%	0.578	S	S	*	*	H	α-helix	trans	-59.2	-49.7	175.1	177.5	-167.3	172.5	-165.7	-0.8	111.3	L615 E616 E617 A621 I622 E623	L615-R619 WeakPolarHBondContact O-CB 3.43Å; L615-R619 PolarHBondContact O-N 2.92Å; E616-R619 VanDerWaalsContact CD-NH1 3.29Å; E616-R619 WeakPolarHBondContact O-CB 3.44Å; E616-R619 PolarHBondContact O-N 3.4Å; E616-R619 IonicContact OE1-CZ 2.68Å; E616-R619 IonicContact OE1-NE 2.73Å; E616-R619 IonicContact OE1-NH1 3.21Å; E616-R619 PolarHBondContact OE1-NH1 3.08Å; E616-R619 WeakPolarHBondContact OE2-CD 3.48Å; E616-R619 IonicContact OE2-CZ 3.59Å; E616-R619 IonicContact OE2-NE 2.88Å; E616-R619 IonicContact OE2-NH1 3.68Å; E616-R619 PolarHBondContact OE2-NH1 3.44Å; E617-R619 PolarHBondContact O-N 2.99Å; R619-A621 VanDerWaalsContact C-N 3.3Å; R619-A621 PolarHBondContact O-N 2.98Å; R619-I622 WeakPolarHBondContact O-CB 3.22Å; R619-I622 PolarHBondContact O-N 3.46Å; R619-I622 VanDerWaalsContact O-N 3.17Å; R619-E623 PolarHBondContact O-N 2.85Å
620	K	89.1	Confident	78.5	Confident	149 Å²	149	123.1 Å²	123.1	65%	0.648	58%	0.58	S	S	*	*	H	α-helix	trans	-62.4	-34.9	177.9	-169.5	174	-175.9	176.3	0	112.3	E616 E617 A624	E616-K620 VanDerWaalsContact O-CB 3.24Å; E616-K620 WeakPolarHBondContact O-CB 3.02Å; E616-K620 PolarHBondContact O-N 3.1Å; E617-K620 PolarHBondContact O-N 3.43Å; K620-A624 VanDerWaalsContact O-CB 3.25Å; K620-A624 WeakPolarHBondContact O-CB 3.3Å; K620-A624 PolarHBondContact O-N 3.36Å
621	A	75.8	Confident	78.5	Confident	53 Å²	53	120.8 Å²	120.8	44%	0.438	58%	0.577	S	S	.	*	H	α-helix	trans	-68.6	-41.5	172.9	0	0	0	0	0	112.5	E617 K618 R619 A624 Q625	E617-A621 WeakPolarHBondContact O-CB 3.43Å; E617-A621 PolarHBondContact O-N 3.44Å; K618-A621 PolarHBondContact O-N 3.2Å; R619-A621 VanDerWaalsContact C-N 3.3Å; R619-A621 PolarHBondContact O-N 2.98Å; A621-A624 PolarHBondContact O-N 3.04Å; A621-Q625 WeakPolarHBondContact O-CG 3.24Å; A621-Q625 PolarHBondContact O-N 2.95Å
622	I	76.9	Confident	78.3	Confident	123 Å²	123	119.2 Å²	119.2	63%	0.631	58%	0.577	S	S	*	*	H	α-helix	trans	-62.2	-45	173.8	-69.3	162	0	0	0	110.4	K618 R619 Q625 K626	K618-I622 VanDerWaalsContact O-CG1 3.29Å; K618-I622 WeakPolarHBondContact O-CG1 3.49Å; K618-I622 PolarHBondContact O-N 2.94Å; R619-I622 WeakPolarHBondContact O-CB 3.22Å; R619-I622 PolarHBondContact O-N 3.46Å; R619-I622 VanDerWaalsContact O-N 3.17Å; I622-Q625 PolarHBondContact O-N 3.12Å; I622-K626 PolarHBondContact O-N 3.41Å
623	E	74.4	Confident	77.9	Confident	120 Å²	120	116.8 Å²	116.8	56%	0.561	57%	0.572	S	S	*	*	H	α-helix	trans	-65.8	-39.2	177.1	-173.2	166.8	-152.1	0	0	112.3	R619 Q625 K626 K627	R619-E623 PolarHBondContact O-N 2.85Å; E623-Q625 VanDerWaalsContact C-N 3.35Å; E623-Q625 PolarHBondContact O-N 2.85Å; E623-K626 PolarHBondContact O-N 3.4Å; E623-K627 WeakPolarHBondContact O-CB 3.43Å; E623-K627 PolarHBondContact O-N 2.96Å
624	A	81.8	Confident	77.1	Confident	60 Å²	60	113.7 Å²	113.7	50%	0.496	56%	0.559	S	S	.	*	H	α-helix	trans	-63.2	-37.9	172.3	0	0	0	0	0	112.4	K620 A621 K628	K620-A624 VanDerWaalsContact O-CB 3.25Å; K620-A624 WeakPolarHBondContact O-CB 3.3Å; K620-A624 PolarHBondContact O-N 3.36Å; A621-A624 PolarHBondContact O-N 3.04Å; A624-K628 VanDerWaalsContact O-CB 3.31Å; A624-K628 WeakPolarHBondContact O-CB 3.28Å; A624-K628 PolarHBondContact O-N 2.93Å
625	Q	74.7	Confident	77.3	Confident	142 Å²	142	116.1 Å²	116.1	66%	0.664	57%	0.568	S	S	*	*	H	α-helix	trans	-68.1	-44.5	173	-72.8	-154.8	13.6	0	0	112.2	A621 I622 E623 K627 K628 V629	A621-Q625 WeakPolarHBondContact O-CG 3.24Å; A621-Q625 PolarHBondContact O-N 2.95Å; I622-Q625 PolarHBondContact O-N 3.12Å; E623-Q625 VanDerWaalsContact C-N 3.35Å; E623-Q625 PolarHBondContact O-N 2.85Å; Q625-K627 VanDerWaalsContact C-N 3.34Å; Q625-K627 PolarHBondContact O-N 3.29Å; Q625-K628 WeakPolarHBondContact O-CB 3.46Å; Q625-K628 PolarHBondContact O-N 3.31Å; Q625-K628 VanDerWaalsContact O-N 3.08Å; Q625-V629 WeakPolarHBondContact O-CG2 3.45Å; Q625-V629 PolarHBondContact O-N 3.35Å
626	K	83.3	Confident	77.1	Confident	146 Å²	146	115.7 Å²	115.7	64%	0.635	56%	0.562	S	S	*	*	H	α-helix	trans	-53.6	-50.6	172.8	-179.4	-174.2	174	-172.1	0	110.9	I622 E623 K628 V629 E630	I622-K626 PolarHBondContact O-N 3.41Å; E623-K626 PolarHBondContact O-N 3.4Å; K626-K628 VanDerWaalsContact C-N 3.29Å; K626-K628 PolarHBondContact O-N 2.88Å; K626-V629 PolarHBondContact O-N 3.38Å; K626-E630 WeakPolarHBondContact O-CB 3.19Å; K626-E630 PolarHBondContact O-N 2.92Å
627	K	84.5	Confident	76.5	Confident	153 Å²	153	118.5 Å²	118.5	67%	0.665	57%	0.569	S	S	*	*	H	α-helix	trans	-62.4	-33.3	177.4	-168.8	169.9	-173.9	169.8	0	112.7	E623 Q625 A631	E623-K627 WeakPolarHBondContact O-CB 3.43Å; E623-K627 PolarHBondContact O-N 2.96Å; Q625-K627 VanDerWaalsContact C-N 3.34Å; Q625-K627 PolarHBondContact O-N 3.29Å; K627-A631 WeakPolarHBondContact O-CB 3.3Å; K627-A631 PolarHBondContact O-N 3.3Å
628	K	83.3	Confident	76.4	Confident	163 Å²	163	118 Å²	118	71%	0.709	57%	0.567	S	S	*	*	H	α-helix	trans	-70.8	-39.5	174.5	-171.8	178.1	179.4	-177	0	112.3	A624 Q625 K626 A632	A624-K628 VanDerWaalsContact O-CB 3.31Å; A624-K628 WeakPolarHBondContact O-CB 3.28Å; A624-K628 PolarHBondContact O-N 2.93Å; Q625-K628 WeakPolarHBondContact O-CB 3.46Å; Q625-K628 PolarHBondContact O-N 3.31Å; Q625-K628 VanDerWaalsContact O-N 3.08Å; K626-K628 VanDerWaalsContact C-N 3.29Å; K626-K628 PolarHBondContact O-N 2.88Å; K628-A632 WeakPolarHBondContact O-CB 3.24Å; K628-A632 PolarHBondContact O-N 3.46Å
629	V	73.6	Confident	75.9	Confident	101 Å²	101	118.5 Å²	118.5	61%	0.612	57%	0.569	S	S	*	*	H	α-helix	trans	-66	-45.4	173.4	172.3	0	0	0	0	110.6	Q625 K626 A631 A632 F633	Q625-V629 WeakPolarHBondContact O-CG2 3.45Å; Q625-V629 PolarHBondContact O-N 3.35Å; K626-V629 PolarHBondContact O-N 3.38Å; V629-A631 PolarHBondContact O-N 2.92Å; V629-A632 WeakPolarHBondContact O-CB 3.43Å; V629-A632 PolarHBondContact O-N 2.99Å; V629-A632 VanDerWaalsContact O-N 3.13Å; V629-F633 WeakPolarHBondContact O-CB 3.37Å; V629-F633 PolarHBondContact O-N 3.29Å
630	E	71.1	Confident	74.7	Confident	120 Å²	120	116.5 Å²	116.5	56%	0.561	57%	0.567	S	S	*	*	H	α-helix	trans	-62.4	-40.5	176.8	-171.3	178.7	171.2	0	0	112.4	K626 F633 T634	K626-E630 WeakPolarHBondContact O-CB 3.19Å; K626-E630 PolarHBondContact O-N 2.92Å; E630-F633 PolarHBondContact O-N 2.75Å; E630-T634 VanDerWaalsContact O-CB 3.32Å; E630-T634 WeakPolarHBondContact O-CB 3.34Å; E630-T634 PolarHBondContact O-N 3.02Å; E630-T634 PolarHBondContact O-OG1 3.27Å
631	A	72.3	Confident	73.9	Confident	48 Å²	48	111.4 Å²	111.4	40%	0.397	56%	0.557	S	S	.	*	H	α-helix	trans	-67.2	-36.3	172.2	0	0	0	0	0	112.6	K627 V629 R635	K627-A631 WeakPolarHBondContact O-CB 3.3Å; K627-A631 PolarHBondContact O-N 3.3Å; V629-A631 PolarHBondContact O-N 2.92Å; A631-R635 WeakPolarHBondContact O-CB 3.43Å; A631-R635 WeakPolarHBondContact O-CG 3.47Å; A631-R635 PolarHBondContact O-N 2.91Å
632	A	69.9	Low	73.3	Confident	57 Å²	57	114.3 Å²	114.3	47%	0.471	56%	0.561	S	S	.	*	H	α-helix	trans	-66.9	-43.9	174.6	0	0	0	0	0	111.6	K628 V629 R635 H636	K628-A632 WeakPolarHBondContact O-CB 3.24Å; K628-A632 PolarHBondContact O-N 3.46Å; V629-A632 WeakPolarHBondContact O-CB 3.43Å; V629-A632 PolarHBondContact O-N 2.99Å; V629-A632 VanDerWaalsContact O-N 3.13Å; A632-R635 PolarHBondContact O-N 3.48Å; A632-H636 WeakPolarHBondContact O-CB 3.31Å; A632-H636 PolarHBondContact O-N 3.4Å
633	F	62.3	Low	72.7	Confident	138 Å²	138	111.5 Å²	111.5	61%	0.605	55%	0.552	S	S	*	*	H	α-helix	trans	-63.6	-41	175	-164.9	-96.9	0	0	0	111.6	V629 E630 H636 R637	V629-F633 WeakPolarHBondContact O-CB 3.37Å; V629-F633 PolarHBondContact O-N 3.29Å; E630-F633 PolarHBondContact O-N 2.75Å; F633-H636 PolarHBondContact O-N 3.44Å; F633-R637 WeakPolarHBondContact O-CB 3.44Å; F633-R637 PolarHBondContact O-N 3.31Å
634	T	68.4	Low	72.1	Confident	42 Å²	42	108.3 Å²	108.3	26%	0.258	55%	0.547	S	S	.	.	H	α-helix	trans	-63.9	-43	174.2	-61.7	0	0	0	0	111.8	E630 H636 R637 Q638	E630-T634 VanDerWaalsContact O-CB 3.32Å; E630-T634 WeakPolarHBondContact O-CB 3.34Å; E630-T634 PolarHBondContact O-N 3.02Å; E630-T634 PolarHBondContact O-OG1 3.27Å; T634-H636 VanDerWaalsContact C-N 3.35Å; T634-R637 PolarHBondContact O-N 3.45Å; T634-Q638 WeakPolarHBondContact O-CB 3.37Å; T634-Q638 WeakPolarHBondContact O-CG 3.05Å; T634-Q638 PolarHBondContact O-N 3.48Å
635	R	79.4	Confident	70.9	Confident	179 Å²	179	111.7 Å²	111.7	68%	0.675	55%	0.55	S	S	*	*	H	α-helix	trans	-64.3	-36.3	173	-78.3	178.5	174.2	-163.3	-1.9	112.5	A631 A632 Q638 K639	A631-R635 WeakPolarHBondContact O-CB 3.43Å; A631-R635 WeakPolarHBondContact O-CG 3.47Å; A631-R635 PolarHBondContact O-N 2.91Å; A632-R635 PolarHBondContact O-N 3.48Å; R635-Q638 PolarHBondContact O-N 3.14Å; R635-K639 WeakPolarHBondContact O-CG 3.48Å; R635-K639 PolarHBondContact O-N 3.17Å
636	H	71.4	Confident	70.6	Confident	110 Å²	110	109.4 Å²	109.4	51%	0.509	54%	0.542	S	S	.	.	H	α-helix	trans	-66.4	-47.1	174.6	-176.9	83.3	0	0	0	111	A632 F633 T634 Q638 K639 M640	A632-H636 WeakPolarHBondContact O-CB 3.31Å; A632-H636 PolarHBondContact O-N 3.4Å; F633-H636 PolarHBondContact O-N 3.44Å; T634-H636 VanDerWaalsContact C-N 3.35Å; H636-Q638 VanDerWaalsContact C-N 3.29Å; H636-Q638 PolarHBondContact O-N 3.11Å; H636-K639 PolarHBondContact O-N 2.87Å; H636-K639 VanDerWaalsContact O-N 3.1Å; H636-M640 WeakPolarHBondContact O-CG 3.34Å; H636-M640 PolarHBondContact O-N 3.26Å
637	R	65	Low	69.3	Low	152 Å²	152	106.7 Å²	106.7	57%	0.574	54%	0.535	S	S	*	.	H	α-helix	trans	-57.2	-41	173.1	-169.9	177.3	71.7	-132.7	0.9	112	F633 T634 G641	F633-R637 WeakPolarHBondContact O-CB 3.44Å; F633-R637 PolarHBondContact O-N 3.31Å; T634-R637 PolarHBondContact O-N 3.45Å; R637-G641 PolarHBondContact O-N 3.3Å
638	Q	78.1	Confident	68.2	Low	122 Å²	122	104 Å²	104	57%	0.57	53%	0.531	S	S	*	.	H	α-helix	trans	-64.9	-43	173.7	-76.2	172.8	-25.3	0	0	112.5	T634 R635 H636 G641 H642	T634-Q638 WeakPolarHBondContact O-CB 3.37Å; T634-Q638 WeakPolarHBondContact O-CG 3.05Å; T634-Q638 PolarHBondContact O-N 3.48Å; R635-Q638 PolarHBondContact O-N 3.14Å; H636-Q638 VanDerWaalsContact C-N 3.29Å; H636-Q638 PolarHBondContact O-N 3.11Å; Q638-G641 PolarHBondContact O-N 2.87Å; Q638-H642 VanDerWaalsContact O-CB 3.27Å; Q638-H642 WeakPolarHBondContact O-CB 3.49Å; Q638-H642 PolarHBondContact O-N 3.2Å
639	K	73.1	Confident	66.9	Low	159 Å²	159	99.5 Å²	99.5	69%	0.691	52%	0.517	S	S	*	.	H	α-helix	trans	-63.2	-43.1	175.1	-78	-175.4	174.3	-167.4	0	112.4	R635 H636 H642 S643	R635-K639 WeakPolarHBondContact O-CG 3.48Å; R635-K639 PolarHBondContact O-N 3.17Å; H636-K639 PolarHBondContact O-N 2.87Å; H636-K639 VanDerWaalsContact O-N 3.1Å; K639-H642 PolarHBondContact O-N 3.25Å; K639-S643 WeakPolarHBondContact O-CB 3.32Å; K639-S643 PolarHBondContact O-N 2.84Å
640	M	60.7	Low	65.8	Low	110 Å²	110	101 Å²	101	54%	0.542	52%	0.515	S	S	.	.	H	α-helix	trans	-63.1	-44.5	175.2	-68.8	-63.4	-75.7	0	0	111.2	H636 H642 S643 A644	H636-M640 WeakPolarHBondContact O-CG 3.34Å; H636-M640 PolarHBondContact O-N 3.26Å; M640-H642 PolarHBondContact O-N 2.99Å; M640-S643 PolarHBondContact O-N 3.41Å; M640-A644 WeakPolarHBondContact O-CB 3.46Å; M640-A644 PolarHBondContact O-N 3.49Å
641	G	71.1	Confident	65	Low	42 Å²	42	102.5 Å²	102.5	43%	0.433	52%	0.516	S	S	.	.	H	α-helix	trans	-62.4	-38.9	173.7	0	0	0	0	0	113.5	R637 Q638 A644 F645	R637-G641 PolarHBondContact O-N 3.3Å; Q638-G641 PolarHBondContact O-N 2.87Å; G641-A644 PolarHBondContact O-N 2.96Å; G641-F645 VanDerWaalsContact O-CB 3.25Å; G641-F645 WeakPolarHBondContact O-CB 3.3Å; G641-F645 PolarHBondContact O-N 3.28Å
642	H	64	Low	63.5	Low	114 Å²	114	109 Å²	109	53%	0.528	54%	0.535	S	S	.	.	H	α-helix	trans	-72.7	-32.6	178	-162.6	-46.5	0	0	0	112.3	Q638 K639 M640 L646	Q638-H642 VanDerWaalsContact O-CB 3.27Å; Q638-H642 WeakPolarHBondContact O-CB 3.49Å; Q638-H642 PolarHBondContact O-N 3.2Å; K639-H642 PolarHBondContact O-N 3.25Å; M640-H642 PolarHBondContact O-N 2.99Å; H642-L646 WeakPolarHBondContact O-CB 3.39Å; H642-L646 VanDerWaalsContact O-CG 3.31Å; H642-L646 WeakPolarHBondContact O-CG 3.42Å; H642-L646 PolarHBondContact O-N 2.86Å
643	S	64.9	Low	62.1	Low	63 Å²	63	109.5 Å²	109.5	44%	0.441	54%	0.539	S	S	.	.	H	α-helix	trans	-68.9	-45.6	171	177.2	0	0	0	0	111.3	K639 M640 F645 L646 N647	K639-S643 WeakPolarHBondContact O-CB 3.32Å; K639-S643 PolarHBondContact O-N 2.84Å; M640-S643 PolarHBondContact O-N 3.41Å; S643-F645 VanDerWaalsContact C-N 3.34Å; S643-F645 PolarHBondContact O-N 2.88Å; S643-L646 PolarHBondContact O-N 3.12Å; S643-N647 PolarHBondContact O-N 2.97Å
644	A	62.4	Low	61.2	Low	54 Å²	54	108.8 Å²	108.8	45%	0.446	54%	0.541	S	S	.	.	H	α-helix	trans	-61	-42.7	174.1	0	0	0	0	0	111.7	M640 G641 N647 V648	M640-A644 WeakPolarHBondContact O-CB 3.46Å; M640-A644 PolarHBondContact O-N 3.49Å; G641-A644 PolarHBondContact O-N 2.96Å; A644-N647 PolarHBondContact O-N 3.36Å; A644-V648 WeakPolarHBondContact O-CG2 3.38Å; A644-V648 PolarHBondContact O-N 3.42Å
645	F	56.1	Low	60	Low	130 Å²	130	109.9 Å²	109.9	57%	0.57	56%	0.562	S	S	*	*	H	α-helix	trans	-62	-46.1	175.6	-178.3	-104.3	0	0	0	112.1	G641 S643 N647 V648 V649	G641-F645 VanDerWaalsContact O-CB 3.25Å; G641-F645 WeakPolarHBondContact O-CB 3.3Å; G641-F645 PolarHBondContact O-N 3.28Å; S643-F645 VanDerWaalsContact C-N 3.34Å; S643-F645 PolarHBondContact O-N 2.88Å; F645-N647 VanDerWaalsContact C-N 3.31Å; F645-N647 PolarHBondContact O-N 3.46Å; F645-V648 PolarHBondContact O-N 3.06Å; F645-V649 HydrophobicContact CD1-CG2 4.09Å; F645-V649 HydrophobicContact CD2-CG2 4.38Å; F645-V649 HydrophobicContact CE1-CG2 3.69Å; F645-V649 HydrophobicContact CE2-CG2 4Å; F645-V649 HydrophobicContact CG-CG2 4.43Å; F645-V649 HydrophobicContact CZ-CG2 3.64Å; F645-V649 WeakPolarHBondContact O-CB 3.45Å; F645-V649 WeakPolarHBondContact O-CG2 3.44Å; F645-V649 PolarHBondContact O-N 2.64Å
646	L	67.9	Low	57.7	Low	94 Å²	94	105.7 Å²	105.7	49%	0.492	57%	0.565	S	S	.	*	H	α-helix	trans	-62.8	-35.5	175.7	-75.4	172.1	0	0	0	112.6	H642 S643 V649 K650	H642-L646 WeakPolarHBondContact O-CB 3.39Å; H642-L646 VanDerWaalsContact O-CG 3.31Å; H642-L646 WeakPolarHBondContact O-CG 3.42Å; H642-L646 PolarHBondContact O-N 2.86Å; S643-L646 PolarHBondContact O-N 3.12Å; L646-V649 PolarHBondContact O-N 3.43Å; L646-K650 WeakPolarHBondContact O-CB 3Å; L646-K650 PolarHBondContact O-N 3.23Å
647	N	56.3	Low	55.8	Low	90 Å²	90	105.5 Å²	105.5	48%	0.481	58%	0.582	S	S	.	*	H	α-helix	trans	-67.5	-38.3	173.9	-74.1	-2.9	0	0	0	112.5	S643 A644 F645 K650 R651	S643-N647 PolarHBondContact O-N 2.97Å; A644-N647 PolarHBondContact O-N 3.36Å; F645-N647 VanDerWaalsContact C-N 3.31Å; F645-N647 PolarHBondContact O-N 3.46Å; N647-K650 PolarHBondContact O-N 3.26Å; N647-R651 WeakPolarHBondContact O-CG 3.45Å; N647-R651 PolarHBondContact O-N 3.45Å
648	V	60.6	Low	54.2	Low	96 Å²	96	104 Å²	104	58%	0.582	60%	0.596	S	S	*	*	H	α-helix	trans	-69.8	-39.9	175	171.5	0	0	0	0	111.5	A644 F645 K652	A644-V648 WeakPolarHBondContact O-CG2 3.38Å; A644-V648 PolarHBondContact O-N 3.42Å; F645-V648 PolarHBondContact O-N 3.06Å; V648-K652 PolarHBondContact O-N 2.91Å
649	V	55.9	Low	52.1	Low	68 Å²	68	101.5 Å²	101.5	41%	0.412	60%	0.602	S	S	.	*	H	α-helix	trans	-64.9	-40.6	174	170.6	0	0	0	0	110.7	F645 L646 K652 A653	F645-V649 HydrophobicContact CD1-CG2 4.09Å; F645-V649 HydrophobicContact CD2-CG2 4.38Å; F645-V649 HydrophobicContact CE1-CG2 3.69Å; F645-V649 HydrophobicContact CE2-CG2 4Å; F645-V649 HydrophobicContact CG-CG2 4.43Å; F645-V649 HydrophobicContact CZ-CG2 3.64Å; F645-V649 WeakPolarHBondContact O-CB 3.45Å; F645-V649 WeakPolarHBondContact O-CG2 3.44Å; F645-V649 PolarHBondContact O-N 2.64Å; L646-V649 PolarHBondContact O-N 3.43Å; V649-K652 CarbonylContact O-C 3.47Å; V649-K652 PolarHBondContact O-N 3.01Å; V649-K652 VanDerWaalsContact O-N 3.1Å; V649-A653 PolarHBondContact O-N 2.67Å
650	K	52	Low	50.1	Low	133 Å²	133	101.5 Å²	101.5	58%	0.578	61%	0.609	S	S	*	*	H	α-helix	trans	-63.8	-48.9	175.5	-176.8	165.5	-177.8	174.8	0	112.2	L646 N647 K652 A653 D654	L646-K650 WeakPolarHBondContact O-CB 3Å; L646-K650 PolarHBondContact O-N 3.23Å; N647-K650 PolarHBondContact O-N 3.26Å; K650-K652 PolarHBondContact O-N 3.23Å; K650-A653 PolarHBondContact O-N 3.17Å; K650-D654 WeakPolarHBondContact CE-OD2 3.39Å; K650-D654 WeakPolarHBondContact CG-OD2 3.48Å; K650-D654 PolarHBondContact O-N 2.61Å; K650-D654 VanDerWaalsContact O-N 3.17Å
651	R	53.4	Low	48.6	Very low	151 Å²	151	105 Å²	105	57%	0.57	63%	0.625	S	S	*	*	H	α-helix	trans	-57.9	-14.5	172.1	-72.7	-166.9	-146.2	-150.6	-1	114.2	N647 E694	N647-R651 WeakPolarHBondContact O-CG 3.45Å; N647-R651 PolarHBondContact O-N 3.45Å; R651-E694 IonicContact CZ-OE2 3.94Å; R651-E694 IonicContact NH1-OE2 2.78Å; R651-E694 IonicContact NH2-OE1 3.74Å; R651-E694 PolarHBondContact NH2-OE1 3.03Å; R651-E694 IonicContact NH2-OE2 2.73Å; R651-E694 PolarHBondContact NH2-OE2 2.97Å
652	K	41	Very low	46.5	Very low	185 Å²	185	106.9 Å²	106.9	80%	0.804	64%	0.644	S	S	*	*	H	α-helix	trans	-103.8	-7	175.2	-167.8	155.8	-175.3	167	0	113.9	V648 V649 K650	V648-K652 PolarHBondContact O-N 2.91Å; V649-K652 CarbonylContact O-C 3.47Å; V649-K652 PolarHBondContact O-N 3.01Å; V649-K652 VanDerWaalsContact O-N 3.1Å; K650-K652 PolarHBondContact O-N 3.23Å
653	A	39.8	Very low	44.8	Very low	68 Å²	68	104.8 Å²	104.8	56%	0.562	65%	0.653	S	S	*	*	H	α-helix	trans	-88.4	-37.8	170.8	0	0	0	0	0	111.4	V649 K650 G655	V649-A653 PolarHBondContact O-N 2.67Å; K650-A653 PolarHBondContact O-N 3.17Å; A653-G655 PolarHBondContact O-N 3.26Å
654	D	43	Very low	42.9	Very low	122 Å²	122	111.3 Å²	111.3	65%	0.652	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	34.8	-176.2	-53.6	-29.3	0	0	0	113.2	K650	K650-D654 WeakPolarHBondContact CE-OD2 3.39Å; K650-D654 WeakPolarHBondContact CG-OD2 3.48Å; K650-D654 PolarHBondContact O-N 2.61Å; K650-D654 VanDerWaalsContact O-N 3.17Å
655	G	43.3	Very low	41.2	Very low	66 Å²	66	114 Å²	114	68%	0.68	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-146.6	24.4	-165.2	0	0	0	0	0	117	A653	A653-G655 PolarHBondContact O-N 3.26Å
656	A	32	Very low	39.7	Very low	90 Å²	90	115.6 Å²	115.6	74%	0.744	70%	0.702	S	S	*	*	S	Bend	trans	-151.1	133.7	174.5	0	0	0	0	0	112.4
657	A	31.2	Very low	37.8	Very low	106 Å²	106	114.9 Å²	114.9	88%	0.876	72%	0.717	S	S	*	*			trans	61.9	145.4	-170.7	0	0	0	0	0	114.1
658	S	31.1	Very low	36.3	Very low	122 Å²	122	120.4 Å²	120.4	85%	0.853	74%	0.741	S	S	*	*			cis	-152.7	174.7	-8.7	46.2	0	0	0	0	106.5
659	G	34.5	Very low	34.7	Very low	68 Å²	68	119 Å²	119	70%	0.701	75%	0.746	S	S	*	*			cis	124.7	117.9	6.4	0	0	0	0	0	111.1
660	D	31.7	Very low	33.3	Very low	159 Å²	159	125.5 Å²	125.5	85%	0.85	77%	0.768	S	S	*	*			trans	86.4	150.7	166.3	-135.1	-6.6	0	0	0	121.6
661	E	29.3	Very low	32	Very low	184 Å²	184	126.3 Å²	126.3	86%	0.86	78%	0.778	S	S	*	*			trans	51.9	168.5	173.8	-54.4	-152.9	122.8	0	0	118.5
662	G	26.5	Very low	30.6	Very low	81 Å²	81	127.4 Å²	127.4	84%	0.835	79%	0.787	S	S	*	*			cis	142.8	137.2	-7.9	0	0	0	0	0	111.9
663	G	27	Very low	30	Very low	70 Å²	70	124 Å²	124	72%	0.722	78%	0.782	S	S	*	*			cis	176.4	151	-11.6	0	0	0	0	0	112.8
664	Q	26.4	Very low	30.1	Very low	200 Å²	200	126.8 Å²	126.8	94%	0.935	79%	0.794	S	S	*	*			trans	63.6	165.3	179.9	-60	177.8	-53.3	0	0	115.4
665	T	25.7	Very low	29.5	Very low	112 Å²	112	123.9 Å²	123.9	69%	0.687	79%	0.793	S	S	*	*			cis	-139.5	149.4	13	50.3	0	0	0	0	114
666	D	24.4	Very low	29	Very low	162 Å²	162	127.2 Å²	127.2	87%	0.866	81%	0.806	S	S	*	*			trans	38.8	136.8	139.7	-50	-42.6	0	0	0	124.5
667	G	28.1	Very low	28.8	Very low	79 Å²	79	126.8 Å²	126.8	81%	0.814	81%	0.811	S	S	*	*			trans	170.1	116.3	165.4	0	0	0	0	0	114.5
668	E	26	Very low	28.8	Very low	207 Å²	207	129.9 Å²	129.9	97%	0.967	81%	0.813	S	S	*	*			trans	-67.7	153	-174.2	-58.3	176.4	88.9	0	0	114.8
669	G	26.8	Very low	28.7	Very low	67 Å²	67	132.9 Å²	132.9	69%	0.691	81%	0.813	S	S	*	*			cis	159.1	-173.2	-5.3	0	0	0	0	0	113.6
670	K	25.6	Very low	28.5	Very low	204 Å²	204	133.6 Å²	133.6	89%	0.887	82%	0.821	S	S	*	*			trans	71.2	120	161	-144	166.3	-168.7	166.2	0	116.6
671	L	25.8	Very low	28.5	Very low	149 Å²	149	129.8 Å²	129.8	78%	0.78	82%	0.819	S	S	*	*			cis	-168.3	169.3	-9.3	-140.5	67.7	0	0	0	106
672	K	23.9	Very low	28.6	Very low	174 Å²	174	130.4 Å²	130.4	76%	0.757	82%	0.822	S	S	*	*			cis	-147.7	-130.8	7.8	-163.2	179.6	174.9	-178.5	0	110.4
673	T	28.2	Very low	28.9	Very low	115 Å²	115	132.3 Å²	132.3	71%	0.706	82%	0.823	S	S	*	*			trans	-173.9	178.9	-158.8	23.2	0	0	0	0	109.4
674	P	42.6	Very low	29.1	Very low	125 Å²	125	137.7 Å²	137.7	81%	0.812	83%	0.828	S	S	*	*			cis	-127.8	-178.1	-5	23.2	1.6	0	0	0	114
675	G	29.3	Very low	29.5	Very low	62 Å²	62	133 Å²	133	64%	0.639	82%	0.824	S	S	*	*			cis	169.6	177.7	-6.4	0	0	0	0	0	114.7
676	S	32.5	Very low	30	Very low	135 Å²	135	136 Å²	136	94%	0.944	83%	0.83	S	S	*	*			trans	67.9	136.4	170.8	67.8	0	0	0	0	120.5
677	G	29.3	Very low	30.8	Very low	82 Å²	82	135.1 Å²	135.1	85%	0.845	82%	0.824	S	S	*	*			trans	166.9	10.1	166.5	0	0	0	0	0	126.1
678	D	30.7	Very low	32.2	Very low	171 Å²	171	135.1 Å²	135.1	91%	0.914	81%	0.808	S	S	*	*			trans	60.3	176.8	162.2	-102.2	24.8	0	0	0	124.2
679	E	29.5	Very low	33.2	Very low	184 Å²	184	133.6 Å²	133.6	86%	0.86	80%	0.801	S	S	*	*			trans	-94.9	161.7	-145.1	-54.2	-161.8	112.5	0	0	120.6
680	G	30.2	Very low	34.6	Very low	84 Å²	84	133.5 Å²	133.5	87%	0.866	79%	0.794	S	S	*	*			trans	88.2	135.4	140.8	0	0	0	0	0	118.7
681	G	30.9	Very low	36	Very low	79 Å²	79	127.5 Å²	127.5	81%	0.814	77%	0.771	S	S	*	*			cis	-168.5	159.3	-3.6	0	0	0	0	0	111.2
682	Q	32	Very low	37.8	Very low	197 Å²	197	125.8 Å²	125.8	92%	0.921	76%	0.762	S	S	*	*			trans	-107.9	163.8	-167.1	-73.3	-177.5	-9.2	0	0	112.4
683	S	31.2	Very low	39.9	Very low	121 Å²	121	120.6 Å²	120.6	85%	0.846	75%	0.748	S	S	*	*				-174.4	160.7	64.5	47.6	0	0	0	0	114.2
684	H	32.4	Very low	41.6	Very low	182 Å²	182	118.9 Å²	118.9	84%	0.843	73%	0.732	S	S	*	*			trans	-135.3	132	177.6	-164.7	-74	0	0	0	108
685	A	33.9	Very low	42.5	Very low	101 Å²	101	120.4 Å²	120.4	84%	0.835	72%	0.723	S	S	*	*			trans	-68.6	138.8	-173.1	0	0	0	0	0	112.2
686	Q	37	Very low	44.7	Very low	177 Å²	177	120.9 Å²	120.9	83%	0.827	71%	0.713	S	S	*	*			trans	-124.1	124.6	-176.1	-172.7	172.3	-1.3	0	0	108.9
687	I	42	Very low	47	Very low	142 Å²	142	121.4 Å²	121.4	73%	0.728	70%	0.695	S	S	*	*			trans	-73.6	134.8	-179.1	-59.2	174.2	0	0	0	108.9	D691	I687-D691 HydrophobicContact CG2-CB 4.13Å
688	T	55.6	Low	49	Very low	79 Å²	79	120.4 Å²	120.4	49%	0.485	67%	0.674	S	S	.	*			trans	-95.4	157.4	-175.1	70.2	0	0	0	0	112.9	A690 D691 L692	T688-A690 PolarHBondContact O-N 3.3Å; T688-D691 PolarHBondContact O-N 3.25Å; T688-D691 VanDerWaalsContact O-N 3.1Å; T688-D691 PolarHBondContact OG1-OD2 3.18Å; T688-L692 PolarHBondContact O-N 3.23Å
689	E	48.2	Very low	51.1	Low	175 Å²	175	115.6 Å²	115.6	82%	0.818	65%	0.648	S	S	*	*	H	α-helix	trans	-61.7	-24.3	178.1	-164.3	173	173.6	0	0	113.1	S693	E689-S693 PolarHBondContact O-N 3.43Å; E689-S693 PolarHBondContact O-OG 3.38Å
690	A	55.9	Low	53.4	Low	66 Å²	66	112.5 Å²	112.5	55%	0.545	63%	0.634	S	S	.	*	H	α-helix	trans	-67.1	-40.1	173	0	0	0	0	0	112.8	T688 S693 E694	T688-A690 PolarHBondContact O-N 3.3Å; A690-S693 PolarHBondContact O-N 2.99Å; A690-S693 PolarHBondContact O-OG 2.92Å; A690-S693 VanDerWaalsContact O-OG 3.05Å; A690-E694 PolarHBondContact O-N 2.98Å
691	D	54.2	Low	55.7	Low	77 Å²	77	115 Å²	115	41%	0.412	62%	0.621	S	S	.	*	H	α-helix	trans	-67.4	-38.1	176.3	-73.9	-56.5	0	0	0	111.4	I687 T688 S693 E694 Y695	I687-D691 HydrophobicContact CG2-CB 4.13Å; T688-D691 PolarHBondContact O-N 3.25Å; T688-D691 VanDerWaalsContact O-N 3.1Å; T688-D691 PolarHBondContact OG1-OD2 3.18Å; D691-S693 VanDerWaalsContact C-N 3.32Å; D691-S693 PolarHBondContact O-N 3.16Å; D691-E694 PolarHBondContact O-N 2.71Å; D691-Y695 VanDerWaalsContact O-CB 3.23Å; D691-Y695 WeakPolarHBondContact O-CB 3.08Å; D691-Y695 PolarHBondContact O-N 3.38Å
692	L	64.6	Low	57.3	Low	113 Å²	113	117.2 Å²	117.2	59%	0.592	61%	0.613	S	S	*	*	H	α-helix	trans	-64.7	-37.7	179.1	-138.8	80.5	0	0	0	112.1	T688 T696	T688-L692 PolarHBondContact O-N 3.23Å; L692-T696 WeakPolarHBondContact O-CB 3.08Å; L692-T696 PolarHBondContact O-N 2.95Å; L692-T696 PolarHBondContact O-OG1 3.38Å
693	S	68	Low	58.9	Low	65 Å²	65	112.1 Å²	112.1	46%	0.455	59%	0.592	S	S	.	*	H	α-helix	trans	-77.8	-33.2	177.8	51.6	0	0	0	0	113	E689 A690 D691 R697	E689-S693 PolarHBondContact O-N 3.43Å; E689-S693 PolarHBondContact O-OG 3.38Å; A690-S693 PolarHBondContact O-N 2.99Å; A690-S693 PolarHBondContact O-OG 2.92Å; A690-S693 VanDerWaalsContact O-OG 3.05Å; D691-S693 VanDerWaalsContact C-N 3.32Å; D691-S693 PolarHBondContact O-N 3.16Å; S693-R697 WeakPolarHBondContact O-CB 3.47Å; S693-R697 PolarHBondContact O-N 3.36Å
694	E	63.5	Low	61.2	Low	79 Å²	79	113.6 Å²	113.6	37%	0.369	59%	0.585	S	S	.	*	H	α-helix	trans	-70.6	-36.2	170.1	-160.5	-174.1	-139.5	0	0	112.3	R651 A690 D691 R697 S698	R651-E694 IonicContact CZ-OE2 3.94Å; R651-E694 IonicContact NH1-OE2 2.78Å; R651-E694 IonicContact NH2-OE1 3.74Å; R651-E694 PolarHBondContact NH2-OE1 3.03Å; R651-E694 IonicContact NH2-OE2 2.73Å; R651-E694 PolarHBondContact NH2-OE2 2.97Å; A690-E694 PolarHBondContact O-N 2.98Å; D691-E694 PolarHBondContact O-N 2.71Å; E694-R697 PolarHBondContact O-N 2.86Å; E694-S698 WeakPolarHBondContact O-CB 3.42Å; E694-S698 PolarHBondContact O-N 2.67Å; E694-S698 PolarHBondContact O-OG 3.25Å
695	Y	62.1	Low	63.4	Low	157 Å²	157	108.3 Å²	108.3	62%	0.616	57%	0.569	S	S	*	*	H	α-helix	trans	-61.4	-46.8	171.9	-178.3	-109.4	0	0	0	111.4	D691 S698 I699	D691-Y695 VanDerWaalsContact O-CB 3.23Å; D691-Y695 WeakPolarHBondContact O-CB 3.08Å; D691-Y695 PolarHBondContact O-N 3.38Å; Y695-S698 WeakPolarHBondContact O-CA 3.34Å; Y695-S698 WeakPolarHBondContact O-CB 3.13Å; Y695-S698 PolarHBondContact O-N 3.36Å; Y695-S698 VanDerWaalsContact O-N 3.07Å; Y695-I699 HydrophobicContact CD1-CD1 3.93Å; Y695-I699 HydrophobicContact CE1-CD1 3.48Å; Y695-I699 VanDerWaalsContact CE1-CD1 3.48Å; Y695-I699 HydrophobicContact CE1-CG1 4.47Å; Y695-I699 PolarHBondContact O-N 3.24Å
696	T	76	Confident	65.2	Low	72 Å²	72	107.9 Å²	107.9	44%	0.442	55%	0.552	S	S	.	*	H	α-helix	trans	-58.9	-49.8	175.7	-58.2	0	0	0	0	111.4	L692 S698 I699 E700	L692-T696 WeakPolarHBondContact O-CB 3.08Å; L692-T696 PolarHBondContact O-N 2.95Å; L692-T696 PolarHBondContact O-OG1 3.38Å; T696-S698 PolarHBondContact O-N 3.15Å; T696-I699 WeakPolarHBondContact O-CB 3.46Å; T696-I699 PolarHBondContact O-N 2.86Å; T696-I699 VanDerWaalsContact O-N 3.11Å; T696-E700 WeakPolarHBondContact O-CG 3.48Å; T696-E700 PolarHBondContact O-N 2.89Å
697	R	79.3	Confident	67	Low	147 Å²	147	101.9 Å²	101.9	56%	0.555	53%	0.533	S	S	*	.	H	α-helix	trans	-61.2	-25.2	175.6	-170.1	-176.2	-69.3	161.1	-3.1	113	S693 E694 K701	S693-R697 WeakPolarHBondContact O-CB 3.47Å; S693-R697 PolarHBondContact O-N 3.36Å; E694-R697 PolarHBondContact O-N 2.86Å; R697-K701 WeakPolarHBondContact O-CG 3.44Å; R697-K701 PolarHBondContact O-N 3.4Å
698	S	72.6	Confident	69	Low	60 Å²	60	102.1 Å²	102.1	42%	0.42	53%	0.529	S	S	.	.	H	α-helix	trans	-79.1	-38.1	175.6	-60.8	0	0	0	0	112.2	E694 Y695 T696 E700 K701 L702	E694-S698 WeakPolarHBondContact O-CB 3.42Å; E694-S698 PolarHBondContact O-N 2.67Å; E694-S698 PolarHBondContact O-OG 3.25Å; Y695-S698 WeakPolarHBondContact O-CA 3.34Å; Y695-S698 WeakPolarHBondContact O-CB 3.13Å; Y695-S698 PolarHBondContact O-N 3.36Å; Y695-S698 VanDerWaalsContact O-N 3.07Å; T696-S698 PolarHBondContact O-N 3.15Å; S698-E700 VanDerWaalsContact C-N 3.35Å; S698-K701 PolarHBondContact O-N 3.39Å; S698-L702 PolarHBondContact O-N 2.95Å
699	I	74.9	Confident	70	Confident	70 Å²	70	103.3 Å²	103.3	36%	0.359	53%	0.532	S	S	.	.	H	α-helix	trans	-61.3	-43.3	170.2	-70.5	170.8	0	0	0	110.6	Y695 T696 K701 L702 N703	Y695-I699 HydrophobicContact CD1-CD1 3.93Å; Y695-I699 HydrophobicContact CE1-CD1 3.48Å; Y695-I699 VanDerWaalsContact CE1-CD1 3.48Å; Y695-I699 HydrophobicContact CE1-CG1 4.47Å; Y695-I699 PolarHBondContact O-N 3.24Å; T696-I699 WeakPolarHBondContact O-CB 3.46Å; T696-I699 PolarHBondContact O-N 2.86Å; T696-I699 VanDerWaalsContact O-N 3.11Å; I699-K701 PolarHBondContact O-N 3.45Å; I699-L702 WeakPolarHBondContact O-CB 3.1Å; I699-L702 PolarHBondContact O-N 3.2Å; I699-N703 WeakPolarHBondContact O-CB 3.46Å; I699-N703 PolarHBondContact O-N 3.37Å; I699-N703 PolarHBondContact O-ND2 2.92Å
700	E	76.1	Confident	70.8	Confident	120 Å²	120	100.5 Å²	100.5	56%	0.561	52%	0.519	S	S	*	.	H	α-helix	trans	-59.3	-45.9	176.3	-69.7	177.3	147.1	0	0	112.3	T696 S698 L702 N703 H704	T696-E700 WeakPolarHBondContact O-CG 3.48Å; T696-E700 PolarHBondContact O-N 2.89Å; S698-E700 VanDerWaalsContact C-N 3.35Å; E700-L702 VanDerWaalsContact C-N 3.31Å; E700-L702 PolarHBondContact O-N 3.31Å; E700-N703 PolarHBondContact O-N 3.3Å; E700-H704 WeakPolarHBondContact O-CB 3.42Å; E700-H704 PolarHBondContact O-N 2.85Å
701	K	78.6	Confident	71.9	Confident	136 Å²	136	100.2 Å²	100.2	59%	0.591	52%	0.516	S	S	*	.	H	α-helix	trans	-63	-35.8	174.9	-74	171.3	-179.4	177	0	112.7	R697 S698 I699 S705	R697-K701 WeakPolarHBondContact O-CG 3.44Å; R697-K701 PolarHBondContact O-N 3.4Å; S698-K701 PolarHBondContact O-N 3.39Å; I699-K701 PolarHBondContact O-N 3.45Å; K701-S705 WeakPolarHBondContact O-CB 3.47Å; K701-S705 PolarHBondContact O-N 3.17Å; K701-S705 PolarHBondContact O-OG 3.47Å
702	L	64.7	Low	73.1	Confident	125 Å²	125	99.9 Å²	99.9	65%	0.654	51%	0.512	S	S	*	.	H	α-helix	trans	-68	-45.3	175.6	-158.4	82.5	0	0	0	110.9	S698 I699 E700 H704 S705 L706	S698-L702 PolarHBondContact O-N 2.95Å; I699-L702 WeakPolarHBondContact O-CB 3.1Å; I699-L702 PolarHBondContact O-N 3.2Å; E700-L702 VanDerWaalsContact C-N 3.31Å; E700-L702 PolarHBondContact O-N 3.31Å; L702-H704 PolarHBondContact O-N 2.88Å; L702-S705 CarbonylContact O-C 3.54Å; L702-S705 WeakPolarHBondContact O-CB 3.26Å; L702-S705 PolarHBondContact O-N 3.1Å; L702-L706 WeakPolarHBondContact O-CB 3.47Å; L702-L706 PolarHBondContact O-N 3.27Å
703	N	66.4	Low	73.1	Confident	91 Å²	91	100.9 Å²	100.9	49%	0.487	52%	0.515	S	S	.	.	H	α-helix	trans	-62.8	-40.4	176.4	-73.5	-23.5	0	0	0	112.2	I699 E700 S705 L706 A707	I699-N703 WeakPolarHBondContact O-CB 3.46Å; I699-N703 PolarHBondContact O-N 3.37Å; I699-N703 PolarHBondContact O-ND2 2.92Å; E700-N703 PolarHBondContact O-N 3.3Å; N703-S705 VanDerWaalsContact C-N 3.3Å; N703-S705 PolarHBondContact O-N 2.96Å; N703-L706 PolarHBondContact O-N 2.97Å; N703-A707 WeakPolarHBondContact O-CB 3.26Å; N703-A707 PolarHBondContact O-N 2.77Å
704	H	79.8	Confident	73.5	Confident	151 Å²	151	103.6 Å²	103.6	70%	0.699	52%	0.521	S	S	*	.	H	α-helix	trans	-64.8	-37.3	175.3	-149.1	91.5	0	0	0	111.5	E700 L702 F708	E700-H704 WeakPolarHBondContact O-CB 3.42Å; E700-H704 PolarHBondContact O-N 2.85Å; L702-H704 PolarHBondContact O-N 2.88Å; H704-F708 WeakPolarHBondContact O-CB 3.37Å; H704-F708 PolarHBondContact O-N 3.05Å
705	S	77.1	Confident	74.6	Confident	72 Å²	72	104.6 Å²	104.6	50%	0.503	52%	0.521	S	S	.	.	H	α-helix	trans	-70.2	-36.8	175.4	-54.6	0	0	0	0	112.2	K701 L702 N703 L709	K701-S705 WeakPolarHBondContact O-CB 3.47Å; K701-S705 PolarHBondContact O-N 3.17Å; K701-S705 PolarHBondContact O-OG 3.47Å; L702-S705 CarbonylContact O-C 3.54Å; L702-S705 WeakPolarHBondContact O-CB 3.26Å; L702-S705 PolarHBondContact O-N 3.1Å; N703-S705 VanDerWaalsContact C-N 3.3Å; N703-S705 PolarHBondContact O-N 2.96Å; S705-L709 WeakPolarHBondContact O-CB 3.47Å; S705-L709 PolarHBondContact O-N 3.45Å
706	L	72.9	Confident	75.5	Confident	92 Å²	92	101.7 Å²	101.7	48%	0.482	52%	0.516	S	S	.	.	H	α-helix	trans	-66.3	-45.7	173.9	-167	88	0	0	0	111.1	L702 N703 F708 L709 Q710	L702-L706 WeakPolarHBondContact O-CB 3.47Å; L702-L706 PolarHBondContact O-N 3.27Å; N703-L706 PolarHBondContact O-N 2.97Å; L706-F708 VanDerWaalsContact C-N 3.34Å; L706-F708 PolarHBondContact O-N 3.49Å; L706-L709 PolarHBondContact O-N 2.98Å; L706-Q710 WeakPolarHBondContact O-CB 3.28Å; L706-Q710 VanDerWaalsContact O-CG 3.31Å; L706-Q710 WeakPolarHBondContact O-CG 3.46Å; L706-Q710 PolarHBondContact O-N 3.34Å
707	A	75.1	Confident	75.6	Confident	51 Å²	51	100.7 Å²	100.7	42%	0.421	52%	0.515	S	S	.	.	H	α-helix	trans	-62.3	-40.7	176.8	0	0	0	0	0	111.7	N703 Q710 A711	N703-A707 WeakPolarHBondContact O-CB 3.26Å; N703-A707 PolarHBondContact O-N 2.77Å; A707-Q710 PolarHBondContact O-N 2.83Å; A707-A711 WeakPolarHBondContact O-CB 3.45Å; A707-A711 PolarHBondContact O-N 3.12Å
708	F	84	Confident	75.8	Confident	147 Å²	147	98.7 Å²	98.7	65%	0.645	51%	0.512	S	S	*	.	H	α-helix	trans	-61.9	-44.4	172.4	-178.7	-93.1	0	0	0	112.1	H704 L706 Q710 A711 E712	H704-F708 WeakPolarHBondContact O-CB 3.37Å; H704-F708 PolarHBondContact O-N 3.05Å; L706-F708 VanDerWaalsContact C-N 3.34Å; L706-F708 PolarHBondContact O-N 3.49Å; F708-Q710 PolarHBondContact O-N 3.33Å; F708-A711 PolarHBondContact O-N 3.2Å; F708-E712 WeakPolarHBondContact O-CB 3.5Å; F708-E712 PolarHBondContact O-N 3.45Å
709	L	76.5	Confident	76.2	Confident	104 Å²	104	100.5 Å²	100.5	55%	0.545	51%	0.514	S	S	.	.	H	α-helix	trans	-64.9	-38.6	177.3	-176	64.5	0	0	0	112.4	S705 L706 E712 M713	S705-L709 WeakPolarHBondContact O-CB 3.47Å; S705-L709 PolarHBondContact O-N 3.45Å; L706-L709 PolarHBondContact O-N 2.98Å; L709-E712 PolarHBondContact O-N 3.38Å; L709-M713 WeakPolarHBondContact O-CB 3.47Å; L709-M713 PolarHBondContact O-N 2.89Å
710	Q	65.5	Low	75.6	Confident	116 Å²	116	103.5 Å²	103.5	54%	0.542	53%	0.526	S	S	.	.	H	α-helix	trans	-65	-45	174.6	-75	171.5	-19.2	0	0	111.5	L706 A707 F708 E712 M713 Q714	L706-Q710 WeakPolarHBondContact O-CB 3.28Å; L706-Q710 VanDerWaalsContact O-CG 3.31Å; L706-Q710 WeakPolarHBondContact O-CG 3.46Å; L706-Q710 PolarHBondContact O-N 3.34Å; A707-Q710 PolarHBondContact O-N 2.83Å; F708-Q710 PolarHBondContact O-N 3.33Å; Q710-E712 VanDerWaalsContact C-N 3.34Å; Q710-E712 PolarHBondContact O-N 2.86Å; Q710-M713 PolarHBondContact O-N 2.85Å; Q710-Q714 WeakPolarHBondContact O-CB 3.39Å; Q710-Q714 PolarHBondContact O-N 3.33Å
711	A	78.2	Confident	75.9	Confident	60 Å²	60	103.8 Å²	103.8	50%	0.496	53%	0.528	S	S	.	.	H	α-helix	trans	-60.9	-41.6	175.1	0	0	0	0	0	112	A707 F708 Q714 R715	A707-A711 WeakPolarHBondContact O-CB 3.45Å; A707-A711 PolarHBondContact O-N 3.12Å; F708-A711 PolarHBondContact O-N 3.2Å; A711-Q714 WeakPolarHBondContact O-CB 3.42Å; A711-Q714 PolarHBondContact O-N 3.19Å; A711-R715 WeakPolarHBondContact O-CB 3.42Å; A711-R715 PolarHBondContact O-N 3.13Å
712	E	80.4	Confident	75.9	Confident	69 Å²	69	101.4 Å²	101.4	32%	0.322	52%	0.524	S	S	.	.	H	α-helix	trans	-71.5	-35.3	178.6	-172	66	175.7	0	0	112.4	F708 L709 Q710 R715 L716	F708-E712 WeakPolarHBondContact O-CB 3.5Å; F708-E712 PolarHBondContact O-N 3.45Å; L709-E712 PolarHBondContact O-N 3.38Å; Q710-E712 VanDerWaalsContact C-N 3.34Å; Q710-E712 PolarHBondContact O-N 2.86Å; E712-R715 VanDerWaalsContact CD-NH2 3.35Å; E712-R715 PolarHBondContact O-N 3.33Å; E712-R715 IonicContact OE1-CZ 3.05Å; E712-R715 IonicContact OE1-NE 3.66Å; E712-R715 IonicContact OE1-NH2 3.87Å; E712-R715 PolarHBondContact OE1-NH2 3.5Å; E712-R715 IonicContact OE2-CZ 2.77Å; E712-R715 IonicContact OE2-NE 3.71Å; E712-R715 PolarHBondContact OE2-NE 3.28Å; E712-R715 IonicContact OE2-NH2 2.86Å; E712-R715 PolarHBondContact OE2-NH2 3.33Å; E712-L716 HydrophobicContact CG-CD1 4.44Å; E712-L716 WeakPolarHBondContact O-CB 3.21Å; E712-L716 PolarHBondContact O-N 3.27Å
713	M	62.9	Low	76.6	Confident	134 Å²	134	100.9 Å²	100.9	66%	0.66	52%	0.521	S	S	*	.	H	α-helix	trans	-61.3	-45	167.8	-95.6	-173.6	61.4	0	0	112	L709 Q710 R715 L716 A717	L709-M713 WeakPolarHBondContact O-CB 3.47Å; L709-M713 PolarHBondContact O-N 2.89Å; Q710-M713 PolarHBondContact O-N 2.85Å; M713-R715 VanDerWaalsContact C-N 3.31Å; M713-R715 PolarHBondContact O-N 3.36Å; M713-L716 PolarHBondContact O-N 2.83Å; M713-A717 WeakPolarHBondContact O-CB 3.49Å; M713-A717 PolarHBondContact O-N 3.37Å
714	Q	76.4	Confident	76.8	Confident	123 Å²	123	102 Å²	102	58%	0.575	53%	0.525	S	S	*	.	H	α-helix	trans	-60.7	-42.6	176.9	-163.6	78.2	40.8	0	0	110.9	Q710 A711 A717 Q718	Q710-Q714 WeakPolarHBondContact O-CB 3.39Å; Q710-Q714 PolarHBondContact O-N 3.33Å; A711-Q714 WeakPolarHBondContact O-CB 3.42Å; A711-Q714 PolarHBondContact O-N 3.19Å; Q714-A717 PolarHBondContact O-N 2.77Å; Q714-Q718 WeakPolarHBondContact O-CG 3.42Å; Q714-Q718 PolarHBondContact O-N 2.8Å
715	R	87.1	Confident	76.6	Confident	100 Å²	100	97.4 Å²	97.4	38%	0.377	51%	0.513	S	S	.	.	H	α-helix	trans	-64.6	-40.7	177.3	-161	-170.3	64.4	62.8	6.7	112.1	A711 E712 M713 Q719	A711-R715 WeakPolarHBondContact O-CB 3.42Å; A711-R715 PolarHBondContact O-N 3.13Å; E712-R715 VanDerWaalsContact CD-NH2 3.35Å; E712-R715 PolarHBondContact O-N 3.33Å; E712-R715 IonicContact OE1-CZ 3.05Å; E712-R715 IonicContact OE1-NE 3.66Å; E712-R715 IonicContact OE1-NH2 3.87Å; E712-R715 PolarHBondContact OE1-NH2 3.5Å; E712-R715 IonicContact OE2-CZ 2.77Å; E712-R715 IonicContact OE2-NE 3.71Å; E712-R715 PolarHBondContact OE2-NE 3.28Å; E712-R715 IonicContact OE2-NH2 2.86Å; E712-R715 PolarHBondContact OE2-NH2 3.33Å; M713-R715 VanDerWaalsContact C-N 3.31Å; M713-R715 PolarHBondContact O-N 3.36Å; R715-Q719 VanDerWaalsContact NH1-CD 3.25Å; R715-Q719 WeakPolarHBondContact O-CG 3.29Å; R715-Q719 PolarHBondContact O-N 2.94Å
716	L	80.4	Confident	76.1	Confident	95 Å²	95	100 Å²	100	50%	0.497	52%	0.519	S	S	.	.	H	α-helix	trans	-66.1	-41.4	173.9	-94.9	149.5	0	0	0	112.3	E712 M713 Q719 Q720	E712-L716 HydrophobicContact CG-CD1 4.44Å; E712-L716 WeakPolarHBondContact O-CB 3.21Å; E712-L716 PolarHBondContact O-N 3.27Å; M713-L716 PolarHBondContact O-N 2.83Å; L716-Q719 PolarHBondContact O-N 2.63Å; L716-Q720 PolarHBondContact O-N 2.84Å
717	A	79.8	Confident	75.5	Confident	52 Å²	52	103.6 Å²	103.6	43%	0.43	53%	0.526	S	S	.	.	H	α-helix	trans	-60.9	-45.6	174.6	0	0	0	0	0	111.4	M713 Q714 Q719 Q720 E721	M713-A717 WeakPolarHBondContact O-CB 3.49Å; M713-A717 PolarHBondContact O-N 3.37Å; Q714-A717 PolarHBondContact O-N 2.77Å; A717-Q719 PolarHBondContact O-N 3Å; A717-Q720 CarbonylContact O-C 3.54Å; A717-Q720 PolarHBondContact O-N 2.81Å; A717-Q720 VanDerWaalsContact O-N 3.1Å; A717-E721 WeakPolarHBondContact O-CB 3.34Å; A717-E721 PolarHBondContact O-N 3.42Å
718	Q	82.8	Confident	74.6	Confident	104 Å²	104	107 Å²	107	49%	0.486	53%	0.533	S	S	.	.	H	α-helix	trans	-62.8	-38.7	174.7	-73.6	173.5	-16.5	0	0	112.7	Q714 Q720 E721 V722	Q714-Q718 WeakPolarHBondContact O-CG 3.42Å; Q714-Q718 PolarHBondContact O-N 2.8Å; Q718-Q720 VanDerWaalsContact C-N 3.29Å; Q718-Q720 PolarHBondContact O-N 2.94Å; Q718-E721 PolarHBondContact O-N 3.32Å; Q718-V722 WeakPolarHBondContact O-CG2 3.33Å; Q718-V722 PolarHBondContact O-N 2.85Å
719	Q	80.3	Confident	72.9	Confident	98 Å²	98	106.7 Å²	106.7	46%	0.458	53%	0.533	S	S	.	.	H	α-helix	trans	-63	-37.1	172.1	-74.4	-167.3	-70.9	0	0	112.1	R715 L716 A717 I723	R715-Q719 VanDerWaalsContact NH1-CD 3.25Å; R715-Q719 WeakPolarHBondContact O-CG 3.29Å; R715-Q719 PolarHBondContact O-N 2.94Å; L716-Q719 PolarHBondContact O-N 2.63Å; A717-Q719 PolarHBondContact O-N 3Å; Q719-I723 WeakPolarHBondContact O-CD1 3.39Å; Q719-I723 VanDerWaalsContact O-CG1 3.24Å; Q719-I723 WeakPolarHBondContact O-CG1 3.28Å; Q719-I723 PolarHBondContact O-N 2.91Å
720	Q	63.4	Low	71.7	Confident	133 Å²	133	108.3 Å²	108.3	62%	0.621	54%	0.538	S	S	*	.	H	α-helix	trans	-72.8	-35.1	178.2	-164.7	154.9	27.2	0	0	112.3	L716 A717 Q718 I723 M724	L716-Q720 PolarHBondContact O-N 2.84Å; A717-Q720 CarbonylContact O-C 3.54Å; A717-Q720 PolarHBondContact O-N 2.81Å; A717-Q720 VanDerWaalsContact O-N 3.1Å; Q718-Q720 VanDerWaalsContact C-N 3.29Å; Q718-Q720 PolarHBondContact O-N 2.94Å; Q720-I723 PolarHBondContact O-N 3.39Å; Q720-M724 WeakPolarHBondContact O-CG 3.43Å; Q720-M724 PolarHBondContact O-N 3.36Å
721	E	81.3	Confident	70.9	Confident	126 Å²	126	109 Å²	109	59%	0.589	54%	0.541	S	S	*	.	H	α-helix	trans	-64.8	-44.7	171.5	-173.2	173.1	-156.7	0	0	111.9	A717 Q718 I723 M724 A725	A717-E721 WeakPolarHBondContact O-CB 3.34Å; A717-E721 PolarHBondContact O-N 3.42Å; Q718-E721 PolarHBondContact O-N 3.32Å; E721-I723 VanDerWaalsContact C-N 3.31Å; E721-I723 PolarHBondContact O-N 3.02Å; E721-M724 PolarHBondContact O-N 2.95Å; E721-M724 VanDerWaalsContact O-N 3.12Å; E721-A725 PolarHBondContact O-N 3.42Å
722	V	78.1	Confident	69.3	Low	86 Å²	86	112.8 Å²	112.8	52%	0.521	55%	0.549	S	S	.	.	H	α-helix	trans	-61.4	-38.9	172.7	170.2	0	0	0	0	111.6	Q718 M724 A725 M726	Q718-V722 WeakPolarHBondContact O-CG2 3.33Å; Q718-V722 PolarHBondContact O-N 2.85Å; V722-M724 VanDerWaalsContact C-N 3.34Å; V722-A725 PolarHBondContact O-N 3.22Å; V722-M726 WeakPolarHBondContact O-CG 3.24Å; V722-M726 PolarHBondContact O-N 3.22Å
723	I	79.8	Confident	67.5	Low	115 Å²	115	117.4 Å²	117.4	59%	0.59	57%	0.57	S	S	*	*	H	α-helix	trans	-65.3	-37	174.5	-71.7	164.4	0	0	0	111.4	Q719 Q720 E721 R727	Q719-I723 WeakPolarHBondContact O-CD1 3.39Å; Q719-I723 VanDerWaalsContact O-CG1 3.24Å; Q719-I723 WeakPolarHBondContact O-CG1 3.28Å; Q719-I723 PolarHBondContact O-N 2.91Å; Q720-I723 PolarHBondContact O-N 3.39Å; E721-I723 VanDerWaalsContact C-N 3.31Å; E721-I723 PolarHBondContact O-N 3.02Å; I723-R727 WeakPolarHBondContact O-CB 3.31Å; I723-R727 PolarHBondContact O-N 3.43Å
724	M	71.6	Confident	65.9	Low	115 Å²	115	115.3 Å²	115.3	57%	0.567	57%	0.565	S	S	*	*	H	α-helix	trans	-66.7	-45.3	172.4	-70.6	-171.6	-61.3	0	0	111.6	Q720 E721 V722 M726 R727 E728	Q720-M724 WeakPolarHBondContact O-CG 3.43Å; Q720-M724 PolarHBondContact O-N 3.36Å; E721-M724 PolarHBondContact O-N 2.95Å; E721-M724 VanDerWaalsContact O-N 3.12Å; V722-M724 VanDerWaalsContact C-N 3.34Å; M724-M726 PolarHBondContact O-N 2.89Å; M724-R727 CarbonylContact O-C 3.56Å; M724-R727 WeakPolarHBondContact O-CA 3.36Å; M724-R727 WeakPolarHBondContact O-CB 3.35Å; M724-R727 PolarHBondContact O-N 2.92Å; M724-E728 PolarHBondContact O-N 3.37Å
725	A	75.8	Confident	63.7	Low	54 Å²	54	119.9 Å²	119.9	45%	0.446	58%	0.577	S	S	.	*	H	α-helix	trans	-62.4	-38.2	177.5	0	0	0	0	0	113.2	E721 V722 R727 E728 Q729	E721-A725 PolarHBondContact O-N 3.42Å; V722-A725 PolarHBondContact O-N 3.22Å; A725-R727 VanDerWaalsContact C-N 3.35Å; A725-E728 WeakPolarHBondContact O-CB 3.19Å; A725-E728 PolarHBondContact O-N 2.84Å; A725-Q729 PolarHBondContact O-N 3.14Å
726	M	65.8	Low	60.9	Low	127 Å²	127	121.6 Å²	121.6	63%	0.626	60%	0.599	S	S	*	*	H	α-helix	trans	-66.7	-36.1	172	-71.2	-171	78.4	0	0	112	V722 M724 Q730	V722-M726 WeakPolarHBondContact O-CG 3.24Å; V722-M726 PolarHBondContact O-N 3.22Å; M724-M726 PolarHBondContact O-N 2.89Å; M726-Q730 WeakPolarHBondContact O-CB 3.47Å; M726-Q730 PolarHBondContact O-N 3.08Å
727	R	60.8	Low	58.6	Low	167 Å²	167	123.6 Å²	123.6	63%	0.63	61%	0.608	S	S	*	*	H	α-helix	trans	-66.4	-39.3	173.6	-170.5	179.2	-173.9	178.2	1.9	111.5	I723 M724 A725 Q730 H731	I723-R727 WeakPolarHBondContact O-CB 3.31Å; I723-R727 PolarHBondContact O-N 3.43Å; M724-R727 CarbonylContact O-C 3.56Å; M724-R727 WeakPolarHBondContact O-CA 3.36Å; M724-R727 WeakPolarHBondContact O-CB 3.35Å; M724-R727 PolarHBondContact O-N 2.92Å; A725-R727 VanDerWaalsContact C-N 3.35Å; R727-Q730 PolarHBondContact O-N 3.17Å; R727-H731 PolarHBondContact O-N 2.86Å; R727-H731 VanDerWaalsContact O-N 3.15Å; R727-H731 PolarHBondContact O-ND1 2.97Å
728	E	56.1	Low	56.3	Low	123 Å²	123	125.9 Å²	125.9	58%	0.575	62%	0.619	S	S	*	*	H	α-helix	trans	-58.4	-51.9	174.8	-155.1	73.6	-137	0	0	110.8	M724 A725 Q730 H731 Q732	M724-E728 PolarHBondContact O-N 3.37Å; A725-E728 WeakPolarHBondContact O-CB 3.19Å; A725-E728 PolarHBondContact O-N 2.84Å; E728-Q730 VanDerWaalsContact C-N 3.28Å; E728-Q730 PolarHBondContact O-N 2.88Å; E728-H731 PolarHBondContact O-N 3.34Å; E728-H731 VanDerWaalsContact O-N 3.11Å; E728-Q732 PolarHBondContact O-N 2.85Å
729	Q	48.1	Very low	53.9	Low	139 Å²	139	126.3 Å²	126.3	65%	0.65	63%	0.63	S	S	*	*	H	α-helix	trans	-60.6	-36.3	175.4	-75.2	-164.8	-38.1	0	0	112.7	A725 H731 Q732 Q733	A725-Q729 PolarHBondContact O-N 3.14Å; Q729-H731 VanDerWaalsContact C-N 3.27Å; Q729-H731 PolarHBondContact O-N 2.88Å; Q729-Q732 PolarHBondContact O-N 2.82Å; Q729-Q732 VanDerWaalsContact O-N 3.12Å; Q729-Q733 PolarHBondContact O-N 3.24Å
730	Q	51.7	Low	51.7	Low	139 Å²	139	127.7 Å²	127.7	65%	0.65	65%	0.648	S	S	*	*	H	α-helix	trans	-66.5	-27.6	177.7	-162.8	171.4	18.3	0	0	112.7	M726 R727 E728	M726-Q730 WeakPolarHBondContact O-CB 3.47Å; M726-Q730 PolarHBondContact O-N 3.08Å; R727-Q730 PolarHBondContact O-N 3.17Å; E728-Q730 VanDerWaalsContact C-N 3.28Å; E728-Q730 PolarHBondContact O-N 2.88Å
731	H	49	Very low	50	Low	129 Å²	129	130.5 Å²	130.5	60%	0.597	66%	0.661	S	S	*	*	H	α-helix	trans	-79	-18.4	173.5	-70.7	64.9	0	0	0	113	R727 E728 Q729 Q733	R727-H731 PolarHBondContact O-N 2.86Å; R727-H731 VanDerWaalsContact O-N 3.15Å; R727-H731 PolarHBondContact O-ND1 2.97Å; E728-H731 PolarHBondContact O-N 3.34Å; E728-H731 VanDerWaalsContact O-N 3.11Å; Q729-H731 VanDerWaalsContact C-N 3.27Å; Q729-H731 PolarHBondContact O-N 2.88Å; H731-Q733 VanDerWaalsContact C-N 3.34Å
732	Q	43.3	Very low	47.4	Very low	140 Å²	140	131.3 Å²	131.3	65%	0.654	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	5.7	175.3	-62.3	-179.6	17.8	0	0	113.6	E728 Q729	E728-Q732 PolarHBondContact O-N 2.85Å; Q729-Q732 PolarHBondContact O-N 2.82Å; Q729-Q732 VanDerWaalsContact O-N 3.12Å
733	Q	42.8	Very low	45	Very low	167 Å²	167	133.9 Å²	133.9	78%	0.78	69%	0.685	S	S	*	*	S	Bend	trans	-128.9	18.9	-176.7	-75.4	-69.4	-68.8	0	0	113.1	Q729 H731	Q729-Q733 PolarHBondContact O-N 3.24Å; H731-Q733 VanDerWaalsContact C-N 3.34Å
734	T	30.2	Very low	42.7	Very low	90 Å²	90	134.2 Å²	134.2	55%	0.552	70%	0.695	S	S	*	*	S	Bend	trans	-145.8	136.1	176	-50.9	0	0	0	0	110
735	W	30.1	Very low	40.4	Very low	219 Å²	219	133.1 Å²	133.1	83%	0.83	70%	0.699	S	S	*	*			trans	75.7	62.9	-170.6	-56.4	110.8	0	0	0	117.1	I737	W735-I737 HydrophobicContact CE3-CD1 4.47Å; W735-I737 HydrophobicContact CZ3-CD1 4.15Å
736	V	28.5	Very low	39.1	Very low	136 Å²	136	135.3 Å²	135.3	82%	0.824	71%	0.709	S	S	*	*			trans	-127.7	120.7	141.2	-179.9	0	0	0	0	107.7
737	I	31.1	Very low	37.3	Very low	137 Å²	137	136.2 Å²	136.2	70%	0.703	71%	0.711	S	S	*	*			trans	-117.9	118.4	167.9	-62.1	178.5	0	0	0	106.5	W735	W735-I737 HydrophobicContact CE3-CD1 4.47Å; W735-I737 HydrophobicContact CZ3-CD1 4.15Å
738	P	31	Very low	35.7	Very low	99 Å²	99	136.8 Å²	136.8	64%	0.643	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-77.6	155.4	179.4	32	-34.7	0	0	0	111.9
739	P	33.8	Very low	34.4	Very low	113 Å²	113	139.8 Å²	139.8	73%	0.734	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-66.5	155.6	173.7	29.2	-35.1	0	0	0	112.1
740	P	33.9	Very low	34.1	Very low	128 Å²	128	139 Å²	139	83%	0.831	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-73	150.7	-170.9	29.6	-36.1	0	0	0	113.8
741	H	27.1	Very low	32.9	Very low	191 Å²	191	143.6 Å²	143.6	88%	0.884	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-72.9	133.6	178	-64.8	-85.4	0	0	0	112.9
742	T	27.3	Very low	32.6	Very low	143 Å²	143	143.5 Å²	143.5	88%	0.877	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-102.3	147.3	149.3	53.9	0	0	0	0	109.3
743	N	26.5	Very low	32	Very low	140 Å²	140	140.7 Å²	140.7	75%	0.749	77%	0.77	S	S	*	*			trans	-135.1	128.2	179.7	-171	10.7	0	0	0	106.9	S745	N743-S745 PolarHBondContact OD1-N 3.25Å
744	P	31.6	Very low	31.4	Very low	123 Å²	123	137.7 Å²	137.7	80%	0.799	77%	0.773	S	S	*	*				-141.3	129.5	100.9	35.2	-20.1	0	0	0	115.6
745	S	24.5	Very low	31.6	Very low	91 Å²	91	139.8 Å²	139.8	64%	0.636	79%	0.786	S	S	*	*				-6.4	155.4	129.1	-164.5	0	0	0	0	118.1	N743	N743-S745 PolarHBondContact OD1-N 3.25Å
746	P	48.9	Very low	31.7	Very low	101 Å²	101	135.2 Å²	135.2	66%	0.656	78%	0.782	S	S	*	*			cis	-138.5	174.5	-34.4	35.6	-18.2	0	0	0	114.1
747	Q	27.3	Very low	31.9	Very low	146 Å²	146	139.4 Å²	139.4	68%	0.682	78%	0.783	S	S	*	*				159.9	144.4	125.9	-88.6	-176.9	32.9	0	0	116.4
748	K	27.6	Very low	32	Very low	179 Å²	179	137.8 Å²	137.8	78%	0.778	78%	0.784	S	S	*	*			trans	72.2	138.1	147.2	-72.1	162.4	179.2	156.2	0	122.2
749	H	28.5	Very low	31.9	Very low	185 Å²	185	139.4 Å²	139.4	86%	0.856	80%	0.798	S	S	*	*			trans	-79.5	-177.9	163	-45	-89.7	0	0	0	110.8
750	P	41.8	Very low	31.6	Very low	122 Å²	122	137.1 Å²	137.1	79%	0.792	80%	0.795	S	S	*	*			cis	-139.2	-168.4	2.7	37.1	-14.1	0	0	0	116.7
751	R	26.2	Very low	32.4	Very low	236 Å²	236	137.3 Å²	137.3	89%	0.891	80%	0.796	S	S	*	*			trans	-48.6	174.1	156.7	-71.6	179.7	175.7	-179.8	-1.3	113.9
752	P	43	Very low	32.5	Very low	128 Å²	128	133 Å²	133	83%	0.831	79%	0.787	S	S	*	*			cis	-133.2	-170.7	11.5	33.8	-10.9	0	0	0	116
753	G	30	Very low	32.7	Very low	81 Å²	81	131.5 Å²	131.5	84%	0.835	78%	0.783	S	S	*	*			trans	-122.7	-164.7	176.9	0	0	0	0	0	114.6
754	A	30.8	Very low	33.7	Very low	104 Å²	104	131 Å²	131	86%	0.86	79%	0.788	S	S	*	*			trans	-129.6	174	-170.9	0	0	0	0	0	114.5
755	V	34.6	Very low	33.5	Very low	133 Å²	133	129.4 Å²	129.4	81%	0.806	79%	0.785	S	S	*	*			trans	-149.1	148.7	-171.9	174.1	0	0	0	0	111
756	T	32.2	Very low	33.6	Very low	124 Å²	124	133 Å²	133	76%	0.761	80%	0.796	S	S	*	*			trans	154.6	156.3	158.1	43.1	0	0	0	0	109.7
757	R	32.5	Very low	32.7	Very low	223 Å²	223	132.9 Å²	132.9	84%	0.842	80%	0.798	S	S	*	*			cis	-160.8	142	-6.4	-104	156.5	139.6	-173.9	-8.1	105.2
758	S	33.5	Very low	33.7	Very low	104 Å²	104	131.5 Å²	131.5	73%	0.727	80%	0.802	S	S	*	*			cis	102.4	108.3	28.8	78.9	0	0	0	0	115.3
759	S	29.3	Very low	33.7	Very low	132 Å²	132	134.3 Å²	134.3	92%	0.923	81%	0.808	S	S	*	*			trans	-169.3	153.8	153.9	48.7	0	0	0	0	112.2
760	G	26.9	Very low	33.8	Very low	66 Å²	66	132.4 Å²	132.4	68%	0.68	80%	0.804	S	S	*	*			trans	-145	-154.5	176.2	0	0	0	0	0	109.8
761	P	50	Low	33.8	Very low	131 Å²	131	131 Å²	131	85%	0.851	80%	0.795	S	S	*	*			cis	-100.2	-128.8	10.4	12.4	12.1	0	0	0	112.7
762	S	29.3	Very low	33.9	Very low	100 Å²	100	130.1 Å²	130.1	70%	0.699	79%	0.791	S	S	*	*			cis	-158.1	172.5	12.4	-72	0	0	0	0	113.5
763	S	32.4	Very low	33.3	Very low	112 Å²	112	130.6 Å²	130.6	78%	0.783	79%	0.792	S	S	*	*			trans	-145.2	179.2	173.9	-44	0	0	0	0	109.5
764	P	46.4	Very low	33.2	Very low	131 Å²	131	131.8 Å²	131.8	85%	0.851	79%	0.794	S	S	*	*				-142.1	-160.1	54	40.8	-20.4	0	0	0	113.8
765	A	28.8	Very low	33.1	Very low	89 Å²	89	138.3 Å²	138.3	74%	0.736	80%	0.797	S	S	*	*				-172.8	149	-68.3	0	0	0	0	0	108.7
766	D	25.7	Very low	33.8	Very low	165 Å²	165	137 Å²	137	88%	0.882	79%	0.791	S	S	*	*			trans	-156.4	152.7	149.7	-137.1	-24	0	0	0	112.3
767	S	30.5	Very low	33.6	Very low	100 Å²	100	136.3 Å²	136.3	70%	0.699	79%	0.791	S	S	*	*			trans	-167.9	161.9	-173	-156	0	0	0	0	110.5
768	P	47.4	Very low	33.4	Very low	117 Å²	117	133.9 Å²	133.9	76%	0.76	79%	0.789	S	S	*	*				-157.7	167	93.1	41.1	-22.6	0	0	0	118.7
769	R	27.2	Very low	33.3	Very low	238 Å²	238	136.4 Å²	136.4	90%	0.898	79%	0.794	S	S	*	*			trans	90.8	118.8	142	-155.5	168.1	-80.6	-168.4	-4.1	119.5
770	N	30.8	Very low	33.1	Very low	145 Å²	145	140 Å²	140	78%	0.775	79%	0.793	S	S	*	*			trans	-105.3	-177	170.5	-141.7	4.4	0	0	0	107.4
771	P	43.4	Very low	33.4	Very low	93 Å²	93	145 Å²	145	60%	0.604	80%	0.803	S	S	*	*			cis	-147.7	168.6	14.3	44	-22.9	0	0	0	121
772	R	27.6	Very low	32.4	Very low	216 Å²	216	142.9 Å²	142.9	82%	0.815	80%	0.797	S	S	*	*			trans	82.2	145.2	139.9	-84.1	163.6	-173.8	160.5	2	123.5
773	T	30.4	Very low	33	Very low	139 Å²	139	143 Å²	143	85%	0.853	80%	0.795	S	S	*	*			trans	85.5	140	149.4	37	0	0	0	0	123.3
774	A	27.5	Very low	33.1	Very low	106 Å²	106	148.4 Å²	148.4	88%	0.876	80%	0.8	S	S	*	*			trans	78.5	150.1	163.2	0	0	0	0	0	121.3
775	R	29.4	Very low	32.4	Very low	240 Å²	240	146.3 Å²	146.3	91%	0.906	79%	0.788	S	S	*	*			trans	-148.7	165.6	176.8	-111	-173.5	-178.4	-176.2	1.3	105.6
776	P	48.8	Very low	32.7	Very low	106 Å²	106	153.4 Å²	153.4	69%	0.688	80%	0.796	S	S	*	*			cis	-135.1	-168.7	-7.1	33.6	-11.1	0	0	0	114.2
777	S	28.9	Very low	32.9	Very low	109 Å²	109	152.5 Å²	152.5	76%	0.762	80%	0.796	S	S	*	*			trans	102	138.8	145.8	-57.7	0	0	0	0	121.7
778	E	27.1	Very low	33.6	Very low	173 Å²	173	155.6 Å²	155.6	81%	0.808	80%	0.803	S	S	*	*			trans	75.7	120.2	159.1	-68.4	-169.1	-164.5	0	0	124.1
779	L	30.7	Very low	32.8	Very low	156 Å²	156	156.8 Å²	156.8	82%	0.817	81%	0.809	S	S	*	*			trans	53	112.6	133.9	-62	171.8	0	0	0	121.4
780	K	25.5	Very low	32.8	Very low	208 Å²	208	149.8 Å²	149.8	90%	0.904	80%	0.802	S	S	*	*				-151.9	131.8	129.2	-135.2	164.4	-172	169.3	0	113.8
781	L	33.2	Very low	33.2	Very low	172 Å²	172	148.6 Å²	148.6	90%	0.901	80%	0.802	S	S	*	*			trans	-146.8	170.5	170.7	-114.3	176.4	0	0	0	108.7
782	A	28.8	Very low	32.6	Very low	86 Å²	86	152.7 Å²	152.7	71%	0.711	81%	0.813	S	S	*	*			trans	68.6	163	-176.6	0	0	0	0	0	115.1
783	P	42.5	Very low	32.7	Very low	102 Å²	102	146.9 Å²	146.9	66%	0.662	81%	0.806	S	S	*	*			cis	-133.4	150.5	14.6	23.8	0.3	0	0	0	118.9
784	Y	35.3	Very low	32.7	Very low	226 Å²	226	146.5 Å²	146.5	89%	0.886	80%	0.803	S	S	*	*			trans	58.1	152.7	139.3	-66.1	-47.8	0	0	0	122.2
785	S	30.8	Very low	32.8	Very low	86 Å²	86	147.9 Å²	147.9	60%	0.601	80%	0.796	S	S	*	*			cis	-168	154.3	-12.6	51.3	0	0	0	0	112.2
786	R	34.5	Very low	33	Very low	239 Å²	239	142 Å²	142	90%	0.902	79%	0.791	S	S	*	*				161	160.8	126.7	-87.2	174.2	-175	-173.6	1.4	112
787	V	30.5	Very low	32	Very low	145 Å²	145	144.2 Å²	144.2	88%	0.879	80%	0.796	S	S	*	*			trans	-136.3	157.7	-165.4	173.4	0	0	0	0	111.5
788	L	46.1	Very low	33.2	Very low	165 Å²	165	143.8 Å²	143.8	86%	0.864	79%	0.79	S	S	*	*			trans	-73.8	163.7	-179.3	-62.4	159.4	0	0	0	114.1
789	T	29.8	Very low	33.5	Very low	143 Å²	143	146.1 Å²	146.1	88%	0.877	79%	0.792	S	S	*	*			trans	-140.4	140.7	168.5	-52.8	0	0	0	0	112.5
790	A	27	Very low	33.4	Very low	91 Å²	91	145.4 Å²	145.4	75%	0.752	79%	0.788	S	S	*	*			trans	-145.1	151.2	158.7	0	0	0	0	0	109.3
791	P	39.2	Very low	33.7	Very low	119 Å²	119	145.5 Å²	145.5	77%	0.773	78%	0.783	S	S	*	*			trans	-98.1	137	-163.9	35.5	-35.2	0	0	0	117.5
792	Q	31	Very low	33.3	Very low	179 Å²	179	149.1 Å²	149.1	84%	0.836	78%	0.784	S	S	*	*				30.8	141.4	126.7	-64.9	-176.6	-8.7	0	0	122.4
793	S	30.4	Very low	33	Very low	94 Å²	94	154.1 Å²	154.1	66%	0.657	79%	0.79	S	S	*	*			cis	81.2	132.2	3.7	98.4	0	0	0	0	119.3
794	V	30	Very low	32.6	Very low	132 Å²	132	154.2 Å²	154.2	80%	0.8	79%	0.793	S	S	*	*			cis	-168.6	148.7	-6.4	-103.3	0	0	0	0	111.9
795	D	29.2	Very low	32.8	Very low	135 Å²	135	149.7 Å²	149.7	72%	0.722	79%	0.792	S	S	*	*			trans	60.4	165.2	147.9	-132.4	-36.8	0	0	0	122.5
796	S	33.1	Very low	32.9	Very low	116 Å²	116	151.1 Å²	151.1	81%	0.811	80%	0.801	S	S	*	*			trans	-173.7	130.9	160.5	-84.2	0	0	0	0	115.1
797	I	28.5	Very low	33.2	Very low	153 Å²	153	148.3 Å²	148.3	79%	0.785	80%	0.798	S	S	*	*			trans	-141.5	-175.7	174.4	-9.6	178.7	0	0	0	111.2
798	P	54.4	Low	34.4	Very low	100 Å²	100	146.5 Å²	146.5	65%	0.649	79%	0.789	S	S	*	*				-128	177	-125.6	37	-16.1	0	0	0	118.5
799	R	32.6	Very low	33.6	Very low	222 Å²	222	144.2 Å²	144.2	84%	0.838	78%	0.781	S	S	*	*			trans	142.9	137.3	131.8	-78.2	173.6	173.6	147.9	0.1	117.4
800	L	28.8	Very low	33.7	Very low	141 Å²	141	145.3 Å²	145.3	74%	0.738	78%	0.781	S	S	*	*			trans	26.4	148.4	132.6	-61	159	0	0	0	119.9
801	R	31.1	Very low	33.8	Very low	209 Å²	209	144.8 Å²	144.8	79%	0.789	78%	0.777	S	S	*	*			cis	-175.2	151.7	16.4	-138.9	175.4	-170.2	160.4	0.7	110.6
802	R	25.3	Very low	33.5	Very low	248 Å²	248	148 Å²	148	94%	0.936	78%	0.781	S	S	*	*			trans	-173.9	-179.5	136.5	-111.9	178.3	178	179.9	-0.8	114.7
803	F	23.8	Very low	34.7	Very low	192 Å²	192	145.4 Å²	145.4	84%	0.842	78%	0.78	S	S	*	*			trans	-110	165.3	-158.6	-79	-107.5	0	0	0	115.4
804	S	32.2	Very low	34.7	Very low	103 Å²	103	146.9 Å²	146.9	72%	0.72	79%	0.785	S	S	*	*			trans	-96.9	170.2	166.7	-45.1	0	0	0	0	112.6
805	P	41.2	Very low	34.9	Very low	132 Å²	132	146.5 Å²	146.5	86%	0.857	78%	0.782	S	S	*	*				-141.8	-164	95.1	35.9	-17.4	0	0	0	114.8
806	C	33.1	Very low	35	Very low	116 Å²	116	147 Å²	147	78%	0.784	78%	0.78	S	S	*	*			trans	-121.7	143.2	-148.9	-57.9	0	0	0	0	118
807	Q	40.6	Very low	35	Very low	180 Å²	180	146.5 Å²	146.5	84%	0.841	77%	0.772	S	S	*	*				50.7	-172.6	126.9	-116.1	-170	-2.2	0	0	120.5
808	P	54.1	Low	34.9	Very low	106 Å²	106	147.3 Å²	147.3	69%	0.688	77%	0.77	S	S	*	*			cis	-99	-152.5	16	11.2	14.8	0	0	0	114
809	V	29.6	Very low	33.5	Very low	117 Å²	117	148 Å²	148	71%	0.709	77%	0.773	S	S	*	*			cis	-160.8	174.8	23.3	-145.5	0	0	0	0	112.5
810	L	31.5	Very low	33.4	Very low	166 Å²	166	143.4 Å²	143.4	87%	0.869	77%	0.769	S	S	*	*			trans	73	164.4	167.1	-61.4	170.8	0	0	0	116.5
811	A	30.6	Very low	33.3	Very low	81 Å²	81	142.2 Å²	142.2	67%	0.669	77%	0.768	S	S	*	*			cis	-143	172.3	7.6	0	0	0	0	0	113.9
812	H	32.8	Very low	34.4	Very low	187 Å²	187	138 Å²	138	87%	0.866	77%	0.768	S	S	*	*			trans	-144	173.7	-176.6	-59.5	-24.5	0	0	0	109.5
813	P	56.8	Low	34.8	Very low	124 Å²	124	131.1 Å²	131.1	81%	0.805	76%	0.757	S	S	*	*			cis	-109.2	-126.6	7.7	22.2	3.4	0	0	0	112.7
814	V	29.8	Very low	35.1	Very low	125 Å²	125	129.4 Å²	129.4	76%	0.758	75%	0.752	S	S	*	*			cis	-169.2	162.7	8.7	93.7	0	0	0	0	106.9
815	V	32.9	Very low	35.1	Very low	124 Å²	124	131.2 Å²	131.2	75%	0.752	75%	0.753	S	S	*	*			cis	-177.4	152.5	-23.1	139.8	0	0	0	0	105.8
816	E	33.2	Very low	35.6	Very low	146 Å²	146	130.4 Å²	130.4	68%	0.682	75%	0.748	S	S	*	*			cis	-110.5	-92	-5.8	-177.7	-154.3	-73.9	0	0	110.3	F818	E816-F818 PolarHBondContact OE2-N 2.86Å
817	T	31.2	Very low	36.5	Very low	104 Å²	104	130.6 Å²	130.6	64%	0.638	75%	0.747	S	S	*	*			cis	-153.1	121.4	-8.2	-44.3	0	0	0	0	112.4
818	F	27.8	Very low	35.8	Very low	170 Å²	170	129.4 Å²	129.4	75%	0.746	74%	0.739	S	S	*	*			trans	60.6	174.1	163.9	-84.8	-147.2	0	0	0	115.8	E816	E816-F818 PolarHBondContact OE2-N 2.86Å
819	T	24.6	Very low	35.2	Very low	114 Å²	114	129.6 Å²	129.6	70%	0.699	74%	0.741	S	S	*	*			cis	-165	155.1	-29.1	30.2	0	0	0	0	106.9
820	V	30.5	Very low	34.9	Very low	127 Å²	127	130.4 Å²	130.4	77%	0.77	74%	0.737	S	S	*	*			cis	-147.8	-113.9	-7.3	55.3	0	0	0	0	110.5
821	T	25.8	Very low	35.5	Very low	115 Å²	115	127.3 Å²	127.3	71%	0.706	73%	0.727	S	S	*	*			trans	-152.3	172.7	-164.4	54.3	0	0	0	0	112.7
822	P	55.3	Low	35.4	Very low	122 Å²	122	129.4 Å²	129.4	79%	0.792	74%	0.737	S	S	*	*			cis	-127.6	-172.5	10.2	35.1	-14.6	0	0	0	115.3
823	S	34.3	Very low	35.3	Very low	102 Å²	102	124.3 Å²	124.3	71%	0.713	73%	0.734	S	S	*	*			cis	-176.9	-160.5	-36.9	-157.9	0	0	0	0	105.9
824	E	28.8	Very low	33.9	Very low	156 Å²	156	127.7 Å²	127.7	73%	0.729	74%	0.739	S	S	*	*			cis	-148.4	168.7	9.9	-87.1	-144.8	91.9	0	0	112.4
825	L	31.7	Very low	33.8	Very low	142 Å²	142	125.8 Å²	125.8	74%	0.743	74%	0.737	S	S	*	*			trans	13.6	144.4	149.9	-55.8	174.7	0	0	0	122.2
826	P	53.3	Low	33.7	Very low	114 Å²	114	129.4 Å²	129.4	74%	0.74	74%	0.742	S	S	*	*			cis	-132	-146.1	-18.3	43.4	-24.3	0	0	0	110.2
827	P	50.9	Low	33.5	Very low	120 Å²	120	128 Å²	128	78%	0.779	75%	0.748	S	S	*	*			cis	-124.9	-130.5	-19.5	41.3	-21.6	0	0	0	112.9
828	K	25.7	Very low	33.1	Very low	155 Å²	155	128 Å²	128	67%	0.674	75%	0.752	S	S	*	*			trans	-167	-175.8	-172.3	-115	-162.5	168.3	-172.8	0	112.3	E830	K828-E830 HydrophobicContact CD-CG 4.4Å; K828-E830 WeakPolarHBondContact CE-OE1 3.37Å; K828-E830 IonicContact NZ-OE1 2.62Å; K828-E830 PolarHBondContact NZ-OE1 2.83Å
829	P	41.8	Very low	33.1	Very low	110 Å²	110	127 Å²	127	71%	0.714	76%	0.755	S	S	*	*			cis	-140.1	152.3	5.3	38.4	-17.7	0	0	0	120.6
830	E	22.9	Very low	33.4	Very low	135 Å²	135	128.9 Å²	128.9	63%	0.631	76%	0.758	S	S	*	*				43.7	164.8	127.1	-58	-63.5	173.8	0	0	124.9	K828	K828-E830 HydrophobicContact CD-CG 4.4Å; K828-E830 WeakPolarHBondContact CE-OE1 3.37Å; K828-E830 IonicContact NZ-OE1 2.62Å; K828-E830 PolarHBondContact NZ-OE1 2.83Å
831	P	44	Very low	33.2	Very low	101 Å²	101	131.8 Å²	131.8	66%	0.656	76%	0.764	S	S	*	*			cis	-143	174.3	-27.1	36.1	-16.3	0	0	0	118.6
832	S	29.2	Very low	33.4	Very low	125 Å²	125	132.4 Å²	132.4	87%	0.874	77%	0.767	S	S	*	*			trans	85.1	150.8	144.5	80.2	0	0	0	0	124.6
833	G	30	Very low	32.6	Very low	79 Å²	79	131.8 Å²	131.8	81%	0.814	76%	0.763	S	S	*	*			trans	130.3	71	144.1	0	0	0	0	0	124.7
834	Q	28.3	Very low	32.6	Very low	196 Å²	196	134.5 Å²	134.5	92%	0.916	77%	0.769	S	S	*	*			trans	2.8	138.6	156.8	-63	-175.1	-0.8	0	0	126.3
835	A	28.6	Very low	32.4	Very low	85 Å²	85	136.2 Å²	136.2	70%	0.702	78%	0.779	S	S	*	*				88.2	131.9	126.5	0	0	0	0	0	127.4
836	K	29.1	Very low	32.6	Very low	200 Å²	200	133.5 Å²	133.5	87%	0.87	78%	0.777	S	S	*	*			trans	68.7	125.8	146.3	-68.7	171.5	-177.4	174.8	0	123.3
837	S	28.9	Very low	31.3	Very low	115 Å²	115	133.8 Å²	133.8	80%	0.804	78%	0.777	S	S	*	*				140.2	149	114.7	70.9	0	0	0	0	119.4
838	S	24.8	Very low	30	Very low	104 Å²	104	137.7 Å²	137.7	73%	0.727	78%	0.782	S	S	*	*			trans	42.6	117.5	143.6	-58.2	0	0	0	0	126.3
839	L	27.3	Very low	29.9	Very low	151 Å²	151	135.7 Å²	135.7	79%	0.791	79%	0.787	S	S	*	*				49	121.5	121.4	-69.5	159.5	0	0	0	123.5
840	I	30.1	Very low	29.1	Very low	152 Å²	152	136 Å²	136	78%	0.779	79%	0.787	S	S	*	*			trans	63.5	115.1	140.8	-56.4	171.3	0	0	0	118.4
841	E	26.4	Very low	29.1	Very low	189 Å²	189	137.5 Å²	137.5	88%	0.883	79%	0.794	S	S	*	*			trans	-150.4	157.3	137.7	-133.8	167	-141.1	0	0	113
842	V	31.1	Very low	28.1	Very low	128 Å²	128	139.6 Å²	139.6	78%	0.776	80%	0.8	S	S	*	*			trans	-154	135.5	-179.7	163.6	0	0	0	0	104.1
843	P	38.5	Very low	28.1	Very low	109 Å²	109	140.8 Å²	140.8	71%	0.708	80%	0.795	S	S	*	*			cis	-137.7	178.8	30.9	32.4	-9.7	0	0	0	117.1
844	L	32.7	Very low	27.9	Very low	158 Å²	158	143.2 Å²	143.2	83%	0.827	80%	0.795	S	S	*	*			trans	33.7	113.8	143.7	-64.5	167.6	0	0	0	119.9
845	M	25.1	Very low	28	Very low	193 Å²	193	141.4 Å²	141.4	95%	0.951	79%	0.79	S	S	*	*				-129	142.6	129.3	-88	-64.8	-166.3	0	0	109
846	A	35.3	Very low	28.1	Very low	84 Å²	84	144.1 Å²	144.1	69%	0.694	79%	0.792	S	S	*	*			trans	-130.4	144.7	171.8	0	0	0	0	0	108.4
847	T	26.2	Very low	28	Very low	121 Å²	121	142.2 Å²	142.2	74%	0.742	79%	0.792	S	S	*	*			trans	-163.8	132.5	159.3	24.1	0	0	0	0	112.2
848	K	25.1	Very low	28	Very low	202 Å²	202	139.1 Å²	139.1	88%	0.878	78%	0.778	S	S	*	*			trans	68.6	153.5	146.5	-60.9	171.8	-178.5	-174.5	0	117.3
849	S	21.9	Very low	28.6	Very low	112 Å²	112	141.3 Å²	141.3	78%	0.783	78%	0.781	S	S	*	*			cis	-127.9	164.6	2.2	57.2	0	0	0	0	113.2
850	T	24.8	Very low	28.9	Very low	118 Å²	118	141.1 Å²	141.1	72%	0.724	78%	0.776	S	S	*	*			trans	-80.4	-169.9	173.2	-37.8	0	0	0	0	110.7
851	E	23.9	Very low	29.3	Very low	165 Å²	165	140.5 Å²	140.5	77%	0.771	77%	0.771	S	S	*	*			trans	87.7	133.2	159.9	-66.5	140.2	-113.4	0	0	116.8
852	D	24.1	Very low	29.6	Very low	146 Å²	146	138.1 Å²	138.1	78%	0.781	76%	0.76	S	S	*	*			cis	-151.2	178.9	-3.2	-152.4	4.5	0	0	0	114.9
853	L	28.3	Very low	29.6	Very low	149 Å²	149	139.2 Å²	139.2	78%	0.78	76%	0.757	S	S	*	*			trans	-80.8	161.7	-171	-64.7	160.7	0	0	0	115.9
854	T	26	Very low	29	Very low	131 Å²	131	140.8 Å²	140.8	80%	0.804	76%	0.76	S	S	*	*			trans	-169.6	143.9	136.7	30.3	0	0	0	0	108
855	I	29.2	Very low	28.8	Very low	157 Å²	157	137.4 Å²	137.4	81%	0.805	75%	0.749	S	S	*	*			cis	-154.8	155.6	-27.4	-121.1	167.8	0	0	0	105.2
856	D	31.1	Very low	29.1	Very low	142 Å²	142	133.9 Å²	133.9	76%	0.759	74%	0.738	S	S	*	*			trans	-111	159.7	179.1	-168.1	67.3	0	0	0	110.6	G858	D856-G858 PolarHBondContact OD2-N 3.01Å; D856-G858 VanDerWaalsContact OD2-N 3.15Å
857	D	26.7	Very low	28.9	Very low	160 Å²	160	138.8 Å²	138.8	86%	0.856	75%	0.747	S	S	*	*			trans	-128.9	91.2	163.1	-96.3	-36.8	0	0	0	105.1
858	G	30.1	Very low	28.8	Very low	51 Å²	51	137.8 Å²	137.8	53%	0.526	75%	0.745	S	S	.	*				98	148.2	83.6	0	0	0	0	0	111.3	D856	D856-G858 PolarHBondContact OD2-N 3.01Å; D856-G858 VanDerWaalsContact OD2-N 3.15Å
859	L	36.9	Very low	29.1	Very low	150 Å²	150	132.2 Å²	132.2	79%	0.785	74%	0.737	S	S	*	*			cis	-148.3	175.9	3.5	-60.4	169.4	0	0	0	106.3
860	E	34.5	Very low	29.5	Very low	146 Å²	146	134.2 Å²	134.2	68%	0.682	74%	0.739	S	S	*	*			cis	-159.5	-159.3	2.7	-132.2	156.5	-145.3	0	0	105.7
861	M	36.8	Very low	29.8	Very low	139 Å²	139	137.8 Å²	137.8	69%	0.685	75%	0.747	S	S	*	*			cis	-163.7	162.8	3.7	-136.1	-170.9	-79.2	0	0	107.4
862	E	32.4	Very low	30.3	Very low	139 Å²	139	137.6 Å²	137.6	65%	0.65	75%	0.746	S	S	*	*			trans	46.3	140.4	154.1	-53	-51.8	76.6	0	0	122.1
863	Q	31.5	Very low	30.7	Very low	151 Å²	151	137.1 Å²	137.1	71%	0.706	74%	0.739	S	S	*	*			cis	-162	150.9	2.4	-133.4	168.6	37.6	0	0	110.8
864	D	26.4	Very low	30.9	Very low	143 Å²	143	137.5 Å²	137.5	77%	0.765	74%	0.739	S	S	*	*			trans	47.8	159.1	147.8	-97.2	38.8	0	0	0	122.5
865	S	29.1	Very low	31.2	Very low	86 Å²	86	138.3 Å²	138.3	60%	0.601	74%	0.737	S	S	*	*			cis	-174.5	165.4	-16.4	41.7	0	0	0	0	108.1
866	T	31.5	Very low	31.3	Very low	119 Å²	119	136.4 Å²	136.4	73%	0.73	74%	0.737	S	S	*	*			cis	-166.6	152.6	-21	29.6	0	0	0	0	108.3
867	E	29.4	Very low	31.4	Very low	188 Å²	188	141.8 Å²	141.8	88%	0.879	75%	0.747	S	S	*	*			trans	62.9	159.1	162.2	-72.4	-178.3	162.6	0	0	118.4
868	S	24.8	Very low	31.5	Very low	99 Å²	99	138 Å²	138	69%	0.692	75%	0.746	S	S	*	*			cis	-162.5	171.3	-20.9	55	0	0	0	0	109.5
869	A	30.7	Very low	32	Very low	86 Å²	86	144.5 Å²	144.5	71%	0.711	76%	0.76	S	S	*	*			trans	30.2	145.6	141.7	0	0	0	0	0	121.8
870	D	30.5	Very low	31.9	Very low	154 Å²	154	147.4 Å²	147.4	82%	0.824	77%	0.766	S	S	*	*			cis	-177.8	-163.2	-17.4	-131.7	-45.2	0	0	0	107.1
871	E	31.2	Very low	32.4	Very low	193 Å²	193	147.5 Å²	147.5	90%	0.902	77%	0.765	S	S	*	*			trans	74.9	175.7	160.6	-53.5	-151.1	147.6	0	0	118.8
872	E	36	Very low	32.8	Very low	160 Å²	160	150.6 Å²	150.6	75%	0.748	77%	0.774	S	S	*	*			trans	-142.6	172.4	-135.5	-141.4	-162.8	125.7	0	0	113.9
873	Q	31.2	Very low	33.3	Very low	137 Å²	137	150 Å²	150	64%	0.64	77%	0.772	S	S	*	*			trans	74.2	120.5	151.8	-75	177.6	36.4	0	0	122.5
874	M	33.1	Very low	34.1	Very low	157 Å²	157	148.3 Å²	148.3	77%	0.773	77%	0.768	S	S	*	*				91.8	149.5	124.1	-72.3	-72	-162.6	0	0	122.9
875	L	31.5	Very low	35.5	Very low	147 Å²	147	144.3 Å²	144.3	77%	0.77	76%	0.76	S	S	*	*			trans	64.1	81.5	153.6	-100.4	63	0	0	0	121
876	C	32.3	Very low	36.6	Very low	118 Å²	118	146.3 Å²	146.3	80%	0.797	76%	0.758	S	S	*	*				22.4	132.4	118.7	-63.8	0	0	0	0	121.3
877	R	32.5	Very low	37.8	Very low	255 Å²	255	143.6 Å²	143.6	96%	0.962	75%	0.747	S	S	*	*			trans	88.7	116.8	161.3	-61.5	-178.7	164.7	-157.2	-3.1	117.3
878	G	28.5	Very low	39.3	Very low	81 Å²	81	140.3 Å²	140.3	84%	0.835	73%	0.732	S	S	*	*			trans	173.3	82.7	165.5	0	0	0	0	0	113.1
879	F	41.7	Very low	41.5	Very low	186 Å²	186	142.1 Å²	142.1	82%	0.816	73%	0.729	S	S	*	*			trans	-80.5	125.3	167.8	-108.3	-96.4	0	0	0	109.3	F881	F879-F881 HydrophobicContact CE1-CE2 4.41Å
880	F	33.9	Very low	43.5	Very low	212 Å²	212	141 Å²	141	93%	0.93	71%	0.712	S	S	*	*			trans	-158	142.8	142.6	-113.8	-73.8	0	0	0	110.8
881	F	46.1	Very low	45.5	Very low	148 Å²	148	138.2 Å²	138.2	65%	0.649	69%	0.694	S	S	*	*			trans	-82.1	139.8	-173.8	-98.3	-110.5	0	0	0	113.3	F879 D884	F879-F881 HydrophobicContact CE1-CE2 4.41Å; F881-D884 WeakPolarHBondContact CD1-OD1 3.46Å; F881-D884 WeakPolarHBondContact CE1-OD1 3.49Å
882	K	45.3	Very low	47.7	Very low	203 Å²	203	131.3 Å²	131.3	88%	0.883	67%	0.67	S	S	*	*			trans	-159.8	158.4	144	-124.8	164.5	-176.8	172.7	0	111.2
883	E	41.5	Very low	49.9	Very low	128 Å²	128	129.8 Å²	129.8	60%	0.598	66%	0.663	S	S	*	*			trans	76.7	57.3	177.3	-151.6	178.8	-109.9	0	0	116.8	G885 K886	E883-G885 PolarHBondContact O-N 3.22Å; E883-K886 IonicContact OE1-NZ 3.52Å; E883-K886 WeakPolarHBondContact OE2-CD 3.5Å; E883-K886 VanDerWaalsContact OE2-CE 3.27Å; E883-K886 WeakPolarHBondContact OE2-CE 3.39Å; E883-K886 IonicContact OE2-NZ 2.76Å; E883-K886 PolarHBondContact OE2-NZ 2.57Å
884	D	49.8	Very low	52.4	Low	115 Å²	115	131.5 Å²	131.5	62%	0.615	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	12.8	175.5	-59.9	-75.5	0	0	0	116.1	F881	F881-D884 WeakPolarHBondContact CD1-OD1 3.46Å; F881-D884 WeakPolarHBondContact CE1-OD1 3.49Å
885	G	54.6	Low	54.9	Low	58 Å²	58	130.2 Å²	130.2	60%	0.598	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	-39.1	178.1	0	0	0	0	0	114	E883	E883-G885 PolarHBondContact O-N 3.22Å
886	K	52.5	Low	57.3	Low	129 Å²	129	125.9 Å²	125.9	56%	0.561	64%	0.636	S	S	*	*	H	α-helix	trans	-87.8	-10.4	-169.6	-66.1	167	-175	160	0	113.9	E883 N890	E883-K886 IonicContact OE1-NZ 3.52Å; E883-K886 WeakPolarHBondContact OE2-CD 3.5Å; E883-K886 VanDerWaalsContact OE2-CE 3.27Å; E883-K886 WeakPolarHBondContact OE2-CE 3.39Å; E883-K886 IonicContact OE2-NZ 2.76Å; E883-K886 PolarHBondContact OE2-NZ 2.57Å; K886-N890 WeakPolarHBondContact O-CB 3.43Å; K886-N890 PolarHBondContact O-N 2.9Å
887	A	57.5	Low	59.9	Low	61 Å²	61	122.8 Å²	122.8	50%	0.504	62%	0.619	S	S	.	*	H	α-helix	trans	-74.4	-43.5	-175.2	0	0	0	0	0	113.2	M891	A887-M891 WeakPolarHBondContact O-CB 3.45Å; A887-M891 PolarHBondContact O-N 2.74Å
888	E	60.7	Low	62.5	Low	120 Å²	120	116.2 Å²	116.2	56%	0.561	60%	0.602	S	S	*	*	H	α-helix	trans	-65.8	-44.1	177.2	-169	68.4	-117.7	0	0	110.5	M891 A892 R895	E888-M891 CarbonylContact O-C 3.31Å; E888-M891 PolarHBondContact O-N 2.89Å; E888-M891 VanDerWaalsContact O-N 3.14Å; E888-A892 WeakPolarHBondContact O-CB 3.35Å; E888-A892 PolarHBondContact O-N 3.35Å; E888-R895 IonicContact OE1-NH1 2.68Å; E888-R895 PolarHBondContact OE1-NH1 3.37Å
889	E	70.3	Confident	65.3	Low	136 Å²	136	117.3 Å²	117.3	64%	0.636	59%	0.588	S	S	*	*	H	α-helix	trans	-61.5	-46	176.5	-174.6	172.5	-145.6	0	0	111.8	M891 A892 Q893	E889-M891 PolarHBondContact O-N 3.31Å; E889-A892 PolarHBondContact O-N 2.93Å; E889-Q893 VanDerWaalsContact O-CB 3.31Å; E889-Q893 WeakPolarHBondContact O-CB 3.4Å; E889-Q893 PolarHBondContact O-N 3.46Å
890	N	72.7	Confident	67.4	Low	64 Å²	64	114.2 Å²	114.2	34%	0.342	58%	0.576	S	S	.	*	H	α-helix	trans	-65.5	-29.6	176.3	-155.6	-102.9	0	0	0	112.1	K886 R894	K886-N890 WeakPolarHBondContact O-CB 3.43Å; K886-N890 PolarHBondContact O-N 2.9Å; N890-R894 WeakPolarHBondContact O-CB 3.45Å; N890-R894 WeakPolarHBondContact O-CG 3.47Å; N890-R894 PolarHBondContact O-N 3.39Å; N890-R894 VanDerWaalsContact OD1-CZ 3.22Å; N890-R894 PolarHBondContact OD1-NE 3.4Å; N890-R894 PolarHBondContact OD1-NH2 3.32Å
891	M	72.6	Confident	70	Confident	94 Å²	94	111.3 Å²	111.3	46%	0.463	56%	0.563	S	S	.	*	H	α-helix	trans	-73.9	-39	173	-157.3	-179.3	-51.8	0	0	112.3	A887 E888 E889 R894 R895	A887-M891 WeakPolarHBondContact O-CB 3.45Å; A887-M891 PolarHBondContact O-N 2.74Å; E888-M891 CarbonylContact O-C 3.31Å; E888-M891 PolarHBondContact O-N 2.89Å; E888-M891 VanDerWaalsContact O-N 3.14Å; E889-M891 PolarHBondContact O-N 3.31Å; M891-R894 PolarHBondContact O-N 3.17Å; M891-R895 WeakPolarHBondContact O-CB 3.44Å; M891-R895 WeakPolarHBondContact O-CD 3.11Å; M891-R895 WeakPolarHBondContact O-CG 3.47Å; M891-R895 PolarHBondContact O-N 3.24Å; M891-R895 PolarHBondContact SD-NH2 2.9Å
892	A	77.8	Confident	72	Confident	48 Å²	48	111.3 Å²	111.3	40%	0.397	56%	0.559	S	S	.	*	H	α-helix	trans	-62.8	-45.1	172.4	0	0	0	0	0	111.5	E888 E889 R894 R895 A896	E888-A892 WeakPolarHBondContact O-CB 3.35Å; E888-A892 PolarHBondContact O-N 3.35Å; E889-A892 PolarHBondContact O-N 2.93Å; A892-R894 PolarHBondContact O-N 2.87Å; A892-R895 WeakPolarHBondContact O-CB 3.47Å; A892-R895 PolarHBondContact O-N 2.95Å; A892-R895 VanDerWaalsContact O-N 3.17Å; A892-A896 WeakPolarHBondContact O-CB 3.41Å; A892-A896 PolarHBondContact O-N 3.29Å
893	Q	81.9	Confident	73.8	Confident	128 Å²	128	107.7 Å²	107.7	60%	0.598	55%	0.547	S	S	*	.	H	α-helix	trans	-65	-38.6	177	-160.5	177.6	49.6	0	0	111.7	E889 A896 A897	E889-Q893 VanDerWaalsContact O-CB 3.31Å; E889-Q893 WeakPolarHBondContact O-CB 3.4Å; E889-Q893 PolarHBondContact O-N 3.46Å; Q893-A896 PolarHBondContact O-N 2.86Å; Q893-A897 WeakPolarHBondContact O-CB 3.49Å; Q893-A897 PolarHBondContact O-N 3.45Å
894	R	84.4	Confident	75.9	Confident	174 Å²	174	110.1 Å²	110.1	66%	0.657	55%	0.551	S	S	*	*	H	α-helix	trans	-64.9	-40.1	170.2	-73.9	172	-160.3	-142.4	4.8	112.7	N890 M891 A892 L898	N890-R894 WeakPolarHBondContact O-CB 3.45Å; N890-R894 WeakPolarHBondContact O-CG 3.47Å; N890-R894 PolarHBondContact O-N 3.39Å; N890-R894 VanDerWaalsContact OD1-CZ 3.22Å; N890-R894 PolarHBondContact OD1-NE 3.4Å; N890-R894 PolarHBondContact OD1-NH2 3.32Å; M891-R894 PolarHBondContact O-N 3.17Å; A892-R894 PolarHBondContact O-N 2.87Å; R894-L898 VanDerWaalsContact O-CB 3.32Å; R894-L898 WeakPolarHBondContact O-CB 3.46Å; R894-L898 PolarHBondContact O-N 3.01Å
895	R	84.3	Confident	77.4	Confident	129 Å²	129	111.8 Å²	111.8	49%	0.487	55%	0.548	S	S	.	.	H	α-helix	trans	-62.4	-45.5	174.1	-72.1	160.5	179.3	149.9	-4.5	110.5	E888 M891 A892 L898 L899	E888-R895 IonicContact OE1-NH1 2.68Å; E888-R895 PolarHBondContact OE1-NH1 3.37Å; M891-R895 WeakPolarHBondContact O-CB 3.44Å; M891-R895 WeakPolarHBondContact O-CD 3.11Å; M891-R895 WeakPolarHBondContact O-CG 3.47Å; M891-R895 PolarHBondContact O-N 3.24Å; M891-R895 PolarHBondContact SD-NH2 2.9Å; A892-R895 WeakPolarHBondContact O-CB 3.47Å; A892-R895 PolarHBondContact O-N 2.95Å; A892-R895 VanDerWaalsContact O-N 3.17Å; R895-L898 PolarHBondContact O-N 3.32Å; R895-L899 WeakPolarHBondContact O-CG 3.5Å; R895-L899 PolarHBondContact O-N 3.31Å
896	A	81.7	Confident	78.9	Confident	56 Å²	56	113 Å²	113	46%	0.463	54%	0.538	S	S	.	.	H	α-helix	trans	-61.9	-50.8	176.8	0	0	0	0	0	112.1	A892 Q893 L898 L899 E900	A892-A896 WeakPolarHBondContact O-CB 3.41Å; A892-A896 PolarHBondContact O-N 3.29Å; Q893-A896 PolarHBondContact O-N 2.86Å; A896-L898 VanDerWaalsContact C-N 3.27Å; A896-L898 PolarHBondContact O-N 3.06Å; A896-L899 CarbonylContact O-C 3.54Å; A896-L899 WeakPolarHBondContact O-CB 3.25Å; A896-L899 PolarHBondContact O-N 2.69Å; A896-L899 VanDerWaalsContact O-N 3.12Å; A896-E900 PolarHBondContact O-N 3.02Å
897	A	87.8	Confident	80.6	Confident	53 Å²	53	113.6 Å²	113.6	44%	0.438	54%	0.541	S	S	.	.	H	α-helix	trans	-61.8	-32.4	177.4	0	0	0	0	0	112.9	Q893 K901	Q893-A897 WeakPolarHBondContact O-CB 3.49Å; Q893-A897 PolarHBondContact O-N 3.45Å; A897-K901 WeakPolarHBondContact O-CB 3.46Å; A897-K901 PolarHBondContact O-N 2.94Å
898	L	86.6	Confident	81.8	Confident	118 Å²	118	114.2 Å²	114.2	62%	0.618	53%	0.533	S	S	*	.	H	α-helix	trans	-72.3	-39.1	174.8	-161.3	158.2	0	0	0	111.6	R894 R895 A896 K901 R902	R894-L898 VanDerWaalsContact O-CB 3.32Å; R894-L898 WeakPolarHBondContact O-CB 3.46Å; R894-L898 PolarHBondContact O-N 3.01Å; R895-L898 PolarHBondContact O-N 3.32Å; A896-L898 VanDerWaalsContact C-N 3.27Å; A896-L898 PolarHBondContact O-N 3.06Å; L898-K901 CarbonylContact O-C 3.52Å; L898-K901 PolarHBondContact O-N 3.2Å; L898-R902 PolarHBondContact O-N 3.09Å
899	L	87.4	Confident	82.9	Confident	104 Å²	104	112.1 Å²	112.1	55%	0.545	53%	0.532	S	S	.	.	H	α-helix	trans	-64.5	-46	171.9	-74.4	169.5	0	0	0	111.6	R895 A896 K901 R902 M903	R895-L899 WeakPolarHBondContact O-CG 3.5Å; R895-L899 PolarHBondContact O-N 3.31Å; A896-L899 CarbonylContact O-C 3.54Å; A896-L899 WeakPolarHBondContact O-CB 3.25Å; A896-L899 PolarHBondContact O-N 2.69Å; A896-L899 VanDerWaalsContact O-N 3.12Å; L899-K901 VanDerWaalsContact C-N 3.35Å; L899-K901 PolarHBondContact O-N 3.35Å; L899-R902 CarbonylContact O-C 3.54Å; L899-R902 WeakPolarHBondContact O-CA 3.37Å; L899-R902 VanDerWaalsContact O-CB 3.3Å; L899-R902 WeakPolarHBondContact O-CB 3.28Å; L899-R902 PolarHBondContact O-N 2.84Å; L899-M903 WeakPolarHBondContact O-CG 3.41Å; L899-M903 PolarHBondContact O-N 3.4Å
900	E	85.6	Confident	83.6	Confident	121 Å²	121	111.3 Å²	111.3	57%	0.565	53%	0.528	S	S	*	.	H	α-helix	trans	-60.7	-44.7	174.8	-163.3	-155.2	147.1	0	0	110.9	A896 R902 M903 R904	A896-E900 PolarHBondContact O-N 3.02Å; E900-R902 PolarHBondContact O-N 3.22Å; E900-M903 PolarHBondContact O-N 2.9Å; E900-M903 VanDerWaalsContact O-N 3.16Å; E900-R904 WeakPolarHBondContact O-CB 3.35Å; E900-R904 PolarHBondContact O-N 2.92Å
901	K	89.4	Confident	84	Confident	150 Å²	150	113.4 Å²	113.4	65%	0.652	54%	0.537	S	S	*	.	H	α-helix	trans	-67.8	-12.1	173.8	-166.9	166.8	-174.5	170.2	0	113.4	A897 L898 L899 R905	A897-K901 WeakPolarHBondContact O-CB 3.46Å; A897-K901 PolarHBondContact O-N 2.94Å; L898-K901 CarbonylContact O-C 3.52Å; L898-K901 PolarHBondContact O-N 3.2Å; L899-K901 VanDerWaalsContact C-N 3.35Å; L899-K901 PolarHBondContact O-N 3.35Å; K901-R905 WeakPolarHBondContact O-CG 3.47Å; K901-R905 PolarHBondContact O-NE 3.04Å; K901-R905 PolarHBondContact O-NH2 2.92Å
902	R	87.6	Confident	84.7	Confident	149 Å²	149	115.4 Å²	115.4	56%	0.562	54%	0.54	S	S	*	.	H	α-helix	trans	-83.8	-53.1	165	-178	-177.6	171.7	179.8	-1.4	110.2	L898 L899 E900 R904 R905 E906	L898-R902 PolarHBondContact O-N 3.09Å; L899-R902 CarbonylContact O-C 3.54Å; L899-R902 WeakPolarHBondContact O-CA 3.37Å; L899-R902 VanDerWaalsContact O-CB 3.3Å; L899-R902 WeakPolarHBondContact O-CB 3.28Å; L899-R902 PolarHBondContact O-N 2.84Å; E900-R902 PolarHBondContact O-N 3.22Å; R902-R904 VanDerWaalsContact C-N 3.27Å; R902-R904 PolarHBondContact O-N 2.93Å; R902-R905 PolarHBondContact O-N 3.4Å; R902-R905 VanDerWaalsContact O-N 3.1Å; R902-E906 WeakPolarHBondContact O-CB 3.4Å; R902-E906 PolarHBondContact O-N 3.37Å
903	M	82.8	Confident	85.1	Confident	127 Å²	127	119.4 Å²	119.4	63%	0.626	55%	0.548	S	S	*	.	H	α-helix	trans	-55.6	-40	178.1	-65.3	-60.2	-68.4	0	0	112.3	L899 E900 E906 K907	L899-M903 WeakPolarHBondContact O-CG 3.41Å; L899-M903 PolarHBondContact O-N 3.4Å; E900-M903 PolarHBondContact O-N 2.9Å; E900-M903 VanDerWaalsContact O-N 3.16Å; M903-E906 PolarHBondContact O-N 3.43Å; M903-K907 WeakPolarHBondContact O-CB 3.29Å; M903-K907 PolarHBondContact O-N 2.89Å
904	R	85.9	Confident	85	Confident	179 Å²	179	120 Å²	120	68%	0.675	55%	0.552	S	S	*	*	H	α-helix	trans	-65.9	-42.9	176.8	-166.3	173.8	-173	124.3	0.3	112.3	E900 R902 E906 K907 E908	E900-R904 WeakPolarHBondContact O-CB 3.35Å; E900-R904 PolarHBondContact O-N 2.92Å; R902-R904 VanDerWaalsContact C-N 3.27Å; R902-R904 PolarHBondContact O-N 2.93Å; R904-E906 VanDerWaalsContact C-N 3.33Å; R904-K907 PolarHBondContact O-N 3.41Å; R904-E908 WeakPolarHBondContact O-CB 3.47Å; R904-E908 PolarHBondContact O-N 3.5Å
905	R	82.3	Confident	85	Confident	149 Å²	149	117.9 Å²	117.9	56%	0.562	55%	0.55	S	S	*	*	H	α-helix	trans	-68.1	-32.7	174	-78.7	-177	-68.4	156.8	0.4	112.5	K901 R902 S909	K901-R905 WeakPolarHBondContact O-CG 3.47Å; K901-R905 PolarHBondContact O-NE 3.04Å; K901-R905 PolarHBondContact O-NH2 2.92Å; R902-R905 PolarHBondContact O-N 3.4Å; R902-R905 VanDerWaalsContact O-N 3.1Å; R905-S909 WeakPolarHBondContact O-CB 3.14Å; R905-S909 PolarHBondContact O-N 3.45Å
906	E	85.9	Confident	85.1	Confident	85 Å²	85	116.9 Å²	116.9	40%	0.397	55%	0.554	S	S	.	*	H	α-helix	trans	-70.6	-44.9	175.8	-172.3	145.1	-158.8	0	0	111	R902 M903 R904 S909 Q910	R902-E906 WeakPolarHBondContact O-CB 3.4Å; R902-E906 PolarHBondContact O-N 3.37Å; M903-E906 PolarHBondContact O-N 3.43Å; R904-E906 VanDerWaalsContact C-N 3.33Å; E906-S909 WeakPolarHBondContact O-CB 3.31Å; E906-S909 PolarHBondContact O-N 3.36Å; E906-Q910 WeakPolarHBondContact O-CB 3.23Å; E906-Q910 VanDerWaalsContact O-CG 3.3Å; E906-Q910 WeakPolarHBondContact O-CG 3.46Å; E906-Q910 PolarHBondContact O-N 3.46Å
907	K	86.9	Confident	85.1	Confident	140 Å²	140	119.3 Å²	119.3	61%	0.609	56%	0.555	S	S	*	*	H	α-helix	trans	-62.6	-42	171.8	-169.9	172.2	-176.2	175.3	0	112.2	M903 R904 Q910 M911	M903-K907 WeakPolarHBondContact O-CB 3.29Å; M903-K907 PolarHBondContact O-N 2.89Å; R904-K907 PolarHBondContact O-N 3.41Å; K907-Q910 PolarHBondContact O-N 2.85Å; K907-M911 WeakPolarHBondContact O-CB 3.23Å; K907-M911 WeakPolarHBondContact O-CG 3.45Å; K907-M911 PolarHBondContact O-N 3.5Å
908	E	82.4	Confident	84.9	Confident	74 Å²	74	119.7 Å²	119.7	35%	0.346	56%	0.559	S	S	.	*	H	α-helix	trans	-63.9	-38.6	174.4	-169.2	-169.3	150.2	0	0	112.1	R904 R912	R904-E908 WeakPolarHBondContact O-CB 3.47Å; R904-E908 PolarHBondContact O-N 3.5Å; E908-R912 PolarHBondContact O-N 2.91Å; E908-R912 IonicContact OE1-CZ 3.59Å; E908-R912 IonicContact OE1-NH1 2.68Å; E908-R912 PolarHBondContact OE1-NH1 3.15Å; E908-R912 IonicContact OE1-NH2 2.73Å; E908-R912 PolarHBondContact OE1-NH2 3.36Å
909	S	84.6	Confident	84.8	Confident	76 Å²	76	118.4 Å²	118.4	53%	0.531	55%	0.549	S	S	.	.	H	α-helix	trans	-66.6	-42.7	173.5	-173.1	0	0	0	0	112	R905 E906 R912 K913	R905-S909 WeakPolarHBondContact O-CB 3.14Å; R905-S909 PolarHBondContact O-N 3.45Å; E906-S909 WeakPolarHBondContact O-CB 3.31Å; E906-S909 PolarHBondContact O-N 3.36Å; S909-R912 PolarHBondContact O-N 3.3Å; S909-K913 WeakPolarHBondContact O-CB 3.49Å; S909-K913 PolarHBondContact O-N 3.49Å
910	Q	84.6	Confident	84.5	Confident	119 Å²	119	118 Å²	118	56%	0.556	55%	0.547	S	S	*	.	H	α-helix	trans	-65	-41.6	175.3	-72.4	174.9	13.4	0	0	111.9	E906 K907 K913 M914	E906-Q910 WeakPolarHBondContact O-CB 3.23Å; E906-Q910 VanDerWaalsContact O-CG 3.3Å; E906-Q910 WeakPolarHBondContact O-CG 3.46Å; E906-Q910 PolarHBondContact O-N 3.46Å; K907-Q910 PolarHBondContact O-N 2.85Å; Q910-K913 WeakPolarHBondContact O-CB 3.42Å; Q910-K913 PolarHBondContact O-N 2.82Å; Q910-M914 WeakPolarHBondContact O-CB 3.41Å; Q910-M914 PolarHBondContact O-N 2.87Å
911	M	81.4	Confident	84	Confident	109 Å²	109	115.6 Å²	115.6	54%	0.537	54%	0.536	S	S	.	.	H	α-helix	trans	-63.4	-47.7	173.8	-71.4	-169.7	-50.8	0	0	111.5	K907 K913 M914 E915	K907-M911 WeakPolarHBondContact O-CB 3.23Å; K907-M911 WeakPolarHBondContact O-CG 3.45Å; K907-M911 PolarHBondContact O-N 3.5Å; M911-K913 VanDerWaalsContact C-N 3.26Å; M911-K913 PolarHBondContact O-N 2.86Å; M911-M914 PolarHBondContact O-N 3.35Å; M911-M914 VanDerWaalsContact O-N 3.15Å; M911-E915 VanDerWaalsContact O-CB 3.29Å; M911-E915 WeakPolarHBondContact O-CB 3.45Å; M911-E915 PolarHBondContact O-N 2.95Å
912	R	87.3	Confident	83.1	Confident	135 Å²	135	115.3 Å²	115.3	51%	0.509	54%	0.537	S	S	.	.	H	α-helix	trans	-61	-32.8	173.7	-76.5	-160.5	-172.2	92.8	9.6	113.2	E908 S909 L916	E908-R912 PolarHBondContact O-N 2.91Å; E908-R912 IonicContact OE1-CZ 3.59Å; E908-R912 IonicContact OE1-NH1 2.68Å; E908-R912 PolarHBondContact OE1-NH1 3.15Å; E908-R912 IonicContact OE1-NH2 2.73Å; E908-R912 PolarHBondContact OE1-NH2 3.36Å; S909-R912 PolarHBondContact O-N 3.3Å; R912-L916 WeakPolarHBondContact O-CB 3.34Å; R912-L916 VanDerWaalsContact O-CG 3.28Å; R912-L916 WeakPolarHBondContact O-CG 3.49Å; R912-L916 PolarHBondContact O-N 3.34Å
913	K	86.6	Confident	82.9	Confident	132 Å²	132	114.5 Å²	114.5	57%	0.574	54%	0.538	S	S	*	.	H	α-helix	trans	-66.3	-47.6	173.9	-168.8	-157.3	168.7	-115.6	0	110.6	S909 Q910 M911 E915 L916 E917	S909-K913 WeakPolarHBondContact O-CB 3.49Å; S909-K913 PolarHBondContact O-N 3.49Å; Q910-K913 WeakPolarHBondContact O-CB 3.42Å; Q910-K913 PolarHBondContact O-N 2.82Å; M911-K913 VanDerWaalsContact C-N 3.26Å; M911-K913 PolarHBondContact O-N 2.86Å; K913-E915 VanDerWaalsContact C-N 3.34Å; K913-E915 PolarHBondContact O-N 2.85Å; K913-L916 PolarHBondContact O-N 2.9Å; K913-E917 IonicContact NZ-OE2 2.66Å; K913-E917 PolarHBondContact NZ-OE2 3.19Å; K913-E917 VanDerWaalsContact O-CB 3.23Å; K913-E917 WeakPolarHBondContact O-CB 3.48Å; K913-E917 PolarHBondContact O-N 3.27Å
914	M	80	Confident	82.5	Confident	140 Å²	140	112.8 Å²	112.8	69%	0.69	53%	0.527	S	S	*	.	H	α-helix	trans	-62	-40.5	177.5	-174.6	-178.6	-71.8	0	0	111.8	Q910 M911 E917 A918	Q910-M914 WeakPolarHBondContact O-CB 3.41Å; Q910-M914 PolarHBondContact O-N 2.87Å; M911-M914 PolarHBondContact O-N 3.35Å; M911-M914 VanDerWaalsContact O-N 3.15Å; M914-E917 PolarHBondContact O-N 3.38Å; M914-A918 WeakPolarHBondContact O-CB 3.45Å; M914-A918 PolarHBondContact O-N 2.98Å
915	E	83.8	Confident	81.7	Confident	131 Å²	131	108.8 Å²	108.8	61%	0.612	52%	0.516	S	S	*	.	H	α-helix	trans	-62.3	-47.5	174.8	-177.5	179.2	-145.6	0	0	112	M911 K913 E917 A918 E919	M911-E915 VanDerWaalsContact O-CB 3.29Å; M911-E915 WeakPolarHBondContact O-CB 3.45Å; M911-E915 PolarHBondContact O-N 2.95Å; K913-E915 VanDerWaalsContact C-N 3.34Å; K913-E915 PolarHBondContact O-N 2.85Å; E915-E917 VanDerWaalsContact C-N 3.34Å; E915-E917 PolarHBondContact O-N 2.88Å; E915-A918 PolarHBondContact O-N 3.35Å; E915-E919 PolarHBondContact O-N 2.74Å
916	L	86.1	Confident	81.2	Confident	107 Å²	107	103.7 Å²	103.7	56%	0.56	51%	0.51	S	S	*	.	H	α-helix	trans	-67.1	-32.6	174.8	-74.8	168.6	0	0	0	113	R912 K913 L920	R912-L916 WeakPolarHBondContact O-CB 3.34Å; R912-L916 VanDerWaalsContact O-CG 3.28Å; R912-L916 WeakPolarHBondContact O-CG 3.49Å; R912-L916 PolarHBondContact O-N 3.34Å; K913-L916 PolarHBondContact O-N 2.9Å; L916-L920 VanDerWaalsContact O-CB 3.23Å; L916-L920 WeakPolarHBondContact O-CB 3.36Å; L916-L920 PolarHBondContact O-N 2.82Å
917	E	81.9	Confident	80.5	Confident	107 Å²	107	102 Å²	102	50%	0.5	51%	0.51	S	S	.	.	H	α-helix	trans	-69.6	-41	175.6	-166.2	153.4	-166.5	0	0	110.1	K913 M914 E915 L920 E921	K913-E917 IonicContact NZ-OE2 2.66Å; K913-E917 PolarHBondContact NZ-OE2 3.19Å; K913-E917 VanDerWaalsContact O-CB 3.23Å; K913-E917 WeakPolarHBondContact O-CB 3.48Å; K913-E917 PolarHBondContact O-N 3.27Å; M914-E917 PolarHBondContact O-N 3.38Å; E915-E917 VanDerWaalsContact C-N 3.34Å; E915-E917 PolarHBondContact O-N 2.88Å; E917-L920 PolarHBondContact O-N 3.26Å; E917-E921 PolarHBondContact O-N 2.84Å
918	A	84.2	Confident	79.7	Confident	61 Å²	61	102.6 Å²	102.6	50%	0.504	51%	0.508	S	S	.	.	H	α-helix	trans	-67.4	-42.4	172.3	0	0	0	0	0	113.5	M914 E915 L920 E921 Q922	M914-A918 WeakPolarHBondContact O-CB 3.45Å; M914-A918 PolarHBondContact O-N 2.98Å; E915-A918 PolarHBondContact O-N 3.35Å; A918-L920 VanDerWaalsContact C-N 3.26Å; A918-L920 PolarHBondContact O-N 2.71Å; A918-E921 PolarHBondContact O-N 3.44Å; A918-Q922 WeakPolarHBondContact O-CB 3.31Å; A918-Q922 PolarHBondContact O-N 3.34Å
919	E	84.4	Confident	78.5	Confident	91 Å²	91	106.9 Å²	106.9	43%	0.425	52%	0.523	S	S	.	.	H	α-helix	trans	-60.8	-39	174	-163.8	-138.7	129.3	0	0	110.8	E915 K923	E915-E919 PolarHBondContact O-N 2.74Å; E919-K923 WeakPolarHBondContact O-CB 3.42Å; E919-K923 PolarHBondContact O-N 3.48Å; E919-K923 IonicContact OE1-NZ 2.61Å; E919-K923 PolarHBondContact OE1-NZ 3.5Å
920	L	80.3	Confident	77.8	Confident	96 Å²	96	105.9 Å²	105.9	50%	0.503	52%	0.519	S	S	.	.	H	α-helix	trans	-70	-37.1	177.2	-165.5	153	0	0	0	111.6	L916 E917 A918 K923 K924	L916-L920 VanDerWaalsContact O-CB 3.23Å; L916-L920 WeakPolarHBondContact O-CB 3.36Å; L916-L920 PolarHBondContact O-N 2.82Å; E917-L920 PolarHBondContact O-N 3.26Å; A918-L920 VanDerWaalsContact C-N 3.26Å; A918-L920 PolarHBondContact O-N 2.71Å; L920-K923 PolarHBondContact O-N 3.41Å; L920-K924 HydrophobicContact CD2-CD 4.06Å; L920-K924 VanDerWaalsContact CD2-CE 3.47Å; L920-K924 HydrophobicContact CD2-CG 4.26Å; L920-K924 WeakPolarHBondContact O-CG 3.27Å; L920-K924 PolarHBondContact O-N 2.88Å
921	E	75.3	Confident	77.2	Confident	71 Å²	71	105.4 Å²	105.4	33%	0.332	52%	0.52	S	S	.	.	H	α-helix	trans	-66.5	-49	173.3	-140.2	63.3	-143.1	0	0	111.9	E917 A918 K923 K924 E925	E917-E921 PolarHBondContact O-N 2.84Å; A918-E921 PolarHBondContact O-N 3.44Å; E921-K923 PolarHBondContact O-N 2.88Å; E921-K924 WeakPolarHBondContact O-CA 3.3Å; E921-K924 WeakPolarHBondContact O-CB 3.33Å; E921-K924 PolarHBondContact O-N 3.39Å; E921-K924 WeakPolarHBondContact OE1-CD 3.44Å; E921-K924 IonicContact OE1-NZ 2.71Å; E921-K924 PolarHBondContact OE1-NZ 2.87Å; E921-K924 IonicContact OE2-NZ 3.29Å; E921-K924 PolarHBondContact OE2-NZ 2.91Å; E921-E925 WeakPolarHBondContact O-CG 3.24Å; E921-E925 PolarHBondContact O-N 2.94Å
922	Q	71.4	Confident	76.7	Confident	143 Å²	143	105.5 Å²	105.5	67%	0.668	52%	0.522	S	S	*	.	H	α-helix	trans	-56.5	-37.5	174	-170.1	-175.9	58.8	0	0	111.7	A918 E925 G926	A918-Q922 WeakPolarHBondContact O-CB 3.31Å; A918-Q922 PolarHBondContact O-N 3.34Å; Q922-E925 PolarHBondContact O-N 3.26Å; Q922-G926 PolarHBondContact O-N 3.28Å
923	K	82.9	Confident	75.5	Confident	132 Å²	132	103.8 Å²	103.8	57%	0.574	52%	0.52	S	S	*	.	H	α-helix	trans	-71.8	-33.8	175.3	-177.8	173.4	-90.2	144	0	113.1	E919 L920 E921 A927	E919-K923 WeakPolarHBondContact O-CB 3.42Å; E919-K923 PolarHBondContact O-N 3.48Å; E919-K923 IonicContact OE1-NZ 2.61Å; E919-K923 PolarHBondContact OE1-NZ 3.5Å; L920-K923 PolarHBondContact O-N 3.41Å; E921-K923 PolarHBondContact O-N 2.88Å; K923-A927 WeakPolarHBondContact O-CB 3.48Å; K923-A927 PolarHBondContact O-N 3.12Å; K923-A927 VanDerWaalsContact O-N 3.09Å
924	K	75	Confident	74.7	Confident	91 Å²	91	102.2 Å²	102.2	40%	0.396	52%	0.517	S	S	.	.	H	α-helix	trans	-64	-42.2	167.9	-73	163.3	175.1	165.4	0	110.7	L920 E921 A927 R928	L920-K924 HydrophobicContact CD2-CD 4.06Å; L920-K924 VanDerWaalsContact CD2-CE 3.47Å; L920-K924 HydrophobicContact CD2-CG 4.26Å; L920-K924 WeakPolarHBondContact O-CG 3.27Å; L920-K924 PolarHBondContact O-N 2.88Å; E921-K924 WeakPolarHBondContact O-CA 3.3Å; E921-K924 WeakPolarHBondContact O-CB 3.33Å; E921-K924 PolarHBondContact O-N 3.39Å; E921-K924 WeakPolarHBondContact OE1-CD 3.44Å; E921-K924 IonicContact OE1-NZ 2.71Å; E921-K924 PolarHBondContact OE1-NZ 2.87Å; E921-K924 IonicContact OE2-NZ 3.29Å; E921-K924 PolarHBondContact OE2-NZ 2.91Å; K924-A927 CarbonylContact O-C 3.57Å; K924-A927 WeakPolarHBondContact O-CB 3.48Å; K924-A927 PolarHBondContact O-N 3.08Å; K924-R928 WeakPolarHBondContact O-CG 3.38Å; K924-R928 PolarHBondContact O-N 3.12Å
925	E	69.4	Low	73.9	Confident	95 Å²	95	97.8 Å²	97.8	44%	0.444	50%	0.5	S	S	.	.	H	α-helix	trans	-67.7	-45.2	179.4	-67.4	-163.1	144.4	0	0	112.1	E921 Q922 A927 R928 Y929	E921-E925 WeakPolarHBondContact O-CG 3.24Å; E921-E925 PolarHBondContact O-N 2.94Å; Q922-E925 PolarHBondContact O-N 3.26Å; E925-A927 PolarHBondContact O-N 3.24Å; E925-R928 CarbonylContact O-C 3.56Å; E925-R928 WeakPolarHBondContact O-CA 3.44Å; E925-R928 WeakPolarHBondContact O-CB 3.4Å; E925-R928 PolarHBondContact O-N 3.3Å; E925-Y929 WeakPolarHBondContact O-CD2 3.28Å; E925-Y929 PolarHBondContact O-N 3.26Å
926	G	71.3	Confident	72.8	Confident	43 Å²	43	95.6 Å²	95.6	44%	0.443	49%	0.489	S	S	.	.	H	α-helix	trans	-54.7	-38.4	169.9	0	0	0	0	0	112.5	Q922 A930	Q922-G926 PolarHBondContact O-N 3.28Å; G926-A930 VanDerWaalsContact O-CB 3.28Å; G926-A930 WeakPolarHBondContact O-CB 3.36Å; G926-A930 PolarHBondContact O-N 3.37Å
927	A	71.7	Confident	72.1	Confident	48 Å²	48	94.2 Å²	94.2	40%	0.397	49%	0.485	S	S	.	.	H	α-helix	trans	-71.1	-32.5	173.6	0	0	0	0	0	113.7	K923 K924 E925 N931	K923-A927 WeakPolarHBondContact O-CB 3.48Å; K923-A927 PolarHBondContact O-N 3.12Å; K923-A927 VanDerWaalsContact O-N 3.09Å; K924-A927 CarbonylContact O-C 3.57Å; K924-A927 WeakPolarHBondContact O-CB 3.48Å; K924-A927 PolarHBondContact O-N 3.08Å; E925-A927 PolarHBondContact O-N 3.24Å; A927-N931 WeakPolarHBondContact O-CB 3.5Å; A927-N931 PolarHBondContact O-N 3.45Å; A927-N931 VanDerWaalsContact O-N 3.08Å; A927-N931 PolarHBondContact O-ND2 3.37Å
928	R	68.9	Low	71	Confident	153 Å²	153	95.4 Å²	95.4	58%	0.577	49%	0.488	S	S	*	.	H	α-helix	trans	-65.7	-50.9	171.2	-73.2	172.4	177.7	158.6	-1.1	110.6	K924 E925 A930 N931 L932	K924-R928 WeakPolarHBondContact O-CG 3.38Å; K924-R928 PolarHBondContact O-N 3.12Å; E925-R928 CarbonylContact O-C 3.56Å; E925-R928 WeakPolarHBondContact O-CA 3.44Å; E925-R928 WeakPolarHBondContact O-CB 3.4Å; E925-R928 PolarHBondContact O-N 3.3Å; R928-A930 PolarHBondContact O-N 2.89Å; R928-N931 PolarHBondContact O-N 3.42Å; R928-N931 VanDerWaalsContact O-N 3.14Å; R928-L932 PolarHBondContact O-N 3.16Å
929	Y	58.6	Low	70.4	Confident	165 Å²	165	97.5 Å²	97.5	65%	0.647	49%	0.49	S	S	*	.	H	α-helix	trans	-57.4	-45.5	175.6	-85.3	-75.6	0	0	0	111.7	E925 N931 L932 Q933	E925-Y929 WeakPolarHBondContact O-CD2 3.28Å; E925-Y929 PolarHBondContact O-N 3.26Å; Y929-N931 VanDerWaalsContact C-N 3.33Å; Y929-N931 PolarHBondContact O-N 3.34Å; Y929-L932 WeakPolarHBondContact O-CB 3.46Å; Y929-L932 PolarHBondContact O-N 3.13Å; Y929-L932 VanDerWaalsContact O-N 3.17Å; Y929-Q933 PolarHBondContact O-N 3.01Å
930	A	69.8	Low	68.9	Low	54 Å²	54	96.8 Å²	96.8	45%	0.446	49%	0.485	S	S	.	.	H	α-helix	trans	-61.3	-37.9	176.1	0	0	0	0	0	113	G926 R928 L934	G926-A930 VanDerWaalsContact O-CB 3.28Å; G926-A930 WeakPolarHBondContact O-CB 3.36Å; G926-A930 PolarHBondContact O-N 3.37Å; R928-A930 PolarHBondContact O-N 2.89Å; A930-L934 WeakPolarHBondContact O-CB 3.22Å; A930-L934 PolarHBondContact O-N 2.95Å
931	N	70.3	Confident	67.5	Low	110 Å²	110	95.1 Å²	95.1	59%	0.588	48%	0.482	S	S	*	.	H	α-helix	trans	-71.2	-34.9	174.5	-85.3	-84.7	0	0	0	112.8	A927 R928 Y929 L934 S935	A927-N931 WeakPolarHBondContact O-CB 3.5Å; A927-N931 PolarHBondContact O-N 3.45Å; A927-N931 VanDerWaalsContact O-N 3.08Å; A927-N931 PolarHBondContact O-ND2 3.37Å; R928-N931 PolarHBondContact O-N 3.42Å; R928-N931 VanDerWaalsContact O-N 3.14Å; Y929-N931 VanDerWaalsContact C-N 3.33Å; Y929-N931 PolarHBondContact O-N 3.34Å; N931-L934 PolarHBondContact O-N 2.86Å; N931-S935 PolarHBondContact O-N 3.45Å
932	L	71.8	Confident	66.4	Low	110 Å²	110	98.4 Å²	98.4	58%	0.576	50%	0.497	S	S	*	.	H	α-helix	trans	-66.3	-43.2	174.4	-164.1	70.8	0	0	0	110.9	R928 Y929 L934 S935 F936	R928-L932 PolarHBondContact O-N 3.16Å; Y929-L932 WeakPolarHBondContact O-CB 3.46Å; Y929-L932 PolarHBondContact O-N 3.13Å; Y929-L932 VanDerWaalsContact O-N 3.17Å; L932-L934 VanDerWaalsContact C-N 3.32Å; L932-L934 PolarHBondContact O-N 2.87Å; L932-S935 PolarHBondContact O-N 2.62Å; L932-S935 PolarHBondContact O-OG 3.48Å; L932-F936 WeakPolarHBondContact O-CB 3.19Å; L932-F936 PolarHBondContact O-N 3.46Å
933	Q	62.7	Low	65.3	Low	99 Å²	99	98.6 Å²	98.6	46%	0.463	49%	0.493	S	S	.	.	H	α-helix	trans	-58	-45.2	171.1	-152.6	87	48.4	0	0	111	E185 Y929 S935 F936 V937	E185-Q933 PolarHBondContact OE1-NE2 3.01Å; Y929-Q933 PolarHBondContact O-N 3.01Å; Q933-S935 VanDerWaalsContact C-N 3.33Å; Q933-S935 PolarHBondContact O-N 2.88Å; Q933-F936 PolarHBondContact O-N 2.84Å; Q933-V937 WeakPolarHBondContact O-CG2 3.34Å; Q933-V937 PolarHBondContact O-N 3.21Å
934	L	70.1	Confident	63.3	Low	99 Å²	99	99.8 Å²	99.8	52%	0.518	50%	0.498	S	S	.	.	H	α-helix	trans	-66	-31.6	178.4	-127.3	75.9	0	0	0	113.2	A930 N931 L932 K938	A930-L934 WeakPolarHBondContact O-CB 3.22Å; A930-L934 PolarHBondContact O-N 2.95Å; N931-L934 PolarHBondContact O-N 2.86Å; L932-L934 VanDerWaalsContact C-N 3.32Å; L932-L934 PolarHBondContact O-N 2.87Å; L934-K938 WeakPolarHBondContact O-CB 3.43Å; L934-K938 WeakPolarHBondContact O-CD 3.39Å; L934-K938 WeakPolarHBondContact O-CG 3.3Å; L934-K938 PolarHBondContact O-N 3.28Å
935	S	62.8	Low	62.1	Low	47 Å²	47	100.6 Å²	100.6	33%	0.329	51%	0.507	S	S	.	.	H	α-helix	trans	-74	-41	174.3	76.8	0	0	0	0	110.9	N931 L932 Q933 K938 I939	N931-S935 PolarHBondContact O-N 3.45Å; L932-S935 PolarHBondContact O-N 2.62Å; L932-S935 PolarHBondContact O-OG 3.48Å; Q933-S935 VanDerWaalsContact C-N 3.33Å; Q933-S935 PolarHBondContact O-N 2.88Å; S935-K938 WeakPolarHBondContact O-CB 3.36Å; S935-K938 PolarHBondContact O-N 2.93Å; S935-I939 VanDerWaalsContact O-CG1 3.28Å; S935-I939 WeakPolarHBondContact O-CG1 3.44Å; S935-I939 PolarHBondContact O-N 2.78Å
936	F	60.6	Low	61.2	Low	85 Å²	85	104.2 Å²	104.2	37%	0.373	52%	0.521	S	S	.	.	H	α-helix	trans	-62.4	-44.6	177.2	-143.1	-108.8	0	0	0	112.2	N184 E185 L932 Q933 K938 I939 K940	N184-F936 VanDerWaalsContact O-CE1 3.26Å; N184-F936 WeakPolarHBondContact O-CE1 3.49Å; E185-F936 HydrophobicContact CG-CD1 4.01Å; E185-F936 HydrophobicContact CG-CE1 4.32Å; L932-F936 WeakPolarHBondContact O-CB 3.19Å; L932-F936 PolarHBondContact O-N 3.46Å; Q933-F936 PolarHBondContact O-N 2.84Å; F936-K938 VanDerWaalsContact C-N 3.34Å; F936-K938 PolarHBondContact O-N 3.13Å; F936-I939 PolarHBondContact O-N 3.1Å; F936-K940 HydrophobicContact CD1-CD 4.26Å; F936-K940 HydrophobicContact CE1-CD 4.45Å; F936-K940 PolarHBondContact O-N 2.89Å
937	V	70.7	Confident	59.9	Low	78 Å²	78	107.2 Å²	107.2	47%	0.473	52%	0.522	S	S	.	.	H	α-helix	trans	-61.9	-39.9	173.4	171.1	0	0	0	0	111.7	Q933 S941	Q933-V937 WeakPolarHBondContact O-CG2 3.34Å; Q933-V937 PolarHBondContact O-N 3.21Å; V937-S941 VanDerWaalsContact O-CB 3.31Å; V937-S941 WeakPolarHBondContact O-CB 3.21Å; V937-S941 PolarHBondContact O-N 3.48Å
938	K	60.1	Low	58.8	Low	133 Å²	133	112.7 Å²	112.7	58%	0.578	54%	0.537	S	S	*	.	H	α-helix	trans	-64.8	-39.8	174	-75.8	168.3	-174.6	173.7	0	112.1	L934 S935 F936 S941 Q942	L934-K938 WeakPolarHBondContact O-CB 3.43Å; L934-K938 WeakPolarHBondContact O-CD 3.39Å; L934-K938 WeakPolarHBondContact O-CG 3.3Å; L934-K938 PolarHBondContact O-N 3.28Å; S935-K938 WeakPolarHBondContact O-CB 3.36Å; S935-K938 PolarHBondContact O-N 2.93Å; F936-K938 VanDerWaalsContact C-N 3.34Å; F936-K938 PolarHBondContact O-N 3.13Å; K938-S941 PolarHBondContact O-N 3.45Å; K938-Q942 WeakPolarHBondContact O-CB 3.48Å; K938-Q942 VanDerWaalsContact O-CG 3.26Å; K938-Q942 WeakPolarHBondContact O-CG 3.42Å; K938-Q942 PolarHBondContact O-N 3.16Å
939	I	69.6	Low	57.9	Low	105 Å²	105	108.4 Å²	108.4	54%	0.538	53%	0.529	S	S	.	.	H	α-helix	trans	-66.7	-46.2	176.7	-69.1	162.4	0	0	0	110.7	S935 F936 S941 Q942 Y943	S935-I939 VanDerWaalsContact O-CG1 3.28Å; S935-I939 WeakPolarHBondContact O-CG1 3.44Å; S935-I939 PolarHBondContact O-N 2.78Å; F936-I939 PolarHBondContact O-N 3.1Å; I939-S941 VanDerWaalsContact C-N 3.29Å; I939-S941 PolarHBondContact O-N 3.33Å; I939-Q942 PolarHBondContact O-N 2.84Å; I939-Y943 WeakPolarHBondContact O-CB 3.43Å; I939-Y943 PolarHBondContact O-N 3.19Å
940	K	53.3	Low	57.7	Low	76 Å²	76	106.1 Å²	106.1	33%	0.33	52%	0.524	S	S	.	.	H	α-helix	trans	-59.9	-37.8	174	-74.5	-176.2	177.2	175.8	0	112.1	N184 E185 F936 K944	N184-K940 PolarHBondContact O-NZ 2.92Å; E185-K940 WeakPolarHBondContact OE2-CE 3.41Å; E185-K940 IonicContact OE2-NZ 3.77Å; E185-K940 PolarHBondContact OE2-NZ 2.91Å; F936-K940 HydrophobicContact CD1-CD 4.26Å; F936-K940 HydrophobicContact CE1-CD 4.45Å; F936-K940 PolarHBondContact O-N 2.89Å; K940-K944 PolarHBondContact O-N 2.85Å
941	S	52.4	Low	56.6	Low	61 Å²	61	111.6 Å²	111.6	43%	0.427	53%	0.534	S	S	.	.	H	α-helix	trans	-66.9	-48.6	174.8	-175.9	0	0	0	0	112.6	V937 K938 I939 Y943 K944 N945	V937-S941 VanDerWaalsContact O-CB 3.31Å; V937-S941 WeakPolarHBondContact O-CB 3.21Å; V937-S941 PolarHBondContact O-N 3.48Å; K938-S941 PolarHBondContact O-N 3.45Å; I939-S941 VanDerWaalsContact C-N 3.29Å; I939-S941 PolarHBondContact O-N 3.33Å; S941-Y943 VanDerWaalsContact C-N 3.32Å; S941-Y943 PolarHBondContact O-N 2.97Å; S941-K944 PolarHBondContact O-N 2.97Å; S941-N945 WeakPolarHBondContact O-CB 3.46Å; S941-N945 PolarHBondContact O-N 3.43Å; S941-N945 PolarHBondContact O-ND2 2.81Å
942	Q	51.8	Low	55.9	Low	139 Å²	139	110.2 Å²	110.2	65%	0.65	53%	0.53	S	S	*	.	H	α-helix	trans	-55.1	-46.7	173.2	-75.4	-79.6	8.8	0	0	111.4	K938 I939 N945 K946	K938-Q942 WeakPolarHBondContact O-CB 3.48Å; K938-Q942 VanDerWaalsContact O-CG 3.26Å; K938-Q942 WeakPolarHBondContact O-CG 3.42Å; K938-Q942 PolarHBondContact O-N 3.16Å; I939-Q942 PolarHBondContact O-N 2.84Å; Q942-N945 PolarHBondContact O-N 2.82Å; Q942-K946 WeakPolarHBondContact O-CB 3.38Å; Q942-K946 PolarHBondContact O-N 3.36Å
943	Y	48	Very low	55.5	Low	147 Å²	147	112.4 Å²	112.4	58%	0.576	54%	0.535	S	S	*	.	H	α-helix	trans	-65.7	-43.1	-178.9	-165.2	-91.3	0	0	0	112.4	I939 S941 K946 K947	I939-Y943 WeakPolarHBondContact O-CB 3.43Å; I939-Y943 PolarHBondContact O-N 3.19Å; S941-Y943 VanDerWaalsContact C-N 3.32Å; S941-Y943 PolarHBondContact O-N 2.97Å; Y943-K946 PolarHBondContact O-N 2.93Å; Y943-K947 HydrophobicContact CE1-CD 3.77Å; Y943-K947 WeakPolarHBondContact O-CB 3.21Å; Y943-K947 PolarHBondContact O-N 3.12Å; Y943-K947 VanDerWaalsContact O-N 3.15Å; Y943-K947 PolarHBondContact OH-NZ 3.36Å; Y943-K947 VanDerWaalsContact OH-NZ 3.08Å
944	K	41.4	Very low	55.9	Low	157 Å²	157	113.1 Å²	113.1	68%	0.683	54%	0.541	S	S	*	.	H	α-helix	trans	-60.2	-47.4	173	-84.1	-174.6	173	179.8	0	112.1	K940 S941 K946 K947 F948	K940-K944 PolarHBondContact O-N 2.85Å; S941-K944 PolarHBondContact O-N 2.97Å; K944-K946 VanDerWaalsContact C-N 3.29Å; K944-K946 PolarHBondContact O-N 2.88Å; K944-K947 PolarHBondContact O-N 3.29Å; K944-F948 PolarHBondContact O-N 3.21Å
945	N	48	Very low	55.8	Low	109 Å²	109	114.4 Å²	114.4	58%	0.583	54%	0.543	S	S	*	.	H	α-helix	trans	-67.2	-27.6	-179.2	-72.3	-24.7	0	0	0	113.2	S941 Q942 P949	S941-N945 WeakPolarHBondContact O-CB 3.46Å; S941-N945 PolarHBondContact O-N 3.43Å; S941-N945 PolarHBondContact O-ND2 2.81Å; Q942-N945 PolarHBondContact O-N 2.82Å; N945-P949 WeakPolarHBondContact O-CD 3.47Å; N945-P949 WeakPolarHBondContact O-CG 3.49Å
946	K	51.1	Low	56.2	Low	170 Å²	170	114.6 Å²	114.6	74%	0.739	55%	0.547	S	S	*	.	H	α-helix	trans	-79.2	-32.8	177.1	-156.3	173.2	-173.9	-177.7	0	113	Q942 Y943 K944	Q942-K946 WeakPolarHBondContact O-CB 3.38Å; Q942-K946 PolarHBondContact O-N 3.36Å; Y943-K946 PolarHBondContact O-N 2.93Å; K944-K946 VanDerWaalsContact C-N 3.29Å; K944-K946 PolarHBondContact O-N 2.88Å
947	K	44.9	Very low	56.9	Low	106 Å²	106	114.8 Å²	114.8	46%	0.461	55%	0.549	S	S	.	.	H	α-helix	trans	-85.5	-28.3	-175.2	-150.6	165.9	-169.4	170	0	114.2	Y943 K944 E950 Y951	Y943-K947 HydrophobicContact CE1-CD 3.77Å; Y943-K947 WeakPolarHBondContact O-CB 3.21Å; Y943-K947 PolarHBondContact O-N 3.12Å; Y943-K947 VanDerWaalsContact O-N 3.15Å; Y943-K947 PolarHBondContact OH-NZ 3.36Å; Y943-K947 VanDerWaalsContact OH-NZ 3.08Å; K944-K947 PolarHBondContact O-N 3.29Å; K947-E950 PolarHBondContact O-N 2.99Å; K947-Y951 PolarHBondContact O-N 3.28Å; K947-Y951 VanDerWaalsContact O-N 3.1Å
948	F	48.7	Very low	57.2	Low	164 Å²	164	117 Å²	117	72%	0.719	55%	0.554	S	S	*	*	H	α-helix	trans	-61.6	-44.7	178.6	-122.5	-94.7	0	0	0	114.5	K944 E950 T952	K944-F948 PolarHBondContact O-N 3.21Å; F948-E950 VanDerWaalsContact C-N 3.27Å; F948-E950 PolarHBondContact O-N 2.95Å; F948-T952 PolarHBondContact O-N 3.47Å; F948-T952 PolarHBondContact O-OG1 3.24Å
949	P	50.1	Low	57.9	Low	62 Å²	62	117.4 Å²	117.4	40%	0.403	56%	0.558	S	S	.	*	H	α-helix	trans	-69.9	-21.7	175.1	-19.8	33.4	0	0	0	113.8	N945 T952 K953	N945-P949 WeakPolarHBondContact O-CD 3.47Å; N945-P949 WeakPolarHBondContact O-CG 3.49Å; P949-T952 WeakPolarHBondContact CA-OG1 3.23Å; P949-T952 PolarHBondContact O-OG1 2.79Å; P949-K953 WeakPolarHBondContact O-CB 3.48Å; P949-K953 WeakPolarHBondContact O-CD 2.99Å; P949-K953 WeakPolarHBondContact O-CG 3.2Å; P949-K953 PolarHBondContact O-N 3.14Å
950	E	53.5	Low	58.2	Low	117 Å²	117	119.1 Å²	119.1	55%	0.547	56%	0.558	S	S	.	*	H	α-helix	trans	-82.2	-46.9	-176.9	-169.9	167.3	-123.6	0	0	110.9	K947 F948 T952 K953 L954	K947-E950 PolarHBondContact O-N 2.99Å; F948-E950 VanDerWaalsContact C-N 3.27Å; F948-E950 PolarHBondContact O-N 2.95Å; E950-T952 VanDerWaalsContact C-N 3.3Å; E950-T952 PolarHBondContact O-N 3.46Å; E950-K953 PolarHBondContact O-N 3.08Å; E950-L954 HydrophobicContact CG-CD1 4.33Å; E950-L954 WeakPolarHBondContact O-CG 3.41Å; E950-L954 PolarHBondContact O-N 2.76Å
951	Y	46.6	Very low	59.6	Low	169 Å²	169	119.6 Å²	119.6	66%	0.663	57%	0.567	S	S	*	*	H	α-helix	trans	-60.5	-37.3	174.2	-175.1	-106.3	0	0	0	112.8	K947 K955	K947-Y951 PolarHBondContact O-N 3.28Å; K947-Y951 VanDerWaalsContact O-N 3.1Å; Y951-K955 WeakPolarHBondContact O-CB 3.48Å; Y951-K955 PolarHBondContact O-N 3.43Å; Y951-K955 VanDerWaalsContact O-N 3.07Å
952	T	56.3	Low	61	Low	81 Å²	81	123 Å²	123	50%	0.497	57%	0.574	S	S	.	*	H	α-helix	trans	-71.4	-35.4	176	41.4	0	0	0	0	112.9	F948 P949 E950 A956	F948-T952 PolarHBondContact O-N 3.47Å; F948-T952 PolarHBondContact O-OG1 3.24Å; P949-T952 WeakPolarHBondContact CA-OG1 3.23Å; P949-T952 PolarHBondContact O-OG1 2.79Å; E950-T952 VanDerWaalsContact C-N 3.3Å; E950-T952 PolarHBondContact O-N 3.46Å; T952-A956 WeakPolarHBondContact O-CB 3.18Å; T952-A956 PolarHBondContact O-N 2.68Å; T952-A956 VanDerWaalsContact O-N 3.14Å
953	K	62.9	Low	62.5	Low	156 Å²	156	124 Å²	124	68%	0.678	58%	0.576	S	S	*	*	H	α-helix	trans	-67.2	-46.9	171.5	-77.5	173.1	-178.6	-176.2	0	112.5	P949 E950 K955 A956 E957	P949-K953 WeakPolarHBondContact O-CB 3.48Å; P949-K953 WeakPolarHBondContact O-CD 2.99Å; P949-K953 WeakPolarHBondContact O-CG 3.2Å; P949-K953 PolarHBondContact O-N 3.14Å; E950-K953 PolarHBondContact O-N 3.08Å; K953-K955 VanDerWaalsContact C-N 3.32Å; K953-K955 PolarHBondContact O-N 3.23Å; K953-A956 PolarHBondContact O-N 3.19Å; K953-E957 PolarHBondContact O-N 3.31Å
954	L	70.9	Confident	64.1	Low	114 Å²	114	123 Å²	123	60%	0.597	58%	0.576	S	S	*	*	H	α-helix	trans	-59	-43.8	178.2	-73.6	168.2	0	0	0	111.4	E950 A956 E957 E958	E950-L954 HydrophobicContact CG-CD1 4.33Å; E950-L954 WeakPolarHBondContact O-CG 3.41Å; E950-L954 PolarHBondContact O-N 2.76Å; L954-A956 PolarHBondContact O-N 3.14Å; L954-E957 PolarHBondContact O-N 3.47Å; L954-E958 WeakPolarHBondContact O-CB 3.32Å; L954-E958 PolarHBondContact O-N 3.42Å
955	K	68.8	Low	66.1	Low	127 Å²	127	122 Å²	122	55%	0.552	57%	0.574	S	S	*	*	H	α-helix	trans	-64.7	-38.3	176.3	-173	173.6	179.9	179.6	0	113.2	Y951 K953 E959	Y951-K955 WeakPolarHBondContact O-CB 3.48Å; Y951-K955 PolarHBondContact O-N 3.43Å; Y951-K955 VanDerWaalsContact O-N 3.07Å; K953-K955 VanDerWaalsContact C-N 3.32Å; K953-K955 PolarHBondContact O-N 3.23Å; K955-E959 WeakPolarHBondContact O-CB 3.21Å; K955-E959 PolarHBondContact O-N 2.68Å; K955-E959 VanDerWaalsContact O-N 3.08Å
956	A	71.4	Confident	67.8	Low	51 Å²	51	121.5 Å²	121.5	42%	0.421	57%	0.568	S	S	.	*	H	α-helix	trans	-68.6	-34.6	175.2	0	0	0	0	0	112.3	T952 K953 L954 R960	T952-A956 WeakPolarHBondContact O-CB 3.18Å; T952-A956 PolarHBondContact O-N 2.68Å; T952-A956 VanDerWaalsContact O-N 3.14Å; K953-A956 PolarHBondContact O-N 3.19Å; L954-A956 PolarHBondContact O-N 3.14Å; A956-R960 WeakPolarHBondContact O-CG 3.46Å; A956-R960 PolarHBondContact O-N 2.85Å
957	E	75.3	Confident	69.4	Low	89 Å²	89	120.4 Å²	120.4	42%	0.416	56%	0.564	S	S	.	*	H	α-helix	trans	-73.1	-40.3	176.2	-160.3	64.5	-171.1	0	0	111.8	K953 L954 E959 R960 V961	K953-E957 PolarHBondContact O-N 3.31Å; L954-E957 PolarHBondContact O-N 3.47Å; E957-E959 VanDerWaalsContact C-N 3.31Å; E957-E959 PolarHBondContact O-N 3.26Å; E957-R960 WeakPolarHBondContact O-CB 3.15Å; E957-R960 PolarHBondContact O-N 2.97Å; E957-R960 VanDerWaalsContact O-N 3.15Å; E957-R960 IonicContact OE1-CZ 2.9Å; E957-R960 IonicContact OE1-NH1 2.62Å; E957-R960 PolarHBondContact OE1-NH1 3.03Å; E957-R960 IonicContact OE2-CZ 2.64Å; E957-R960 IonicContact OE2-NH1 2.74Å; E957-R960 PolarHBondContact OE2-NH1 2.94Å; E957-V961 WeakPolarHBondContact O-CG2 3.39Å; E957-V961 PolarHBondContact O-N 3.45Å
958	E	75.3	Confident	71.6	Confident	123 Å²	123	118.3 Å²	118.3	58%	0.575	57%	0.566	S	S	*	*	H	α-helix	trans	-57.2	-43.7	170.9	-169.2	-165	154.9	0	0	111.2	L954 R960 V961 K962	L954-E958 WeakPolarHBondContact O-CB 3.32Å; L954-E958 PolarHBondContact O-N 3.42Å; E958-R960 PolarHBondContact O-N 3.18Å; E958-V961 PolarHBondContact O-N 2.7Å; E958-K962 VanDerWaalsContact O-CB 3.22Å; E958-K962 WeakPolarHBondContact O-CB 3.22Å; E958-K962 PolarHBondContact O-N 3.11Å
959	E	76.4	Confident	73.6	Confident	142 Å²	142	119 Å²	119	66%	0.664	56%	0.564	S	S	*	*	H	α-helix	trans	-66.4	-34.4	176.5	-170.9	168.6	-158.1	0	0	112.6	K955 E957 K963	K955-E959 WeakPolarHBondContact O-CB 3.21Å; K955-E959 PolarHBondContact O-N 2.68Å; K955-E959 VanDerWaalsContact O-N 3.08Å; E957-E959 VanDerWaalsContact C-N 3.31Å; E957-E959 PolarHBondContact O-N 3.26Å; E959-K963 WeakPolarHBondContact O-CB 3.47Å; E959-K963 PolarHBondContact O-N 2.68Å; E959-K963 VanDerWaalsContact O-N 3.14Å
960	R	74.3	Confident	75.3	Confident	142 Å²	142	122 Å²	122	54%	0.536	57%	0.57	S	S	.	*	H	α-helix	trans	-66.1	-49.7	171.3	-76.2	-179.2	60.8	-128.3	-17.2	112.1	A956 E957 E958 K962 K963 E964	A956-R960 WeakPolarHBondContact O-CG 3.46Å; A956-R960 PolarHBondContact O-N 2.85Å; E957-R960 WeakPolarHBondContact O-CB 3.15Å; E957-R960 PolarHBondContact O-N 2.97Å; E957-R960 VanDerWaalsContact O-N 3.15Å; E957-R960 IonicContact OE1-CZ 2.9Å; E957-R960 IonicContact OE1-NH1 2.62Å; E957-R960 PolarHBondContact OE1-NH1 3.03Å; E957-R960 IonicContact OE2-CZ 2.64Å; E957-R960 IonicContact OE2-NH1 2.74Å; E957-R960 PolarHBondContact OE2-NH1 2.94Å; E958-R960 PolarHBondContact O-N 3.18Å; R960-K962 VanDerWaalsContact C-N 3.34Å; R960-K962 PolarHBondContact O-N 3.31Å; R960-K963 WeakPolarHBondContact O-CB 3.44Å; R960-K963 PolarHBondContact O-N 3.19Å; R960-E964 PolarHBondContact O-N 3.31Å
961	V	83.8	Confident	76.9	Confident	85 Å²	85	119.8 Å²	119.8	52%	0.515	56%	0.56	S	S	.	*	H	α-helix	trans	-59.4	-45.3	178.5	170.4	0	0	0	0	110.5	E957 E958 K963 E964 E965	E957-V961 WeakPolarHBondContact O-CG2 3.39Å; E957-V961 PolarHBondContact O-N 3.45Å; E958-V961 PolarHBondContact O-N 2.7Å; V961-K963 VanDerWaalsContact C-N 3.31Å; V961-K963 PolarHBondContact O-N 3.07Å; V961-E964 CarbonylContact O-C 3.58Å; V961-E964 PolarHBondContact O-N 2.82Å; V961-E964 VanDerWaalsContact O-N 3.1Å; V961-E965 WeakPolarHBondContact O-CB 3.44Å; V961-E965 PolarHBondContact O-N 3.48Å
962	K	81.6	Confident	79	Confident	132 Å²	132	118.7 Å²	118.7	57%	0.574	56%	0.559	S	S	*	*	H	α-helix	trans	-61.8	-36.4	177.9	-166.4	169.8	-165.4	160.3	0	113	E958 R960 E966	E958-K962 VanDerWaalsContact O-CB 3.22Å; E958-K962 WeakPolarHBondContact O-CB 3.22Å; E958-K962 PolarHBondContact O-N 3.11Å; R960-K962 VanDerWaalsContact C-N 3.34Å; R960-K962 PolarHBondContact O-N 3.31Å; K962-E966 WeakPolarHBondContact O-CB 3.32Å; K962-E966 PolarHBondContact O-N 2.89Å
963	K	82.3	Confident	80.8	Confident	161 Å²	161	119.6 Å²	119.6	70%	0.7	56%	0.56	S	S	*	*	H	α-helix	trans	-71.1	-32.2	174.9	-172.7	175.6	-176	174.9	0	112.5	E959 R960 V961 K967	E959-K963 WeakPolarHBondContact O-CB 3.47Å; E959-K963 PolarHBondContact O-N 2.68Å; E959-K963 VanDerWaalsContact O-N 3.14Å; R960-K963 WeakPolarHBondContact O-CB 3.44Å; R960-K963 PolarHBondContact O-N 3.19Å; V961-K963 VanDerWaalsContact C-N 3.31Å; V961-K963 PolarHBondContact O-N 3.07Å; K963-K967 WeakPolarHBondContact O-CB 3.46Å; K963-K967 PolarHBondContact O-N 2.85Å
964	E	81.7	Confident	82	Confident	125 Å²	125	117.8 Å²	117.8	58%	0.584	55%	0.552	S	S	*	*	H	α-helix	trans	-75	-41.3	173.8	-177.3	149.4	-141	0	0	112.1	R960 V961 K967 A968	R960-E964 PolarHBondContact O-N 3.31Å; V961-E964 CarbonylContact O-C 3.58Å; V961-E964 PolarHBondContact O-N 2.82Å; V961-E964 VanDerWaalsContact O-N 3.1Å; E964-K967 WeakPolarHBondContact O-CB 3.43Å; E964-K967 PolarHBondContact O-N 3.47Å; E964-A968 PolarHBondContact O-N 2.89Å
965	E	83.3	Confident	82.7	Confident	136 Å²	136	118 Å²	118	64%	0.636	55%	0.55	S	S	*	*	H	α-helix	trans	-63.7	-41.5	173.5	-170.8	-177.9	-138	0	0	111.6	V961 K967 A968 R969	V961-E965 WeakPolarHBondContact O-CB 3.44Å; V961-E965 PolarHBondContact O-N 3.48Å; E965-K967 VanDerWaalsContact C-N 3.3Å; E965-K967 PolarHBondContact O-N 2.88Å; E965-A968 PolarHBondContact O-N 2.74Å; E965-R969 WeakPolarHBondContact O-CB 3.5Å; E965-R969 PolarHBondContact O-N 2.69Å
966	E	83.8	Confident	83.6	Confident	99 Å²	99	114.4 Å²	114.4	46%	0.463	54%	0.535	S	S	.	.	H	α-helix	trans	-63.7	-36.1	173.4	-161.7	-166.1	155.4	0	0	111.9	K962 K970	K962-E966 WeakPolarHBondContact O-CB 3.32Å; K962-E966 PolarHBondContact O-N 2.89Å; E966-K970 WeakPolarHBondContact O-CB 3.34Å; E966-K970 VanDerWaalsContact O-CG 3.28Å; E966-K970 WeakPolarHBondContact O-CG 3.38Å; E966-K970 PolarHBondContact O-N 3.49Å; E966-K970 WeakPolarHBondContact OE1-CE 3.35Å; E966-K970 IonicContact OE1-NZ 2.7Å; E966-K970 PolarHBondContact OE1-NZ 3.3Å
967	K	86.7	Confident	84.4	Confident	148 Å²	148	119.5 Å²	119.5	64%	0.643	55%	0.545	S	S	*	.	H	α-helix	trans	-66.6	-45.2	173.8	-178.9	-169.5	173.6	-164.4	0	111.2	K963 E964 E965 K970 E971	K963-K967 WeakPolarHBondContact O-CB 3.46Å; K963-K967 PolarHBondContact O-N 2.85Å; E964-K967 WeakPolarHBondContact O-CB 3.43Å; E964-K967 PolarHBondContact O-N 3.47Å; E965-K967 VanDerWaalsContact C-N 3.3Å; E965-K967 PolarHBondContact O-N 2.88Å; K967-K970 PolarHBondContact O-N 2.86Å; K967-E971 PolarHBondContact O-N 2.83Å
968	A	90.6	Very high	85	Confident	61 Å²	61	120.5 Å²	120.5	50%	0.504	55%	0.552	S	S	.	*	H	α-helix	trans	-61.2	-44.4	175.8	0	0	0	0	0	111.5	E964 E965 K970 E971 F972	E964-A968 PolarHBondContact O-N 2.89Å; E965-A968 PolarHBondContact O-N 2.74Å; A968-K970 PolarHBondContact O-N 3.25Å; A968-E971 PolarHBondContact O-N 3.45Å; A968-F972 WeakPolarHBondContact O-CB 3.13Å; A968-F972 PolarHBondContact O-N 3.01Å
969	R	89.3	Confident	85.6	Confident	180 Å²	180	122.3 Å²	122.3	68%	0.679	55%	0.554	S	S	*	*	H	α-helix	trans	-61.4	-40.2	175.6	-171	178.2	-178.3	-145.7	0.8	112.4	E965 I973	E965-R969 WeakPolarHBondContact O-CB 3.5Å; E965-R969 PolarHBondContact O-N 2.69Å; R969-I973 HydrophobicContact CG-CD1 4.2Å; R969-I973 WeakPolarHBondContact O-CD1 3.38Å; R969-I973 VanDerWaalsContact O-CG1 3.26Å; R969-I973 WeakPolarHBondContact O-CG1 3.31Å; R969-I973 PolarHBondContact O-N 3.17Å; R969-I973 VanDerWaalsContact O-N 3.08Å
970	K	87.1	Confident	86.1	Confident	123 Å²	123	123.1 Å²	123.1	54%	0.535	55%	0.551	S	S	.	*	H	α-helix	trans	-65.5	-42.1	174.8	-77.5	168.9	-178.7	169.8	0	112.3	E966 K967 A968 I973 K974	E966-K970 WeakPolarHBondContact O-CB 3.34Å; E966-K970 VanDerWaalsContact O-CG 3.28Å; E966-K970 WeakPolarHBondContact O-CG 3.38Å; E966-K970 PolarHBondContact O-N 3.49Å; E966-K970 WeakPolarHBondContact OE1-CE 3.35Å; E966-K970 IonicContact OE1-NZ 2.7Å; E966-K970 PolarHBondContact OE1-NZ 3.3Å; K967-K970 PolarHBondContact O-N 2.86Å; A968-K970 PolarHBondContact O-N 3.25Å; K970-I973 PolarHBondContact O-N 3.05Å; K970-K974 WeakPolarHBondContact O-CB 3.32Å; K970-K974 PolarHBondContact O-N 3.2Å
971	E	87.6	Confident	86.9	Confident	72 Å²	72	122 Å²	122	34%	0.336	55%	0.55	S	S	.	.	H	α-helix	trans	-67.9	-40.2	177	-172.9	56.4	-146.5	0	0	111.9	K967 A968 I973 K974 Q975	K967-E971 PolarHBondContact O-N 2.83Å; A968-E971 PolarHBondContact O-N 3.45Å; E971-I973 PolarHBondContact O-N 2.8Å; E971-K974 WeakPolarHBondContact O-CB 3.27Å; E971-K974 PolarHBondContact O-N 3.31Å; E971-K974 IonicContact OE1-NZ 3.89Å; E971-K974 PolarHBondContact OE1-NZ 2.8Å; E971-K974 IonicContact OE2-NZ 3.05Å; E971-K974 PolarHBondContact OE2-NZ 3.45Å; E971-Q975 WeakPolarHBondContact O-CG 3.44Å; E971-Q975 PolarHBondContact O-N 2.78Å; E971-Q975 PolarHBondContact OE1-NE2 3.14Å
972	F	90.8	Very high	86.7	Confident	145 Å²	145	124.9 Å²	124.9	64%	0.636	56%	0.558	S	S	*	*	H	α-helix	trans	-59.1	-46.9	173.8	-178.6	-94.3	0	0	0	112.1	A968 K974 Q975 E976	A968-F972 WeakPolarHBondContact O-CB 3.13Å; A968-F972 PolarHBondContact O-N 3.01Å; F972-K974 VanDerWaalsContact C-N 3.28Å; F972-K974 PolarHBondContact O-N 3.49Å; F972-Q975 PolarHBondContact O-N 3.03Å; F972-E976 WeakPolarHBondContact O-CB 3.2Å; F972-E976 PolarHBondContact O-N 2.9Å
973	I	92.2	Very high	86.6	Confident	100 Å²	100	123.1 Å²	123.1	51%	0.513	55%	0.554	S	S	.	*	H	α-helix	trans	-60.2	-39.6	175.7	-70	165.3	0	0	0	111.1	R969 K970 E971 Y977	R969-I973 HydrophobicContact CG-CD1 4.2Å; R969-I973 WeakPolarHBondContact O-CD1 3.38Å; R969-I973 VanDerWaalsContact O-CG1 3.26Å; R969-I973 WeakPolarHBondContact O-CG1 3.31Å; R969-I973 PolarHBondContact O-N 3.17Å; R969-I973 VanDerWaalsContact O-N 3.08Å; K970-I973 PolarHBondContact O-N 3.05Å; E971-I973 PolarHBondContact O-N 2.8Å; I973-Y977 VanDerWaalsContact O-CB 3.32Å; I973-Y977 WeakPolarHBondContact O-CB 3.44Å; I973-Y977 PolarHBondContact O-N 2.89Å
974	K	89.8	Confident	86.7	Confident	119 Å²	119	119.9 Å²	119.9	52%	0.517	54%	0.54	S	S	.	.	H	α-helix	trans	-66.3	-42.2	176.7	163.8	168.3	159.3	-84.3	0	112.6	K970 E971 F972 L978	K970-K974 WeakPolarHBondContact O-CB 3.32Å; K970-K974 PolarHBondContact O-N 3.2Å; E971-K974 WeakPolarHBondContact O-CB 3.27Å; E971-K974 PolarHBondContact O-N 3.31Å; E971-K974 IonicContact OE1-NZ 3.89Å; E971-K974 PolarHBondContact OE1-NZ 2.8Å; E971-K974 IonicContact OE2-NZ 3.05Å; E971-K974 PolarHBondContact OE2-NZ 3.45Å; F972-K974 VanDerWaalsContact C-N 3.28Å; F972-K974 PolarHBondContact O-N 3.49Å; K974-L978 WeakPolarHBondContact O-CB 3.34Å; K974-L978 PolarHBondContact O-N 3.21Å
975	Q	85.1	Confident	86.7	Confident	118 Å²	118	119 Å²	119	55%	0.551	54%	0.538	S	S	*	.	H	α-helix	trans	-69.5	-42.4	176.7	-70.2	-174.6	14.3	0	0	112.1	E971 F972 Y977 L978 R979	E971-Q975 WeakPolarHBondContact O-CG 3.44Å; E971-Q975 PolarHBondContact O-N 2.78Å; E971-Q975 PolarHBondContact OE1-NE2 3.14Å; F972-Q975 PolarHBondContact O-N 3.03Å; Q975-Y977 VanDerWaalsContact C-N 3.34Å; Q975-Y977 PolarHBondContact O-N 2.97Å; Q975-L978 PolarHBondContact O-N 3.29Å; Q975-L978 VanDerWaalsContact O-N 3.17Å; Q975-R979 WeakPolarHBondContact O-CB 3.34Å; Q975-R979 PolarHBondContact O-N 2.83Å
976	E	86.8	Confident	86.2	Confident	51 Å²	51	118.2 Å²	118.2	24%	0.238	54%	0.536	C	S	.	.	H	α-helix	trans	-64.1	-38.2	175.3	176.8	62.8	-179.4	0	0	111.7	F972 R980	F972-E976 WeakPolarHBondContact O-CB 3.2Å; F972-E976 PolarHBondContact O-N 2.9Å; E976-R980 WeakPolarHBondContact O-CB 3.4Å; E976-R980 VanDerWaalsContact O-CG 3.25Å; E976-R980 WeakPolarHBondContact O-CG 3.46Å; E976-R980 PolarHBondContact O-N 3.19Å; E976-R980 IonicContact OE1-CZ 3.5Å; E976-R980 IonicContact OE1-NE 3.53Å; E976-R980 PolarHBondContact OE1-NE 3Å; E976-R980 IonicContact OE1-NH2 2.69Å; E976-R980 PolarHBondContact OE1-NH2 2.87Å
977	Y	89.3	Confident	85.7	Confident	158 Å²	158	118.6 Å²	118.6	62%	0.62	54%	0.538	S	S	*	.	H	α-helix	trans	-62.2	-43.4	170.8	175.8	-99.9	0	0	0	112.2	I973 Q975 R980 K981	I973-Y977 VanDerWaalsContact O-CB 3.32Å; I973-Y977 WeakPolarHBondContact O-CB 3.44Å; I973-Y977 PolarHBondContact O-N 2.89Å; Q975-Y977 VanDerWaalsContact C-N 3.34Å; Q975-Y977 PolarHBondContact O-N 2.97Å; Y977-R980 PolarHBondContact O-N 2.9Å; Y977-K981 WeakPolarHBondContact O-CB 3.31Å; Y977-K981 PolarHBondContact O-N 2.92Å
978	L	88.1	Confident	85	Confident	111 Å²	111	114.9 Å²	114.9	58%	0.581	53%	0.525	S	S	*	.	H	α-helix	trans	-65.7	-43.1	179.2	-161.2	69.8	0	0	0	111.6	K974 Q975 K981 Q982	K974-L978 WeakPolarHBondContact O-CB 3.34Å; K974-L978 PolarHBondContact O-N 3.21Å; Q975-L978 PolarHBondContact O-N 3.29Å; Q975-L978 VanDerWaalsContact O-N 3.17Å; L978-K981 PolarHBondContact O-N 2.84Å; L978-Q982 PolarHBondContact O-N 3.46Å
979	R	87.6	Confident	83.7	Confident	161 Å²	161	116.9 Å²	116.9	61%	0.608	53%	0.525	S	S	*	.	H	α-helix	trans	-59.3	-47	173.4	-174.1	-174.3	-173.9	-172.7	5	111.6	Q975 K981 Q982 L983	Q975-R979 WeakPolarHBondContact O-CB 3.34Å; Q975-R979 PolarHBondContact O-N 2.83Å; R979-K981 PolarHBondContact O-N 3.47Å; R979-Q982 PolarHBondContact O-N 2.73Å; R979-L983 HydrophobicContact CG-CD1 4.26Å; R979-L983 WeakPolarHBondContact O-CG 3.45Å; R979-L983 PolarHBondContact O-N 3.01Å
980	R	86.6	Confident	82.3	Confident	158 Å²	158	112.3 Å²	112.3	60%	0.596	52%	0.515	S	S	*	.	H	α-helix	trans	-62.4	-40.4	175.4	-74.8	177	-170.6	-146.4	0.4	112.1	E976 Y977 Q982 L983 K984	E976-R980 WeakPolarHBondContact O-CB 3.4Å; E976-R980 VanDerWaalsContact O-CG 3.25Å; E976-R980 WeakPolarHBondContact O-CG 3.46Å; E976-R980 PolarHBondContact O-N 3.19Å; E976-R980 IonicContact OE1-CZ 3.5Å; E976-R980 IonicContact OE1-NE 3.53Å; E976-R980 PolarHBondContact OE1-NE 3Å; E976-R980 IonicContact OE1-NH2 2.69Å; E976-R980 PolarHBondContact OE1-NH2 2.87Å; Y977-R980 PolarHBondContact O-N 2.9Å; R980-Q982 VanDerWaalsContact C-N 3.33Å; R980-Q982 PolarHBondContact O-N 3.42Å; R980-L983 PolarHBondContact O-N 3.36Å; R980-K984 VanDerWaalsContact O-CB 3.28Å; R980-K984 WeakPolarHBondContact O-CB 3.25Å; R980-K984 PolarHBondContact O-N 2.98Å
981	K	90.1	Very high	81	Confident	119 Å²	119	111.1 Å²	111.1	52%	0.517	52%	0.518	S	S	.	.	H	α-helix	trans	-62.3	-40.3	175.2	-174.6	-177.6	176.8	-174.2	0	111.7	Y977 L978 R979 K984 L985	Y977-K981 WeakPolarHBondContact O-CB 3.31Å; Y977-K981 PolarHBondContact O-N 2.92Å; L978-K981 PolarHBondContact O-N 2.84Å; R979-K981 PolarHBondContact O-N 3.47Å; K981-K984 PolarHBondContact O-N 3.2Å; K981-L985 PolarHBondContact O-N 3.35Å
982	Q	81.3	Confident	79.7	Confident	145 Å²	145	114 Å²	114	68%	0.678	53%	0.534	S	S	*	.	H	α-helix	trans	-69.8	-41.6	178.5	-164.4	170.5	10.2	0	0	112.1	L978 R979 R980 L985 M986	L978-Q982 PolarHBondContact O-N 3.46Å; R979-Q982 PolarHBondContact O-N 2.73Å; R980-Q982 VanDerWaalsContact C-N 3.33Å; R980-Q982 PolarHBondContact O-N 3.42Å; Q982-L985 PolarHBondContact O-N 3.02Å; Q982-M986 PolarHBondContact O-N 3.15Å
983	L	79.6	Confident	78.2	Confident	95 Å²	95	113.1 Å²	113.1	50%	0.497	54%	0.535	S	S	.	.	H	α-helix	trans	-63.6	-42.2	171.8	-73.2	167.5	0	0	0	112.1	R979 R980 L985 M986 E987	R979-L983 HydrophobicContact CG-CD1 4.26Å; R979-L983 WeakPolarHBondContact O-CG 3.45Å; R979-L983 PolarHBondContact O-N 3.01Å; R980-L983 PolarHBondContact O-N 3.36Å; L983-L985 VanDerWaalsContact C-N 3.31Å; L983-L985 PolarHBondContact O-N 2.82Å; L983-M986 HydrophobicContact CD2-CE 4.5Å; L983-M986 WeakPolarHBondContact O-CB 3.26Å; L983-M986 PolarHBondContact O-N 3.37Å; L983-M986 VanDerWaalsContact O-N 3.12Å; L983-E987 WeakPolarHBondContact O-CB 3.48Å; L983-E987 PolarHBondContact O-N 2.8Å
984	K	84.2	Confident	76	Confident	93 Å²	93	116.3 Å²	116.3	40%	0.404	55%	0.545	S	S	.	.	H	α-helix	trans	-59.4	-42.2	176.6	-164.4	81.3	-158	79.6	0	111.6	R980 K981 M986 E987 D988	R980-K984 VanDerWaalsContact O-CB 3.28Å; R980-K984 WeakPolarHBondContact O-CB 3.25Å; R980-K984 PolarHBondContact O-N 2.98Å; K981-K984 PolarHBondContact O-N 3.2Å; K984-M986 VanDerWaalsContact C-N 3.26Å; K984-M986 PolarHBondContact O-N 2.71Å; K984-E987 WeakPolarHBondContact CE-OE2 3.37Å; K984-E987 IonicContact NZ-OE2 2.68Å; K984-E987 PolarHBondContact NZ-OE2 3.15Å; K984-E987 PolarHBondContact O-N 2.85Å; K984-D988 IonicContact NZ-OD1 3.89Å; K984-D988 PolarHBondContact NZ-OD1 3.37Å; K984-D988 IonicContact NZ-OD2 3.53Å; K984-D988 VanDerWaalsContact O-CB 3.29Å; K984-D988 WeakPolarHBondContact O-CB 3.27Å; K984-D988 PolarHBondContact O-N 2.93Å
985	L	80.8	Confident	73.8	Confident	106 Å²	106	116.4 Å²	116.4	56%	0.555	56%	0.558	S	S	*	*	H	α-helix	trans	-60.9	-32.8	176	-107	156.8	0	0	0	113.3	K981 Q982 L983 M989	K981-L985 PolarHBondContact O-N 3.35Å; Q982-L985 PolarHBondContact O-N 3.02Å; L983-L985 VanDerWaalsContact C-N 3.31Å; L983-L985 PolarHBondContact O-N 2.82Å; L985-M989 WeakPolarHBondContact O-CG 3.28Å; L985-M989 PolarHBondContact O-N 3.17Å
986	M	74	Confident	71.9	Confident	120 Å²	120	122.2 Å²	122.2	59%	0.591	58%	0.575	S	S	*	*	H	α-helix	trans	-77.1	-45	175.9	-159.7	170.8	76.5	0	0	111.2	Q982 L983 K984 D988 M989 D990	Q982-M986 PolarHBondContact O-N 3.15Å; L983-M986 HydrophobicContact CD2-CE 4.5Å; L983-M986 WeakPolarHBondContact O-CB 3.26Å; L983-M986 PolarHBondContact O-N 3.37Å; L983-M986 VanDerWaalsContact O-N 3.12Å; K984-M986 VanDerWaalsContact C-N 3.26Å; K984-M986 PolarHBondContact O-N 2.71Å; M986-D988 VanDerWaalsContact C-N 3.34Å; M986-D988 PolarHBondContact O-N 3.19Å; M986-M989 WeakPolarHBondContact O-CB 3.34Å; M986-M989 PolarHBondContact O-N 3.46Å; M986-D990 PolarHBondContact O-N 3.11Å
987	E	73.3	Confident	69.5	Low	107 Å²	107	125.6 Å²	125.6	50%	0.5	60%	0.601	S	S	.	*	H	α-helix	trans	-61.8	-38.2	175.8	-172.5	-176.8	-120	0	0	112.5	L983 K984 M989 D990 T991	L983-E987 WeakPolarHBondContact O-CB 3.48Å; L983-E987 PolarHBondContact O-N 2.8Å; K984-E987 WeakPolarHBondContact CE-OE2 3.37Å; K984-E987 IonicContact NZ-OE2 2.68Å; K984-E987 PolarHBondContact NZ-OE2 3.15Å; K984-E987 PolarHBondContact O-N 2.85Å; E987-M989 VanDerWaalsContact C-N 3.33Å; E987-M989 PolarHBondContact O-N 2.95Å; E987-D990 PolarHBondContact O-N 2.98Å; E987-T991 PolarHBondContact O-N 3.43Å; E987-T991 PolarHBondContact O-OG1 2.91Å
988	D	71.8	Confident	67.1	Low	70 Å²	70	122.2 Å²	122.2	37%	0.374	61%	0.605	S	S	.	*	H	α-helix	trans	-67.8	-31.2	176.7	-70.7	-15.2	0	0	0	111.7	K984 M986 T991 I992	K984-D988 IonicContact NZ-OD1 3.89Å; K984-D988 PolarHBondContact NZ-OD1 3.37Å; K984-D988 IonicContact NZ-OD2 3.53Å; K984-D988 VanDerWaalsContact O-CB 3.29Å; K984-D988 WeakPolarHBondContact O-CB 3.27Å; K984-D988 PolarHBondContact O-N 2.93Å; M986-D988 VanDerWaalsContact C-N 3.34Å; M986-D988 PolarHBondContact O-N 3.19Å; D988-T991 WeakPolarHBondContact CA-OG1 3.32Å; D988-T991 PolarHBondContact O-OG1 2.89Å; D988-I992 WeakPolarHBondContact O-CG1 3.48Å
989	M	62.5	Low	65.2	Low	103 Å²	103	126.6 Å²	126.6	51%	0.507	62%	0.62	S	S	.	*	H	α-helix	trans	-71.2	-45.5	169.3	-71.3	-68.3	103.1	0	0	111.8	L985 M986 E987 T991 I992 I993	L985-M989 WeakPolarHBondContact O-CG 3.28Å; L985-M989 PolarHBondContact O-N 3.17Å; M986-M989 WeakPolarHBondContact O-CB 3.34Å; M986-M989 PolarHBondContact O-N 3.46Å; E987-M989 VanDerWaalsContact C-N 3.33Å; E987-M989 PolarHBondContact O-N 2.95Å; M989-T991 PolarHBondContact O-N 3.27Å; M989-I992 HydrophobicContact CE-CD1 3.83Å; M989-I992 WeakPolarHBondContact O-CB 3.34Å; M989-I992 PolarHBondContact O-N 3.39Å; M989-I993 WeakPolarHBondContact O-CG1 3.47Å; M989-I993 PolarHBondContact O-N 2.86Å
990	D	60.5	Low	62.9	Low	84 Å²	84	128.7 Å²	128.7	45%	0.449	64%	0.636	S	S	.	*	H	α-helix	trans	-59.5	-33.1	177.4	-81.4	-33.4	0	0	0	112.8	M986 E987 I992 I993 K994	M986-D990 PolarHBondContact O-N 3.11Å; E987-D990 PolarHBondContact O-N 2.98Å; D990-I992 VanDerWaalsContact C-N 3.3Å; D990-I992 PolarHBondContact O-N 3.39Å; D990-I993 PolarHBondContact O-N 3.01Å; D990-K994 PolarHBondContact O-N 3.1Å
991	T	59	Low	61.2	Low	99 Å²	99	130.7 Å²	130.7	61%	0.607	65%	0.649	S	S	*	*	H	α-helix	trans	-71.4	-18.6	174.2	50.8	0	0	0	0	114.9	E987 D988 M989	E987-T991 PolarHBondContact O-N 3.43Å; E987-T991 PolarHBondContact O-OG1 2.91Å; D988-T991 WeakPolarHBondContact CA-OG1 3.32Å; D988-T991 PolarHBondContact O-OG1 2.89Å; M989-T991 PolarHBondContact O-N 3.27Å
992	I	59.7	Low	58.6	Low	131 Å²	131	137.1 Å²	137.1	67%	0.672	67%	0.671	S	S	*	*	H	α-helix	trans	-83.7	-25.4	172.9	-66.8	169.8	0	0	0	110.9	D988 M989 D990	D988-I992 WeakPolarHBondContact O-CG1 3.48Å; M989-I992 HydrophobicContact CE-CD1 3.83Å; M989-I992 WeakPolarHBondContact O-CB 3.34Å; M989-I992 PolarHBondContact O-N 3.39Å; D990-I992 VanDerWaalsContact C-N 3.3Å; D990-I992 PolarHBondContact O-N 3.39Å
993	I	60	Low	55.9	Low	127 Å²	127	133.8 Å²	133.8	65%	0.651	68%	0.675	S	S	*	*	H	α-helix	trans	-86.1	-19.8	-173.4	-67.4	167.1	0	0	0	113.2	M989 D990	M989-I993 WeakPolarHBondContact O-CG1 3.47Å; M989-I993 PolarHBondContact O-N 2.86Å; D990-I993 PolarHBondContact O-N 3.01Å
994	K	45.7	Very low	53.9	Low	168 Å²	168	141.1 Å²	141.1	73%	0.73	70%	0.696	S	S	*	*	S	Bend	trans	-92.4	120.7	-177.4	-85.8	171.6	178	159	0	113.9	D990	D990-K994 PolarHBondContact O-N 3.1Å
995	P	43.2	Very low	51.4	Low	120 Å²	120	141.8 Å²	141.8	78%	0.779	71%	0.71	S	S	*	*			trans	-74.4	154.7	-178.8	31.2	-35.9	0	0	0	112.8	P997	P995-P997 WeakPolarHBondContact O-CD 3.45Å
996	R	46.3	Very low	49.2	Very low	241 Å²	241	145 Å²	145	91%	0.909	72%	0.719	S	S	*	*			trans	-107.5	111.7	-171.2	-173.7	-168.6	-157.6	175.9	10.6	112.3
997	P	35.4	Very low	47.6	Very low	122 Å²	122	145 Å²	145	79%	0.792	73%	0.732	S	S	*	*			trans	-73.4	153.8	162.6	-12.1	28.9	0	0	0	110.8	P995	P995-P997 WeakPolarHBondContact O-CD 3.45Å
998	A	38.7	Very low	45.7	Very low	86 Å²	86	145.4 Å²	145.4	71%	0.711	74%	0.736	S	S	*	*			trans	-117.6	152.6	-174.4	0	0	0	0	0	113.2
999	K	48.7	Very low	43.7	Very low	204 Å²	204	149.1 Å²	149.1	89%	0.887	75%	0.751	S	S	*	*			trans	39.2	118.4	152.7	-62.3	171.1	-179.6	172.6	0	118.1
1000	Q	38.7	Very low	42.2	Very low	204 Å²	204	151.9 Å²	151.9	95%	0.953	76%	0.755	S	S	*	*			trans	-146.1	149.3	133.8	-112.5	173.3	29.5	0	0	111.9
1001	K	51.3	Low	40.8	Very low	200 Å²	200	154.7 Å²	154.7	87%	0.87	77%	0.77	S	S	*	*			trans	-116.1	123.8	176	-83.8	-175.9	174.6	-179.4	0	109.1
1002	R	35.7	Very low	39.4	Very low	255 Å²	255	151.7 Å²	151.7	96%	0.962	75%	0.754	S	S	*	*			trans	176.2	156.9	130.6	-99.9	166.9	-179.6	-164.3	-0.2	110.7
1003	G	25.9	Very low	37.8	Very low	75 Å²	75	153.4 Å²	153.4	77%	0.773	76%	0.761	S	S	*	*			trans	86.4	73.1	159.6	0	0	0	0	0	118.2
1004	R	35.7	Very low	36.3	Very low	248 Å²	248	152.3 Å²	152.3	94%	0.936	76%	0.756	S	S	*	*				-157	120.6	128.5	-140.6	167.7	-177.1	142.9	0.2	112.4
1005	P	32.8	Very low	35.3	Very low	107 Å²	107	148.8 Å²	148.8	70%	0.695	75%	0.753	S	S	*	*			trans	-86.9	151.4	171.8	34.1	-32.9	0	0	0	112.1
1006	K	34.2	Very low	34.7	Very low	173 Å²	173	148.2 Å²	148.2	75%	0.752	75%	0.749	S	S	*	*			trans	53.2	94.8	144.1	-58.9	174.8	169.8	-171.1	0	118.5	I1008	K1006-I1008 HydrophobicContact CB-CB 4.32Å; K1006-I1008 HydrophobicContact CB-CD1 4.05Å; K1006-I1008 HydrophobicContact CB-CG1 4.07Å; K1006-I1008 HydrophobicContact CD-CD1 3.62Å; K1006-I1008 HydrophobicContact CG-CD1 3.54Å; K1006-I1008 HydrophobicContact CG-CG1 3.92Å
1007	S	39.8	Very low	33.9	Very low	122 Å²	122	145.7 Å²	145.7	85%	0.853	75%	0.745	S	S	*	*				-112.8	130.8	94.7	61.7	0	0	0	0	106.1
1008	I	33.9	Very low	33.5	Very low	114 Å²	114	145.3 Å²	145.3	59%	0.585	74%	0.74	S	S	*	*			cis	56.8	105	15.7	-65.2	-167	0	0	0	111.9	K1006	K1006-I1008 HydrophobicContact CB-CB 4.32Å; K1006-I1008 HydrophobicContact CB-CD1 4.05Å; K1006-I1008 HydrophobicContact CB-CG1 4.07Å; K1006-I1008 HydrophobicContact CD-CD1 3.62Å; K1006-I1008 HydrophobicContact CG-CD1 3.54Å; K1006-I1008 HydrophobicContact CG-CG1 3.92Å
1009	H	30.1	Very low	33.4	Very low	149 Å²	149	146.8 Å²	146.8	69%	0.69	74%	0.743	S	S	*	*			cis	-144.8	152.5	-1.3	-149.6	61.8	0	0	0	106.6
1010	R	30.4	Very low	32.8	Very low	161 Å²	161	142.9 Å²	142.9	61%	0.608	74%	0.735	S	S	*	*				31.3	136.5	83.4	-87.8	-166.5	158.3	171.2	-6.7	113.7	S1012	R1010-S1012 VanDerWaalsContact NE-CB 3.33Å; R1010-S1012 PolarHBondContact NE-OG 2.88Å; R1010-S1012 PolarHBondContact NH2-OG 3.35Å
1011	D	31.9	Very low	32.3	Very low	142 Å²	142	144.1 Å²	144.1	76%	0.759	73%	0.731	S	S	*	*			cis	-99.9	155.8	29.7	-63.3	-50.8	0	0	0	114.8
1012	S	28.6	Very low	31.4	Very low	37 Å²	37	138.9 Å²	138.9	26%	0.259	73%	0.725	S	S	.	*			cis	62.3	89.4	14.9	-80.8	0	0	0	0	118.3	R1010	R1010-S1012 VanDerWaalsContact NE-CB 3.33Å; R1010-S1012 PolarHBondContact NE-OG 2.88Å; R1010-S1012 PolarHBondContact NH2-OG 3.35Å
1013	M	27.6	Very low	31.8	Very low	166 Å²	166	131.7 Å²	131.7	82%	0.818	71%	0.711	S	S	*	*				-145.6	128.7	92.2	-74.2	-48	167.1	0	0	108.6
1014	D	26.6	Very low	32	Very low	105 Å²	105	135 Å²	135	56%	0.561	72%	0.717	S	S	*	*			cis	76.6	142.4	22.3	-151.5	-22.7	0	0	0	114.6
1015	S	24.9	Very low	31.7	Very low	94 Å²	94	127 Å²	127	66%	0.657	71%	0.711	S	S	*	*			trans	69.5	171.9	163.3	-63.2	0	0	0	0	115.1
1016	P	32.4	Very low	31.6	Very low	108 Å²	108	127 Å²	127	70%	0.701	71%	0.714	S	S	*	*				-138.5	-164.9	-99.4	32.8	-7.9	0	0	0	114.6
1017	K	28.3	Very low	31.5	Very low	188 Å²	188	129.1 Å²	129.1	82%	0.817	72%	0.717	S	S	*	*			trans	88.7	124.1	165	-57.6	178	177.6	174.9	0	118
1018	T	27.9	Very low	30.9	Very low	113 Å²	113	130.1 Å²	130.1	69%	0.693	71%	0.709	S	S	*	*			trans	-33.3	155	138.6	35.8	0	0	0	0	115.1
1019	P	35	Very low	30.6	Very low	118 Å²	118	134.8 Å²	134.8	77%	0.766	72%	0.719	S	S	*	*				-89.2	139.9	87.3	25.3	-35.6	0	0	0	111.2
1020	V	37.1	Very low	30.4	Very low	121 Å²	121	136.1 Å²	136.1	73%	0.733	72%	0.723	S	S	*	*				62.8	107.8	60.8	-179.4	0	0	0	0	108.4
1021	R	28.9	Very low	30.1	Very low	231 Å²	231	137.2 Å²	137.2	87%	0.872	73%	0.732	S	S	*	*			cis	-153.4	124.4	29.1	-169.1	174.8	-176.4	165.1	-0.4	112.8
1022	A	31.9	Very low	29.9	Very low	89 Å²	89	135.2 Å²	135.2	74%	0.736	73%	0.73	S	S	*	*			trans	49.8	157.7	145	0	0	0	0	0	122.2
1023	P	43.7	Very low	29.8	Very low	104 Å²	104	140.1 Å²	140.1	68%	0.675	76%	0.758	S	S	*	*			cis	-137.8	162.7	-39.9	37.2	-21.8	0	0	0	114.6
1024	T	29.4	Very low	30	Very low	146 Å²	146	138 Å²	138	90%	0.896	76%	0.759	S	S	*	*			trans	55.3	134.4	156.6	48.1	0	0	0	0	119.9
1025	G	29.5	Very low	30	Very low	78 Å²	78	137.6 Å²	137.6	80%	0.804	76%	0.764	S	S	*	*			cis	149.2	166.5	2.6	0	0	0	0	0	110.3
1026	S	32.2	Very low	30.2	Very low	109 Å²	109	140.4 Å²	140.4	76%	0.762	77%	0.772	S	S	*	*			cis	-174.2	142.2	-15	-171.9	0	0	0	0	111
1027	R	30.9	Very low	30.1	Very low	216 Å²	216	140.3 Å²	140.3	82%	0.815	77%	0.773	S	S	*	*			trans	65.9	164.4	165.8	-72.7	173.7	162.2	-140	12.8	117.1
1028	Q	28.4	Very low	29.9	Very low	144 Å²	144	138.4 Å²	138.4	67%	0.673	77%	0.771	S	S	*	*			cis	-145.1	-156.5	-6.8	-134	168.7	-70.4	0	0	114.2
1029	R	27.4	Very low	29.8	Very low	211 Å²	211	137.6 Å²	137.6	80%	0.796	78%	0.776	S	S	*	*			trans	-103.1	162.1	-165.9	-43.6	174.4	-168.2	144.2	-2.1	115
1030	F	24.7	Very low	29.3	Very low	177 Å²	177	136.9 Å²	136.9	78%	0.776	77%	0.774	S	S	*	*			trans	48	133.4	140.8	-86.8	-65.2	0	0	0	122.5
1031	F	24.2	Very low	28.9	Very low	184 Å²	184	138.4 Å²	138.4	81%	0.807	78%	0.777	S	S	*	*			trans	61.2	113.5	153.5	-77.4	-64.4	0	0	0	120.9
1032	S	28.6	Very low	28.9	Very low	101 Å²	101	134.1 Å²	134.1	71%	0.706	78%	0.777	S	S	*	*				51.4	108.7	123.7	176.5	0	0	0	0	119.9
1033	V	25.6	Very low	28.9	Very low	139 Å²	139	138.2 Å²	138.2	84%	0.842	79%	0.785	S	S	*	*				-147.9	134.7	118.7	-101.7	0	0	0	0	110.5
1034	S	31.8	Very low	28.1	Very low	121 Å²	121	136.9 Å²	136.9	85%	0.846	79%	0.79	S	S	*	*			trans	-90.2	138.8	164	-43.6	0	0	0	0	109.2
1035	S	27.2	Very low	28	Very low	97 Å²	97	136.9 Å²	136.9	68%	0.678	79%	0.785	S	S	*	*			trans	-162.6	108.5	165.9	56.3	0	0	0	0	115.2
1036	L	29	Very low	27.9	Very low	154 Å²	154	137.5 Å²	137.5	81%	0.806	78%	0.777	S	S	*	*			trans	67	160	142.6	-48	172.4	0	0	0	116.9	L1038	L1036-L1038 HydrophobicContact CD2-CD1 4.37Å
1037	S	29.5	Very low	27.5	Very low	105 Å²	105	139.6 Å²	139.6	73%	0.734	78%	0.779	S	S	*	*			cis	-126.7	155.4	-2.3	-61.1	0	0	0	0	108.5
1038	L	25.5	Very low	27.4	Very low	149 Å²	149	134.2 Å²	134.2	78%	0.78	78%	0.775	S	S	*	*			cis	68.1	127.5	44	-75.6	178.3	0	0	0	115.8	L1036	L1036-L1038 HydrophobicContact CD2-CD1 4.37Å
1039	A	25.6	Very low	27.4	Very low	96 Å²	96	132.6 Å²	132.6	79%	0.793	78%	0.775	S	S	*	*			trans	66.8	148.9	173.6	0	0	0	0	0	116
1040	S	25	Very low	27.5	Very low	102 Å²	102	131 Å²	131	71%	0.713	78%	0.776	S	S	*	*			cis	-163.4	163.9	-11.1	-114.4	0	0	0	0	111.4
1041	L	28.1	Very low	27.7	Very low	154 Å²	154	127.1 Å²	127.1	81%	0.806	77%	0.77	S	S	*	*			trans	37.2	119.7	146.9	-56.1	168.2	0	0	0	120.2
1042	T	28.8	Very low	27.9	Very low	141 Å²	141	123.1 Å²	123.1	87%	0.865	76%	0.757	S	S	*	*				174.8	161.9	102.4	40.7	0	0	0	0	112.3
1043	L	30.9	Very low	28.1	Very low	175 Å²	175	125.5 Å²	125.5	92%	0.916	76%	0.755	S	S	*	*			trans	-83.4	150.8	159	-89.4	60.2	0	0	0	109.3
1044	G	28.4	Very low	28.2	Very low	75 Å²	75	129.7 Å²	129.7	77%	0.773	76%	0.756	S	S	*	*			trans	-178	117	172.9	0	0	0	0	0	115.4
1045	D	25.9	Very low	28.2	Very low	147 Å²	147	127.9 Å²	127.9	79%	0.786	75%	0.748	S	S	*	*			trans	16.9	127.2	160.4	-74.8	-64.4	0	0	0	126.1
1046	S	28.3	Very low	29	Very low	91 Å²	91	129.3 Å²	129.3	64%	0.636	76%	0.755	S	S	*	*				48.7	121.4	99.2	-37.9	0	0	0	0	122.9
1047	D	24.4	Very low	28.9	Very low	153 Å²	153	127.2 Å²	127.2	82%	0.818	75%	0.754	S	S	*	*			trans	36.8	131.6	137.5	-62.5	-29.3	0	0	0	123.6
1048	S	29.1	Very low	29.1	Very low	103 Å²	103	133 Å²	133	72%	0.72	76%	0.76	S	S	*	*				152.6	152.7	101.4	61.5	0	0	0	0	117.3
1049	V	28	Very low	29.9	Very low	110 Å²	110	130.8 Å²	130.8	67%	0.667	75%	0.754	S	S	*	*			trans	43.4	123.6	153.6	-61.6	0	0	0	0	122.7
1050	H	28.8	Very low	29.9	Very low	177 Å²	177	132.9 Å²	132.9	82%	0.819	75%	0.752	S	S	*	*				65.9	145.7	99.9	-57.6	8.2	0	0	0	116.5
1051	S	29.4	Very low	30.2	Very low	95 Å²	95	133.1 Å²	133.1	66%	0.664	75%	0.754	S	S	*	*			cis	-164.5	-153.8	-18.3	50.5	0	0	0	0	107
1052	D	28.6	Very low	30.1	Very low	100 Å²	100	130 Å²	130	54%	0.535	75%	0.75	S	S	.	*			cis	-172.6	153.8	5.6	-135.3	-44.7	0	0	0	113
1053	K	32.1	Very low	29.9	Very low	151 Å²	151	131.4 Å²	131.4	66%	0.657	75%	0.752	S	S	*	*			trans	57.3	160.8	155.4	-71.6	140.5	-165.5	145.5	0	119
1054	R	27.3	Very low	29.7	Very low	227 Å²	227	125.9 Å²	125.9	86%	0.857	74%	0.737	S	S	*	*			cis	-154.6	165.6	-4.3	-128.2	165	-168.7	164.3	1.1	111.7
1055	A	31.7	Very low	29.5	Very low	83 Å²	83	131.7 Å²	131.7	69%	0.686	74%	0.742	S	S	*	*			trans	-103.6	176.8	172.6	0	0	0	0	0	112.4
1056	P	44.3	Very low	29.5	Very low	128 Å²	128	131.3 Å²	131.3	83%	0.831	74%	0.739	S	S	*	*				-134.1	-160.9	92.6	43.6	-32.9	0	0	0	111
1057	S	26.5	Very low	29.3	Very low	110 Å²	110	131.9 Å²	131.9	77%	0.769	74%	0.743	S	S	*	*			cis	-152.4	-177.1	5.9	64.3	0	0	0	0	111.5
1058	R	33.9	Very low	30.2	Very low	227 Å²	227	129.8 Å²	129.8	86%	0.857	74%	0.738	S	S	*	*			trans	-160.7	165.7	166.9	-119.8	-164.6	-165.4	-164.2	5.3	112.1
1059	P	42.2	Very low	29.9	Very low	102 Å²	102	130.6 Å²	130.6	66%	0.662	74%	0.738	S	S	*	*			trans	-125.4	-162.4	139.4	37.4	-25.9	0	0	0	110.9
1060	D	26.2	Very low	29.7	Very low	139 Å²	139	136.7 Å²	136.7	74%	0.743	75%	0.749	S	S	*	*				-173.7	160.3	-77.1	-92.8	-40.4	0	0	0	109.2
1061	S	30.8	Very low	29.6	Very low	108 Å²	108	133.4 Å²	133.4	76%	0.755	75%	0.747	S	S	*	*			cis	-168.8	156.8	-33	-107.5	0	0	0	0	109.1
1062	A	26.4	Very low	29.2	Very low	89 Å²	89	134.9 Å²	134.9	74%	0.736	76%	0.757	S	S	*	*	S	Bend	trans	-148.4	101.3	172.2	0	0	0	0	0	112.3
1063	N	25.3	Very low	29.3	Very low	169 Å²	169	135.5 Å²	135.5	90%	0.904	77%	0.769	S	S	*	*	S	Bend	trans	49.2	109.2	157.1	-51.5	-14.7	0	0	0	118.9
1064	G	25.9	Very low	29	Very low	59 Å²	59	139.2 Å²	139.2	61%	0.608	78%	0.779	S	S	*	*			cis	153.7	139.8	-11.3	0	0	0	0	0	114.2
1065	F	24	Very low	28.9	Very low	197 Å²	197	135.9 Å²	135.9	86%	0.864	78%	0.778	S	S	*	*			trans	63.3	135.8	157.1	-57.6	-82.2	0	0	0	118.4
1066	L	25.5	Very low	28.5	Very low	140 Å²	140	135.6 Å²	135.6	73%	0.733	78%	0.783	S	S	*	*			cis	-157.8	136.9	-0.4	-96.5	155.8	0	0	0	112.5
1067	S	24.1	Very low	27.7	Very low	102 Å²	102	138.3 Å²	138.3	71%	0.713	79%	0.785	S	S	*	*			trans	59.4	-171.8	136	-46.1	0	0	0	0	118.7
1068	P	44.8	Very low	28.2	Very low	109 Å²	109	141.5 Å²	141.5	71%	0.708	79%	0.785	S	S	*	*				-140.6	-169.2	-117	33.5	-6.5	0	0	0	117.7
1069	T	22.6	Very low	27.9	Very low	120 Å²	120	136.6 Å²	136.6	74%	0.736	78%	0.775	S	S	*	*			trans	101.4	148.7	150.8	80.4	0	0	0	0	120.8
1070	R	22.5	Very low	27.4	Very low	238 Å²	238	144.5 Å²	144.5	90%	0.898	79%	0.792	S	S	*	*			trans	64.9	145.3	160.5	-63.1	-178.9	85.5	-152.3	6.1	119.5
1071	S	28.6	Very low	27.5	Very low	109 Å²	109	145.8 Å²	145.8	76%	0.762	79%	0.794	S	S	*	*			trans	-83.8	128.2	173.3	50.3	0	0	0	0	111.7
1072	S	20.4	Very low	27.2	Very low	126 Å²	126	147.8 Å²	147.8	88%	0.881	80%	0.796	S	S	*	*			trans	-171.1	146.7	138.9	-85.9	0	0	0	0	113.5
1073	S	30.5	Very low	27.2	Very low	113 Å²	113	148.4 Å²	148.4	79%	0.79	80%	0.801	S	S	*	*			trans	-29.2	132.4	169.7	-179	0	0	0	0	117.7
1074	R	25.1	Very low	27.6	Very low	229 Å²	229	145.7 Å²	145.7	86%	0.864	80%	0.795	S	S	*	*				-161.2	157.9	122.3	-116.9	172.7	70.4	-176.7	1.9	114.2
1075	N	24.8	Very low	27.6	Very low	157 Å²	157	148.3 Å²	148.3	84%	0.84	80%	0.799	S	S	*	*			trans	-30.6	133.7	-178.9	-55.7	-1.3	0	0	0	117.4
1076	G	24.4	Very low	27.7	Very low	76 Å²	76	145.4 Å²	145.4	78%	0.784	80%	0.798	S	S	*	*			trans	-163.9	140.4	162	0	0	0	0	0	109.2
1077	E	27.5	Very low	27.9	Very low	186 Å²	186	144.2 Å²	144.2	87%	0.869	80%	0.801	S	S	*	*			trans	-73.9	170.5	-176	-62.9	177.1	94	0	0	113.5
1078	K	36.3	Very low	28.1	Very low	177 Å²	177	144.4 Å²	144.4	77%	0.77	80%	0.803	S	S	*	*			trans	90.7	167.6	141.9	-113.4	179.5	-176.6	172.8	0	120.7
1079	D	28.8	Very low	27.5	Very low	123 Å²	123	146 Å²	146	66%	0.658	81%	0.81	S	S	*	*			trans	64.8	71.5	160	-51.6	-22.4	0	0	0	119.2	E1081	D1079-E1081 PolarHBondContact O-N 3.45Å
1080	W	30.4	Very low	27.8	Very low	268 Å²	268	146.5 Å²	146.5	100%	1.015	81%	0.814	S	S	*	*			trans	-73.4	63.5	149.8	-81.9	100.8	0	0	0	111.4
1081	E	28.1	Very low	28.3	Very low	167 Å²	167	140.4 Å²	140.4	78%	0.78	81%	0.807	S	S	*	*			trans	-96.2	115.6	160.7	-70.4	-152.3	144	0	0	110.1	D1079	D1079-E1081 PolarHBondContact O-N 3.45Å
1082	N	26.1	Very low	28.8	Very low	150 Å²	150	143.2 Å²	143.2	80%	0.802	81%	0.814	S	S	*	*			trans	-176.2	79.8	143.7	-100.4	-32.2	0	0	0	111.9
1083	A	25.7	Very low	29.3	Very low	102 Å²	102	143.5 Å²	143.5	84%	0.843	81%	0.81	S	S	*	*	S	Bend	trans	-149.7	20.8	163.9	0	0	0	0	0	113.3
1084	S	33.5	Very low	29.6	Very low	112 Å²	112	146.9 Å²	146.9	78%	0.783	81%	0.813	S	S	*	*			trans	-150.5	60.8	-178.6	-75.2	0	0	0	0	113.2
1085	T	26.6	Very low	30.2	Very low	113 Å²	113	145 Å²	145	69%	0.693	81%	0.808	S	S	*	*			trans	-124.8	71.3	172.4	-38.1	0	0	0	0	110.8
1086	T	26	Very low	30.8	Very low	136 Å²	136	144 Å²	144	83%	0.834	81%	0.807	S	S	*	*			trans	-163.7	35.2	162.9	4.5	0	0	0	0	112.6	S1088	T1086-S1088 VanDerWaalsContact C-N 3.28Å; T1086-S1088 PolarHBondContact O-N 2.81Å
1087	S	28.8	Very low	31.8	Very low	115 Å²	115	141.5 Å²	141.5	80%	0.804	78%	0.782	S	S	*	*			trans	-75.7	80.9	166	56.2	0	0	0	0	110.4	V1089	S1087-V1089 PolarHBondContact O-N 2.81Å
1088	S	28.3	Very low	32.8	Very low	107 Å²	107	138.1 Å²	138.1	75%	0.748	78%	0.776	S	S	*	*			trans	-64.8	126.3	165.7	-63.8	0	0	0	0	109.3	T1086 T1090	T1086-S1088 VanDerWaalsContact C-N 3.28Å; T1086-S1088 PolarHBondContact O-N 2.81Å; S1088-T1090 PolarHBondContact O-N 2.66Å
1089	V	33.4	Very low	33.5	Very low	142 Å²	142	138.3 Å²	138.3	86%	0.861	77%	0.772	S	S	*	*			trans	-69.9	117.5	-174.8	177.3	0	0	0	0	110.9	S1087	S1087-V1089 PolarHBondContact O-N 2.81Å
1090	T	28.6	Very low	34.6	Very low	131 Å²	131	140.8 Å²	140.8	80%	0.804	78%	0.784	S	S	*	*			trans	-124.4	147.1	154	50.4	0	0	0	0	109.2	S1088	S1088-T1090 PolarHBondContact O-N 2.66Å
1091	S	32.5	Very low	35.2	Very low	109 Å²	109	137.1 Å²	137.1	76%	0.762	77%	0.772	S	S	*	*			trans	-72.3	158.1	-169.8	46.8	0	0	0	0	113.4	T1093	S1091-T1093 PolarHBondContact O-N 3.07Å
1092	N	39	Very low	36.4	Very low	168 Å²	168	138 Å²	138	90%	0.898	77%	0.773	S	S	*	*			trans	-52.5	99.6	179.5	-69.8	-17.7	0	0	0	113.5
1093	T	30.9	Very low	36.9	Very low	132 Å²	132	138.4 Å²	138.4	81%	0.81	77%	0.77	S	S	*	*			trans	-116.9	114	141.7	30.3	0	0	0	0	107.2	S1091 Y1095	S1091-T1093 PolarHBondContact O-N 3.07Å; T1093-Y1095 PolarHBondContact O-N 2.91Å
1094	E	37.7	Very low	38	Very low	184 Å²	184	137.7 Å²	137.7	86%	0.86	76%	0.757	S	S	*	*			trans	-65.1	109.2	-177.1	-167.3	166.1	-147	0	0	109	T1096	E1094-T1096 VanDerWaalsContact C-N 3.28Å; E1094-T1096 PolarHBondContact O-N 3.42Å; E1094-T1096 PolarHBondContact O-OG1 3.36Å
1095	Y	36.8	Very low	38.7	Very low	191 Å²	191	136.8 Å²	136.8	75%	0.749	75%	0.75	S	S	*	*			trans	-73.5	82.8	-175.5	178.7	-100.1	0	0	0	110.4	T1093 G1097	T1093-Y1095 PolarHBondContact O-N 2.91Å; Y1095-G1097 PolarHBondContact O-N 3.45Å
1096	T	38.1	Very low	39.9	Very low	134 Å²	134	136.3 Å²	136.3	82%	0.822	76%	0.758	S	S	*	*			trans	-76	29.6	172.9	-43.9	0	0	0	0	111.7	E1094	E1094-T1096 VanDerWaalsContact C-N 3.28Å; E1094-T1096 PolarHBondContact O-N 3.42Å; E1094-T1096 PolarHBondContact O-OG1 3.36Å
1097	G	45.7	Very low	42	Very low	25 Å²	25	137.2 Å²	137.2	26%	0.258	75%	0.75	S	S	.	*	S	Bend	trans	-81.4	165.8	175.6	0	0	0	0	0	112.3	Y1095 R1099	Y1095-G1097 PolarHBondContact O-N 3.45Å; G1097-R1099 PolarHBondContact O-N 3.17Å
1098	P	47.1	Very low	44.5	Very low	115 Å²	115	133.4 Å²	133.4	75%	0.747	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-56.1	133	175.1	-23.9	34.4	0	0	0	111.2
1099	R	51.4	Low	47.4	Very low	180 Å²	180	128.7 Å²	128.7	68%	0.679	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-63.4	138.2	172.6	-66.9	-179.1	178.6	168.6	1.2	109.1	G1097 Y1101	G1097-R1099 PolarHBondContact O-N 3.17Å; R1099-Y1101 PolarHBondContact O-N 2.9Å
1100	L	51.7	Low	50.2	Low	175 Å²	175	123.4 Å²	123.4	92%	0.916	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-52.9	123.3	172.6	-77	161.8	0	0	0	109.6	K1102	L1100-K1102 PolarHBondContact O-N 3.19Å; L1100-K1102 VanDerWaalsContact O-N 3.13Å
1101	Y	42.5	Very low	53	Low	192 Å²	192	123.3 Å²	123.3	75%	0.753	65%	0.646	S	S	*	*			trans	-69.6	112.5	-179.5	-174.8	-94.1	0	0	0	109.8	R1099 E1103	R1099-Y1101 PolarHBondContact O-N 2.9Å; Y1101-E1103 HydrophobicContact CE1-CG 4.3Å
1102	K	54.8	Low	55.8	Low	186 Å²	186	120.2 Å²	120.2	81%	0.809	62%	0.62	S	S	*	*			trans	-119.7	136.5	164	-178	174.2	-178.3	174.6	0	106.3	L1100	L1100-K1102 PolarHBondContact O-N 3.19Å; L1100-K1102 VanDerWaalsContact O-N 3.13Å
1103	E	36.6	Very low	58.3	Low	158 Å²	158	112.2 Å²	112.2	74%	0.738	58%	0.578	S	S	*	*			trans	-51.2	130.7	-177.4	-64.3	-179.9	146.6	0	0	111.2	Y1101 S1105	Y1101-E1103 HydrophobicContact CE1-CG 4.3Å; E1103-S1105 PolarHBondContact O-N 3.45Å; E1103-S1105 VanDerWaalsContact O-N 3.14Å
1104	P	48.7	Very low	61.2	Low	86 Å²	86	108 Å²	108	56%	0.558	55%	0.549	S	S	*	.			trans	-57.4	119.3	174.2	-25.3	35	0	0	0	110.4	A1106	P1104-A1106 PolarHBondContact O-N 2.95Å
1105	S	47.9	Very low	63.7	Low	93 Å²	93	102.9 Å²	102.9	65%	0.65	53%	0.527	S	S	*	.			trans	-67.2	95.7	176.9	166.7	0	0	0	0	109.4	E1103 K1107	E1103-S1105 PolarHBondContact O-N 3.45Å; E1103-S1105 VanDerWaalsContact O-N 3.14Å; S1105-K1107 PolarHBondContact O-N 3.35Å
1106	A	51.5	Low	66.3	Low	104 Å²	104	93.8 Å²	93.8	86%	0.86	49%	0.491	S	S	*	.			trans	-67.9	30.3	-177.3	0	0	0	0	0	115.1	P1104 S1108	P1104-A1106 PolarHBondContact O-N 2.95Å; A1106-S1108 PolarHBondContact O-N 3.07Å
1107	K	69.3	Low	68.7	Low	155 Å²	155	87.4 Å²	87.4	67%	0.674	45%	0.452	S	S	*	.			trans	-93.1	92.5	179.2	-174.1	179	-178.3	177.9	0	109.6	S1105	S1105-K1107 PolarHBondContact O-N 3.35Å
1108	S	82.7	Confident	70.7	Confident	35 Å²	35	87.5 Å²	87.5	25%	0.245	45%	0.451	C	S	.	.			trans	-56.1	139.3	171.6	173.5	0	0	0	0	111.7	A1106 K1110 N1144	A1106-S1108 PolarHBondContact O-N 3.07Å; S1108-K1110 WeakPolarHBondContact OG-CB 3.48Å; S1108-K1110 PolarHBondContact OG-N 2.9Å; S1108-K1110 VanDerWaalsContact OG-N 3.14Å; S1108-N1144 WeakPolarHBondContact CA-O 3.4Å; S1108-N1144 VanDerWaalsContact CB-O 3.23Å; S1108-N1144 WeakPolarHBondContact CB-O 3.25Å; S1108-N1144 PolarHBondContact OG-O 2.89Å
1109	N	89.3	Confident	72.3	Confident	8 Å²	8	86.8 Å²	86.8	4%	0.043	44%	0.437	C	S	.	.			trans	-94.2	6	172.8	83.6	-20.7	0	0	0	113.8	H1111 I1112 I1113 N1144 N1145 F1146 D1212	N1109-H1111 VanDerWaalsContact C-N 3.32Å; N1109-H1111 PolarHBondContact O-N 2.85Å; N1109-I1112 HydrophobicContact CB-CB 4.28Å; N1109-I1112 HydrophobicContact CB-CD1 4.09Å; N1109-I1112 HydrophobicContact CB-CG1 4.36Å; N1109-I1112 WeakPolarHBondContact O-CA 3.5Å; N1109-I1112 VanDerWaalsContact O-CB 3.27Å; N1109-I1112 WeakPolarHBondContact O-CB 3.49Å; N1109-I1112 PolarHBondContact O-N 2.9Å; N1109-I1113 PolarHBondContact O-N 3.05Å; N1109-N1144 PolarHBondContact N-O 3.04Å; N1109-N1145 WeakPolarHBondContact OD1-CA 3.27Å; N1109-F1146 PolarHBondContact ND2-O 2.9Å; N1109-F1146 PolarHBondContact OD1-N 2.84Å; N1109-F1146 PolarHBondContact OD1-O 2.86Å; N1109-D1212 PolarHBondContact ND2-OD1 3.2Å
1110	K	90.7	Very high	73.8	Confident	30 Å²	30	80.7 Å²	80.7	13%	0.13	42%	0.421	C	S	.	.	H	α-helix	trans	-47.4	-50.4	-178.8	-173.5	168.7	174.6	168.7	0	112.5	S1108 I1112 I1113 Q1114 M1138 E1139 F1146	S1108-K1110 WeakPolarHBondContact OG-CB 3.48Å; S1108-K1110 PolarHBondContact OG-N 2.9Å; S1108-K1110 VanDerWaalsContact OG-N 3.14Å; K1110-I1112 VanDerWaalsContact C-N 3.32Å; K1110-I1112 PolarHBondContact O-N 2.87Å; K1110-I1113 PolarHBondContact O-N 2.82Å; K1110-Q1114 WeakPolarHBondContact O-CB 3.49Å; K1110-Q1114 VanDerWaalsContact O-CG 3.32Å; K1110-Q1114 WeakPolarHBondContact O-CG 3.33Å; K1110-Q1114 PolarHBondContact O-N 2.87Å; K1110-M1138 WeakPolarHBondContact CE-O 3.28Å; K1110-M1138 HydrophobicContact CG-CG 4.41Å; K1110-M1138 PolarHBondContact NZ-O 3.43Å; K1110-M1138 VanDerWaalsContact NZ-O 3.11Å; K1110-E1139 WeakPolarHBondContact CE-OE1 3.29Å; K1110-E1139 WeakPolarHBondContact CE-OE2 3.45Å; K1110-E1139 VanDerWaalsContact NZ-CD 3.26Å; K1110-E1139 IonicContact NZ-OE1 3.48Å; K1110-E1139 PolarHBondContact NZ-OE1 3.37Å; K1110-E1139 IonicContact NZ-OE2 3.53Å; K1110-E1139 PolarHBondContact NZ-OE2 3.27Å; K1110-F1146 HydrophobicContact CB-CD2 4.14Å; K1110-F1146 HydrophobicContact CB-CE2 3.83Å; K1110-F1146 HydrophobicContact CD-CE2 3.98Å; K1110-F1146 HydrophobicContact CD-CZ 4.49Å; K1110-F1146 HydrophobicContact CG-CD2 4.37Å; K1110-F1146 HydrophobicContact CG-CE2 3.79Å
1111	H	88.7	Confident	75.3	Confident	130 Å²	130	73.1 Å²	73.1	60%	0.602	38%	0.383	S	S	*	.	H	α-helix	trans	-64.8	-29.7	176.6	-61.1	101.7	0	0	0	114.2	N1109 N1115	N1109-H1111 VanDerWaalsContact C-N 3.32Å; N1109-H1111 PolarHBondContact O-N 2.85Å; H1111-N1115 WeakPolarHBondContact O-CB 3.35Å; H1111-N1115 PolarHBondContact O-N 2.97Å; H1111-N1115 PolarHBondContact O-ND2 2.89Å
1112	I	91.3	Very high	77.3	Confident	44 Å²	44	64.3 Å²	64.3	23%	0.226	35%	0.349	C	S	.	.	H	α-helix	trans	-70.4	-46	177	-53.1	-176.8	0	0	0	108.8	N1109 K1110 N1115 A1116 Y1192	N1109-I1112 HydrophobicContact CB-CB 4.28Å; N1109-I1112 HydrophobicContact CB-CD1 4.09Å; N1109-I1112 HydrophobicContact CB-CG1 4.36Å; N1109-I1112 WeakPolarHBondContact O-CA 3.5Å; N1109-I1112 VanDerWaalsContact O-CB 3.27Å; N1109-I1112 WeakPolarHBondContact O-CB 3.49Å; N1109-I1112 PolarHBondContact O-N 2.9Å; K1110-I1112 VanDerWaalsContact C-N 3.32Å; K1110-I1112 PolarHBondContact O-N 2.87Å; I1112-N1115 PolarHBondContact O-N 3.3Å; I1112-A1116 WeakPolarHBondContact O-CB 3.42Å; I1112-A1116 PolarHBondContact O-N 3.36Å; I1112-Y1192 HydrophobicContact CG2-CD1 3.68Å; I1112-Y1192 HydrophobicContact CG2-CG 4.29Å
1113	I	91.6	Very high	78.5	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-68.8	-41.1	177.6	-57.4	-55.5	0	0	0	111.9	N1109 K1110 N1115 A1116 L1117 M1138 F1146 V1148 L1160 D1212	N1109-I1113 PolarHBondContact O-N 3.05Å; K1110-I1113 PolarHBondContact O-N 2.82Å; I1113-N1115 VanDerWaalsContact C-N 3.31Å; I1113-N1115 PolarHBondContact O-N 3.17Å; I1113-A1116 PolarHBondContact O-N 3.01Å; I1113-A1116 VanDerWaalsContact O-N 3.17Å; I1113-L1117 HydrophobicContact CG2-CD1 4.01Å; I1113-L1117 HydrophobicContact CG2-CG 4.15Å; I1113-L1117 WeakPolarHBondContact O-CB 3.37Å; I1113-L1117 VanDerWaalsContact O-CG 3.29Å; I1113-L1117 WeakPolarHBondContact O-CG 3.5Å; I1113-L1117 PolarHBondContact O-N 2.88Å; I1113-M1138 HydrophobicContact CB-SD 4.33Å; I1113-M1138 HydrophobicContact CG2-CE 4.46Å; I1113-M1138 HydrophobicContact CG2-SD 3.96Å; I1113-F1146 HydrophobicContact CG1-CB 4.1Å; I1113-F1146 HydrophobicContact CG2-CB 4.44Å; I1113-V1148 HydrophobicContact CG2-CG2 4.12Å; I1113-L1160 HydrophobicContact CG2-CD1 3.85Å; I1113-D1212 HydrophobicContact CD1-CB 3.68Å; I1113-D1212 WeakPolarHBondContact CD1-O 3.41Å
1114	Q	90.3	Very high	80.8	Confident	43 Å²	43	52.7 Å²	52.7	20%	0.201	32%	0.32	C	S	.	.	H	α-helix	trans	-53.8	-47	171.6	-76.4	173.6	-19	0	0	111.6	K1110 A1118 L1135 M1138 E1139	K1110-Q1114 WeakPolarHBondContact O-CB 3.49Å; K1110-Q1114 VanDerWaalsContact O-CG 3.32Å; K1110-Q1114 WeakPolarHBondContact O-CG 3.33Å; K1110-Q1114 PolarHBondContact O-N 2.87Å; Q1114-A1118 VanDerWaalsContact O-CB 3.3Å; Q1114-A1118 WeakPolarHBondContact O-CB 3.41Å; Q1114-A1118 PolarHBondContact O-N 3.16Å; Q1114-L1135 HydrophobicContact CB-CD2 4.28Å; Q1114-L1135 HydrophobicContact CG-CD2 3.92Å; Q1114-M1138 HydrophobicContact CB-CE 4.35Å; Q1114-M1138 HydrophobicContact CG-CE 3.43Å; Q1114-M1138 VanDerWaalsContact CG-CE 3.43Å; Q1114-E1139 PolarHBondContact NE2-OE2 2.92Å
1115	N	90.7	Very high	82.4	Confident	76 Å²	76	57.2 Å²	57.2	41%	0.406	33%	0.331	S	S	.	.	H	α-helix	trans	-65.4	-41.9	176.3	-79.9	-55.7	0	0	0	112.6	H1111 I1112 I1113 A1118 H1119 Y1192	H1111-N1115 WeakPolarHBondContact O-CB 3.35Å; H1111-N1115 PolarHBondContact O-N 2.97Å; H1111-N1115 PolarHBondContact O-ND2 2.89Å; I1112-N1115 PolarHBondContact O-N 3.3Å; I1113-N1115 VanDerWaalsContact C-N 3.31Å; I1113-N1115 PolarHBondContact O-N 3.17Å; N1115-A1118 PolarHBondContact O-N 2.93Å; N1115-H1119 WeakPolarHBondContact O-CB 3.46Å; N1115-H1119 PolarHBondContact O-N 3.36Å; N1115-Y1192 HydrophobicContact CB-CE1 4.35Å
1116	A	91	Very high	84.3	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-64.9	-41.8	178.3	0	0	0	0	0	112.6	I1112 I1113 C1120 C1121 Y1192 F1199	I1112-A1116 WeakPolarHBondContact O-CB 3.42Å; I1112-A1116 PolarHBondContact O-N 3.36Å; I1113-A1116 PolarHBondContact O-N 3.01Å; I1113-A1116 VanDerWaalsContact O-N 3.17Å; A1116-C1120 WeakPolarHBondContact O-CA 3.17Å; A1116-C1120 WeakPolarHBondContact O-CB 3.39Å; A1116-C1120 PolarHBondContact O-N 3.45Å; A1116-C1121 PolarHBondContact O-N 2.83Å; A1116-Y1192 HydrophobicContact CB-CD1 4.08Å; A1116-Y1192 HydrophobicContact CB-CD2 3.53Å; A1116-Y1192 HydrophobicContact CB-CE1 4.13Å; A1116-Y1192 HydrophobicContact CB-CE2 3.61Å; A1116-Y1192 HydrophobicContact CB-CG 3.76Å; A1116-F1199 HydrophobicContact CB-CE2 4.06Å; A1116-F1199 HydrophobicContact CB-CZ 3.68Å
1117	L	89.9	Confident	85.9	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.005	31%	0.314	C	S	.	.	I	π-helix	trans	-62.5	-44.8	173.1	-67.4	174.5	0	0	0	111.3	I1113 H1119 C1121 L1122 I1134 M1138 V1148 F1157	I1113-L1117 HydrophobicContact CG2-CD1 4.01Å; I1113-L1117 HydrophobicContact CG2-CG 4.15Å; I1113-L1117 WeakPolarHBondContact O-CB 3.37Å; I1113-L1117 VanDerWaalsContact O-CG 3.29Å; I1113-L1117 WeakPolarHBondContact O-CG 3.5Å; I1113-L1117 PolarHBondContact O-N 2.88Å; L1117-H1119 PolarHBondContact O-N 3.08Å; L1117-C1121 HydrophobicContact CD2-CB 4.09Å; L1117-L1122 HydrophobicContact CD2-CD1 4.11Å; L1117-L1122 CarbonylContact O-C 3.52Å; L1117-L1122 WeakPolarHBondContact O-CA 3.38Å; L1117-L1122 WeakPolarHBondContact O-CB 3.28Å; L1117-L1122 PolarHBondContact O-N 3.24Å; L1117-I1134 HydrophobicContact CD1-CG2 3.81Å; L1117-M1138 HydrophobicContact CD1-CE 3.74Å; L1117-V1148 HydrophobicContact CD2-CG2 4.25Å; L1117-F1157 HydrophobicContact CD2-CD2 3.74Å; L1117-F1157 HydrophobicContact CD2-CE2 3.55Å; L1117-F1157 HydrophobicContact CD2-CZ 4.43Å
1118	A	86.8	Confident	86.8	Confident	27 Å²	27	54.2 Å²	54.2	22%	0.223	30%	0.302	C	S	.	.	I	π-helix	trans	-71.5	-26.7	-177.4	0	0	0	0	0	115	Q1114 N1115	Q1114-A1118 VanDerWaalsContact O-CB 3.3Å; Q1114-A1118 WeakPolarHBondContact O-CB 3.41Å; Q1114-A1118 PolarHBondContact O-N 3.16Å; N1115-A1118 PolarHBondContact O-N 2.93Å
1119	H	80.8	Confident	87	Confident	99 Å²	99	55.3 Å²	55.3	46%	0.458	32%	0.319	S	S	.	.	I	π-helix	trans	-120.5	-19.2	-172.1	-70	-47.5	0	0	0	116.2	N1115 L1117 K1197	N1115-H1119 WeakPolarHBondContact O-CB 3.46Å; N1115-H1119 PolarHBondContact O-N 3.36Å; L1117-H1119 PolarHBondContact O-N 3.08Å; H1119-K1197 HydrophobicContact CB-CD 4.28Å
1120	C	82.9	Confident	86.8	Confident	52 Å²	52	59.4 Å²	59.4	35%	0.351	34%	0.338	S	S	.	.	I	π-helix	trans	-124.4	-54.5	-175.2	-172.4	0	0	0	0	112	A1116 Y1192 F1199	A1116-C1120 WeakPolarHBondContact O-CA 3.17Å; A1116-C1120 WeakPolarHBondContact O-CB 3.39Å; A1116-C1120 PolarHBondContact O-N 3.45Å; C1120-Y1192 HydrophobicContact CB-CE2 4.07Å; C1120-F1199 HydrophobicContact CB-CE2 4.24Å
1121	C	82.3	Confident	86.8	Confident	16 Å²	16	60 Å²	60	11%	0.108	34%	0.341	C	S	.	.	I	π-helix	trans	-84.1	-37	-169.4	-59.2	0	0	0	0	115	A1116 L1117 F1157 F1199	A1116-C1121 PolarHBondContact O-N 2.83Å; L1117-C1121 HydrophobicContact CD2-CB 4.09Å; C1121-F1157 HydrophobicContact CB-CB 4.13Å; C1121-F1157 HydrophobicContact CB-CD2 4.18Å; C1121-F1199 WeakPolarHBondContact SG-CE2 3.48Å
1122	L	84.5	Confident	86.8	Confident	7 Å²	7	57.7 Å²	57.7	4%	0.037	33%	0.333	C	S	.	.	S	Bend	trans	-132.9	41.6	-176.2	-63	173.2	0	0	0	110.8	L1117 N1127 K1131 I1134 F1157	L1117-L1122 HydrophobicContact CD2-CD1 4.11Å; L1117-L1122 CarbonylContact O-C 3.52Å; L1117-L1122 WeakPolarHBondContact O-CA 3.38Å; L1117-L1122 WeakPolarHBondContact O-CB 3.28Å; L1117-L1122 PolarHBondContact O-N 3.24Å; L1122-N1127 HydrophobicContact CB-CB 4.14Å; L1122-N1127 HydrophobicContact CD2-CB 4.29Å; L1122-K1131 HydrophobicContact CB-CB 4.02Å; L1122-K1131 HydrophobicContact CD1-CB 4.29Å; L1122-I1134 HydrophobicContact CD1-CD1 3.6Å; L1122-F1157 HydrophobicContact CD1-CD1 4.27Å; L1122-F1157 HydrophobicContact CD1-CE1 4.38Å; L1122-F1157 HydrophobicContact CD1-CG 4.43Å; L1122-F1157 HydrophobicContact CD2-CB 4.16Å; L1122-F1157 HydrophobicContact CD2-CD1 3.97Å; L1122-F1157 HydrophobicContact CD2-CG 4.11Å; L1122-F1157 HydrophobicContact CG-CB 4.49Å; L1122-F1157 HydrophobicContact CG-CD1 4.37Å; L1122-F1157 HydrophobicContact CG-CG 4.23Å
1123	A	82	Confident	86.8	Confident	44 Å²	44	62.2 Å²	62.2	36%	0.364	35%	0.351	S	S	.	.			trans	-72.1	156.6	173.9	0	0	0	0	0	111.8	N1127	A1123-N1127 PolarHBondContact O-ND2 3.47Å
1124	G	83.8	Confident	86.8	Confident	56 Å²	56	62.4 Å²	62.4	58%	0.577	35%	0.352	S	S	*	.	S	Bend	trans	85.1	153.3	177.5	0	0	0	0	0	114.7	V1126 N1127	G1124-V1126 VanDerWaalsContact C-N 3.29Å; G1124-V1126 PolarHBondContact O-N 2.88Å; G1124-N1127 PolarHBondContact O-N 3.38Å; G1124-N1127 VanDerWaalsContact O-N 3.16Å
1125	K	81.7	Confident	86.8	Confident	182 Å²	182	62.4 Å²	62.4	79%	0.791	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-58	-35.5	-173	-68	-173.4	175.9	-174.6	0	114.3	N1127 E1128	K1125-N1127 PolarHBondContact O-N 3.18Å; K1125-E1128 VanDerWaalsContact O-CB 3.24Å; K1125-E1128 WeakPolarHBondContact O-CB 3.4Å; K1125-E1128 PolarHBondContact O-N 3.45Å; K1125-E1128 VanDerWaalsContact O-N 3.1Å
1126	V	88.4	Confident	86.7	Confident	142 Å²	142	63.9 Å²	63.9	86%	0.861	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-59.1	-33.7	-179	-177.3	0	0	0	0	111.6	G1124	G1124-V1126 VanDerWaalsContact C-N 3.29Å; G1124-V1126 PolarHBondContact O-N 2.88Å
1127	N	85.7	Confident	86.6	Confident	54 Å²	54	66.6 Å²	66.6	29%	0.289	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-93.3	-0.5	-178.3	-61	-47.3	0	0	0	113.2	L1122 A1123 G1124 K1125 G1129 Q1130 K1131	L1122-N1127 HydrophobicContact CB-CB 4.14Å; L1122-N1127 HydrophobicContact CD2-CB 4.29Å; A1123-N1127 PolarHBondContact O-ND2 3.47Å; G1124-N1127 PolarHBondContact O-N 3.38Å; G1124-N1127 VanDerWaalsContact O-N 3.16Å; K1125-N1127 PolarHBondContact O-N 3.18Å; N1127-G1129 PolarHBondContact O-N 3.01Å; N1127-Q1130 PolarHBondContact O-N 3.47Å; N1127-K1131 VanDerWaalsContact O-CB 3.29Å; N1127-K1131 WeakPolarHBondContact O-CB 3.36Å; N1127-K1131 PolarHBondContact O-N 2.77Å
1128	E	87.8	Confident	86.6	Confident	93 Å²	93	66.6 Å²	66.6	44%	0.435	37%	0.37	S	S	.	.	H	α-helix	trans	-66	-39.6	-166.8	-171.5	153.7	-142.9	0	0	113	K1125 N1132	K1125-E1128 VanDerWaalsContact O-CB 3.24Å; K1125-E1128 WeakPolarHBondContact O-CB 3.4Å; K1125-E1128 PolarHBondContact O-N 3.45Å; K1125-E1128 VanDerWaalsContact O-N 3.1Å; E1128-N1132 WeakPolarHBondContact O-CB 3.5Å; E1128-N1132 PolarHBondContact O-N 3.07Å; E1128-N1132 PolarHBondContact O-ND2 2.74Å; E1128-N1132 PolarHBondContact O-OD1 2.93Å
1129	G	86.4	Confident	86.7	Confident	57 Å²	57	70.8 Å²	70.8	59%	0.588	39%	0.385	S	S	*	.	H	α-helix	trans	-64.9	-43.1	173.2	0	0	0	0	0	113.1	N1127 N1132 K1133	N1127-G1129 PolarHBondContact O-N 3.01Å; G1129-N1132 PolarHBondContact O-N 2.95Å; G1129-K1133 PolarHBondContact O-N 3.43Å; G1129-K1133 VanDerWaalsContact O-N 3.08Å
1130	Q	86.1	Confident	87.1	Confident	94 Å²	94	72.1 Å²	72.1	44%	0.439	39%	0.389	S	S	.	.	H	α-helix	trans	-66.1	-43.1	177	-176.5	179.2	0.4	0	0	111.4	N1127 K1133 I1134	N1127-Q1130 PolarHBondContact O-N 3.47Å; Q1130-K1133 PolarHBondContact O-N 3.46Å; Q1130-I1134 HydrophobicContact CG-CD1 3.72Å; Q1130-I1134 WeakPolarHBondContact O-CD1 3.39Å; Q1130-I1134 VanDerWaalsContact O-CG1 3.28Å; Q1130-I1134 WeakPolarHBondContact O-CG1 3.45Å; Q1130-I1134 PolarHBondContact O-N 3.02Å
1131	K	90.3	Very high	87.2	Confident	44 Å²	44	70.6 Å²	70.6	19%	0.191	38%	0.379	C	S	.	.	H	α-helix	trans	-56.1	-51.7	174.1	172.6	-168.7	159.4	-163.4	0	110.8	L1122 N1127 K1133 I1134 L1135	L1122-K1131 HydrophobicContact CB-CB 4.02Å; L1122-K1131 HydrophobicContact CD1-CB 4.29Å; N1127-K1131 VanDerWaalsContact O-CB 3.29Å; N1127-K1131 WeakPolarHBondContact O-CB 3.36Å; N1127-K1131 PolarHBondContact O-N 2.77Å; K1131-K1133 PolarHBondContact O-N 3.18Å; K1131-I1134 PolarHBondContact O-N 2.84Å; K1131-L1135 HydrophobicContact CD-CD1 4.5Å; K1131-L1135 HydrophobicContact CG-CD1 3.88Å; K1131-L1135 HydrophobicContact CG-CG 4.39Å; K1131-L1135 VanDerWaalsContact O-CG 3.32Å; K1131-L1135 WeakPolarHBondContact O-CG 3.44Å; K1131-L1135 PolarHBondContact O-N 3.39Å
1132	N	89.7	Confident	87.3	Confident	81 Å²	81	77.8 Å²	77.8	43%	0.433	41%	0.411	S	S	.	.	H	α-helix	trans	-63.2	-43.1	-177.2	-68.2	-8.6	0	0	0	111.3	E1128 G1129 I1134 L1135 E1136	E1128-N1132 WeakPolarHBondContact O-CB 3.5Å; E1128-N1132 PolarHBondContact O-N 3.07Å; E1128-N1132 PolarHBondContact O-ND2 2.74Å; E1128-N1132 PolarHBondContact O-OD1 2.93Å; G1129-N1132 PolarHBondContact O-N 2.95Å; N1132-I1134 VanDerWaalsContact C-N 3.33Å; N1132-I1134 PolarHBondContact O-N 3.49Å; N1132-L1135 PolarHBondContact O-N 3.36Å; N1132-E1136 WeakPolarHBondContact O-CB 3.4Å; N1132-E1136 PolarHBondContact O-N 3.48Å
1133	K	90.9	Very high	87.3	Confident	139 Å²	139	78.8 Å²	78.8	60%	0.604	42%	0.42	S	S	*	.	H	α-helix	trans	-59.5	-39.2	173.8	-173.1	166.3	-174.7	166	0	112.9	G1129 Q1130 K1131 E1137	G1129-K1133 PolarHBondContact O-N 3.43Å; G1129-K1133 VanDerWaalsContact O-N 3.08Å; Q1130-K1133 PolarHBondContact O-N 3.46Å; K1131-K1133 PolarHBondContact O-N 3.18Å; K1133-E1137 WeakPolarHBondContact O-CG 3.02Å; K1133-E1137 PolarHBondContact O-N 2.9Å; K1133-E1137 VanDerWaalsContact O-N 3.15Å
1134	I	90.4	Very high	87.4	Confident	4 Å²	4	81.1 Å²	81.1	2%	0.021	43%	0.427	C	S	.	.	H	α-helix	trans	-73.8	-35.1	178.1	-67.8	163.4	0	0	0	111.9	L1117 L1122 Q1130 K1131 N1132 M1138 F1157 L1160 T1174	L1117-I1134 HydrophobicContact CD1-CG2 3.81Å; L1122-I1134 HydrophobicContact CD1-CD1 3.6Å; Q1130-I1134 HydrophobicContact CG-CD1 3.72Å; Q1130-I1134 WeakPolarHBondContact O-CD1 3.39Å; Q1130-I1134 VanDerWaalsContact O-CG1 3.28Å; Q1130-I1134 WeakPolarHBondContact O-CG1 3.45Å; Q1130-I1134 PolarHBondContact O-N 3.02Å; K1131-I1134 PolarHBondContact O-N 2.84Å; N1132-I1134 VanDerWaalsContact C-N 3.33Å; N1132-I1134 PolarHBondContact O-N 3.49Å; I1134-M1138 VanDerWaalsContact O-CB 3.28Å; I1134-M1138 WeakPolarHBondContact O-CB 3.18Å; I1134-M1138 PolarHBondContact O-N 3.32Å; I1134-F1157 HydrophobicContact CD1-CD1 4.46Å; I1134-F1157 HydrophobicContact CD1-CE1 3.51Å; I1134-F1157 HydrophobicContact CD1-CZ 3.67Å; I1134-L1160 HydrophobicContact CG2-CB 4.44Å; I1134-L1160 HydrophobicContact CG2-CD2 3.76Å; I1134-T1174 HydrophobicContact CB-CG2 4.35Å; I1134-T1174 HydrophobicContact CG1-CG2 3.91Å; I1134-T1174 HydrophobicContact CG2-CG2 4.01Å
1135	L	90	Very high	87.7	Confident	42 Å²	42	79.4 Å²	79.4	22%	0.22	40%	0.404	C	S	.	.	H	α-helix	trans	-65.1	-40.8	173.6	-71.1	171.9	0	0	0	111.2	Q1114 K1131 N1132 M1138 E1139	Q1114-L1135 HydrophobicContact CB-CD2 4.28Å; Q1114-L1135 HydrophobicContact CG-CD2 3.92Å; K1131-L1135 HydrophobicContact CD-CD1 4.5Å; K1131-L1135 HydrophobicContact CG-CD1 3.88Å; K1131-L1135 HydrophobicContact CG-CG 4.39Å; K1131-L1135 VanDerWaalsContact O-CG 3.32Å; K1131-L1135 WeakPolarHBondContact O-CG 3.44Å; K1131-L1135 PolarHBondContact O-N 3.39Å; N1132-L1135 PolarHBondContact O-N 3.36Å; L1135-M1138 HydrophobicContact CD2-CE 3.75Å; L1135-M1138 PolarHBondContact O-N 2.82Å; L1135-E1139 PolarHBondContact O-N 2.99Å
1136	E	90.1	Very high	88.2	Confident	108 Å²	108	70.8 Å²	70.8	51%	0.505	37%	0.367	S	S	.	.	H	α-helix	trans	-62.2	-49.4	176.3	-165.5	-163.9	138.8	0	0	111.9	N1132 M1138 E1139 K1140	N1132-E1136 WeakPolarHBondContact O-CB 3.4Å; N1132-E1136 PolarHBondContact O-N 3.48Å; E1136-M1138 VanDerWaalsContact C-N 3.29Å; E1136-M1138 PolarHBondContact O-N 3.26Å; E1136-E1139 PolarHBondContact O-N 3.03Å; E1136-K1140 WeakPolarHBondContact O-CG 3.3Å; E1136-K1140 PolarHBondContact O-N 3.33Å; E1136-K1140 WeakPolarHBondContact OE1-CE 3.44Å; E1136-K1140 IonicContact OE1-NZ 2.69Å; E1136-K1140 PolarHBondContact OE1-NZ 2.87Å
1137	E	88.9	Confident	88.4	Confident	57 Å²	57	64 Å²	64	27%	0.266	33%	0.326	S	S	.	.	H	α-helix	trans	-64.2	-31.6	176.3	-65.8	-60.7	114	0	0	112.9	K1133 E1139 K1140 S1141	K1133-E1137 WeakPolarHBondContact O-CG 3.02Å; K1133-E1137 PolarHBondContact O-N 2.9Å; K1133-E1137 VanDerWaalsContact O-N 3.15Å; E1137-E1139 VanDerWaalsContact C-N 3.33Å; E1137-K1140 WeakPolarHBondContact OE1-CD 3.32Å; E1137-K1140 IonicContact OE1-NZ 3.3Å; E1137-K1140 PolarHBondContact OE1-NZ 2.87Å; E1137-S1141 WeakPolarHBondContact O-CB 3.38Å; E1137-S1141 PolarHBondContact O-N 2.66Å
1138	M	89.3	Confident	88.7	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-76.1	-19.6	173.1	-174.8	169.6	49.6	0	0	112.9	K1110 I1113 Q1114 L1117 I1134 L1135 E1136 F1146 L1160	K1110-M1138 WeakPolarHBondContact CE-O 3.28Å; K1110-M1138 HydrophobicContact CG-CG 4.41Å; K1110-M1138 PolarHBondContact NZ-O 3.43Å; K1110-M1138 VanDerWaalsContact NZ-O 3.11Å; I1113-M1138 HydrophobicContact CB-SD 4.33Å; I1113-M1138 HydrophobicContact CG2-CE 4.46Å; I1113-M1138 HydrophobicContact CG2-SD 3.96Å; Q1114-M1138 HydrophobicContact CB-CE 4.35Å; Q1114-M1138 HydrophobicContact CG-CE 3.43Å; Q1114-M1138 VanDerWaalsContact CG-CE 3.43Å; L1117-M1138 HydrophobicContact CD1-CE 3.74Å; I1134-M1138 VanDerWaalsContact O-CB 3.28Å; I1134-M1138 WeakPolarHBondContact O-CB 3.18Å; I1134-M1138 PolarHBondContact O-N 3.32Å; L1135-M1138 HydrophobicContact CD2-CE 3.75Å; L1135-M1138 PolarHBondContact O-N 2.82Å; E1136-M1138 VanDerWaalsContact C-N 3.29Å; E1136-M1138 PolarHBondContact O-N 3.26Å; M1138-F1146 HydrophobicContact CG-CD1 4.07Å; M1138-F1146 HydrophobicContact CG-CD2 4.31Å; M1138-F1146 HydrophobicContact CG-CE1 3.73Å; M1138-F1146 HydrophobicContact CG-CE2 3.99Å; M1138-F1146 HydrophobicContact CG-CG 4.34Å; M1138-F1146 HydrophobicContact CG-CZ 3.69Å; M1138-F1146 HydrophobicContact SD-CD1 4.27Å; M1138-F1146 HydrophobicContact SD-CD2 4.15Å; M1138-F1146 HydrophobicContact SD-CE2 4.39Å; M1138-F1146 HydrophobicContact SD-CG 4.09Å; M1138-L1160 HydrophobicContact CB-CD2 4.03Å; M1138-L1160 HydrophobicContact CG-CD2 4.25Å; M1138-L1160 HydrophobicContact SD-CD2 3.89Å
1139	E	88.3	Confident	89	Confident	116 Å²	116	57 Å²	57	54%	0.542	29%	0.292	S	S	.	.	H	α-helix	trans	-83.2	-36.4	172.7	-151.6	54.1	-118.5	0	0	111.7	K1110 Q1114 L1135 E1136 E1137 S1141	K1110-E1139 WeakPolarHBondContact CE-OE1 3.29Å; K1110-E1139 WeakPolarHBondContact CE-OE2 3.45Å; K1110-E1139 VanDerWaalsContact NZ-CD 3.26Å; K1110-E1139 IonicContact NZ-OE1 3.48Å; K1110-E1139 PolarHBondContact NZ-OE1 3.37Å; K1110-E1139 IonicContact NZ-OE2 3.53Å; K1110-E1139 PolarHBondContact NZ-OE2 3.27Å; Q1114-E1139 PolarHBondContact NE2-OE2 2.92Å; L1135-E1139 PolarHBondContact O-N 2.99Å; E1136-E1139 PolarHBondContact O-N 3.03Å; E1137-E1139 VanDerWaalsContact C-N 3.33Å; E1139-S1141 PolarHBondContact O-N 3Å
1140	K	88.9	Confident	89.3	Confident	126 Å²	126	54.3 Å²	54.3	55%	0.548	26%	0.264	S	S	.	.	H	α-helix	trans	-63.9	-20.4	168.6	-66.2	171.3	-170	164.5	0	113.8	E1136 E1137	E1136-K1140 WeakPolarHBondContact O-CG 3.3Å; E1136-K1140 PolarHBondContact O-N 3.33Å; E1136-K1140 WeakPolarHBondContact OE1-CE 3.44Å; E1136-K1140 IonicContact OE1-NZ 2.69Å; E1136-K1140 PolarHBondContact OE1-NZ 2.87Å; E1137-K1140 WeakPolarHBondContact OE1-CD 3.32Å; E1137-K1140 IonicContact OE1-NZ 3.3Å; E1137-K1140 PolarHBondContact OE1-NZ 2.87Å
1141	S	86.6	Confident	89.3	Confident	21 Å²	21	55.1 Å²	55.1	15%	0.147	26%	0.263	C	S	.	.			trans	-92.6	121	-177.3	-168.1	0	0	0	0	112.1	E1137 E1139 A1143	E1137-S1141 WeakPolarHBondContact O-CB 3.38Å; E1137-S1141 PolarHBondContact O-N 2.66Å; E1139-S1141 PolarHBondContact O-N 3Å; S1141-A1143 PolarHBondContact O-N 2.85Å
1142	E	83.8	Confident	89	Confident	167 Å²	167	55.7 Å²	55.7	78%	0.78	27%	0.268	S	S	*	.			trans	-74.5	3.9	175.8	-56.1	-160.9	163.1	0	0	114.4	N1144	E1142-N1144 PolarHBondContact O-N 2.9Å
1143	A	84	Confident	88.5	Confident	27 Å²	27	56.3 Å²	56.3	22%	0.223	28%	0.278	C	S	.	.			trans	-63.5	137	-178.4	0	0	0	0	0	111.8	S1141 F1146 T1162	S1141-A1143 PolarHBondContact O-N 2.85Å; A1143-F1146 HydrophobicContact CB-CD1 4.48Å; A1143-F1146 HydrophobicContact CB-CE1 3.84Å; A1143-F1146 HydrophobicContact CB-CE2 4.42Å; A1143-F1146 HydrophobicContact CB-CZ 3.81Å; A1143-F1146 WeakPolarHBondContact O-CE2 3.35Å; A1143-F1146 WeakPolarHBondContact O-CZ 3.48Å; A1143-T1162 HydrophobicContact CB-CG2 3.41Å; A1143-T1162 VanDerWaalsContact CB-CG2 3.41Å
1144	N	85.1	Confident	87.9	Confident	94 Å²	94	52.4 Å²	52.4	50%	0.503	28%	0.278	S	S	.	.	S	Bend	trans	-84.7	-27.7	179.6	-80.1	-86.6	0	0	0	112.9	S1108 N1109 E1142	S1108-N1144 WeakPolarHBondContact CA-O 3.4Å; S1108-N1144 VanDerWaalsContact CB-O 3.23Å; S1108-N1144 WeakPolarHBondContact CB-O 3.25Å; S1108-N1144 PolarHBondContact OG-O 2.89Å; N1109-N1144 PolarHBondContact N-O 3.04Å; E1142-N1144 PolarHBondContact O-N 2.9Å
1145	N	89	Confident	87.4	Confident	20 Å²	20	54 Å²	54	11%	0.107	29%	0.288	C	S	.	.			trans	-123.7	131.3	178.7	-52.6	-81.3	0	0	0	110.5	N1109 Y1163	N1109-N1145 WeakPolarHBondContact OD1-CA 3.27Å; N1145-Y1163 HydrophobicContact CB-CD1 4.27Å; N1145-Y1163 PolarHBondContact O-N 3.34Å
1146	F	92.3	Very high	87.2	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	143.9	177.2	-57.8	-91.6	0	0	0	110.3	N1109 K1110 I1113 M1138 A1143 L1160 Y1161 T1162 L1173	N1109-F1146 PolarHBondContact ND2-O 2.9Å; N1109-F1146 PolarHBondContact OD1-N 2.84Å; N1109-F1146 PolarHBondContact OD1-O 2.86Å; K1110-F1146 HydrophobicContact CB-CD2 4.14Å; K1110-F1146 HydrophobicContact CB-CE2 3.83Å; K1110-F1146 HydrophobicContact CD-CE2 3.98Å; K1110-F1146 HydrophobicContact CD-CZ 4.49Å; K1110-F1146 HydrophobicContact CG-CD2 4.37Å; K1110-F1146 HydrophobicContact CG-CE2 3.79Å; I1113-F1146 HydrophobicContact CG1-CB 4.1Å; I1113-F1146 HydrophobicContact CG2-CB 4.44Å; M1138-F1146 HydrophobicContact CG-CD1 4.07Å; M1138-F1146 HydrophobicContact CG-CD2 4.31Å; M1138-F1146 HydrophobicContact CG-CE1 3.73Å; M1138-F1146 HydrophobicContact CG-CE2 3.99Å; M1138-F1146 HydrophobicContact CG-CG 4.34Å; M1138-F1146 HydrophobicContact CG-CZ 3.69Å; M1138-F1146 HydrophobicContact SD-CD1 4.27Å; M1138-F1146 HydrophobicContact SD-CD2 4.15Å; M1138-F1146 HydrophobicContact SD-CE2 4.39Å; M1138-F1146 HydrophobicContact SD-CG 4.09Å; A1143-F1146 HydrophobicContact CB-CD1 4.48Å; A1143-F1146 HydrophobicContact CB-CE1 3.84Å; A1143-F1146 HydrophobicContact CB-CE2 4.42Å; A1143-F1146 HydrophobicContact CB-CZ 3.81Å; A1143-F1146 WeakPolarHBondContact O-CE2 3.35Å; A1143-F1146 WeakPolarHBondContact O-CZ 3.48Å; F1146-L1160 HydrophobicContact CB-CD1 4.1Å; F1146-Y1161 CarbonylContact C-O 3.51Å; F1146-Y1161 VanDerWaalsContact CA-O 3.26Å; F1146-Y1161 WeakPolarHBondContact CA-O 3.4Å; F1146-T1162 HydrophobicContact CD1-CG2 3.93Å; F1146-T1162 HydrophobicContact CE1-CG2 3.83Å; F1146-L1173 HydrophobicContact CD1-CD2 4.21Å; F1146-L1173 HydrophobicContact CE1-CD2 3.87Å
1147	L	92.2	Very high	87.3	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	131.9	177.2	-84.7	60	0	0	0	109.7	Y1161 Y1163 I1170 M1207 V1211 D1212 V1214	L1147-Y1161 PolarHBondContact N-O 2.98Å; L1147-Y1161 PolarHBondContact O-N 2.9Å; L1147-Y1163 HydrophobicContact CD1-CD1 4.25Å; L1147-Y1163 HydrophobicContact CD1-CG 4.12Å; L1147-I1170 HydrophobicContact CD2-CD1 4.39Å; L1147-I1170 HydrophobicContact CD2-CG2 4.37Å; L1147-M1207 HydrophobicContact CD2-CE 4.07Å; L1147-V1211 HydrophobicContact CD2-CG1 4.49Å; L1147-D1212 WeakPolarHBondContact CA-O 3.46Å; L1147-V1214 HydrophobicContact CD2-CG1 4.12Å; L1147-V1214 HydrophobicContact CD2-CG2 4.46Å
1148	V	93.5	Very high	87.3	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	130.5	168.1	174.6	0	0	0	0	109.9	I1113 L1117 F1150 F1157 L1160 D1212 A1213 V1214	I1113-V1148 HydrophobicContact CG2-CG2 4.12Å; L1117-V1148 HydrophobicContact CD2-CG2 4.25Å; V1148-F1150 HydrophobicContact CB-CE1 4.43Å; V1148-F1150 HydrophobicContact CG1-CD1 3.77Å; V1148-F1150 HydrophobicContact CG1-CE1 3.5Å; V1148-F1150 VanDerWaalsContact CG1-CE1 3.5Å; V1148-F1150 HydrophobicContact CG1-CZ 4.16Å; V1148-F1157 HydrophobicContact CG1-CD2 3.53Å; V1148-F1157 HydrophobicContact CG1-CE2 3.88Å; V1148-F1157 HydrophobicContact CG2-CE2 4.33Å; V1148-L1160 HydrophobicContact CG2-CD1 4.17Å; V1148-D1212 PolarHBondContact N-O 2.92Å; V1148-A1213 HydrophobicContact CB-CB 3.93Å; V1148-A1213 CarbonylContact O-C 3.59Å; V1148-A1213 WeakPolarHBondContact O-CA 3.34Å; V1148-A1213 VanDerWaalsContact O-CB 3.31Å; V1148-A1213 WeakPolarHBondContact O-CB 3.48Å; V1148-V1214 PolarHBondContact O-N 3.22Å
1149	L	93	Very high	87.4	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	120.9	165.5	179.2	62.7	0	0	0	109.9	R1158 S1159 Y1161 I1181 V1214 I1216 W1221	L1149-R1158 PolarHBondContact O-N 2.82Å; L1149-S1159 WeakPolarHBondContact CD2-OG 3.39Å; L1149-S1159 PolarHBondContact N-O 3.29Å; L1149-Y1161 HydrophobicContact CB-CD2 3.9Å; L1149-Y1161 HydrophobicContact CB-CE2 3.48Å; L1149-Y1161 VanDerWaalsContact CB-CE2 3.48Å; L1149-Y1161 HydrophobicContact CD2-CE2 3.72Å; L1149-Y1161 HydrophobicContact CG-CE2 4.21Å; L1149-I1181 HydrophobicContact CD1-CD1 4.22Å; L1149-I1181 HydrophobicContact CD2-CD1 4.17Å; L1149-V1214 HydrophobicContact CD1-CG2 4.15Å; L1149-I1216 HydrophobicContact CD1-CB 4.41Å; L1149-I1216 HydrophobicContact CD1-CD1 4.46Å; L1149-I1216 HydrophobicContact CD1-CG1 4.13Å; L1149-I1216 HydrophobicContact CD1-CG2 3.79Å; L1149-I1216 HydrophobicContact CD2-CD1 4.17Å; L1149-W1221 HydrophobicContact CD1-CZ2 4.39Å; L1149-W1221 HydrophobicContact CD2-CH2 3.54Å; L1149-W1221 HydrophobicContact CD2-CZ2 3.91Å; L1149-W1221 HydrophobicContact CG-CH2 4.1Å; L1149-W1221 HydrophobicContact CG-CZ2 4.11Å
1150	F	92.7	Very high	87.7	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	149.4	167.8	-61.6	-44.1	0	0	0	111.7	V1148 C1155 Q1156 Y1190 F1199 A1213 V1214 T1215	V1148-F1150 HydrophobicContact CB-CE1 4.43Å; V1148-F1150 HydrophobicContact CG1-CD1 3.77Å; V1148-F1150 HydrophobicContact CG1-CE1 3.5Å; V1148-F1150 VanDerWaalsContact CG1-CE1 3.5Å; V1148-F1150 HydrophobicContact CG1-CZ 4.16Å; F1150-C1155 HydrophobicContact CD1-CB 4.35Å; F1150-C1155 VanDerWaalsContact CD1-O 3.27Å; F1150-C1155 WeakPolarHBondContact CD1-O 3.15Å; F1150-C1155 HydrophobicContact CD2-CB 4.27Å; F1150-C1155 HydrophobicContact CE1-CB 4.08Å; F1150-C1155 WeakPolarHBondContact CE1-O 3.4Å; F1150-C1155 HydrophobicContact CE2-CB 3.98Å; F1150-C1155 HydrophobicContact CG-CB 4.45Å; F1150-C1155 HydrophobicContact CZ-CB 3.89Å; F1150-Q1156 VanDerWaalsContact CA-O 3.28Å; F1150-Q1156 WeakPolarHBondContact CA-O 3.39Å; F1150-Y1190 HydrophobicContact CD2-CD2 4.32Å; F1150-Y1190 HydrophobicContact CE2-CG 4.43Å; F1150-F1199 HydrophobicContact CE1-CE2 4.49Å; F1150-F1199 HydrophobicContact CE2-CB 4.41Å; F1150-F1199 AromaticContact CE2-CD1 3.94Å; F1150-F1199 HydrophobicContact CE2-CD1 3.94Å; F1150-F1199 HydrophobicContact CE2-CD2 4.3Å; F1150-F1199 HydrophobicContact CE2-CE1 4.27Å; F1150-F1199 AromaticContact CE2-CG 3.94Å; F1150-F1199 HydrophobicContact CE2-CG 3.94Å; F1150-F1199 AromaticContact CZ-CD1 3.88Å; F1150-F1199 HydrophobicContact CZ-CD1 3.88Å; F1150-F1199 AromaticContact CZ-CD2 3.68Å; F1150-F1199 HydrophobicContact CZ-CD2 3.68Å; F1150-F1199 AromaticContact CZ-CE1 3.87Å; F1150-F1199 HydrophobicContact CZ-CE1 3.87Å; F1150-F1199 AromaticContact CZ-CE2 3.7Å; F1150-F1199 HydrophobicContact CZ-CE2 3.7Å; F1150-F1199 AromaticContact CZ-CG 3.78Å; F1150-F1199 HydrophobicContact CZ-CG 3.78Å; F1150-F1199 AromaticContact CZ-CZ 3.76Å; F1150-F1199 HydrophobicContact CZ-CZ 3.76Å; F1150-A1213 HydrophobicContact CD2-CB 3.94Å; F1150-A1213 HydrophobicContact CE2-CB 3.36Å; F1150-A1213 HydrophobicContact CZ-CB 3.74Å; F1150-V1214 PolarHBondContact N-O 3.27Å; F1150-T1215 HydrophobicContact CB-CG2 3.86Å
1151	R	86.4	Confident	87.9	Confident	111 Å²	111	41.9 Å²	41.9	42%	0.419	23%	0.229	S	C	.	.	S	Bend	trans	-63.9	-58.1	172.1	-169.3	-172	158.1	116.1	2.1	111.2	Q1156 R1158 W1221	R1151-Q1156 HydrophobicContact CB-CB 4.34Å; R1151-Q1156 PolarHBondContact N-O 3.39Å; R1151-R1158 HydrophobicContact CB-CG 3.66Å; R1151-R1158 HydrophobicContact CG-CG 4.36Å; R1151-W1221 PolarHBondContact O-NE1 2.89Å
1152	D	84	Confident	88.2	Confident	56 Å²	56	42.4 Å²	42.4	30%	0.299	23%	0.231	S	C	.	.	S	Bend	trans	-137.6	174.4	-171.4	-51	-68.8	0	0	0	108.5	G1154 C1155	D1152-G1154 PolarHBondContact O-N 3.03Å; D1152-C1155 PolarHBondContact O-N 2.89Å
1153	S	78.3	Confident	88.4	Confident	94 Å²	94	35.2 Å²	35.2	66%	0.657	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-20.7	178.1	55.4	0	0	0	0	114.7	C1155	S1153-C1155 PolarHBondContact O-N 2.85Å; S1153-C1155 PolarHBondContact O-SG 2.99Å
1154	G	79.1	Confident	88.4	Confident	57 Å²	57	36 Å²	36	59%	0.588	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69	17	172.9	0	0	0	0	0	115.8	D1152 Q1156	D1152-G1154 PolarHBondContact O-N 3.03Å; G1154-Q1156 PolarHBondContact O-N 3.49Å
1155	C	81	Confident	88	Confident	36 Å²	36	33.4 Å²	33.4	24%	0.243	19%	0.189	C	C	.	.			trans	55.3	26.1	171.3	-60.9	0	0	0	0	115.7	F1150 D1152 S1153 F1157	F1150-C1155 HydrophobicContact CD1-CB 4.35Å; F1150-C1155 VanDerWaalsContact CD1-O 3.27Å; F1150-C1155 WeakPolarHBondContact CD1-O 3.15Å; F1150-C1155 HydrophobicContact CD2-CB 4.27Å; F1150-C1155 HydrophobicContact CE1-CB 4.08Å; F1150-C1155 WeakPolarHBondContact CE1-O 3.4Å; F1150-C1155 HydrophobicContact CE2-CB 3.98Å; F1150-C1155 HydrophobicContact CG-CB 4.45Å; F1150-C1155 HydrophobicContact CZ-CB 3.89Å; D1152-C1155 PolarHBondContact O-N 2.89Å; S1153-C1155 PolarHBondContact O-N 2.85Å; S1153-C1155 PolarHBondContact O-SG 2.99Å; C1155-F1157 PolarHBondContact O-N 2.88Å
1156	Q	85.4	Confident	87.2	Confident	98 Å²	98	38.6 Å²	38.6	46%	0.458	21%	0.213	S	C	.	.			trans	-73.6	118.7	176.8	-67	-173.3	11.9	0	0	111.4	F1150 R1151 G1154	F1150-Q1156 VanDerWaalsContact CA-O 3.28Å; F1150-Q1156 WeakPolarHBondContact CA-O 3.39Å; R1151-Q1156 HydrophobicContact CB-CB 4.34Å; R1151-Q1156 PolarHBondContact N-O 3.39Å; G1154-Q1156 PolarHBondContact O-N 3.49Å
1157	F	90.8	Very high	86.4	Confident	20 Å²	20	42.4 Å²	42.4	9%	0.088	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.3	137.8	176.8	-174.1	-90.4	0	0	0	113	L1117 C1121 L1122 I1134 V1148 C1155 L1160	L1117-F1157 HydrophobicContact CD2-CD2 3.74Å; L1117-F1157 HydrophobicContact CD2-CE2 3.55Å; L1117-F1157 HydrophobicContact CD2-CZ 4.43Å; C1121-F1157 HydrophobicContact CB-CB 4.13Å; C1121-F1157 HydrophobicContact CB-CD2 4.18Å; L1122-F1157 HydrophobicContact CD1-CD1 4.27Å; L1122-F1157 HydrophobicContact CD1-CE1 4.38Å; L1122-F1157 HydrophobicContact CD1-CG 4.43Å; L1122-F1157 HydrophobicContact CD2-CB 4.16Å; L1122-F1157 HydrophobicContact CD2-CD1 3.97Å; L1122-F1157 HydrophobicContact CD2-CG 4.11Å; L1122-F1157 HydrophobicContact CG-CB 4.49Å; L1122-F1157 HydrophobicContact CG-CD1 4.37Å; L1122-F1157 HydrophobicContact CG-CG 4.23Å; I1134-F1157 HydrophobicContact CD1-CD1 4.46Å; I1134-F1157 HydrophobicContact CD1-CE1 3.51Å; I1134-F1157 HydrophobicContact CD1-CZ 3.67Å; V1148-F1157 HydrophobicContact CG1-CD2 3.53Å; V1148-F1157 HydrophobicContact CG1-CE2 3.88Å; V1148-F1157 HydrophobicContact CG2-CE2 4.33Å; C1155-F1157 PolarHBondContact O-N 2.88Å; F1157-L1160 HydrophobicContact CZ-CB 4.3Å
1158	R	90	Very high	85.6	Confident	77 Å²	77	45.5 Å²	45.5	29%	0.291	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	-41.4	170.6	-69.3	-69.9	155.6	-178.8	-5.3	113.9	L1149 R1151 I1176 W1221	L1149-R1158 PolarHBondContact O-N 2.82Å; R1151-R1158 HydrophobicContact CB-CG 3.66Å; R1151-R1158 HydrophobicContact CG-CG 4.36Å; R1158-I1176 PolarHBondContact O-N 3.4Å; R1158-W1221 HydrophobicContact CB-CH2 3.99Å; R1158-W1221 HydrophobicContact CG-CH2 4.05Å; R1158-W1221 HydrophobicContact CG-CZ2 4.5Å
1159	S	91.8	Very high	85.1	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	162.9	-179.8	25.5	0	0	0	0	111.9	L1149 Y1161 T1174 I1176	L1149-S1159 WeakPolarHBondContact CD2-OG 3.39Å; L1149-S1159 PolarHBondContact N-O 3.29Å; S1159-Y1161 VanDerWaalsContact OG-CE2 3.31Å; S1159-Y1161 WeakPolarHBondContact OG-CE2 3.45Å; S1159-T1174 CarbonylContact C-O 3.09Å; S1159-T1174 WeakPolarHBondContact CA-O 3.37Å; S1159-T1174 WeakPolarHBondContact CB-O 3.41Å; S1159-I1176 WeakPolarHBondContact CB-O 3.4Å; S1159-I1176 PolarHBondContact OG-O 2.91Å
1160	L	93.3	Very high	85	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	135.5	174.4	-176.1	66.2	0	0	0	108.8	I1113 I1134 M1138 F1146 V1148 F1157 L1173 T1174	I1113-L1160 HydrophobicContact CG2-CD1 3.85Å; I1134-L1160 HydrophobicContact CG2-CB 4.44Å; I1134-L1160 HydrophobicContact CG2-CD2 3.76Å; M1138-L1160 HydrophobicContact CB-CD2 4.03Å; M1138-L1160 HydrophobicContact CG-CD2 4.25Å; M1138-L1160 HydrophobicContact SD-CD2 3.89Å; F1146-L1160 HydrophobicContact CB-CD1 4.1Å; V1148-L1160 HydrophobicContact CG2-CD1 4.17Å; F1157-L1160 HydrophobicContact CZ-CB 4.3Å; L1160-L1173 HydrophobicContact CD2-CD2 4.07Å; L1160-L1173 WeakPolarHBondContact O-CB 3.43Å; L1160-L1173 PolarHBondContact O-N 3.47Å; L1160-T1174 HydrophobicContact CB-CG2 3.85Å; L1160-T1174 HydrophobicContact CD2-CG2 4.36Å; L1160-T1174 PolarHBondContact N-O 2.98Å; L1160-T1174 PolarHBondContact O-N 3.28Å; L1160-T1174 VanDerWaalsContact O-N 3.16Å
1161	Y	93.3	Very high	84.9	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	150.9	179.9	-68.3	-106.5	0	0	0	110.2	F1146 L1147 L1149 S1159 I1170 N1171 K1172 P1178 I1181	F1146-Y1161 CarbonylContact C-O 3.51Å; F1146-Y1161 VanDerWaalsContact CA-O 3.26Å; F1146-Y1161 WeakPolarHBondContact CA-O 3.4Å; L1147-Y1161 PolarHBondContact N-O 2.98Å; L1147-Y1161 PolarHBondContact O-N 2.9Å; L1149-Y1161 HydrophobicContact CB-CD2 3.9Å; L1149-Y1161 HydrophobicContact CB-CE2 3.48Å; L1149-Y1161 VanDerWaalsContact CB-CE2 3.48Å; L1149-Y1161 HydrophobicContact CD2-CE2 3.72Å; L1149-Y1161 HydrophobicContact CG-CE2 4.21Å; S1159-Y1161 VanDerWaalsContact OG-CE2 3.31Å; S1159-Y1161 WeakPolarHBondContact OG-CE2 3.45Å; Y1161-I1170 HydrophobicContact CD1-CG2 3.83Å; Y1161-I1170 HydrophobicContact CG-CG2 3.93Å; Y1161-N1171 CarbonylContact C-O 3.59Å; Y1161-N1171 VanDerWaalsContact CA-O 3.25Å; Y1161-N1171 WeakPolarHBondContact CA-O 3.45Å; Y1161-N1171 WeakPolarHBondContact CB-O 3.24Å; Y1161-N1171 VanDerWaalsContact CD1-C 3.49Å; Y1161-K1172 VanDerWaalsContact CD1-CA 3.42Å; Y1161-K1172 HydrophobicContact CD1-CB 3.81Å; Y1161-K1172 HydrophobicContact CD1-CG 4.27Å; Y1161-K1172 HydrophobicContact CE1-CB 3.43Å; Y1161-K1172 VanDerWaalsContact CE1-CB 3.43Å; Y1161-K1172 HydrophobicContact CE1-CD 4.39Å; Y1161-K1172 HydrophobicContact CE1-CG 3.8Å; Y1161-K1172 HydrophobicContact CE2-CG 4.12Å; Y1161-P1178 WeakPolarHBondContact OH-CD 3.31Å; Y1161-P1178 PolarHBondContact OH-O 3.27Å; Y1161-P1178 VanDerWaalsContact OH-O 3.05Å; Y1161-I1181 HydrophobicContact CD1-CD1 3.97Å; Y1161-I1181 HydrophobicContact CD1-CG1 4.27Å; Y1161-I1181 HydrophobicContact CD2-CD1 4.27Å; Y1161-I1181 HydrophobicContact CE1-CD1 3.53Å; Y1161-I1181 HydrophobicContact CE1-CG1 3.7Å; Y1161-I1181 HydrophobicContact CE2-CD1 3.87Å; Y1161-I1181 HydrophobicContact CG-CD1 4.35Å
1162	T	92.6	Very high	85.2	Confident	32 Å²	32	51.2 Å²	51.2	20%	0.196	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	147.3	164.9	55.6	0	0	0	0	109.5	A1143 F1146 I1170 N1171 L1173	A1143-T1162 HydrophobicContact CB-CG2 3.41Å; A1143-T1162 VanDerWaalsContact CB-CG2 3.41Å; F1146-T1162 HydrophobicContact CD1-CG2 3.93Å; F1146-T1162 HydrophobicContact CE1-CG2 3.83Å; T1162-I1170 CarbonylContact O-C 3.52Å; T1162-I1170 WeakPolarHBondContact O-CA 3.44Å; T1162-N1171 PolarHBondContact N-O 3.47Å; T1162-N1171 PolarHBondContact O-N 3.05Å; T1162-N1171 PolarHBondContact OG1-O 2.61Å; T1162-L1173 HydrophobicContact CG2-CB 4.35Å; T1162-L1173 HydrophobicContact CG2-CD2 4.32Å
1163	Y	88.8	Confident	85.5	Confident	16 Å²	16	50.9 Å²	50.9	6%	0.063	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	125.2	177	172.9	-119.5	0	0	0	111	N1145 L1147 P1165 E1169 I1170	N1145-Y1163 HydrophobicContact CB-CD1 4.27Å; N1145-Y1163 PolarHBondContact O-N 3.34Å; L1147-Y1163 HydrophobicContact CD1-CD1 4.25Å; L1147-Y1163 HydrophobicContact CD1-CG 4.12Å; Y1163-P1165 HydrophobicContact CE1-CB 3.87Å; Y1163-P1165 WeakPolarHBondContact O-CD 3.46Å; Y1163-E1169 WeakPolarHBondContact CA-O 3.42Å; Y1163-E1169 WeakPolarHBondContact CD2-O 3.44Å; Y1163-I1170 HydrophobicContact CD2-CG1 3.66Å; Y1163-I1170 HydrophobicContact CE2-CG1 4.25Å
1164	C	83.4	Confident	86	Confident	43 Å²	43	47.8 Å²	47.8	29%	0.291	26%	0.257	S	S	.	.			trans	-100.4	108	171.2	175.1	0	0	0	0	108.6	E1166 T1167 Q1168 E1169	C1164-E1166 PolarHBondContact O-N 2.81Å; C1164-E1166 PolarHBondContact SG-OE2 3.42Å; C1164-T1167 WeakPolarHBondContact CB-OG1 3.31Å; C1164-T1167 PolarHBondContact O-N 3.1Å; C1164-T1167 PolarHBondContact SG-N 3.01Å; C1164-T1167 PolarHBondContact SG-OG1 3.43Å; C1164-Q1168 WeakPolarHBondContact O-CA 3.31Å; C1164-Q1168 PolarHBondContact O-N 3.22Å; C1164-E1169 PolarHBondContact N-O 3.44Å
1165	P	77.8	Confident	86.4	Confident	40 Å²	40	46.5 Å²	46.5	26%	0.26	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-19.1	180	24.5	-31.7	0	0	0	113.6	Y1163	Y1163-P1165 HydrophobicContact CE1-CB 3.87Å; Y1163-P1165 WeakPolarHBondContact O-CD 3.46Å
1166	E	72.6	Confident	86.7	Confident	130 Å²	130	50.5 Å²	50.5	61%	0.607	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-52.4	176.2	-59.7	69.1	-153.4	0	0	111.7	C1164	C1164-E1166 PolarHBondContact O-N 2.81Å; C1164-E1166 PolarHBondContact SG-OE2 3.42Å
1167	T	74.3	Confident	86.8	Confident	79 Å²	79	46.9 Å²	46.9	49%	0.485	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-21.2	178.2	64.4	0	0	0	0	113.1	C1164 E1169	C1164-T1167 WeakPolarHBondContact CB-OG1 3.31Å; C1164-T1167 PolarHBondContact O-N 3.1Å; C1164-T1167 PolarHBondContact SG-N 3.01Å; C1164-T1167 PolarHBondContact SG-OG1 3.43Å; T1167-E1169 PolarHBondContact O-N 3.41Å; T1167-E1169 WeakPolarHBondContact OG1-CB 3.16Å; T1167-E1169 PolarHBondContact OG1-N 2.86Å
1168	Q	76.7	Confident	86.7	Confident	66 Å²	66	48 Å²	48	31%	0.308	26%	0.26	S	S	.	.			trans	61.9	22	-168.2	-66	155.5	95.9	0	0	114.5	C1164	C1164-Q1168 WeakPolarHBondContact O-CA 3.31Å; C1164-Q1168 PolarHBondContact O-N 3.22Å
1169	E	83	Confident	86.5	Confident	100 Å²	100	53.4 Å²	53.4	47%	0.467	29%	0.286	S	S	.	.			trans	-79.7	142.5	172.1	-67.7	179.2	-158.6	0	0	112.1	Y1163 C1164 T1167 N1171	Y1163-E1169 WeakPolarHBondContact CA-O 3.42Å; Y1163-E1169 WeakPolarHBondContact CD2-O 3.44Å; C1164-E1169 PolarHBondContact N-O 3.44Å; T1167-E1169 PolarHBondContact O-N 3.41Å; T1167-E1169 WeakPolarHBondContact OG1-CB 3.16Å; T1167-E1169 PolarHBondContact OG1-N 2.86Å; E1169-N1171 PolarHBondContact OE2-ND2 3.01Å
1170	I	89.9	Confident	86.3	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.01	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	94.3	177.5	-55.6	165.2	0	0	0	107.3	L1147 Y1161 T1162 Y1163 S1180 I1181 I1186 M1207	L1147-I1170 HydrophobicContact CD2-CD1 4.39Å; L1147-I1170 HydrophobicContact CD2-CG2 4.37Å; Y1161-I1170 HydrophobicContact CD1-CG2 3.83Å; Y1161-I1170 HydrophobicContact CG-CG2 3.93Å; T1162-I1170 CarbonylContact O-C 3.52Å; T1162-I1170 WeakPolarHBondContact O-CA 3.44Å; Y1163-I1170 HydrophobicContact CD2-CG1 3.66Å; Y1163-I1170 HydrophobicContact CE2-CG1 4.25Å; I1170-S1180 CarbonylContact O-C 3.45Å; I1170-S1180 VanDerWaalsContact O-CA 3.28Å; I1170-S1180 WeakPolarHBondContact O-CA 3.29Å; I1170-S1180 PolarHBondContact O-OG 2.73Å; I1170-I1181 HydrophobicContact CB-CB 4.13Å; I1170-I1181 HydrophobicContact CD1-CG2 4.4Å; I1170-I1181 HydrophobicContact CG2-CB 4.12Å; I1170-I1181 PolarHBondContact O-N 3.05Å; I1170-I1186 HydrophobicContact CD1-CD1 3.81Å; I1170-M1207 HydrophobicContact CD1-SD 3.67Å
1171	N	90.9	Very high	86.1	Confident	57 Å²	57	55.9 Å²	55.9	31%	0.305	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	138.9	-169.3	-67.3	-29.8	0	0	0	110.7	Y1161 T1162 E1169 L1173 S1180	Y1161-N1171 CarbonylContact C-O 3.59Å; Y1161-N1171 VanDerWaalsContact CA-O 3.25Å; Y1161-N1171 WeakPolarHBondContact CA-O 3.45Å; Y1161-N1171 WeakPolarHBondContact CB-O 3.24Å; Y1161-N1171 VanDerWaalsContact CD1-C 3.49Å; T1162-N1171 PolarHBondContact N-O 3.47Å; T1162-N1171 PolarHBondContact O-N 3.05Å; T1162-N1171 PolarHBondContact OG1-O 2.61Å; E1169-N1171 PolarHBondContact OE2-ND2 3.01Å; N1171-L1173 PolarHBondContact O-N 2.97Å; N1171-S1180 VanDerWaalsContact OD1-CB 3.31Å; N1171-S1180 WeakPolarHBondContact OD1-CB 3.44Å; N1171-S1180 PolarHBondContact OD1-OG 3.48Å
1172	K	93.3	Very high	85.8	Confident	73 Å²	73	59.5 Å²	59.5	32%	0.317	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	124	-171.1	-165.8	178.5	65.2	169.5	0	111.4	Y1161 G1175 G1177 K1179	Y1161-K1172 VanDerWaalsContact CD1-CA 3.42Å; Y1161-K1172 HydrophobicContact CD1-CB 3.81Å; Y1161-K1172 HydrophobicContact CD1-CG 4.27Å; Y1161-K1172 HydrophobicContact CE1-CB 3.43Å; Y1161-K1172 VanDerWaalsContact CE1-CB 3.43Å; Y1161-K1172 HydrophobicContact CE1-CD 4.39Å; Y1161-K1172 HydrophobicContact CE1-CG 3.8Å; Y1161-K1172 HydrophobicContact CE2-CG 4.12Å; K1172-G1175 WeakPolarHBondContact CD-O 3.44Å; K1172-G1175 WeakPolarHBondContact CE-O 3.49Å; K1172-G1175 PolarHBondContact NZ-O 2.98Å; K1172-G1177 PolarHBondContact NZ-O 3.34Å; K1172-K1179 WeakPolarHBondContact CB-O 3.49Å; K1172-K1179 PolarHBondContact N-O 3Å
1173	L	89.2	Confident	85.3	Confident	49 Å²	49	63.2 Å²	63.2	26%	0.257	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	-52.3	173.2	-176.8	59.7	0	0	0	111.1	F1146 L1160 T1162 N1171	F1146-L1173 HydrophobicContact CD1-CD2 4.21Å; F1146-L1173 HydrophobicContact CE1-CD2 3.87Å; L1160-L1173 HydrophobicContact CD2-CD2 4.07Å; L1160-L1173 WeakPolarHBondContact O-CB 3.43Å; L1160-L1173 PolarHBondContact O-N 3.47Å; T1162-L1173 HydrophobicContact CG2-CB 4.35Å; T1162-L1173 HydrophobicContact CG2-CD2 4.32Å; N1171-L1173 PolarHBondContact O-N 2.97Å
1174	T	88.9	Confident	85.1	Confident	28 Å²	28	71.7 Å²	71.7	17%	0.172	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	155	-175.9	-179.4	0	0	0	0	113	I1134 S1159 L1160	I1134-T1174 HydrophobicContact CB-CG2 4.35Å; I1134-T1174 HydrophobicContact CG1-CG2 3.91Å; I1134-T1174 HydrophobicContact CG2-CG2 4.01Å; S1159-T1174 CarbonylContact C-O 3.09Å; S1159-T1174 WeakPolarHBondContact CA-O 3.37Å; S1159-T1174 WeakPolarHBondContact CB-O 3.41Å; L1160-T1174 HydrophobicContact CB-CG2 3.85Å; L1160-T1174 HydrophobicContact CD2-CG2 4.36Å; L1160-T1174 PolarHBondContact N-O 2.98Å; L1160-T1174 PolarHBondContact O-N 3.28Å; L1160-T1174 VanDerWaalsContact O-N 3.16Å
1175	G	88.1	Confident	85.2	Confident	30 Å²	30	71.3 Å²	71.3	31%	0.309	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	91.8	-167.5	178.1	0	0	0	0	0	116.1	K1172	K1172-G1175 WeakPolarHBondContact CD-O 3.44Å; K1172-G1175 WeakPolarHBondContact CE-O 3.49Å; K1172-G1175 PolarHBondContact NZ-O 2.98Å
1176	I	86.3	Confident	85.8	Confident	120 Å²	120	70.5 Å²	70.5	62%	0.615	36%	0.36	S	S	*	.	S	Bend	trans	-95.4	124.7	-170.3	-56.9	174.6	0	0	0	109.9	R1158 S1159	R1158-I1176 PolarHBondContact O-N 3.4Å; S1159-I1176 WeakPolarHBondContact CB-O 3.4Å; S1159-I1176 PolarHBondContact OG-O 2.91Å
1177	G	87.9	Confident	86.5	Confident	22 Å²	22	69 Å²	69	23%	0.227	36%	0.357	C	S	.	.	S	Bend	trans	156.4	171.1	-175.3	0	0	0	0	0	112.4	K1172	K1172-G1177 PolarHBondContact NZ-O 3.34Å
1178	P	88.1	Confident	87.1	Confident	44 Å²	44	65.4 Å²	65.4	29%	0.286	34%	0.335	S	S	.	.			trans	-60.1	158.5	178	27.3	-36.5	0	0	0	112.5	Y1161 S1180 I1181 M1185 I1216	Y1161-P1178 WeakPolarHBondContact OH-CD 3.31Å; Y1161-P1178 PolarHBondContact OH-O 3.27Å; Y1161-P1178 VanDerWaalsContact OH-O 3.05Å; P1178-S1180 VanDerWaalsContact C-N 3.34Å; P1178-S1180 PolarHBondContact O-N 3.3Å; P1178-I1181 HydrophobicContact CG-CG1 3.93Å; P1178-M1185 HydrophobicContact CB-CE 4.42Å; P1178-M1185 HydrophobicContact CG-CE 4.15Å; P1178-I1216 HydrophobicContact CG-CD1 4.37Å
1179	K	86.3	Confident	87.9	Confident	190 Å²	190	62.7 Å²	62.7	83%	0.826	32%	0.323	S	S	*	.	S	Bend	trans	-66.8	-33.1	-178.6	-70.1	-169.1	176.1	-171.9	0	113.2	K1172	K1172-K1179 WeakPolarHBondContact CB-O 3.49Å; K1172-K1179 PolarHBondContact N-O 3Å
1180	S	87.8	Confident	88.3	Confident	50 Å²	50	58.7 Å²	58.7	35%	0.35	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	153	175.1	-171	0	0	0	0	109.7	I1170 N1171 P1178	I1170-S1180 CarbonylContact O-C 3.45Å; I1170-S1180 VanDerWaalsContact O-CA 3.28Å; I1170-S1180 WeakPolarHBondContact O-CA 3.29Å; I1170-S1180 PolarHBondContact O-OG 2.73Å; N1171-S1180 VanDerWaalsContact OD1-CB 3.31Å; N1171-S1180 WeakPolarHBondContact OD1-CB 3.44Å; N1171-S1180 PolarHBondContact OD1-OG 3.48Å; P1178-S1180 VanDerWaalsContact C-N 3.34Å; P1178-S1180 PolarHBondContact O-N 3.3Å
1181	I	89	Confident	88.3	Confident	2 Å²	2	63.3 Å²	63.3	1%	0.01	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	126.9	178.9	-63.6	172.7	0	0	0	109	L1149 Y1161 I1170 P1178 M1185 I1186 I1216	L1149-I1181 HydrophobicContact CD1-CD1 4.22Å; L1149-I1181 HydrophobicContact CD2-CD1 4.17Å; Y1161-I1181 HydrophobicContact CD1-CD1 3.97Å; Y1161-I1181 HydrophobicContact CD1-CG1 4.27Å; Y1161-I1181 HydrophobicContact CD2-CD1 4.27Å; Y1161-I1181 HydrophobicContact CE1-CD1 3.53Å; Y1161-I1181 HydrophobicContact CE1-CG1 3.7Å; Y1161-I1181 HydrophobicContact CE2-CD1 3.87Å; Y1161-I1181 HydrophobicContact CG-CD1 4.35Å; I1170-I1181 HydrophobicContact CB-CB 4.13Å; I1170-I1181 HydrophobicContact CD1-CG2 4.4Å; I1170-I1181 HydrophobicContact CG2-CB 4.12Å; I1170-I1181 PolarHBondContact O-N 3.05Å; P1178-I1181 HydrophobicContact CG-CG1 3.93Å; I1181-M1185 HydrophobicContact CG2-CB 4.18Å; I1181-I1186 HydrophobicContact CG2-CD1 4.27Å; I1181-I1186 HydrophobicContact CG2-CG1 3.79Å; I1181-I1216 HydrophobicContact CD1-CG2 4.01Å; I1181-I1216 HydrophobicContact CG1-CG2 4.45Å; I1181-I1216 HydrophobicContact CG2-CG2 4.09Å
1182	T	86.8	Confident	88.3	Confident	76 Å²	76	61.1 Å²	61.1	47%	0.466	31%	0.311	S	S	.	.			trans	-94.8	157	172.8	72.2	0	0	0	0	111.1	K1184 M1185	T1182-K1184 PolarHBondContact O-N 3.24Å; T1182-M1185 HydrophobicContact CG2-SD 4.22Å; T1182-M1185 PolarHBondContact N-SD 2.99Å; T1182-M1185 VanDerWaalsContact N-SD 3.36Å; T1182-M1185 WeakPolarHBondContact O-CB 3.24Å; T1182-M1185 PolarHBondContact O-N 2.87Å; T1182-M1185 PolarHBondContact OG1-SD 2.88Å
1183	R	83.3	Confident	88.1	Confident	111 Å²	111	59.8 Å²	59.8	42%	0.419	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-51.9	-30.9	177.1	-170.2	-171.4	-71.4	-140.3	1.3	113.5	M1185	R1183-M1185 VanDerWaalsContact C-N 3.25Å; R1183-M1185 PolarHBondContact O-N 3.03Å
1184	K	82.8	Confident	87.9	Confident	193 Å²	193	60.2 Å²	60.2	84%	0.839	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-75.5	-7.1	179.7	-64.1	-174.6	178.9	-178	0	114.3	T1182	T1182-K1184 PolarHBondContact O-N 3.24Å
1185	M	86.8	Confident	87.6	Confident	36 Å²	36	65.9 Å²	65.9	18%	0.177	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-98.9	-14	-180	-65.6	162.6	67	0	0	112.8	P1178 I1181 T1182 R1183 I1216 H1217 L1220	P1178-M1185 HydrophobicContact CB-CE 4.42Å; P1178-M1185 HydrophobicContact CG-CE 4.15Å; I1181-M1185 HydrophobicContact CG2-CB 4.18Å; T1182-M1185 HydrophobicContact CG2-SD 4.22Å; T1182-M1185 PolarHBondContact N-SD 2.99Å; T1182-M1185 VanDerWaalsContact N-SD 3.36Å; T1182-M1185 WeakPolarHBondContact O-CB 3.24Å; T1182-M1185 PolarHBondContact O-N 2.87Å; T1182-M1185 PolarHBondContact OG1-SD 2.88Å; R1183-M1185 VanDerWaalsContact C-N 3.25Å; R1183-M1185 PolarHBondContact O-N 3.03Å; M1185-I1216 WeakPolarHBondContact O-CA 3.23Å; M1185-I1216 WeakPolarHBondContact O-CB 3.45Å; M1185-H1217 PolarHBondContact O-N 3.12Å; M1185-L1220 HydrophobicContact CB-CD1 3.61Å; M1185-L1220 HydrophobicContact CE-CD1 3.96Å; M1185-L1220 HydrophobicContact CE-CD2 4.45Å; M1185-L1220 HydrophobicContact CG-CD1 3.83Å
1186	I	89	Confident	87.4	Confident	22 Å²	22	71.3 Å²	71.3	11%	0.113	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	126.6	-173.3	-61.7	170.5	0	0	0	109.9	I1170 I1181 L1189 M1207 V1214 T1215	I1170-I1186 HydrophobicContact CD1-CD1 3.81Å; I1181-I1186 HydrophobicContact CG2-CD1 4.27Å; I1181-I1186 HydrophobicContact CG2-CG1 3.79Å; I1186-L1189 HydrophobicContact CG2-CD2 4.15Å; I1186-L1189 HydrophobicContact CG2-CG 4.05Å; I1186-M1207 HydrophobicContact CD1-CG 4.21Å; I1186-M1207 HydrophobicContact CD1-SD 3.55Å; I1186-M1207 VanDerWaalsContact CD1-SD 3.55Å; I1186-V1214 HydrophobicContact CD1-CG1 4.14Å; I1186-V1214 HydrophobicContact CG1-CG1 4.43Å; I1186-V1214 HydrophobicContact CG2-CB 4.35Å; I1186-V1214 HydrophobicContact CG2-CG1 3.99Å; I1186-T1215 WeakPolarHBondContact CA-O 3.37Å
1187	D	87.8	Confident	87.4	Confident	99 Å²	99	70.7 Å²	70.7	53%	0.529	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	-46.5	-179.2	-170.8	76.9	0	0	0	111.2	T1215 H1217	D1187-T1215 PolarHBondContact N-O 3Å; D1187-H1217 IonicContact OD1-CE1 2.72Å; D1187-H1217 PolarHBondContact OD1-CE1 2.89Å; D1187-H1217 VanDerWaalsContact OD1-CE1 3.3Å; D1187-H1217 IonicContact OD1-CG 2.84Å; D1187-H1217 IonicContact OD1-ND1 3.5Å; D1187-H1217 PolarHBondContact OD1-ND1 2.82Å
1188	G	88.3	Confident	87.4	Confident	4 Å²	4	74 Å²	74	4%	0.041	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	151.1	-178.5	0	0	0	0	0	112.9	V1214 T1215	G1188-V1214 WeakPolarHBondContact O-CA 3.32Å; G1188-T1215 VanDerWaalsContact CA-OG1 3.3Å; G1188-T1215 WeakPolarHBondContact CA-OG1 3.46Å; G1188-T1215 PolarHBondContact N-OG1 2.81Å; G1188-T1215 PolarHBondContact O-N 3.09Å
1189	L	91.9	Very high	87.4	Confident	9 Å²	9	73 Å²	73	5%	0.047	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	135.6	-177.2	-74.4	157.8	0	0	0	109.3	I1186 Q1201 I1202 A1204 M1207 V1211 V1214	I1186-L1189 HydrophobicContact CG2-CD2 4.15Å; I1186-L1189 HydrophobicContact CG2-CG 4.05Å; L1189-Q1201 CarbonylContact O-C 3.57Å; L1189-Q1201 WeakPolarHBondContact O-CA 3.31Å; L1189-I1202 HydrophobicContact CB-CB 4.39Å; L1189-I1202 PolarHBondContact O-N 2.99Å; L1189-A1204 WeakPolarHBondContact CD1-O 3.44Å; L1189-M1207 HydrophobicContact CD2-CE 3.62Å; L1189-M1207 HydrophobicContact CD2-SD 4.22Å; L1189-V1211 HydrophobicContact CD2-CB 4.42Å; L1189-V1211 HydrophobicContact CD2-CG1 3.63Å; L1189-V1211 HydrophobicContact CD2-CG2 3.92Å; L1189-V1214 HydrophobicContact CD2-CG1 3.76Å
1190	Y	91.1	Very high	87.6	Confident	15 Å²	15	66.1 Å²	66.1	6%	0.059	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	145.6	-172.5	-63	-95.2	0	0	0	111.5	F1150 F1199 S1200 Q1201 D1212 A1213 T1215	F1150-Y1190 HydrophobicContact CD2-CD2 4.32Å; F1150-Y1190 HydrophobicContact CE2-CG 4.43Å; Y1190-F1199 HydrophobicContact CD1-CB 4.39Å; Y1190-S1200 WeakPolarHBondContact CA-O 3.44Å; Y1190-Q1201 HydrophobicContact CD1-CB 3.96Å; Y1190-Q1201 HydrophobicContact CD1-CG 4.36Å; Y1190-Q1201 HydrophobicContact CE1-CB 3.78Å; Y1190-Q1201 HydrophobicContact CE1-CG 4.01Å; Y1190-D1212 PolarHBondContact O-N 3.2Å; Y1190-A1213 PolarHBondContact N-O 3Å; Y1190-A1213 PolarHBondContact O-N 2.84Å; Y1190-T1215 HydrophobicContact CE2-CG2 3.88Å
1191	K	91.9	Very high	87.6	Confident	100 Å²	100	70 Å²	70	44%	0.435	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	139.6	172.3	-175.8	177.2	65.3	178.7	0	109.4	F1199 S1200 I1202 S1210 D1212	K1191-F1199 WeakPolarHBondContact O-CA 3.44Å; K1191-S1200 PolarHBondContact N-O 3.46Å; K1191-S1200 PolarHBondContact O-N 3.39Å; K1191-I1202 HydrophobicContact CB-CD1 4.01Å; K1191-I1202 HydrophobicContact CB-CG1 4.17Å; K1191-S1210 WeakPolarHBondContact CG-O 3.28Å; K1191-D1212 WeakPolarHBondContact CG-OD2 3.48Å
1192	Y	90.8	Very high	87.6	Confident	11 Å²	11	71.8 Å²	71.8	4%	0.043	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	129.5	173	-176.6	-107.2	0	0	0	110.2	I1112 N1115 A1116 C1120 K1197 F1199 D1212	I1112-Y1192 HydrophobicContact CG2-CD1 3.68Å; I1112-Y1192 HydrophobicContact CG2-CG 4.29Å; N1115-Y1192 HydrophobicContact CB-CE1 4.35Å; A1116-Y1192 HydrophobicContact CB-CD1 4.08Å; A1116-Y1192 HydrophobicContact CB-CD2 3.53Å; A1116-Y1192 HydrophobicContact CB-CE1 4.13Å; A1116-Y1192 HydrophobicContact CB-CE2 3.61Å; A1116-Y1192 HydrophobicContact CB-CG 3.76Å; C1120-Y1192 HydrophobicContact CB-CE2 4.07Å; Y1192-K1197 WeakPolarHBondContact OH-CA 3.2Å; Y1192-F1199 HydrophobicContact CD2-CD1 4.49Å; Y1192-F1199 AromaticContact CD2-CD2 3.99Å; Y1192-F1199 HydrophobicContact CD2-CD2 3.99Å; Y1192-F1199 HydrophobicContact CD2-CE1 4.22Å; Y1192-F1199 AromaticContact CD2-CE2 3.65Å; Y1192-F1199 HydrophobicContact CD2-CE2 3.65Å; Y1192-F1199 HydrophobicContact CD2-CG 4.4Å; Y1192-F1199 AromaticContact CD2-CZ 3.81Å; Y1192-F1199 HydrophobicContact CD2-CZ 3.81Å; Y1192-F1199 HydrophobicContact CE2-CE2 4.25Å; Y1192-F1199 HydrophobicContact CG-CE1 4.49Å; Y1192-F1199 HydrophobicContact CG-CZ 4.37Å; Y1192-D1212 PolarHBondContact N-OD2 3.5Å
1193	N	88.6	Confident	87.2	Confident	44 Å²	44	74.3 Å²	74.3	24%	0.235	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	109.8	170.3	-177.3	-60.6	0	0	0	108.6	D1195 K1196 K1197 Q1198	N1193-D1195 VanDerWaalsContact C-N 3.3Å; N1193-D1195 PolarHBondContact O-N 3.13Å; N1193-D1195 WeakPolarHBondContact OD1-CB 3.35Å; N1193-D1195 PolarHBondContact OD1-N 3.16Å; N1193-K1196 HydrophobicContact CB-CB 4.46Å; N1193-K1196 PolarHBondContact OD1-N 3.24Å; N1193-K1197 VanDerWaalsContact O-CA 3.24Å; N1193-K1197 WeakPolarHBondContact O-CA 3.35Å; N1193-K1197 PolarHBondContact O-N 2.95Å; N1193-Q1198 PolarHBondContact N-O 3.03Å; N1193-Q1198 PolarHBondContact O-N 3.23Å
1194	S	83.9	Confident	87	Confident	58 Å²	58	71.6 Å²	71.6	41%	0.406	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-32.3	-178.5	-59.6	0	0	0	0	114	K1197	S1194-K1197 VanDerWaalsContact O-CG 3.31Å; S1194-K1197 WeakPolarHBondContact O-CG 3.3Å
1195	D	83.8	Confident	86.6	Confident	147 Å²	147	71.3 Å²	71.3	79%	0.786	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-42.2	-175.8	-40.9	-48.2	0	0	0	110.7	N1193	N1193-D1195 VanDerWaalsContact C-N 3.3Å; N1193-D1195 PolarHBondContact O-N 3.13Å; N1193-D1195 WeakPolarHBondContact OD1-CB 3.35Å; N1193-D1195 PolarHBondContact OD1-N 3.16Å
1196	K	83.3	Confident	86.2	Confident	145 Å²	145	73.7 Å²	73.7	63%	0.63	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-5.2	176.2	-61.8	-169.5	178.3	-170.4	0	113.5	N1193 Q1198	N1193-K1196 HydrophobicContact CB-CB 4.46Å; N1193-K1196 PolarHBondContact OD1-N 3.24Å; K1196-Q1198 HydrophobicContact CB-CG 3.79Å; K1196-Q1198 PolarHBondContact O-N 3.32Å; K1196-Q1198 VanDerWaalsContact O-N 3.13Å
1197	K	87.4	Confident	85.7	Confident	107 Å²	107	73.4 Å²	73.4	47%	0.465	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.2	32.2	-176.6	-57.9	-171.1	179.9	-167.4	0	115	H1119 Y1192 N1193 S1194	H1119-K1197 HydrophobicContact CB-CD 4.28Å; Y1192-K1197 WeakPolarHBondContact OH-CA 3.2Å; N1193-K1197 VanDerWaalsContact O-CA 3.24Å; N1193-K1197 WeakPolarHBondContact O-CA 3.35Å; N1193-K1197 PolarHBondContact O-N 2.95Å; S1194-K1197 VanDerWaalsContact O-CG 3.31Å; S1194-K1197 WeakPolarHBondContact O-CG 3.3Å
1198	Q	86.4	Confident	85.2	Confident	92 Å²	92	70.7 Å²	70.7	43%	0.43	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	155.7	-173.4	73.4	-175.1	28	0	0	111.4	N1193 K1196	N1193-Q1198 PolarHBondContact N-O 3.03Å; N1193-Q1198 PolarHBondContact O-N 3.23Å; K1196-Q1198 HydrophobicContact CB-CG 3.79Å; K1196-Q1198 PolarHBondContact O-N 3.32Å; K1196-Q1198 VanDerWaalsContact O-N 3.13Å
1199	F	89.1	Confident	84.6	Confident	21 Å²	21	73.5 Å²	73.5	9%	0.092	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	140.7	170.1	-71.5	-93.4	0	0	0	110.8	A1116 C1120 C1121 F1150 Y1190 K1191 Y1192 D1212 A1213	A1116-F1199 HydrophobicContact CB-CE2 4.06Å; A1116-F1199 HydrophobicContact CB-CZ 3.68Å; C1120-F1199 HydrophobicContact CB-CE2 4.24Å; C1121-F1199 WeakPolarHBondContact SG-CE2 3.48Å; F1150-F1199 HydrophobicContact CE1-CE2 4.49Å; F1150-F1199 HydrophobicContact CE2-CB 4.41Å; F1150-F1199 AromaticContact CE2-CD1 3.94Å; F1150-F1199 HydrophobicContact CE2-CD1 3.94Å; F1150-F1199 HydrophobicContact CE2-CD2 4.3Å; F1150-F1199 HydrophobicContact CE2-CE1 4.27Å; F1150-F1199 AromaticContact CE2-CG 3.94Å; F1150-F1199 HydrophobicContact CE2-CG 3.94Å; F1150-F1199 AromaticContact CZ-CD1 3.88Å; F1150-F1199 HydrophobicContact CZ-CD1 3.88Å; F1150-F1199 AromaticContact CZ-CD2 3.68Å; F1150-F1199 HydrophobicContact CZ-CD2 3.68Å; F1150-F1199 AromaticContact CZ-CE1 3.87Å; F1150-F1199 HydrophobicContact CZ-CE1 3.87Å; F1150-F1199 AromaticContact CZ-CE2 3.7Å; F1150-F1199 HydrophobicContact CZ-CE2 3.7Å; F1150-F1199 AromaticContact CZ-CG 3.78Å; F1150-F1199 HydrophobicContact CZ-CG 3.78Å; F1150-F1199 AromaticContact CZ-CZ 3.76Å; F1150-F1199 HydrophobicContact CZ-CZ 3.76Å; Y1190-F1199 HydrophobicContact CD1-CB 4.39Å; K1191-F1199 WeakPolarHBondContact O-CA 3.44Å; Y1192-F1199 HydrophobicContact CD2-CD1 4.49Å; Y1192-F1199 AromaticContact CD2-CD2 3.99Å; Y1192-F1199 HydrophobicContact CD2-CD2 3.99Å; Y1192-F1199 HydrophobicContact CD2-CE1 4.22Å; Y1192-F1199 AromaticContact CD2-CE2 3.65Å; Y1192-F1199 HydrophobicContact CD2-CE2 3.65Å; Y1192-F1199 HydrophobicContact CD2-CG 4.4Å; Y1192-F1199 AromaticContact CD2-CZ 3.81Å; Y1192-F1199 HydrophobicContact CD2-CZ 3.81Å; Y1192-F1199 HydrophobicContact CE2-CE2 4.25Å; Y1192-F1199 HydrophobicContact CG-CE1 4.49Å; Y1192-F1199 HydrophobicContact CG-CZ 4.37Å; F1199-D1212 HydrophobicContact CE1-CB 4.26Å; F1199-A1213 HydrophobicContact CD1-CB 3.85Å; F1199-A1213 HydrophobicContact CE1-CB 3.57Å; F1199-A1213 HydrophobicContact CZ-CB 4.45Å
1200	S	89.1	Confident	84	Confident	46 Å²	46	76.1 Å²	76.1	32%	0.322	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	127.7	174.5	-64.7	0	0	0	0	108.9	Y1190 K1191	Y1190-S1200 WeakPolarHBondContact CA-O 3.44Å; K1191-S1200 PolarHBondContact N-O 3.46Å; K1191-S1200 PolarHBondContact O-N 3.39Å
1201	Q	88.4	Confident	83.9	Confident	132 Å²	132	75.6 Å²	75.6	62%	0.617	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.8	141.1	178	-166.2	174.6	2.4	0	0	110.4	L1189 Y1190	L1189-Q1201 CarbonylContact O-C 3.57Å; L1189-Q1201 WeakPolarHBondContact O-CA 3.31Å; Y1190-Q1201 HydrophobicContact CD1-CB 3.96Å; Y1190-Q1201 HydrophobicContact CD1-CG 4.36Å; Y1190-Q1201 HydrophobicContact CE1-CB 3.78Å; Y1190-Q1201 HydrophobicContact CE1-CG 4.01Å
1202	I	88.3	Confident	83.9	Confident	39 Å²	39	71.2 Å²	71.2	20%	0.2	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	127.1	174.8	-46.2	-179.3	0	0	0	107.5	L1189 K1191 A1204 V1211	L1189-I1202 HydrophobicContact CB-CB 4.39Å; L1189-I1202 PolarHBondContact O-N 2.99Å; K1191-I1202 HydrophobicContact CB-CD1 4.01Å; K1191-I1202 HydrophobicContact CB-CG1 4.17Å; I1202-A1204 HydrophobicContact CG2-CB 4.21Å; I1202-A1204 PolarHBondContact O-N 2.98Å; I1202-V1211 HydrophobicContact CD1-CG2 3.86Å
1203	P	79.6	Confident	84	Confident	130 Å²	130	70.7 Å²	70.7	84%	0.844	39%	0.392	S	S	*	.	S	Bend	trans	-72.2	-16.5	-178.6	28.3	-35.2	0	0	0	113.6
1204	A	79	Confident	84.2	Confident	54 Å²	54	68.6 Å²	68.6	45%	0.446	38%	0.38	S	S	.	.			trans	-79	128.7	178.5	0	0	0	0	0	111.8	L1189 I1202 T1206	L1189-A1204 WeakPolarHBondContact CD1-O 3.44Å; I1202-A1204 HydrophobicContact CG2-CB 4.21Å; I1202-A1204 PolarHBondContact O-N 2.98Å; A1204-T1206 PolarHBondContact O-N 3.21Å
1205	K	73.1	Confident	84.5	Confident	186 Å²	186	66 Å²	66	81%	0.809	36%	0.362	S	S	*	.			trans	-78.4	6.8	174.6	-60.7	-172.9	179	-175.2	0	114.4
1206	T	78.7	Confident	84.9	Confident	86 Å²	86	59.1 Å²	59.1	53%	0.528	33%	0.325	S	S	.	.	S	Bend	trans	-100.7	120.8	-174.9	-63.3	0	0	0	0	110.6	A1204 S1208	A1204-T1206 PolarHBondContact O-N 3.21Å; T1206-S1208 PolarHBondContact O-N 3.1Å
1207	M	79.8	Confident	85.2	Confident	16 Å²	16	55.1 Å²	55.1	8%	0.079	31%	0.308	C	S	.	.			trans	-57.5	131.4	173.5	-73.4	-100.6	47.3	0	0	111.7	L1147 I1170 I1186 L1189 V1211	L1147-M1207 HydrophobicContact CD2-CE 4.07Å; I1170-M1207 HydrophobicContact CD1-SD 3.67Å; I1186-M1207 HydrophobicContact CD1-CG 4.21Å; I1186-M1207 HydrophobicContact CD1-SD 3.55Å; I1186-M1207 VanDerWaalsContact CD1-SD 3.55Å; L1189-M1207 HydrophobicContact CD2-CE 3.62Å; L1189-M1207 HydrophobicContact CD2-SD 4.22Å; M1207-V1211 HydrophobicContact CE-CB 3.82Å; M1207-V1211 HydrophobicContact CE-CG1 3.74Å; M1207-V1211 HydrophobicContact CE-CG2 3.84Å
1208	S	77.4	Confident	85.1	Confident	43 Å²	43	54.8 Å²	54.8	30%	0.301	31%	0.312	S	S	.	.			trans	-146.2	164.4	-178.4	71.2	0	0	0	0	110.6	T1206 S1210 V1211	T1206-S1208 PolarHBondContact O-N 3.1Å; S1208-S1210 PolarHBondContact O-N 3.21Å; S1208-S1210 PolarHBondContact OG-OG 2.83Å; S1208-V1211 WeakPolarHBondContact O-CG2 3.27Å; S1208-V1211 PolarHBondContact O-N 3.5Å
1209	A	74.4	Confident	84.8	Confident	63 Å²	63	56.3 Å²	56.3	52%	0.521	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	15	178.2	0	0	0	0	0	114.4
1210	S	80.3	Confident	84.5	Confident	63 Å²	63	58.5 Å²	58.5	44%	0.441	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.1	20.6	172.9	58.6	0	0	0	0	112.6	K1191 S1208	K1191-S1210 WeakPolarHBondContact CG-O 3.28Å; S1208-S1210 PolarHBondContact O-N 3.21Å; S1208-S1210 PolarHBondContact OG-OG 2.83Å
1211	V	89.3	Confident	84	Confident	5 Å²	5	59.4 Å²	59.4	3%	0.03	33%	0.328	C	S	.	.			trans	-101.8	125.1	173.3	178.6	0	0	0	0	108.4	L1147 L1189 I1202 M1207 S1208 A1213 V1214	L1147-V1211 HydrophobicContact CD2-CG1 4.49Å; L1189-V1211 HydrophobicContact CD2-CB 4.42Å; L1189-V1211 HydrophobicContact CD2-CG1 3.63Å; L1189-V1211 HydrophobicContact CD2-CG2 3.92Å; I1202-V1211 HydrophobicContact CD1-CG2 3.86Å; M1207-V1211 HydrophobicContact CE-CB 3.82Å; M1207-V1211 HydrophobicContact CE-CG1 3.74Å; M1207-V1211 HydrophobicContact CE-CG2 3.84Å; S1208-V1211 WeakPolarHBondContact O-CG2 3.27Å; S1208-V1211 PolarHBondContact O-N 3.5Å; V1211-A1213 WeakPolarHBondContact CG1-O 3.18Å; V1211-V1214 HydrophobicContact CG1-CG1 4.3Å
1212	D	91.5	Very high	83.3	Confident	8 Å²	8	60.3 Å²	60.3	4%	0.043	33%	0.332	C	S	.	.			trans	-109.5	-19.4	-179.6	-62.7	-57.4	0	0	0	112.3	N1109 I1113 L1147 V1148 Y1190 K1191 Y1192 F1199	N1109-D1212 PolarHBondContact ND2-OD1 3.2Å; I1113-D1212 HydrophobicContact CD1-CB 3.68Å; I1113-D1212 WeakPolarHBondContact CD1-O 3.41Å; L1147-D1212 WeakPolarHBondContact CA-O 3.46Å; V1148-D1212 PolarHBondContact N-O 2.92Å; Y1190-D1212 PolarHBondContact O-N 3.2Å; K1191-D1212 WeakPolarHBondContact CG-OD2 3.48Å; Y1192-D1212 PolarHBondContact N-OD2 3.5Å; F1199-D1212 HydrophobicContact CE1-CB 4.26Å
1213	A	91.9	Very high	81.7	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	160.2	177.2	0	0	0	0	0	113.5	V1148 F1150 Y1190 F1199 V1211	V1148-A1213 HydrophobicContact CB-CB 3.93Å; V1148-A1213 CarbonylContact O-C 3.59Å; V1148-A1213 WeakPolarHBondContact O-CA 3.34Å; V1148-A1213 VanDerWaalsContact O-CB 3.31Å; V1148-A1213 WeakPolarHBondContact O-CB 3.48Å; F1150-A1213 HydrophobicContact CD2-CB 3.94Å; F1150-A1213 HydrophobicContact CE2-CB 3.36Å; F1150-A1213 HydrophobicContact CZ-CB 3.74Å; Y1190-A1213 PolarHBondContact N-O 3Å; Y1190-A1213 PolarHBondContact O-N 2.84Å; F1199-A1213 HydrophobicContact CD1-CB 3.85Å; F1199-A1213 HydrophobicContact CE1-CB 3.57Å; F1199-A1213 HydrophobicContact CZ-CB 4.45Å; V1211-A1213 WeakPolarHBondContact CG1-O 3.18Å
1214	V	92.6	Very high	80	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	152.6	-178.2	-77.5	0	0	0	0	111.5	L1147 V1148 L1149 F1150 I1186 G1188 L1189 V1211	L1147-V1214 HydrophobicContact CD2-CG1 4.12Å; L1147-V1214 HydrophobicContact CD2-CG2 4.46Å; V1148-V1214 PolarHBondContact O-N 3.22Å; L1149-V1214 HydrophobicContact CD1-CG2 4.15Å; F1150-V1214 PolarHBondContact N-O 3.27Å; I1186-V1214 HydrophobicContact CD1-CG1 4.14Å; I1186-V1214 HydrophobicContact CG1-CG1 4.43Å; I1186-V1214 HydrophobicContact CG2-CB 4.35Å; I1186-V1214 HydrophobicContact CG2-CG1 3.99Å; G1188-V1214 WeakPolarHBondContact O-CA 3.32Å; L1189-V1214 HydrophobicContact CD2-CG1 3.76Å; V1211-V1214 HydrophobicContact CG1-CG1 4.3Å
1215	T	92.2	Very high	78.1	Confident	4 Å²	4	74.3 Å²	74.3	3%	0.025	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	151.2	157.5	47.9	0	0	0	0	109.6	F1150 I1186 D1187 G1188 Y1190	F1150-T1215 HydrophobicContact CB-CG2 3.86Å; I1186-T1215 WeakPolarHBondContact CA-O 3.37Å; D1187-T1215 PolarHBondContact N-O 3Å; G1188-T1215 VanDerWaalsContact CA-OG1 3.3Å; G1188-T1215 WeakPolarHBondContact CA-OG1 3.46Å; G1188-T1215 PolarHBondContact N-OG1 2.81Å; G1188-T1215 PolarHBondContact O-N 3.09Å; Y1190-T1215 HydrophobicContact CE2-CG2 3.88Å
1216	I	92.1	Very high	76.6	Confident	1 Å²	1	71.3 Å²	71.3	1%	0.005	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	154.1	172.2	62.6	178.1	0	0	0	110.8	L1149 P1178 I1181 M1185 N1218 L1220 W1221	L1149-I1216 HydrophobicContact CD1-CB 4.41Å; L1149-I1216 HydrophobicContact CD1-CD1 4.46Å; L1149-I1216 HydrophobicContact CD1-CG1 4.13Å; L1149-I1216 HydrophobicContact CD1-CG2 3.79Å; L1149-I1216 HydrophobicContact CD2-CD1 4.17Å; P1178-I1216 HydrophobicContact CG-CD1 4.37Å; I1181-I1216 HydrophobicContact CD1-CG2 4.01Å; I1181-I1216 HydrophobicContact CG1-CG2 4.45Å; I1181-I1216 HydrophobicContact CG2-CG2 4.09Å; M1185-I1216 WeakPolarHBondContact O-CA 3.23Å; M1185-I1216 WeakPolarHBondContact O-CB 3.45Å; I1216-N1218 PolarHBondContact O-N 3.32Å; I1216-L1220 HydrophobicContact CB-CD1 4.07Å; I1216-L1220 HydrophobicContact CD1-CB 4.06Å; I1216-L1220 HydrophobicContact CD1-CD1 4.42Å; I1216-W1221 HydrophobicContact CD1-CD2 4.35Å; I1216-W1221 HydrophobicContact CD1-CH2 4.27Å; I1216-W1221 HydrophobicContact CD1-CZ2 3.9Å; I1216-W1221 HydrophobicContact CG1-CZ2 3.85Å
1217	H	89	Confident	74.5	Confident	61 Å²	61	71.8 Å²	71.8	28%	0.282	39%	0.391	S	S	.	.			trans	-57.8	138	-178.1	-66.9	-51.7	0	0	0	112.8	M1185 D1187 H1219 L1220	M1185-H1217 PolarHBondContact O-N 3.12Å; D1187-H1217 IonicContact OD1-CE1 2.72Å; D1187-H1217 PolarHBondContact OD1-CE1 2.89Å; D1187-H1217 VanDerWaalsContact OD1-CE1 3.3Å; D1187-H1217 IonicContact OD1-CG 2.84Å; D1187-H1217 IonicContact OD1-ND1 3.5Å; D1187-H1217 PolarHBondContact OD1-ND1 2.82Å; H1217-H1219 VanDerWaalsContact CB-CE1 3.44Å; H1217-H1219 WeakPolarHBondContact CB-CE1 3.14Å; H1217-H1219 AromaticContact CD2-CE1 3.86Å; H1217-H1219 AromaticContact CG-CE1 3.95Å; H1217-H1219 PolarHBondContact O-N 3.5Å; H1217-L1220 HydrophobicContact CB-CD1 4.42Å; H1217-L1220 WeakPolarHBondContact O-CB 3.44Å; H1217-L1220 PolarHBondContact O-N 3.04Å
1218	N	84.3	Confident	72.5	Confident	101 Å²	101	77 Å²	77	54%	0.54	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-56.4	-25.6	-173.4	-68.2	-14.4	0	0	0	115.6	I1216 L1220 W1221	I1216-N1218 PolarHBondContact O-N 3.32Å; N1218-L1220 PolarHBondContact O-N 3.23Å; N1218-W1221 PolarHBondContact O-N 2.99Å
1219	H	81.1	Confident	70.7	Confident	124 Å²	124	80.8 Å²	80.8	57%	0.574	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-67	-17.6	175.9	68	-104	0	0	0	113.5	H1217	H1217-H1219 VanDerWaalsContact CB-CE1 3.44Å; H1217-H1219 WeakPolarHBondContact CB-CE1 3.14Å; H1217-H1219 AromaticContact CD2-CE1 3.86Å; H1217-H1219 AromaticContact CG-CE1 3.95Å; H1217-H1219 PolarHBondContact O-N 3.5Å
1220	L	81.9	Confident	68.9	Low	67 Å²	67	87.2 Å²	87.2	35%	0.351	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-84.5	-20.1	177.3	-59.8	168.4	0	0	0	112.7	M1185 I1216 H1217 N1218	M1185-L1220 HydrophobicContact CB-CD1 3.61Å; M1185-L1220 HydrophobicContact CE-CD1 3.96Å; M1185-L1220 HydrophobicContact CE-CD2 4.45Å; M1185-L1220 HydrophobicContact CG-CD1 3.83Å; I1216-L1220 HydrophobicContact CB-CD1 4.07Å; I1216-L1220 HydrophobicContact CD1-CB 4.06Å; I1216-L1220 HydrophobicContact CD1-CD1 4.42Å; H1217-L1220 HydrophobicContact CB-CD1 4.42Å; H1217-L1220 WeakPolarHBondContact O-CB 3.44Å; H1217-L1220 PolarHBondContact O-N 3.04Å; N1218-L1220 PolarHBondContact O-N 3.23Å
1221	W	79.7	Confident	67.1	Low	65 Å²	65	93.7 Å²	93.7	25%	0.246	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-21.9	170.8	-64.7	125.8	0	0	0	112.6	L1149 R1151 R1158 I1216 N1218 T1223	L1149-W1221 HydrophobicContact CD1-CZ2 4.39Å; L1149-W1221 HydrophobicContact CD2-CH2 3.54Å; L1149-W1221 HydrophobicContact CD2-CZ2 3.91Å; L1149-W1221 HydrophobicContact CG-CH2 4.1Å; L1149-W1221 HydrophobicContact CG-CZ2 4.11Å; R1151-W1221 PolarHBondContact O-NE1 2.89Å; R1158-W1221 HydrophobicContact CB-CH2 3.99Å; R1158-W1221 HydrophobicContact CG-CH2 4.05Å; R1158-W1221 HydrophobicContact CG-CZ2 4.5Å; I1216-W1221 HydrophobicContact CD1-CD2 4.35Å; I1216-W1221 HydrophobicContact CD1-CH2 4.27Å; I1216-W1221 HydrophobicContact CD1-CZ2 3.9Å; I1216-W1221 HydrophobicContact CG1-CZ2 3.85Å; N1218-W1221 PolarHBondContact O-N 2.99Å; W1221-T1223 PolarHBondContact O-N 2.99Å
1222	Q	74.2	Confident	64.5	Low	150 Å²	150	99.8 Å²	99.8	70%	0.701	52%	0.521	S	S	*	.	S	Bend	trans	-82.5	102.4	176.2	-66.8	-174.5	1.8	0	0	110.2	K1224	Q1222-K1224 PolarHBondContact O-N 2.96Å
1223	T	53.8	Low	61.9	Low	130 Å²	130	104.5 Å²	104.5	80%	0.798	55%	0.55	S	S	*	*			trans	-64.4	96.8	168.8	38.9	0	0	0	0	110.1	W1221 K1225	W1221-T1223 PolarHBondContact O-N 2.99Å; T1223-K1225 VanDerWaalsContact C-N 3.25Å; T1223-K1225 PolarHBondContact O-N 3.1Å
1224	K	43.7	Very low	59.5	Low	204 Å²	204	110.4 Å²	110.4	89%	0.887	59%	0.588	S	S	*	*			trans	-57.2	97	155.1	-89.4	-168.8	173.5	-176.7	0	107.2	Q1222	Q1222-K1224 PolarHBondContact O-N 2.96Å
1225	K	39.8	Very low	56.7	Low	184 Å²	184	115 Å²	115	80%	0.8	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-50	131	162.1	-70	-175.1	176.7	-176.7	0	106.6	T1223 A1227	T1223-K1225 VanDerWaalsContact C-N 3.25Å; T1223-K1225 PolarHBondContact O-N 3.1Å; K1225-A1227 PolarHBondContact O-N 3.17Å; K1225-A1227 VanDerWaalsContact O-N 3.12Å
1226	P	40.8	Very low	54.1	Low	122 Å²	122	123.7 Å²	123.7	79%	0.792	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-56.2	124.2	167.4	25.3	-32.2	0	0	0	106.8	T1228	P1226-T1228 PolarHBondContact O-N 3.2Å; P1226-T1228 VanDerWaalsContact O-N 3.09Å
1227	A	35	Very low	51.4	Low	97 Å²	97	133 Å²	133	80%	0.802	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-63.4	117	179.8	0	0	0	0	0	107.7	K1225	K1225-A1227 PolarHBondContact O-N 3.17Å; K1225-A1227 VanDerWaalsContact O-N 3.12Å
1228	T	37.3	Very low	49.5	Very low	125 Å²	125	136.7 Å²	136.7	77%	0.767	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-59.7	130.3	173.3	38.7	0	0	0	0	108.3	P1226 K1230	P1226-T1228 PolarHBondContact O-N 3.2Å; P1226-T1228 VanDerWaalsContact O-N 3.09Å; T1228-K1230 PolarHBondContact O-N 3.48Å
1229	P	39.7	Very low	47.7	Very low	123 Å²	123	138.5 Å²	138.5	80%	0.799	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-59	130.8	175	25.1	-32.7	0	0	0	108.1	K1231	P1229-K1231 PolarHBondContact O-N 2.97Å
1230	K	37.5	Very low	45.8	Very low	197 Å²	197	139.3 Å²	139.3	86%	0.857	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-59.8	126.5	-176.8	-74.2	-175.6	176.4	-178.6	0	109.4	T1228 V1232	T1228-K1230 PolarHBondContact O-N 3.48Å; K1230-V1232 PolarHBondContact O-N 2.86Å
1231	K	41.6	Very low	43.7	Very low	199 Å²	199	143.6 Å²	143.6	87%	0.865	80%	0.802	S	S	*	*			trans	-55.4	104.1	171.4	-179.7	-180	-179.6	178.9	0	109.2	P1229 V1233	P1229-K1231 PolarHBondContact O-N 2.97Å; K1231-V1233 PolarHBondContact O-N 2.89Å
1232	V	34.2	Very low	41.4	Very low	134 Å²	134	148.5 Å²	148.5	81%	0.812	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-74.1	123.4	169.6	179.8	0	0	0	0	107.2	K1230	K1230-V1232 PolarHBondContact O-N 2.86Å
1233	V	37.6	Very low	39.2	Very low	107 Å²	107	148.4 Å²	148.4	65%	0.648	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-77.9	136.2	174.6	175.9	0	0	0	0	108	K1231 A1235	K1231-V1233 PolarHBondContact O-N 2.89Å; V1233-A1235 PolarHBondContact O-N 2.62Å
1234	P	40.9	Very low	38.2	Very low	124 Å²	124	149.7 Å²	149.7	81%	0.805	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-66.5	116.8	173	27.7	-33.5	0	0	0	109.7
1235	A	34.4	Very low	37.8	Very low	97 Å²	97	145.5 Å²	145.5	80%	0.802	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-99.1	154	166.3	0	0	0	0	0	109.5	V1233	V1233-A1235 PolarHBondContact O-N 2.62Å
1236	Q	37.2	Very low	37.6	Very low	186 Å²	186	142.3 Å²	142.3	87%	0.869	85%	0.85	S	S	*	*			trans	-86.3	174.4	-173.5	-65.4	168.2	-40.9	0	0	112.5
1237	S	35.2	Very low	37.3	Very low	197 Å²	197	144.2 Å²	144.2	100%	1.378	86%	0.855	S	S	*	*			trans	62.3	0	178.7	71.3	0	0	0	0	116.4

Retrieved 1,237 of 1,237 residues in 346.1 ms (Link to these results)

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