A0A5K4F8N0_SCHMA Loading...

EGF-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F8N0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 878 aa.

						>A0A5K4F8N0_SCHMA|A0A5K4F8N0
MLLCLIILLFIHFINSNLIHYITMNQLINILLSLRDKNHLFMLPYSNNDQLLFYPYHRPLYKPLWKLNKPYLYFSQYSFPNLYQTSTSSSSSSSSSSSSSLSSSSSSLSSILNMKFIKNDILLIKESTYNSSIKYILIENFTLFDLYTNLLLKFAGDINFTQYEKKIITNDDTTEYNDISSINSNNENSYDNIQMKSRKITNTVVYTQDEDDEDGDDDQDNRITNVILGERLQPRMFLPLFIDIYRIFKAMKVKCGKNCKDYIPNYQYVLWMYNWVICTILGPKPKNDIDGICPKLCRPREDLIKNDFIQQIINLTFKPIKIINPFDVCSQLLHTISGSCLVHGNSVSVNEFSCQCKSNAYHWQTINSLTGCLLIPEIIKNKFHNLSPSKWYIECNKEMEKFCQQNNTIKCYQRLRLMKDTTYNTTDTTTSTNTTSHTTNTTNTTTTTNNTHSTNTTTSTNDTTNTTHTTNTTDTANTTTNTTHTINTTTTTDTSDTTYTTTTNTTHTTTTTNNNNNNTNTTHTTNTTTTTNTTHTTNTTTIDTIHSTTTTNNNELTLISNIDISLWPYCLCHQNFTGLDCSIPFNPCDHLIQNVLMKPQILMHNQLVHNDIDRPLISFDDGDEDDDLKSATGNWLCGVPFGYGTCHSSGFQYRCQCKIGYEKDVNYSDQDNCWKQTELKTIETVHECGQSVCLNGGECVYVTKGLVTYIDQYNNDTTNSTNSNNDSSYAYNRVPMCQCQPGYTGLYCELTGVWSDWNSWSDCQPNCGLKRYRSRLRSCYGDIGCIGSGKEIQNCPPRKCITVPLNTLNDRPIQRTKFTGNYHLIWFLGCLIPIEIVLIIIGVIAYEKYVLKKSSSSSSSASSLSSRSSSSSSSSTSL
					

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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	35	Very low	46.7	Very low	194 Å²	194	76.5 Å²	76.5	96%	0.956	40%	0.397	S	S	*	.				0	-59.7	0	-79	-154.6	76.2	0	0	113.6	L3 C4 L5	M1-L3 VanDerWaalsContact C-N 3.34Å; M1-L3 PolarHBondContact O-N 3.38Å; M1-C4 WeakPolarHBondContact O-CA 3.43Å; M1-C4 WeakPolarHBondContact O-CB 3.5Å; M1-C4 PolarHBondContact O-N 2.93Å; M1-L5 PolarHBondContact O-N 2.86Å
2	L	39.3	Very low	46.8	Very low	49 Å²	49	80 Å²	80	26%	0.257	41%	0.41	S	S	.	.	H	α-helix	trans	-47.9	-48.3	-170.8	179.5	53.2	0	0	0	114.5	C4 L5 I6 F237 I280	L2-C4 PolarHBondContact O-N 3.01Å; L2-L5 WeakPolarHBondContact O-CB 3.41Å; L2-L5 PolarHBondContact O-N 3.19Å; L2-I6 HydrophobicContact CD1-CD1 3.88Å; L2-I6 HydrophobicContact CD1-CG1 4.06Å; L2-I6 HydrophobicContact CG-CD1 3.93Å; L2-I6 WeakPolarHBondContact O-CG1 3.5Å; L2-I6 PolarHBondContact O-N 3.27Å; L2-F237 HydrophobicContact CD2-CE1 4.29Å; L2-F237 HydrophobicContact CD2-CE2 4.28Å; L2-F237 HydrophobicContact CD2-CZ 3.77Å; L2-I280 HydrophobicContact CD1-CD1 3.57Å; L2-I280 HydrophobicContact CD1-CG2 3.91Å; L2-I280 HydrophobicContact CD2-CG2 4.49Å
3	L	43.9	Very low	46.7	Very low	63 Å²	63	86.4 Å²	86.4	33%	0.33	43%	0.433	S	S	.	.	H	α-helix	trans	-56.7	-44.9	177.2	-168.9	71.2	0	0	0	112.7	M1 L5 I6 I7 L143 L146 L240	M1-L3 VanDerWaalsContact C-N 3.34Å; M1-L3 PolarHBondContact O-N 3.38Å; L3-L5 VanDerWaalsContact C-N 3.3Å; L3-L5 PolarHBondContact O-N 3.47Å; L3-I6 PolarHBondContact O-N 2.99Å; L3-I7 HydrophobicContact CG-CD1 4.06Å; L3-I7 WeakPolarHBondContact O-CB 3.49Å; L3-I7 VanDerWaalsContact O-CG1 3.27Å; L3-I7 WeakPolarHBondContact O-CG1 3.48Å; L3-I7 PolarHBondContact O-N 2.96Å; L3-L143 HydrophobicContact CD2-CD1 4.21Å; L3-L146 HydrophobicContact CD2-CD2 4.19Å; L3-L240 HydrophobicContact CD1-CD2 4.48Å
4	C	42.1	Very low	46.9	Very low	66 Å²	66	84.8 Å²	84.8	45%	0.446	43%	0.426	S	S	.	.	H	α-helix	trans	-65.4	-33.4	175.9	-51.2	0	0	0	0	112.2	M1 L2 I7 L8	M1-C4 WeakPolarHBondContact O-CA 3.43Å; M1-C4 WeakPolarHBondContact O-CB 3.5Å; M1-C4 PolarHBondContact O-N 2.93Å; L2-C4 PolarHBondContact O-N 3.01Å; C4-I7 PolarHBondContact O-N 3.08Å; C4-L8 VanDerWaalsContact O-CB 3.29Å; C4-L8 WeakPolarHBondContact O-CB 3.34Å; C4-L8 WeakPolarHBondContact O-CD1 3.21Å; C4-L8 WeakPolarHBondContact O-CG 3.41Å; C4-L8 PolarHBondContact O-N 3Å
5	L	45.8	Very low	47	Very low	83 Å²	83	87.2 Å²	87.2	44%	0.435	44%	0.44	S	S	.	.	H	α-helix	trans	-71.8	-39.8	178.2	-132.3	167	0	0	0	111	M1 L2 L3 L8 L9	M1-L5 PolarHBondContact O-N 2.86Å; L2-L5 WeakPolarHBondContact O-CB 3.41Å; L2-L5 PolarHBondContact O-N 3.19Å; L3-L5 VanDerWaalsContact C-N 3.3Å; L3-L5 PolarHBondContact O-N 3.47Å; L5-L8 PolarHBondContact O-N 3.02Å; L5-L9 HydrophobicContact CD2-CD1 3.88Å; L5-L9 HydrophobicContact CD2-CG 4.14Å; L5-L9 WeakPolarHBondContact O-CB 3.28Å; L5-L9 VanDerWaalsContact O-CG 3.26Å; L5-L9 WeakPolarHBondContact O-CG 3.3Å; L5-L9 PolarHBondContact O-N 2.75Å
6	I	50.9	Low	46.8	Very low	26 Å²	26	85.6 Å²	85.6	13%	0.133	44%	0.44	C	S	.	.	H	α-helix	trans	-62.2	-46.1	170.5	-67.4	166.8	0	0	0	110.4	L2 L3 L9 F10 V276	L2-I6 HydrophobicContact CD1-CD1 3.88Å; L2-I6 HydrophobicContact CD1-CG1 4.06Å; L2-I6 HydrophobicContact CG-CD1 3.93Å; L2-I6 WeakPolarHBondContact O-CG1 3.5Å; L2-I6 PolarHBondContact O-N 3.27Å; L3-I6 PolarHBondContact O-N 2.99Å; I6-L9 PolarHBondContact O-N 3.03Å; I6-F10 VanDerWaalsContact O-CB 3.31Å; I6-F10 WeakPolarHBondContact O-CB 3.3Å; I6-F10 PolarHBondContact O-N 3.17Å; I6-V276 HydrophobicContact CD1-CG1 4.1Å; I6-V276 HydrophobicContact CG1-CG1 4.39Å
7	I	53.7	Low	46.1	Very low	43 Å²	43	88.2 Å²	88.2	22%	0.221	46%	0.455	C	S	.	.	H	α-helix	trans	-63.1	-43.3	177.2	-70	165.3	0	0	0	111.4	L3 C4 F10 I11 L150	L3-I7 HydrophobicContact CG-CD1 4.06Å; L3-I7 WeakPolarHBondContact O-CB 3.49Å; L3-I7 VanDerWaalsContact O-CG1 3.27Å; L3-I7 WeakPolarHBondContact O-CG1 3.48Å; L3-I7 PolarHBondContact O-N 2.96Å; C4-I7 PolarHBondContact O-N 3.08Å; I7-F10 PolarHBondContact O-N 3.07Å; I7-I11 HydrophobicContact CG2-CD1 3.73Å; I7-I11 HydrophobicContact CG2-CG1 4.42Å; I7-I11 WeakPolarHBondContact O-CB 3.37Å; I7-I11 VanDerWaalsContact O-CG1 3.29Å; I7-I11 WeakPolarHBondContact O-CG1 3.49Å; I7-I11 PolarHBondContact O-N 3.25Å; I7-L150 HydrophobicContact CD1-CD2 4.11Å; I7-L150 HydrophobicContact CG2-CD2 4.31Å
8	L	48.4	Very low	45.6	Very low	97 Å²	97	90.1 Å²	90.1	51%	0.508	47%	0.465	S	S	.	.	H	α-helix	trans	-65.8	-39.7	176.8	-75.9	167.1	0	0	0	112	C4 L5 F10 I11 H12	C4-L8 VanDerWaalsContact O-CB 3.29Å; C4-L8 WeakPolarHBondContact O-CB 3.34Å; C4-L8 WeakPolarHBondContact O-CD1 3.21Å; C4-L8 WeakPolarHBondContact O-CG 3.41Å; C4-L8 PolarHBondContact O-N 3Å; L5-L8 PolarHBondContact O-N 3.02Å; L8-F10 VanDerWaalsContact C-N 3.35Å; L8-I11 PolarHBondContact O-N 3.1Å; L8-H12 WeakPolarHBondContact O-CB 2.69Å; L8-H12 PolarHBondContact O-N 3.14Å
9	L	50.8	Low	45.3	Very low	88 Å²	88	89.1 Å²	89.1	46%	0.461	46%	0.46	S	S	.	.	H	α-helix	trans	-66	-36.4	172.5	-73.9	168.3	0	0	0	111.9	L5 I6 H12 F13	L5-L9 HydrophobicContact CD2-CD1 3.88Å; L5-L9 HydrophobicContact CD2-CG 4.14Å; L5-L9 WeakPolarHBondContact O-CB 3.28Å; L5-L9 VanDerWaalsContact O-CG 3.26Å; L5-L9 WeakPolarHBondContact O-CG 3.3Å; L5-L9 PolarHBondContact O-N 2.75Å; I6-L9 PolarHBondContact O-N 3.03Å; L9-H12 PolarHBondContact O-N 3.11Å; L9-F13 VanDerWaalsContact O-CB 3.22Å; L9-F13 WeakPolarHBondContact O-CB 3.29Å; L9-F13 PolarHBondContact O-N 2.64Å
10	F	52.5	Low	44.8	Very low	75 Å²	75	93 Å²	93	33%	0.329	48%	0.475	S	S	.	.	H	α-helix	trans	-67.6	-43.2	175.7	-161.9	-104.2	0	0	0	111.5	I6 I7 L8 F13 I14 I244 F248	I6-F10 VanDerWaalsContact O-CB 3.31Å; I6-F10 WeakPolarHBondContact O-CB 3.3Å; I6-F10 PolarHBondContact O-N 3.17Å; I7-F10 PolarHBondContact O-N 3.07Å; L8-F10 VanDerWaalsContact C-N 3.35Å; F10-F13 PolarHBondContact O-N 3.38Å; F10-I14 HydrophobicContact CD1-CD1 3.65Å; F10-I14 HydrophobicContact CE1-CD1 3.71Å; F10-I14 WeakPolarHBondContact O-CB 3.17Å; F10-I14 VanDerWaalsContact O-CG1 3.27Å; F10-I14 WeakPolarHBondContact O-CG1 3.49Å; F10-I14 PolarHBondContact O-N 2.56Å; F10-I244 HydrophobicContact CE2-CG2 4.26Å; F10-I244 HydrophobicContact CZ-CG2 4.42Å; F10-F248 HydrophobicContact CE2-CE2 4.25Å; F10-F248 HydrophobicContact CZ-CE2 4.03Å; F10-F248 HydrophobicContact CZ-CZ 4.11Å
11	I	52	Low	44.7	Very low	57 Å²	57	98.5 Å²	98.5	29%	0.292	49%	0.492	S	S	.	.	H	α-helix	trans	-64.2	-41.3	172.8	-68.5	166.1	0	0	0	110.9	I7 L8 F13 I14 N15 F154	I7-I11 HydrophobicContact CG2-CD1 3.73Å; I7-I11 HydrophobicContact CG2-CG1 4.42Å; I7-I11 WeakPolarHBondContact O-CB 3.37Å; I7-I11 VanDerWaalsContact O-CG1 3.29Å; I7-I11 WeakPolarHBondContact O-CG1 3.49Å; I7-I11 PolarHBondContact O-N 3.25Å; L8-I11 PolarHBondContact O-N 3.1Å; I11-F13 VanDerWaalsContact C-N 3.34Å; I11-I14 PolarHBondContact O-N 2.66Å; I11-N15 WeakPolarHBondContact O-CB 3.38Å; I11-N15 VanDerWaalsContact O-CG 3.29Å; I11-N15 PolarHBondContact O-N 2.84Å; I11-N15 PolarHBondContact O-ND2 3.16Å; I11-F154 HydrophobicContact CD1-CE2 4.49Å
12	H	47.3	Very low	45	Very low	119 Å²	119	91.9 Å²	91.9	55%	0.551	46%	0.46	S	S	*	.	H	α-helix	trans	-66.5	-35.5	176	-165.8	-43.5	0	0	0	111.7	L8 L9 N15 S16	L8-H12 WeakPolarHBondContact O-CB 2.69Å; L8-H12 PolarHBondContact O-N 3.14Å; L9-H12 PolarHBondContact O-N 3.11Å; H12-N15 PolarHBondContact O-N 3.04Å; H12-S16 PolarHBondContact CE1-OG 2.89Å; H12-S16 PolarHBondContact ND1-OG 2.79Å; H12-S16 WeakPolarHBondContact O-CB 3.06Å; H12-S16 PolarHBondContact O-N 1.91Å; H12-S16 PolarHBondContact O-OG 2.85Å; H12-S16 VanDerWaalsContact O-OG 3.08Å
13	F	46.1	Very low	45.1	Very low	163 Å²	163	93.4 Å²	93.4	72%	0.715	47%	0.471	S	S	*	.	H	α-helix	trans	-71.8	-33.6	174.8	-168.2	-96.7	0	0	0	112.4	L9 F10 I11	L9-F13 VanDerWaalsContact O-CB 3.22Å; L9-F13 WeakPolarHBondContact O-CB 3.29Å; L9-F13 PolarHBondContact O-N 2.64Å; F10-F13 PolarHBondContact O-N 3.38Å; I11-F13 VanDerWaalsContact C-N 3.34Å
14	I	49	Very low	44.8	Very low	64 Å²	64	96.9 Å²	96.9	33%	0.328	49%	0.487	S	S	.	.	H	α-helix	trans	-66.7	-39.4	170.6	-76.2	166.8	0	0	0	111.4	F10 I11 I19	F10-I14 HydrophobicContact CD1-CD1 3.65Å; F10-I14 HydrophobicContact CE1-CD1 3.71Å; F10-I14 WeakPolarHBondContact O-CB 3.17Å; F10-I14 VanDerWaalsContact O-CG1 3.27Å; F10-I14 WeakPolarHBondContact O-CG1 3.49Å; F10-I14 PolarHBondContact O-N 2.56Å; I11-I14 PolarHBondContact O-N 2.66Å; I14-I19 HydrophobicContact CB-CD1 4.41Å; I14-I19 HydrophobicContact CG2-CD1 3.91Å; I14-I19 WeakPolarHBondContact O-CD1 3.23Å
15	N	47.7	Very low	44.7	Very low	121 Å²	121	99.2 Å²	99.2	65%	0.647	50%	0.495	S	S	*	.	H	α-helix	trans	-84.6	-30.9	-176.5	-72.1	-16.5	0	0	0	114	I11 H12 N17	I11-N15 WeakPolarHBondContact O-CB 3.38Å; I11-N15 VanDerWaalsContact O-CG 3.29Å; I11-N15 PolarHBondContact O-N 2.84Å; I11-N15 PolarHBondContact O-ND2 3.16Å; H12-N15 PolarHBondContact O-N 3.04Å; N15-N17 VanDerWaalsContact C-N 3.3Å; N15-N17 PolarHBondContact O-N 3.46Å
16	S	44.5	Very low	44.6	Very low	61 Å²	61	99.4 Å²	99.4	43%	0.427	49%	0.494	S	S	.	.	S	Bend	trans	-85.8	63.5	-174.2	-65.4	0	0	0	0	114.2	H12	H12-S16 PolarHBondContact CE1-OG 2.89Å; H12-S16 PolarHBondContact ND1-OG 2.79Å; H12-S16 WeakPolarHBondContact O-CB 3.06Å; H12-S16 PolarHBondContact O-N 1.91Å; H12-S16 PolarHBondContact O-OG 2.85Å; H12-S16 VanDerWaalsContact O-OG 3.08Å
17	N	34.9	Very low	44.1	Very low	131 Å²	131	100.7 Å²	100.7	70%	0.701	50%	0.501	S	S	*	.	S	Bend	trans	87.3	148.5	170	-48.4	-77.8	0	0	0	117.5	N15	N15-N17 VanDerWaalsContact C-N 3.3Å; N15-N17 PolarHBondContact O-N 3.46Å
18	L	38	Very low	43.5	Very low	122 Å²	122	102.2 Å²	102.2	64%	0.639	51%	0.509	S	S	*	.			trans	75.1	36.3	173.4	-64.4	110.3	0	0	0	118.9	Y262	L18-Y262 PolarHBondContact O-OH 3.42Å
19	I	38.2	Very low	43.2	Very low	70 Å²	70	102.3 Å²	102.3	36%	0.359	51%	0.51	S	S	.	.			trans	-118.5	74.2	157.2	-48.3	-177.8	0	0	0	111	I14 I22	I14-I19 HydrophobicContact CB-CD1 4.41Å; I14-I19 HydrophobicContact CG2-CD1 3.91Å; I14-I19 WeakPolarHBondContact O-CD1 3.23Å; I19-I22 HydrophobicContact CG2-CB 3.89Å; I19-I22 HydrophobicContact CG2-CG1 4.42Å
20	H	36.2	Very low	42.8	Very low	168 Å²	168	99.6 Å²	99.6	78%	0.778	50%	0.495	S	S	*	.			trans	-74.6	149.4	150.8	-84.9	-90.5	0	0	0	108.8
21	Y	42.8	Very low	42	Very low	208 Å²	208	100 Å²	100	82%	0.816	50%	0.5	S	S	*	.	S	Bend	trans	76.1	3.9	171.9	-67.4	-78	0	0	0	120.6	Q26	Y21-Q26 PolarHBondContact O-NE2 3.13Å; Y21-Q26 PolarHBondContact O-OE1 3.07Å
22	I	41.1	Very low	41.3	Very low	56 Å²	56	101 Å²	101	29%	0.287	51%	0.506	S	S	.	.			trans	-120.6	98.6	164.7	-53.8	-178.7	0	0	0	109.9	I19 Q26 L27	I19-I22 HydrophobicContact CG2-CB 3.89Å; I19-I22 HydrophobicContact CG2-CG1 4.42Å; I22-Q26 HydrophobicContact CG2-CB 4.07Å; I22-L27 HydrophobicContact CG2-CB 4.16Å
23	T	41.7	Very low	40.7	Very low	80 Å²	80	97.9 Å²	97.9	49%	0.491	50%	0.497	S	S	.	.			trans	-66.8	157.3	168	58.7	0	0	0	0	111.1	N25 Q26 L27	T23-N25 PolarHBondContact O-N 3.17Å; T23-Q26 WeakPolarHBondContact O-CA 3.17Å; T23-Q26 WeakPolarHBondContact O-CB 3.22Å; T23-Q26 PolarHBondContact O-N 3.24Å; T23-Q26 WeakPolarHBondContact OG1-CG 3.37Å; T23-Q26 PolarHBondContact OG1-N 2.85Å; T23-Q26 VanDerWaalsContact OG1-N 3.09Å; T23-Q26 PolarHBondContact OG1-OE1 2.84Å; T23-L27 PolarHBondContact O-N 3.42Å
24	M	37.5	Very low	40.1	Very low	136 Å²	136	92 Å²	92	67%	0.67	47%	0.473	S	S	*	.	H	α-helix	trans	-55.6	-34.7	171.4	-76.2	-68.2	-79.6	0	0	112	L27 I28	M24-L27 PolarHBondContact O-N 2.85Å; M24-L27 HydrophobicContact SD-CD2 4.11Å; M24-I28 VanDerWaalsContact O-CB 3.29Å; M24-I28 WeakPolarHBondContact O-CB 3.34Å; M24-I28 WeakPolarHBondContact O-CD1 3.49Å; M24-I28 WeakPolarHBondContact O-CG1 3.42Å; M24-I28 PolarHBondContact O-N 2.76Å
25	N	40.5	Very low	39.3	Very low	115 Å²	115	97.2 Å²	97.2	62%	0.615	49%	0.489	S	S	*	.	H	α-helix	trans	-67.2	-33.8	173.4	-74.2	-8.8	0	0	0	113	T23 N29	T23-N25 PolarHBondContact O-N 3.17Å; N25-N29 WeakPolarHBondContact O-CB 3.42Å; N25-N29 PolarHBondContact O-N 2.92Å; N25-N29 PolarHBondContact O-ND2 3.2Å
26	Q	43	Very low	38.4	Very low	87 Å²	87	96.9 Å²	96.9	41%	0.407	49%	0.487	S	S	.	.	H	α-helix	trans	-71.3	-39	171.2	-74.6	160.2	-70.8	0	0	111.8	Y21 I22 T23 N29 I30	Y21-Q26 PolarHBondContact O-NE2 3.13Å; Y21-Q26 PolarHBondContact O-OE1 3.07Å; I22-Q26 HydrophobicContact CG2-CB 4.07Å; T23-Q26 WeakPolarHBondContact O-CA 3.17Å; T23-Q26 WeakPolarHBondContact O-CB 3.22Å; T23-Q26 PolarHBondContact O-N 3.24Å; T23-Q26 WeakPolarHBondContact OG1-CG 3.37Å; T23-Q26 PolarHBondContact OG1-N 2.85Å; T23-Q26 VanDerWaalsContact OG1-N 3.09Å; T23-Q26 PolarHBondContact OG1-OE1 2.84Å; Q26-N29 PolarHBondContact O-N 2.95Å; Q26-I30 WeakPolarHBondContact O-CB 3.49Å; Q26-I30 WeakPolarHBondContact O-CD1 3.27Å; Q26-I30 WeakPolarHBondContact O-CG1 3.44Å; Q26-I30 PolarHBondContact O-N 3.26Å
27	L	39.7	Very low	37.8	Very low	53 Å²	53	103.1 Å²	103.1	28%	0.277	51%	0.507	S	S	.	.	H	α-helix	trans	-62.4	-46.9	174	-177.4	63.6	0	0	0	111	I22 T23 M24 I30 L31 M251	I22-L27 HydrophobicContact CG2-CB 4.16Å; T23-L27 PolarHBondContact O-N 3.42Å; M24-L27 PolarHBondContact O-N 2.85Å; M24-L27 HydrophobicContact SD-CD2 4.11Å; L27-I30 PolarHBondContact O-N 2.8Å; L27-L31 HydrophobicContact CD1-CD1 4.48Å; L27-L31 HydrophobicContact CG-CD1 4.16Å; L27-L31 VanDerWaalsContact O-CG 3.31Å; L27-L31 WeakPolarHBondContact O-CG 3.29Å; L27-L31 PolarHBondContact O-N 3.36Å; L27-M251 HydrophobicContact CD1-CE 3.8Å
28	I	40.8	Very low	37.7	Very low	75 Å²	75	103.8 Å²	103.8	39%	0.385	51%	0.51	S	S	.	.	H	α-helix	trans	-61.5	-45.4	174.5	-71	164.9	0	0	0	110.4	M24 I30 L31 L32	M24-I28 VanDerWaalsContact O-CB 3.29Å; M24-I28 WeakPolarHBondContact O-CB 3.34Å; M24-I28 WeakPolarHBondContact O-CD1 3.49Å; M24-I28 WeakPolarHBondContact O-CG1 3.42Å; M24-I28 PolarHBondContact O-N 2.76Å; I28-I30 VanDerWaalsContact C-N 3.33Å; I28-I30 PolarHBondContact O-N 3.02Å; I28-L31 PolarHBondContact O-N 3.07Å; I28-L32 HydrophobicContact CG2-CD1 3.63Å; I28-L32 HydrophobicContact CG2-CG 4.07Å; I28-L32 VanDerWaalsContact O-CB 3.31Å; I28-L32 WeakPolarHBondContact O-CB 3.31Å; I28-L32 VanDerWaalsContact O-CG 3.24Å; I28-L32 WeakPolarHBondContact O-CG 2.99Å; I28-L32 PolarHBondContact O-N 2.75Å
29	N	42.4	Very low	37.2	Very low	99 Å²	99	104.1 Å²	104.1	53%	0.529	51%	0.508	S	S	.	.	H	α-helix	trans	-66.7	-31.1	176.5	-74.7	-22.2	0	0	0	112.9	N25 Q26 S33	N25-N29 WeakPolarHBondContact O-CB 3.42Å; N25-N29 PolarHBondContact O-N 2.92Å; N25-N29 PolarHBondContact O-ND2 3.2Å; Q26-N29 PolarHBondContact O-N 2.95Å; N29-S33 WeakPolarHBondContact O-CB 3.23Å; N29-S33 PolarHBondContact O-N 3.1Å; N29-S33 PolarHBondContact O-OG 2.97Å
30	I	42.7	Very low	36.7	Very low	31 Å²	31	106.5 Å²	106.5	16%	0.159	52%	0.521	C	S	.	.	H	α-helix	trans	-65.5	-50.6	170.4	-73.1	163	0	0	0	109.5	Q26 L27 I28 L32 S33 L34 M251	Q26-I30 WeakPolarHBondContact O-CB 3.49Å; Q26-I30 WeakPolarHBondContact O-CD1 3.27Å; Q26-I30 WeakPolarHBondContact O-CG1 3.44Å; Q26-I30 PolarHBondContact O-N 3.26Å; L27-I30 PolarHBondContact O-N 2.8Å; I28-I30 VanDerWaalsContact C-N 3.33Å; I28-I30 PolarHBondContact O-N 3.02Å; I30-L32 PolarHBondContact O-N 3.01Å; I30-S33 CarbonylContact O-C 3.48Å; I30-S33 PolarHBondContact O-N 2.03Å; I30-S33 PolarHBondContact O-OG 3.43Å; I30-S33 VanDerWaalsContact O-OG 3.05Å; I30-L34 HydrophobicContact CG2-CD1 4.01Å; I30-L34 VanDerWaalsContact O-CG 3.3Å; I30-L34 WeakPolarHBondContact O-CG 3.03Å; I30-L34 PolarHBondContact O-N 3.31Å; I30-M251 HydrophobicContact CG2-CE 4.04Å; I30-M251 HydrophobicContact CG2-CG 4.2Å
31	L	35.9	Very low	36.3	Very low	83 Å²	83	105 Å²	105	44%	0.435	51%	0.512	S	S	.	.	H	α-helix	trans	-62.1	-39.9	178	-68.1	166.7	0	0	0	112.6	L27 I28 L34 R35	L27-L31 HydrophobicContact CD1-CD1 4.48Å; L27-L31 HydrophobicContact CG-CD1 4.16Å; L27-L31 VanDerWaalsContact O-CG 3.31Å; L27-L31 WeakPolarHBondContact O-CG 3.29Å; L27-L31 PolarHBondContact O-N 3.36Å; I28-L31 PolarHBondContact O-N 3.07Å; L31-L34 CarbonylContact O-C 3.58Å; L31-L34 PolarHBondContact O-N 3.44Å; L31-R35 WeakPolarHBondContact O-CB 3.24Å; L31-R35 PolarHBondContact O-N 2.98Å
32	L	37.1	Very low	35.4	Very low	79 Å²	79	101.6 Å²	101.6	41%	0.414	51%	0.506	S	S	.	.	H	α-helix	trans	-72.3	-29.9	176.1	-69.1	177.4	0	0	0	112.8	I28 I30 L34 R35	I28-L32 HydrophobicContact CG2-CD1 3.63Å; I28-L32 HydrophobicContact CG2-CG 4.07Å; I28-L32 VanDerWaalsContact O-CB 3.31Å; I28-L32 WeakPolarHBondContact O-CB 3.31Å; I28-L32 VanDerWaalsContact O-CG 3.24Å; I28-L32 WeakPolarHBondContact O-CG 2.99Å; I28-L32 PolarHBondContact O-N 2.75Å; I30-L32 PolarHBondContact O-N 3.01Å; L32-L34 VanDerWaalsContact C-N 3.3Å; L32-R35 CarbonylContact O-C 3.55Å; L32-R35 WeakPolarHBondContact O-CA 3.5Å; L32-R35 WeakPolarHBondContact O-CB 3.4Å; L32-R35 PolarHBondContact O-N 3.36Å; L32-R35 VanDerWaalsContact O-N 3.11Å
33	S	35	Very low	34.7	Very low	53 Å²	53	106.2 Å²	106.2	37%	0.371	53%	0.53	S	S	.	.	H	α-helix	trans	-83.9	-5.5	172	62.7	0	0	0	0	113.8	N29 I30 K254	N29-S33 WeakPolarHBondContact O-CB 3.23Å; N29-S33 PolarHBondContact O-N 3.1Å; N29-S33 PolarHBondContact O-OG 2.97Å; I30-S33 CarbonylContact O-C 3.48Å; I30-S33 PolarHBondContact O-N 2.03Å; I30-S33 PolarHBondContact O-OG 3.43Å; I30-S33 VanDerWaalsContact O-OG 3.05Å; S33-K254 PolarHBondContact OG-NZ 3.29Å
34	L	33	Very low	33.9	Very low	39 Å²	39	107.8 Å²	107.8	20%	0.204	54%	0.542	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	4.8	160.5	-64.5	166.3	0	0	0	111.6	I30 L31 L32 F41	I30-L34 HydrophobicContact CG2-CD1 4.01Å; I30-L34 VanDerWaalsContact O-CG 3.3Å; I30-L34 WeakPolarHBondContact O-CG 3.03Å; I30-L34 PolarHBondContact O-N 3.31Å; L31-L34 CarbonylContact O-C 3.58Å; L31-L34 PolarHBondContact O-N 3.44Å; L32-L34 VanDerWaalsContact C-N 3.3Å; L34-F41 HydrophobicContact CB-CD2 4.26Å; L34-F41 HydrophobicContact CB-CE2 4.35Å; L34-F41 HydrophobicContact CD2-CD2 4.07Å; L34-F41 HydrophobicContact CD2-CE2 3.53Å; L34-F41 HydrophobicContact CD2-CZ 4Å
35	R	32.3	Very low	33.5	Very low	174 Å²	174	110.9 Å²	110.9	66%	0.657	55%	0.547	S	S	*	.	S	Bend	trans	-116.3	17	177.8	-166.2	-162.5	167.8	-177	-2.1	111.1	L31 L32	L31-R35 WeakPolarHBondContact O-CB 3.24Å; L31-R35 PolarHBondContact O-N 2.98Å; L32-R35 CarbonylContact O-C 3.55Å; L32-R35 WeakPolarHBondContact O-CA 3.5Å; L32-R35 WeakPolarHBondContact O-CB 3.4Å; L32-R35 PolarHBondContact O-N 3.36Å; L32-R35 VanDerWaalsContact O-N 3.11Å
36	D	29	Very low	33	Very low	115 Å²	115	108.2 Å²	108.2	62%	0.615	54%	0.538	S	S	*	.	S	Bend	trans	-70.3	147.6	173.6	-154.1	-9.4	0	0	0	110.1	N38 H39	D36-N38 PolarHBondContact O-N 2.71Å; D36-H39 PolarHBondContact O-N 3.24Å
37	K	33	Very low	32.5	Very low	191 Å²	191	112 Å²	112	83%	0.83	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-11	-136.6	-66.5	-178.7	179	179.2	0	117.4
38	N	31.3	Very low	32.2	Very low	145 Å²	145	116.3 Å²	116.3	78%	0.775	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.9	2.2	-177.1	-66.3	-9.7	0	0	0	114.3	D36	D36-N38 PolarHBondContact O-N 2.71Å
39	H	28.9	Very low	31.8	Very low	130 Å²	130	117.9 Å²	117.9	60%	0.602	59%	0.593	S	S	*	*			trans	-128.6	65.2	-169.5	-63.3	-52.3	0	0	0	113.7	D36 F41	D36-H39 PolarHBondContact O-N 3.24Å; H39-F41 WeakPolarHBondContact O-CD2 3.27Å; H39-F41 PolarHBondContact O-N 3Å
40	L	26.2	Very low	31.4	Very low	119 Å²	119	116 Å²	116	62%	0.623	58%	0.582	S	S	*	*			trans	-73.9	114.5	171.6	-148.8	77.1	0	0	0	110.1	M42	L40-M42 PolarHBondContact O-N 2.95Å
41	F	28.1	Very low	30.8	Very low	136 Å²	136	119.1 Å²	119.1	60%	0.596	60%	0.598	S	S	*	*	S	Bend	trans	-71.8	10.2	178.4	-76.8	-92	0	0	0	114.5	L34 H39	L34-F41 HydrophobicContact CB-CD2 4.26Å; L34-F41 HydrophobicContact CB-CE2 4.35Å; L34-F41 HydrophobicContact CD2-CD2 4.07Å; L34-F41 HydrophobicContact CD2-CE2 3.53Å; L34-F41 HydrophobicContact CD2-CZ 4Å; H39-F41 WeakPolarHBondContact O-CD2 3.27Å; H39-F41 PolarHBondContact O-N 3Å
42	M	25.4	Very low	30.5	Very low	138 Å²	138	119.6 Å²	119.6	68%	0.68	60%	0.6	S	S	*	*	S	Bend	trans	-122.9	84.9	167.5	-62.7	-176.3	78.7	0	0	107.8	L40	L40-M42 PolarHBondContact O-N 2.95Å
43	L	26.3	Very low	30.1	Very low	152 Å²	152	121.8 Å²	121.8	80%	0.796	61%	0.607	S	S	*	*			trans	-74.7	130.6	173.7	-73.6	169	0	0	0	109.5
44	P	24.9	Very low	29.8	Very low	113 Å²	113	121.2 Å²	121.2	73%	0.734	60%	0.597	S	S	*	*			trans	-63.8	152.1	162	30.1	-33.6	0	0	0	109.3	S46	P44-S46 PolarHBondContact O-N 2.02Å
45	Y	28.6	Very low	29.5	Very low	201 Å²	201	123.8 Å²	123.8	79%	0.788	62%	0.616	S	S	*	*			trans	-59.6	111.8	176.1	-87.2	-97.2	0	0	0	110.2
46	S	29.6	Very low	29.3	Very low	60 Å²	60	120.5 Å²	120.5	42%	0.42	60%	0.604	S	S	.	*			trans	-69.6	127.6	167.4	169.4	0	0	0	0	108.5	P44 N48 D49	P44-S46 PolarHBondContact O-N 2.02Å; S46-N48 PolarHBondContact O-N 2.88Å; S46-N48 PolarHBondContact OG-N 3.35Å; S46-D49 WeakPolarHBondContact CB-OD2 2.99Å; S46-D49 PolarHBondContact O-N 2.96Å; S46-D49 PolarHBondContact OG-OD2 2.98Å
47	N	32.1	Very low	29.2	Very low	166 Å²	166	119.4 Å²	119.4	89%	0.888	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-9.8	179.5	-76.1	-17.3	0	0	0	114
48	N	33.5	Very low	28.8	Very low	143 Å²	143	120.1 Å²	120.1	77%	0.765	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	-11.6	-176.1	-63.6	-1.8	0	0	0	113.7	S46	S46-N48 PolarHBondContact O-N 2.88Å; S46-N48 PolarHBondContact OG-N 3.35Å
49	D	32.9	Very low	28.6	Very low	108 Å²	108	119.4 Å²	119.4	58%	0.578	60%	0.596	S	S	*	*	S	Bend	trans	-116.9	81.5	-167.5	-65.2	-68.4	0	0	0	113.7	S46	S46-D49 WeakPolarHBondContact CB-OD2 2.99Å; S46-D49 PolarHBondContact O-N 2.96Å; S46-D49 PolarHBondContact OG-OD2 2.98Å
50	Q	34.5	Very low	28.7	Very low	61 Å²	61	120.5 Å²	120.5	29%	0.285	61%	0.605	S	S	.	*			trans	61.7	107.6	138.7	-70.6	174.5	14	0	0	119.4	L52 N367 L369 L558	Q50-L52 PolarHBondContact O-N 3.31Å; Q50-N367 PolarHBondContact NE2-O 3.43Å; Q50-L369 HydrophobicContact CB-CD1 4.01Å; Q50-L369 HydrophobicContact CG-CB 4.1Å; Q50-L369 HydrophobicContact CG-CD1 4.34Å; Q50-L558 HydrophobicContact CG-CD1 4.36Å
51	L	29.6	Very low	28.9	Very low	96 Å²	96	121.3 Å²	121.3	50%	0.503	60%	0.601	S	S	.	*			trans	-68.7	109.7	-176.8	-59.9	112.2	0	0	0	113.8	Y54 L558	L51-Y54 HydrophobicContact CD2-CD2 3.84Å; L51-L558 HydrophobicContact CD1-CB 4.34Å
52	L	29.1	Very low	29	Very low	92 Å²	92	119 Å²	119	48%	0.482	59%	0.591	S	S	.	*	S	Bend	trans	-95.2	140.4	143.5	-97.4	68.5	0	0	0	108.8	Q50 L332	Q50-L52 PolarHBondContact O-N 3.31Å; L52-L332 HydrophobicContact CD2-CD2 4.4Å; L52-L332 HydrophobicContact CG-CD2 4.43Å
53	F	29.1	Very low	29.2	Very low	125 Å²	125	113.6 Å²	113.6	55%	0.548	57%	0.566	S	S	.	*			trans	70.4	53.1	172.8	-46.7	-68.6	0	0	0	118.5	Q331	F53-Q331 HydrophobicContact CE1-CB 3.95Å; F53-Q331 VanDerWaalsContact CE1-O 3.29Å; F53-Q331 WeakPolarHBondContact CE1-O 3.43Å; F53-Q331 HydrophobicContact CZ-CB 4.34Å
54	Y	29.6	Very low	29.4	Very low	41 Å²	41	112.6 Å²	112.6	16%	0.161	56%	0.561	C	S	.	*			trans	-88.7	124.7	158.8	-158.1	-70.4	0	0	0	110.8	L51 Y56 P63	L51-Y54 HydrophobicContact CD2-CD2 3.84Å; Y54-Y56 AromaticContact CD1-CD2 3.74Å; Y54-Y56 HydrophobicContact CD1-CD2 3.74Å; Y54-Y56 HydrophobicContact CD1-CE2 4.01Å; Y54-Y56 AromaticContact CE1-CD2 3.41Å; Y54-Y56 HydrophobicContact CE1-CD2 3.41Å; Y54-Y56 VanDerWaalsContact CE1-CD2 3.41Å; Y54-Y56 AromaticContact CE1-CE2 3.26Å; Y54-Y56 HydrophobicContact CE1-CE2 3.26Å; Y54-Y56 HydrophobicContact CE1-CG 4.35Å; Y54-Y56 AromaticContact CZ-CE2 3.94Å; Y54-P63 HydrophobicContact CE2-CG 4.39Å
55	P	26.7	Very low	30.1	Very low	94 Å²	94	116 Å²	116	61%	0.61	56%	0.559	S	S	*	*			trans	-96	143.4	175.3	35.8	-31.7	0	0	0	112.7
56	Y	27.9	Very low	30.5	Very low	104 Å²	104	111.3 Å²	111.3	41%	0.408	54%	0.543	S	S	.	.			trans	-136.4	176.7	172.8	-114.1	-61.1	0	0	0	113.2	Y54 M418 D563	Y54-Y56 AromaticContact CD1-CD2 3.74Å; Y54-Y56 HydrophobicContact CD1-CD2 3.74Å; Y54-Y56 HydrophobicContact CD1-CE2 4.01Å; Y54-Y56 AromaticContact CE1-CD2 3.41Å; Y54-Y56 HydrophobicContact CE1-CD2 3.41Å; Y54-Y56 VanDerWaalsContact CE1-CD2 3.41Å; Y54-Y56 AromaticContact CE1-CE2 3.26Å; Y54-Y56 HydrophobicContact CE1-CE2 3.26Å; Y54-Y56 HydrophobicContact CE1-CG 4.35Å; Y54-Y56 AromaticContact CZ-CE2 3.94Å; Y56-M418 HydrophobicContact CD1-CE 4.12Å; Y56-M418 HydrophobicContact CD1-SD 4.03Å; Y56-M418 HydrophobicContact CD2-SD 3.96Å; Y56-M418 HydrophobicContact CE1-CE 3.54Å; Y56-M418 HydrophobicContact CE1-SD 3.58Å; Y56-M418 VanDerWaalsContact CE1-SD 3.58Å; Y56-M418 HydrophobicContact CE2-SD 3.46Å; Y56-M418 WeakPolarHBondContact CE2-SD 3.37Å; Y56-M418 HydrophobicContact CG-SD 4.25Å; Y56-D563 WeakPolarHBondContact CB-OD2 3.45Å
57	H	25.5	Very low	30.7	Very low	92 Å²	92	110.8 Å²	110.8	43%	0.426	54%	0.535	S	S	.	.	S	Bend	trans	75	42.8	-177.9	-80.9	31.8	0	0	0	119	D563	H57-D563 IonicContact CE1-OD1 2.69Å; H57-D563 PolarHBondContact CE1-OD1 2.9Å; H57-D563 IonicContact CE1-OD2 2.82Å; H57-D563 PolarHBondContact CE1-OD2 3.26Å; H57-D563 IonicContact CG-OD2 2.67Å; H57-D563 VanDerWaalsContact ND1-CG 3.34Å; H57-D563 IonicContact ND1-OD1 2.84Å; H57-D563 IonicContact ND1-OD2 3.14Å; H57-D563 PolarHBondContact ND1-OD2 3.19Å
58	R	24.3	Very low	30.8	Very low	206 Å²	206	106.8 Å²	106.8	78%	0.777	51%	0.514	S	S	*	.	S	Bend	trans	-149.3	149.6	144.9	-78.7	-153.2	-178.1	-154.5	-1.2	111	L60	R58-L60 PolarHBondContact O-N 2.98Å
59	P	28.3	Very low	30.7	Very low	130 Å²	130	107.5 Å²	107.5	84%	0.844	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	13.1	-164.3	31.4	-37.9	0	0	0	116.7
60	L	30.2	Very low	30.9	Very low	153 Å²	153	106.9 Å²	106.9	80%	0.801	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.6	-2.1	-167.8	-69.8	171.1	0	0	0	115.5	R58	R58-L60 PolarHBondContact O-N 2.98Å
61	Y	31.1	Very low	30.8	Very low	136 Å²	136	111.3 Å²	111.3	53%	0.533	53%	0.527	S	S	.	.			trans	-110.2	97.2	-173.5	-70.2	-77	0	0	0	113.4	E230	Y61-E230 WeakPolarHBondContact CE1-OE1 3.29Å
62	K	30.5	Very low	31	Very low	88 Å²	88	110.5 Å²	110.5	38%	0.383	52%	0.523	S	S	.	.			trans	-83.3	132.6	149.1	-76.4	179.1	169.2	-171.9	0	107.8	K66 L67	K62-K66 HydrophobicContact CB-CB 4.23Å; K62-L67 HydrophobicContact CB-CD2 4.04Å
63	P	29.7	Very low	31.1	Very low	25 Å²	25	113.7 Å²	113.7	16%	0.162	53%	0.529	C	S	.	.			trans	-63.2	157.1	171.3	28.2	-35.2	0	0	0	110.5	Y54 W65 K66	Y54-P63 HydrophobicContact CE2-CG 4.39Å; P63-W65 HydrophobicContact CB-CD2 3.86Å; P63-W65 HydrophobicContact CB-CE3 3.9Å; P63-W65 HydrophobicContact CB-CH2 3.55Å; P63-W65 HydrophobicContact CB-CZ2 3.48Å; P63-W65 VanDerWaalsContact CB-CZ2 3.48Å; P63-W65 HydrophobicContact CB-CZ3 3.75Å; P63-W65 HydrophobicContact CG-CD2 4.21Å; P63-W65 HydrophobicContact CG-CH2 4.34Å; P63-W65 HydrophobicContact CG-CZ2 3.77Å; P63-W65 PolarHBondContact O-N 2.74Å; P63-K66 HydrophobicContact CG-CB 4.08Å; P63-K66 HydrophobicContact CG-CD 4.11Å; P63-K66 HydrophobicContact CG-CG 4.03Å; P63-K66 PolarHBondContact O-N 2.91Å
64	L	28.9	Very low	31.1	Very low	130 Å²	130	117.8 Å²	117.8	68%	0.681	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-54.3	-33.6	-169.3	-126.4	75.8	0	0	0	114	K66 L67	L64-K66 VanDerWaalsContact C-N 3.34Å; L64-L67 HydrophobicContact CD1-CD1 4.07Å; L64-L67 HydrophobicContact CG-CD1 4.1Å; L64-L67 WeakPolarHBondContact O-CB 3.46Å; L64-L67 PolarHBondContact O-N 2.94Å
65	W	41.1	Very low	31	Very low	185 Å²	185	120 Å²	120	70%	0.701	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-80.6	-5.4	178.4	61.6	90.8	0	0	0	115	P63	P63-W65 HydrophobicContact CB-CD2 3.86Å; P63-W65 HydrophobicContact CB-CE3 3.9Å; P63-W65 HydrophobicContact CB-CH2 3.55Å; P63-W65 HydrophobicContact CB-CZ2 3.48Å; P63-W65 VanDerWaalsContact CB-CZ2 3.48Å; P63-W65 HydrophobicContact CB-CZ3 3.75Å; P63-W65 HydrophobicContact CG-CD2 4.21Å; P63-W65 HydrophobicContact CG-CH2 4.34Å; P63-W65 HydrophobicContact CG-CZ2 3.77Å; P63-W65 PolarHBondContact O-N 2.74Å
66	K	35.4	Very low	31	Very low	103 Å²	103	122.2 Å²	122.2	45%	0.448	57%	0.571	S	S	.	*	G	3₁₀ helix	trans	-101.1	7	169.2	-76.3	-168.2	172.2	-173.1	0	112.6	K62 P63 L64	K62-K66 HydrophobicContact CB-CB 4.23Å; P63-K66 HydrophobicContact CG-CB 4.08Å; P63-K66 HydrophobicContact CG-CD 4.11Å; P63-K66 HydrophobicContact CG-CG 4.03Å; P63-K66 PolarHBondContact O-N 2.91Å; L64-K66 VanDerWaalsContact C-N 3.34Å
67	L	34.4	Very low	31	Very low	48 Å²	48	128.5 Å²	128.5	25%	0.251	60%	0.596	S	S	.	*	S	Bend	trans	-82.2	143.3	174.5	-62	177.2	0	0	0	111.2	K62 L64 Y71	K62-L67 HydrophobicContact CB-CD2 4.04Å; L64-L67 HydrophobicContact CD1-CD1 4.07Å; L64-L67 HydrophobicContact CG-CD1 4.1Å; L64-L67 WeakPolarHBondContact O-CB 3.46Å; L64-L67 PolarHBondContact O-N 2.94Å; L67-Y71 HydrophobicContact CB-CD2 4.05Å; L67-Y71 HydrophobicContact CB-CG 4.03Å; L67-Y71 HydrophobicContact CD1-CD1 4.21Å; L67-Y71 HydrophobicContact CD1-CD2 4.24Å; L67-Y71 HydrophobicContact CD1-CG 3.88Å
68	N	34.4	Very low	30.9	Very low	82 Å²	82	128.6 Å²	128.6	44%	0.439	61%	0.607	S	S	.	*	P	Polyproline II helix	trans	-69.6	170	175.4	-68.5	28.1	0	0	0	110.7	Y71	N68-Y71 WeakPolarHBondContact O-CB 3.23Å; N68-Y71 WeakPolarHBondContact O-CD2 3.45Å; N68-Y71 PolarHBondContact O-N 2.97Å; N68-Y71 VanDerWaalsContact O-N 3.1Å
69	K	32.2	Very low	31	Very low	159 Å²	159	128.4 Å²	128.4	69%	0.691	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.9	141	172.7	-69.4	179.7	-178.9	175.9	0	110.3	L72	K69-L72 HydrophobicContact CG-CB 4.12Å; K69-L72 HydrophobicContact CG-CD2 4.31Å
70	P	35.7	Very low	30.9	Very low	94 Å²	94	128.1 Å²	128.1	61%	0.61	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	cis	-81.8	-8	14.2	32.7	-37.3	0	0	0	116.1	L72	P70-L72 PolarHBondContact O-N 2.81Å
71	Y	32.9	Very low	30.6	Very low	154 Å²	154	127.5 Å²	127.5	60%	0.604	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	3.3	-167.8	-57	-77.7	0	0	0	116.2	L67 N68	L67-Y71 HydrophobicContact CB-CD2 4.05Å; L67-Y71 HydrophobicContact CB-CG 4.03Å; L67-Y71 HydrophobicContact CD1-CD1 4.21Å; L67-Y71 HydrophobicContact CD1-CD2 4.24Å; L67-Y71 HydrophobicContact CD1-CG 3.88Å; N68-Y71 WeakPolarHBondContact O-CB 3.23Å; N68-Y71 WeakPolarHBondContact O-CD2 3.45Å; N68-Y71 PolarHBondContact O-N 2.97Å; N68-Y71 VanDerWaalsContact O-N 3.1Å
72	L	33.8	Very low	30.3	Very low	80 Å²	80	128.2 Å²	128.2	42%	0.419	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.2	-14.7	-173.7	-154.6	72.4	0	0	0	114.5	K69 P70 F74 S75	K69-L72 HydrophobicContact CG-CB 4.12Å; K69-L72 HydrophobicContact CG-CD2 4.31Å; P70-L72 PolarHBondContact O-N 2.81Å; L72-F74 VanDerWaalsContact C-N 3.34Å; L72-F74 PolarHBondContact O-N 3.2Å; L72-S75 PolarHBondContact O-OG 3.31Å
73	Y	31.1	Very low	30.1	Very low	158 Å²	158	135.2 Å²	135.2	62%	0.62	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-72.1	-11.3	-160	-111	-89.3	0	0	0	117.1	S75	Y73-S75 PolarHBondContact O-N 2.65Å
74	F	29.8	Very low	30.1	Very low	211 Å²	211	142 Å²	142	93%	0.925	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-91.4	20.2	-172.7	-71.5	-76.3	0	0	0	115.2	L72	L72-F74 VanDerWaalsContact C-N 3.34Å; L72-F74 PolarHBondContact O-N 3.2Å
75	S	27	Very low	30.1	Very low	87 Å²	87	141.7 Å²	141.7	61%	0.608	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-122.5	0.6	-165.6	59.5	0	0	0	0	116.4	L72 Y73	L72-S75 PolarHBondContact O-OG 3.31Å; Y73-S75 PolarHBondContact O-N 2.65Å
76	Q	26	Very low	29.4	Very low	142 Å²	142	138.1 Å²	138.1	66%	0.664	68%	0.682	S	S	*	*			trans	-107	9.6	-156.1	-79.4	-169.6	-42.4	0	0	118.6
77	Y	28.1	Very low	29	Very low	235 Å²	235	139.3 Å²	139.3	92%	0.922	70%	0.698	S	S	*	*			trans	-110.4	115.1	176.1	-67.9	-71.6	0	0	0	112.4
78	S	23.6	Very low	28.7	Very low	94 Å²	94	142 Å²	142	66%	0.657	72%	0.721	S	S	*	*			trans	-120.4	-168.1	-176.1	-73.6	0	0	0	0	111.9
79	F	25.8	Very low	28.6	Very low	202 Å²	202	143 Å²	143	89%	0.886	73%	0.734	S	S	*	*			trans	91.6	139.2	170	-47.5	-62.7	0	0	0	117.2
80	P	26.9	Very low	28.6	Very low	125 Å²	125	140.4 Å²	140.4	81%	0.812	74%	0.736	S	S	*	*			cis	-127.5	173.3	-29.3	37.5	-21.8	0	0	0	113.6
81	N	24.2	Very low	28.6	Very low	140 Å²	140	141 Å²	141	75%	0.749	74%	0.743	S	S	*	*			trans	-81.7	144.1	-179.2	-179	10.2	0	0	0	112.5	Y83	N81-Y83 PolarHBondContact OD1-N 3.16Å; N81-Y83 VanDerWaalsContact OD1-N 3.17Å
82	L	25.1	Very low	28.7	Very low	150 Å²	150	138.4 Å²	138.4	79%	0.785	75%	0.747	S	S	*	*			trans	-153.1	48.5	168.1	-121.3	176.3	0	0	0	115.2	Q84	L82-Q84 HydrophobicContact CD2-CB 4.34Å; L82-Q84 PolarHBondContact O-N 3.31Å
83	Y	26.4	Very low	28.7	Very low	235 Å²	235	140 Å²	140	92%	0.922	76%	0.764	S	S	*	*			trans	-81.5	86.1	156.8	-96.5	-74.3	0	0	0	110.4	N81	N81-Y83 PolarHBondContact OD1-N 3.16Å; N81-Y83 VanDerWaalsContact OD1-N 3.17Å
84	Q	30.2	Very low	28.8	Very low	168 Å²	168	137.6 Å²	137.6	79%	0.785	77%	0.771	S	S	*	*			trans	-121.5	140.9	163.2	-151.3	170.4	17	0	0	110.4	L82	L82-Q84 HydrophobicContact CD2-CB 4.34Å; L82-Q84 PolarHBondContact O-N 3.31Å
85	T	27.3	Very low	29	Very low	124 Å²	124	132.2 Å²	132.2	76%	0.761	76%	0.76	S	S	*	*			trans	-63	145.4	-165.1	44	0	0	0	0	114.9
86	S	26.6	Very low	29.3	Very low	109 Å²	109	133.1 Å²	133.1	76%	0.762	77%	0.766	S	S	*	*			trans	-42.1	127.5	165.4	51.4	0	0	0	0	115.6
87	T	26.8	Very low	29.6	Very low	129 Å²	129	131 Å²	131	79%	0.791	77%	0.767	S	S	*	*			trans	-164.1	124.3	138.8	13.4	0	0	0	0	113.2
88	S	29.5	Very low	29.9	Very low	105 Å²	105	125 Å²	125	73%	0.734	76%	0.759	S	S	*	*			trans	55.2	140.9	148.5	52.6	0	0	0	0	124.6
89	S	32.1	Very low	30.2	Very low	102 Å²	102	124.9 Å²	124.9	71%	0.713	76%	0.758	S	S	*	*			trans	76.3	91.4	145	43	0	0	0	0	123.5
90	S	32.7	Very low	30.5	Very low	104 Å²	104	118.5 Å²	118.5	73%	0.727	74%	0.739	S	S	*	*				70.2	133.3	117.5	60.8	0	0	0	0	125.3
91	S	35.2	Very low	30.5	Very low	107 Å²	107	117.9 Å²	117.9	75%	0.748	73%	0.728	S	S	*	*			trans	68.4	144.2	148	44.7	0	0	0	0	121
92	S	34.3	Very low	30.7	Very low	100 Å²	100	114.4 Å²	114.4	70%	0.699	72%	0.715	S	S	*	*			cis	-175.1	153	-15.7	47.7	0	0	0	0	112.8
93	S	34.4	Very low	30.8	Very low	112 Å²	112	110.2 Å²	110.2	78%	0.783	70%	0.698	S	S	*	*			trans	61.2	158.5	157.8	46.3	0	0	0	0	119.1
94	S	33.9	Very low	31	Very low	109 Å²	109	105 Å²	105	76%	0.762	70%	0.696	S	S	*	*			cis	179.8	160.7	-15.3	50.5	0	0	0	0	108.5
95	S	33.7	Very low	30.8	Very low	97 Å²	97	102.8 Å²	102.8	68%	0.678	70%	0.699	S	S	*	*			cis	-176.3	179.7	-18.2	56	0	0	0	0	109.9
96	S	33.1	Very low	30.9	Very low	106 Å²	106	102 Å²	102	74%	0.741	70%	0.699	S	S	*	*			trans	65.7	150.7	154.5	36.1	0	0	0	0	120.9
97	S	32.7	Very low	30.9	Very low	99 Å²	99	101.9 Å²	101.9	69%	0.692	70%	0.698	S	S	*	*			cis	-176.1	157.6	-18.7	50.9	0	0	0	0	113.4
98	S	32.4	Very low	30.9	Very low	108 Å²	108	104.3 Å²	104.3	76%	0.755	71%	0.705	S	S	*	*			trans	60.8	153.8	148.6	48.7	0	0	0	0	122.2
99	S	31.6	Very low	30.7	Very low	91 Å²	91	104.1 Å²	104.1	64%	0.636	70%	0.704	S	S	*	*			cis	-171.4	161.9	-18.5	55.7	0	0	0	0	115
100	S	30.5	Very low	30.3	Very low	68 Å²	68	104.9 Å²	104.9	48%	0.476	71%	0.709	S	S	.	*			trans	69.7	120.8	134.8	60.5	0	0	0	0	126.1	Q162	S100-Q162 VanDerWaalsContact C-CD 3.48Å; S100-Q162 VanDerWaalsContact CA-OE1 3.3Å; S100-Q162 VanDerWaalsContact N-OE1 3.14Å; S100-Q162 PolarHBondContact O-NE2 3.34Å
101	L	27.6	Very low	29.9	Very low	113 Å²	113	107.1 Å²	107.1	59%	0.592	71%	0.711	S	S	*	*			trans	65.7	157	134.6	-83	81.4	0	0	0	120.4	N159	L101-N159 HydrophobicContact CG-CB 4.37Å
102	S	28.2	Very low	29.4	Very low	67 Å²	67	108.5 Å²	108.5	47%	0.469	71%	0.709	S	S	.	*			cis	-169	140.7	-16.1	50.5	0	0	0	0	115.2	N159	S102-N159 WeakPolarHBondContact CB-ND2 3.36Å
103	S	28.3	Very low	29	Very low	62 Å²	62	110.9 Å²	110.9	43%	0.434	71%	0.714	S	S	.	*			trans	42.1	128.2	140.7	65.2	0	0	0	0	124.1	N159 T161	S103-N159 WeakPolarHBondContact CB-OD1 3.42Å; S103-T161 PolarHBondContact N-OG1 2.77Å
104	S	29.2	Very low	28.5	Very low	126 Å²	126	112.4 Å²	112.4	88%	0.881	71%	0.711	S	S	*	*				-174.8	165.2	125.2	36.7	0	0	0	0	111
105	S	27.2	Very low	28	Very low	121 Å²	121	116.3 Å²	116.3	85%	0.846	71%	0.714	S	S	*	*			trans	-151.3	141.6	-161.3	58.8	0	0	0	0	116
106	S	29.3	Very low	27.7	Very low	108 Å²	108	119.6 Å²	119.6	76%	0.755	72%	0.716	S	S	*	*			trans	-152.8	125.4	156.5	46.9	0	0	0	0	107.9
107	S	27	Very low	27.3	Very low	106 Å²	106	121.4 Å²	121.4	74%	0.741	72%	0.716	S	S	*	*			cis	85.1	100	43.1	79.4	0	0	0	0	114.3
108	L	25.6	Very low	27	Very low	180 Å²	180	125.7 Å²	125.7	94%	0.942	72%	0.723	S	S	*	*			trans	-166.3	164.4	140.4	-106.3	159.9	0	0	0	110.6
109	S	24.9	Very low	26.9	Very low	101 Å²	101	127 Å²	127	71%	0.706	72%	0.721	S	S	*	*			trans	-140.8	150.2	-154.6	58.2	0	0	0	0	114.3
110	S	25	Very low	26.8	Very low	117 Å²	117	130.2 Å²	130.2	82%	0.818	73%	0.731	S	S	*	*			trans	-156.5	101.1	158.9	-70.6	0	0	0	0	114.4
111	I	24.1	Very low	26.5	Very low	152 Å²	152	133.7 Å²	133.7	78%	0.779	74%	0.743	S	S	*	*			trans	31.4	118.1	136.9	-50.9	171.2	0	0	0	119
112	L	24.7	Very low	26.4	Very low	135 Å²	135	133.6 Å²	133.6	71%	0.707	74%	0.742	S	S	*	*			trans	-114	141.9	158.5	-142.9	87.9	0	0	0	110.6
113	N	25.1	Very low	26.2	Very low	151 Å²	151	138 Å²	138	81%	0.807	76%	0.76	S	S	*	*			trans	-102.3	132.7	178.2	-86.8	-74.6	0	0	0	111.8
114	M	24.3	Very low	26.1	Very low	143 Å²	143	140.6 Å²	140.6	70%	0.704	77%	0.767	S	S	*	*			trans	-106.4	142.3	175.9	-75.5	-175.3	162	0	0	112.4
115	K	24.3	Very low	25.9	Very low	192 Å²	192	143.9 Å²	143.9	84%	0.835	77%	0.766	S	S	*	*			trans	-150.7	116.7	171.7	-171.4	-175.4	177.9	-165.9	0	110.7
116	F	25.8	Very low	25.7	Very low	165 Å²	165	146.3 Å²	146.3	72%	0.724	76%	0.764	S	S	*	*			trans	-81.1	149	177.3	-73.3	-96	0	0	0	112.4
117	I	25.9	Very low	25.4	Very low	144 Å²	144	146.2 Å²	146.2	74%	0.738	76%	0.763	S	S	*	*			trans	-131.8	159	163.7	-61.7	-177.6	0	0	0	106.8
118	K	26.7	Very low	25.4	Very low	190 Å²	190	147.9 Å²	147.9	83%	0.826	77%	0.769	S	S	*	*	S	Bend	trans	-55.1	158.1	-177.7	-100.7	-175.4	171.1	-172	0	113.3
119	N	28.9	Very low	25.5	Very low	135 Å²	135	149.7 Å²	149.7	72%	0.722	77%	0.765	S	S	*	*	S	Bend	trans	76.5	38	174.2	-56.2	12.9	0	0	0	115.7	I121	N119-I121 PolarHBondContact O-N 2.88Å
120	D	29.8	Very low	25.5	Very low	158 Å²	158	151.7 Å²	151.7	85%	0.845	77%	0.768	S	S	*	*	S	Bend	trans	51.6	13.4	156.9	-66.5	5.1	0	0	0	119.7
121	I	24.3	Very low	25.6	Very low	141 Å²	141	151 Å²	151	72%	0.723	76%	0.762	S	S	*	*			trans	-88	115.2	171.3	-65.2	169.7	0	0	0	110.1	N119 L123	N119-I121 PolarHBondContact O-N 2.88Å; I121-L123 HydrophobicContact CG2-CD1 4.38Å; I121-L123 HydrophobicContact CG2-CG 4.09Å
122	L	26.3	Very low	25.6	Very low	112 Å²	112	149.9 Å²	149.9	59%	0.586	77%	0.768	S	S	*	*			trans	-98.2	89.4	174.8	-173	72.2	0	0	0	111.3	I124	L122-I124 HydrophobicContact CD2-CD1 4.22Å; L122-I124 HydrophobicContact CD2-CG1 4.42Å; L122-I124 HydrophobicContact CG-CG1 4.22Å; L122-I124 PolarHBondContact O-N 2.68Å
123	L	23.9	Very low	25.5	Very low	159 Å²	159	148 Å²	148	83%	0.832	76%	0.758	S	S	*	*			trans	-80.1	112.1	169.6	-80.5	162.8	0	0	0	110.7	I121	I121-L123 HydrophobicContact CG2-CD1 4.38Å; I121-L123 HydrophobicContact CG2-CG 4.09Å
124	I	26.6	Very low	25.3	Very low	116 Å²	116	150.1 Å²	150.1	60%	0.595	76%	0.76	S	S	*	*			trans	-101.6	116.1	166.1	-56.6	180	0	0	0	107.6	L122	L122-I124 HydrophobicContact CD2-CD1 4.22Å; L122-I124 HydrophobicContact CD2-CG1 4.42Å; L122-I124 HydrophobicContact CG-CG1 4.22Å; L122-I124 PolarHBondContact O-N 2.68Å
125	K	23.3	Very low	25.3	Very low	196 Å²	196	152 Å²	152	85%	0.852	76%	0.76	S	S	*	*			trans	-106.9	105.3	175.9	-177.1	178.2	-179.3	177.3	0	109.3
126	E	24.9	Very low	25.3	Very low	172 Å²	172	149.6 Å²	149.6	80%	0.804	76%	0.756	S	S	*	*			trans	-94.4	146.5	163.7	-170.8	157.3	-144.7	0	0	109.2
127	S	22.9	Very low	25.2	Very low	105 Å²	105	148 Å²	148	73%	0.734	75%	0.753	S	S	*	*			trans	-125.1	105.8	-171.5	59.3	0	0	0	0	111.9
128	T	27	Very low	25	Very low	141 Å²	141	147.5 Å²	147.5	87%	0.865	75%	0.751	S	S	*	*			trans	-122.5	161.9	165	46.9	0	0	0	0	109.9
129	Y	26	Very low	24.9	Very low	219 Å²	219	144.5 Å²	144.5	86%	0.859	74%	0.74	S	S	*	*			trans	-92.6	143.3	-161.3	-127.2	-101.8	0	0	0	113
130	N	26.3	Very low	24.9	Very low	143 Å²	143	144.8 Å²	144.8	77%	0.765	74%	0.742	S	S	*	*	S	Bend	trans	64.4	155.2	172.9	-71.5	-14.9	0	0	0	118.2
131	S	27.6	Very low	24.9	Very low	101 Å²	101	144.8 Å²	144.8	71%	0.706	73%	0.734	S	S	*	*			trans	63.7	98.3	-178.1	-158.1	0	0	0	0	116.2	I133	S131-I133 PolarHBondContact O-N 3.12Å
132	S	22.7	Very low	25.1	Very low	129 Å²	129	141.2 Å²	141.2	90%	0.902	72%	0.719	S	S	*	*			trans	-80.2	90.7	174.8	54.4	0	0	0	0	111.8
133	I	23	Very low	25.3	Very low	95 Å²	95	141.4 Å²	141.4	49%	0.487	72%	0.72	S	S	.	*			trans	-105	119.3	172.3	-54.7	174.8	0	0	0	109.7	S131 Y135	S131-I133 PolarHBondContact O-N 3.12Å; I133-Y135 HydrophobicContact CB-CD2 4.17Å; I133-Y135 HydrophobicContact CB-CE2 3.67Å; I133-Y135 HydrophobicContact CD1-CE2 4.34Å; I133-Y135 WeakPolarHBondContact CD1-OH 3.47Å; I133-Y135 HydrophobicContact CG2-CD1 4.19Å; I133-Y135 HydrophobicContact CG2-CD2 3.9Å; I133-Y135 HydrophobicContact CG2-CE1 3.82Å; I133-Y135 HydrophobicContact CG2-CE2 3.52Å; I133-Y135 HydrophobicContact CG2-CG 4.23Å; I133-Y135 VanDerWaalsContact CG2-CZ 3.48Å; I133-Y135 PolarHBondContact O-N 3.42Å
134	K	21.4	Very low	25.8	Very low	197 Å²	197	140.7 Å²	140.7	86%	0.857	71%	0.711	S	S	*	*			trans	-76.1	95.9	168.9	-81.2	-174.9	175	-179.3	0	109.4	I136	K134-I136 PolarHBondContact O-N 2.99Å
135	Y	24.1	Very low	26.2	Very low	181 Å²	181	137.7 Å²	137.7	71%	0.71	70%	0.696	S	S	*	*			trans	-80.7	108	167.3	-68.6	-72.9	0	0	0	110.5	I133	I133-Y135 HydrophobicContact CB-CD2 4.17Å; I133-Y135 HydrophobicContact CB-CE2 3.67Å; I133-Y135 HydrophobicContact CD1-CE2 4.34Å; I133-Y135 WeakPolarHBondContact CD1-OH 3.47Å; I133-Y135 HydrophobicContact CG2-CD1 4.19Å; I133-Y135 HydrophobicContact CG2-CD2 3.9Å; I133-Y135 HydrophobicContact CG2-CE1 3.82Å; I133-Y135 HydrophobicContact CG2-CE2 3.52Å; I133-Y135 HydrophobicContact CG2-CG 4.23Å; I133-Y135 VanDerWaalsContact CG2-CZ 3.48Å; I133-Y135 PolarHBondContact O-N 3.42Å
136	I	23.2	Very low	26.7	Very low	143 Å²	143	131.6 Å²	131.6	73%	0.733	67%	0.672	S	S	*	*			trans	-103.5	134.4	161.4	-67.6	174.5	0	0	0	106	K134	K134-I136 PolarHBondContact O-N 2.99Å
137	L	23.5	Very low	27.1	Very low	130 Å²	130	130 Å²	130	68%	0.681	66%	0.66	S	S	*	*			trans	64.6	161.2	-164.9	-58.7	161.1	0	0	0	110.4
138	I	22.8	Very low	27.7	Very low	135 Å²	135	127.5 Å²	127.5	69%	0.692	64%	0.64	S	S	*	*				-144.3	115.7	53.5	-78.6	163.3	0	0	0	107.2
139	E	24.6	Very low	28	Very low	126 Å²	126	125.1 Å²	125.1	59%	0.589	62%	0.622	S	S	*	*				71.5	158.3	103.3	-60.1	168.1	176.3	0	0	115.1
140	N	29	Very low	28.4	Very low	142 Å²	142	117 Å²	117	76%	0.759	59%	0.594	S	S	*	*			trans	58.6	62.8	177.1	-58.7	-26.7	0	0	0	117.2
141	F	29.1	Very low	28.7	Very low	157 Å²	157	115 Å²	115	69%	0.689	58%	0.582	S	S	*	*			trans	-129.2	85.8	155.8	-158.4	-86.9	0	0	0	110.6	L146	F141-L146 HydrophobicContact CE1-CB 4.28Å; F141-L146 HydrophobicContact CE1-CD1 4.19Å; F141-L146 HydrophobicContact CZ-CD1 4.38Å
142	T	29.6	Very low	28.9	Very low	67 Å²	67	116 Å²	116	41%	0.411	58%	0.579	S	S	.	*			trans	-84.2	165.6	-176.8	71.5	0	0	0	0	112.2	F144 D145 L146	T142-F144 PolarHBondContact O-N 2.85Å; T142-F144 WeakPolarHBondContact OG1-CB 3.38Å; T142-F144 PolarHBondContact OG1-N 3.06Å; T142-D145 WeakPolarHBondContact CA-OD2 3.46Å; T142-D145 VanDerWaalsContact CB-OD2 3.28Å; T142-D145 WeakPolarHBondContact CB-OD2 3.45Å; T142-D145 WeakPolarHBondContact CG2-OD2 2.99Å; T142-D145 PolarHBondContact N-OD2 2.81Å; T142-D145 PolarHBondContact O-N 2.95Å; T142-D145 VanDerWaalsContact OG1-CG 3.23Å; T142-D145 PolarHBondContact OG1-N 3.05Å; T142-D145 PolarHBondContact OG1-OD2 3.24Å; T142-L146 PolarHBondContact O-N 2.93Å; T142-L146 VanDerWaalsContact O-N 3.12Å
143	L	30.8	Very low	29.3	Very low	116 Å²	116	118.4 Å²	118.4	61%	0.607	57%	0.573	S	S	*	*	H	α-helix	trans	-62.5	-26.2	169	-167.7	67.8	0	0	0	111.7	L3 L146 Y147	L3-L143 HydrophobicContact CD2-CD1 4.21Å; L143-L146 HydrophobicContact CD1-CD2 4.12Å; L143-Y147 WeakPolarHBondContact O-CB 3.07Å; L143-Y147 PolarHBondContact O-N 3.22Å
144	F	33.9	Very low	29.6	Very low	144 Å²	144	120 Å²	120	63%	0.632	58%	0.577	S	S	*	*	H	α-helix	trans	-68.7	-42.4	173.1	-174.7	-92.3	0	0	0	111.2	T142 L146 Y147 T148	T142-F144 PolarHBondContact O-N 2.85Å; T142-F144 WeakPolarHBondContact OG1-CB 3.38Å; T142-F144 PolarHBondContact OG1-N 3.06Å; F144-L146 VanDerWaalsContact C-N 3.31Å; F144-L146 PolarHBondContact O-N 3.39Å; F144-Y147 CarbonylContact O-C 3.48Å; F144-Y147 PolarHBondContact O-N 3.22Å; F144-T148 WeakPolarHBondContact O-CB 3.49Å; F144-T148 PolarHBondContact O-N 3.24Å; F144-T148 PolarHBondContact O-OG1 2.75Å
145	D	34.6	Very low	29.9	Very low	52 Å²	52	114.2 Å²	114.2	28%	0.278	57%	0.566	S	S	.	*	H	α-helix	trans	-63	-38.8	175.2	-56.8	-54.7	0	0	0	111.7	T142 N149	T142-D145 WeakPolarHBondContact CA-OD2 3.46Å; T142-D145 VanDerWaalsContact CB-OD2 3.28Å; T142-D145 WeakPolarHBondContact CB-OD2 3.45Å; T142-D145 WeakPolarHBondContact CG2-OD2 2.99Å; T142-D145 PolarHBondContact N-OD2 2.81Å; T142-D145 PolarHBondContact O-N 2.95Å; T142-D145 VanDerWaalsContact OG1-CG 3.23Å; T142-D145 PolarHBondContact OG1-N 3.05Å; T142-D145 PolarHBondContact OG1-OD2 3.24Å; D145-N149 VanDerWaalsContact O-CB 3.28Å; D145-N149 WeakPolarHBondContact O-CB 3.32Å; D145-N149 PolarHBondContact O-N 3.06Å; D145-N149 PolarHBondContact O-ND2 2.82Å
146	L	33.8	Very low	30	Very low	69 Å²	69	108.3 Å²	108.3	36%	0.361	56%	0.56	S	S	.	*	H	α-helix	trans	-61.4	-45.3	170.5	-171.1	75	0	0	0	111.2	L3 F141 T142 L143 F144 L150	L3-L146 HydrophobicContact CD2-CD2 4.19Å; F141-L146 HydrophobicContact CE1-CB 4.28Å; F141-L146 HydrophobicContact CE1-CD1 4.19Å; F141-L146 HydrophobicContact CZ-CD1 4.38Å; T142-L146 PolarHBondContact O-N 2.93Å; T142-L146 VanDerWaalsContact O-N 3.12Å; L143-L146 HydrophobicContact CD1-CD2 4.12Å; F144-L146 VanDerWaalsContact C-N 3.31Å; F144-L146 PolarHBondContact O-N 3.39Å; L146-L150 WeakPolarHBondContact O-CB 3.34Å; L146-L150 PolarHBondContact O-N 3.03Å
147	Y	33.6	Very low	30.2	Very low	139 Å²	139	109.6 Å²	109.6	55%	0.545	57%	0.568	S	S	.	*	H	α-helix	trans	-67.2	-42.3	-178.3	-149.9	-101.7	0	0	0	112.2	L143 F144 L150 L151	L143-Y147 WeakPolarHBondContact O-CB 3.07Å; L143-Y147 PolarHBondContact O-N 3.22Å; F144-Y147 CarbonylContact O-C 3.48Å; F144-Y147 PolarHBondContact O-N 3.22Å; Y147-L150 PolarHBondContact O-N 2.77Å; Y147-L151 HydrophobicContact CD1-CD1 3.63Å; Y147-L151 HydrophobicContact CD1-CG 4.26Å; Y147-L151 HydrophobicContact CE1-CD1 3.81Å; Y147-L151 HydrophobicContact CE1-CG 4.4Å; Y147-L151 WeakPolarHBondContact O-CB 3.34Å; Y147-L151 VanDerWaalsContact O-CG 3.3Å; Y147-L151 WeakPolarHBondContact O-CG 3.43Å; Y147-L151 PolarHBondContact O-N 3.05Å
148	T	36.1	Very low	30.5	Very low	51 Å²	51	111.1 Å²	111.1	31%	0.313	58%	0.575	S	S	.	*	H	α-helix	trans	-68.5	-44.5	177.4	-62.2	0	0	0	0	110.9	F144 L150 L151 L152	F144-T148 WeakPolarHBondContact O-CB 3.49Å; F144-T148 PolarHBondContact O-N 3.24Å; F144-T148 PolarHBondContact O-OG1 2.75Å; T148-L150 VanDerWaalsContact C-N 3.29Å; T148-L150 PolarHBondContact O-N 2.7Å; T148-L151 PolarHBondContact O-N 3.5Å; T148-L152 HydrophobicContact CG2-CD1 3.97Å; T148-L152 HydrophobicContact CG2-CG 4.49Å; T148-L152 WeakPolarHBondContact O-CB 3.16Å; T148-L152 VanDerWaalsContact O-CG 3.24Å; T148-L152 WeakPolarHBondContact O-CG 3.39Å; T148-L152 PolarHBondContact O-N 2.87Å
149	N	33.2	Very low	30.6	Very low	91 Å²	91	108 Å²	108	49%	0.487	56%	0.56	S	S	.	*	H	α-helix	trans	-65.6	-30.5	173.9	-79.5	-74.9	0	0	0	113	D145 K153	D145-N149 VanDerWaalsContact O-CB 3.28Å; D145-N149 WeakPolarHBondContact O-CB 3.32Å; D145-N149 PolarHBondContact O-N 3.06Å; D145-N149 PolarHBondContact O-ND2 2.82Å; N149-K153 WeakPolarHBondContact O-CB 3.36Å; N149-K153 PolarHBondContact O-N 3.49Å; N149-K153 VanDerWaalsContact O-N 3.09Å
150	L	33.5	Very low	30.8	Very low	50 Å²	50	109 Å²	109	26%	0.262	56%	0.563	S	S	.	*	H	α-helix	trans	-73.8	-42.1	175.2	-163	69.2	0	0	0	111.5	I7 L146 Y147 T148 K153 F154	I7-L150 HydrophobicContact CD1-CD2 4.11Å; I7-L150 HydrophobicContact CG2-CD2 4.31Å; L146-L150 WeakPolarHBondContact O-CB 3.34Å; L146-L150 PolarHBondContact O-N 3.03Å; Y147-L150 PolarHBondContact O-N 2.77Å; T148-L150 VanDerWaalsContact C-N 3.29Å; T148-L150 PolarHBondContact O-N 2.7Å; L150-K153 WeakPolarHBondContact O-CB 3.35Å; L150-K153 PolarHBondContact O-N 3.48Å; L150-K153 VanDerWaalsContact O-N 3.13Å; L150-F154 HydrophobicContact CD1-CD2 4.31Å; L150-F154 HydrophobicContact CD1-CE2 3.78Å; L150-F154 HydrophobicContact CD2-CE2 4.49Å; L150-F154 HydrophobicContact CG-CD2 4.01Å; L150-F154 HydrophobicContact CG-CE2 3.84Å; L150-F154 VanDerWaalsContact O-CD2 3.25Å; L150-F154 WeakPolarHBondContact O-CD2 3.47Å; L150-F154 PolarHBondContact O-N 3.39Å; L150-F154 VanDerWaalsContact O-N 3.08Å
151	L	32.6	Very low	30.6	Very low	101 Å²	101	106.6 Å²	106.6	53%	0.529	55%	0.553	S	S	.	*	H	α-helix	trans	-63.6	-41.8	173.2	-74.6	170.6	0	0	0	111.7	Y147 T148 K153 F154 A155	Y147-L151 HydrophobicContact CD1-CD1 3.63Å; Y147-L151 HydrophobicContact CD1-CG 4.26Å; Y147-L151 HydrophobicContact CE1-CD1 3.81Å; Y147-L151 HydrophobicContact CE1-CG 4.4Å; Y147-L151 WeakPolarHBondContact O-CB 3.34Å; Y147-L151 VanDerWaalsContact O-CG 3.3Å; Y147-L151 WeakPolarHBondContact O-CG 3.43Å; Y147-L151 PolarHBondContact O-N 3.05Å; T148-L151 PolarHBondContact O-N 3.5Å; L151-K153 PolarHBondContact O-N 2.92Å; L151-F154 PolarHBondContact O-N 3.27Å; L151-A155 VanDerWaalsContact O-CB 3.28Å; L151-A155 WeakPolarHBondContact O-CB 3.43Å; L151-A155 PolarHBondContact O-N 3.44Å
152	L	31.2	Very low	30.7	Very low	122 Å²	122	103.1 Å²	103.1	64%	0.639	54%	0.539	S	S	*	.	H	α-helix	trans	-63.4	-26.8	172.3	-72.8	166.9	0	0	0	112.7	T148	T148-L152 HydrophobicContact CG2-CD1 3.97Å; T148-L152 HydrophobicContact CG2-CG 4.49Å; T148-L152 WeakPolarHBondContact O-CB 3.16Å; T148-L152 VanDerWaalsContact O-CG 3.24Å; T148-L152 WeakPolarHBondContact O-CG 3.39Å; T148-L152 PolarHBondContact O-N 2.87Å
153	K	31.1	Very low	30.6	Very low	178 Å²	178	108.9 Å²	108.9	77%	0.774	55%	0.554	S	S	*	*	H	α-helix	trans	-79.1	-23.8	173.1	-105.7	178.7	176.3	171.4	0	114.8	N149 L150 L151	N149-K153 WeakPolarHBondContact O-CB 3.36Å; N149-K153 PolarHBondContact O-N 3.49Å; N149-K153 VanDerWaalsContact O-N 3.09Å; L150-K153 WeakPolarHBondContact O-CB 3.35Å; L150-K153 PolarHBondContact O-N 3.48Å; L150-K153 VanDerWaalsContact O-N 3.13Å; L151-K153 PolarHBondContact O-N 2.92Å
154	F	30.3	Very low	30.5	Very low	129 Å²	129	112.9 Å²	112.9	57%	0.566	57%	0.57	S	S	*	*	H	α-helix	trans	-101.8	-14.3	178.8	-74.4	-64.9	0	0	0	113.6	I11 L150 L151 G156	I11-F154 HydrophobicContact CD1-CE2 4.49Å; L150-F154 HydrophobicContact CD1-CD2 4.31Å; L150-F154 HydrophobicContact CD1-CE2 3.78Å; L150-F154 HydrophobicContact CD2-CE2 4.49Å; L150-F154 HydrophobicContact CG-CD2 4.01Å; L150-F154 HydrophobicContact CG-CE2 3.84Å; L150-F154 VanDerWaalsContact O-CD2 3.25Å; L150-F154 WeakPolarHBondContact O-CD2 3.47Å; L150-F154 PolarHBondContact O-N 3.39Å; L150-F154 VanDerWaalsContact O-N 3.08Å; L151-F154 PolarHBondContact O-N 3.27Å; F154-G156 PolarHBondContact O-N 2.93Å
155	A	27.3	Very low	30.2	Very low	76 Å²	76	115.1 Å²	115.1	63%	0.628	58%	0.579	S	S	*	*	S	Bend	trans	-88.3	72.7	170.8	0	0	0	0	0	111.3	L151	L151-A155 VanDerWaalsContact O-CB 3.28Å; L151-A155 WeakPolarHBondContact O-CB 3.43Å; L151-A155 PolarHBondContact O-N 3.44Å
156	G	25.8	Very low	29.9	Very low	56 Å²	56	120.9 Å²	120.9	58%	0.577	60%	0.602	S	S	*	*			trans	-65.4	147	175.5	0	0	0	0	0	113.8	F154	F154-G156 PolarHBondContact O-N 2.93Å
157	D	27.4	Very low	29.5	Very low	170 Å²	170	125.5 Å²	125.5	91%	0.909	63%	0.625	S	S	*	*	S	Bend	trans	61.5	47.2	155.6	-53.9	-24.2	0	0	0	119.5
158	I	29.6	Very low	29.1	Very low	162 Å²	162	126.4 Å²	126.4	83%	0.831	64%	0.638	S	S	*	*			trans	-131.9	132.4	157.5	-52.7	-179.3	0	0	0	111.8	F160	I158-F160 PolarHBondContact O-N 3.37Å
159	N	25.7	Very low	28.6	Very low	69 Å²	69	128.4 Å²	128.4	37%	0.369	65%	0.65	S	S	.	*			trans	-57.8	121.5	-178.4	-96.6	-38.8	0	0	0	114.7	L101 S102 S103	L101-N159 HydrophobicContact CG-CB 4.37Å; S102-N159 WeakPolarHBondContact CB-ND2 3.36Å; S103-N159 WeakPolarHBondContact CB-OD1 3.42Å
160	F	28.1	Very low	28.3	Very low	149 Å²	149	132.1 Å²	132.1	65%	0.654	67%	0.67	S	S	*	*			trans	-142	39.2	157.7	-143.9	-106.2	0	0	0	115.4	I158 Q162 Y163	I158-F160 PolarHBondContact O-N 3.37Å; F160-Q162 PolarHBondContact O-N 2.03Å; F160-Y163 AromaticContact CE1-CD2 3.54Å; F160-Y163 HydrophobicContact CE1-CD2 3.54Å; F160-Y163 HydrophobicContact CE1-CE2 4.31Å; F160-Y163 AromaticContact CE1-CG 3.99Å; F160-Y163 HydrophobicContact CE1-CG 3.99Å; F160-Y163 HydrophobicContact CZ-CD2 4.02Å; F160-Y163 HydrophobicContact CZ-CE2 4.45Å
161	T	26.1	Very low	28	Very low	91 Å²	91	136.2 Å²	136.2	56%	0.558	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	63.8	170.5	27.3	0	0	0	0	112	S103	S103-T161 PolarHBondContact N-OG1 2.77Å
162	Q	31.2	Very low	28	Very low	83 Å²	83	138.4 Å²	138.4	39%	0.388	71%	0.705	S	S	.	*	T	Hydrogen-bonded Turn	trans	-149.3	-11.6	178.1	-144.8	176.1	13.9	0	0	116.2	S100 F160	S100-Q162 VanDerWaalsContact C-CD 3.48Å; S100-Q162 VanDerWaalsContact CA-OE1 3.3Å; S100-Q162 VanDerWaalsContact N-OE1 3.14Å; S100-Q162 PolarHBondContact O-NE2 3.34Å; F160-Q162 PolarHBondContact O-N 2.03Å
163	Y	26.5	Very low	27.7	Very low	188 Å²	188	137.5 Å²	137.5	74%	0.737	70%	0.704	S	S	*	*	S	Bend	trans	-98.8	-28.2	-177.6	-114.6	-108.8	0	0	0	115.1	F160 K165	F160-Y163 AromaticContact CE1-CD2 3.54Å; F160-Y163 HydrophobicContact CE1-CD2 3.54Å; F160-Y163 HydrophobicContact CE1-CE2 4.31Å; F160-Y163 AromaticContact CE1-CG 3.99Å; F160-Y163 HydrophobicContact CE1-CG 3.99Å; F160-Y163 HydrophobicContact CZ-CD2 4.02Å; F160-Y163 HydrophobicContact CZ-CE2 4.45Å; Y163-K165 PolarHBondContact O-N 2.8Å
164	E	28.9	Very low	27.5	Very low	201 Å²	201	135 Å²	135	94%	0.939	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	8.3	-177.5	-147.8	166.5	-146.8	0	0	113.5
165	K	28.1	Very low	27.3	Very low	190 Å²	190	136 Å²	136	83%	0.826	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.8	28.9	-177.2	-143.6	175	-173	-179.7	0	113.3	Y163	Y163-K165 PolarHBondContact O-N 2.8Å
166	K	27	Very low	27.3	Very low	174 Å²	174	140.8 Å²	140.8	76%	0.757	71%	0.714	S	S	*	*	S	Bend	trans	-140.3	19.6	178.2	-142.4	177.9	-178.2	-179.7	0	115.6
167	I	26.9	Very low	27.3	Very low	165 Å²	165	143.9 Å²	143.9	85%	0.846	72%	0.717	S	S	*	*	S	Bend	trans	-125.4	26.4	161.3	-37	-177.5	0	0	0	110.5
168	I	25.3	Very low	27.3	Very low	158 Å²	158	142 Å²	142	81%	0.81	71%	0.707	S	S	*	*	S	Bend	trans	-140.9	73.2	159.1	-50.6	179.5	0	0	0	107.8
169	T	24.8	Very low	27.2	Very low	93 Å²	93	141.1 Å²	141.1	57%	0.571	70%	0.702	S	S	*	*			trans	-162.7	102.6	157.1	46.6	0	0	0	0	108.4
170	N	28.1	Very low	27.2	Very low	169 Å²	169	142.4 Å²	142.4	90%	0.904	72%	0.717	S	S	*	*			trans	-144.5	108.6	130.1	-105.5	13.1	0	0	0	104
171	D	26.4	Very low	27.1	Very low	137 Å²	137	140 Å²	140	73%	0.733	72%	0.718	S	S	*	*			trans	-70.3	141.2	171.7	-61.9	-77.1	0	0	0	109.6
172	D	32.1	Very low	27.2	Very low	147 Å²	147	142.3 Å²	142.3	79%	0.786	73%	0.726	S	S	*	*			trans	-175.3	94	133.4	-95.8	-33.1	0	0	0	107.6
173	T	26	Very low	27	Very low	103 Å²	103	145.4 Å²	145.4	63%	0.632	75%	0.745	S	S	*	*				82.8	135.1	79.8	57.3	0	0	0	0	113.5
174	T	26.4	Very low	27	Very low	125 Å²	125	140.2 Å²	140.2	77%	0.767	74%	0.736	S	S	*	*			trans	63	144.2	165.1	46.8	0	0	0	0	119
175	E	25.9	Very low	27	Very low	151 Å²	151	137.2 Å²	137.2	71%	0.706	73%	0.727	S	S	*	*			cis	-165	179.1	-19.3	-141.7	-178.6	136.2	0	0	110.2
176	Y	26.5	Very low	27	Very low	176 Å²	176	134.1 Å²	134.1	69%	0.69	72%	0.719	S	S	*	*			trans	66.4	110.8	161.7	-95.4	-101.3	0	0	0	121.4
177	N	26.4	Very low	27	Very low	120 Å²	120	132.2 Å²	132.2	64%	0.642	71%	0.713	S	S	*	*				27	153.4	105.6	-35.8	-29.5	0	0	0	118.5
178	D	26.7	Very low	27	Very low	132 Å²	132	129.9 Å²	129.9	71%	0.706	70%	0.702	S	S	*	*			cis	-166	-179.2	27.2	-148.1	-31	0	0	0	112.1
179	I	28.8	Very low	27.2	Very low	142 Å²	142	127.7 Å²	127.7	73%	0.728	70%	0.701	S	S	*	*			trans	67.1	113.2	163.1	-56.9	152.9	0	0	0	115.5
180	S	25.4	Very low	27.3	Very low	97 Å²	97	132.7 Å²	132.7	68%	0.678	71%	0.711	S	S	*	*			cis	99.2	142.2	17.1	98	0	0	0	0	117.9
181	S	26.4	Very low	27.1	Very low	97 Å²	97	131 Å²	131	68%	0.678	70%	0.702	S	S	*	*			trans	95.2	151.9	153.7	83.1	0	0	0	0	121.9
182	I	28	Very low	27	Very low	141 Å²	141	130.4 Å²	130.4	72%	0.723	70%	0.699	S	S	*	*			trans	75.3	98.9	164.4	-57.8	170.2	0	0	0	115
183	N	26.4	Very low	26.6	Very low	147 Å²	147	130 Å²	130	79%	0.786	70%	0.695	S	S	*	*				84.7	145.2	62.9	-72.6	-8.3	0	0	0	113.7
184	S	26.5	Very low	26.5	Very low	79 Å²	79	133.5 Å²	133.5	55%	0.552	70%	0.704	S	S	*	*			cis	-173.4	178	-15.5	57.7	0	0	0	0	110.6
185	N	29	Very low	26.4	Very low	139 Å²	139	135.7 Å²	135.7	74%	0.743	71%	0.708	S	S	*	*			trans	76	151.5	166.6	-37.5	-24.3	0	0	0	115.4
186	N	27.2	Very low	26.3	Very low	125 Å²	125	137.5 Å²	137.5	67%	0.668	71%	0.713	S	S	*	*			cis	-170.3	163.4	-14.4	-112.9	28	0	0	0	108.3
187	E	27.1	Very low	26.2	Very low	134 Å²	134	133.2 Å²	133.2	63%	0.626	71%	0.709	S	S	*	*			cis	-164.7	176.9	-15.1	-138.6	174.2	-125.6	0	0	109.4
188	N	28	Very low	26	Very low	115 Å²	115	138.1 Å²	138.1	62%	0.615	72%	0.719	S	S	*	*			trans	50.3	109.2	152.1	-57.5	-29.1	0	0	0	122.9
189	S	30.2	Very low	25.9	Very low	113 Å²	113	141.1 Å²	141.1	79%	0.79	73%	0.725	S	S	*	*				160.3	78.1	98.5	-175.5	0	0	0	0	111.8
190	Y	24.9	Very low	25.6	Very low	198 Å²	198	141.5 Å²	141.5	78%	0.776	73%	0.727	S	S	*	*				74.7	122.4	93.7	-91.5	-70.2	0	0	0	117.7
191	D	23.9	Very low	25.6	Very low	132 Å²	132	143.4 Å²	143.4	71%	0.706	74%	0.735	S	S	*	*			trans	-67.5	170.2	173.1	-47.2	-104.9	0	0	0	113.8
192	N	26.3	Very low	25.5	Very low	126 Å²	126	146.4 Å²	146.4	67%	0.674	74%	0.743	S	S	*	*				179.3	120	101.7	-93.1	-68.5	0	0	0	116
193	I	22.6	Very low	25.2	Very low	139 Å²	139	146.1 Å²	146.1	71%	0.713	75%	0.749	S	S	*	*				37.1	113.8	127.1	-43.5	173.8	0	0	0	119.1
194	Q	24.9	Very low	25.1	Very low	175 Å²	175	145.7 Å²	145.7	82%	0.818	75%	0.751	S	S	*	*				-169.5	149.3	104.6	-100.7	-160.8	49.5	0	0	116
195	M	22.8	Very low	24.9	Very low	172 Å²	172	147.8 Å²	147.8	85%	0.847	76%	0.76	S	S	*	*			trans	-93	148.9	176.6	-55.8	177.1	-179.4	0	0	112.8
196	K	25	Very low	24.5	Very low	189 Å²	189	151 Å²	151	82%	0.822	76%	0.764	S	S	*	*				178.9	151.6	129.8	-96.1	146.3	-173.4	164	0	110.3
197	S	22.7	Very low	24.6	Very low	86 Å²	86	152 Å²	152	60%	0.601	77%	0.774	S	S	*	*			cis	173.4	143.7	-32.2	74.6	0	0	0	0	106.3
198	R	22.9	Very low	24.5	Very low	222 Å²	222	153.9 Å²	153.9	84%	0.838	78%	0.783	S	S	*	*			trans	63.5	106.7	153.8	-61.6	168.9	167.4	169	-4.4	120.3
199	K	25.5	Very low	24.3	Very low	195 Å²	195	155.4 Å²	155.4	85%	0.848	79%	0.791	S	S	*	*				175.1	118.9	107.2	-91.1	162.2	-177.2	177.1	0	107.4
200	I	22.8	Very low	24.3	Very low	150 Å²	150	158.8 Å²	158.8	77%	0.769	79%	0.794	S	S	*	*				63.4	95.3	66.3	-54.9	172	0	0	0	112.9
201	T	24.8	Very low	24.5	Very low	137 Å²	137	156.3 Å²	156.3	84%	0.84	80%	0.795	S	S	*	*			trans	-154.3	141.3	148.8	15.3	0	0	0	0	108.9
202	N	24	Very low	24.7	Very low	160 Å²	160	157.6 Å²	157.6	86%	0.856	80%	0.802	S	S	*	*			trans	-99.4	131.1	176.5	-63.2	-12.7	0	0	0	110.1
203	T	22.5	Very low	24.8	Very low	136 Å²	136	160.8 Å²	160.8	83%	0.834	81%	0.812	S	S	*	*			trans	-148.2	146.9	155.9	-36.7	0	0	0	0	109.4
204	V	24.1	Very low	25	Very low	138 Å²	138	162.3 Å²	162.3	84%	0.836	82%	0.822	S	S	*	*			trans	-85.4	128.1	166.2	175.3	0	0	0	0	108.2
205	V	21.6	Very low	25.1	Very low	123 Å²	123	156.9 Å²	156.9	75%	0.745	81%	0.813	S	S	*	*			trans	-168.4	157.2	159	128.4	0	0	0	0	110.3
206	Y	21.6	Very low	25.5	Very low	207 Å²	207	156.9 Å²	156.9	81%	0.812	82%	0.816	S	S	*	*			trans	-42.7	148.4	178.5	-51.1	-93.4	0	0	0	116
207	T	27.4	Very low	25.9	Very low	144 Å²	144	154 Å²	154	88%	0.883	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-80.1	119.8	157.5	43.9	0	0	0	0	108.6
208	Q	25.1	Very low	26.3	Very low	175 Å²	175	156 Å²	156	82%	0.818	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-91.5	151.9	163.8	-76.6	-170.4	-111.4	0	0	110.2
209	D	25.7	Very low	26.7	Very low	147 Å²	147	152.6 Å²	152.6	79%	0.786	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-60.8	133.8	168.8	-23	-86.2	0	0	0	110.4
210	E	30.1	Very low	26.9	Very low	184 Å²	184	148.6 Å²	148.6	86%	0.86	80%	0.795	S	S	*	*			trans	-140.5	107.3	153.2	-74.7	-167.4	157.2	0	0	107.6
211	D	29.2	Very low	27.1	Very low	146 Å²	146	145.8 Å²	145.8	78%	0.781	78%	0.782	S	S	*	*			trans	52.5	105.7	145.2	-47.9	-10.6	0	0	0	120.8
212	D	27	Very low	27.1	Very low	159 Å²	159	148.7 Å²	148.7	85%	0.85	78%	0.778	S	S	*	*			trans	23.8	118.4	134.2	-51.2	-22.8	0	0	0	120.8
213	E	28.3	Very low	27.2	Very low	193 Å²	193	144.8 Å²	144.8	90%	0.902	76%	0.756	S	S	*	*				-167	118.2	124.8	-109	172.9	-154.7	0	0	111.4
214	D	27.3	Very low	27.3	Very low	170 Å²	170	142.2 Å²	142.2	91%	0.909	74%	0.74	S	S	*	*			trans	16.2	127.5	161.6	-55.5	-20.1	0	0	0	122.8
215	G	27.3	Very low	27.3	Very low	62 Å²	62	141.1 Å²	141.1	64%	0.639	73%	0.73	S	S	*	*			trans	141.2	105.2	145.3	0	0	0	0	0	118.8	D217	G215-D217 VanDerWaalsContact C-N 3.31Å; G215-D217 PolarHBondContact O-N 3.46Å
216	D	30.8	Very low	27.5	Very low	171 Å²	171	139.2 Å²	139.2	91%	0.914	72%	0.718	S	S	*	*			trans	38.7	-8.3	143.4	-60.5	-16	0	0	0	124.7	D218	D216-D218 PolarHBondContact O-N 2.67Å
217	D	32.1	Very low	27.7	Very low	128 Å²	128	133.3 Å²	133.3	68%	0.684	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	0.8	-165.7	-95.4	-3.4	0	0	0	116.6	G215 Q219 N221	G215-D217 VanDerWaalsContact C-N 3.31Å; G215-D217 PolarHBondContact O-N 3.46Å; D217-Q219 VanDerWaalsContact C-N 3.31Å; D217-Q219 PolarHBondContact O-N 2.85Å; D217-N221 PolarHBondContact O-ND2 3.24Å; D217-N221 VanDerWaalsContact O-ND2 3.09Å
218	D	32.7	Very low	27.6	Very low	128 Å²	128	131.3 Å²	131.3	68%	0.684	68%	0.683	S	S	*	*	H	α-helix	trans	-75.8	-16.8	-168.5	-152.6	25.1	0	0	0	113.7	D216	D216-D218 PolarHBondContact O-N 2.67Å
219	Q	31.4	Very low	27.6	Very low	151 Å²	151	123.4 Å²	123.4	71%	0.706	65%	0.649	S	S	*	*	H	α-helix	trans	-79	-39.7	-177.2	-165.7	142.7	-49.6	0	0	113.2	D217 R222 I223	D217-Q219 VanDerWaalsContact C-N 3.31Å; D217-Q219 PolarHBondContact O-N 2.85Å; Q219-R222 WeakPolarHBondContact O-CB 3.34Å; Q219-R222 PolarHBondContact O-N 2.99Å; Q219-I223 HydrophobicContact CG-CD1 4.34Å; Q219-I223 WeakPolarHBondContact O-CG1 3.37Å; Q219-I223 PolarHBondContact O-N 2.93Å; Q219-I223 VanDerWaalsContact O-N 3.15Å
220	D	29.3	Very low	27.7	Very low	111 Å²	111	120.2 Å²	120.2	59%	0.594	63%	0.629	S	S	*	*	H	α-helix	trans	-74.3	-29.2	-179.4	-111.7	10.9	0	0	0	112.4	R222 I223 T224	D220-R222 VanDerWaalsContact C-N 3.34Å; D220-I223 PolarHBondContact O-N 3.24Å; D220-T224 WeakPolarHBondContact O-CB 3.36Å; D220-T224 PolarHBondContact O-N 2.02Å; D220-T224 PolarHBondContact O-OG1 3.41Å
221	N	26.8	Very low	27.7	Very low	92 Å²	92	120.1 Å²	120.1	49%	0.492	62%	0.621	S	S	.	*	H	α-helix	trans	-65.7	-35.5	171.4	-78.4	-67	0	0	0	112.1	D217 N225	D217-N221 PolarHBondContact O-ND2 3.24Å; D217-N221 VanDerWaalsContact O-ND2 3.09Å; N221-N225 PolarHBondContact O-N 2.83Å; N221-N225 PolarHBondContact O-ND2 3.26Å
222	R	25	Very low	28	Very low	197 Å²	197	117.4 Å²	117.4	74%	0.743	61%	0.606	S	S	*	*	H	α-helix	trans	-64.9	-48.4	169.2	-93.7	-178.2	169.2	-174.2	-0.1	112	Q219 D220 T224 N225 V226	Q219-R222 WeakPolarHBondContact O-CB 3.34Å; Q219-R222 PolarHBondContact O-N 2.99Å; D220-R222 VanDerWaalsContact C-N 3.34Å; R222-T224 PolarHBondContact O-N 3.29Å; R222-N225 PolarHBondContact O-N 3.48Å; R222-V226 WeakPolarHBondContact O-CG2 3.19Å; R222-V226 PolarHBondContact O-N 3.01Å
223	I	26.3	Very low	28.9	Very low	79 Å²	79	113 Å²	113	41%	0.405	58%	0.581	S	S	.	*	H	α-helix	trans	-59.9	-46	-178.5	-69.2	164.2	0	0	0	111	Q219 D220 N225 V226 I227	Q219-I223 HydrophobicContact CG-CD1 4.34Å; Q219-I223 WeakPolarHBondContact O-CG1 3.37Å; Q219-I223 PolarHBondContact O-N 2.93Å; Q219-I223 VanDerWaalsContact O-N 3.15Å; D220-I223 PolarHBondContact O-N 3.24Å; I223-N225 PolarHBondContact O-N 3.24Å; I223-V226 PolarHBondContact O-N 2.96Å; I223-I227 HydrophobicContact CG2-CD1 3.68Å; I223-I227 HydrophobicContact CG2-CG1 4.48Å; I223-I227 WeakPolarHBondContact O-CG1 3.38Å; I223-I227 PolarHBondContact O-N 3.46Å
224	T	24	Very low	29.6	Very low	81 Å²	81	104 Å²	104	50%	0.497	54%	0.539	S	S	.	.	H	α-helix	trans	-63.6	-39.6	-178.2	-57.6	0	0	0	0	112.5	D220 R222 I227 L228	D220-T224 WeakPolarHBondContact O-CB 3.36Å; D220-T224 PolarHBondContact O-N 2.02Å; D220-T224 PolarHBondContact O-OG1 3.41Å; R222-T224 PolarHBondContact O-N 3.29Å; T224-I227 PolarHBondContact O-N 3Å; T224-L228 PolarHBondContact O-N 3.19Å; T224-L228 VanDerWaalsContact O-N 3.08Å
225	N	24.4	Very low	30.6	Very low	115 Å²	115	103.1 Å²	103.1	62%	0.615	52%	0.523	S	S	*	.	H	α-helix	trans	-68.1	-34.2	176.5	-81.1	-69.2	0	0	0	113	N221 R222 I223 G229	N221-N225 PolarHBondContact O-N 2.83Å; N221-N225 PolarHBondContact O-ND2 3.26Å; R222-N225 PolarHBondContact O-N 3.48Å; I223-N225 PolarHBondContact O-N 3.24Å; N225-G229 PolarHBondContact O-N 3.27Å; N225-G229 VanDerWaalsContact O-N 3.16Å
226	V	25.4	Very low	31.6	Very low	83 Å²	83	105.4 Å²	105.4	50%	0.503	52%	0.518	S	S	.	.	H	α-helix	trans	-64.8	-50.3	173.1	172.3	0	0	0	0	110.7	R222 I223 L228 G229 E230	R222-V226 WeakPolarHBondContact O-CG2 3.19Å; R222-V226 PolarHBondContact O-N 3.01Å; I223-V226 PolarHBondContact O-N 2.96Å; V226-L228 VanDerWaalsContact C-N 3.27Å; V226-L228 PolarHBondContact O-N 2.03Å; V226-G229 PolarHBondContact O-N 3.31Å; V226-E230 PolarHBondContact O-N 2.7Å
227	I	26.8	Very low	32.5	Very low	84 Å²	84	98.9 Å²	98.9	43%	0.431	48%	0.481	S	S	.	.	H	α-helix	trans	-60.1	-35.8	-179.4	-67.4	168.3	0	0	0	112	I223 T224	I223-I227 HydrophobicContact CG2-CD1 3.68Å; I223-I227 HydrophobicContact CG2-CG1 4.48Å; I223-I227 WeakPolarHBondContact O-CG1 3.38Å; I223-I227 PolarHBondContact O-N 3.46Å; T224-I227 PolarHBondContact O-N 3Å
228	L	24.9	Very low	33.7	Very low	101 Å²	101	93.8 Å²	93.8	53%	0.529	45%	0.454	S	S	.	.	H	α-helix	trans	-73.5	-31.4	176.7	-142.8	74.5	0	0	0	112.6	T224 V226	T224-L228 PolarHBondContact O-N 3.19Å; T224-L228 VanDerWaalsContact O-N 3.08Å; V226-L228 VanDerWaalsContact C-N 3.27Å; V226-L228 PolarHBondContact O-N 2.03Å
229	G	25.1	Very low	34.6	Very low	10 Å²	10	91.1 Å²	91.1	10%	0.103	44%	0.444	C	S	.	.	H	α-helix	trans	-69.5	-40.5	175.2	0	0	0	0	0	113.6	N225 V226 R231 L232 I289	N225-G229 PolarHBondContact O-N 3.27Å; N225-G229 VanDerWaalsContact O-N 3.16Å; V226-G229 PolarHBondContact O-N 3.31Å; G229-R231 PolarHBondContact O-N 2.78Å; G229-L232 PolarHBondContact O-N 3.34Å; G229-I289 WeakPolarHBondContact O-CD1 3.46Å
230	E	26.9	Very low	35.7	Very low	79 Å²	79	87.1 Å²	87.1	37%	0.369	43%	0.427	S	S	.	.	H	α-helix	trans	-59.8	-33.5	-179.7	-71.1	-178.6	157.9	0	0	113.1	Y61 V226 L232	Y61-E230 WeakPolarHBondContact CE1-OE1 3.29Å; V226-E230 PolarHBondContact O-N 2.7Å; E230-L232 PolarHBondContact O-N 2.87Å
231	R	30.5	Very low	37.1	Very low	182 Å²	182	82.3 Å²	82.3	69%	0.687	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-8.9	175.9	-79.4	-179.5	167.1	149.2	-1.5	115	G229	G229-R231 PolarHBondContact O-N 2.78Å
232	L	35.2	Very low	38.4	Very low	90 Å²	90	79.7 Å²	79.7	47%	0.471	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	0.2	-176.1	-66.9	170.3	0	0	0	114	G229 E230 I289	G229-L232 PolarHBondContact O-N 3.34Å; E230-L232 PolarHBondContact O-N 2.87Å; L232-I289 HydrophobicContact CB-CD1 4.09Å; L232-I289 HydrophobicContact CD1-CD1 4.27Å
233	Q	46.5	Very low	39.7	Very low	67 Å²	67	72.6 Å²	72.6	31%	0.313	36%	0.363	S	S	.	.			trans	-63.2	126.5	-176.5	-67.9	-175.8	18.5	0	0	112.9	R235 M236	Q233-R235 VanDerWaalsContact C-N 3.26Å; Q233-R235 PolarHBondContact O-N 3.25Å; Q233-M236 WeakPolarHBondContact O-CB 3.39Å; Q233-M236 PolarHBondContact O-N 2.83Å
234	P	43.9	Very low	41.1	Very low	3 Å²	3	70.2 Å²	70.2	2%	0.019	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-56	-37.7	177.2	-27.2	33.9	0	0	0	114.2	M236 F237 Y273 I277 L281	P234-M236 PolarHBondContact O-N 2.79Å; P234-M236 VanDerWaalsContact O-N 3.14Å; P234-F237 WeakPolarHBondContact O-CD2 3.35Å; P234-F237 PolarHBondContact O-N 2.81Å; P234-Y273 WeakPolarHBondContact O-CE2 3.36Å; P234-Y273 PolarHBondContact O-OH 2.93Å; P234-I277 HydrophobicContact CB-CD1 3.83Å; P234-I277 HydrophobicContact CB-CG1 4.09Å; P234-I277 HydrophobicContact CB-CG2 3.84Å; P234-I277 HydrophobicContact CG-CG2 4.08Å; P234-L281 HydrophobicContact CB-CD1 4.4Å; P234-L281 HydrophobicContact CG-CD1 3.91Å
235	R	48.2	Very low	42.8	Very low	152 Å²	152	67.7 Å²	67.7	57%	0.574	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-57.8	-30.5	-173.6	-68.9	-178.9	168.3	-160.1	-5.1	113.5	Q233 F237 L238	Q233-R235 VanDerWaalsContact C-N 3.26Å; Q233-R235 PolarHBondContact O-N 3.25Å; R235-F237 PolarHBondContact O-N 3.32Å; R235-F237 VanDerWaalsContact O-N 3.13Å; R235-L238 PolarHBondContact O-N 3.35Å; R235-L238 VanDerWaalsContact O-N 3.12Å
236	M	46.7	Very low	44.2	Very low	110 Å²	110	69.5 Å²	69.5	54%	0.542	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-54.7	-29.7	176.8	180	175	56.3	0	0	112.9	Q233 P234	Q233-M236 WeakPolarHBondContact O-CB 3.39Å; Q233-M236 PolarHBondContact O-N 2.83Å; P234-M236 PolarHBondContact O-N 2.79Å; P234-M236 VanDerWaalsContact O-N 3.14Å
237	F	50.6	Low	45.7	Very low	34 Å²	34	69 Å²	69	15%	0.149	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-86.1	-17.2	-177.9	-60.3	-75.1	0	0	0	114	L2 P234 R235 L240 F241 Y273 I277	L2-F237 HydrophobicContact CD2-CE1 4.29Å; L2-F237 HydrophobicContact CD2-CE2 4.28Å; L2-F237 HydrophobicContact CD2-CZ 3.77Å; P234-F237 WeakPolarHBondContact O-CD2 3.35Å; P234-F237 PolarHBondContact O-N 2.81Å; R235-F237 PolarHBondContact O-N 3.32Å; R235-F237 VanDerWaalsContact O-N 3.13Å; F237-L240 WeakPolarHBondContact O-CB 3.34Å; F237-L240 PolarHBondContact O-N 2.94Å; F237-F241 HydrophobicContact CB-CE2 4.31Å; F237-F241 VanDerWaalsContact O-CD2 3.32Å; F237-F241 WeakPolarHBondContact O-CD2 3.44Å; F237-Y273 HydrophobicContact CB-CE2 4.3Å; F237-I277 HydrophobicContact CD2-CD1 3.95Å
238	L	58.1	Low	47.3	Very low	20 Å²	20	67.1 Å²	67.1	11%	0.105	31%	0.313	C	S	.	.	H	α-helix	trans	-61.8	-40.8	-172.5	-177	56.8	0	0	0	114.4	R235 L240 F241 I242 L270 Y273 Q331	R235-L238 PolarHBondContact O-N 3.35Å; R235-L238 VanDerWaalsContact O-N 3.12Å; L238-L240 VanDerWaalsContact C-N 3.28Å; L238-L240 PolarHBondContact O-N 2.84Å; L238-F241 PolarHBondContact O-N 3.09Å; L238-F241 VanDerWaalsContact O-N 3.17Å; L238-I242 HydrophobicContact CG-CD1 4.2Å; L238-I242 PolarHBondContact O-N 2.9Å; L238-L270 HydrophobicContact CD1-CD2 3.8Å; L238-Y273 HydrophobicContact CB-CD2 4.19Å; L238-Y273 HydrophobicContact CB-CE2 3.82Å; L238-Y273 HydrophobicContact CD1-CD1 3.98Å; L238-Y273 HydrophobicContact CD1-CD2 4.05Å; L238-Y273 HydrophobicContact CD1-CE1 4.31Å; L238-Y273 HydrophobicContact CD1-CE2 4.36Å; L238-Y273 HydrophobicContact CD1-CG 3.85Å; L238-Q331 VanDerWaalsContact CD2-OE1 3.24Å
239	P	51.5	Low	49	Very low	73 Å²	73	64.6 Å²	64.6	47%	0.474	30%	0.298	S	S	.	.	H	α-helix	trans	-56.1	-39.1	174.9	-27.1	36.6	0	0	0	113.4	F241 I242 D243	P239-F241 VanDerWaalsContact C-N 3.31Å; P239-F241 PolarHBondContact O-N 2.9Å; P239-I242 WeakPolarHBondContact O-CA 3.42Å; P239-I242 WeakPolarHBondContact O-CB 3.37Å; P239-I242 PolarHBondContact O-N 3.45Å; P239-D243 PolarHBondContact O-N 2.92Å
240	L	54.1	Low	50.6	Low	67 Å²	67	65.8 Å²	65.8	35%	0.351	31%	0.307	S	S	.	.	H	α-helix	trans	-59	-40.6	178.3	178.6	64.6	0	0	0	112.2	L3 F237 L238 D243 I244	L3-L240 HydrophobicContact CD1-CD2 4.48Å; F237-L240 WeakPolarHBondContact O-CB 3.34Å; F237-L240 PolarHBondContact O-N 2.94Å; L238-L240 VanDerWaalsContact C-N 3.28Å; L238-L240 PolarHBondContact O-N 2.84Å; L240-D243 PolarHBondContact O-N 2.81Å; L240-I244 HydrophobicContact CD1-CD1 4.35Å; L240-I244 HydrophobicContact CG-CD1 4.12Å; L240-I244 WeakPolarHBondContact O-CD1 3.41Å; L240-I244 VanDerWaalsContact O-CG1 3.23Å; L240-I244 WeakPolarHBondContact O-CG1 3.08Å; L240-I244 PolarHBondContact O-N 3.21Å
241	F	58.2	Low	52.1	Low	10 Å²	10	63.6 Å²	63.6	4%	0.044	30%	0.297	C	S	.	.	H	α-helix	trans	-69.8	-35.1	176.2	-71.7	-90.8	0	0	0	112	F237 L238 P239 Y245 V269 M272 Y273 V276	F237-F241 HydrophobicContact CB-CE2 4.31Å; F237-F241 VanDerWaalsContact O-CD2 3.32Å; F237-F241 WeakPolarHBondContact O-CD2 3.44Å; L238-F241 PolarHBondContact O-N 3.09Å; L238-F241 VanDerWaalsContact O-N 3.17Å; P239-F241 VanDerWaalsContact C-N 3.31Å; P239-F241 PolarHBondContact O-N 2.9Å; F241-Y245 PolarHBondContact O-N 2.8Å; F241-V269 HydrophobicContact CB-CG1 3.7Å; F241-V269 WeakPolarHBondContact O-CG1 3.48Å; F241-M272 HydrophobicContact CD1-CB 4.08Å; F241-M272 HydrophobicContact CE1-CB 3.98Å; F241-Y273 AromaticContact CD2-CD2 3.73Å; F241-Y273 HydrophobicContact CD2-CD2 3.73Å; F241-Y273 HydrophobicContact CD2-CG 4.26Å; F241-Y273 AromaticContact CE2-CD2 3.86Å; F241-Y273 HydrophobicContact CE2-CD2 3.86Å; F241-Y273 HydrophobicContact CE2-CG 4.5Å; F241-V276 HydrophobicContact CE1-CG2 4.24Å; F241-V276 HydrophobicContact CZ-CB 3.91Å; F241-V276 HydrophobicContact CZ-CG1 4.21Å; F241-V276 HydrophobicContact CZ-CG2 3.83Å
242	I	54.3	Low	53.5	Low	36 Å²	36	59 Å²	59	19%	0.185	28%	0.282	C	S	.	.	H	α-helix	trans	-64.9	-40.8	174.8	-64.4	169	0	0	0	110.8	L238 P239 Y245 R246 Y266	L238-I242 HydrophobicContact CG-CD1 4.2Å; L238-I242 PolarHBondContact O-N 2.9Å; P239-I242 WeakPolarHBondContact O-CA 3.42Å; P239-I242 WeakPolarHBondContact O-CB 3.37Å; P239-I242 PolarHBondContact O-N 3.45Å; I242-Y245 WeakPolarHBondContact O-CB 3.15Å; I242-Y245 PolarHBondContact O-N 3.07Å; I242-R246 WeakPolarHBondContact O-CG 2.93Å; I242-R246 PolarHBondContact O-N 3.24Å; I242-Y266 HydrophobicContact CG1-CE2 4.18Å
243	D	51.4	Low	54.8	Low	48 Å²	48	60.7 Å²	60.7	26%	0.257	30%	0.296	S	S	.	.	H	α-helix	trans	-72	-37.5	178.1	-67.4	-32.3	0	0	0	112.5	P239 L240 Y245 R246 I247	P239-D243 PolarHBondContact O-N 2.92Å; L240-D243 PolarHBondContact O-N 2.81Å; D243-Y245 VanDerWaalsContact C-N 3.28Å; D243-Y245 PolarHBondContact O-N 3.07Å; D243-R246 PolarHBondContact O-N 3.47Å; D243-R246 VanDerWaalsContact OD1-CD 3.32Å; D243-R246 WeakPolarHBondContact OD1-CD 3Å; D243-R246 IonicContact OD1-CZ 2.81Å; D243-R246 IonicContact OD1-NE 2.64Å; D243-R246 IonicContact OD1-NH1 2.99Å; D243-R246 PolarHBondContact OD1-NH1 3.07Å; D243-I247 VanDerWaalsContact O-CG1 3.28Å; D243-I247 WeakPolarHBondContact O-CG1 3.37Å; D243-I247 PolarHBondContact O-N 2.92Å
244	I	56.2	Low	55.6	Low	30 Å²	30	63.4 Å²	63.4	15%	0.154	31%	0.307	C	S	.	.	H	α-helix	trans	-56.9	-42.6	168.7	-71.7	165.4	0	0	0	110.8	F10 L240 I247 F248 I263	F10-I244 HydrophobicContact CE2-CG2 4.26Å; F10-I244 HydrophobicContact CZ-CG2 4.42Å; L240-I244 HydrophobicContact CD1-CD1 4.35Å; L240-I244 HydrophobicContact CG-CD1 4.12Å; L240-I244 WeakPolarHBondContact O-CD1 3.41Å; L240-I244 VanDerWaalsContact O-CG1 3.23Å; L240-I244 WeakPolarHBondContact O-CG1 3.08Å; L240-I244 PolarHBondContact O-N 3.21Å; I244-I247 PolarHBondContact O-N 3.21Å; I244-F248 HydrophobicContact CG2-CD2 3.71Å; I244-F248 HydrophobicContact CG2-CE2 3.65Å; I244-F248 VanDerWaalsContact O-CD2 3.26Å; I244-F248 WeakPolarHBondContact O-CD2 3.26Å; I244-F248 PolarHBondContact O-N 3.48Å; I244-I263 HydrophobicContact CG2-CD1 4.29Å
245	Y	60.1	Low	56.4	Low	27 Å²	27	65.7 Å²	65.7	11%	0.106	32%	0.322	C	S	.	.	H	α-helix	trans	-64	-45.1	175.8	179.5	-114.8	0	0	0	113.1	F241 I242 D243 I247 F248 K249 I263 Y266 V269	F241-Y245 PolarHBondContact O-N 2.8Å; I242-Y245 WeakPolarHBondContact O-CB 3.15Å; I242-Y245 PolarHBondContact O-N 3.07Å; D243-Y245 VanDerWaalsContact C-N 3.28Å; D243-Y245 PolarHBondContact O-N 3.07Å; Y245-I247 VanDerWaalsContact C-N 3.3Å; Y245-I247 PolarHBondContact O-N 3.42Å; Y245-F248 PolarHBondContact O-N 2.99Å; Y245-K249 HydrophobicContact CD2-CG 4.29Å; Y245-K249 HydrophobicContact CE1-CG 4.22Å; Y245-K249 HydrophobicContact CE2-CD 4.25Å; Y245-K249 HydrophobicContact CE2-CG 3.86Å; Y245-K249 PolarHBondContact O-N 3.02Å; Y245-K249 WeakPolarHBondContact OH-CE 3.4Å; Y245-I263 HydrophobicContact CD2-CB 4.09Å; Y245-I263 HydrophobicContact CD2-CG2 3.69Å; Y245-I263 HydrophobicContact CE2-CB 4.44Å; Y245-I263 HydrophobicContact CE2-CG2 4.01Å; Y245-Y266 HydrophobicContact CD1-CD2 4.34Å; Y245-Y266 HydrophobicContact CE1-CD2 4.43Å; Y245-V269 VanDerWaalsContact CB-CG2 3.5Å; Y245-V269 HydrophobicContact CD1-CG2 4.31Å; Y245-V269 HydrophobicContact CD2-CG2 3.28Å; Y245-V269 HydrophobicContact CE2-CG2 4.02Å; Y245-V269 HydrophobicContact CG-CG2 3.45Å; Y245-V269 VanDerWaalsContact CG-CG2 3.45Å
246	R	53.6	Low	57.3	Low	153 Å²	153	60.3 Å²	60.3	58%	0.577	31%	0.314	S	S	*	.	H	α-helix	trans	-56	-45.5	175	-72.8	161.9	166.9	172.6	-6.1	110.8	I242 D243 K249 A250	I242-R246 WeakPolarHBondContact O-CG 2.93Å; I242-R246 PolarHBondContact O-N 3.24Å; D243-R246 PolarHBondContact O-N 3.47Å; D243-R246 VanDerWaalsContact OD1-CD 3.32Å; D243-R246 WeakPolarHBondContact OD1-CD 3Å; D243-R246 IonicContact OD1-CZ 2.81Å; D243-R246 IonicContact OD1-NE 2.64Å; D243-R246 IonicContact OD1-NH1 2.99Å; D243-R246 PolarHBondContact OD1-NH1 3.07Å; R246-K249 PolarHBondContact O-N 3.41Å; R246-A250 WeakPolarHBondContact O-CB 3.33Å; R246-A250 PolarHBondContact O-N 3.5Å
247	I	57.6	Low	58	Low	72 Å²	72	65.1 Å²	65.1	37%	0.369	33%	0.332	S	S	.	.	H	α-helix	trans	-60.8	-49.7	176	-67.5	163.5	0	0	0	111.1	D243 I244 Y245 K249 A250 M251	D243-I247 VanDerWaalsContact O-CG1 3.28Å; D243-I247 WeakPolarHBondContact O-CG1 3.37Å; D243-I247 PolarHBondContact O-N 2.92Å; I244-I247 PolarHBondContact O-N 3.21Å; Y245-I247 VanDerWaalsContact C-N 3.3Å; Y245-I247 PolarHBondContact O-N 3.42Å; I247-K249 PolarHBondContact O-N 2.97Å; I247-A250 PolarHBondContact O-N 3.19Å; I247-M251 HydrophobicContact CG2-CE 3.7Å; I247-M251 HydrophobicContact CG2-CG 4.46Å; I247-M251 HydrophobicContact CG2-SD 4.09Å; I247-M251 WeakPolarHBondContact O-CB 3.19Å; I247-M251 WeakPolarHBondContact O-CG 3.44Å; I247-M251 PolarHBondContact O-N 3.43Å
248	F	59.9	Low	58.4	Low	45 Å²	45	70.8 Å²	70.8	20%	0.197	36%	0.364	C	S	.	.	H	α-helix	trans	-63.7	-37.6	179.7	-83.7	-64.8	0	0	0	113.3	F10 I244 Y245 M251 K252 Y262 I263	F10-F248 HydrophobicContact CE2-CE2 4.25Å; F10-F248 HydrophobicContact CZ-CE2 4.03Å; F10-F248 HydrophobicContact CZ-CZ 4.11Å; I244-F248 HydrophobicContact CG2-CD2 3.71Å; I244-F248 HydrophobicContact CG2-CE2 3.65Å; I244-F248 VanDerWaalsContact O-CD2 3.26Å; I244-F248 WeakPolarHBondContact O-CD2 3.26Å; I244-F248 PolarHBondContact O-N 3.48Å; Y245-F248 PolarHBondContact O-N 2.99Å; F248-M251 PolarHBondContact O-N 2.81Å; F248-K252 PolarHBondContact O-N 3.01Å; F248-Y262 HydrophobicContact CD1-CD2 4.02Å; F248-Y262 HydrophobicContact CD1-CG 4.31Å; F248-Y262 AromaticContact CE1-CD2 3.97Å; F248-Y262 HydrophobicContact CE1-CD2 3.97Å; F248-Y262 HydrophobicContact CE1-CG 4.07Å; F248-I263 HydrophobicContact CB-CD1 4.48Å; F248-I263 HydrophobicContact CD2-CD1 3.45Å; F248-I263 VanDerWaalsContact CD2-CD1 3.45Å; F248-I263 HydrophobicContact CD2-CG1 3.97Å; F248-I263 HydrophobicContact CE2-CD1 3.96Å; F248-I263 HydrophobicContact CE2-CG1 4.48Å; F248-I263 HydrophobicContact CG-CD1 4.21Å; F248-I263 HydrophobicContact CG-CG1 4.32Å
249	K	61.1	Low	58.5	Low	48 Å²	48	71.1 Å²	71.1	21%	0.209	37%	0.368	C	S	.	.	H	α-helix	trans	-69.8	-39.6	174	-70.6	-51.8	-166.4	-159.8	0	112.4	Y245 R246 I247 M251 K252 V253 D261 I263 P264	Y245-K249 HydrophobicContact CD2-CG 4.29Å; Y245-K249 HydrophobicContact CE1-CG 4.22Å; Y245-K249 HydrophobicContact CE2-CD 4.25Å; Y245-K249 HydrophobicContact CE2-CG 3.86Å; Y245-K249 PolarHBondContact O-N 3.02Å; Y245-K249 WeakPolarHBondContact OH-CE 3.4Å; R246-K249 PolarHBondContact O-N 3.41Å; I247-K249 PolarHBondContact O-N 2.97Å; K249-M251 VanDerWaalsContact C-N 3.35Å; K249-M251 PolarHBondContact O-N 2.96Å; K249-K252 PolarHBondContact O-N 3.34Å; K249-V253 WeakPolarHBondContact O-CG2 3.08Å; K249-V253 PolarHBondContact O-N 2.64Å; K249-D261 IonicContact NZ-OD1 2.69Å; K249-D261 PolarHBondContact NZ-OD1 3.44Å; K249-D261 IonicContact NZ-OD2 2.74Å; K249-D261 PolarHBondContact NZ-OD2 2.75Å; K249-I263 WeakPolarHBondContact CE-O 3.46Å; K249-I263 PolarHBondContact NZ-O 2.81Å; K249-P264 VanDerWaalsContact NZ-C 3.33Å; K249-P264 PolarHBondContact NZ-O 3.2Å
250	A	57.7	Low	58.6	Low	36 Å²	36	73.7 Å²	73.7	30%	0.298	37%	0.371	S	S	.	.	H	α-helix	trans	-60.9	-42.5	172.5	0	0	0	0	0	112	R246 I247 V253 K254	R246-A250 WeakPolarHBondContact O-CB 3.33Å; R246-A250 PolarHBondContact O-N 3.5Å; I247-A250 PolarHBondContact O-N 3.19Å; A250-V253 PolarHBondContact O-N 3.26Å; A250-K254 WeakPolarHBondContact O-CB 3.05Å; A250-K254 PolarHBondContact O-N 2.87Å
251	M	58.7	Low	58.9	Low	33 Å²	33	72.5 Å²	72.5	16%	0.163	37%	0.365	C	S	.	.	H	α-helix	trans	-60.6	-44.3	173.1	-73.8	178.9	174.5	0	0	112.1	L27 I30 I247 F248 K249 K254 C255	L27-M251 HydrophobicContact CD1-CE 3.8Å; I30-M251 HydrophobicContact CG2-CE 4.04Å; I30-M251 HydrophobicContact CG2-CG 4.2Å; I247-M251 HydrophobicContact CG2-CE 3.7Å; I247-M251 HydrophobicContact CG2-CG 4.46Å; I247-M251 HydrophobicContact CG2-SD 4.09Å; I247-M251 WeakPolarHBondContact O-CB 3.19Å; I247-M251 WeakPolarHBondContact O-CG 3.44Å; I247-M251 PolarHBondContact O-N 3.43Å; F248-M251 PolarHBondContact O-N 2.81Å; K249-M251 VanDerWaalsContact C-N 3.35Å; K249-M251 PolarHBondContact O-N 2.96Å; M251-K254 PolarHBondContact O-N 3.45Å; M251-C255 WeakPolarHBondContact O-CB 3.33Å; M251-C255 PolarHBondContact O-N 2.96Å
252	K	59.2	Low	58.7	Low	85 Å²	85	76.1 Å²	76.1	37%	0.37	38%	0.379	S	S	.	.	H	α-helix	trans	-60.3	-47.3	176.2	-169.7	-169	-177.3	-174.3	0	111.7	F248 K249 K254 C255 G256 D261	F248-K252 PolarHBondContact O-N 3.01Å; K249-K252 PolarHBondContact O-N 3.34Å; K252-K254 VanDerWaalsContact C-N 3.32Å; K252-K254 PolarHBondContact O-N 2.7Å; K252-C255 PolarHBondContact O-N 3.22Å; K252-G256 PolarHBondContact O-N 3.11Å; K252-D261 HydrophobicContact CD-CB 4.08Å; K252-D261 WeakPolarHBondContact CD-OD2 3.39Å; K252-D261 WeakPolarHBondContact CE-OD2 3.35Å; K252-D261 IonicContact NZ-OD2 3.07Å; K252-D261 PolarHBondContact NZ-OD2 3.23Å
253	V	64.1	Low	59	Low	125 Å²	125	74.7 Å²	74.7	76%	0.758	37%	0.372	S	S	*	.	H	α-helix	trans	-58.7	-44.5	177.1	170.6	0	0	0	0	110.9	K249 A250 C255	K249-V253 WeakPolarHBondContact O-CG2 3.08Å; K249-V253 PolarHBondContact O-N 2.64Å; A250-V253 PolarHBondContact O-N 3.26Å; V253-C255 VanDerWaalsContact C-N 3.34Å; V253-C255 PolarHBondContact O-N 2.7Å
254	K	61.8	Low	59.1	Low	124 Å²	124	75.3 Å²	75.3	54%	0.539	38%	0.378	S	S	.	.	H	α-helix	trans	-71.8	-23.6	-178.2	-163.2	161.1	-166.3	160.7	0	114.4	S33 A250 M251 K252	S33-K254 PolarHBondContact OG-NZ 3.29Å; A250-K254 WeakPolarHBondContact O-CB 3.05Å; A250-K254 PolarHBondContact O-N 2.87Å; M251-K254 PolarHBondContact O-N 3.45Å; K252-K254 VanDerWaalsContact C-N 3.32Å; K252-K254 PolarHBondContact O-N 2.7Å
255	C	62.1	Low	59.1	Low	52 Å²	52	76.6 Å²	76.6	35%	0.351	39%	0.386	S	S	.	.	H	α-helix	trans	-99	-16.4	-177.9	-175.3	0	0	0	0	113.9	M251 K252 V253 C259	M251-C255 WeakPolarHBondContact O-CB 3.33Å; M251-C255 PolarHBondContact O-N 2.96Å; K252-C255 PolarHBondContact O-N 3.22Å; V253-C255 VanDerWaalsContact C-N 3.34Å; V253-C255 PolarHBondContact O-N 2.7Å; C255-C259 HydrophobicContact CB-CB 3.56Å; C255-C259 WeakPolarHBondContact CB-SG 3.38Å; C255-C259 WeakPolarHBondContact SG-CB 3.26Å; C255-C259 CovalentContact SG-SG 2.02Å; C255-C259 PolarHBondContact SG-SG 2.9Å
256	G	66	Low	58.8	Low	39 Å²	39	78.1 Å²	78.1	40%	0.402	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	64.5	-145	178.9	0	0	0	0	0	113.4	K252 N258	K252-G256 PolarHBondContact O-N 3.11Å; G256-N258 PolarHBondContact O-N 3.22Å; G256-N258 VanDerWaalsContact O-N 3.12Å
257	K	61.2	Low	58.6	Low	211 Å²	211	75.5 Å²	75.5	92%	0.917	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-64.9	-14.3	-173.7	-67.7	-175.2	178.5	-179.9	0	114.7
258	N	59.1	Low	58.5	Low	152 Å²	152	77.6 Å²	77.6	81%	0.813	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-89.5	-13.9	-171.3	-65.2	2.8	0	0	0	113.7	G256	G256-N258 PolarHBondContact O-N 3.22Å; G256-N258 VanDerWaalsContact O-N 3.12Å
259	C	59.8	Low	58.3	Low	28 Å²	28	75.6 Å²	75.6	19%	0.189	38%	0.381	C	S	.	.	S	Bend	trans	-94.2	137.6	177.2	-83.9	0	0	0	0	113	C255	C255-C259 HydrophobicContact CB-CB 3.56Å; C255-C259 WeakPolarHBondContact CB-SG 3.38Å; C255-C259 WeakPolarHBondContact SG-CB 3.26Å; C255-C259 CovalentContact SG-SG 2.02Å; C255-C259 PolarHBondContact SG-SG 2.9Å
260	K	54.8	Low	58.1	Low	127 Å²	127	73.4 Å²	73.4	55%	0.552	37%	0.372	S	S	*	.			trans	-63.2	134.6	167.8	-167.4	175.5	-176.7	-178.8	0	109.8	Y262	K260-Y262 HydrophobicContact CB-CE1 4.44Å; K260-Y262 HydrophobicContact CB-CE2 4.29Å; K260-Y262 HydrophobicContact CD-CE1 4.25Å; K260-Y262 WeakPolarHBondContact O-CD2 3.17Å; K260-Y262 WeakPolarHBondContact O-CE2 3.32Å; K260-Y262 PolarHBondContact O-N 2.89Å; K260-Y262 VanDerWaalsContact O-N 3.09Å
261	D	60.6	Low	58	Low	42 Å²	42	79.1 Å²	79.1	23%	0.225	39%	0.386	C	S	.	.			trans	-81.3	87.8	174	-160.9	-13.1	0	0	0	109.3	K249 K252 I263	K249-D261 IonicContact NZ-OD1 2.69Å; K249-D261 PolarHBondContact NZ-OD1 3.44Å; K249-D261 IonicContact NZ-OD2 2.74Å; K249-D261 PolarHBondContact NZ-OD2 2.75Å; K252-D261 HydrophobicContact CD-CB 4.08Å; K252-D261 WeakPolarHBondContact CD-OD2 3.39Å; K252-D261 WeakPolarHBondContact CE-OD2 3.35Å; K252-D261 IonicContact NZ-OD2 3.07Å; K252-D261 PolarHBondContact NZ-OD2 3.23Å; D261-I263 PolarHBondContact O-N 3.26Å
262	Y	54.3	Low	57.8	Low	86 Å²	86	80.2 Å²	80.2	34%	0.337	39%	0.392	S	S	.	.	S	Bend	trans	-61.3	-28.3	-175.3	-65.7	-81.9	0	0	0	113.5	L18 F248 K260	L18-Y262 PolarHBondContact O-OH 3.42Å; F248-Y262 HydrophobicContact CD1-CD2 4.02Å; F248-Y262 HydrophobicContact CD1-CG 4.31Å; F248-Y262 AromaticContact CE1-CD2 3.97Å; F248-Y262 HydrophobicContact CE1-CD2 3.97Å; F248-Y262 HydrophobicContact CE1-CG 4.07Å; K260-Y262 HydrophobicContact CB-CE1 4.44Å; K260-Y262 HydrophobicContact CB-CE2 4.29Å; K260-Y262 HydrophobicContact CD-CE1 4.25Å; K260-Y262 WeakPolarHBondContact O-CD2 3.17Å; K260-Y262 WeakPolarHBondContact O-CE2 3.32Å; K260-Y262 PolarHBondContact O-N 2.89Å; K260-Y262 VanDerWaalsContact O-N 3.09Å
263	I	58.8	Low	57.9	Low	6 Å²	6	76.5 Å²	76.5	3%	0.031	38%	0.375	C	S	.	.	S	Bend	trans	-133	85.1	176.2	-48.5	-174.1	0	0	0	107.8	I244 Y245 F248 K249 D261 N265 V269 M272	I244-I263 HydrophobicContact CG2-CD1 4.29Å; Y245-I263 HydrophobicContact CD2-CB 4.09Å; Y245-I263 HydrophobicContact CD2-CG2 3.69Å; Y245-I263 HydrophobicContact CE2-CB 4.44Å; Y245-I263 HydrophobicContact CE2-CG2 4.01Å; F248-I263 HydrophobicContact CB-CD1 4.48Å; F248-I263 HydrophobicContact CD2-CD1 3.45Å; F248-I263 VanDerWaalsContact CD2-CD1 3.45Å; F248-I263 HydrophobicContact CD2-CG1 3.97Å; F248-I263 HydrophobicContact CE2-CD1 3.96Å; F248-I263 HydrophobicContact CE2-CG1 4.48Å; F248-I263 HydrophobicContact CG-CD1 4.21Å; F248-I263 HydrophobicContact CG-CG1 4.32Å; K249-I263 WeakPolarHBondContact CE-O 3.46Å; K249-I263 PolarHBondContact NZ-O 2.81Å; D261-I263 PolarHBondContact O-N 3.26Å; I263-N265 PolarHBondContact O-N 3.38Å; I263-V269 HydrophobicContact CG2-CG2 3.62Å; I263-M272 HydrophobicContact CD1-SD 4.36Å
264	P	54.8	Low	57.5	Low	60 Å²	60	72.8 Å²	72.8	39%	0.39	35%	0.351	S	S	.	.			trans	-67.4	-32.9	-165.5	25.1	-33.9	0	0	0	113.5	K249 Y268	K249-P264 VanDerWaalsContact NZ-C 3.33Å; K249-P264 PolarHBondContact NZ-O 3.2Å; P264-Y268 HydrophobicContact CG-CD2 3.68Å; P264-Y268 HydrophobicContact CG-CE2 3.5Å; P264-Y268 VanDerWaalsContact CG-CE2 3.5Å; P264-Y268 HydrophobicContact CG-CG 4.38Å
265	N	56.3	Low	57.1	Low	58 Å²	58	72.8 Å²	72.8	31%	0.31	35%	0.348	S	S	.	.	S	Bend	trans	-140.3	169.7	173.6	72.7	36.4	0	0	0	111.2	I263 Q267 Y268	I263-N265 PolarHBondContact O-N 3.38Å; N265-Q267 PolarHBondContact ND2-OE1 2.95Å; N265-Q267 PolarHBondContact O-N 3.26Å; N265-Q267 WeakPolarHBondContact OD1-CA 3.29Å; N265-Q267 WeakPolarHBondContact OD1-CB 3.44Å; N265-Q267 WeakPolarHBondContact OD1-CG 3.48Å; N265-Q267 PolarHBondContact OD1-N 3.2Å; N265-Y268 PolarHBondContact O-N 2.84Å; N265-Y268 WeakPolarHBondContact OD1-CD2 3.42Å; N265-Y268 PolarHBondContact OD1-N 2.65Å
266	Y	54.4	Low	56.7	Low	59 Å²	59	71.2 Å²	71.2	23%	0.231	34%	0.336	C	S	.	.	H	α-helix	trans	-63	-25	-178.8	-174.1	-135.5	0	0	0	113.6	I242 Y245 Y268 V269 L270 F326 V328	I242-Y266 HydrophobicContact CG1-CE2 4.18Å; Y245-Y266 HydrophobicContact CD1-CD2 4.34Å; Y245-Y266 HydrophobicContact CE1-CD2 4.43Å; Y266-Y268 VanDerWaalsContact C-N 3.27Å; Y266-Y268 PolarHBondContact O-N 3.31Å; Y266-V269 HydrophobicContact CD2-CB 4Å; Y266-V269 HydrophobicContact CD2-CG1 4.43Å; Y266-V269 HydrophobicContact CD2-CG2 3.94Å; Y266-V269 HydrophobicContact CE2-CB 4.33Å; Y266-V269 HydrophobicContact CE2-CG1 4.32Å; Y266-V269 WeakPolarHBondContact O-CB 3.19Å; Y266-V269 PolarHBondContact O-N 2.96Å; Y266-V269 VanDerWaalsContact O-N 3.07Å; Y266-L270 HydrophobicContact CD1-CD1 3.44Å; Y266-L270 VanDerWaalsContact CD1-CD1 3.44Å; Y266-L270 HydrophobicContact CD2-CD1 4.06Å; Y266-L270 HydrophobicContact CD2-CG 4.35Å; Y266-L270 HydrophobicContact CE1-CD1 3.33Å; Y266-L270 HydrophobicContact CE1-CD2 4.43Å; Y266-L270 HydrophobicContact CE1-CG 4.25Å; Y266-L270 HydrophobicContact CE2-CD1 3.95Å; Y266-L270 HydrophobicContact CE2-CD2 4.18Å; Y266-L270 HydrophobicContact CE2-CG 4.05Å; Y266-L270 HydrophobicContact CG-CD1 3.8Å; Y266-L270 WeakPolarHBondContact O-CD1 3.43Å; Y266-L270 WeakPolarHBondContact O-CG 3.2Å; Y266-L270 PolarHBondContact O-N 3.46Å; Y266-F326 HydrophobicContact CE1-CE1 4.42Å; Y266-V328 HydrophobicContact CE1-CG2 4.45Å
267	Q	49.3	Very low	56.2	Low	97 Å²	97	69.5 Å²	69.5	45%	0.453	32%	0.318	S	S	.	.	H	α-helix	trans	-63.4	-32.8	180	-48.5	169.2	-16.4	0	0	111.7	N265 L270 W271 P325	N265-Q267 PolarHBondContact ND2-OE1 2.95Å; N265-Q267 PolarHBondContact O-N 3.26Å; N265-Q267 WeakPolarHBondContact OD1-CA 3.29Å; N265-Q267 WeakPolarHBondContact OD1-CB 3.44Å; N265-Q267 WeakPolarHBondContact OD1-CG 3.48Å; N265-Q267 PolarHBondContact OD1-N 3.2Å; Q267-L270 PolarHBondContact O-N 2.91Å; Q267-W271 WeakPolarHBondContact O-CB 3.35Å; Q267-W271 PolarHBondContact O-N 2.94Å; Q267-P325 HydrophobicContact CB-CB 4.37Å; Q267-P325 VanDerWaalsContact CD-CB 3.5Å; Q267-P325 HydrophobicContact CG-CB 3.84Å
268	Y	53.9	Low	55.7	Low	117 Å²	117	61 Å²	61	46%	0.459	28%	0.284	S	S	.	.	H	α-helix	trans	-65.8	-36	174.1	-78.2	-93.8	0	0	0	112.7	P264 N265 Y266 L270 M272	P264-Y268 HydrophobicContact CG-CD2 3.68Å; P264-Y268 HydrophobicContact CG-CE2 3.5Å; P264-Y268 VanDerWaalsContact CG-CE2 3.5Å; P264-Y268 HydrophobicContact CG-CG 4.38Å; N265-Y268 PolarHBondContact O-N 2.84Å; N265-Y268 WeakPolarHBondContact OD1-CD2 3.42Å; N265-Y268 PolarHBondContact OD1-N 2.65Å; Y266-Y268 VanDerWaalsContact C-N 3.27Å; Y266-Y268 PolarHBondContact O-N 3.31Å; Y268-L270 VanDerWaalsContact C-N 3.27Å; Y268-L270 PolarHBondContact O-N 3.28Å; Y268-M272 WeakPolarHBondContact O-CB 3.45Å; Y268-M272 VanDerWaalsContact O-CG 3.3Å; Y268-M272 WeakPolarHBondContact O-CG 3.13Å; Y268-M272 PolarHBondContact O-N 2.97Å
269	V	57.1	Low	55.2	Low	2 Å²	2	57.8 Å²	57.8	1%	0.012	27%	0.27	C	S	.	.	H	α-helix	trans	-59.6	-43.3	175.4	-173.8	0	0	0	0	110.7	F241 Y245 I263 Y266 M272 Y273	F241-V269 HydrophobicContact CB-CG1 3.7Å; F241-V269 WeakPolarHBondContact O-CG1 3.48Å; Y245-V269 VanDerWaalsContact CB-CG2 3.5Å; Y245-V269 HydrophobicContact CD1-CG2 4.31Å; Y245-V269 HydrophobicContact CD2-CG2 3.28Å; Y245-V269 HydrophobicContact CE2-CG2 4.02Å; Y245-V269 HydrophobicContact CG-CG2 3.45Å; Y245-V269 VanDerWaalsContact CG-CG2 3.45Å; I263-V269 HydrophobicContact CG2-CG2 3.62Å; Y266-V269 HydrophobicContact CD2-CB 4Å; Y266-V269 HydrophobicContact CD2-CG1 4.43Å; Y266-V269 HydrophobicContact CD2-CG2 3.94Å; Y266-V269 HydrophobicContact CE2-CB 4.33Å; Y266-V269 HydrophobicContact CE2-CG1 4.32Å; Y266-V269 WeakPolarHBondContact O-CB 3.19Å; Y266-V269 PolarHBondContact O-N 2.96Å; Y266-V269 VanDerWaalsContact O-N 3.07Å; V269-M272 WeakPolarHBondContact O-CB 3.45Å; V269-M272 PolarHBondContact O-N 3.25Å; V269-Y273 PolarHBondContact O-N 3.42Å
270	L	56.6	Low	54.6	Low	3 Å²	3	60.3 Å²	60.3	2%	0.016	28%	0.281	C	S	.	.	H	α-helix	trans	-82.2	-31.8	-172.7	-62.6	159.5	0	0	0	111.1	L238 Y266 Q267 Y268 N274 F326	L238-L270 HydrophobicContact CD1-CD2 3.8Å; Y266-L270 HydrophobicContact CD1-CD1 3.44Å; Y266-L270 VanDerWaalsContact CD1-CD1 3.44Å; Y266-L270 HydrophobicContact CD2-CD1 4.06Å; Y266-L270 HydrophobicContact CD2-CG 4.35Å; Y266-L270 HydrophobicContact CE1-CD1 3.33Å; Y266-L270 HydrophobicContact CE1-CD2 4.43Å; Y266-L270 HydrophobicContact CE1-CG 4.25Å; Y266-L270 HydrophobicContact CE2-CD1 3.95Å; Y266-L270 HydrophobicContact CE2-CD2 4.18Å; Y266-L270 HydrophobicContact CE2-CG 4.05Å; Y266-L270 HydrophobicContact CG-CD1 3.8Å; Y266-L270 WeakPolarHBondContact O-CD1 3.43Å; Y266-L270 WeakPolarHBondContact O-CG 3.2Å; Y266-L270 PolarHBondContact O-N 3.46Å; Q267-L270 PolarHBondContact O-N 2.91Å; Y268-L270 VanDerWaalsContact C-N 3.27Å; Y268-L270 PolarHBondContact O-N 3.28Å; L270-N274 VanDerWaalsContact O-CB 3.31Å; L270-N274 WeakPolarHBondContact O-CB 3.22Å; L270-N274 PolarHBondContact O-N 3.09Å; L270-N274 PolarHBondContact O-OD1 3.02Å; L270-F326 HydrophobicContact CB-CB 4.16Å; L270-F326 HydrophobicContact CB-CD2 3.96Å; L270-F326 HydrophobicContact CB-CG 4.12Å; L270-F326 HydrophobicContact CD1-CB 3.61Å; L270-F326 HydrophobicContact CD1-CD1 3.32Å; L270-F326 HydrophobicContact CD1-CD2 3.89Å; L270-F326 HydrophobicContact CD1-CE1 3.82Å; L270-F326 HydrophobicContact CD1-CE2 4.34Å; L270-F326 HydrophobicContact CD1-CG 3.34Å; L270-F326 HydrophobicContact CD1-CZ 4.29Å; L270-F326 HydrophobicContact CD2-CD1 4.35Å; L270-F326 HydrophobicContact CD2-CD2 3.92Å; L270-F326 HydrophobicContact CD2-CE1 4.12Å; L270-F326 HydrophobicContact CD2-CE2 3.69Å; L270-F326 HydrophobicContact CD2-CG 4.23Å; L270-F326 HydrophobicContact CD2-CZ 3.78Å; L270-F326 HydrophobicContact CG-CB 4.44Å; L270-F326 HydrophobicContact CG-CD1 4.33Å; L270-F326 HydrophobicContact CG-CD2 4.11Å; L270-F326 HydrophobicContact CG-CE2 4.38Å; L270-F326 HydrophobicContact CG-CG 4.07Å
271	W	55.7	Low	54.3	Low	156 Å²	156	55.6 Å²	55.6	59%	0.591	26%	0.262	S	S	*	.	H	α-helix	trans	-62.2	-44.5	164.3	179.9	88.8	0	0	0	111.5	Q267 N274 W275	Q267-W271 WeakPolarHBondContact O-CB 3.35Å; Q267-W271 PolarHBondContact O-N 2.94Å; W271-N274 PolarHBondContact O-N 2.74Å; W271-W275 VanDerWaalsContact O-CB 3.25Å; W271-W275 WeakPolarHBondContact O-CB 3.44Å; W271-W275 PolarHBondContact O-N 3.4Å
272	M	55	Low	53.4	Low	56 Å²	56	54.1 Å²	54.1	28%	0.276	26%	0.257	S	S	.	.	H	α-helix	trans	-62.6	-45.1	175.1	-75.5	177.5	68.3	0	0	112.1	F241 I263 Y268 V269 W275 V276	F241-M272 HydrophobicContact CD1-CB 4.08Å; F241-M272 HydrophobicContact CE1-CB 3.98Å; I263-M272 HydrophobicContact CD1-SD 4.36Å; Y268-M272 WeakPolarHBondContact O-CB 3.45Å; Y268-M272 VanDerWaalsContact O-CG 3.3Å; Y268-M272 WeakPolarHBondContact O-CG 3.13Å; Y268-M272 PolarHBondContact O-N 2.97Å; V269-M272 WeakPolarHBondContact O-CB 3.45Å; V269-M272 PolarHBondContact O-N 3.25Å; M272-W275 PolarHBondContact O-N 3.42Å; M272-V276 WeakPolarHBondContact O-CG2 3.22Å; M272-V276 PolarHBondContact O-N 3.38Å
273	Y	61.1	Low	52.8	Low	7 Å²	7	53.7 Å²	53.7	3%	0.027	26%	0.264	C	S	.	.	H	α-helix	trans	-57.9	-53.6	174	165.8	-102.2	0	0	0	111.2	P234 F237 L238 F241 V269 W275 V276 I277 L296	P234-Y273 WeakPolarHBondContact O-CE2 3.36Å; P234-Y273 PolarHBondContact O-OH 2.93Å; F237-Y273 HydrophobicContact CB-CE2 4.3Å; L238-Y273 HydrophobicContact CB-CD2 4.19Å; L238-Y273 HydrophobicContact CB-CE2 3.82Å; L238-Y273 HydrophobicContact CD1-CD1 3.98Å; L238-Y273 HydrophobicContact CD1-CD2 4.05Å; L238-Y273 HydrophobicContact CD1-CE1 4.31Å; L238-Y273 HydrophobicContact CD1-CE2 4.36Å; L238-Y273 HydrophobicContact CD1-CG 3.85Å; F241-Y273 AromaticContact CD2-CD2 3.73Å; F241-Y273 HydrophobicContact CD2-CD2 3.73Å; F241-Y273 HydrophobicContact CD2-CG 4.26Å; F241-Y273 AromaticContact CE2-CD2 3.86Å; F241-Y273 HydrophobicContact CE2-CD2 3.86Å; F241-Y273 HydrophobicContact CE2-CG 4.5Å; V269-Y273 PolarHBondContact O-N 3.42Å; Y273-W275 VanDerWaalsContact C-N 3.32Å; Y273-W275 PolarHBondContact O-N 3.3Å; Y273-V276 PolarHBondContact O-N 2.91Å; Y273-I277 HydrophobicContact CD2-CG1 4.02Å; Y273-I277 HydrophobicContact CE1-CG1 4.43Å; Y273-I277 HydrophobicContact CE2-CD1 4.09Å; Y273-I277 HydrophobicContact CE2-CG1 3.67Å; Y273-I277 WeakPolarHBondContact O-CG1 3.34Å; Y273-I277 PolarHBondContact O-N 2.74Å; Y273-L296 HydrophobicContact CE1-CD1 4.22Å; Y273-L296 HydrophobicContact CE1-CD2 3.89Å
274	N	54.8	Low	52.1	Low	46 Å²	46	59.8 Å²	59.8	25%	0.246	29%	0.291	C	S	.	.	H	α-helix	trans	-59.7	-41.1	178.7	-73.5	-2.3	0	0	0	111.9	L270 W271 I277 C278 L296	L270-N274 VanDerWaalsContact O-CB 3.31Å; L270-N274 WeakPolarHBondContact O-CB 3.22Å; L270-N274 PolarHBondContact O-N 3.09Å; L270-N274 PolarHBondContact O-OD1 3.02Å; W271-N274 PolarHBondContact O-N 2.74Å; N274-I277 PolarHBondContact O-N 2.04Å; N274-C278 WeakPolarHBondContact O-CB 3.36Å; N274-C278 PolarHBondContact O-N 3.42Å; N274-C278 PolarHBondContact O-SG 3.07Å; N274-L296 WeakPolarHBondContact OD1-CD1 3.21Å; N274-L296 WeakPolarHBondContact OD1-CG 3.35Å
275	W	52.9	Low	51.3	Low	125 Å²	125	62.2 Å²	62.2	47%	0.473	31%	0.306	S	S	.	.	H	α-helix	trans	-60.7	-51	176.3	-180	80.2	0	0	0	111.4	W271 M272 Y273 I277 C278 T279	W271-W275 VanDerWaalsContact O-CB 3.25Å; W271-W275 WeakPolarHBondContact O-CB 3.44Å; W271-W275 PolarHBondContact O-N 3.4Å; M272-W275 PolarHBondContact O-N 3.42Å; Y273-W275 VanDerWaalsContact C-N 3.32Å; Y273-W275 PolarHBondContact O-N 3.3Å; W275-I277 PolarHBondContact O-N 3.41Å; W275-C278 PolarHBondContact O-N 3.29Å; W275-T279 WeakPolarHBondContact O-CB 3.44Å; W275-T279 PolarHBondContact O-N 3Å; W275-T279 PolarHBondContact O-OG1 3.22Å; W275-T279 VanDerWaalsContact O-OG1 3.11Å
276	V	55.1	Low	50.6	Low	18 Å²	18	67.9 Å²	67.9	11%	0.109	33%	0.328	C	S	.	.	H	α-helix	trans	-59.8	-45.5	177.8	171.7	0	0	0	0	111.6	I6 F241 M272 Y273 I280	I6-V276 HydrophobicContact CD1-CG1 4.1Å; I6-V276 HydrophobicContact CG1-CG1 4.39Å; F241-V276 HydrophobicContact CE1-CG2 4.24Å; F241-V276 HydrophobicContact CZ-CB 3.91Å; F241-V276 HydrophobicContact CZ-CG1 4.21Å; F241-V276 HydrophobicContact CZ-CG2 3.83Å; M272-V276 WeakPolarHBondContact O-CG2 3.22Å; M272-V276 PolarHBondContact O-N 3.38Å; Y273-V276 PolarHBondContact O-N 2.91Å; V276-I280 HydrophobicContact CG1-CD1 3.98Å; V276-I280 VanDerWaalsContact O-CB 3.28Å; V276-I280 WeakPolarHBondContact O-CB 2.95Å; V276-I280 VanDerWaalsContact O-CG1 3.28Å; V276-I280 WeakPolarHBondContact O-CG1 3.29Å; V276-I280 PolarHBondContact O-N 3.44Å
277	I	54.7	Low	49.9	Very low	4 Å²	4	67.4 Å²	67.4	2%	0.021	33%	0.33	C	S	.	.	H	α-helix	trans	-63.5	-50.3	178.3	-66.1	-54	0	0	0	111.5	P234 F237 Y273 N274 W275 I280 L281 G282 L296	P234-I277 HydrophobicContact CB-CD1 3.83Å; P234-I277 HydrophobicContact CB-CG1 4.09Å; P234-I277 HydrophobicContact CB-CG2 3.84Å; P234-I277 HydrophobicContact CG-CG2 4.08Å; F237-I277 HydrophobicContact CD2-CD1 3.95Å; Y273-I277 HydrophobicContact CD2-CG1 4.02Å; Y273-I277 HydrophobicContact CE1-CG1 4.43Å; Y273-I277 HydrophobicContact CE2-CD1 4.09Å; Y273-I277 HydrophobicContact CE2-CG1 3.67Å; Y273-I277 WeakPolarHBondContact O-CG1 3.34Å; Y273-I277 PolarHBondContact O-N 2.74Å; N274-I277 PolarHBondContact O-N 2.04Å; W275-I277 PolarHBondContact O-N 3.41Å; I277-I280 PolarHBondContact O-N 3.19Å; I277-L281 HydrophobicContact CD1-CD1 4.17Å; I277-L281 HydrophobicContact CG2-CD1 4.36Å; I277-L281 WeakPolarHBondContact O-CB 3.44Å; I277-L281 PolarHBondContact O-N 3.32Å; I277-G282 PolarHBondContact O-N 3.34Å; I277-L296 HydrophobicContact CB-CD2 3.99Å; I277-L296 HydrophobicContact CG1-CD2 4.35Å; I277-L296 HydrophobicContact CG2-CD2 3.61Å
278	C	50	Low	49.6	Very low	31 Å²	31	64.1 Å²	64.1	21%	0.209	32%	0.315	C	S	.	.	H	α-helix	trans	-75.7	-28	-172.3	-63	0	0	0	0	113.6	N274 W275 G282 C297	N274-C278 WeakPolarHBondContact O-CB 3.36Å; N274-C278 PolarHBondContact O-N 3.42Å; N274-C278 PolarHBondContact O-SG 3.07Å; W275-C278 PolarHBondContact O-N 3.29Å; C278-G282 WeakPolarHBondContact O-CA 3.47Å; C278-C297 WeakPolarHBondContact CA-SG 3.47Å; C278-C297 HydrophobicContact CB-CB 3.8Å; C278-C297 WeakPolarHBondContact CB-SG 3.46Å; C278-C297 WeakPolarHBondContact SG-CA 3.39Å; C278-C297 WeakPolarHBondContact SG-CB 3.37Å; C278-C297 CovalentContact SG-SG 2.03Å; C278-C297 PolarHBondContact SG-SG 2.88Å
279	T	49.5	Very low	48.8	Very low	85 Å²	85	63.3 Å²	63.3	52%	0.521	32%	0.318	S	S	.	.	H	α-helix	trans	-75.7	-28.7	172.8	-65.2	0	0	0	0	112.5	W275	W275-T279 WeakPolarHBondContact O-CB 3.44Å; W275-T279 PolarHBondContact O-N 3Å; W275-T279 PolarHBondContact O-OG1 3.22Å; W275-T279 VanDerWaalsContact O-OG1 3.11Å
280	I	48.1	Very low	48	Very low	81 Å²	81	65.8 Å²	65.8	42%	0.415	33%	0.331	S	S	.	.	H	α-helix	trans	-106.4	-49.3	-170.5	-59.5	-179.7	0	0	0	113.4	L2 V276 I277	L2-I280 HydrophobicContact CD1-CD1 3.57Å; L2-I280 HydrophobicContact CD1-CG2 3.91Å; L2-I280 HydrophobicContact CD2-CG2 4.49Å; V276-I280 HydrophobicContact CG1-CD1 3.98Å; V276-I280 VanDerWaalsContact O-CB 3.28Å; V276-I280 WeakPolarHBondContact O-CB 2.95Å; V276-I280 VanDerWaalsContact O-CG1 3.28Å; V276-I280 WeakPolarHBondContact O-CG1 3.29Å; V276-I280 PolarHBondContact O-N 3.44Å; I277-I280 PolarHBondContact O-N 3.19Å
281	L	47	Very low	47.1	Very low	28 Å²	28	66.8 Å²	66.8	15%	0.147	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-40.7	177.8	-61.8	178.6	0	0	0	110.7	P234 I277 N287	P234-L281 HydrophobicContact CB-CD1 4.4Å; P234-L281 HydrophobicContact CG-CD1 3.91Å; I277-L281 HydrophobicContact CD1-CD1 4.17Å; I277-L281 HydrophobicContact CG2-CD1 4.36Å; I277-L281 WeakPolarHBondContact O-CB 3.44Å; I277-L281 PolarHBondContact O-N 3.32Å; L281-N287 PolarHBondContact O-ND2 2.78Å
282	G	41.4	Very low	46.5	Very low	11 Å²	11	61 Å²	61	11%	0.113	32%	0.322	C	S	.	.			trans	70.6	164	175.3	0	0	0	0	0	114.9	I277 C278 K284	I277-G282 PolarHBondContact O-N 3.34Å; C278-G282 WeakPolarHBondContact O-CA 3.47Å; G282-K284 PolarHBondContact O-N 2.9Å
283	P	42.6	Very low	45.6	Very low	77 Å²	77	58.3 Å²	58.3	50%	0.5	31%	0.309	S	S	.	.	S	Bend	trans	-81.2	30.5	-173.5	35.6	-38.7	0	0	0	113.4	C297	P283-C297 HydrophobicContact CB-CB 4.36Å
284	K	44.3	Very low	44.3	Very low	134 Å²	134	59.9 Å²	59.9	58%	0.583	32%	0.32	S	S	*	.			trans	-84.7	128.1	-175.8	-70.8	-175.2	177.7	179.1	0	110.1	G282 K286 N287 D288	G282-K284 PolarHBondContact O-N 2.9Å; K284-K286 PolarHBondContact O-N 3.29Å; K284-K286 VanDerWaalsContact O-N 3.1Å; K284-N287 WeakPolarHBondContact O-CA 3.41Å; K284-N287 PolarHBondContact O-N 3.43Å; K284-D288 PolarHBondContact O-N 3.48Å
285	P	37.7	Very low	43.7	Very low	111 Å²	111	64.9 Å²	64.9	72%	0.721	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-52	-37.5	-179.2	-31	36.4	0	0	0	114.4	N287 D288	P285-N287 PolarHBondContact O-N 3.27Å; P285-N287 VanDerWaalsContact O-N 3.12Å; P285-D288 PolarHBondContact O-N 3.5Å
286	K	41.9	Very low	43.4	Very low	178 Å²	178	60.9 Å²	60.9	77%	0.774	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-68.5	-6.5	177.2	75.6	146.3	-143.4	154	0	115.8	K284	K284-K286 PolarHBondContact O-N 3.29Å; K284-K286 VanDerWaalsContact O-N 3.1Å
287	N	40.2	Very low	42.8	Very low	48 Å²	48	61.6 Å²	61.6	26%	0.257	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-114.9	4	175	-65.3	3.2	0	0	0	111	L281 K284 P285	L281-N287 PolarHBondContact O-ND2 2.78Å; K284-N287 WeakPolarHBondContact O-CA 3.41Å; K284-N287 PolarHBondContact O-N 3.43Å; P285-N287 PolarHBondContact O-N 3.27Å; P285-N287 VanDerWaalsContact O-N 3.12Å
288	D	42.7	Very low	42.1	Very low	28 Å²	28	70.3 Å²	70.3	15%	0.15	37%	0.366	C	S	.	.			trans	-116.2	67	-169.3	-179.3	46.9	0	0	0	110.4	K284 P285 D290 G291 I292 C293 P294	K284-D288 PolarHBondContact O-N 3.48Å; P285-D288 PolarHBondContact O-N 3.5Å; D288-D290 PolarHBondContact O-N 3.13Å; D288-G291 WeakPolarHBondContact OD1-CA 3.3Å; D288-G291 PolarHBondContact OD1-N 2.92Å; D288-G291 WeakPolarHBondContact OD2-CA 3.19Å; D288-I292 PolarHBondContact OD1-N 2.64Å; D288-C293 HydrophobicContact CB-CB 4.16Å; D288-C293 WeakPolarHBondContact OD1-CB 3.42Å; D288-C293 PolarHBondContact OD1-N 2.86Å; D288-P294 WeakPolarHBondContact OD1-CD 3.46Å; D288-P294 WeakPolarHBondContact OD2-CD 3.45Å; D288-P294 WeakPolarHBondContact OD2-CG 3.33Å
289	I	37.7	Very low	41.3	Very low	101 Å²	101	72.8 Å²	72.8	52%	0.518	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-19.3	-170.7	-63.2	144.4	0	0	0	112.1	G229 L232	G229-I289 WeakPolarHBondContact O-CD1 3.46Å; L232-I289 HydrophobicContact CB-CD1 4.09Å; L232-I289 HydrophobicContact CD1-CD1 4.27Å
290	D	38.6	Very low	40.7	Very low	54 Å²	54	75.2 Å²	75.2	29%	0.289	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.9	0.2	-175.2	59.3	2.9	0	0	0	113.9	D288 I292	D288-D290 PolarHBondContact O-N 3.13Å; D290-I292 VanDerWaalsContact C-N 3.27Å; D290-I292 HydrophobicContact CB-CD1 4.11Å; D290-I292 HydrophobicContact CB-CG1 4.39Å; D290-I292 PolarHBondContact O-N 2.96Å; D290-I292 WeakPolarHBondContact OD1-CB 3.31Å; D290-I292 PolarHBondContact OD1-N 3.37Å; D290-I292 VanDerWaalsContact OD1-N 3.16Å; D290-I292 WeakPolarHBondContact OD2-CD1 3.29Å
291	G	38.7	Very low	40.2	Very low	24 Å²	24	76.4 Å²	76.4	25%	0.247	39%	0.385	C	S	.	.	S	Bend	trans	67.9	24.3	-177.8	0	0	0	0	0	113.7	D288 K295	D288-G291 WeakPolarHBondContact OD1-CA 3.3Å; D288-G291 PolarHBondContact OD1-N 2.92Å; D288-G291 WeakPolarHBondContact OD2-CA 3.19Å; G291-K295 VanDerWaalsContact O-CD 3.25Å; G291-K295 WeakPolarHBondContact O-CD 3.35Å; G291-K295 WeakPolarHBondContact O-CE 3.5Å; G291-K295 PolarHBondContact O-NZ 3.41Å
292	I	42.4	Very low	39.9	Very low	33 Å²	33	78.7 Å²	78.7	17%	0.169	40%	0.397	C	S	.	.			trans	-106	-30.7	-174.6	-70.5	168.9	0	0	0	112.2	D288 D290 K295 L296	D288-I292 PolarHBondContact OD1-N 2.64Å; D290-I292 VanDerWaalsContact C-N 3.27Å; D290-I292 HydrophobicContact CB-CD1 4.11Å; D290-I292 HydrophobicContact CB-CG1 4.39Å; D290-I292 PolarHBondContact O-N 2.96Å; D290-I292 WeakPolarHBondContact OD1-CB 3.31Å; D290-I292 PolarHBondContact OD1-N 3.37Å; D290-I292 VanDerWaalsContact OD1-N 3.16Å; D290-I292 WeakPolarHBondContact OD2-CD1 3.29Å; I292-K295 CarbonylContact O-C 3.48Å; I292-K295 WeakPolarHBondContact O-CA 3.39Å; I292-K295 WeakPolarHBondContact O-CB 3.38Å; I292-K295 PolarHBondContact O-N 3.08Å; I292-L296 WeakPolarHBondContact O-CB 3.47Å; I292-L296 PolarHBondContact O-N 2.78Å
293	C	37.2	Very low	39.8	Very low	1 Å²	1	83 Å²	83	1%	0.007	42%	0.417	C	S	.	.	H	α-helix	trans	-59.6	-45.6	179.9	-76	0	0	0	0	112.7	D288 K295 L296 C297	D288-C293 HydrophobicContact CB-CB 4.16Å; D288-C293 WeakPolarHBondContact OD1-CB 3.42Å; D288-C293 PolarHBondContact OD1-N 2.86Å; C293-K295 PolarHBondContact O-N 2.96Å; C293-L296 PolarHBondContact O-N 2.97Å; C293-C297 VanDerWaalsContact O-CB 3.25Å; C293-C297 WeakPolarHBondContact O-CB 3.32Å; C293-C297 PolarHBondContact O-N 3.45Å; C293-C297 PolarHBondContact O-SG 3.22Å
294	P	32.4	Very low	39.7	Very low	40 Å²	40	82.8 Å²	82.8	26%	0.26	41%	0.411	S	S	.	.	H	α-helix	trans	-68.1	-7.5	172	-22.8	34.4	0	0	0	115.5	D288 R298	D288-P294 WeakPolarHBondContact OD1-CD 3.46Å; D288-P294 WeakPolarHBondContact OD2-CD 3.45Å; D288-P294 WeakPolarHBondContact OD2-CG 3.33Å; P294-R298 VanDerWaalsContact O-CD 3.24Å; P294-R298 WeakPolarHBondContact O-CD 3.28Å; P294-R298 VanDerWaalsContact O-CG 3.25Å; P294-R298 WeakPolarHBondContact O-CG 3.39Å; P294-R298 PolarHBondContact O-NE 2.94Å
295	K	42.2	Very low	39.6	Very low	151 Å²	151	85.8 Å²	85.8	66%	0.657	42%	0.424	S	S	*	.	H	α-helix	trans	-98.7	-37.5	173.4	-63.6	175.5	-174.7	137.9	0	111.2	G291 I292 C293	G291-K295 VanDerWaalsContact O-CD 3.25Å; G291-K295 WeakPolarHBondContact O-CD 3.35Å; G291-K295 WeakPolarHBondContact O-CE 3.5Å; G291-K295 PolarHBondContact O-NZ 3.41Å; I292-K295 CarbonylContact O-C 3.48Å; I292-K295 WeakPolarHBondContact O-CA 3.39Å; I292-K295 WeakPolarHBondContact O-CB 3.38Å; I292-K295 PolarHBondContact O-N 3.08Å; C293-K295 PolarHBondContact O-N 2.96Å
296	L	46.4	Very low	40.1	Very low	41 Å²	41	84.3 Å²	84.3	22%	0.215	41%	0.41	C	S	.	.	H	α-helix	trans	-73.9	-36.5	178	-157.7	79.6	0	0	0	112.2	Y273 N274 I277 I292 C293 R298	Y273-L296 HydrophobicContact CE1-CD1 4.22Å; Y273-L296 HydrophobicContact CE1-CD2 3.89Å; N274-L296 WeakPolarHBondContact OD1-CD1 3.21Å; N274-L296 WeakPolarHBondContact OD1-CG 3.35Å; I277-L296 HydrophobicContact CB-CD2 3.99Å; I277-L296 HydrophobicContact CG1-CD2 4.35Å; I277-L296 HydrophobicContact CG2-CD2 3.61Å; I292-L296 WeakPolarHBondContact O-CB 3.47Å; I292-L296 PolarHBondContact O-N 2.78Å; C293-L296 PolarHBondContact O-N 2.97Å; L296-R298 PolarHBondContact O-N 3.16Å
297	C	44.1	Very low	40.3	Very low	33 Å²	33	82 Å²	82	22%	0.223	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	29.1	-173.6	-53.3	0	0	0	0	114.1	C278 P283 C293	C278-C297 WeakPolarHBondContact CA-SG 3.47Å; C278-C297 HydrophobicContact CB-CB 3.8Å; C278-C297 WeakPolarHBondContact CB-SG 3.46Å; C278-C297 WeakPolarHBondContact SG-CA 3.39Å; C278-C297 WeakPolarHBondContact SG-CB 3.37Å; C278-C297 CovalentContact SG-SG 2.03Å; C278-C297 PolarHBondContact SG-SG 2.88Å; P283-C297 HydrophobicContact CB-CB 4.36Å; C293-C297 VanDerWaalsContact O-CB 3.25Å; C293-C297 WeakPolarHBondContact O-CB 3.32Å; C293-C297 PolarHBondContact O-N 3.45Å; C293-C297 PolarHBondContact O-SG 3.22Å
298	R	39.3	Very low	40.4	Very low	186 Å²	186	86.6 Å²	86.6	70%	0.702	42%	0.424	S	S	*	.			trans	-99.3	136	178.8	-93	177.7	-168.9	-153.4	0	113.2	P294 L296	P294-R298 VanDerWaalsContact O-CD 3.24Å; P294-R298 WeakPolarHBondContact O-CD 3.28Å; P294-R298 VanDerWaalsContact O-CG 3.25Å; P294-R298 WeakPolarHBondContact O-CG 3.39Å; P294-R298 PolarHBondContact O-NE 2.94Å; L296-R298 PolarHBondContact O-N 3.16Å
299	P	33.6	Very low	40.4	Very low	83 Å²	83	88.4 Å²	88.4	54%	0.539	43%	0.433	S	S	.	.			trans	-71.6	170.4	161.2	30.2	-33	0	0	0	113.1	I320 K321	P299-I320 HydrophobicContact CB-CB 4.48Å; P299-I320 HydrophobicContact CB-CG1 4.25Å; P299-I320 HydrophobicContact CB-CG2 3.56Å; P299-K321 WeakPolarHBondContact CB-O 3.34Å
300	R	35.9	Very low	40.6	Very low	137 Å²	137	85.7 Å²	85.7	52%	0.517	42%	0.418	S	S	.	.			trans	-157.2	13.2	-150.8	-114.9	-164.7	-172.5	-176.5	-5.2	122.5	K321 I322 I323 N324	R300-K321 PolarHBondContact N-O 3.46Å; R300-I322 WeakPolarHBondContact CB-O 3.2Å; R300-I323 VanDerWaalsContact CB-O 3.29Å; R300-I323 WeakPolarHBondContact CB-O 3.26Å; R300-I323 WeakPolarHBondContact CD-O 3.03Å; R300-I323 WeakPolarHBondContact O-CG1 3.07Å; R300-I323 PolarHBondContact O-N 3.04Å; R300-N324 PolarHBondContact NH1-O 3.47Å
301	E	37.8	Very low	40.6	Very low	105 Å²	105	89.1 Å²	89.1	49%	0.491	43%	0.433	S	S	.	.	S	Bend	trans	112.5	-88	179.8	-74	-74.4	131.5	0	0	120.3	K321 I322 I323	E301-K321 VanDerWaalsContact C-C 3.43Å; E301-K321 HydrophobicContact CG-CD 4.43Å; E301-K321 PolarHBondContact N-O 3.1Å; E301-K321 VanDerWaalsContact N-O 3.16Å; E301-K321 CarbonylContact O-C 3.23Å; E301-K321 WeakPolarHBondContact O-CA 3.41Å; E301-K321 WeakPolarHBondContact O-CB 3.47Å; E301-K321 WeakPolarHBondContact O-CD 3.48Å; E301-K321 WeakPolarHBondContact O-CG 3.29Å; E301-K321 WeakPolarHBondContact OE1-CD 3.3Å; E301-K321 WeakPolarHBondContact OE1-CE 3.17Å; E301-K321 IonicContact OE1-NZ 3.45Å; E301-K321 PolarHBondContact OE1-NZ 2.92Å; E301-K321 WeakPolarHBondContact OE2-CD 3.22Å; E301-K321 IonicContact OE2-NZ 2.7Å; E301-K321 PolarHBondContact OE2-NZ 3.38Å; E301-I322 PolarHBondContact O-N 2.78Å; E301-I323 HydrophobicContact CB-CD1 3.52Å; E301-I323 HydrophobicContact CB-CG1 3.43Å; E301-I323 VanDerWaalsContact CB-CG1 3.43Å
302	D	40.7	Very low	40.5	Very low	77 Å²	77	91.9 Å²	91.9	41%	0.412	44%	0.441	S	S	.	.			trans	-138.2	143.4	178.7	-177.9	33.5	0	0	0	116.1	I304 I323	D302-I304 WeakPolarHBondContact OD1-CB 3.14Å; D302-I304 WeakPolarHBondContact OD1-CG1 3.03Å; D302-I304 PolarHBondContact OD1-N 2.66Å; D302-I323 WeakPolarHBondContact O-CA 3.44Å; D302-I323 WeakPolarHBondContact O-CB 3.38Å; D302-I323 WeakPolarHBondContact O-CG2 3.34Å; D302-I323 PolarHBondContact O-N 2.94Å
303	L	40	Very low	40.2	Very low	102 Å²	102	91.7 Å²	91.7	53%	0.534	44%	0.44	S	S	.	.			trans	-164.1	34.8	164.7	-142.1	166.6	0	0	0	110.3	K305 I322	L303-K305 PolarHBondContact O-N 2.72Å; L303-I322 HydrophobicContact CB-CB 3.61Å; L303-I322 HydrophobicContact CB-CD1 3.88Å; L303-I322 HydrophobicContact CB-CG1 4.35Å; L303-I322 HydrophobicContact CB-CG2 3.48Å; L303-I322 VanDerWaalsContact CB-CG2 3.48Å; L303-I322 HydrophobicContact CD1-CG2 4.04Å; L303-I322 HydrophobicContact CG-CG2 4.42Å
304	I	39.2	Very low	40.2	Very low	72 Å²	72	96.5 Å²	96.5	37%	0.369	47%	0.465	S	S	.	.			trans	-86.1	-8.6	-151.8	-81.7	169.6	0	0	0	116.1	D302 N306 Q310 I322	D302-I304 WeakPolarHBondContact OD1-CB 3.14Å; D302-I304 WeakPolarHBondContact OD1-CG1 3.03Å; D302-I304 PolarHBondContact OD1-N 2.66Å; I304-N306 PolarHBondContact O-N 2.87Å; I304-Q310 PolarHBondContact O-NE2 3.07Å; I304-I322 HydrophobicContact CG1-CD1 3.9Å
305	K	43.7	Very low	40.3	Very low	196 Å²	196	101.7 Å²	101.7	85%	0.852	49%	0.49	S	S	*	.			trans	-89.4	34.6	-163.7	-59.4	-174.3	179.6	179.2	0	117.2	L303	L303-K305 PolarHBondContact O-N 2.72Å
306	N	48.3	Very low	39.9	Very low	81 Å²	81	98.8 Å²	98.8	43%	0.433	49%	0.485	S	S	.	.			trans	-137.8	114.7	176.8	-176.3	-31	0	0	0	111.6	I304 F308 I309 Q310	I304-N306 PolarHBondContact O-N 2.87Å; N306-F308 VanDerWaalsContact C-N 3.3Å; N306-F308 PolarHBondContact O-N 2.9Å; N306-F308 PolarHBondContact OD1-N 3.31Å; N306-F308 VanDerWaalsContact OD1-N 3.1Å; N306-I309 HydrophobicContact CB-CB 4.3Å; N306-I309 HydrophobicContact CB-CD1 4.25Å; N306-I309 HydrophobicContact CB-CG1 4.31Å; N306-I309 PolarHBondContact O-N 2.96Å; N306-Q310 PolarHBondContact O-N 3.4Å
307	D	45.7	Very low	39	Very low	128 Å²	128	102.6 Å²	102.6	68%	0.684	50%	0.5	S	S	*	.	H	α-helix	trans	-58.4	-36.4	-173.9	-61.4	-25.4	0	0	0	113.8	I309 Q310 Q311	D307-I309 VanDerWaalsContact C-N 3.31Å; D307-I309 PolarHBondContact O-N 3.41Å; D307-Q310 PolarHBondContact O-N 2.74Å; D307-Q311 WeakPolarHBondContact O-CG 3.38Å; D307-Q311 PolarHBondContact O-N 3.26Å
308	F	42.7	Very low	38.3	Very low	145 Å²	145	110 Å²	110	64%	0.636	53%	0.529	S	S	*	.	H	α-helix	trans	-66.6	-36.7	178.2	-173.8	-100.5	0	0	0	111.5	N306 I312	N306-F308 VanDerWaalsContact C-N 3.3Å; N306-F308 PolarHBondContact O-N 2.9Å; N306-F308 PolarHBondContact OD1-N 3.31Å; N306-F308 VanDerWaalsContact OD1-N 3.1Å; F308-I312 HydrophobicContact CD1-CD1 4.07Å; F308-I312 HydrophobicContact CE1-CD1 3.7Å; F308-I312 HydrophobicContact CZ-CD1 4.2Å; F308-I312 WeakPolarHBondContact O-CG1 3.3Å; F308-I312 PolarHBondContact O-N 2.69Å
309	I	41.8	Very low	37.8	Very low	66 Å²	66	106.8 Å²	106.8	34%	0.338	53%	0.532	S	S	.	.	H	α-helix	trans	-75.2	-37.2	175.8	-62.7	-179.3	0	0	0	110.2	N306 D307 Q311 I312 I313	N306-I309 HydrophobicContact CB-CB 4.3Å; N306-I309 HydrophobicContact CB-CD1 4.25Å; N306-I309 HydrophobicContact CB-CG1 4.31Å; N306-I309 PolarHBondContact O-N 2.96Å; D307-I309 VanDerWaalsContact C-N 3.31Å; D307-I309 PolarHBondContact O-N 3.41Å; I309-Q311 PolarHBondContact O-N 3Å; I309-I312 PolarHBondContact O-N 3.3Å; I309-I313 HydrophobicContact CG2-CD1 3.78Å; I309-I313 HydrophobicContact CG2-CG1 4.3Å; I309-I313 WeakPolarHBondContact O-CG1 3.47Å; I309-I313 PolarHBondContact O-N 3.01Å
310	Q	41.3	Very low	38	Very low	44 Å²	44	105.6 Å²	105.6	21%	0.206	52%	0.52	C	S	.	.	H	α-helix	trans	-61.1	-40.8	174.3	-75.6	-63.5	-16.1	0	0	113	I304 N306 D307 I312 I313 N314	I304-Q310 PolarHBondContact O-NE2 3.07Å; N306-Q310 PolarHBondContact O-N 3.4Å; D307-Q310 PolarHBondContact O-N 2.74Å; Q310-I312 PolarHBondContact O-N 3.2Å; Q310-I313 PolarHBondContact O-N 3.06Å; Q310-N314 WeakPolarHBondContact O-CB 3.38Å; Q310-N314 PolarHBondContact O-N 2.96Å; Q310-N314 PolarHBondContact O-ND2 2.8Å
311	Q	40.2	Very low	37.8	Very low	127 Å²	127	104.5 Å²	104.5	59%	0.593	52%	0.519	S	S	*	.	H	α-helix	trans	-62.1	-43.1	175.7	-72	175.9	20.2	0	0	111.6	D307 I309 L315	D307-Q311 WeakPolarHBondContact O-CG 3.38Å; D307-Q311 PolarHBondContact O-N 3.26Å; I309-Q311 PolarHBondContact O-N 3Å; Q311-L315 WeakPolarHBondContact O-CB 3.14Å; Q311-L315 WeakPolarHBondContact O-CD1 3.22Å; Q311-L315 VanDerWaalsContact O-CG 3.26Å; Q311-L315 WeakPolarHBondContact O-CG 3.44Å; Q311-L315 PolarHBondContact O-N 3.21Å; Q311-L315 VanDerWaalsContact O-N 3.12Å
312	I	36	Very low	37.4	Very low	81 Å²	81	101.5 Å²	101.5	42%	0.415	51%	0.506	S	S	.	.	H	α-helix	trans	-65.6	-41.9	177.5	-66.1	169.5	0	0	0	111.5	F308 I309 Q310 L315 T316	F308-I312 HydrophobicContact CD1-CD1 4.07Å; F308-I312 HydrophobicContact CE1-CD1 3.7Å; F308-I312 HydrophobicContact CZ-CD1 4.2Å; F308-I312 WeakPolarHBondContact O-CG1 3.3Å; F308-I312 PolarHBondContact O-N 2.69Å; I309-I312 PolarHBondContact O-N 3.3Å; Q310-I312 PolarHBondContact O-N 3.2Å; I312-L315 PolarHBondContact O-N 3.29Å; I312-T316 PolarHBondContact O-N 3.15Å; I312-T316 PolarHBondContact O-OG1 3.17Å
313	I	35.5	Very low	37.1	Very low	30 Å²	30	101.5 Å²	101.5	15%	0.154	51%	0.505	C	S	.	.	H	α-helix	trans	-62.7	-52.6	176.5	-70.2	171.1	0	0	0	110.6	I309 Q310 L315 T316 F317 I322	I309-I313 HydrophobicContact CG2-CD1 3.78Å; I309-I313 HydrophobicContact CG2-CG1 4.3Å; I309-I313 WeakPolarHBondContact O-CG1 3.47Å; I309-I313 PolarHBondContact O-N 3.01Å; Q310-I313 PolarHBondContact O-N 3.06Å; I313-L315 PolarHBondContact O-N 3.32Å; I313-T316 PolarHBondContact O-N 3.22Å; I313-T316 PolarHBondContact O-OG1 3.48Å; I313-F317 PolarHBondContact O-N 2.89Å; I313-I322 HydrophobicContact CD1-CD1 3.87Å
314	N	37.3	Very low	37	Very low	102 Å²	102	101.9 Å²	101.9	55%	0.545	51%	0.508	S	S	.	.	H	α-helix	trans	-63.7	-24.5	-177.5	-73.3	-43.7	0	0	0	113.6	Q310	Q310-N314 WeakPolarHBondContact O-CB 3.38Å; Q310-N314 PolarHBondContact O-N 2.96Å; Q310-N314 PolarHBondContact O-ND2 2.8Å
315	L	34.9	Very low	36.8	Very low	149 Å²	149	101.5 Å²	101.5	78%	0.78	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-13.5	174.3	-76.2	168.8	0	0	0	114.2	Q311 I312 I313	Q311-L315 WeakPolarHBondContact O-CB 3.14Å; Q311-L315 WeakPolarHBondContact O-CD1 3.22Å; Q311-L315 VanDerWaalsContact O-CG 3.26Å; Q311-L315 WeakPolarHBondContact O-CG 3.44Å; Q311-L315 PolarHBondContact O-N 3.21Å; Q311-L315 VanDerWaalsContact O-N 3.12Å; I312-L315 PolarHBondContact O-N 3.29Å; I313-L315 PolarHBondContact O-N 3.32Å
316	T	33.3	Very low	36.7	Very low	89 Å²	89	94.9 Å²	94.9	55%	0.546	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.5	-24.3	-169.9	54.1	0	0	0	0	115.6	I312 I313	I312-T316 PolarHBondContact O-N 3.15Å; I312-T316 PolarHBondContact O-OG1 3.17Å; I313-T316 PolarHBondContact O-N 3.22Å; I313-T316 PolarHBondContact O-OG1 3.48Å
317	F	28.1	Very low	36.8	Very low	122 Å²	122	92.1 Å²	92.1	54%	0.535	47%	0.466	S	S	.	.	S	Bend	trans	-141.2	151.8	-178.3	-67.8	-83.8	0	0	0	112.5	I313 I320	I313-F317 PolarHBondContact O-N 2.89Å; F317-I320 HydrophobicContact CB-CD1 3.8Å; F317-I320 HydrophobicContact CD1-CD1 4.11Å; F317-I320 HydrophobicContact CG-CD1 3.91Å
318	K	30.1	Very low	37.1	Very low	189 Å²	189	87.6 Å²	87.6	82%	0.822	44%	0.444	S	S	*	.	S	Bend	trans	-60.9	151.7	160.4	-96.2	-172.8	173.8	-176.5	0	109.4	I320	K318-I320 PolarHBondContact O-N 3.43Å
319	P	28	Very low	37.9	Very low	117 Å²	117	80.8 Å²	80.8	76%	0.76	41%	0.414	S	S	*	.			trans	-50.2	124.4	-171.9	-31.5	37.1	0	0	0	114
320	I	37.1	Very low	38.5	Very low	58 Å²	58	80.6 Å²	80.6	30%	0.297	42%	0.419	S	S	.	.			trans	-111.1	146	-176	-85.9	167.4	0	0	0	109.6	P299 F317 K318 I322	P299-I320 HydrophobicContact CB-CB 4.48Å; P299-I320 HydrophobicContact CB-CG1 4.25Å; P299-I320 HydrophobicContact CB-CG2 3.56Å; F317-I320 HydrophobicContact CB-CD1 3.8Å; F317-I320 HydrophobicContact CD1-CD1 4.11Å; F317-I320 HydrophobicContact CG-CD1 3.91Å; K318-I320 PolarHBondContact O-N 3.43Å; I320-I322 HydrophobicContact CG2-CG1 3.83Å
321	K	31.4	Very low	39	Very low	115 Å²	115	80.4 Å²	80.4	50%	0.5	42%	0.417	S	S	.	.			trans	-98.6	131.9	167.2	-97.8	-150.9	-176	-174.2	0	109.1	P299 R300 E301	P299-K321 WeakPolarHBondContact CB-O 3.34Å; R300-K321 PolarHBondContact N-O 3.46Å; E301-K321 VanDerWaalsContact C-C 3.43Å; E301-K321 HydrophobicContact CG-CD 4.43Å; E301-K321 PolarHBondContact N-O 3.1Å; E301-K321 VanDerWaalsContact N-O 3.16Å; E301-K321 CarbonylContact O-C 3.23Å; E301-K321 WeakPolarHBondContact O-CA 3.41Å; E301-K321 WeakPolarHBondContact O-CB 3.47Å; E301-K321 WeakPolarHBondContact O-CD 3.48Å; E301-K321 WeakPolarHBondContact O-CG 3.29Å; E301-K321 WeakPolarHBondContact OE1-CD 3.3Å; E301-K321 WeakPolarHBondContact OE1-CE 3.17Å; E301-K321 IonicContact OE1-NZ 3.45Å; E301-K321 PolarHBondContact OE1-NZ 2.92Å; E301-K321 WeakPolarHBondContact OE2-CD 3.22Å; E301-K321 IonicContact OE2-NZ 2.7Å; E301-K321 PolarHBondContact OE2-NZ 3.38Å
322	I	30.3	Very low	39.7	Very low	42 Å²	42	75.9 Å²	75.9	22%	0.215	40%	0.397	C	S	.	.			trans	-114.7	-36.3	-150.6	-50.2	162.2	0	0	0	121.3	R300 E301 L303 I304 I313 I320	R300-I322 WeakPolarHBondContact CB-O 3.2Å; E301-I322 PolarHBondContact O-N 2.78Å; L303-I322 HydrophobicContact CB-CB 3.61Å; L303-I322 HydrophobicContact CB-CD1 3.88Å; L303-I322 HydrophobicContact CB-CG1 4.35Å; L303-I322 HydrophobicContact CB-CG2 3.48Å; L303-I322 VanDerWaalsContact CB-CG2 3.48Å; L303-I322 HydrophobicContact CD1-CG2 4.04Å; L303-I322 HydrophobicContact CG-CG2 4.42Å; I304-I322 HydrophobicContact CG1-CD1 3.9Å; I313-I322 HydrophobicContact CD1-CD1 3.87Å; I320-I322 HydrophobicContact CG2-CG1 3.83Å
323	I	35	Very low	40.5	Very low	76 Å²	76	76.6 Å²	76.6	39%	0.39	40%	0.402	S	S	.	.			trans	-31.8	163	-150.1	-5.6	149.8	0	0	0	121.7	R300 E301 D302	R300-I323 VanDerWaalsContact CB-O 3.29Å; R300-I323 WeakPolarHBondContact CB-O 3.26Å; R300-I323 WeakPolarHBondContact CD-O 3.03Å; R300-I323 WeakPolarHBondContact O-CG1 3.07Å; R300-I323 PolarHBondContact O-N 3.04Å; E301-I323 HydrophobicContact CB-CD1 3.52Å; E301-I323 HydrophobicContact CB-CG1 3.43Å; E301-I323 VanDerWaalsContact CB-CG1 3.43Å; D302-I323 WeakPolarHBondContact O-CA 3.44Å; D302-I323 WeakPolarHBondContact O-CB 3.38Å; D302-I323 WeakPolarHBondContact O-CG2 3.34Å; D302-I323 PolarHBondContact O-N 2.94Å
324	N	37.6	Very low	41.9	Very low	110 Å²	110	77.7 Å²	77.7	59%	0.588	41%	0.406	S	S	*	.			trans	74.6	116.2	157.4	-95.6	-2.7	0	0	0	114.9	R300	R300-N324 PolarHBondContact NH1-O 3.47Å
325	P	35.6	Very low	43.1	Very low	65 Å²	65	73.3 Å²	73.3	42%	0.422	38%	0.383	S	S	.	.			trans	-67.6	176.6	173.2	31.4	-35	0	0	0	111.5	Q267	Q267-P325 HydrophobicContact CB-CB 4.37Å; Q267-P325 VanDerWaalsContact CD-CB 3.5Å; Q267-P325 HydrophobicContact CG-CB 3.84Å
326	F	41.7	Very low	44.3	Very low	57 Å²	57	66.7 Å²	66.7	25%	0.25	35%	0.348	C	S	.	.			trans	-59.6	142.5	179.7	-175	-87.9	0	0	0	113.1	Y266 L270 Q331	Y266-F326 HydrophobicContact CE1-CE1 4.42Å; L270-F326 HydrophobicContact CB-CB 4.16Å; L270-F326 HydrophobicContact CB-CD2 3.96Å; L270-F326 HydrophobicContact CB-CG 4.12Å; L270-F326 HydrophobicContact CD1-CB 3.61Å; L270-F326 HydrophobicContact CD1-CD1 3.32Å; L270-F326 HydrophobicContact CD1-CD2 3.89Å; L270-F326 HydrophobicContact CD1-CE1 3.82Å; L270-F326 HydrophobicContact CD1-CE2 4.34Å; L270-F326 HydrophobicContact CD1-CG 3.34Å; L270-F326 HydrophobicContact CD1-CZ 4.29Å; L270-F326 HydrophobicContact CD2-CD1 4.35Å; L270-F326 HydrophobicContact CD2-CD2 3.92Å; L270-F326 HydrophobicContact CD2-CE1 4.12Å; L270-F326 HydrophobicContact CD2-CE2 3.69Å; L270-F326 HydrophobicContact CD2-CG 4.23Å; L270-F326 HydrophobicContact CD2-CZ 3.78Å; L270-F326 HydrophobicContact CG-CB 4.44Å; L270-F326 HydrophobicContact CG-CD1 4.33Å; L270-F326 HydrophobicContact CG-CD2 4.11Å; L270-F326 HydrophobicContact CG-CE2 4.38Å; L270-F326 HydrophobicContact CG-CG 4.07Å; F326-Q331 HydrophobicContact CE1-CG 4.09Å; F326-Q331 VanDerWaalsContact CZ-CD 3.49Å; F326-Q331 HydrophobicContact CZ-CG 3.74Å
327	D	49	Very low	45.6	Very low	22 Å²	22	66.2 Å²	66.2	12%	0.118	35%	0.349	C	S	.	.			trans	-106.7	121.2	178.1	161	52.6	0	0	0	111	C329 S330 S337 G338	D327-C329 VanDerWaalsContact C-N 3.32Å; D327-C329 PolarHBondContact O-N 3.21Å; D327-C329 WeakPolarHBondContact OD1-CB 3.16Å; D327-C329 PolarHBondContact OD1-N 2.95Å; D327-S330 PolarHBondContact O-N 2.88Å; D327-S330 PolarHBondContact O-OG 3.23Å; D327-S330 VanDerWaalsContact OD2-CB 3.32Å; D327-S330 WeakPolarHBondContact OD2-CB 2.95Å; D327-S330 PolarHBondContact OD2-N 3.17Å; D327-S337 WeakPolarHBondContact OD2-CA 2.93Å; D327-G338 PolarHBondContact OD1-N 3.44Å; D327-G338 PolarHBondContact OD2-N 2.77Å
328	V	52.4	Low	46.9	Very low	34 Å²	34	63.3 Å²	63.3	21%	0.206	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-69.9	-29.3	179.3	-179.2	0	0	0	0	111.8	Y266 S330 Q331 L332	Y266-V328 HydrophobicContact CE1-CG2 4.45Å; V328-S330 PolarHBondContact O-N 3.34Å; V328-Q331 WeakPolarHBondContact O-CB 3.29Å; V328-Q331 PolarHBondContact O-N 3.22Å; V328-L332 HydrophobicContact CG1-CD1 4.3Å; V328-L332 PolarHBondContact O-N 3.39Å
329	C	58.6	Low	48.7	Very low	1 Å²	1	54.9 Å²	54.9	1%	0.007	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-70.4	-15.5	179.9	-56.8	0	0	0	0	113.3	D327 Q331 T335 I336 C340 C354	D327-C329 VanDerWaalsContact C-N 3.32Å; D327-C329 PolarHBondContact O-N 3.21Å; D327-C329 WeakPolarHBondContact OD1-CB 3.16Å; D327-C329 PolarHBondContact OD1-N 2.95Å; C329-Q331 PolarHBondContact O-N 3.49Å; C329-T335 PolarHBondContact O-OG1 2.94Å; C329-I336 WeakPolarHBondContact CB-O 3.05Å; C329-C340 WeakPolarHBondContact SG-CA 3.39Å; C329-C340 WeakPolarHBondContact SG-CB 3.48Å; C329-C340 PolarHBondContact SG-N 2.83Å; C329-C340 VanDerWaalsContact SG-N 3.35Å; C329-C354 VanDerWaalsContact CA-SG 3.54Å; C329-C354 HydrophobicContact CB-CB 3.89Å; C329-C354 WeakPolarHBondContact CB-SG 3.31Å; C329-C354 WeakPolarHBondContact SG-CB 3.49Å; C329-C354 CovalentContact SG-SG 2.02Å; C329-C354 PolarHBondContact SG-SG 2.82Å
330	S	54.4	Low	50.4	Low	63 Å²	63	51 Å²	51	44%	0.441	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-74.5	-10.2	169.4	72.9	0	0	0	0	114.2	D327 V328	D327-S330 PolarHBondContact O-N 2.88Å; D327-S330 PolarHBondContact O-OG 3.23Å; D327-S330 VanDerWaalsContact OD2-CB 3.32Å; D327-S330 WeakPolarHBondContact OD2-CB 2.95Å; D327-S330 PolarHBondContact OD2-N 3.17Å; V328-S330 PolarHBondContact O-N 3.34Å
331	Q	51.7	Low	51.6	Low	39 Å²	39	52.6 Å²	52.6	18%	0.182	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-28.9	176.7	-66.5	-166.4	108.7	0	0	113.9	F53 L238 F326 V328 C329	F53-Q331 HydrophobicContact CE1-CB 3.95Å; F53-Q331 VanDerWaalsContact CE1-O 3.29Å; F53-Q331 WeakPolarHBondContact CE1-O 3.43Å; F53-Q331 HydrophobicContact CZ-CB 4.34Å; L238-Q331 VanDerWaalsContact CD2-OE1 3.24Å; F326-Q331 HydrophobicContact CE1-CG 4.09Å; F326-Q331 VanDerWaalsContact CZ-CD 3.49Å; F326-Q331 HydrophobicContact CZ-CG 3.74Å; V328-Q331 WeakPolarHBondContact O-CB 3.29Å; V328-Q331 PolarHBondContact O-N 3.22Å; C329-Q331 PolarHBondContact O-N 3.49Å
332	L	55.3	Low	53	Low	33 Å²	33	51.8 Å²	51.8	17%	0.173	31%	0.306	C	S	.	.	S	Bend	trans	-79.1	155.2	-177.1	-66.8	169.8	0	0	0	110.4	L52 V328 T335 F352 W363	L52-L332 HydrophobicContact CD2-CD2 4.4Å; L52-L332 HydrophobicContact CG-CD2 4.43Å; V328-L332 HydrophobicContact CG1-CD1 4.3Å; V328-L332 PolarHBondContact O-N 3.39Å; L332-T335 VanDerWaalsContact C-OG1 3.27Å; L332-T335 HydrophobicContact CB-CG2 3.69Å; L332-T335 VanDerWaalsContact CB-OG1 3.29Å; L332-T335 WeakPolarHBondContact CB-OG1 3.04Å; L332-T335 HydrophobicContact CD1-CG2 4.36Å; L332-T335 PolarHBondContact O-OG1 2.81Å; L332-F352 HydrophobicContact CD1-CD2 4.38Å; L332-F352 HydrophobicContact CD1-CE2 3.71Å; L332-F352 HydrophobicContact CD1-CZ 4.41Å; L332-W363 HydrophobicContact CD1-CH2 4.03Å; L332-W363 HydrophobicContact CD1-CZ3 4.46Å
333	L	54	Low	54.4	Low	96 Å²	96	55.8 Å²	55.8	50%	0.503	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	142.2	179.3	-161.4	67.5	0	0	0	109.9	T335	L333-T335 PolarHBondContact O-N 3.22Å
334	H	63.5	Low	55.2	Low	52 Å²	52	54.3 Å²	54.3	24%	0.241	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	16.4	-179.4	-43.5	-61	0	0	0	116	C356 K357 Y361 C372	H334-C356 CarbonylContact O-C 3.48Å; H334-C356 WeakPolarHBondContact O-CA 3.39Å; H334-K357 WeakPolarHBondContact O-CB 3.06Å; H334-K357 PolarHBondContact O-N 2.77Å; H334-Y361 HydrophobicContact CB-CD1 4.04Å; H334-Y361 HydrophobicContact CB-CD2 3.59Å; H334-Y361 HydrophobicContact CB-CE1 4.11Å; H334-Y361 HydrophobicContact CB-CE2 3.62Å; H334-Y361 HydrophobicContact CB-CG 3.82Å; H334-Y361 AromaticContact CD2-CD1 3.88Å; H334-Y361 AromaticContact CD2-CE1 3.34Å; H334-Y361 WeakPolarHBondContact CD2-CE1 3.27Å; H334-Y361 AromaticContact CD2-CZ 3.5Å; H334-Y361 AromaticContact CE1-CZ 3.52Å; H334-Y361 PolarHBondContact CE1-OH 3.06Å; H334-Y361 AromaticContact CG-CD2 3.97Å; H334-Y361 AromaticContact CG-CE1 3.58Å; H334-Y361 AromaticContact CG-CE2 3.48Å; H334-Y361 VanDerWaalsContact CG-CE2 3.48Å; H334-Y361 AromaticContact CG-CZ 3.31Å; H334-Y361 AromaticContact ND1-CE2 3.53Å; H334-Y361 AromaticContact ND1-CZ 3.33Å; H334-Y361 VanDerWaalsContact ND1-CZ 3.33Å; H334-Y361 PolarHBondContact ND1-OH 3.13Å; H334-Y361 AromaticContact NE2-CE1 3.69Å; H334-Y361 AromaticContact NE2-CZ 3.64Å; H334-Y361 PolarHBondContact NE2-OH 3.36Å; H334-C372 HydrophobicContact CB-CB 4.06Å; H334-C372 WeakPolarHBondContact O-CB 3.26Å
335	T	63.9	Low	55.4	Low	10 Å²	10	57.5 Å²	57.5	6%	0.061	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-93.1	165.7	170.3	45.7	0	0	0	0	111.6	C329 L332 L333 C354 Q355 W363 C372	C329-T335 PolarHBondContact O-OG1 2.94Å; L332-T335 VanDerWaalsContact C-OG1 3.27Å; L332-T335 HydrophobicContact CB-CG2 3.69Å; L332-T335 VanDerWaalsContact CB-OG1 3.29Å; L332-T335 WeakPolarHBondContact CB-OG1 3.04Å; L332-T335 HydrophobicContact CD1-CG2 4.36Å; L332-T335 PolarHBondContact O-OG1 2.81Å; L333-T335 PolarHBondContact O-N 3.22Å; T335-C354 HydrophobicContact CG2-CB 3.42Å; T335-C354 VanDerWaalsContact CG2-CB 3.42Å; T335-Q355 WeakPolarHBondContact CA-O 3.32Å; T335-W363 HydrophobicContact CG2-CZ3 3.81Å; T335-C372 HydrophobicContact CG2-CB 4.17Å; T335-C372 VanDerWaalsContact CG2-SG 3.55Å
336	I	60	Low	55.4	Low	11 Å²	11	57.8 Å²	57.8	6%	0.056	35%	0.348	C	S	.	.			trans	-105.6	129.6	176.4	-35.9	163.3	0	0	0	110.9	C329 G338 S339 Q355 K357 N396 E398 M399	C329-I336 WeakPolarHBondContact CB-O 3.05Å; I336-G338 PolarHBondContact O-N 2.92Å; I336-S339 WeakPolarHBondContact O-CB 3.4Å; I336-S339 PolarHBondContact O-N 3.4Å; I336-S339 VanDerWaalsContact O-N 3.16Å; I336-S339 PolarHBondContact O-OG 3.5Å; I336-Q355 HydrophobicContact CD1-CB 3.69Å; I336-Q355 HydrophobicContact CG1-CB 4.38Å; I336-Q355 WeakPolarHBondContact CG1-O 3.37Å; I336-Q355 PolarHBondContact N-O 3.15Å; I336-K357 HydrophobicContact CG1-CB 4.16Å; I336-N396 WeakPolarHBondContact CD1-ND2 3.45Å; I336-E398 HydrophobicContact CD1-CB 3.98Å; I336-E398 HydrophobicContact CD1-CG 4.49Å; I336-E398 HydrophobicContact CG2-CG 3.95Å; I336-E398 WeakPolarHBondContact CG2-OE2 3.44Å; I336-M399 HydrophobicContact CG2-CE 4.05Å
337	S	60.2	Low	55.2	Low	79 Å²	79	60.9 Å²	60.9	55%	0.552	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	122.9	-177.9	-51.4	0	0	0	0	111.9	D327	D327-S337 WeakPolarHBondContact OD2-CA 2.93Å
338	G	56.2	Low	54.9	Low	61 Å²	61	62 Å²	62	63%	0.629	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.4	-6.9	-177.8	0	0	0	0	0	114.4	D327 I336 C340	D327-G338 PolarHBondContact OD1-N 3.44Å; D327-G338 PolarHBondContact OD2-N 2.77Å; I336-G338 PolarHBondContact O-N 2.92Å; G338-C340 VanDerWaalsContact C-N 3.26Å; G338-C340 PolarHBondContact O-N 3.44Å
339	S	67.9	Low	54.6	Low	11 Å²	11	64.1 Å²	64.1	8%	0.077	39%	0.394	C	S	.	.			trans	-83.6	11.6	-178.4	70.6	0	0	0	0	115.1	I336 L341 Q355	I336-S339 WeakPolarHBondContact O-CB 3.4Å; I336-S339 PolarHBondContact O-N 3.4Å; I336-S339 VanDerWaalsContact O-N 3.16Å; I336-S339 PolarHBondContact O-OG 3.5Å; S339-L341 PolarHBondContact O-N 3.26Å; S339-Q355 PolarHBondContact OG-N 3.02Å
340	C	62.5	Low	54.4	Low	37 Å²	37	69.2 Å²	69.2	25%	0.25	42%	0.421	C	S	.	.			trans	-71.9	115.9	-173.3	-163	0	0	0	0	112.4	C329 G338	C329-C340 WeakPolarHBondContact SG-CA 3.39Å; C329-C340 WeakPolarHBondContact SG-CB 3.48Å; C329-C340 PolarHBondContact SG-N 2.83Å; C329-C340 VanDerWaalsContact SG-N 3.35Å; G338-C340 VanDerWaalsContact C-N 3.26Å; G338-C340 PolarHBondContact O-N 3.44Å
341	L	63.3	Low	54.6	Low	90 Å²	90	68 Å²	68	47%	0.471	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	121.3	170.7	-58.8	176.7	0	0	0	108.7	S339 F352 S353	S339-L341 PolarHBondContact O-N 3.26Å; L341-F352 CarbonylContact O-C 3.53Å; L341-F352 VanDerWaalsContact O-CA 3.29Å; L341-F352 WeakPolarHBondContact O-CA 3.46Å; L341-S353 PolarHBondContact N-O 3.37Å; L341-S353 PolarHBondContact O-N 2.98Å
342	V	59.3	Low	55	Low	98 Å²	98	67.9 Å²	67.9	59%	0.594	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.5	124.1	174	179.2	0	0	0	0	108.9	E351	V342-E351 CarbonylContact C-O 3.52Å; V342-E351 WeakPolarHBondContact CA-O 3.2Å; V342-E351 WeakPolarHBondContact CG1-O 3.29Å
343	H	60.2	Low	55.8	Low	126 Å²	126	67 Å²	67	58%	0.583	40%	0.404	S	S	*	.			trans	-104.9	74	-178	-65.3	-55.7	0	0	0	110.5	E351 S353	H343-E351 PolarHBondContact N-O 3.15Å; H343-E351 WeakPolarHBondContact O-CG 3.24Å; H343-S353 WeakPolarHBondContact NE2-CB 3.23Å; H343-S353 PolarHBondContact NE2-OG 2.81Å
344	G	52.1	Low	56.7	Low	46 Å²	46	62.8 Å²	62.8	47%	0.474	38%	0.382	S	S	.	.	S	Bend	trans	135.7	-160.6	176.3	0	0	0	0	0	114
345	N	42.4	Very low	57.3	Low	177 Å²	177	65.5 Å²	65.5	95%	0.947	40%	0.395	S	S	*	.	S	Bend	trans	-119.4	2.9	-175	-74.6	-24.6	0	0	0	113.1
346	S	34.3	Very low	58	Low	71 Å²	71	65.9 Å²	65.9	50%	0.497	40%	0.398	S	S	.	.	S	Bend	trans	-111.9	-174.3	-176.7	141.6	0	0	0	0	111.3	E351	S346-E351 VanDerWaalsContact CA-OE2 3.23Å; S346-E351 WeakPolarHBondContact CA-OE2 3.35Å; S346-E351 WeakPolarHBondContact CB-OE1 3.23Å; S346-E351 WeakPolarHBondContact CB-OE2 3.44Å; S346-E351 PolarHBondContact N-OE2 3.22Å; S346-E351 PolarHBondContact OG-OE1 3.23Å; S346-E351 PolarHBondContact OG-OE2 3.05Å
347	V	38.4	Very low	58.1	Low	121 Å²	121	67.5 Å²	67.5	73%	0.733	41%	0.405	S	S	*	.			trans	-120	21.2	-162.9	-152	0	0	0	0	111.3
348	S	43.6	Very low	58.4	Low	46 Å²	46	63.8 Å²	63.8	32%	0.322	38%	0.379	S	S	.	.			trans	-83.9	156.4	-178.1	78.9	0	0	0	0	112.4	N350 E351	S348-N350 PolarHBondContact O-N 3.46Å; S348-N350 VanDerWaalsContact O-N 3.14Å; S348-E351 VanDerWaalsContact CB-OE1 3.3Å; S348-E351 WeakPolarHBondContact CB-OE1 3.19Å; S348-E351 PolarHBondContact N-OE1 2.98Å; S348-E351 PolarHBondContact O-N 2.82Å; S348-E351 VanDerWaalsContact O-N 3.16Å; S348-E351 WeakPolarHBondContact OG-CG 3.41Å; S348-E351 PolarHBondContact OG-OE1 2.91Å
349	V	45.1	Very low	59.1	Low	79 Å²	79	64.3 Å²	64.3	48%	0.479	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-15.6	177.7	171	0	0	0	0	112.7	F352	V349-F352 HydrophobicContact CB-CE1 4.46Å; V349-F352 HydrophobicContact CB-CZ 4.46Å; V349-F352 HydrophobicContact CG1-CZ 4.09Å
350	N	55	Low	59.1	Low	108 Å²	108	63.8 Å²	63.8	58%	0.578	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-3.8	-179.1	-58.2	-13.6	0	0	0	112.8	S348 T370	S348-N350 PolarHBondContact O-N 3.46Å; S348-N350 VanDerWaalsContact O-N 3.14Å; N350-T370 PolarHBondContact OD1-OG1 3.3Å; N350-T370 VanDerWaalsContact OD1-OG1 3.1Å
351	E	57.9	Low	59.7	Low	36 Å²	36	62.8 Å²	62.8	17%	0.168	35%	0.354	C	S	.	.	S	Bend	trans	-102.9	20.4	-180	-71.9	170.2	-93.8	0	0	112.7	V342 H343 S346 S348	V342-E351 CarbonylContact C-O 3.52Å; V342-E351 WeakPolarHBondContact CA-O 3.2Å; V342-E351 WeakPolarHBondContact CG1-O 3.29Å; H343-E351 PolarHBondContact N-O 3.15Å; H343-E351 WeakPolarHBondContact O-CG 3.24Å; S346-E351 VanDerWaalsContact CA-OE2 3.23Å; S346-E351 WeakPolarHBondContact CA-OE2 3.35Å; S346-E351 WeakPolarHBondContact CB-OE1 3.23Å; S346-E351 WeakPolarHBondContact CB-OE2 3.44Å; S346-E351 PolarHBondContact N-OE2 3.22Å; S346-E351 PolarHBondContact OG-OE1 3.23Å; S346-E351 PolarHBondContact OG-OE2 3.05Å; S348-E351 VanDerWaalsContact CB-OE1 3.3Å; S348-E351 WeakPolarHBondContact CB-OE1 3.19Å; S348-E351 PolarHBondContact N-OE1 2.98Å; S348-E351 PolarHBondContact O-N 2.82Å; S348-E351 VanDerWaalsContact O-N 3.16Å; S348-E351 WeakPolarHBondContact OG-CG 3.41Å; S348-E351 PolarHBondContact OG-OE1 2.91Å
352	F	60.6	Low	60.7	Low	38 Å²	38	63.6 Å²	63.6	17%	0.167	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	153.1	163.1	57.4	-103.9	0	0	0	111.6	L332 L341 V349 W363	L332-F352 HydrophobicContact CD1-CD2 4.38Å; L332-F352 HydrophobicContact CD1-CE2 3.71Å; L332-F352 HydrophobicContact CD1-CZ 4.41Å; L341-F352 CarbonylContact O-C 3.53Å; L341-F352 VanDerWaalsContact O-CA 3.29Å; L341-F352 WeakPolarHBondContact O-CA 3.46Å; V349-F352 HydrophobicContact CB-CE1 4.46Å; V349-F352 HydrophobicContact CB-CZ 4.46Å; V349-F352 HydrophobicContact CG1-CZ 4.09Å; F352-W363 AromaticContact CD2-CH2 3.75Å; F352-W363 HydrophobicContact CD2-CH2 3.75Å; F352-W363 AromaticContact CD2-CZ2 3.7Å; F352-W363 HydrophobicContact CD2-CZ2 3.7Å; F352-W363 AromaticContact CE2-CH2 3.76Å; F352-W363 HydrophobicContact CE2-CH2 3.76Å; F352-W363 AromaticContact CE2-CZ2 3.91Å; F352-W363 HydrophobicContact CE2-CZ2 3.91Å; F352-W363 VanDerWaalsContact O-CZ2 3.24Å; F352-W363 WeakPolarHBondContact O-CZ2 3.45Å
353	S	71	Confident	61.8	Low	14 Å²	14	61.4 Å²	61.4	10%	0.098	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	144.2	162.5	68.6	0	0	0	0	110.7	L341 H343	L341-S353 PolarHBondContact N-O 3.37Å; L341-S353 PolarHBondContact O-N 2.98Å; H343-S353 WeakPolarHBondContact NE2-CB 3.23Å; H343-S353 PolarHBondContact NE2-OG 2.81Å
354	C	73.6	Confident	62.7	Low	7 Å²	7	57.4 Å²	57.4	5%	0.047	32%	0.318	C	S	.	.			trans	-110.4	156.2	166.2	-60.6	0	0	0	0	109.8	C329 T335 W363	C329-C354 VanDerWaalsContact CA-SG 3.54Å; C329-C354 HydrophobicContact CB-CB 3.89Å; C329-C354 WeakPolarHBondContact CB-SG 3.31Å; C329-C354 WeakPolarHBondContact SG-CB 3.49Å; C329-C354 CovalentContact SG-SG 2.02Å; C329-C354 PolarHBondContact SG-SG 2.82Å; T335-C354 HydrophobicContact CG2-CB 3.42Å; T335-C354 VanDerWaalsContact CG2-CB 3.42Å; C354-W363 HydrophobicContact CB-CE3 3.98Å; C354-W363 HydrophobicContact CB-CH2 4.2Å; C354-W363 HydrophobicContact CB-CZ3 3.53Å
355	Q	76.9	Confident	63.6	Low	110 Å²	110	58.9 Å²	58.9	51%	0.514	32%	0.318	S	S	.	.			trans	-73.8	144.3	160.7	-63.1	-179.8	14.3	0	0	109.1	T335 I336 S339	T335-Q355 WeakPolarHBondContact CA-O 3.32Å; I336-Q355 HydrophobicContact CD1-CB 3.69Å; I336-Q355 HydrophobicContact CG1-CB 4.38Å; I336-Q355 WeakPolarHBondContact CG1-O 3.37Å; I336-Q355 PolarHBondContact N-O 3.15Å; S339-Q355 PolarHBondContact OG-N 3.02Å
356	C	77.1	Confident	64.7	Low	18 Å²	18	53.5 Å²	53.5	12%	0.122	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-93	134.2	-177.7	-61.1	0	0	0	0	111.5	H334 S358 Y361 C372 N396	H334-C356 CarbonylContact O-C 3.48Å; H334-C356 WeakPolarHBondContact O-CA 3.39Å; C356-S358 PolarHBondContact O-N 3.04Å; C356-S358 VanDerWaalsContact O-N 3.1Å; C356-Y361 VanDerWaalsContact CB-O 3.31Å; C356-Y361 WeakPolarHBondContact CB-O 3.5Å; C356-C372 WeakPolarHBondContact CA-SG 3.28Å; C356-C372 HydrophobicContact CB-CB 3.78Å; C356-C372 WeakPolarHBondContact CB-SG 3.4Å; C356-C372 VanDerWaalsContact SG-CA 3.52Å; C356-C372 WeakPolarHBondContact SG-CB 3.33Å; C356-C372 CovalentContact SG-SG 2.03Å; C356-C372 PolarHBondContact SG-SG 2.83Å; C356-N396 PolarHBondContact O-ND2 2.76Å
357	K	63.4	Low	66	Low	45 Å²	45	55 Å²	55	20%	0.196	29%	0.291	C	S	.	.	S	Bend	trans	-62.5	-17.5	-172.3	-179.5	165.5	177.6	165.6	0	114.5	H334 I336 N396 M399 Q413 L566	H334-K357 WeakPolarHBondContact O-CB 3.06Å; H334-K357 PolarHBondContact O-N 2.77Å; I336-K357 HydrophobicContact CG1-CB 4.16Å; K357-N396 VanDerWaalsContact C-ND2 3.28Å; K357-N396 WeakPolarHBondContact CA-ND2 3.4Å; K357-N396 PolarHBondContact O-ND2 2.87Å; K357-M399 HydrophobicContact CD-SD 4.37Å; K357-M399 HydrophobicContact CG-CE 4.47Å; K357-M399 HydrophobicContact CG-CG 4.43Å; K357-M399 HydrophobicContact CG-SD 3.95Å; K357-M399 WeakPolarHBondContact O-CG 3.49Å; K357-Q413 PolarHBondContact O-NE2 2.87Å; K357-Q413 PolarHBondContact O-OE1 3.15Å; K357-L566 WeakPolarHBondContact CE-O 3.17Å; K357-L566 PolarHBondContact NZ-O 3.42Å
358	S	65.8	Low	66.9	Low	1 Å²	1	53.8 Å²	53.8	1%	0.007	29%	0.288	C	S	.	.	S	Bend	trans	-142.5	150.8	173.9	-172.7	0	0	0	0	110.4	C356 A360 Y361 I393 Q413	C356-S358 PolarHBondContact O-N 3.04Å; C356-S358 VanDerWaalsContact O-N 3.1Å; S358-A360 PolarHBondContact O-N 3.4Å; S358-A360 PolarHBondContact OG-N 3.14Å; S358-Y361 PolarHBondContact O-N 3.48Å; S358-I393 VanDerWaalsContact OG-CG2 3.27Å; S358-I393 WeakPolarHBondContact OG-CG2 3.41Å; S358-Q413 PolarHBondContact OG-OE1 3.06Å
359	N	70.9	Confident	67.6	Low	71 Å²	71	52.5 Å²	52.5	38%	0.38	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-9.5	170.6	-59.2	-16.8	0	0	0	112.2	Y361 I375 I393 E394 C395	N359-Y361 VanDerWaalsContact C-N 3.29Å; N359-I375 WeakPolarHBondContact O-CD1 2.96Å; N359-I393 HydrophobicContact CB-CD1 4.18Å; N359-I393 HydrophobicContact CB-CG1 4.26Å; N359-E394 PolarHBondContact ND2-O 3.09Å; N359-C395 PolarHBondContact ND2-O 3.01Å
360	A	68.4	Low	68.6	Low	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-20.2	170.2	0	0	0	0	0	114.1	S358 L374 I375 I378 I393 L415 I564	S358-A360 PolarHBondContact O-N 3.4Å; S358-A360 PolarHBondContact OG-N 3.14Å; A360-L374 HydrophobicContact CB-CD1 3.97Å; A360-L374 WeakPolarHBondContact O-CA 3.31Å; A360-L374 WeakPolarHBondContact O-CD1 3.1Å; A360-I375 WeakPolarHBondContact O-CG1 3.4Å; A360-I375 PolarHBondContact O-N 3.12Å; A360-I378 HydrophobicContact CB-CD1 3.78Å; A360-I393 HydrophobicContact CB-CD1 4.07Å; A360-I393 HydrophobicContact CB-CG2 4.23Å; A360-L415 HydrophobicContact CB-CD2 4.19Å; A360-I564 HydrophobicContact CB-CD1 3.44Å; A360-I564 VanDerWaalsContact CB-CD1 3.44Å
361	Y	75.6	Confident	69.3	Low	16 Å²	16	44.5 Å²	44.5	6%	0.063	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	135.2	-178.9	-55.3	-80.5	0	0	0	110.5	H334 C356 S358 N359 C372 L373 L374 I564	H334-Y361 HydrophobicContact CB-CD1 4.04Å; H334-Y361 HydrophobicContact CB-CD2 3.59Å; H334-Y361 HydrophobicContact CB-CE1 4.11Å; H334-Y361 HydrophobicContact CB-CE2 3.62Å; H334-Y361 HydrophobicContact CB-CG 3.82Å; H334-Y361 AromaticContact CD2-CD1 3.88Å; H334-Y361 AromaticContact CD2-CE1 3.34Å; H334-Y361 WeakPolarHBondContact CD2-CE1 3.27Å; H334-Y361 AromaticContact CD2-CZ 3.5Å; H334-Y361 AromaticContact CE1-CZ 3.52Å; H334-Y361 PolarHBondContact CE1-OH 3.06Å; H334-Y361 AromaticContact CG-CD2 3.97Å; H334-Y361 AromaticContact CG-CE1 3.58Å; H334-Y361 AromaticContact CG-CE2 3.48Å; H334-Y361 VanDerWaalsContact CG-CE2 3.48Å; H334-Y361 AromaticContact CG-CZ 3.31Å; H334-Y361 AromaticContact ND1-CE2 3.53Å; H334-Y361 AromaticContact ND1-CZ 3.33Å; H334-Y361 VanDerWaalsContact ND1-CZ 3.33Å; H334-Y361 PolarHBondContact ND1-OH 3.13Å; H334-Y361 AromaticContact NE2-CE1 3.69Å; H334-Y361 AromaticContact NE2-CZ 3.64Å; H334-Y361 PolarHBondContact NE2-OH 3.36Å; C356-Y361 VanDerWaalsContact CB-O 3.31Å; C356-Y361 WeakPolarHBondContact CB-O 3.5Å; S358-Y361 PolarHBondContact O-N 3.48Å; N359-Y361 VanDerWaalsContact C-N 3.29Å; Y361-C372 WeakPolarHBondContact CD1-O 3.44Å; Y361-L373 WeakPolarHBondContact CA-O 3.39Å; Y361-L374 HydrophobicContact CD1-CB 4.17Å; Y361-L374 HydrophobicContact CD1-CD1 4.03Å; Y361-L374 HydrophobicContact CE1-CB 4.17Å; Y361-L374 HydrophobicContact CE1-CD1 3.7Å; Y361-I564 HydrophobicContact CD2-CD1 4.41Å; Y361-I564 HydrophobicContact CE2-CB 4.27Å; Y361-I564 HydrophobicContact CE2-CD1 3.53Å; Y361-I564 HydrophobicContact CE2-CG1 4.13Å; Y361-I564 WeakPolarHBondContact OH-CG1 3Å
362	H	82.6	Confident	70.1	Confident	108 Å²	108	43 Å²	43	50%	0.5	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	148.1	173.2	-174.1	-97.4	0	0	0	110	Q364 C372 L373 I375	H362-Q364 PolarHBondContact O-N 2.74Å; H362-C372 WeakPolarHBondContact O-CA 3.49Å; H362-L373 PolarHBondContact N-O 2.82Å; H362-L373 PolarHBondContact O-N 3.03Å; H362-I375 HydrophobicContact CB-CG1 3.96Å
363	W	82.3	Confident	70.7	Confident	52 Å²	52	42.7 Å²	42.7	20%	0.197	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	107.9	172.7	-172.3	-92.2	0	0	0	109.5	L332 T335 F352 C354 T370 G371	L332-W363 HydrophobicContact CD1-CH2 4.03Å; L332-W363 HydrophobicContact CD1-CZ3 4.46Å; T335-W363 HydrophobicContact CG2-CZ3 3.81Å; F352-W363 AromaticContact CD2-CH2 3.75Å; F352-W363 HydrophobicContact CD2-CH2 3.75Å; F352-W363 AromaticContact CD2-CZ2 3.7Å; F352-W363 HydrophobicContact CD2-CZ2 3.7Å; F352-W363 AromaticContact CE2-CH2 3.76Å; F352-W363 HydrophobicContact CE2-CH2 3.76Å; F352-W363 AromaticContact CE2-CZ2 3.91Å; F352-W363 HydrophobicContact CE2-CZ2 3.91Å; F352-W363 VanDerWaalsContact O-CZ2 3.24Å; F352-W363 WeakPolarHBondContact O-CZ2 3.45Å; C354-W363 HydrophobicContact CB-CE3 3.98Å; C354-W363 HydrophobicContact CB-CH2 4.2Å; C354-W363 HydrophobicContact CB-CZ3 3.53Å; W363-T370 HydrophobicContact CZ2-CG2 3.63Å; W363-G371 WeakPolarHBondContact CA-O 3.25Å
364	Q	79	Confident	70.6	Confident	42 Å²	42	43.5 Å²	43.5	20%	0.196	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	154.7	-173.8	57.1	-169.9	-23.3	0	0	112.1	H362 I366 G371 L373 L374	H362-Q364 PolarHBondContact O-N 2.74Å; Q364-I366 HydrophobicContact CG-CD1 4.12Å; Q364-I366 HydrophobicContact CG-CG1 4.26Å; Q364-G371 PolarHBondContact N-O 2.59Å; Q364-G371 PolarHBondContact O-N 3.13Å; Q364-G371 VanDerWaalsContact O-N 3.11Å; Q364-L373 HydrophobicContact CG-CB 3.85Å; Q364-L373 HydrophobicContact CG-CD1 4.25Å; Q364-L373 HydrophobicContact CG-CG 4.24Å; Q364-L373 PolarHBondContact NE2-O 3.42Å; Q364-L374 PolarHBondContact NE2-O 2.91Å
365	T	72.5	Confident	70.6	Confident	77 Å²	77	45.3 Å²	45.3	47%	0.472	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	112.7	173.3	-56	0	0	0	0	109	L369 T370	T365-L369 VanDerWaalsContact CA-O 3.3Å; T365-L369 WeakPolarHBondContact CA-O 3.14Å; T365-T370 VanDerWaalsContact CG2-OG1 3.28Å; T365-T370 WeakPolarHBondContact CG2-OG1 3.45Å; T365-T370 WeakPolarHBondContact OG1-CG2 3.46Å; T365-T370 PolarHBondContact OG1-OG1 3.29Å
366	I	65.3	Low	70.2	Confident	64 Å²	64	42.7 Å²	42.7	33%	0.328	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	123.1	177.1	-61.7	177.3	0	0	0	108.3	Q364 S368 L369 L373	Q364-I366 HydrophobicContact CG-CD1 4.12Å; Q364-I366 HydrophobicContact CG-CG1 4.26Å; I366-S368 PolarHBondContact O-N 3.09Å; I366-S368 VanDerWaalsContact O-N 3.08Å; I366-L369 PolarHBondContact N-O 3.23Å; I366-L369 WeakPolarHBondContact O-CB 3.35Å; I366-L369 PolarHBondContact O-N 2.59Å; I366-L373 HydrophobicContact CB-CD1 4Å; I366-L373 HydrophobicContact CD1-CD1 4.11Å; I366-L373 HydrophobicContact CG1-CD1 4.1Å
367	N	62.1	Low	69.7	Low	103 Å²	103	48 Å²	48	55%	0.551	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	24	179.9	-57.7	-12.1	0	0	0	115.3	Q50	Q50-N367 PolarHBondContact NE2-O 3.43Å
368	S	57.5	Low	69.6	Low	94 Å²	94	48.1 Å²	48.1	66%	0.657	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.4	-7.9	-170.4	-38.7	0	0	0	0	116.5	I366 T370	I366-S368 PolarHBondContact O-N 3.09Å; I366-S368 VanDerWaalsContact O-N 3.08Å; S368-T370 PolarHBondContact O-N 2.82Å
369	L	56.9	Low	69.1	Low	20 Å²	20	52.7 Å²	52.7	11%	0.105	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	105.1	171	-175.6	71.9	0	0	0	108.8	Q50 T365 I366 L373 L558	Q50-L369 HydrophobicContact CB-CD1 4.01Å; Q50-L369 HydrophobicContact CG-CB 4.1Å; Q50-L369 HydrophobicContact CG-CD1 4.34Å; T365-L369 VanDerWaalsContact CA-O 3.3Å; T365-L369 WeakPolarHBondContact CA-O 3.14Å; I366-L369 PolarHBondContact N-O 3.23Å; I366-L369 WeakPolarHBondContact O-CB 3.35Å; I366-L369 PolarHBondContact O-N 2.59Å; L369-L373 HydrophobicContact CB-CD1 4.44Å; L369-L373 HydrophobicContact CD2-CD1 3.93Å; L369-L373 HydrophobicContact CD2-CD2 3.57Å; L369-L373 HydrophobicContact CD2-CG 4.43Å; L369-L373 HydrophobicContact CG-CD1 4.18Å; L369-L373 HydrophobicContact CG-CD2 4.08Å; L369-L558 HydrophobicContact CD2-CD1 4.07Å; L369-L558 HydrophobicContact CD2-CD2 3.91Å
370	T	65.9	Low	68.4	Low	11 Å²	11	57.2 Å²	57.2	7%	0.067	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	123.4	173.7	-57.7	0	0	0	0	110.2	N350 W363 T365 S368	N350-T370 PolarHBondContact OD1-OG1 3.3Å; N350-T370 VanDerWaalsContact OD1-OG1 3.1Å; W363-T370 HydrophobicContact CZ2-CG2 3.63Å; T365-T370 VanDerWaalsContact CG2-OG1 3.28Å; T365-T370 WeakPolarHBondContact CG2-OG1 3.45Å; T365-T370 WeakPolarHBondContact OG1-CG2 3.46Å; T365-T370 PolarHBondContact OG1-OG1 3.29Å; S368-T370 PolarHBondContact O-N 2.82Å
371	G	71.4	Confident	67.6	Low	7 Å²	7	63.2 Å²	63.2	7%	0.072	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.5	-166.7	176.8	0	0	0	0	0	113.9	W363 Q364 L373	W363-G371 WeakPolarHBondContact CA-O 3.25Å; Q364-G371 PolarHBondContact N-O 2.59Å; Q364-G371 PolarHBondContact O-N 3.13Å; Q364-G371 VanDerWaalsContact O-N 3.11Å; G371-L373 PolarHBondContact O-N 3.21Å
372	C	73.6	Confident	66.1	Low	5 Å²	5	70.7 Å²	70.7	3%	0.034	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	89.6	170.5	-73.3	0	0	0	0	110.1	H334 T335 C356 Y361 H362	H334-C372 HydrophobicContact CB-CB 4.06Å; H334-C372 WeakPolarHBondContact O-CB 3.26Å; T335-C372 HydrophobicContact CG2-CB 4.17Å; T335-C372 VanDerWaalsContact CG2-SG 3.55Å; C356-C372 WeakPolarHBondContact CA-SG 3.28Å; C356-C372 HydrophobicContact CB-CB 3.78Å; C356-C372 WeakPolarHBondContact CB-SG 3.4Å; C356-C372 VanDerWaalsContact SG-CA 3.52Å; C356-C372 WeakPolarHBondContact SG-CB 3.33Å; C356-C372 CovalentContact SG-SG 2.03Å; C356-C372 PolarHBondContact SG-SG 2.83Å; Y361-C372 WeakPolarHBondContact CD1-O 3.44Å; H362-C372 WeakPolarHBondContact O-CA 3.49Å
373	L	72.7	Confident	64.5	Low	31 Å²	31	71 Å²	71	16%	0.162	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	145.5	-176.9	-51.5	-175.7	0	0	0	110.3	Y361 H362 Q364 I366 L369 G371	Y361-L373 WeakPolarHBondContact CA-O 3.39Å; H362-L373 PolarHBondContact N-O 2.82Å; H362-L373 PolarHBondContact O-N 3.03Å; Q364-L373 HydrophobicContact CG-CB 3.85Å; Q364-L373 HydrophobicContact CG-CD1 4.25Å; Q364-L373 HydrophobicContact CG-CG 4.24Å; Q364-L373 PolarHBondContact NE2-O 3.42Å; I366-L373 HydrophobicContact CB-CD1 4Å; I366-L373 HydrophobicContact CD1-CD1 4.11Å; I366-L373 HydrophobicContact CG1-CD1 4.1Å; L369-L373 HydrophobicContact CB-CD1 4.44Å; L369-L373 HydrophobicContact CD2-CD1 3.93Å; L369-L373 HydrophobicContact CD2-CD2 3.57Å; L369-L373 HydrophobicContact CD2-CG 4.43Å; L369-L373 HydrophobicContact CG-CD1 4.18Å; L369-L373 HydrophobicContact CG-CD2 4.08Å; G371-L373 PolarHBondContact O-N 3.21Å
374	L	70	Confident	62.5	Low	32 Å²	32	75.8 Å²	75.8	17%	0.168	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	138.3	-174	-164.5	77.7	0	0	0	110.7	A360 Y361 Q364 P376 I378 I379 I562	A360-L374 HydrophobicContact CB-CD1 3.97Å; A360-L374 WeakPolarHBondContact O-CA 3.31Å; A360-L374 WeakPolarHBondContact O-CD1 3.1Å; Y361-L374 HydrophobicContact CD1-CB 4.17Å; Y361-L374 HydrophobicContact CD1-CD1 4.03Å; Y361-L374 HydrophobicContact CE1-CB 4.17Å; Y361-L374 HydrophobicContact CE1-CD1 3.7Å; Q364-L374 PolarHBondContact NE2-O 2.91Å; L374-P376 WeakPolarHBondContact O-CD 3.33Å; L374-I378 HydrophobicContact CD1-CD1 4.31Å; L374-I378 HydrophobicContact CD2-CB 4.46Å; L374-I378 HydrophobicContact CD2-CG2 4.32Å; L374-I379 HydrophobicContact CD2-CD1 4.12Å; L374-I379 HydrophobicContact CD2-CG1 3.8Å; L374-I562 HydrophobicContact CD2-CB 4.36Å; L374-I562 HydrophobicContact CD2-CD1 3.81Å
375	I	73.9	Confident	60.6	Low	44 Å²	44	81.3 Å²	81.3	23%	0.226	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-64.3	123	178.4	-64.6	173.4	0	0	0	109	N359 A360 H362 E377 I378	N359-I375 WeakPolarHBondContact O-CD1 2.96Å; A360-I375 WeakPolarHBondContact O-CG1 3.4Å; A360-I375 PolarHBondContact O-N 3.12Å; H362-I375 HydrophobicContact CB-CG1 3.96Å; I375-E377 HydrophobicContact CG2-CB 4.12Å; I375-E377 HydrophobicContact CG2-CG 4.47Å; I375-E377 WeakPolarHBondContact CG2-OE2 3.45Å; I375-E377 PolarHBondContact O-N 2.82Å; I375-I378 HydrophobicContact CB-CD1 4.03Å; I375-I378 HydrophobicContact CB-CG1 4.23Å; I375-I378 WeakPolarHBondContact O-CB 3.24Å; I375-I378 PolarHBondContact O-N 2.94Å
376	P	67	Low	58.9	Low	55 Å²	55	84.7 Å²	84.7	36%	0.357	43%	0.431	S	S	.	.	H	α-helix	trans	-59.7	-22.6	-172.9	-28.1	36.2	0	0	0	115.2	L374 I378 I379 K380	L374-P376 WeakPolarHBondContact O-CD 3.33Å; P376-I378 VanDerWaalsContact C-N 3.29Å; P376-I378 PolarHBondContact O-N 3.42Å; P376-I379 PolarHBondContact O-N 2.83Å; P376-I379 VanDerWaalsContact O-N 3.17Å; P376-K380 WeakPolarHBondContact O-CG 3.34Å; P376-K380 PolarHBondContact O-N 3.47Å
377	E	66.4	Low	57.7	Low	130 Å²	130	85.4 Å²	85.4	61%	0.607	44%	0.442	S	S	*	.	H	α-helix	trans	-66.5	-30.6	176.6	-66.3	150.6	173.8	0	0	112.2	I375 I379 K380 N381	I375-E377 HydrophobicContact CG2-CB 4.12Å; I375-E377 HydrophobicContact CG2-CG 4.47Å; I375-E377 WeakPolarHBondContact CG2-OE2 3.45Å; I375-E377 PolarHBondContact O-N 2.82Å; E377-I379 PolarHBondContact O-N 2.96Å; E377-K380 PolarHBondContact O-N 3.26Å; E377-N381 WeakPolarHBondContact O-CB 3.4Å; E377-N381 VanDerWaalsContact O-CG 3.27Å; E377-N381 PolarHBondContact O-N 2.96Å; E377-N381 PolarHBondContact O-ND2 3.4Å
378	I	62.1	Low	56.7	Low	47 Å²	47	84 Å²	84	24%	0.241	44%	0.438	C	S	.	.	H	α-helix	trans	-65.5	-30.2	174	-57.5	175.8	0	0	0	110.6	A360 L374 I375 P376 I393 I562	A360-I378 HydrophobicContact CB-CD1 3.78Å; L374-I378 HydrophobicContact CD1-CD1 4.31Å; L374-I378 HydrophobicContact CD2-CB 4.46Å; L374-I378 HydrophobicContact CD2-CG2 4.32Å; I375-I378 HydrophobicContact CB-CD1 4.03Å; I375-I378 HydrophobicContact CB-CG1 4.23Å; I375-I378 WeakPolarHBondContact O-CB 3.24Å; I375-I378 PolarHBondContact O-N 2.94Å; P376-I378 VanDerWaalsContact C-N 3.29Å; P376-I378 PolarHBondContact O-N 3.42Å; I378-I393 HydrophobicContact CD1-CD1 4.44Å; I378-I562 HydrophobicContact CG2-CD1 4.34Å
379	I	56.2	Low	56.1	Low	97 Å²	97	82.3 Å²	82.3	50%	0.497	43%	0.426	S	S	.	.	H	α-helix	trans	-82.8	-30.9	174.7	-49.8	179	0	0	0	111.2	L374 P376 E377 F383	L374-I379 HydrophobicContact CD2-CD1 4.12Å; L374-I379 HydrophobicContact CD2-CG1 3.8Å; P376-I379 PolarHBondContact O-N 2.83Å; P376-I379 VanDerWaalsContact O-N 3.17Å; E377-I379 PolarHBondContact O-N 2.96Å; I379-F383 WeakPolarHBondContact O-CD2 3.3Å; I379-F383 WeakPolarHBondContact O-CE2 3.3Å
380	K	55.3	Low	55.9	Low	167 Å²	167	85.3 Å²	85.3	73%	0.726	44%	0.439	S	S	*	.	H	α-helix	trans	-86.7	-21.9	-175.8	-72.4	178.2	178.2	-178	0	114.8	P376 E377 K382	P376-K380 WeakPolarHBondContact O-CG 3.34Å; P376-K380 PolarHBondContact O-N 3.47Å; E377-K380 PolarHBondContact O-N 3.26Å; K380-K382 VanDerWaalsContact C-N 3.31Å; K380-K382 PolarHBondContact O-N 3.35Å
381	N	52.1	Low	55.5	Low	125 Å²	125	88.6 Å²	88.6	67%	0.668	45%	0.45	S	S	*	.	S	Bend	trans	-76.7	78	-176.3	-78.9	-25.8	0	0	0	113	E377	E377-N381 WeakPolarHBondContact O-CB 3.4Å; E377-N381 VanDerWaalsContact O-CG 3.27Å; E377-N381 PolarHBondContact O-N 2.96Å; E377-N381 PolarHBondContact O-ND2 3.4Å
382	K	44.4	Very low	55.2	Low	174 Å²	174	93 Å²	93	76%	0.757	47%	0.465	S	S	*	.			trans	53.5	78.3	164.8	-68.5	-174.8	174.4	-179.1	0	115.8	K380 H384	K380-K382 VanDerWaalsContact C-N 3.31Å; K380-K382 PolarHBondContact O-N 3.35Å; K382-H384 PolarHBondContact O-N 2.89Å
383	F	47.7	Very low	54.9	Low	114 Å²	114	94.8 Å²	94.8	50%	0.5	47%	0.474	S	S	.	.			trans	-71.2	46.4	161.3	-82	-111.7	0	0	0	112.7	I379 L417 I562	I379-F383 WeakPolarHBondContact O-CD2 3.3Å; I379-F383 WeakPolarHBondContact O-CE2 3.3Å; F383-L417 HydrophobicContact CE1-CD1 4.01Å; F383-I562 HydrophobicContact CZ-CD1 4.47Å
384	H	40.2	Very low	55	Low	152 Å²	152	97.9 Å²	97.9	70%	0.704	49%	0.487	S	S	*	.	S	Bend	trans	-134.6	119.8	177.9	-84	-81.7	0	0	0	110.8	K382	K382-H384 PolarHBondContact O-N 2.89Å
385	N	38.7	Very low	55.2	Low	158 Å²	158	96.6 Å²	96.6	85%	0.845	48%	0.481	S	S	*	.	S	Bend	trans	66.9	41.6	162.3	-53.6	13	0	0	0	117.3
386	L	37.9	Very low	55.2	Low	149 Å²	149	95.2 Å²	95.2	78%	0.78	47%	0.474	S	S	*	.			trans	-131.5	141.5	169.9	-76.4	164.1	0	0	0	111.3
387	S	40.7	Very low	55.8	Low	79 Å²	79	100.8 Å²	100.8	55%	0.552	49%	0.493	S	S	*	.			trans	-65.8	146.2	-176.9	-173	0	0	0	0	112.2	S389	S387-S389 VanDerWaalsContact C-N 3.27Å; S387-S389 PolarHBondContact O-N 3.33Å
388	P	40.4	Very low	55.9	Low	72 Å²	72	97.2 Å²	97.2	47%	0.468	48%	0.476	S	S	.	.	S	Bend	trans	-77.9	1.2	-174.2	-14.2	31	0	0	0	115.7
389	S	45.7	Very low	56.2	Low	60 Å²	60	96.2 Å²	96.2	42%	0.42	47%	0.471	S	S	.	.	S	Bend	trans	-68.3	-50.6	-157.2	54.9	0	0	0	0	114.6	S387 D625	S387-S389 VanDerWaalsContact C-N 3.27Å; S387-S389 PolarHBondContact O-N 3.33Å; S389-D625 WeakPolarHBondContact CB-OD2 3.46Å; S389-D625 PolarHBondContact OG-OD1 2.85Å; S389-D625 PolarHBondContact OG-OD2 3.31Å
390	K	51.7	Low	57.2	Low	83 Å²	83	95.4 Å²	95.4	36%	0.361	47%	0.465	S	S	.	.			trans	-141.3	110.7	-172.8	-79.6	161.4	-172.3	159.7	0	114.4	Y392 D627	K390-Y392 HydrophobicContact CB-CE2 3.77Å; K390-Y392 HydrophobicContact CG-CE2 4.43Å; K390-D627 IonicContact NZ-OD1 2.68Å; K390-D627 PolarHBondContact NZ-OD1 2.82Å; K390-D627 IonicContact NZ-OD2 3.96Å; K390-D627 PolarHBondContact NZ-OD2 3.49Å
391	W	57.5	Low	58.4	Low	79 Å²	79	94 Å²	94	30%	0.299	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	142.3	170	-58	-26.9	0	0	0	111.4	R414 L415 L417	W391-R414 WeakPolarHBondContact O-CA 3.41Å; W391-L415 HydrophobicContact CB-CB 4.02Å; W391-L415 HydrophobicContact CB-CD1 4.19Å; W391-L415 HydrophobicContact CE3-CB 4.33Å; W391-L415 PolarHBondContact O-N 3.48Å; W391-L417 HydrophobicContact CH2-CB 3.72Å; W391-L417 HydrophobicContact CH2-CD1 3.98Å; W391-L417 HydrophobicContact CH2-CD2 4.41Å; W391-L417 HydrophobicContact CH2-CG 4.24Å; W391-L417 HydrophobicContact CZ3-CB 3.69Å; W391-L417 HydrophobicContact CZ3-CD1 4Å; W391-L417 HydrophobicContact CZ3-CG 4.41Å
392	Y	64.1	Low	59.4	Low	100 Å²	100	91.2 Å²	91.2	39%	0.392	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	151	-177.8	-53.9	-88.2	0	0	0	111.6	K390 Q413 R414	K390-Y392 HydrophobicContact CB-CE2 3.77Å; K390-Y392 HydrophobicContact CG-CE2 4.43Å; Y392-Q413 WeakPolarHBondContact CA-O 3.49Å; Y392-R414 HydrophobicContact CD1-CG 3.99Å; Y392-R414 HydrophobicContact CE1-CG 3.81Å
393	I	67.8	Low	61	Low	43 Å²	43	83.3 Å²	83.3	22%	0.221	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	154.9	163.3	-167.4	155.9	0	0	0	109.6	S358 N359 A360 I378 Y412 Q413 L415	S358-I393 VanDerWaalsContact OG-CG2 3.27Å; S358-I393 WeakPolarHBondContact OG-CG2 3.41Å; N359-I393 HydrophobicContact CB-CD1 4.18Å; N359-I393 HydrophobicContact CB-CG1 4.26Å; A360-I393 HydrophobicContact CB-CD1 4.07Å; A360-I393 HydrophobicContact CB-CG2 4.23Å; I378-I393 HydrophobicContact CD1-CD1 4.44Å; I393-Y412 CarbonylContact O-C 3.53Å; I393-Y412 VanDerWaalsContact O-CA 3.29Å; I393-Y412 WeakPolarHBondContact O-CA 3.36Å; I393-Q413 HydrophobicContact CG2-CB 4.23Å; I393-Q413 PolarHBondContact N-O 3.42Å; I393-Q413 PolarHBondContact O-N 2.91Å; I393-L415 HydrophobicContact CB-CD1 4.12Å; I393-L415 HydrophobicContact CG2-CD1 4.08Å
394	E	74.9	Confident	62.8	Low	96 Å²	96	82.6 Å²	82.6	45%	0.449	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	147.1	176.2	-61	-170.5	147.6	0	0	111.4	N359 K410 Y412	N359-E394 PolarHBondContact ND2-O 3.09Å; E394-K410 WeakPolarHBondContact OE1-CE 3.22Å; E394-K410 IonicContact OE1-NZ 2.66Å; E394-K410 PolarHBondContact OE1-NZ 3.08Å; E394-Y412 HydrophobicContact CG-CE1 4.38Å
395	C	75.3	Confident	64.7	Low	4 Å²	4	82.5 Å²	82.5	3%	0.027	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-63.2	163.6	176.1	-68.6	0	0	0	0	113.2	N359 M399 E400 C411 Y412 P568	N359-C395 PolarHBondContact ND2-O 3.01Å; C395-M399 HydrophobicContact CB-CB 4.08Å; C395-E400 HydrophobicContact CB-CG 4.16Å; C395-C411 HydrophobicContact CB-CB 3.57Å; C395-C411 WeakPolarHBondContact CB-SG 3.18Å; C395-C411 PolarHBondContact N-O 3.09Å; C395-C411 WeakPolarHBondContact SG-CB 3.38Å; C395-C411 PolarHBondContact SG-O 2.92Å; C395-C411 VanDerWaalsContact SG-O 3.36Å; C395-C411 CovalentContact SG-SG 2.03Å; C395-C411 PolarHBondContact SG-SG 3.41Å; C395-Y412 PolarHBondContact SG-N 3.35Å; C395-Y412 VanDerWaalsContact SG-N 3.37Å; C395-P568 VanDerWaalsContact SG-CB 3.58Å
396	N	72.8	Confident	67	Low	16 Å²	16	81.8 Å²	81.8	9%	0.086	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-89	168.8	161.3	73.8	24.9	0	0	0	111.3	I336 C356 K357 E398 M399 E400	I336-N396 WeakPolarHBondContact CD1-ND2 3.45Å; C356-N396 PolarHBondContact O-ND2 2.76Å; K357-N396 VanDerWaalsContact C-ND2 3.28Å; K357-N396 WeakPolarHBondContact CA-ND2 3.4Å; K357-N396 PolarHBondContact O-ND2 2.87Å; N396-E398 PolarHBondContact O-N 2.99Å; N396-E398 WeakPolarHBondContact OD1-CA 3.25Å; N396-E398 PolarHBondContact OD1-N 3.21Å; N396-M399 PolarHBondContact O-N 3.47Å; N396-M399 WeakPolarHBondContact OD1-CG 3.48Å; N396-M399 PolarHBondContact OD1-N 2.04Å; N396-E400 WeakPolarHBondContact O-CG 3.31Å; N396-E400 PolarHBondContact O-N 2.94Å
397	K	79.3	Confident	69.3	Low	171 Å²	171	75.7 Å²	75.7	74%	0.743	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-4.8	179.8	-65.7	-172.7	176	-176.6	0	116.9	E400 K401	K397-E400 WeakPolarHBondContact CA-OE2 3.07Å; K397-K401 WeakPolarHBondContact O-CE 3.11Å
398	E	69.4	Low	71.3	Confident	55 Å²	55	72.9 Å²	72.9	26%	0.257	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-36.6	175.5	-173.7	145.1	-126.6	0	0	112.2	I336 N396 E400 K401	I336-E398 HydrophobicContact CD1-CB 3.98Å; I336-E398 HydrophobicContact CD1-CG 4.49Å; I336-E398 HydrophobicContact CG2-CG 3.95Å; I336-E398 WeakPolarHBondContact CG2-OE2 3.44Å; N396-E398 PolarHBondContact O-N 2.99Å; N396-E398 WeakPolarHBondContact OD1-CA 3.25Å; N396-E398 PolarHBondContact OD1-N 3.21Å; E398-E400 VanDerWaalsContact C-N 3.32Å; E398-K401 HydrophobicContact CG-CD 4.4Å; E398-K401 WeakPolarHBondContact O-CB 3.25Å; E398-K401 PolarHBondContact O-N 2.86Å; E398-K401 IonicContact OE1-NZ 2.88Å; E398-K401 PolarHBondContact OE1-NZ 2.93Å
399	M	68.7	Low	73.4	Confident	27 Å²	27	74 Å²	74	13%	0.133	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-69.2	-31.7	168.3	-60.5	-61.5	96.8	0	0	111.2	I336 K357 C395 N396 K401 F402 P568	I336-M399 HydrophobicContact CG2-CE 4.05Å; K357-M399 HydrophobicContact CD-SD 4.37Å; K357-M399 HydrophobicContact CG-CE 4.47Å; K357-M399 HydrophobicContact CG-CG 4.43Å; K357-M399 HydrophobicContact CG-SD 3.95Å; K357-M399 WeakPolarHBondContact O-CG 3.49Å; C395-M399 HydrophobicContact CB-CB 4.08Å; N396-M399 PolarHBondContact O-N 3.47Å; N396-M399 WeakPolarHBondContact OD1-CG 3.48Å; N396-M399 PolarHBondContact OD1-N 2.04Å; M399-K401 PolarHBondContact O-N 2.97Å; M399-F402 VanDerWaalsContact O-CB 3.26Å; M399-F402 WeakPolarHBondContact O-CB 3.49Å; M399-F402 PolarHBondContact O-N 3.2Å; M399-P568 HydrophobicContact CB-CB 4.34Å; M399-P568 HydrophobicContact CB-CG 4.31Å
400	E	76.9	Confident	75.2	Confident	80 Å²	80	75.6 Å²	75.6	37%	0.374	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-53	-32.2	169.2	-80.5	168.9	-160.1	0	0	113	C395 N396 K397 E398 F402 C403 C411	C395-E400 HydrophobicContact CB-CG 4.16Å; N396-E400 WeakPolarHBondContact O-CG 3.31Å; N396-E400 PolarHBondContact O-N 2.94Å; K397-E400 WeakPolarHBondContact CA-OE2 3.07Å; E398-E400 VanDerWaalsContact C-N 3.32Å; E400-F402 PolarHBondContact O-N 3.36Å; E400-C403 PolarHBondContact O-N 3.2Å; E400-C403 VanDerWaalsContact O-O 3.14Å; E400-C411 HydrophobicContact CG-CB 4.43Å
401	K	81	Confident	76.5	Confident	138 Å²	138	72.4 Å²	72.4	60%	0.6	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-69.6	-13.1	178.6	-53.8	171.8	-168.4	162.4	0	113.5	K397 E398 M399 C403	K397-K401 WeakPolarHBondContact O-CE 3.11Å; E398-K401 HydrophobicContact CG-CD 4.4Å; E398-K401 WeakPolarHBondContact O-CB 3.25Å; E398-K401 PolarHBondContact O-N 2.86Å; E398-K401 IonicContact OE1-NZ 2.88Å; E398-K401 PolarHBondContact OE1-NZ 2.93Å; M399-K401 PolarHBondContact O-N 2.97Å; K401-C403 VanDerWaalsContact C-N 3.27Å
402	F	71.4	Confident	77.1	Confident	65 Å²	65	71.5 Å²	71.5	29%	0.285	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-77.8	-16.9	170.7	-172.2	-97.1	0	0	0	111.8	M399 E400 W567 P568 L579 D580	M399-F402 VanDerWaalsContact O-CB 3.26Å; M399-F402 WeakPolarHBondContact O-CB 3.49Å; M399-F402 PolarHBondContact O-N 3.2Å; E400-F402 PolarHBondContact O-N 3.36Å; F402-W567 HydrophobicContact CD2-CE3 4.41Å; F402-W567 HydrophobicContact CD2-CZ3 4.35Å; F402-W567 HydrophobicContact CE1-CE3 4.44Å; F402-W567 AromaticContact CE2-CE3 3.72Å; F402-W567 HydrophobicContact CE2-CE3 3.72Å; F402-W567 AromaticContact CE2-CZ3 3.58Å; F402-W567 HydrophobicContact CE2-CZ3 3.58Å; F402-W567 AromaticContact CZ-CE3 3.72Å; F402-W567 HydrophobicContact CZ-CE3 3.72Å; F402-W567 AromaticContact CZ-CZ3 3.98Å; F402-W567 HydrophobicContact CZ-CZ3 3.98Å; F402-P568 HydrophobicContact CB-CG 3.77Å; F402-P568 HydrophobicContact CD1-CG 3.58Å; F402-P568 HydrophobicContact CE1-CG 4.43Å; F402-P568 HydrophobicContact CG-CG 3.89Å; F402-L579 HydrophobicContact CE1-CB 4.01Å; F402-L579 WeakPolarHBondContact CE1-O 3.28Å; F402-L579 HydrophobicContact CZ-CB 4.08Å; F402-D580 WeakPolarHBondContact O-CA 3.24Å; F402-D580 WeakPolarHBondContact O-CB 3.43Å
403	C	79	Confident	77.1	Confident	9 Å²	9	66.7 Å²	66.7	6%	0.061	32%	0.316	C	S	.	.	S	Bend	trans	-102	135.3	177.8	-55.1	0	0	0	0	110.8	E400 K401 Q405 T408 C411 C570	E400-C403 PolarHBondContact O-N 3.2Å; E400-C403 VanDerWaalsContact O-O 3.14Å; K401-C403 VanDerWaalsContact C-N 3.27Å; C403-Q405 PolarHBondContact O-N 3.16Å; C403-T408 HydrophobicContact CB-CG2 3.84Å; C403-T408 WeakPolarHBondContact CB-OG1 3.47Å; C403-C411 PolarHBondContact SG-SG 2.87Å; C403-C570 WeakPolarHBondContact CA-SG 3.2Å; C403-C570 HydrophobicContact CB-CB 3.83Å; C403-C570 WeakPolarHBondContact CB-SG 3.03Å; C403-C570 WeakPolarHBondContact SG-CB 3.22Å; C403-C570 CovalentContact SG-SG 2.03Å; C403-C570 PolarHBondContact SG-SG 3.17Å
404	Q	85.4	Confident	76.7	Confident	99 Å²	99	70.5 Å²	70.5	46%	0.463	33%	0.327	S	S	.	.			trans	-65.6	106.8	174.9	-177.4	73.4	-29	0	0	109.2	N406 N407 T408 D580 C581	Q404-N406 VanDerWaalsContact C-N 3.33Å; Q404-N406 PolarHBondContact O-N 2.03Å; Q404-N407 HydrophobicContact CB-CB 4.09Å; Q404-N407 HydrophobicContact CG-CB 3.83Å; Q404-N407 CarbonylContact O-C 3.58Å; Q404-N407 PolarHBondContact O-N 2.85Å; Q404-T408 WeakPolarHBondContact O-CB 3.42Å; Q404-T408 PolarHBondContact O-N 3.11Å; Q404-T408 VanDerWaalsContact O-N 3.07Å; Q404-T408 PolarHBondContact O-OG1 2.9Å; Q404-D580 WeakPolarHBondContact CB-O 3.4Å; Q404-D580 PolarHBondContact N-O 3.3Å; Q404-C581 HydrophobicContact CB-CB 4.48Å
405	Q	80.7	Confident	75.9	Confident	149 Å²	149	67 Å²	67	70%	0.696	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-42.4	-165.5	-68.7	-175.6	-27.5	0	0	113.8	C403 N407	C403-Q405 PolarHBondContact O-N 3.16Å; Q405-N407 VanDerWaalsContact C-N 3.28Å; Q405-N407 PolarHBondContact O-N 3.39Å
406	N	86.2	Confident	74.9	Confident	144 Å²	144	75 Å²	75	77%	0.77	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-19.6	-179.9	-63.5	-1.1	0	0	0	113.4	Q404	Q404-N406 VanDerWaalsContact C-N 3.33Å; Q404-N406 PolarHBondContact O-N 2.03Å
407	N	86.1	Confident	73.9	Confident	21 Å²	21	77 Å²	77	11%	0.112	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-4.8	-171.6	-64.2	6	0	0	0	112.6	Q404 Q405 H573 F576 C581	Q404-N407 HydrophobicContact CB-CB 4.09Å; Q404-N407 HydrophobicContact CG-CB 3.83Å; Q404-N407 CarbonylContact O-C 3.58Å; Q404-N407 PolarHBondContact O-N 2.85Å; Q405-N407 VanDerWaalsContact C-N 3.28Å; Q405-N407 PolarHBondContact O-N 3.39Å; N407-H573 PolarHBondContact O-N 2.82Å; N407-H573 PolarHBondContact O-ND1 3.41Å; N407-F576 HydrophobicContact CB-CB 4.2Å; N407-F576 HydrophobicContact CB-CD1 4.45Å; N407-F576 HydrophobicContact CB-CD2 3.65Å; N407-F576 HydrophobicContact CB-CE2 4.12Å; N407-F576 HydrophobicContact CB-CG 3.84Å; N407-F576 VanDerWaalsContact CG-CD2 3.49Å; N407-F576 VanDerWaalsContact CG-CE2 3.48Å; N407-F576 WeakPolarHBondContact ND2-CD1 3.2Å; N407-F576 WeakPolarHBondContact ND2-CE1 3.25Å; N407-F576 WeakPolarHBondContact ND2-CG 3.13Å; N407-F576 WeakPolarHBondContact ND2-CZ 3.43Å; N407-F576 WeakPolarHBondContact OD1-CE2 3.26Å; N407-C581 HydrophobicContact CB-CB 3.96Å; N407-C581 VanDerWaalsContact CB-O 3.29Å; N407-C581 WeakPolarHBondContact CB-O 3.13Å; N407-C581 PolarHBondContact ND2-O 3.34Å
408	T	83.4	Confident	72.6	Confident	20 Å²	20	70.8 Å²	70.8	12%	0.123	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	128.8	-174.1	-51.4	0	0	0	0	110.9	C403 Q404 K410 C570 H573	C403-T408 HydrophobicContact CB-CG2 3.84Å; C403-T408 WeakPolarHBondContact CB-OG1 3.47Å; Q404-T408 WeakPolarHBondContact O-CB 3.42Å; Q404-T408 PolarHBondContact O-N 3.11Å; Q404-T408 VanDerWaalsContact O-N 3.07Å; Q404-T408 PolarHBondContact O-OG1 2.9Å; T408-K410 WeakPolarHBondContact CG2-O 3.4Å; T408-C570 HydrophobicContact CG2-CB 3.93Å; T408-H573 PolarHBondContact N-ND1 3.49Å
409	I	84.4	Confident	71.5	Confident	96 Å²	96	76.2 Å²	76.2	49%	0.492	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	-50.8	175.1	-57.8	175.8	0	0	0	110	L571 C572	I409-L571 HydrophobicContact CB-CD2 4.22Å; I409-L571 HydrophobicContact CB-CG 4.26Å; I409-L571 WeakPolarHBondContact CB-O 3.47Å; I409-L571 HydrophobicContact CD1-CG 4.45Å; I409-L571 HydrophobicContact CG2-CD2 4.28Å; I409-L571 PolarHBondContact N-O 2.99Å; I409-C572 WeakPolarHBondContact CD1-O 3.36Å
410	K	82.8	Confident	70.3	Confident	93 Å²	93	79.9 Å²	79.9	40%	0.404	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	153.4	177.5	-79.2	-164.3	168.9	-159.3	0	111.9	E394 T408 Y412 L571	E394-K410 WeakPolarHBondContact OE1-CE 3.22Å; E394-K410 IonicContact OE1-NZ 2.66Å; E394-K410 PolarHBondContact OE1-NZ 3.08Å; T408-K410 WeakPolarHBondContact CG2-O 3.4Å; K410-Y412 HydrophobicContact CB-CD2 4.35Å; K410-Y412 HydrophobicContact CB-CE2 3.68Å; K410-Y412 HydrophobicContact CD-CE1 4.31Å; K410-Y412 VanDerWaalsContact CD-OH 3.27Å; K410-Y412 WeakPolarHBondContact CD-OH 3.37Å; K410-L571 WeakPolarHBondContact O-CB 3.25Å; K410-L571 PolarHBondContact O-N 3.29Å
411	C	78.5	Confident	68.3	Low	15 Å²	15	80.9 Å²	80.9	10%	0.101	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	127.2	173.6	-177.8	0	0	0	0	109.3	C395 E400 C403 P568	C395-C411 HydrophobicContact CB-CB 3.57Å; C395-C411 WeakPolarHBondContact CB-SG 3.18Å; C395-C411 PolarHBondContact N-O 3.09Å; C395-C411 WeakPolarHBondContact SG-CB 3.38Å; C395-C411 PolarHBondContact SG-O 2.92Å; C395-C411 VanDerWaalsContact SG-O 3.36Å; C395-C411 CovalentContact SG-SG 2.03Å; C395-C411 PolarHBondContact SG-SG 3.41Å; E400-C411 HydrophobicContact CG-CB 4.43Å; C403-C411 PolarHBondContact SG-SG 2.87Å; C411-P568 VanDerWaalsContact SG-CB 3.59Å
412	Y	72.1	Confident	66.1	Low	60 Å²	60	80.2 Å²	80.2	24%	0.235	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	159.2	-179.9	-61.7	-75.8	0	0	0	113	I393 E394 C395 K410 P568 Y569 L571	I393-Y412 CarbonylContact O-C 3.53Å; I393-Y412 VanDerWaalsContact O-CA 3.29Å; I393-Y412 WeakPolarHBondContact O-CA 3.36Å; E394-Y412 HydrophobicContact CG-CE1 4.38Å; C395-Y412 PolarHBondContact SG-N 3.35Å; C395-Y412 VanDerWaalsContact SG-N 3.37Å; K410-Y412 HydrophobicContact CB-CD2 4.35Å; K410-Y412 HydrophobicContact CB-CE2 3.68Å; K410-Y412 HydrophobicContact CD-CE1 4.31Å; K410-Y412 VanDerWaalsContact CD-OH 3.27Å; K410-Y412 WeakPolarHBondContact CD-OH 3.37Å; Y412-P568 CarbonylContact O-C 3.56Å; Y412-P568 WeakPolarHBondContact O-CA 3.42Å; Y412-Y569 HydrophobicContact CD2-CD1 4.23Å; Y412-Y569 PolarHBondContact N-O 3.01Å; Y412-Y569 PolarHBondContact O-N 2.7Å; Y412-L571 HydrophobicContact CD2-CB 4.48Å; Y412-L571 HydrophobicContact CE2-CB 4.22Å; Y412-L571 HydrophobicContact CE2-CD2 4.2Å
413	Q	62.5	Low	64.1	Low	0 Å²	0	85 Å²	85	0%	0	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	128.9	168.2	-64.7	173.7	-73	0	0	109.1	K357 S358 Y392 I393 I564 P568	K357-Q413 PolarHBondContact O-NE2 2.87Å; K357-Q413 PolarHBondContact O-OE1 3.15Å; S358-Q413 PolarHBondContact OG-OE1 3.06Å; Y392-Q413 WeakPolarHBondContact CA-O 3.49Å; I393-Q413 HydrophobicContact CG2-CB 4.23Å; I393-Q413 PolarHBondContact N-O 3.42Å; I393-Q413 PolarHBondContact O-N 2.91Å; Q413-I564 HydrophobicContact CB-CG2 4.05Å; Q413-P568 HydrophobicContact CG-CB 4.5Å
414	R	60.6	Low	61.9	Low	123 Å²	123	91.9 Å²	91.9	46%	0.464	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	133.2	-179.4	-56.7	-177.4	-175.9	-174.3	-0.6	109.9	W391 Y392 I564 S565	W391-R414 WeakPolarHBondContact O-CA 3.41Å; Y392-R414 HydrophobicContact CD1-CG 3.99Å; Y392-R414 HydrophobicContact CE1-CG 3.81Å; R414-I564 WeakPolarHBondContact O-CA 3.27Å; R414-S565 PolarHBondContact O-N 3.42Å
415	L	58.3	Low	59.1	Low	21 Å²	21	91.6 Å²	91.6	11%	0.11	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	144.7	167.9	-51.9	98.2	0	0	0	109.3	A360 W391 I393 I562 D563 I564	A360-L415 HydrophobicContact CB-CD2 4.19Å; W391-L415 HydrophobicContact CB-CB 4.02Å; W391-L415 HydrophobicContact CB-CD1 4.19Å; W391-L415 HydrophobicContact CE3-CB 4.33Å; W391-L415 PolarHBondContact O-N 3.48Å; I393-L415 HydrophobicContact CB-CD1 4.12Å; I393-L415 HydrophobicContact CG2-CD1 4.08Å; L415-I562 HydrophobicContact CB-CG2 3.95Å; L415-I562 HydrophobicContact CD2-CG2 3.76Å; L415-I562 HydrophobicContact CG-CG2 4.42Å; L415-D563 CarbonylContact C-O 3.59Å; L415-D563 WeakPolarHBondContact CA-O 3.3Å; L415-I564 HydrophobicContact CB-CG1 4.35Å; L415-I564 HydrophobicContact CD2-CD1 3.44Å; L415-I564 VanDerWaalsContact CD2-CD1 3.44Å; L415-I564 HydrophobicContact CD2-CG1 3.95Å; L415-I564 HydrophobicContact CG-CD1 3.76Å; L415-I564 HydrophobicContact CG-CG1 3.91Å
416	R	52.6	Low	56.9	Low	174 Å²	174	90.2 Å²	90.2	66%	0.657	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.6	131.6	176.7	-174.9	-179.9	-172.3	168.9	9.3	111	I562 D563	R416-I562 WeakPolarHBondContact O-CA 3.02Å; R416-D563 PolarHBondContact N-O 3.13Å; R416-D563 PolarHBondContact O-N 2.82Å
417	L	53.7	Low	54.3	Low	57 Å²	57	90 Å²	90	30%	0.298	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	134.4	170.5	-157.4	75.7	0	0	0	111.3	F383 W391 N561 I562	F383-L417 HydrophobicContact CE1-CD1 4.01Å; W391-L417 HydrophobicContact CH2-CB 3.72Å; W391-L417 HydrophobicContact CH2-CD1 3.98Å; W391-L417 HydrophobicContact CH2-CD2 4.41Å; W391-L417 HydrophobicContact CH2-CG 4.24Å; W391-L417 HydrophobicContact CZ3-CB 3.69Å; W391-L417 HydrophobicContact CZ3-CD1 4Å; W391-L417 HydrophobicContact CZ3-CG 4.41Å; L417-N561 CarbonylContact C-O 3.56Å; L417-N561 VanDerWaalsContact CA-O 3.29Å; L417-N561 WeakPolarHBondContact CA-O 3.09Å; L417-N561 WeakPolarHBondContact CD1-O 3.06Å; L417-I562 HydrophobicContact CD1-CG1 4.07Å
418	M	50.4	Low	51.6	Low	40 Å²	40	94.6 Å²	94.6	20%	0.197	48%	0.476	C	S	.	.			trans	-87.1	113.3	170.3	-51.5	-119.2	68.8	0	0	108.2	Y56 S560 N561 D563	Y56-M418 HydrophobicContact CD1-CE 4.12Å; Y56-M418 HydrophobicContact CD1-SD 4.03Å; Y56-M418 HydrophobicContact CD2-SD 3.96Å; Y56-M418 HydrophobicContact CE1-CE 3.54Å; Y56-M418 HydrophobicContact CE1-SD 3.58Å; Y56-M418 VanDerWaalsContact CE1-SD 3.58Å; Y56-M418 HydrophobicContact CE2-SD 3.46Å; Y56-M418 WeakPolarHBondContact CE2-SD 3.37Å; Y56-M418 HydrophobicContact CG-SD 4.25Å; M418-S560 WeakPolarHBondContact CG-O 3.47Å; M418-N561 PolarHBondContact N-O 3.12Å; M418-D563 HydrophobicContact CG-CB 4.4Å; M418-D563 HydrophobicContact SD-CB 4.2Å
419	K	47.9	Very low	49	Very low	170 Å²	170	99.3 Å²	99.3	74%	0.739	51%	0.505	S	S	*	.			trans	-75	124.9	170.8	-68.1	-177.4	179.3	177.7	0	109	T421	K419-T421 PolarHBondContact O-N 3.38Å
420	D	43.4	Very low	46.6	Very low	103 Å²	103	101.1 Å²	101.1	55%	0.551	52%	0.521	S	S	*	.			trans	-66.2	126.6	175	-89.6	-61.1	0	0	0	111.2	N561	D420-N561 PolarHBondContact OD2-ND2 3.38Å
421	T	34.6	Very low	44	Very low	102 Å²	102	101.1 Å²	101.1	63%	0.626	53%	0.532	S	S	*	.			trans	-105.7	70.5	-176.8	38.6	0	0	0	0	111.3	K419 Y423	K419-T421 PolarHBondContact O-N 3.38Å; T421-Y423 PolarHBondContact O-N 3.47Å
422	T	33.9	Very low	41.5	Very low	123 Å²	123	105.9 Å²	105.9	76%	0.755	56%	0.561	S	S	*	*			trans	-69.3	95.3	166.4	45.5	0	0	0	0	110.2	N424	T422-N424 PolarHBondContact O-N 2.79Å
423	Y	30.5	Very low	39.4	Very low	165 Å²	165	109.9 Å²	109.9	65%	0.647	59%	0.587	S	S	*	*			trans	-72.6	103.5	169.1	-93.8	-99	0	0	0	110	T421 T425	T421-Y423 PolarHBondContact O-N 3.47Å; Y423-T425 PolarHBondContact O-N 3.1Å; Y423-T425 VanDerWaalsContact O-N 3.17Å
424	N	30.9	Very low	37.7	Very low	155 Å²	155	115.7 Å²	115.7	83%	0.829	62%	0.622	S	S	*	*			trans	-75.6	97.1	164.9	-78.8	-5.3	0	0	0	109.3	T422	T422-N424 PolarHBondContact O-N 2.79Å
425	T	27.6	Very low	36.1	Very low	93 Å²	93	115.6 Å²	115.6	57%	0.571	64%	0.636	S	S	*	*			trans	-114.3	96.1	166.8	51.3	0	0	0	0	109.7	Y423	Y423-T425 PolarHBondContact O-N 3.1Å; Y423-T425 VanDerWaalsContact O-N 3.17Å
426	T	34.9	Very low	34.6	Very low	120 Å²	120	119.2 Å²	119.2	74%	0.736	66%	0.663	S	S	*	*			trans	-110.1	109.8	169.2	47.3	0	0	0	0	110.1
427	D	30.4	Very low	33.5	Very low	138 Å²	138	118.4 Å²	118.4	74%	0.738	67%	0.666	S	S	*	*			trans	59.4	89.8	137.2	-48.6	-27.6	0	0	0	119.5
428	T	31.2	Very low	32.3	Very low	118 Å²	118	120.6 Å²	120.6	72%	0.724	68%	0.682	S	S	*	*				29.9	121.8	121.7	54.6	0	0	0	0	120.4
429	T	28.7	Very low	31.1	Very low	120 Å²	120	124.1 Å²	124.1	74%	0.736	71%	0.706	S	S	*	*			trans	56.5	114.4	138.1	61.5	0	0	0	0	119.6
430	T	32.1	Very low	30.1	Very low	134 Å²	134	122.9 Å²	122.9	82%	0.822	71%	0.708	S	S	*	*				-172	145.9	100.8	20.6	0	0	0	0	114.5
431	S	28.4	Very low	29.4	Very low	92 Å²	92	124.1 Å²	124.1	64%	0.643	72%	0.719	S	S	*	*			trans	30.8	111.1	149.9	63.2	0	0	0	0	122.4
432	T	26.6	Very low	28.9	Very low	116 Å²	116	124.9 Å²	124.9	71%	0.712	72%	0.723	S	S	*	*				53.7	139.4	124.3	63.5	0	0	0	0	122.7
433	N	27.7	Very low	28.7	Very low	143 Å²	143	125.7 Å²	125.7	77%	0.765	72%	0.723	S	S	*	*			trans	73	143.9	151.9	-59.8	-11.7	0	0	0	116.6
434	T	28.1	Very low	28.6	Very low	122 Å²	122	123.2 Å²	123.2	75%	0.748	73%	0.726	S	S	*	*			cis	-153.1	155.8	-3.9	3.4	0	0	0	0	111.8
435	T	26.1	Very low	28.5	Very low	121 Å²	121	121 Å²	121	74%	0.742	72%	0.718	S	S	*	*			trans	-3.1	143.1	159.3	-8.6	0	0	0	0	122
436	S	26.7	Very low	28.5	Very low	98 Å²	98	122.3 Å²	122.3	69%	0.685	73%	0.726	S	S	*	*			trans	78.6	162.2	145.8	83.9	0	0	0	0	118.3
437	H	30.2	Very low	28.2	Very low	156 Å²	156	121.9 Å²	121.9	72%	0.722	72%	0.723	S	S	*	*			cis	-154.5	145.7	14.4	-133.4	-64.9	0	0	0	112.7
438	T	28.9	Very low	28.2	Very low	103 Å²	103	121 Å²	121	63%	0.632	72%	0.723	S	S	*	*			trans	34.9	111.5	147.6	42.6	0	0	0	0	121.6
439	T	25.4	Very low	28.3	Very low	114 Å²	114	121.9 Å²	121.9	70%	0.699	72%	0.723	S	S	*	*				82.4	144.5	79.2	59.4	0	0	0	0	118.3
440	N	26.8	Very low	28.5	Very low	145 Å²	145	122 Å²	122	78%	0.775	72%	0.719	S	S	*	*			trans	77.2	152.2	167	-51.3	-24	0	0	0	116
441	T	27.8	Very low	28.4	Very low	129 Å²	129	119.8 Å²	119.8	79%	0.791	71%	0.706	S	S	*	*			cis	-147.9	164.4	7.6	-23.5	0	0	0	0	112
442	T	24.3	Very low	28.7	Very low	117 Å²	117	123.5 Å²	123.5	72%	0.718	71%	0.713	S	S	*	*			trans	-67.3	158.7	171.8	49.1	0	0	0	0	114.7
443	N	29.7	Very low	29	Very low	140 Å²	140	122.7 Å²	122.7	75%	0.749	71%	0.712	S	S	*	*			trans	-176.4	133.1	133	-100.6	-10.7	0	0	0	116.1
444	T	28.5	Very low	29.1	Very low	114 Å²	114	121.5 Å²	121.5	70%	0.699	71%	0.709	S	S	*	*			trans	57.1	147.6	136.2	64.5	0	0	0	0	121.7
445	T	28	Very low	29.3	Very low	109 Å²	109	122.1 Å²	122.1	67%	0.669	71%	0.708	S	S	*	*			cis	-173.7	163.6	-0.7	19.8	0	0	0	0	111.7
446	T	28	Very low	29.3	Very low	120 Å²	120	122.1 Å²	122.1	74%	0.736	71%	0.708	S	S	*	*			trans	65.6	152.5	147.1	52.6	0	0	0	0	119
447	T	29.8	Very low	29.5	Very low	110 Å²	110	123.6 Å²	123.6	68%	0.675	71%	0.713	S	S	*	*			cis	-166.7	151.8	1	11.2	0	0	0	0	112
448	T	30.1	Very low	29.3	Very low	119 Å²	119	122.2 Å²	122.2	73%	0.73	72%	0.716	S	S	*	*			trans	61.3	152	152.6	56.4	0	0	0	0	118.2
449	N	32	Very low	29.3	Very low	137 Å²	137	121.8 Å²	121.8	73%	0.733	72%	0.717	S	S	*	*			cis	-167.8	171.3	3.8	-120.7	3.4	0	0	0	108.6
450	N	32.7	Very low	29.5	Very low	122 Å²	122	122.1 Å²	122.1	65%	0.652	72%	0.719	S	S	*	*			cis	-161.6	-174.3	-5.9	-151.9	-10.7	0	0	0	110.6
451	T	31.3	Very low	29.5	Very low	88 Å²	88	121.4 Å²	121.4	54%	0.54	72%	0.715	S	S	.	*			trans	19.3	134.1	151.6	57.9	0	0	0	0	121.4
452	H	34.2	Very low	29.6	Very low	171 Å²	171	121.1 Å²	121.1	79%	0.792	71%	0.709	S	S	*	*			cis	-163.2	-158.2	3.3	-95.9	-35.2	0	0	0	107.8
453	S	32.7	Very low	29.6	Very low	99 Å²	99	121.1 Å²	121.1	69%	0.692	71%	0.709	S	S	*	*			cis	-164.1	143.9	16.1	-23.5	0	0	0	0	114.4
454	T	30.1	Very low	29.6	Very low	117 Å²	117	120.8 Å²	120.8	72%	0.718	71%	0.712	S	S	*	*			trans	18.5	138.1	130.3	59.9	0	0	0	0	120.9
455	N	31.3	Very low	29.4	Very low	136 Å²	136	122.1 Å²	122.1	73%	0.727	72%	0.715	S	S	*	*			cis	-151.7	144.4	7.2	-85.9	-20.8	0	0	0	108.4
456	T	26.8	Very low	29.3	Very low	121 Å²	121	122.1 Å²	122.1	74%	0.742	72%	0.715	S	S	*	*				70.6	109	55.3	56.3	0	0	0	0	118.1
457	T	30.2	Very low	29.2	Very low	128 Å²	128	121.5 Å²	121.5	79%	0.785	71%	0.712	S	S	*	*			trans	-176.7	117.9	139.5	37	0	0	0	0	107.7
458	T	27.8	Very low	29.3	Very low	128 Å²	128	124.5 Å²	124.5	79%	0.785	72%	0.717	S	S	*	*				59.8	133.6	74.3	61.9	0	0	0	0	114.6
459	S	29.2	Very low	29	Very low	94 Å²	94	123.9 Å²	123.9	66%	0.657	71%	0.714	S	S	*	*			cis	-172.2	174.2	-1.9	51.4	0	0	0	0	110.9
460	T	29.6	Very low	28.9	Very low	120 Å²	120	123.8 Å²	123.8	74%	0.736	72%	0.718	S	S	*	*			trans	57.8	146.3	146.3	45	0	0	0	0	120.7
461	N	26.3	Very low	28.6	Very low	130 Å²	130	125.2 Å²	125.2	70%	0.695	73%	0.726	S	S	*	*			cis	-168.8	-173	-18.8	-134.9	52.9	0	0	0	108.8
462	D	29.2	Very low	28.5	Very low	123 Å²	123	127 Å²	127	66%	0.658	74%	0.737	S	S	*	*			trans	65.8	93.4	151.3	-55.4	-23.9	0	0	0	121.8
463	T	25.3	Very low	28.2	Very low	117 Å²	117	124 Å²	124	72%	0.718	73%	0.731	S	S	*	*				45.4	158.8	116.5	64.5	0	0	0	0	124.2
464	T	28.9	Very low	28	Very low	134 Å²	134	125.8 Å²	125.8	82%	0.822	73%	0.732	S	S	*	*			trans	77.1	152	168.9	74	0	0	0	0	117.1
465	N	24.4	Very low	27.8	Very low	142 Å²	142	126 Å²	126	76%	0.759	73%	0.734	S	S	*	*			cis	-165.8	-175.6	-42.1	-152	-8.9	0	0	0	107.6
466	T	26.6	Very low	27.7	Very low	108 Å²	108	123.3 Å²	123.3	66%	0.663	73%	0.731	S	S	*	*			trans	61.3	101.8	151.8	41.9	0	0	0	0	121
467	T	24.7	Very low	27.7	Very low	108 Å²	108	124.5 Å²	124.5	66%	0.663	73%	0.732	S	S	*	*				46.3	123.7	121.1	57.8	0	0	0	0	122.3
468	H	31.5	Very low	27.5	Very low	172 Å²	172	124 Å²	124	80%	0.796	73%	0.73	S	S	*	*				179.1	120.3	113.2	-88.1	-59.7	0	0	0	107.9
469	T	25.2	Very low	27.3	Very low	107 Å²	107	123.2 Å²	123.2	66%	0.656	73%	0.725	S	S	*	*				63.5	99.7	61.4	71.2	0	0	0	0	116.4
470	T	29.8	Very low	27.3	Very low	135 Å²	135	124 Å²	124	83%	0.828	73%	0.726	S	S	*	*			trans	-178.6	125.7	131.4	31.4	0	0	0	0	107.1
471	N	25.4	Very low	27.1	Very low	151 Å²	151	124.8 Å²	124.8	81%	0.807	73%	0.725	S	S	*	*			cis	69.5	104	47.8	-71.5	8.3	0	0	0	115.6
472	T	30	Very low	27.1	Very low	125 Å²	125	124.6 Å²	124.6	77%	0.767	73%	0.729	S	S	*	*			trans	-173.6	120.8	134.1	36.3	0	0	0	0	105.2
473	T	26.5	Very low	26.9	Very low	110 Å²	110	124 Å²	124	68%	0.675	73%	0.73	S	S	*	*				55	133.6	70.5	78.7	0	0	0	0	111.6
474	D	29.5	Very low	27.1	Very low	135 Å²	135	126.7 Å²	126.7	72%	0.722	73%	0.734	S	S	*	*			cis	-145	151.2	32.3	-88.5	-74	0	0	0	111.7
475	T	25.9	Very low	26.8	Very low	121 Å²	121	125.6 Å²	125.6	74%	0.742	73%	0.727	S	S	*	*				88.6	143.9	55.2	-46.7	0	0	0	0	113.4
476	A	29.7	Very low	27	Very low	81 Å²	81	126.5 Å²	126.5	67%	0.669	73%	0.731	S	S	*	*			trans	87.6	126.8	-174.5	0	0	0	0	0	114.9
477	N	25.6	Very low	27	Very low	145 Å²	145	127.9 Å²	127.9	78%	0.775	73%	0.734	S	S	*	*			cis	68.8	137.4	48.5	-63.2	-21.5	0	0	0	112.1
478	T	26	Very low	27	Very low	119 Å²	119	127.9 Å²	127.9	73%	0.73	73%	0.734	S	S	*	*			cis	-154	173.9	19.3	-18.2	0	0	0	0	112.2
479	T	24.9	Very low	26.7	Very low	111 Å²	111	125.3 Å²	125.3	68%	0.681	73%	0.731	S	S	*	*			trans	-15.3	149.1	152.2	55.5	0	0	0	0	116.8
480	T	27.5	Very low	26.7	Very low	111 Å²	111	125.7 Å²	125.7	68%	0.681	73%	0.733	S	S	*	*				-163.4	159.3	61.5	44.2	0	0	0	0	114.7
481	N	25.4	Very low	26.6	Very low	135 Å²	135	124.8 Å²	124.8	72%	0.722	73%	0.727	S	S	*	*				24.7	147.8	128.4	-41.6	-11.8	0	0	0	119.4
482	T	27.1	Very low	26.6	Very low	126 Å²	126	123 Å²	123	77%	0.773	72%	0.722	S	S	*	*			cis	-158.7	163	27.9	-29.4	0	0	0	0	111.8
483	T	24.3	Very low	26.4	Very low	110 Å²	110	124 Å²	124	68%	0.675	72%	0.723	S	S	*	*			trans	-55.5	151.9	163	49.9	0	0	0	0	113.3
484	H	29.2	Very low	26.4	Very low	175 Å²	175	124.5 Å²	124.5	81%	0.81	73%	0.726	S	S	*	*				-159.6	143.2	111.4	-107.1	-67.8	0	0	0	114.1
485	T	24.3	Very low	26.4	Very low	111 Å²	111	123.8 Å²	123.8	68%	0.681	73%	0.731	S	S	*	*			trans	-75.2	161.6	170.8	35	0	0	0	0	112.6
486	I	28.5	Very low	26.3	Very low	161 Å²	161	125 Å²	125	83%	0.826	73%	0.733	S	S	*	*				-165.5	154.4	127.6	-100.4	153.1	0	0	0	110.5
487	N	25	Very low	26.2	Very low	136 Å²	136	127 Å²	127	73%	0.727	74%	0.737	S	S	*	*			trans	-77.7	-169.7	-175.9	-47.6	-42.8	0	0	0	110.8
488	T	25.5	Very low	26.1	Very low	109 Å²	109	125 Å²	125	67%	0.669	73%	0.731	S	S	*	*			cis	-176.6	154	32.3	-20.7	0	0	0	0	110.8
489	T	25.9	Very low	26.2	Very low	118 Å²	118	129.2 Å²	129.2	72%	0.724	74%	0.735	S	S	*	*			trans	56.9	153.2	145.3	46.6	0	0	0	0	122.6
490	T	24.6	Very low	26.2	Very low	115 Å²	115	129.3 Å²	129.3	71%	0.706	74%	0.735	S	S	*	*			cis	-169.8	-171.7	-23.8	25.4	0	0	0	0	108.8
491	T	27.7	Very low	25.9	Very low	116 Å²	116	129.8 Å²	129.8	71%	0.712	74%	0.738	S	S	*	*			trans	74.7	107.8	154.4	47.3	0	0	0	0	120.5
492	T	24.9	Very low	26	Very low	113 Å²	113	130.1 Å²	130.1	69%	0.693	75%	0.745	S	S	*	*				26.9	144.7	115	63.6	0	0	0	0	119.2
493	D	26.4	Very low	25.8	Very low	147 Å²	147	129.6 Å²	129.6	79%	0.786	74%	0.742	S	S	*	*				-158.9	-171.5	56.5	-103.3	-58.7	0	0	0	115.8
494	T	25.4	Very low	25.9	Very low	120 Å²	120	131 Å²	131	74%	0.736	75%	0.745	S	S	*	*			trans	-101.3	165.5	-170.7	56.6	0	0	0	0	115.6
495	S	30	Very low	25.6	Very low	120 Å²	120	128 Å²	128	84%	0.839	74%	0.739	S	S	*	*			trans	-177.4	152.6	139	27.9	0	0	0	0	115.1
496	D	24.6	Very low	25.7	Very low	145 Å²	145	128 Å²	128	78%	0.775	74%	0.739	S	S	*	*			trans	-87.1	-164	-161.2	-57.3	-73	0	0	0	118.3
497	T	27.9	Very low	25.7	Very low	124 Å²	124	127.7 Å²	127.7	76%	0.761	73%	0.734	S	S	*	*			trans	87.2	115.2	163.4	70	0	0	0	0	116.7
498	T	23.9	Very low	25.7	Very low	104 Å²	104	126.4 Å²	126.4	64%	0.638	73%	0.731	S	S	*	*			cis	79.7	121.1	47.2	66.2	0	0	0	0	115.6
499	Y	26.8	Very low	25.7	Very low	207 Å²	207	126.4 Å²	126.4	81%	0.812	73%	0.731	S	S	*	*				163.5	116.5	119.9	-89.5	-65.4	0	0	0	116.5
500	T	24.3	Very low	25.7	Very low	112 Å²	112	126.7 Å²	126.7	69%	0.687	73%	0.733	S	S	*	*			trans	45.5	114.8	138.9	48.8	0	0	0	0	124.8
501	T	22.7	Very low	25.8	Very low	122 Å²	122	126.5 Å²	126.5	75%	0.748	73%	0.732	S	S	*	*				40.7	130.9	126.4	62.3	0	0	0	0	122.8
502	T	26.5	Very low	25.8	Very low	142 Å²	142	126 Å²	126	87%	0.871	73%	0.729	S	S	*	*				-167.9	169	103.2	15.4	0	0	0	0	113.5
503	T	23.1	Very low	26	Very low	114 Å²	114	126.7 Å²	126.7	70%	0.699	73%	0.728	S	S	*	*			trans	-96.2	143.4	-177.9	49.3	0	0	0	0	112.9
504	N	26.2	Very low	26.3	Very low	139 Å²	139	125.5 Å²	125.5	74%	0.743	72%	0.722	S	S	*	*				175	136.2	110.6	-94	-22.1	0	0	0	116.3
505	T	24.5	Very low	26.6	Very low	112 Å²	112	125.3 Å²	125.3	69%	0.687	72%	0.716	S	S	*	*			trans	29.4	146.9	142.6	59.1	0	0	0	0	124.7
506	T	25.1	Very low	26.8	Very low	111 Å²	111	125.6 Å²	125.6	68%	0.681	71%	0.708	S	S	*	*			trans	88.7	133.9	136.8	33.7	0	0	0	0	122.6
507	H	28.1	Very low	27.2	Very low	156 Å²	156	124.7 Å²	124.7	72%	0.722	70%	0.703	S	S	*	*			trans	67.6	112.1	152	-73.6	-59.4	0	0	0	117.9
508	T	24.8	Very low	27.5	Very low	108 Å²	108	124.4 Å²	124.4	66%	0.663	70%	0.698	S	S	*	*				55.6	130.5	85.4	65.3	0	0	0	0	112.9
509	T	25.7	Very low	27.8	Very low	109 Å²	109	124.3 Å²	124.3	67%	0.669	70%	0.697	S	S	*	*			cis	-166.7	159	17.2	-4.1	0	0	0	0	110.2
510	T	26	Very low	28.1	Very low	125 Å²	125	120.5 Å²	120.5	77%	0.767	69%	0.691	S	S	*	*			trans	61.9	168	156.7	51.6	0	0	0	0	116.1
511	T	27.7	Very low	28.4	Very low	110 Å²	110	120.3 Å²	120.3	68%	0.675	69%	0.689	S	S	*	*			cis	-152.8	141.2	10.6	-19.5	0	0	0	0	110.4
512	T	28.1	Very low	28.8	Very low	106 Å²	106	119.4 Å²	119.4	65%	0.65	68%	0.684	S	S	*	*			trans	42.3	123.7	141.7	53.6	0	0	0	0	122.9
513	N	29.3	Very low	29.2	Very low	128 Å²	128	120.8 Å²	120.8	68%	0.684	68%	0.68	S	S	*	*				113.1	136.7	108.9	-85.5	12.2	0	0	0	121.5
514	N	31.7	Very low	29.6	Very low	121 Å²	121	120.6 Å²	120.6	65%	0.647	68%	0.679	S	S	*	*			trans	73.4	142.3	137.8	-69	8.9	0	0	0	119
515	N	31.6	Very low	29.8	Very low	117 Å²	117	119.6 Å²	119.6	63%	0.626	68%	0.678	S	S	*	*			cis	-168	172	-14	-121.2	-2.1	0	0	0	110.5
516	N	33.7	Very low	30.1	Very low	125 Å²	125	120.2 Å²	120.2	67%	0.668	68%	0.677	S	S	*	*			trans	67.4	154.9	156.6	-64.5	3.8	0	0	0	115.4
517	N	33.7	Very low	30.3	Very low	126 Å²	126	120.3 Å²	120.3	67%	0.674	68%	0.678	S	S	*	*			cis	-157.9	171.4	-11.3	-105.1	-1.2	0	0	0	105.4
518	N	33.6	Very low	30.3	Very low	119 Å²	119	118.1 Å²	118.1	64%	0.636	68%	0.676	S	S	*	*			cis	-166.2	155.1	21.5	-140.6	18.7	0	0	0	110.3
519	T	31.3	Very low	30.5	Very low	102 Å²	102	118.6 Å²	118.6	63%	0.626	68%	0.678	S	S	*	*			trans	43.8	145.8	138.9	57.7	0	0	0	0	122.1
520	N	32.4	Very low	30.7	Very low	127 Å²	127	118.8 Å²	118.8	68%	0.679	68%	0.68	S	S	*	*			cis	-169.5	149.2	28.2	-132	11.4	0	0	0	114.5
521	T	31.5	Very low	30.8	Very low	107 Å²	107	118 Å²	118	66%	0.656	68%	0.675	S	S	*	*			trans	53.1	146	140	57.2	0	0	0	0	122.9
522	T	31.1	Very low	30.8	Very low	104 Å²	104	119.6 Å²	119.6	64%	0.638	68%	0.679	S	S	*	*			cis	-172.5	144.1	-3.8	25.3	0	0	0	0	112.7
523	H	33.3	Very low	30.8	Very low	171 Å²	171	119.9 Å²	119.9	79%	0.792	68%	0.681	S	S	*	*			trans	57.9	161.9	143.4	-63.8	-43.2	0	0	0	120.9
524	T	31.5	Very low	30.5	Very low	110 Å²	110	119 Å²	119	68%	0.675	68%	0.681	S	S	*	*			cis	-156.8	135.8	13.1	-14.8	0	0	0	0	112.9
525	T	30.6	Very low	30.3	Very low	118 Å²	118	121.2 Å²	121.2	72%	0.724	69%	0.686	S	S	*	*			trans	57.2	154.9	143.7	51.6	0	0	0	0	121.8
526	N	31.2	Very low	30	Very low	124 Å²	124	120.6 Å²	120.6	66%	0.663	69%	0.687	S	S	*	*			cis	-157.6	144.2	10.5	-132.6	-0.5	0	0	0	114.6
527	T	28.6	Very low	29.5	Very low	113 Å²	113	120 Å²	120	69%	0.693	69%	0.688	S	S	*	*			trans	54.8	151	147.1	49.4	0	0	0	0	121.2
528	T	29.9	Very low	29.1	Very low	111 Å²	111	121.5 Å²	121.5	68%	0.681	70%	0.696	S	S	*	*			cis	-157	143.6	24.3	-21.6	0	0	0	0	112.8
529	T	28.7	Very low	28.5	Very low	117 Å²	117	121.3 Å²	121.3	72%	0.718	70%	0.699	S	S	*	*			trans	52.1	136.1	145.7	48	0	0	0	0	121.8
530	T	28.6	Very low	28.2	Very low	114 Å²	114	121.8 Å²	121.8	70%	0.699	70%	0.703	S	S	*	*			cis	-167.1	157.1	-0.8	6.6	0	0	0	0	113.1
531	T	28.2	Very low	27.8	Very low	109 Å²	109	121.2 Å²	121.2	67%	0.669	70%	0.704	S	S	*	*			trans	59.9	113.1	151.8	49.9	0	0	0	0	119.6
532	N	27.4	Very low	27.4	Very low	142 Å²	142	122.9 Å²	122.9	76%	0.759	71%	0.707	S	S	*	*				86.1	141.6	73.8	-70.8	7.9	0	0	0	113
533	T	28	Very low	27.2	Very low	112 Å²	112	125 Å²	125	69%	0.687	71%	0.714	S	S	*	*			cis	-161	130.9	-6	13.5	0	0	0	0	111.1
534	T	23.6	Very low	26.7	Very low	111 Å²	111	122.9 Å²	122.9	68%	0.681	71%	0.714	S	S	*	*			trans	25.4	154.3	135.1	61.8	0	0	0	0	123.9
535	H	28.4	Very low	26.6	Very low	166 Å²	166	125 Å²	125	77%	0.769	72%	0.72	S	S	*	*			trans	77.6	141.9	156.2	-73	-67.6	0	0	0	118.5
536	T	24.6	Very low	26.4	Very low	105 Å²	105	127.7 Å²	127.7	64%	0.644	72%	0.723	S	S	*	*			cis	-160.4	158.2	-31.4	-1.8	0	0	0	0	109.3
537	T	23	Very low	26.3	Very low	113 Å²	113	126.7 Å²	126.7	69%	0.693	73%	0.726	S	S	*	*			trans	26.1	118.1	154.5	56.9	0	0	0	0	120
538	N	24.8	Very low	26.1	Very low	157 Å²	157	126.5 Å²	126.5	84%	0.84	73%	0.725	S	S	*	*				-171.6	175.5	107.5	-97.6	-22.5	0	0	0	114.7
539	T	22.6	Very low	26	Very low	114 Å²	114	127.4 Å²	127.4	70%	0.699	73%	0.731	S	S	*	*			trans	-80.7	-177.2	-164.4	52.5	0	0	0	0	115.9
540	T	24.4	Very low	26	Very low	113 Å²	113	127.2 Å²	127.2	69%	0.693	73%	0.73	S	S	*	*			trans	84.2	109.9	144.2	29.9	0	0	0	0	120.1
541	T	23.4	Very low	26	Very low	115 Å²	115	127.1 Å²	127.1	71%	0.706	73%	0.729	S	S	*	*			trans	67	127.6	133.2	52.4	0	0	0	0	121.9
542	I	23.7	Very low	25.9	Very low	142 Å²	142	128.6 Å²	128.6	73%	0.728	73%	0.733	S	S	*	*			trans	58.2	112.9	133.5	-56.1	164.8	0	0	0	116.4
543	D	25.9	Very low	26.1	Very low	148 Å²	148	128.9 Å²	128.9	79%	0.791	73%	0.734	S	S	*	*				-154.3	140.9	117.7	-115.3	-28.6	0	0	0	113.7
544	T	23.6	Very low	26	Very low	127 Å²	127	131 Å²	131	78%	0.779	74%	0.741	S	S	*	*			trans	-100.4	123.7	173.9	43.6	0	0	0	0	110
545	I	29.8	Very low	26.2	Very low	155 Å²	155	133.7 Å²	133.7	80%	0.795	75%	0.746	S	S	*	*			trans	-123.6	129.8	170	-61.7	-176.7	0	0	0	110.1
546	H	25.2	Very low	26.1	Very low	173 Å²	173	131.8 Å²	131.8	80%	0.801	74%	0.741	S	S	*	*			trans	-90.6	138.3	177.2	-93.2	4.8	0	0	0	112.2
547	S	29.3	Very low	26.4	Very low	103 Å²	103	130.9 Å²	130.9	72%	0.72	74%	0.735	S	S	*	*			trans	-171.2	84.1	148.5	52.9	0	0	0	0	108.1
548	T	24.3	Very low	26.9	Very low	110 Å²	110	130.1 Å²	130.1	68%	0.675	73%	0.726	S	S	*	*				52.6	138.5	80	68.1	0	0	0	0	115
549	T	28.2	Very low	27.6	Very low	130 Å²	130	127.6 Å²	127.6	80%	0.798	71%	0.712	S	S	*	*			trans	69.2	135	-173.3	77.3	0	0	0	0	115.4
550	T	29.8	Very low	28.8	Very low	113 Å²	113	125.2 Å²	125.2	69%	0.693	70%	0.7	S	S	*	*			cis	-152.6	132	-5.1	-2.2	0	0	0	0	112.2
551	T	27.2	Very low	30.2	Very low	112 Å²	112	121.4 Å²	121.4	69%	0.687	68%	0.675	S	S	*	*			trans	33.4	100.5	144	55.1	0	0	0	0	120.1
552	N	27.9	Very low	31.5	Very low	140 Å²	140	117 Å²	117	75%	0.749	65%	0.647	S	S	*	*				174.3	154.2	93.7	-87.1	-22.4	0	0	0	114.1
553	N	29.6	Very low	33	Very low	148 Å²	148	111.2 Å²	111.2	79%	0.791	62%	0.618	S	S	*	*			trans	56.6	66.7	162.7	-60.2	8.9	0	0	0	118.2	E555	N553-E555 VanDerWaalsContact C-N 3.33Å; N553-E555 PolarHBondContact O-N 2.87Å; N553-E555 VanDerWaalsContact O-N 3.07Å
554	N	26.2	Very low	34.3	Very low	155 Å²	155	104.7 Å²	104.7	83%	0.829	58%	0.583	S	S	*	*			trans	-76.5	75.6	162.3	-76.2	-17.8	0	0	0	111.8	L556	N554-L556 PolarHBondContact O-N 3.47Å; N554-L556 VanDerWaalsContact O-N 3.13Å
555	E	28.2	Very low	35.5	Very low	168 Å²	168	100 Å²	100	79%	0.785	56%	0.555	S	S	*	*			trans	-79.6	86.4	162.3	-76.4	-161.3	135	0	0	110.3	N553 T557	N553-E555 VanDerWaalsContact C-N 3.33Å; N553-E555 PolarHBondContact O-N 2.87Å; N553-E555 VanDerWaalsContact O-N 3.07Å; E555-T557 PolarHBondContact O-N 2.76Å
556	L	27.4	Very low	36.5	Very low	127 Å²	127	97 Å²	97	67%	0.665	54%	0.54	S	S	*	.			trans	-71.7	69.6	166.7	-91.8	146.2	0	0	0	110.1	N554 L558	N554-L556 PolarHBondContact O-N 3.47Å; N554-L556 VanDerWaalsContact O-N 3.13Å; L556-L558 PolarHBondContact O-N 3.46Å
557	T	30.3	Very low	37.9	Very low	86 Å²	86	96.8 Å²	96.8	53%	0.528	53%	0.532	S	S	.	.			trans	-60.6	118.3	169.7	40.6	0	0	0	0	109.2	E555 I559	E555-T557 PolarHBondContact O-N 2.76Å; T557-I559 WeakPolarHBondContact O-CG1 3.25Å; T557-I559 PolarHBondContact O-N 3.5Å
558	L	33.9	Very low	39.6	Very low	96 Å²	96	92.3 Å²	92.3	50%	0.503	50%	0.501	S	S	.	.			trans	-73.5	58.7	165	-83.4	162.8	0	0	0	109	Q50 L51 L369 L556 S560	Q50-L558 HydrophobicContact CG-CD1 4.36Å; L51-L558 HydrophobicContact CD1-CB 4.34Å; L369-L558 HydrophobicContact CD2-CD1 4.07Å; L369-L558 HydrophobicContact CD2-CD2 3.91Å; L556-L558 PolarHBondContact O-N 3.46Å; L558-S560 PolarHBondContact O-N 2.99Å
559	I	39.2	Very low	41.6	Very low	105 Å²	105	91.2 Å²	91.2	54%	0.538	49%	0.485	S	S	.	.			trans	-67.4	110	-177.4	20.8	177.2	0	0	0	109.3	T557 N561	T557-I559 WeakPolarHBondContact O-CG1 3.25Å; T557-I559 PolarHBondContact O-N 3.5Å; I559-N561 HydrophobicContact CB-CB 4.28Å; I559-N561 WeakPolarHBondContact CB-OD1 3.24Å; I559-N561 WeakPolarHBondContact CG2-OD1 3.25Å; I559-N561 PolarHBondContact O-N 3.2Å
560	S	48.2	Very low	43.9	Very low	63 Å²	63	85.4 Å²	85.4	44%	0.441	45%	0.449	S	S	.	.			trans	-70.4	41.6	174.7	60.2	0	0	0	0	111.7	M418 L558 I562	M418-S560 WeakPolarHBondContact CG-O 3.47Å; L558-S560 PolarHBondContact O-N 2.99Å; S560-I562 VanDerWaalsContact C-N 3.32Å; S560-I562 PolarHBondContact O-N 3.17Å
561	N	53.3	Low	46.1	Very low	34 Å²	34	82.8 Å²	82.8	18%	0.182	43%	0.431	C	S	.	.			trans	-87.4	-2	-163.9	-73.5	23.3	0	0	0	112.9	L417 M418 D420 I559	L417-N561 CarbonylContact C-O 3.56Å; L417-N561 VanDerWaalsContact CA-O 3.29Å; L417-N561 WeakPolarHBondContact CA-O 3.09Å; L417-N561 WeakPolarHBondContact CD1-O 3.06Å; M418-N561 PolarHBondContact N-O 3.12Å; D420-N561 PolarHBondContact OD2-ND2 3.38Å; I559-N561 HydrophobicContact CB-CB 4.28Å; I559-N561 WeakPolarHBondContact CB-OD1 3.24Å; I559-N561 WeakPolarHBondContact CG2-OD1 3.25Å; I559-N561 PolarHBondContact O-N 3.2Å
562	I	50.8	Low	48.6	Very low	23 Å²	23	78.7 Å²	78.7	12%	0.118	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	112.8	172.7	-65.1	169.9	0	0	0	108.8	L374 I378 F383 L415 R416 L417 S560 I564	L374-I562 HydrophobicContact CD2-CB 4.36Å; L374-I562 HydrophobicContact CD2-CD1 3.81Å; I378-I562 HydrophobicContact CG2-CD1 4.34Å; F383-I562 HydrophobicContact CZ-CD1 4.47Å; L415-I562 HydrophobicContact CB-CG2 3.95Å; L415-I562 HydrophobicContact CD2-CG2 3.76Å; L415-I562 HydrophobicContact CG-CG2 4.42Å; R416-I562 WeakPolarHBondContact O-CA 3.02Å; L417-I562 HydrophobicContact CD1-CG1 4.07Å; S560-I562 VanDerWaalsContact C-N 3.32Å; S560-I562 PolarHBondContact O-N 3.17Å; I562-I564 HydrophobicContact CG2-CG1 4.31Å
563	D	53.9	Low	51.4	Low	20 Å²	20	75.9 Å²	75.9	11%	0.107	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	145.6	173.9	-158.8	-11.1	0	0	0	109.1	Y56 H57 L415 R416 M418	Y56-D563 WeakPolarHBondContact CB-OD2 3.45Å; H57-D563 IonicContact CE1-OD1 2.69Å; H57-D563 PolarHBondContact CE1-OD1 2.9Å; H57-D563 IonicContact CE1-OD2 2.82Å; H57-D563 PolarHBondContact CE1-OD2 3.26Å; H57-D563 IonicContact CG-OD2 2.67Å; H57-D563 VanDerWaalsContact ND1-CG 3.34Å; H57-D563 IonicContact ND1-OD1 2.84Å; H57-D563 IonicContact ND1-OD2 3.14Å; H57-D563 PolarHBondContact ND1-OD2 3.19Å; L415-D563 CarbonylContact C-O 3.59Å; L415-D563 WeakPolarHBondContact CA-O 3.3Å; R416-D563 PolarHBondContact N-O 3.13Å; R416-D563 PolarHBondContact O-N 2.82Å; M418-D563 HydrophobicContact CG-CB 4.4Å; M418-D563 HydrophobicContact SD-CB 4.2Å
564	I	55	Low	53.5	Low	10 Å²	10	76.6 Å²	76.6	5%	0.051	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	131.5	-176.6	-63.2	-166.2	0	0	0	110.9	A360 Y361 Q413 R414 L415 I562 L566	A360-I564 HydrophobicContact CB-CD1 3.44Å; A360-I564 VanDerWaalsContact CB-CD1 3.44Å; Y361-I564 HydrophobicContact CD2-CD1 4.41Å; Y361-I564 HydrophobicContact CE2-CB 4.27Å; Y361-I564 HydrophobicContact CE2-CD1 3.53Å; Y361-I564 HydrophobicContact CE2-CG1 4.13Å; Y361-I564 WeakPolarHBondContact OH-CG1 3Å; Q413-I564 HydrophobicContact CB-CG2 4.05Å; R414-I564 WeakPolarHBondContact O-CA 3.27Å; L415-I564 HydrophobicContact CB-CG1 4.35Å; L415-I564 HydrophobicContact CD2-CD1 3.44Å; L415-I564 VanDerWaalsContact CD2-CD1 3.44Å; L415-I564 HydrophobicContact CD2-CG1 3.95Å; L415-I564 HydrophobicContact CG-CD1 3.76Å; L415-I564 HydrophobicContact CG-CG1 3.91Å; I562-I564 HydrophobicContact CG2-CG1 4.31Å; I564-L566 PolarHBondContact O-N 3.12Å
565	S	48.7	Very low	56.2	Low	28 Å²	28	73.3 Å²	73.3	20%	0.196	37%	0.37	C	S	.	.			trans	-49.2	125.4	-177.8	-177.8	0	0	0	0	112.6	R414 W567	R414-S565 PolarHBondContact O-N 3.42Å; S565-W567 WeakPolarHBondContact CB-O 3.33Å; S565-W567 PolarHBondContact O-N 3.39Å; S565-W567 PolarHBondContact OG-N 2.59Å; S565-W567 PolarHBondContact OG-O 2.79Å
566	L	50.1	Low	58.7	Low	94 Å²	94	68.2 Å²	68.2	49%	0.492	35%	0.345	S	S	.	.	S	Bend	trans	-65	-17	174.9	-73.1	169.9	0	0	0	113.3	K357 I564	K357-L566 WeakPolarHBondContact CE-O 3.17Å; K357-L566 PolarHBondContact NZ-O 3.42Å; I564-L566 PolarHBondContact O-N 3.12Å
567	W	54.2	Low	60.8	Low	167 Å²	167	63.8 Å²	63.8	63%	0.633	32%	0.324	S	S	*	.	S	Bend	trans	-117.7	134.9	176.4	-58.9	97.9	0	0	0	110.1	F402 S565	F402-W567 HydrophobicContact CD2-CE3 4.41Å; F402-W567 HydrophobicContact CD2-CZ3 4.35Å; F402-W567 HydrophobicContact CE1-CE3 4.44Å; F402-W567 AromaticContact CE2-CE3 3.72Å; F402-W567 HydrophobicContact CE2-CE3 3.72Å; F402-W567 AromaticContact CE2-CZ3 3.58Å; F402-W567 HydrophobicContact CE2-CZ3 3.58Å; F402-W567 AromaticContact CZ-CE3 3.72Å; F402-W567 HydrophobicContact CZ-CE3 3.72Å; F402-W567 AromaticContact CZ-CZ3 3.98Å; F402-W567 HydrophobicContact CZ-CZ3 3.98Å; S565-W567 WeakPolarHBondContact CB-O 3.33Å; S565-W567 PolarHBondContact O-N 3.39Å; S565-W567 PolarHBondContact OG-N 2.59Å; S565-W567 PolarHBondContact OG-O 2.79Å
568	P	65	Low	62.4	Low	9 Å²	9	61 Å²	61	6%	0.058	31%	0.312	C	S	.	.			trans	-68.7	155.7	169.9	30.9	-32.8	0	0	0	110.7	C395 M399 F402 C411 Y412 Q413	C395-P568 VanDerWaalsContact SG-CB 3.58Å; M399-P568 HydrophobicContact CB-CB 4.34Å; M399-P568 HydrophobicContact CB-CG 4.31Å; F402-P568 HydrophobicContact CB-CG 3.77Å; F402-P568 HydrophobicContact CD1-CG 3.58Å; F402-P568 HydrophobicContact CE1-CG 4.43Å; F402-P568 HydrophobicContact CG-CG 3.89Å; C411-P568 VanDerWaalsContact SG-CB 3.59Å; Y412-P568 CarbonylContact O-C 3.56Å; Y412-P568 WeakPolarHBondContact O-CA 3.42Å; Q413-P568 HydrophobicContact CG-CB 4.5Å
569	Y	67.1	Low	63.8	Low	88 Å²	88	62.6 Å²	62.6	35%	0.345	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	106.5	171.3	172.9	-111.6	0	0	0	108	Y412	Y412-Y569 HydrophobicContact CD2-CD1 4.23Å; Y412-Y569 PolarHBondContact N-O 3.01Å; Y412-Y569 PolarHBondContact O-N 2.7Å
570	C	75.8	Confident	65.5	Low	7 Å²	7	60.1 Å²	60.1	5%	0.047	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	115.3	174.6	-51.5	0	0	0	0	108.8	C403 T408 C572 L579 C581	C403-C570 WeakPolarHBondContact CA-SG 3.2Å; C403-C570 HydrophobicContact CB-CB 3.83Å; C403-C570 WeakPolarHBondContact CB-SG 3.03Å; C403-C570 WeakPolarHBondContact SG-CB 3.22Å; C403-C570 CovalentContact SG-SG 2.03Å; C403-C570 PolarHBondContact SG-SG 3.17Å; T408-C570 HydrophobicContact CG2-CB 3.93Å; C570-C572 PolarHBondContact O-N 2.96Å; C570-L579 PolarHBondContact SG-O 3.22Å; C570-C581 VanDerWaalsContact CB-SG 3.5Å
571	L	76.8	Confident	67	Low	59 Å²	59	57.1 Å²	57.1	31%	0.309	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	102.1	170.8	177.9	66.3	0	0	0	108	I409 K410 Y412	I409-L571 HydrophobicContact CB-CD2 4.22Å; I409-L571 HydrophobicContact CB-CG 4.26Å; I409-L571 WeakPolarHBondContact CB-O 3.47Å; I409-L571 HydrophobicContact CD1-CG 4.45Å; I409-L571 HydrophobicContact CG2-CD2 4.28Å; I409-L571 PolarHBondContact N-O 2.99Å; K410-L571 WeakPolarHBondContact O-CB 3.25Å; K410-L571 PolarHBondContact O-N 3.29Å; Y412-L571 HydrophobicContact CD2-CB 4.48Å; Y412-L571 HydrophobicContact CE2-CB 4.22Å; Y412-L571 HydrophobicContact CE2-CD2 4.2Å
572	C	80.2	Confident	68.4	Low	26 Å²	26	58.1 Å²	58.1	18%	0.176	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	155.4	-176.1	-51.5	0	0	0	0	112.9	I409 C570 F576 C581	I409-C572 WeakPolarHBondContact CD1-O 3.36Å; C570-C572 PolarHBondContact O-N 2.96Å; C572-F576 HydrophobicContact CB-CB 4.25Å; C572-F576 WeakPolarHBondContact CB-O 3.41Å; C572-C581 WeakPolarHBondContact CA-SG 3.39Å; C572-C581 HydrophobicContact CB-CB 3.77Å; C572-C581 WeakPolarHBondContact CB-SG 3.2Å; C572-C581 WeakPolarHBondContact SG-CA 3.41Å; C572-C581 WeakPolarHBondContact SG-CB 3.44Å; C572-C581 CovalentContact SG-SG 2.04Å; C572-C581 PolarHBondContact SG-SG 3.22Å
573	H	85.7	Confident	69.7	Low	81 Å²	81	60.5 Å²	60.5	38%	0.375	31%	0.309	S	S	.	.			trans	-63.6	154	159.7	-70.5	73.9	0	0	0	109.2	N407 T408 N575 F576	N407-H573 PolarHBondContact O-N 2.82Å; N407-H573 PolarHBondContact O-ND1 3.41Å; T408-H573 PolarHBondContact N-ND1 3.49Å; H573-N575 PolarHBondContact O-N 2.77Å; H573-F576 PolarHBondContact O-N 3.07Å
574	Q	74.6	Confident	71.1	Confident	163 Å²	163	63.9 Å²	63.9	76%	0.762	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.4	-29.4	-176.3	-67.3	172.9	-24.7	0	0	113.8	F576 F651	Q574-F576 VanDerWaalsContact C-N 3.33Å; Q574-F576 PolarHBondContact O-N 3.3Å; Q574-F651 WeakPolarHBondContact O-CD1 3.2Å; Q574-F651 WeakPolarHBondContact O-CE1 3.06Å
575	N	81.3	Confident	72.4	Confident	85 Å²	85	65.5 Å²	65.5	46%	0.455	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-10.1	-179.8	-61.1	52.7	0	0	0	115.6	H573 F585 F651	H573-N575 PolarHBondContact O-N 2.77Å; N575-F585 PolarHBondContact O-N 2.88Å; N575-F651 HydrophobicContact CB-CE1 4.37Å; N575-F651 HydrophobicContact CB-CZ 3.91Å; N575-F651 VanDerWaalsContact CG-CZ 3.43Å
576	F	81.4	Confident	74.3	Confident	61 Å²	61	66 Å²	66	27%	0.268	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	157.6	-167.6	-62.7	-76.5	0	0	0	113.7	N407 C572 H573 Q574 C581 I583 P584	N407-F576 HydrophobicContact CB-CB 4.2Å; N407-F576 HydrophobicContact CB-CD1 4.45Å; N407-F576 HydrophobicContact CB-CD2 3.65Å; N407-F576 HydrophobicContact CB-CE2 4.12Å; N407-F576 HydrophobicContact CB-CG 3.84Å; N407-F576 VanDerWaalsContact CG-CD2 3.49Å; N407-F576 VanDerWaalsContact CG-CE2 3.48Å; N407-F576 WeakPolarHBondContact ND2-CD1 3.2Å; N407-F576 WeakPolarHBondContact ND2-CE1 3.25Å; N407-F576 WeakPolarHBondContact ND2-CG 3.13Å; N407-F576 WeakPolarHBondContact ND2-CZ 3.43Å; N407-F576 WeakPolarHBondContact OD1-CE2 3.26Å; C572-F576 HydrophobicContact CB-CB 4.25Å; C572-F576 WeakPolarHBondContact CB-O 3.41Å; H573-F576 PolarHBondContact O-N 3.07Å; Q574-F576 VanDerWaalsContact C-N 3.33Å; Q574-F576 PolarHBondContact O-N 3.3Å; F576-C581 HydrophobicContact CB-CB 4.3Å; F576-I583 CarbonylContact C-O 3.53Å; F576-I583 VanDerWaalsContact CA-O 3.29Å; F576-I583 WeakPolarHBondContact CA-O 3.28Å; F576-P584 HydrophobicContact CE1-CG 4.49Å
577	T	72.3	Confident	76	Confident	35 Å²	35	61.5 Å²	61.5	22%	0.215	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	-172.2	-175.6	-170.7	0	0	0	0	110.1	C581 I583 F585 H590	T577-C581 CarbonylContact O-C 3.6Å; T577-C581 VanDerWaalsContact O-CA 3.3Å; T577-C581 WeakPolarHBondContact O-CA 3.45Å; T577-I583 HydrophobicContact CG2-CB 4.06Å; T577-I583 HydrophobicContact CG2-CG2 4.15Å; T577-I583 PolarHBondContact N-O 3.36Å; T577-I583 WeakPolarHBondContact O-CB 3.28Å; T577-I583 PolarHBondContact O-N 2.97Å; T577-I583 VanDerWaalsContact O-N 3.13Å; T577-F585 HydrophobicContact CG2-CB 4.16Å; T577-F585 HydrophobicContact CG2-CD2 4.19Å; T577-H590 WeakPolarHBondContact CG2-CD2 3.48Å; T577-H590 WeakPolarHBondContact CG2-NE2 3.48Å
578	G	63.5	Low	77.7	Confident	27 Å²	27	53.8 Å²	53.8	28%	0.278	29%	0.287	S	S	.	.	S	Bend	trans	84.8	169.3	-167.5	0	0	0	0	0	112.3	D580 C581	G578-D580 PolarHBondContact O-N 3.36Å; G578-C581 PolarHBondContact O-N 2.85Å
579	L	63.3	Low	78.6	Confident	129 Å²	129	57.2 Å²	57.2	68%	0.675	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-26.3	-175.2	-77.5	160.7	0	0	0	113.7	F402 C570	F402-L579 HydrophobicContact CE1-CB 4.01Å; F402-L579 WeakPolarHBondContact CE1-O 3.28Å; F402-L579 HydrophobicContact CZ-CB 4.08Å; C570-L579 PolarHBondContact SG-O 3.22Å
580	D	73.7	Confident	79.1	Confident	54 Å²	54	55 Å²	55	29%	0.289	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	2.8	-173.2	60.8	-6.1	0	0	0	113.4	F402 Q404 G578 S582	F402-D580 WeakPolarHBondContact O-CA 3.24Å; F402-D580 WeakPolarHBondContact O-CB 3.43Å; Q404-D580 WeakPolarHBondContact CB-O 3.4Å; Q404-D580 PolarHBondContact N-O 3.3Å; G578-D580 PolarHBondContact O-N 3.36Å; D580-S582 PolarHBondContact O-N 3.17Å; D580-S582 VanDerWaalsContact OD1-CB 3.22Å; D580-S582 WeakPolarHBondContact OD1-CB 3.17Å; D580-S582 PolarHBondContact OD1-N 2.86Å; D580-S582 PolarHBondContact OD1-OG 2.92Å; D580-S582 WeakPolarHBondContact OD2-CB 3.4Å; D580-S582 PolarHBondContact OD2-OG 2.86Å; D580-S582 VanDerWaalsContact OD2-OG 3.08Å
581	C	80.4	Confident	78.9	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.311	C	S	.	.	S	Bend	trans	60.3	25.5	-170.9	-49.4	0	0	0	0	115	Q404 N407 C570 C572 F576 T577 G578	Q404-C581 HydrophobicContact CB-CB 4.48Å; N407-C581 HydrophobicContact CB-CB 3.96Å; N407-C581 VanDerWaalsContact CB-O 3.29Å; N407-C581 WeakPolarHBondContact CB-O 3.13Å; N407-C581 PolarHBondContact ND2-O 3.34Å; C570-C581 VanDerWaalsContact CB-SG 3.5Å; C572-C581 WeakPolarHBondContact CA-SG 3.39Å; C572-C581 HydrophobicContact CB-CB 3.77Å; C572-C581 WeakPolarHBondContact CB-SG 3.2Å; C572-C581 WeakPolarHBondContact SG-CA 3.41Å; C572-C581 WeakPolarHBondContact SG-CB 3.44Å; C572-C581 CovalentContact SG-SG 2.04Å; C572-C581 PolarHBondContact SG-SG 3.22Å; F576-C581 HydrophobicContact CB-CB 4.3Å; T577-C581 CarbonylContact O-C 3.6Å; T577-C581 VanDerWaalsContact O-CA 3.3Å; T577-C581 WeakPolarHBondContact O-CA 3.45Å; G578-C581 PolarHBondContact O-N 2.85Å
582	S	81.9	Confident	78.9	Confident	54 Å²	54	56.2 Å²	56.2	38%	0.378	30%	0.303	S	S	.	.			trans	-80.1	-26.6	175.5	65	0	0	0	0	114.1	D580	D580-S582 PolarHBondContact O-N 3.17Å; D580-S582 VanDerWaalsContact OD1-CB 3.22Å; D580-S582 WeakPolarHBondContact OD1-CB 3.17Å; D580-S582 PolarHBondContact OD1-N 2.86Å; D580-S582 PolarHBondContact OD1-OG 2.92Å; D580-S582 WeakPolarHBondContact OD2-CB 3.4Å; D580-S582 PolarHBondContact OD2-OG 2.86Å; D580-S582 VanDerWaalsContact OD2-OG 3.08Å
583	I	78.9	Confident	78.4	Confident	73 Å²	73	61.7 Å²	61.7	37%	0.374	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	128.4	-171.3	-50.8	179	0	0	0	109.4	F576 T577 F585	F576-I583 CarbonylContact C-O 3.53Å; F576-I583 VanDerWaalsContact CA-O 3.29Å; F576-I583 WeakPolarHBondContact CA-O 3.28Å; T577-I583 HydrophobicContact CG2-CB 4.06Å; T577-I583 HydrophobicContact CG2-CG2 4.15Å; T577-I583 PolarHBondContact N-O 3.36Å; T577-I583 WeakPolarHBondContact O-CB 3.28Å; T577-I583 PolarHBondContact O-N 2.97Å; T577-I583 VanDerWaalsContact O-N 3.13Å; I583-F585 PolarHBondContact O-N 3.4Å
584	P	83.8	Confident	77.5	Confident	91 Å²	91	62.2 Å²	62.2	59%	0.591	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.5	132.7	169.1	-21.1	33.6	0	0	0	110.9	F576 N586	F576-P584 HydrophobicContact CE1-CG 4.49Å; P584-N586 PolarHBondContact O-N 3.44Å
585	F	82.3	Confident	77.5	Confident	45 Å²	45	54.9 Å²	54.9	20%	0.197	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-69.4	116.3	-178.8	177.9	-92.4	0	0	0	111.4	N575 T577 I583 P587 H590 I592 F651	N575-F585 PolarHBondContact O-N 2.88Å; T577-F585 HydrophobicContact CG2-CB 4.16Å; T577-F585 HydrophobicContact CG2-CD2 4.19Å; I583-F585 PolarHBondContact O-N 3.4Å; F585-P587 HydrophobicContact CE1-CB 3.77Å; F585-P587 HydrophobicContact CE1-CG 4.24Å; F585-P587 HydrophobicContact CZ-CB 4.22Å; F585-H590 HydrophobicContact CD2-CB 3.96Å; F585-H590 HydrophobicContact CE2-CB 3.78Å; F585-I592 HydrophobicContact CZ-CG1 4.31Å; F585-F651 HydrophobicContact CB-CE1 4.41Å; F585-F651 AromaticContact CD1-CD1 3.8Å; F585-F651 HydrophobicContact CD1-CD1 3.8Å; F585-F651 HydrophobicContact CD1-CE1 4.2Å; F585-F651 HydrophobicContact CE1-CD1 4.39Å
586	N	87.1	Confident	76.9	Confident	37 Å²	37	51.4 Å²	51.4	20%	0.198	28%	0.28	C	S	.	.			trans	-105.7	113.7	166.4	-179.3	2.4	0	0	0	109.7	P584 C588 D589 H590 S648	P584-N586 PolarHBondContact O-N 3.44Å; N586-C588 PolarHBondContact O-N 3.45Å; N586-C588 PolarHBondContact OD1-N 3.18Å; N586-D589 PolarHBondContact ND2-OD2 2.84Å; N586-D589 PolarHBondContact O-N 3.28Å; N586-H590 PolarHBondContact N-ND1 2.85Å; N586-H590 WeakPolarHBondContact O-CB 2.99Å; N586-H590 PolarHBondContact O-N 3.32Å; N586-H590 PolarHBondContact O-ND1 2.82Å; N586-S648 WeakPolarHBondContact OD1-CB 3.35Å; N586-S648 PolarHBondContact OD1-OG 3.32Å
587	P	87.1	Confident	76.2	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-21.5	178.3	22.2	-32.1	0	0	0	114.8	F585 I592 G633 G650 Q652 Y653	F585-P587 HydrophobicContact CE1-CB 3.77Å; F585-P587 HydrophobicContact CE1-CG 4.24Å; F585-P587 HydrophobicContact CZ-CB 4.22Å; P587-I592 HydrophobicContact CB-CD1 3.87Å; P587-I592 HydrophobicContact CB-CG1 4.32Å; P587-G633 WeakPolarHBondContact O-CA 3.2Å; P587-G633 PolarHBondContact O-N 2.93Å; P587-G650 WeakPolarHBondContact CD-O 3.3Å; P587-G650 WeakPolarHBondContact CG-O 3.35Å; P587-Q652 WeakPolarHBondContact CG-O 3.06Å; P587-Y653 HydrophobicContact CB-CD1 3.98Å; P587-Y653 HydrophobicContact CB-CG 4.39Å
588	C	89.9	Confident	75.4	Confident	5 Å²	5	56.6 Å²	56.6	3%	0.034	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-41	174.6	-70	0	0	0	0	112.1	N586 T632 G633 N634 C646	N586-C588 PolarHBondContact O-N 3.45Å; N586-C588 PolarHBondContact OD1-N 3.18Å; C588-T632 WeakPolarHBondContact O-CB 3.19Å; C588-G633 PolarHBondContact O-N 3.45Å; C588-N634 WeakPolarHBondContact O-CB 3.41Å; C588-N634 PolarHBondContact O-N 3.22Å; C588-N634 PolarHBondContact O-ND2 3.4Å; C588-N634 VanDerWaalsContact O-ND2 3.12Å; C588-C646 WeakPolarHBondContact CA-SG 3.25Å; C588-C646 HydrophobicContact CB-CB 3.86Å; C588-C646 WeakPolarHBondContact CB-SG 3.43Å; C588-C646 VanDerWaalsContact SG-C 3.56Å; C588-C646 WeakPolarHBondContact SG-CB 3.47Å; C588-C646 CovalentContact SG-SG 2.04Å; C588-C646 PolarHBondContact SG-SG 3.08Å
589	D	83.3	Confident	74.5	Confident	81 Å²	81	58.5 Å²	58.5	43%	0.433	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-19.1	-171.2	-47.1	-34.4	0	0	0	113.3	N586 N634	N586-D589 PolarHBondContact ND2-OD2 2.84Å; N586-D589 PolarHBondContact O-N 3.28Å; D589-N634 PolarHBondContact OD1-ND2 3.32Å
590	H	77.2	Confident	73.4	Confident	42 Å²	42	60.4 Å²	60.4	19%	0.194	31%	0.314	C	S	.	.	S	Bend	trans	-109.1	147.7	-175.1	-58.1	86.8	0	0	0	111.9	T577 F585 N586 I592	T577-H590 WeakPolarHBondContact CG2-CD2 3.48Å; T577-H590 WeakPolarHBondContact CG2-NE2 3.48Å; F585-H590 HydrophobicContact CD2-CB 3.96Å; F585-H590 HydrophobicContact CE2-CB 3.78Å; N586-H590 PolarHBondContact N-ND1 2.85Å; N586-H590 WeakPolarHBondContact O-CB 2.99Å; N586-H590 PolarHBondContact O-N 3.32Å; N586-H590 PolarHBondContact O-ND1 2.82Å; H590-I592 PolarHBondContact O-N 3.17Å
591	L	73	Confident	71.7	Confident	62 Å²	62	62.7 Å²	62.7	33%	0.325	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-62	118.2	178.3	-75.2	163.5	0	0	0	111.2	L616 T632	L591-L616 HydrophobicContact CD1-CD1 3.88Å; L591-L616 HydrophobicContact CD1-CG 4.43Å; L591-T632 HydrophobicContact CD2-CG2 4.23Å; L591-T632 HydrophobicContact CG-CG2 4.33Å
592	I	75.3	Confident	70	Confident	30 Å²	30	63.9 Å²	63.9	15%	0.154	33%	0.332	C	S	.	.	B	Isolated β-bridge	trans	-89.2	127.4	168.8	-39.9	175.8	0	0	0	107.2	F585 P587 H590 V595 S630 A631 Y653	F585-I592 HydrophobicContact CZ-CG1 4.31Å; P587-I592 HydrophobicContact CB-CD1 3.87Å; P587-I592 HydrophobicContact CB-CG1 4.32Å; H590-I592 PolarHBondContact O-N 3.17Å; I592-V595 HydrophobicContact CB-CG1 3.59Å; I592-V595 HydrophobicContact CB-CG2 4.49Å; I592-V595 HydrophobicContact CG2-CG1 3.38Å; I592-V595 WeakPolarHBondContact O-CG2 3.27Å; I592-S630 VanDerWaalsContact O-CA 3.25Å; I592-S630 WeakPolarHBondContact O-CA 3.39Å; I592-S630 WeakPolarHBondContact O-CB 3.47Å; I592-A631 PolarHBondContact N-O 3.22Å; I592-A631 PolarHBondContact O-N 3.14Å; I592-A631 VanDerWaalsContact O-N 3.13Å; I592-Y653 HydrophobicContact CD1-CD1 3.6Å; I592-Y653 HydrophobicContact CD1-CE1 3.35Å
593	Q	70.8	Confident	67.7	Low	140 Å²	140	69.2 Å²	69.2	65%	0.654	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	148.4	-178.2	-68.8	-175.5	-40.1	0	0	112.2	V595	Q593-V595 PolarHBondContact O-N 3.27Å; Q593-V595 VanDerWaalsContact O-N 3.15Å
594	N	67.3	Low	65.6	Low	93 Å²	93	70.3 Å²	70.3	50%	0.497	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	35.4	172.8	-62.5	9.8	0	0	0	114.7	K629	N594-K629 CarbonylContact C-O 3.48Å; N594-K629 WeakPolarHBondContact CA-O 3.45Å; N594-K629 PolarHBondContact N-O 3.3Å
595	V	74.2	Confident	63.1	Low	8 Å²	8	69.6 Å²	69.6	5%	0.048	35%	0.347	C	S	.	.			trans	-88	-25.4	177	-65.2	0	0	0	0	113.2	I592 Q593 K629 A631 L636 S668 Q670	I592-V595 HydrophobicContact CB-CG1 3.59Å; I592-V595 HydrophobicContact CB-CG2 4.49Å; I592-V595 HydrophobicContact CG2-CG1 3.38Å; I592-V595 WeakPolarHBondContact O-CG2 3.27Å; Q593-V595 PolarHBondContact O-N 3.27Å; Q593-V595 VanDerWaalsContact O-N 3.15Å; V595-K629 PolarHBondContact N-O 3.4Å; V595-A631 HydrophobicContact CG2-CB 3.91Å; V595-L636 HydrophobicContact CB-CD1 4.3Å; V595-L636 HydrophobicContact CG2-CD1 3.94Å; V595-S668 WeakPolarHBondContact O-CA 3.24Å; V595-S668 WeakPolarHBondContact O-CB 3.38Å; V595-S668 PolarHBondContact O-OG 3.27Å; V595-Q670 HydrophobicContact CB-CG 4.11Å; V595-Q670 HydrophobicContact CG1-CG 3.7Å
596	L	68.1	Low	60.6	Low	13 Å²	13	74.9 Å²	74.9	7%	0.068	37%	0.372	C	S	.	.			trans	-88	131.7	-179.8	-51.3	-176	0	0	0	110.3	L602 K629 A631 W635 L636 Y667	L596-L602 HydrophobicContact CD1-CD1 4.07Å; L596-K629 HydrophobicContact CB-CB 4.2Å; L596-K629 PolarHBondContact N-O 2.85Å; L596-K629 VanDerWaalsContact N-O 3.09Å; L596-K629 WeakPolarHBondContact O-CB 3.29Å; L596-K629 VanDerWaalsContact O-CD 3.3Å; L596-K629 WeakPolarHBondContact O-CD 3.48Å; L596-A631 HydrophobicContact CD1-CB 4.31Å; L596-A631 HydrophobicContact CD2-CB 3.87Å; L596-A631 HydrophobicContact CG-CB 4.23Å; L596-W635 HydrophobicContact CD1-CH2 4.18Å; L596-W635 HydrophobicContact CD1-CZ3 4.17Å; L596-W635 HydrophobicContact CD2-CH2 4.32Å; L596-W635 HydrophobicContact CD2-CZ3 3.63Å; L596-L636 HydrophobicContact CD2-CD2 3.83Å; L596-Y667 HydrophobicContact CD2-CE1 4.49Å
597	M	66.9	Low	57.8	Low	85 Å²	85	80.7 Å²	80.7	42%	0.419	40%	0.402	S	S	.	.	S	Bend	trans	-76.3	-36.4	177.2	-72.2	-164.3	168.5	0	0	112.9	Y667 D669	M597-Y667 PolarHBondContact N-O 3.16Å; M597-D669 HydrophobicContact CE-CB 4.5Å; M597-D669 WeakPolarHBondContact CE-OD1 3.43Å; M597-D669 VanDerWaalsContact CE-OD2 3.23Å; M597-D669 WeakPolarHBondContact CE-OD2 3.5Å
598	K	55.2	Low	55.2	Low	120 Å²	120	86.1 Å²	86.1	52%	0.522	44%	0.435	S	S	.	.			trans	-126.8	126.8	-171.7	-65.2	174.9	-176.6	168.5	0	111.3	Q600	K598-Q600 VanDerWaalsContact C-N 3.35Å; K598-Q600 PolarHBondContact O-N 3.03Å
599	P	45.4	Very low	52.3	Low	66 Å²	66	93.6 Å²	93.6	43%	0.429	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-78.2	-16.3	-179	30	-33.7	0	0	0	114.1	I601	P599-I601 PolarHBondContact O-N 3.18Å
600	Q	40.4	Very low	50.1	Low	169 Å²	169	96.3 Å²	96.3	79%	0.79	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-80.9	-5.2	-160.5	-61.7	177.7	-9.7	0	0	115.6	K598	K598-Q600 VanDerWaalsContact C-N 3.35Å; K598-Q600 PolarHBondContact O-N 3.03Å
601	I	37.6	Very low	48.1	Very low	102 Å²	102	99.8 Å²	99.8	52%	0.523	50%	0.504	S	S	.	.	G	3₁₀ helix	trans	-86.8	-14.5	-171.4	-58.1	174.3	0	0	0	112.4	P599 M603 Y667	P599-I601 PolarHBondContact O-N 3.18Å; I601-M603 VanDerWaalsContact C-N 3.33Å; I601-M603 PolarHBondContact O-N 3.37Å; I601-Y667 HydrophobicContact CD1-CD2 4.22Å; I601-Y667 HydrophobicContact CD1-CE2 4.2Å; I601-Y667 HydrophobicContact CG2-CE2 4.38Å
602	L	43.9	Very low	46.2	Very low	26 Å²	26	104.3 Å²	104.3	14%	0.136	53%	0.527	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	8.9	-167.3	-88.9	143	0	0	0	116.5	L596 P615 I617 W635	L596-L602 HydrophobicContact CD1-CD1 4.07Å; L602-P615 HydrophobicContact CD1-CB 4.07Å; L602-P615 HydrophobicContact CD1-CG 4.47Å; L602-P615 HydrophobicContact CD2-CB 4.14Å; L602-P615 HydrophobicContact CD2-CG 4.11Å; L602-I617 HydrophobicContact CB-CD1 3.53Å; L602-I617 HydrophobicContact CD1-CD1 3.68Å; L602-I617 HydrophobicContact CD1-CG1 4.28Å; L602-I617 HydrophobicContact CG-CD1 4.08Å; L602-W635 HydrophobicContact CD2-CH2 4.47Å; L602-W635 HydrophobicContact CD2-CZ2 3.87Å; L602-W635 HydrophobicContact CG-CZ2 4.43Å
603	M	34.5	Very low	44.5	Very low	166 Å²	166	106.1 Å²	106.1	82%	0.818	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-13.2	-174.1	-73	-165	73.5	0	0	116.1	I601	I601-M603 VanDerWaalsContact C-N 3.33Å; I601-M603 PolarHBondContact O-N 3.37Å
604	H	34.4	Very low	43.3	Very low	95 Å²	95	104.9 Å²	104.9	44%	0.44	53%	0.526	S	S	.	.	S	Bend	trans	-88	-17.8	-177	-106.8	107.7	0	0	0	115.7	Q606	H604-Q606 PolarHBondContact O-N 2.88Å; H604-Q606 VanDerWaalsContact O-N 3.12Å
605	N	31.3	Very low	42.1	Very low	76 Å²	76	100.6 Å²	100.6	41%	0.406	50%	0.504	S	S	.	.			trans	-89.9	76.5	178.5	-72.3	19.2	0	0	0	111.2	R614	N605-R614 PolarHBondContact O-NH2 3.36Å
606	Q	29.4	Very low	40.5	Very low	157 Å²	157	105.5 Å²	105.5	73%	0.734	53%	0.529	S	S	*	.			trans	-78.1	136.2	173.1	-68.8	-169.6	-8.4	0	0	112.2	H604 V608	H604-Q606 PolarHBondContact O-N 2.88Å; H604-Q606 VanDerWaalsContact O-N 3.12Å; Q606-V608 PolarHBondContact O-N 2.9Å
607	L	27.9	Very low	39.2	Very low	158 Å²	158	107.4 Å²	107.4	83%	0.827	54%	0.539	S	S	*	.			trans	57.3	48.5	149.8	-59.1	172.2	0	0	0	119
608	V	32.5	Very low	37.6	Very low	114 Å²	114	105.8 Å²	105.8	69%	0.691	54%	0.536	S	S	*	.			trans	-89.6	118.4	146.3	-177.7	0	0	0	0	108.4	Q606 D611	Q606-V608 PolarHBondContact O-N 2.9Å; V608-D611 WeakPolarHBondContact CG1-OD2 3.48Å
609	H	30.8	Very low	36.6	Very low	162 Å²	162	108.8 Å²	108.8	75%	0.75	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	125.1	-177.9	-141.8	-66.3	0	0	0	110
610	N	35.1	Very low	36	Very low	139 Å²	139	112 Å²	112	74%	0.743	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	94.6	5.9	170.9	-42.3	-37.7	0	0	0	119.2
611	D	35.7	Very low	35.7	Very low	114 Å²	114	111.9 Å²	111.9	61%	0.61	57%	0.567	S	S	*	*			trans	-70.1	135.2	173.3	-87.1	-37	0	0	0	113.1	V608	V608-D611 WeakPolarHBondContact CG1-OD2 3.48Å
612	I	34.6	Very low	35.6	Very low	157 Å²	157	109.7 Å²	109.7	81%	0.805	57%	0.57	S	S	*	*	S	Bend	trans	-88.5	-23.4	-175.5	-65.5	173.1	0	0	0	111.7	R614	I612-R614 VanDerWaalsContact C-N 3.3Å; I612-R614 PolarHBondContact O-N 3.48Å
613	D	39	Very low	35.2	Very low	69 Å²	69	116.4 Å²	116.4	37%	0.369	61%	0.607	S	S	.	*	S	Bend	trans	-84.9	6.6	-168.1	-59.7	-18.4	0	0	0	114.6
614	R	45.2	Very low	35.6	Very low	113 Å²	113	117.7 Å²	117.7	43%	0.426	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-76.8	137.4	-170.8	-158.6	179.2	-162.6	-90.9	5.5	112	N605 I612 L616	N605-R614 PolarHBondContact O-NH2 3.36Å; I612-R614 VanDerWaalsContact C-N 3.3Å; I612-R614 PolarHBondContact O-N 3.48Å; R614-L616 PolarHBondContact O-N 2.83Å; R614-L616 VanDerWaalsContact O-N 3.14Å
615	P	41.4	Very low	36	Very low	4 Å²	4	117.4 Å²	117.4	3%	0.026	61%	0.612	C	S	.	*	P	Polyproline II helix	trans	-47	119.4	159.7	-32.9	39.5	0	0	0	112.1	L602 S630 A631 W635	L602-P615 HydrophobicContact CD1-CB 4.07Å; L602-P615 HydrophobicContact CD1-CG 4.47Å; L602-P615 HydrophobicContact CD2-CB 4.14Å; L602-P615 HydrophobicContact CD2-CG 4.11Å; P615-S630 WeakPolarHBondContact CA-O 3.43Å; P615-S630 VanDerWaalsContact CB-O 3.25Å; P615-S630 WeakPolarHBondContact CB-O 3.24Å; P615-A631 HydrophobicContact CG-CB 4.17Å; P615-W635 HydrophobicContact CG-CD2 4.02Å; P615-W635 HydrophobicContact CG-CE3 4.31Å; P615-W635 HydrophobicContact CG-CH2 4.07Å; P615-W635 HydrophobicContact CG-CZ2 3.82Å; P615-W635 HydrophobicContact CG-CZ3 4.33Å
616	L	40.2	Very low	36.7	Very low	111 Å²	111	118.5 Å²	118.5	58%	0.581	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-73.1	124.8	166	-79.8	163.5	0	0	0	108.1	L591 R614 L628	L591-L616 HydrophobicContact CD1-CD1 3.88Å; L591-L616 HydrophobicContact CD1-CG 4.43Å; R614-L616 PolarHBondContact O-N 2.83Å; R614-L616 VanDerWaalsContact O-N 3.14Å; L616-L628 HydrophobicContact CB-CD2 3.98Å
617	I	41.2	Very low	37.5	Very low	53 Å²	53	114.1 Å²	114.1	27%	0.272	60%	0.599	S	S	.	*			trans	-122.4	139.9	169.1	-44.5	173.5	0	0	0	106.9	L602	L602-I617 HydrophobicContact CB-CD1 3.53Å; L602-I617 HydrophobicContact CD1-CD1 3.68Å; L602-I617 HydrophobicContact CD1-CG1 4.28Å; L602-I617 HydrophobicContact CG-CD1 4.08Å
618	S	33.7	Very low	38.7	Very low	51 Å²	51	109.2 Å²	109.2	36%	0.357	57%	0.574	S	S	.	*			trans	-86	127.1	171	44	0	0	0	0	110.2	D620	S618-D620 PolarHBondContact O-N 3.38Å; S618-D620 VanDerWaalsContact O-N 3.15Å
619	F	33.8	Very low	40.1	Very low	183 Å²	183	106.6 Å²	106.6	80%	0.803	55%	0.553	S	S	*	*			trans	-83.3	38.9	168.4	-59.4	-83.5	0	0	0	111.6
620	D	34.3	Very low	41.7	Very low	134 Å²	134	99.4 Å²	99.4	72%	0.717	52%	0.521	S	S	*	.			trans	-98.8	98.2	167.9	-83.6	-60.1	0	0	0	106.1	S618 G622	S618-D620 PolarHBondContact O-N 3.38Å; S618-D620 VanDerWaalsContact O-N 3.15Å; D620-G622 PolarHBondContact O-N 3.42Å
621	D	34.1	Very low	43.5	Very low	165 Å²	165	92.8 Å²	92.8	88%	0.882	49%	0.486	S	S	*	.			trans	-73.5	47.7	-178	-57.7	-54.4	0	0	0	112.3
622	G	35.3	Very low	45.8	Very low	57 Å²	57	87.5 Å²	87.5	59%	0.588	46%	0.457	S	S	*	.			trans	-110.3	112.5	176.6	0	0	0	0	0	110.9	D620 E624	D620-G622 PolarHBondContact O-N 3.42Å; G622-E624 PolarHBondContact O-N 2.83Å
623	D	35.2	Very low	48.2	Very low	167 Å²	167	80 Å²	80	89%	0.893	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	102.9	171.3	-61.7	-66.2	0	0	0	110.6
624	E	42.6	Very low	50.5	Low	193 Å²	193	78.2 Å²	78.2	90%	0.902	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	170.7	-23	145.4	-96.9	171.3	-174.6	0	0	114.3	G622 D626	G622-E624 PolarHBondContact O-N 2.83Å; E624-D626 PolarHBondContact O-N 3.46Å
625	D	42.7	Very low	52.3	Low	89 Å²	89	73.9 Å²	73.9	48%	0.476	39%	0.393	S	S	.	.			trans	-82.8	109.6	-174.7	-82.2	-23.6	0	0	0	113.4	S389 D627	S389-D625 WeakPolarHBondContact CB-OD2 3.46Å; S389-D625 PolarHBondContact OG-OD1 2.85Å; S389-D625 PolarHBondContact OG-OD2 3.31Å; D625-D627 PolarHBondContact O-N 3.24Å
626	D	46	Very low	54.5	Low	98 Å²	98	73.7 Å²	73.7	52%	0.524	39%	0.392	S	S	.	.			trans	-75.9	22.5	-170.1	-156.2	15.4	0	0	0	115.6	E624 K629	E624-D626 PolarHBondContact O-N 3.46Å; D626-K629 IonicContact OD1-NZ 3.57Å; D626-K629 PolarHBondContact OD1-NZ 3.05Å
627	D	46.7	Very low	56.9	Low	65 Å²	65	68.4 Å²	68.4	35%	0.348	36%	0.364	S	S	.	.			trans	-99.9	-10.4	-145.9	-97.3	-84.9	0	0	0	117.6	K390 D625	K390-D627 IonicContact NZ-OD1 2.68Å; K390-D627 PolarHBondContact NZ-OD1 2.82Å; K390-D627 IonicContact NZ-OD2 3.96Å; K390-D627 PolarHBondContact NZ-OD2 3.49Å; D625-D627 PolarHBondContact O-N 3.24Å
628	L	51.9	Low	58.9	Low	56 Å²	56	65.9 Å²	65.9	29%	0.293	35%	0.351	S	S	.	.			trans	-131.8	53.7	-170.9	-75.9	97.6	0	0	0	114.1	L616	L616-L628 HydrophobicContact CB-CD2 3.98Å
629	K	61.8	Low	61.2	Low	59 Å²	59	66 Å²	66	26%	0.257	35%	0.35	S	S	.	.			trans	-106.4	48.8	170.5	-62.5	-179.5	-166.3	149.1	0	112.4	N594 V595 L596 D626	N594-K629 CarbonylContact C-O 3.48Å; N594-K629 WeakPolarHBondContact CA-O 3.45Å; N594-K629 PolarHBondContact N-O 3.3Å; V595-K629 PolarHBondContact N-O 3.4Å; L596-K629 HydrophobicContact CB-CB 4.2Å; L596-K629 PolarHBondContact N-O 2.85Å; L596-K629 VanDerWaalsContact N-O 3.09Å; L596-K629 WeakPolarHBondContact O-CB 3.29Å; L596-K629 VanDerWaalsContact O-CD 3.3Å; L596-K629 WeakPolarHBondContact O-CD 3.48Å; D626-K629 IonicContact OD1-NZ 3.57Å; D626-K629 PolarHBondContact OD1-NZ 3.05Å
630	S	65	Low	63.1	Low	10 Å²	10	61.2 Å²	61.2	7%	0.07	34%	0.337	C	S	.	.			trans	-108	145.2	-168.7	-54.1	0	0	0	0	113.6	I592 P615	I592-S630 VanDerWaalsContact O-CA 3.25Å; I592-S630 WeakPolarHBondContact O-CA 3.39Å; I592-S630 WeakPolarHBondContact O-CB 3.47Å; P615-S630 WeakPolarHBondContact CA-O 3.43Å; P615-S630 VanDerWaalsContact CB-O 3.25Å; P615-S630 WeakPolarHBondContact CB-O 3.24Å
631	A	72.4	Confident	65.2	Low	0 Å²	0	58 Å²	58	0%	0	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-152	162.6	174.8	0	0	0	0	0	112.6	I592 V595 L596 P615 W635 L636	I592-A631 PolarHBondContact N-O 3.22Å; I592-A631 PolarHBondContact O-N 3.14Å; I592-A631 VanDerWaalsContact O-N 3.13Å; V595-A631 HydrophobicContact CG2-CB 3.91Å; L596-A631 HydrophobicContact CD1-CB 4.31Å; L596-A631 HydrophobicContact CD2-CB 3.87Å; L596-A631 HydrophobicContact CG-CB 4.23Å; P615-A631 HydrophobicContact CG-CB 4.17Å; A631-W635 HydrophobicContact CB-CD2 4.32Å; A631-W635 HydrophobicContact CB-CE3 3.51Å; A631-W635 HydrophobicContact CB-CZ3 3.81Å; A631-L636 HydrophobicContact CB-CD1 4.14Å; A631-L636 HydrophobicContact CB-CD2 4.28Å; A631-L636 HydrophobicContact CB-CG 4.04Å
632	T	84.1	Confident	67.5	Low	3 Å²	3	51 Å²	51	2%	0.018	28%	0.284	C	S	.	.			trans	-89	154.5	173.8	67.6	0	0	0	0	111	C588 L591 N634 W635 L636	C588-T632 WeakPolarHBondContact O-CB 3.19Å; L591-T632 HydrophobicContact CD2-CG2 4.23Å; L591-T632 HydrophobicContact CG-CG2 4.33Å; T632-N634 VanDerWaalsContact C-N 3.29Å; T632-N634 PolarHBondContact O-N 3.35Å; T632-W635 PolarHBondContact O-N 3.39Å; T632-W635 VanDerWaalsContact O-N 3.15Å; T632-W635 WeakPolarHBondContact OG1-CB 3.37Å; T632-W635 PolarHBondContact OG1-N 3.37Å; T632-L636 WeakPolarHBondContact O-CG 3.33Å; T632-L636 PolarHBondContact O-N 3.25Å
633	G	86.3	Confident	69.8	Low	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.8	-32.9	175	0	0	0	0	0	113.1	P587 C588 W635 L636 C637 C646	P587-G633 WeakPolarHBondContact O-CA 3.2Å; P587-G633 PolarHBondContact O-N 2.93Å; C588-G633 PolarHBondContact O-N 3.45Å; G633-W635 VanDerWaalsContact C-N 3.32Å; G633-W635 PolarHBondContact O-N 2.87Å; G633-L636 PolarHBondContact O-N 2.89Å; G633-C637 WeakPolarHBondContact O-CB 3.35Å; G633-C637 PolarHBondContact O-N 2.03Å; G633-C637 PolarHBondContact O-SG 3.15Å; G633-C646 VanDerWaalsContact C-SG 3.52Å
634	N	86.6	Confident	72.4	Confident	32 Å²	32	41 Å²	41	17%	0.171	22%	0.217	C	C	.	.	H	α-helix	trans	-60.7	-41.3	172.2	-72	-26.7	0	0	0	111.4	C588 D589 T632 G638 V639 C646	C588-N634 WeakPolarHBondContact O-CB 3.41Å; C588-N634 PolarHBondContact O-N 3.22Å; C588-N634 PolarHBondContact O-ND2 3.4Å; C588-N634 VanDerWaalsContact O-ND2 3.12Å; D589-N634 PolarHBondContact OD1-ND2 3.32Å; T632-N634 VanDerWaalsContact C-N 3.29Å; T632-N634 PolarHBondContact O-N 3.35Å; N634-G638 PolarHBondContact O-N 2.86Å; N634-V639 HydrophobicContact CB-CB 4.33Å; N634-V639 HydrophobicContact CB-CG2 4.29Å; N634-V639 WeakPolarHBondContact O-CB 3.37Å; N634-V639 VanDerWaalsContact O-CG2 3.29Å; N634-V639 WeakPolarHBondContact O-CG2 3.4Å; N634-V639 PolarHBondContact O-N 3.22Å; N634-C646 WeakPolarHBondContact OD1-CB 3.26Å
635	W	83.6	Confident	74.8	Confident	21 Å²	21	34.6 Å²	34.6	8%	0.08	19%	0.191	C	C	.	.	H	α-helix	trans	-72.6	-38.9	176.7	-172.3	90.9	0	0	0	112.2	L596 L602 P615 A631 T632 G633 G638 Y667 W674	L596-W635 HydrophobicContact CD1-CH2 4.18Å; L596-W635 HydrophobicContact CD1-CZ3 4.17Å; L596-W635 HydrophobicContact CD2-CH2 4.32Å; L596-W635 HydrophobicContact CD2-CZ3 3.63Å; L602-W635 HydrophobicContact CD2-CH2 4.47Å; L602-W635 HydrophobicContact CD2-CZ2 3.87Å; L602-W635 HydrophobicContact CG-CZ2 4.43Å; P615-W635 HydrophobicContact CG-CD2 4.02Å; P615-W635 HydrophobicContact CG-CE3 4.31Å; P615-W635 HydrophobicContact CG-CH2 4.07Å; P615-W635 HydrophobicContact CG-CZ2 3.82Å; P615-W635 HydrophobicContact CG-CZ3 4.33Å; A631-W635 HydrophobicContact CB-CD2 4.32Å; A631-W635 HydrophobicContact CB-CE3 3.51Å; A631-W635 HydrophobicContact CB-CZ3 3.81Å; T632-W635 PolarHBondContact O-N 3.39Å; T632-W635 VanDerWaalsContact O-N 3.15Å; T632-W635 WeakPolarHBondContact OG1-CB 3.37Å; T632-W635 PolarHBondContact OG1-N 3.37Å; G633-W635 VanDerWaalsContact C-N 3.32Å; G633-W635 PolarHBondContact O-N 2.87Å; W635-G638 WeakPolarHBondContact O-CA 3.17Å; W635-G638 PolarHBondContact O-N 2.93Å; W635-Y667 HydrophobicContact CE3-CE1 4.38Å; W635-Y667 AromaticContact CH2-CE1 3.82Å; W635-Y667 HydrophobicContact CH2-CE1 3.82Å; W635-Y667 AromaticContact CH2-CZ 3.69Å; W635-Y667 WeakPolarHBondContact CH2-OH 3.42Å; W635-Y667 WeakPolarHBondContact CZ2-OH 3.44Å; W635-Y667 AromaticContact CZ3-CE1 3.5Å; W635-Y667 HydrophobicContact CZ3-CE1 3.5Å; W635-Y667 VanDerWaalsContact CZ3-CE1 3.5Å; W635-Y667 AromaticContact CZ3-CZ 3.89Å; W635-W674 HydrophobicContact CD2-CZ2 4.34Å; W635-W674 HydrophobicContact CZ2-CZ2 4.39Å; W635-W674 PolarHBondContact O-NE1 3.03Å
636	L	87.1	Confident	77.2	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-66.9	-39.3	176.3	-69.7	162.4	0	0	0	112.1	V595 L596 A631 T632 G633 G638 Y653 Y667 N672 C673 W674	V595-L636 HydrophobicContact CB-CD1 4.3Å; V595-L636 HydrophobicContact CG2-CD1 3.94Å; L596-L636 HydrophobicContact CD2-CD2 3.83Å; A631-L636 HydrophobicContact CB-CD1 4.14Å; A631-L636 HydrophobicContact CB-CD2 4.28Å; A631-L636 HydrophobicContact CB-CG 4.04Å; T632-L636 WeakPolarHBondContact O-CG 3.33Å; T632-L636 PolarHBondContact O-N 3.25Å; G633-L636 PolarHBondContact O-N 2.89Å; L636-G638 PolarHBondContact O-N 2.83Å; L636-Y653 HydrophobicContact CB-CE2 4.21Å; L636-Y653 HydrophobicContact CD1-CE1 4.44Å; L636-Y653 WeakPolarHBondContact CD1-OH 3.32Å; L636-Y667 HydrophobicContact CD2-CD1 4.33Å; L636-Y667 HydrophobicContact CD2-CE1 4.37Å; L636-N672 HydrophobicContact CB-CB 4.27Å; L636-N672 CarbonylContact O-C 3.51Å; L636-N672 WeakPolarHBondContact O-CA 3.19Å; L636-N672 WeakPolarHBondContact O-CB 3.05Å; L636-C673 PolarHBondContact O-N 2.87Å; L636-W674 PolarHBondContact O-NE1 3.12Å
637	C	90.6	Very high	79.5	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	5	170.6	-54.4	0	0	0	0	113.8	G633 V639 G644 C646 C655	G633-C637 WeakPolarHBondContact O-CB 3.35Å; G633-C637 PolarHBondContact O-N 2.03Å; G633-C637 PolarHBondContact O-SG 3.15Å; C637-V639 HydrophobicContact CB-CG2 4.1Å; C637-V639 PolarHBondContact O-N 2.88Å; C637-G644 WeakPolarHBondContact O-CA 3.28Å; C637-G644 PolarHBondContact O-N 2.82Å; C637-G644 VanDerWaalsContact O-N 3.15Å; C637-C646 HydrophobicContact CB-CB 4.16Å; C637-C655 WeakPolarHBondContact CA-SG 3.35Å; C637-C655 HydrophobicContact CB-CB 3.75Å; C637-C655 WeakPolarHBondContact CB-SG 3.4Å; C637-C655 WeakPolarHBondContact SG-CA 3.35Å; C637-C655 WeakPolarHBondContact SG-CB 3.31Å; C637-C655 CovalentContact SG-SG 2.03Å; C637-C655 PolarHBondContact SG-SG 3.29Å
638	G	83.9	Confident	81.6	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	30.1	178.4	0	0	0	0	0	114.3	N634 W635 L636 P640 F641 G642 Y643	N634-G638 PolarHBondContact O-N 2.86Å; W635-G638 WeakPolarHBondContact O-CA 3.17Å; W635-G638 PolarHBondContact O-N 2.93Å; L636-G638 PolarHBondContact O-N 2.83Å; G638-P640 VanDerWaalsContact C-CD 3.5Å; G638-F641 CarbonylContact O-C 3.6Å; G638-F641 PolarHBondContact O-N 3.34Å; G638-F641 VanDerWaalsContact O-N 3.11Å; G638-G642 PolarHBondContact O-N 3.12Å; G638-Y643 PolarHBondContact O-N 2.97Å
639	V	82	Confident	83.2	Confident	55 Å²	55	32.5 Å²	32.5	33%	0.333	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-55.4	-44.1	-177.4	-179.5	0	0	0	0	112.8	N634 C637 F641 G642 C646	N634-V639 HydrophobicContact CB-CB 4.33Å; N634-V639 HydrophobicContact CB-CG2 4.29Å; N634-V639 WeakPolarHBondContact O-CB 3.37Å; N634-V639 VanDerWaalsContact O-CG2 3.29Å; N634-V639 WeakPolarHBondContact O-CG2 3.4Å; N634-V639 PolarHBondContact O-N 3.22Å; C637-V639 HydrophobicContact CB-CG2 4.1Å; C637-V639 PolarHBondContact O-N 2.88Å; V639-F641 PolarHBondContact O-N 2.96Å; V639-G642 PolarHBondContact O-N 3.22Å; V639-C646 HydrophobicContact CG2-CB 4.38Å
640	P	72.3	Confident	84	Confident	82 Å²	82	32 Å²	32	53%	0.532	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-62.5	-25.4	178.9	-23.7	35.5	0	0	0	114.2	G638	G638-P640 VanDerWaalsContact C-CD 3.5Å
641	F	78.5	Confident	84.5	Confident	65 Å²	65	36.2 Å²	36.2	29%	0.285	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-99.9	0.6	179.3	-44.8	-65.8	0	0	0	111.8	G638 V639 Y643 W674 Q712	G638-F641 CarbonylContact O-C 3.6Å; G638-F641 PolarHBondContact O-N 3.34Å; G638-F641 VanDerWaalsContact O-N 3.11Å; V639-F641 PolarHBondContact O-N 2.96Å; F641-Y643 VanDerWaalsContact C-N 3.34Å; F641-Y643 HydrophobicContact CB-CD1 3.53Å; F641-Y643 HydrophobicContact CB-CD2 4.25Å; F641-Y643 HydrophobicContact CB-CE1 3.23Å; F641-Y643 HydrophobicContact CB-CE2 3.96Å; F641-Y643 HydrophobicContact CB-CG 4.07Å; F641-Y643 VanDerWaalsContact CB-CZ 3.47Å; F641-Y643 HydrophobicContact CD2-CE2 4.2Å; F641-Y643 HydrophobicContact CG-CE1 4.32Å; F641-Y643 HydrophobicContact CG-CE2 4.36Å; F641-Y643 VanDerWaalsContact O-CD1 3.27Å; F641-Y643 WeakPolarHBondContact O-CD1 3.43Å; F641-Y643 PolarHBondContact O-N 2.88Å; F641-W674 AromaticContact CD2-CH2 3.71Å; F641-W674 HydrophobicContact CD2-CH2 3.71Å; F641-W674 HydrophobicContact CD2-CZ2 4.02Å; F641-W674 AromaticContact CE2-CH2 3.43Å; F641-W674 HydrophobicContact CE2-CH2 3.43Å; F641-W674 VanDerWaalsContact CE2-CH2 3.43Å; F641-W674 AromaticContact CE2-CZ2 3.75Å; F641-W674 HydrophobicContact CE2-CZ2 3.75Å; F641-W674 HydrophobicContact CZ-CH2 4.33Å; F641-Q712 VanDerWaalsContact CG-NE2 3.31Å
642	G	82.2	Confident	85	Confident	18 Å²	18	43.5 Å²	43.5	19%	0.186	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.8	20.6	-179.6	0	0	0	0	0	114.8	G638 V639 G644 K658	G638-G642 PolarHBondContact O-N 3.12Å; V639-G642 PolarHBondContact O-N 3.22Å; G642-G644 VanDerWaalsContact C-N 3.34Å; G642-K658 WeakPolarHBondContact O-CD 3.49Å; G642-K658 WeakPolarHBondContact O-CE 2.91Å; G642-K658 PolarHBondContact O-NZ 3.09Å
643	Y	85.3	Confident	85.3	Confident	11 Å²	11	44.2 Å²	44.2	4%	0.043	26%	0.257	C	S	.	.	S	Bend	trans	-74	-26.4	-176.5	-57.4	-9	0	0	0	112.6	G638 F641 C657 K658 Y661 W674 Q712	G638-Y643 PolarHBondContact O-N 2.97Å; F641-Y643 VanDerWaalsContact C-N 3.34Å; F641-Y643 HydrophobicContact CB-CD1 3.53Å; F641-Y643 HydrophobicContact CB-CD2 4.25Å; F641-Y643 HydrophobicContact CB-CE1 3.23Å; F641-Y643 HydrophobicContact CB-CE2 3.96Å; F641-Y643 HydrophobicContact CB-CG 4.07Å; F641-Y643 VanDerWaalsContact CB-CZ 3.47Å; F641-Y643 HydrophobicContact CD2-CE2 4.2Å; F641-Y643 HydrophobicContact CG-CE1 4.32Å; F641-Y643 HydrophobicContact CG-CE2 4.36Å; F641-Y643 VanDerWaalsContact O-CD1 3.27Å; F641-Y643 WeakPolarHBondContact O-CD1 3.43Å; F641-Y643 PolarHBondContact O-N 2.88Å; Y643-C657 WeakPolarHBondContact O-CA 3.35Å; Y643-K658 PolarHBondContact O-N 3.06Å; Y643-Y661 VanDerWaalsContact CB-CD1 3.5Å; Y643-Y661 AromaticContact CD1-CD1 3.83Å; Y643-Y661 HydrophobicContact CD1-CD1 3.83Å; Y643-Y661 AromaticContact CD1-CE1 2.99Å; Y643-Y661 HydrophobicContact CD1-CE1 2.99Å; Y643-Y661 HydrophobicContact CD1-CE2 4.29Å; Y643-Y661 AromaticContact CD1-CZ 3.26Å; Y643-Y661 WeakPolarHBondContact CD1-OH 3.12Å; Y643-Y661 HydrophobicContact CD2-CD1 4.12Å; Y643-Y661 AromaticContact CD2-CE1 3.93Å; Y643-Y661 HydrophobicContact CD2-CE1 3.93Å; Y643-Y661 AromaticContact CE1-CE1 3.46Å; Y643-Y661 HydrophobicContact CE1-CE1 3.46Å; Y643-Y661 VanDerWaalsContact CE1-CE1 3.46Å; Y643-Y661 AromaticContact CE1-CZ 3.79Å; Y643-Y661 WeakPolarHBondContact CE1-OH 3.48Å; Y643-Y661 HydrophobicContact CE2-CE1 4.33Å; Y643-Y661 AromaticContact CG-CD1 3.58Å; Y643-Y661 HydrophobicContact CG-CD1 3.58Å; Y643-Y661 AromaticContact CG-CE1 3.25Å; Y643-Y661 HydrophobicContact CG-CE1 3.25Å; Y643-Y661 HydrophobicContact CG-CG 4.43Å; Y643-Y661 AromaticContact CG-CZ 3.9Å; Y643-Y661 WeakPolarHBondContact O-CB 3.44Å; Y643-W674 HydrophobicContact CD2-CD2 4.44Å; Y643-W674 HydrophobicContact CD2-CE3 4.37Å; Y643-W674 HydrophobicContact CE2-CD2 4.28Å; Y643-W674 AromaticContact CE2-CE3 3.77Å; Y643-W674 HydrophobicContact CE2-CE3 3.77Å; Y643-W674 HydrophobicContact CE2-CH2 4.32Å; Y643-W674 AromaticContact CE2-CZ3 3.79Å; Y643-W674 HydrophobicContact CE2-CZ3 3.79Å; Y643-Q712 VanDerWaalsContact OH-CD 3.26Å; Y643-Q712 VanDerWaalsContact OH-CG 3.26Å; Y643-Q712 WeakPolarHBondContact OH-CG 3.28Å; Y643-Q712 PolarHBondContact OH-NE2 3.45Å; Y643-Q712 PolarHBondContact OH-O 3.49Å
644	G	89.4	Confident	85.7	Confident	3 Å²	3	51.5 Å²	51.5	3%	0.031	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.7	-168.2	179.1	0	0	0	0	0	112.8	C637 G642 Q656	C637-G644 WeakPolarHBondContact O-CA 3.28Å; C637-G644 PolarHBondContact O-N 2.82Å; C637-G644 VanDerWaalsContact O-N 3.15Å; G642-G644 VanDerWaalsContact C-N 3.34Å; G644-Q656 CarbonylContact C-O 3.57Å; G644-Q656 WeakPolarHBondContact CA-O 3.18Å
645	T	92.2	Very high	86	Confident	60 Å²	60	50.4 Å²	50.4	37%	0.368	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	146.7	169.3	58.7	0	0	0	0	110.9	H647 C655 Q656	T645-H647 PolarHBondContact OG1-NE2 3.43Å; T645-C655 CarbonylContact O-C 3.53Å; T645-C655 WeakPolarHBondContact O-CA 3.44Å; T645-Q656 PolarHBondContact N-O 3.46Å; T645-Q656 PolarHBondContact O-N 3.21Å
646	C	93.4	Very high	86.5	Confident	22 Å²	22	54.7 Å²	54.7	15%	0.149	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	137	176.1	-171.3	0	0	0	0	110.9	C588 G633 N634 C637 V639	C588-C646 WeakPolarHBondContact CA-SG 3.25Å; C588-C646 HydrophobicContact CB-CB 3.86Å; C588-C646 WeakPolarHBondContact CB-SG 3.43Å; C588-C646 VanDerWaalsContact SG-C 3.56Å; C588-C646 WeakPolarHBondContact SG-CB 3.47Å; C588-C646 CovalentContact SG-SG 2.04Å; C588-C646 PolarHBondContact SG-SG 3.08Å; G633-C646 VanDerWaalsContact C-SG 3.52Å; N634-C646 WeakPolarHBondContact OD1-CB 3.26Å; C637-C646 HydrophobicContact CB-CB 4.16Å; V639-C646 HydrophobicContact CG2-CB 4.38Å
647	H	94.2	Very high	86.7	Confident	82 Å²	82	56.7 Å²	56.7	38%	0.38	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	119.8	173.4	-61	-97.5	0	0	0	110	T645 Y653 R654 Q656	T645-H647 PolarHBondContact OG1-NE2 3.43Å; H647-Y653 CarbonylContact O-C 3.47Å; H647-Y653 VanDerWaalsContact O-CA 3.3Å; H647-Y653 WeakPolarHBondContact O-CA 3.4Å; H647-R654 HydrophobicContact CB-CG 3.99Å; H647-R654 PolarHBondContact N-O 2.89Å; H647-R654 PolarHBondContact O-N 2.84Å; H647-Q656 PolarHBondContact NE2-OE1 2.99Å
648	S	90.1	Very high	86.5	Confident	62 Å²	62	62.1 Å²	62.1	43%	0.434	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	141	-179	57.7	0	0	0	0	113.3	N586	N586-S648 WeakPolarHBondContact OD1-CB 3.35Å; N586-S648 PolarHBondContact OD1-OG 3.32Å
649	S	85.4	Confident	86.4	Confident	97 Å²	97	69 Å²	69	68%	0.678	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.8	88.2	172	-156.1	0	0	0	0	109.8	F651 Q652	S649-F651 PolarHBondContact O-N 3.44Å; S649-Q652 CarbonylContact C-O 3.51Å; S649-Q652 PolarHBondContact N-O 3.1Å; S649-Q652 PolarHBondContact O-N 2.81Å
650	G	79.2	Confident	86.4	Confident	48 Å²	48	66.6 Å²	66.6	50%	0.495	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.8	-122.9	-170.4	0	0	0	0	0	111.2	P587 Q652	P587-G650 WeakPolarHBondContact CD-O 3.3Å; P587-G650 WeakPolarHBondContact CG-O 3.35Å; G650-Q652 VanDerWaalsContact C-N 3.33Å
651	F	75.1	Confident	87	Confident	100 Å²	100	64.6 Å²	64.6	44%	0.439	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-9.6	-178.9	-52.4	-58.3	0	0	0	114.1	Q574 N575 F585 S649	Q574-F651 WeakPolarHBondContact O-CD1 3.2Å; Q574-F651 WeakPolarHBondContact O-CE1 3.06Å; N575-F651 HydrophobicContact CB-CE1 4.37Å; N575-F651 HydrophobicContact CB-CZ 3.91Å; N575-F651 VanDerWaalsContact CG-CZ 3.43Å; F585-F651 HydrophobicContact CB-CE1 4.41Å; F585-F651 AromaticContact CD1-CD1 3.8Å; F585-F651 HydrophobicContact CD1-CD1 3.8Å; F585-F651 HydrophobicContact CD1-CE1 4.2Å; F585-F651 HydrophobicContact CE1-CD1 4.39Å; S649-F651 PolarHBondContact O-N 3.44Å
652	Q	83.7	Confident	87.4	Confident	152 Å²	152	65.6 Å²	65.6	71%	0.71	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.7	148.1	175.2	-66.8	177.4	-15.8	0	0	109.3	P587 S649 G650	P587-Q652 WeakPolarHBondContact CG-O 3.06Å; S649-Q652 CarbonylContact C-O 3.51Å; S649-Q652 PolarHBondContact N-O 3.1Å; S649-Q652 PolarHBondContact O-N 2.81Å; G650-Q652 VanDerWaalsContact C-N 3.33Å
653	Y	91.3	Very high	87.7	Confident	19 Å²	19	68.2 Å²	68.2	8%	0.075	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	162.9	162.6	72.7	-74.3	0	0	0	108.3	P587 I592 L636 H647 Q670 D671	P587-Y653 HydrophobicContact CB-CD1 3.98Å; P587-Y653 HydrophobicContact CB-CG 4.39Å; I592-Y653 HydrophobicContact CD1-CD1 3.6Å; I592-Y653 HydrophobicContact CD1-CE1 3.35Å; L636-Y653 HydrophobicContact CB-CE2 4.21Å; L636-Y653 HydrophobicContact CD1-CE1 4.44Å; L636-Y653 WeakPolarHBondContact CD1-OH 3.32Å; H647-Y653 CarbonylContact O-C 3.47Å; H647-Y653 VanDerWaalsContact O-CA 3.3Å; H647-Y653 WeakPolarHBondContact O-CA 3.4Å; Y653-Q670 HydrophobicContact CE1-CB 4.07Å; Y653-Q670 WeakPolarHBondContact OH-CB 3.29Å; Y653-D671 HydrophobicContact CE2-CB 4.28Å; Y653-D671 WeakPolarHBondContact CE2-O 3.39Å; Y653-D671 VanDerWaalsContact CZ-O 3.23Å; Y653-D671 PolarHBondContact OH-N 3.25Å; Y653-D671 PolarHBondContact OH-O 3.28Å
654	R	93.2	Very high	87.6	Confident	153 Å²	153	68.4 Å²	68.4	58%	0.577	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.1	152.1	169.5	62.3	175.6	-63.3	-132.8	-4.1	109.7	H647 D671	H647-R654 HydrophobicContact CB-CG 3.99Å; H647-R654 PolarHBondContact N-O 2.89Å; H647-R654 PolarHBondContact O-N 2.84Å; R654-D671 VanDerWaalsContact CA-OD2 3.27Å; R654-D671 WeakPolarHBondContact CA-OD2 3.2Å
655	C	93.9	Very high	87.2	Confident	8 Å²	8	72.6 Å²	72.6	5%	0.054	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	152.3	174.4	-58	0	0	0	0	111.1	C637 T645 D671 N672 C673	C637-C655 WeakPolarHBondContact CA-SG 3.35Å; C637-C655 HydrophobicContact CB-CB 3.75Å; C637-C655 WeakPolarHBondContact CB-SG 3.4Å; C637-C655 WeakPolarHBondContact SG-CA 3.35Å; C637-C655 WeakPolarHBondContact SG-CB 3.31Å; C637-C655 CovalentContact SG-SG 2.03Å; C637-C655 PolarHBondContact SG-SG 3.29Å; T645-C655 CarbonylContact O-C 3.53Å; T645-C655 WeakPolarHBondContact O-CA 3.44Å; C655-D671 PolarHBondContact N-OD2 3.06Å; C655-D671 PolarHBondContact SG-O 2.96Å; C655-D671 VanDerWaalsContact SG-O 3.4Å; C655-N672 VanDerWaalsContact SG-CA 3.51Å; C655-N672 PolarHBondContact SG-N 2.95Å; C655-C673 VanDerWaalsContact CB-SG 3.51Å
656	Q	94.6	Very high	86.3	Confident	111 Å²	111	74.7 Å²	74.7	52%	0.519	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	92	166.5	178.2	-176.3	-3.3	0	0	106.9	G644 T645 H647	G644-Q656 CarbonylContact C-O 3.57Å; G644-Q656 WeakPolarHBondContact CA-O 3.18Å; T645-Q656 PolarHBondContact N-O 3.46Å; T645-Q656 PolarHBondContact O-N 3.21Å; H647-Q656 PolarHBondContact NE2-OE1 2.99Å
657	C	90.5	Very high	85.2	Confident	42 Å²	42	74.9 Å²	74.9	28%	0.284	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	148.9	-178.9	-48.5	0	0	0	0	111.2	Y643 Y661 C673	Y643-C657 WeakPolarHBondContact O-CA 3.35Å; C657-Y661 WeakPolarHBondContact CB-O 3.44Å; C657-C673 WeakPolarHBondContact CA-SG 3.05Å; C657-C673 HydrophobicContact CB-CB 3.82Å; C657-C673 WeakPolarHBondContact CB-SG 3.29Å; C657-C673 VanDerWaalsContact SG-CA 3.53Å; C657-C673 WeakPolarHBondContact SG-CB 3.48Å; C657-C673 CovalentContact SG-SG 2.04Å; C657-C673 PolarHBondContact SG-SG 2.89Å
658	K	87.4	Confident	84.5	Confident	115 Å²	115	71 Å²	71	50%	0.5	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-78	166.8	171.9	-64.5	-166.8	-164.2	152.3	0	110.2	G642 Y643 G660 Y661	G642-K658 WeakPolarHBondContact O-CD 3.49Å; G642-K658 WeakPolarHBondContact O-CE 2.91Å; G642-K658 PolarHBondContact O-NZ 3.09Å; Y643-K658 PolarHBondContact O-N 3.06Å; K658-G660 PolarHBondContact O-N 3.13Å; K658-Y661 HydrophobicContact CB-CD2 4.03Å; K658-Y661 HydrophobicContact CB-CE2 4.49Å; K658-Y661 PolarHBondContact O-N 2.92Å
659	I	79.8	Confident	84	Confident	145 Å²	145	73.5 Å²	73.5	74%	0.744	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	130	169.4	-51.7	169.6	0	0	0	107.9	L679	I659-L679 HydrophobicContact CG2-CD1 4.2Å; I659-L679 HydrophobicContact CG2-CD2 3.84Å; I659-L679 HydrophobicContact CG2-CG 4.12Å
660	G	81.8	Confident	84	Confident	4 Å²	4	73.1 Å²	73.1	4%	0.041	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	97.5	0.3	-171.6	0	0	0	0	0	114.9	K658 Q676 T677	K658-G660 PolarHBondContact O-N 3.13Å; G660-Q676 CarbonylContact O-C 3.56Å; G660-Q676 WeakPolarHBondContact O-CA 3.25Å; G660-T677 WeakPolarHBondContact CA-O 3.37Å; G660-T677 VanDerWaalsContact CA-OG1 3.32Å; G660-T677 WeakPolarHBondContact CA-OG1 3.26Å; G660-T677 PolarHBondContact O-N 2.92Å; G660-T677 PolarHBondContact O-OG1 3.15Å
661	Y	86.3	Confident	84.6	Confident	39 Å²	39	73 Å²	73	15%	0.153	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	143.9	-176.2	-57.9	-89.6	0	0	0	113.8	Y643 C657 K658 K675 T677 Y713	Y643-Y661 VanDerWaalsContact CB-CD1 3.5Å; Y643-Y661 AromaticContact CD1-CD1 3.83Å; Y643-Y661 HydrophobicContact CD1-CD1 3.83Å; Y643-Y661 AromaticContact CD1-CE1 2.99Å; Y643-Y661 HydrophobicContact CD1-CE1 2.99Å; Y643-Y661 HydrophobicContact CD1-CE2 4.29Å; Y643-Y661 AromaticContact CD1-CZ 3.26Å; Y643-Y661 WeakPolarHBondContact CD1-OH 3.12Å; Y643-Y661 HydrophobicContact CD2-CD1 4.12Å; Y643-Y661 AromaticContact CD2-CE1 3.93Å; Y643-Y661 HydrophobicContact CD2-CE1 3.93Å; Y643-Y661 AromaticContact CE1-CE1 3.46Å; Y643-Y661 HydrophobicContact CE1-CE1 3.46Å; Y643-Y661 VanDerWaalsContact CE1-CE1 3.46Å; Y643-Y661 AromaticContact CE1-CZ 3.79Å; Y643-Y661 WeakPolarHBondContact CE1-OH 3.48Å; Y643-Y661 HydrophobicContact CE2-CE1 4.33Å; Y643-Y661 AromaticContact CG-CD1 3.58Å; Y643-Y661 HydrophobicContact CG-CD1 3.58Å; Y643-Y661 AromaticContact CG-CE1 3.25Å; Y643-Y661 HydrophobicContact CG-CE1 3.25Å; Y643-Y661 HydrophobicContact CG-CG 4.43Å; Y643-Y661 AromaticContact CG-CZ 3.9Å; Y643-Y661 WeakPolarHBondContact O-CB 3.44Å; C657-Y661 WeakPolarHBondContact CB-O 3.44Å; K658-Y661 HydrophobicContact CB-CD2 4.03Å; K658-Y661 HydrophobicContact CB-CE2 4.49Å; K658-Y661 PolarHBondContact O-N 2.92Å; Y661-K675 CarbonylContact C-O 3.52Å; Y661-K675 VanDerWaalsContact CA-O 3.29Å; Y661-K675 WeakPolarHBondContact CA-O 3.47Å; Y661-T677 PolarHBondContact N-OG1 3.23Å; Y661-Y713 HydrophobicContact CD1-CE1 4.07Å; Y661-Y713 HydrophobicContact CE1-CD1 4.18Å; Y661-Y713 AromaticContact CE1-CE1 3.24Å; Y661-Y713 HydrophobicContact CE1-CE1 3.24Å; Y661-Y713 AromaticContact CE1-CZ 3.76Å; Y661-Y713 AromaticContact CZ-CE1 3.55Å; Y661-Y713 AromaticContact CZ-CZ 3.53Å; Y661-Y713 PolarHBondContact OH-OH 2.83Å
662	E	86.3	Confident	85.3	Confident	86 Å²	86	68.2 Å²	68.2	40%	0.402	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	-177.5	172.7	70.7	177.9	-179.6	0	0	112.6	C673 W674 K675 T677	E662-C673 CarbonylContact O-C 3.56Å; E662-C673 VanDerWaalsContact O-C 3.23Å; E662-C673 VanDerWaalsContact O-CA 3.3Å; E662-C673 WeakPolarHBondContact O-CA 3.33Å; E662-W674 PolarHBondContact O-N 3.1Å; E662-K675 HydrophobicContact CG-CB 3.89Å; E662-K675 HydrophobicContact CG-CD 4.02Å; E662-K675 HydrophobicContact CG-CG 3.84Å; E662-K675 PolarHBondContact N-O 2.88Å; E662-K675 PolarHBondContact O-N 3.38Å; E662-K675 WeakPolarHBondContact OE1-CD 3.13Å; E662-K675 WeakPolarHBondContact OE1-CE 3.42Å; E662-K675 IonicContact OE1-NZ 2.7Å; E662-K675 PolarHBondContact OE1-NZ 2.85Å; E662-T677 HydrophobicContact CG-CG2 4.07Å
663	K	88.1	Confident	85.6	Confident	74 Å²	74	61 Å²	61	32%	0.322	30%	0.297	S	S	.	.			trans	-78.7	126.4	-175.4	-177.6	-179.1	173.6	165.5	0	112.8	D669 Q670 N672	K663-D669 PolarHBondContact NZ-O 2.69Å; K663-Q670 WeakPolarHBondContact CE-O 3.5Å; K663-Q670 PolarHBondContact NZ-O 3Å; K663-Q670 VanDerWaalsContact NZ-O 3.09Å; K663-N672 VanDerWaalsContact CA-O 3.24Å; K663-N672 WeakPolarHBondContact CA-O 3.3Å; K663-N672 WeakPolarHBondContact CB-O 3.49Å; K663-N672 WeakPolarHBondContact CG-ND2 3.29Å
664	D	83.4	Confident	85.3	Confident	14 Å²	14	62 Å²	62	8%	0.075	30%	0.3	C	S	.	.			trans	-92.7	111.9	167.3	-170.6	-4	0	0	0	111.4	N666 Y667 N672 W674 K675 N715	D664-N666 VanDerWaalsContact C-N 3.28Å; D664-N666 PolarHBondContact O-N 3.02Å; D664-N666 VanDerWaalsContact OD1-CB 3.3Å; D664-N666 WeakPolarHBondContact OD1-CB 3.5Å; D664-N666 PolarHBondContact OD1-N 3.24Å; D664-N666 PolarHBondContact OD1-ND2 3.03Å; D664-Y667 PolarHBondContact O-N 3.16Å; D664-N672 PolarHBondContact N-OD1 3.03Å; D664-N672 PolarHBondContact O-ND2 3.32Å; D664-W674 HydrophobicContact CB-CB 4.4Å; D664-K675 HydrophobicContact CB-CB 4.09Å; D664-N715 PolarHBondContact OD2-ND2 3.04Å
665	V	82.3	Confident	84.6	Confident	92 Å²	92	55.8 Å²	55.8	56%	0.558	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-20.3	178	-175	0	0	0	0	112.2	Y667	V665-Y667 VanDerWaalsContact C-N 3.29Å; V665-Y667 PolarHBondContact O-N 3.06Å
666	N	72.3	Confident	83.8	Confident	103 Å²	103	56.9 Å²	56.9	55%	0.551	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-15.5	178.2	-54.9	-84.3	0	0	0	113.3	D664	D664-N666 VanDerWaalsContact C-N 3.28Å; D664-N666 PolarHBondContact O-N 3.02Å; D664-N666 VanDerWaalsContact OD1-CB 3.3Å; D664-N666 WeakPolarHBondContact OD1-CB 3.5Å; D664-N666 PolarHBondContact OD1-N 3.24Å; D664-N666 PolarHBondContact OD1-ND2 3.03Å
667	Y	70.1	Confident	82.5	Confident	26 Å²	26	53.7 Å²	53.7	10%	0.102	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-46.6	-177.3	-157.9	-106.6	0	0	0	110.8	L596 M597 I601 W635 L636 D664 V665 W674	L596-Y667 HydrophobicContact CD2-CE1 4.49Å; M597-Y667 PolarHBondContact N-O 3.16Å; I601-Y667 HydrophobicContact CD1-CD2 4.22Å; I601-Y667 HydrophobicContact CD1-CE2 4.2Å; I601-Y667 HydrophobicContact CG2-CE2 4.38Å; W635-Y667 HydrophobicContact CE3-CE1 4.38Å; W635-Y667 AromaticContact CH2-CE1 3.82Å; W635-Y667 HydrophobicContact CH2-CE1 3.82Å; W635-Y667 AromaticContact CH2-CZ 3.69Å; W635-Y667 WeakPolarHBondContact CH2-OH 3.42Å; W635-Y667 WeakPolarHBondContact CZ2-OH 3.44Å; W635-Y667 AromaticContact CZ3-CE1 3.5Å; W635-Y667 HydrophobicContact CZ3-CE1 3.5Å; W635-Y667 VanDerWaalsContact CZ3-CE1 3.5Å; W635-Y667 AromaticContact CZ3-CZ 3.89Å; L636-Y667 HydrophobicContact CD2-CD1 4.33Å; L636-Y667 HydrophobicContact CD2-CE1 4.37Å; D664-Y667 PolarHBondContact O-N 3.16Å; V665-Y667 VanDerWaalsContact C-N 3.29Å; V665-Y667 PolarHBondContact O-N 3.06Å; Y667-W674 HydrophobicContact CD1-CB 4.39Å; Y667-W674 AromaticContact CD1-CD1 3.81Å; Y667-W674 HydrophobicContact CD1-CG 4.05Å; Y667-W674 AromaticContact CE1-CD1 3.5Å; Y667-W674 VanDerWaalsContact CE1-CD1 3.5Å; Y667-W674 AromaticContact CE1-CD2 3.97Å; Y667-W674 HydrophobicContact CE1-CD2 3.97Å; Y667-W674 AromaticContact CE1-CE2 3.88Å; Y667-W674 AromaticContact CE1-CG 3.75Å; Y667-W674 HydrophobicContact CE1-CG 3.75Å; Y667-W674 AromaticContact CE1-NE1 3.59Å; Y667-W674 HydrophobicContact CE2-CD2 4.45Å; Y667-W674 HydrophobicContact CE2-CG 4.5Å; Y667-W674 HydrophobicContact CG-CB 4.46Å; Y667-W674 AromaticContact CZ-CD2 3.81Å; Y667-W674 AromaticContact CZ-CE2 3.91Å; Y667-W674 AromaticContact CZ-CG 3.98Å
668	S	79.5	Confident	80.8	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.295	C	S	.	.			trans	-156.7	142.8	-178.3	-171.9	0	0	0	0	111.4	V595 Q670	V595-S668 WeakPolarHBondContact O-CA 3.24Å; V595-S668 WeakPolarHBondContact O-CB 3.38Å; V595-S668 PolarHBondContact O-OG 3.27Å; S668-Q670 PolarHBondContact O-N 2.84Å; S668-Q670 WeakPolarHBondContact OG-CB 3.49Å; S668-Q670 PolarHBondContact OG-N 2.82Å
669	D	80.9	Confident	79	Confident	115 Å²	115	59.6 Å²	59.6	62%	0.615	30%	0.298	S	S	*	.	S	Bend	trans	-60	-30.1	163.4	-72.9	-53.7	0	0	0	111.7	M597 K663	M597-D669 HydrophobicContact CE-CB 4.5Å; M597-D669 WeakPolarHBondContact CE-OD1 3.43Å; M597-D669 VanDerWaalsContact CE-OD2 3.23Å; M597-D669 WeakPolarHBondContact CE-OD2 3.5Å; K663-D669 PolarHBondContact NZ-O 2.69Å
670	Q	85.1	Confident	77	Confident	90 Å²	90	62.4 Å²	62.4	42%	0.421	31%	0.305	S	S	.	.	S	Bend	trans	-77.1	162.7	-178.5	-53.3	-64.5	-13.3	0	0	112.1	V595 Y653 K663 S668 N672	V595-Q670 HydrophobicContact CB-CG 4.11Å; V595-Q670 HydrophobicContact CG1-CG 3.7Å; Y653-Q670 HydrophobicContact CE1-CB 4.07Å; Y653-Q670 WeakPolarHBondContact OH-CB 3.29Å; K663-Q670 WeakPolarHBondContact CE-O 3.5Å; K663-Q670 PolarHBondContact NZ-O 3Å; K663-Q670 VanDerWaalsContact NZ-O 3.09Å; S668-Q670 PolarHBondContact O-N 2.84Å; S668-Q670 WeakPolarHBondContact OG-CB 3.49Å; S668-Q670 PolarHBondContact OG-N 2.82Å; Q670-N672 PolarHBondContact O-ND2 2.79Å
671	D	90.4	Very high	75.1	Confident	45 Å²	45	65.4 Å²	65.4	24%	0.241	32%	0.323	C	S	.	.			trans	-64.5	139.9	-176.1	-156.6	8.5	0	0	0	112.2	Y653 R654 C655	Y653-D671 HydrophobicContact CE2-CB 4.28Å; Y653-D671 WeakPolarHBondContact CE2-O 3.39Å; Y653-D671 VanDerWaalsContact CZ-O 3.23Å; Y653-D671 PolarHBondContact OH-N 3.25Å; Y653-D671 PolarHBondContact OH-O 3.28Å; R654-D671 VanDerWaalsContact CA-OD2 3.27Å; R654-D671 WeakPolarHBondContact CA-OD2 3.2Å; C655-D671 PolarHBondContact N-OD2 3.06Å; C655-D671 PolarHBondContact SG-O 2.96Å; C655-D671 VanDerWaalsContact SG-O 3.4Å
672	N	90.8	Very high	73	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	36%	0.36	C	S	.	.			trans	-160.6	170.6	-172.6	74.3	73.7	0	0	0	112.1	L636 C655 K663 D664 Q670 W674	L636-N672 HydrophobicContact CB-CB 4.27Å; L636-N672 CarbonylContact O-C 3.51Å; L636-N672 WeakPolarHBondContact O-CA 3.19Å; L636-N672 WeakPolarHBondContact O-CB 3.05Å; C655-N672 VanDerWaalsContact SG-CA 3.51Å; C655-N672 PolarHBondContact SG-N 2.95Å; K663-N672 VanDerWaalsContact CA-O 3.24Å; K663-N672 WeakPolarHBondContact CA-O 3.3Å; K663-N672 WeakPolarHBondContact CB-O 3.49Å; K663-N672 WeakPolarHBondContact CG-ND2 3.29Å; D664-N672 PolarHBondContact N-OD1 3.03Å; D664-N672 PolarHBondContact O-ND2 3.32Å; Q670-N672 PolarHBondContact O-ND2 2.79Å; N672-W674 PolarHBondContact OD1-N 3.31Å
673	C	89.8	Confident	71.3	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	36%	0.359	C	S	.	.			trans	-130.2	35.2	179	-62.5	0	0	0	0	113.3	L636 C655 C657 E662	L636-C673 PolarHBondContact O-N 2.87Å; C655-C673 VanDerWaalsContact CB-SG 3.51Å; C657-C673 WeakPolarHBondContact CA-SG 3.05Å; C657-C673 HydrophobicContact CB-CB 3.82Å; C657-C673 WeakPolarHBondContact CB-SG 3.29Å; C657-C673 VanDerWaalsContact SG-CA 3.53Å; C657-C673 WeakPolarHBondContact SG-CB 3.48Å; C657-C673 CovalentContact SG-SG 2.04Å; C657-C673 PolarHBondContact SG-SG 2.89Å; E662-C673 CarbonylContact O-C 3.56Å; E662-C673 VanDerWaalsContact O-C 3.23Å; E662-C673 VanDerWaalsContact O-CA 3.3Å; E662-C673 WeakPolarHBondContact O-CA 3.33Å
674	W	84.4	Confident	69.6	Low	40 Å²	40	72.9 Å²	72.9	15%	0.152	37%	0.37	C	S	.	.			trans	-89.6	-4.9	-172.3	-77.8	90.9	0	0	0	115.3	W635 L636 F641 Y643 E662 D664 Y667 N672 Q712	W635-W674 HydrophobicContact CD2-CZ2 4.34Å; W635-W674 HydrophobicContact CZ2-CZ2 4.39Å; W635-W674 PolarHBondContact O-NE1 3.03Å; L636-W674 PolarHBondContact O-NE1 3.12Å; F641-W674 AromaticContact CD2-CH2 3.71Å; F641-W674 HydrophobicContact CD2-CH2 3.71Å; F641-W674 HydrophobicContact CD2-CZ2 4.02Å; F641-W674 AromaticContact CE2-CH2 3.43Å; F641-W674 HydrophobicContact CE2-CH2 3.43Å; F641-W674 VanDerWaalsContact CE2-CH2 3.43Å; F641-W674 AromaticContact CE2-CZ2 3.75Å; F641-W674 HydrophobicContact CE2-CZ2 3.75Å; F641-W674 HydrophobicContact CZ-CH2 4.33Å; Y643-W674 HydrophobicContact CD2-CD2 4.44Å; Y643-W674 HydrophobicContact CD2-CE3 4.37Å; Y643-W674 HydrophobicContact CE2-CD2 4.28Å; Y643-W674 AromaticContact CE2-CE3 3.77Å; Y643-W674 HydrophobicContact CE2-CE3 3.77Å; Y643-W674 HydrophobicContact CE2-CH2 4.32Å; Y643-W674 AromaticContact CE2-CZ3 3.79Å; Y643-W674 HydrophobicContact CE2-CZ3 3.79Å; E662-W674 PolarHBondContact O-N 3.1Å; D664-W674 HydrophobicContact CB-CB 4.4Å; Y667-W674 HydrophobicContact CD1-CB 4.39Å; Y667-W674 AromaticContact CD1-CD1 3.81Å; Y667-W674 HydrophobicContact CD1-CG 4.05Å; Y667-W674 AromaticContact CE1-CD1 3.5Å; Y667-W674 VanDerWaalsContact CE1-CD1 3.5Å; Y667-W674 AromaticContact CE1-CD2 3.97Å; Y667-W674 HydrophobicContact CE1-CD2 3.97Å; Y667-W674 AromaticContact CE1-CE2 3.88Å; Y667-W674 AromaticContact CE1-CG 3.75Å; Y667-W674 HydrophobicContact CE1-CG 3.75Å; Y667-W674 AromaticContact CE1-NE1 3.59Å; Y667-W674 HydrophobicContact CE2-CD2 4.45Å; Y667-W674 HydrophobicContact CE2-CG 4.5Å; Y667-W674 HydrophobicContact CG-CB 4.46Å; Y667-W674 AromaticContact CZ-CD2 3.81Å; Y667-W674 AromaticContact CZ-CE2 3.91Å; Y667-W674 AromaticContact CZ-CG 3.98Å; N672-W674 PolarHBondContact OD1-N 3.31Å; W674-Q712 HydrophobicContact CZ3-CG 4.31Å
675	K	78.9	Confident	68.1	Low	22 Å²	22	75.5 Å²	75.5	10%	0.096	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	127.3	174	178	164.2	-175.7	-63.4	0	110.5	Y661 E662 D664 N715 D716	Y661-K675 CarbonylContact C-O 3.52Å; Y661-K675 VanDerWaalsContact CA-O 3.29Å; Y661-K675 WeakPolarHBondContact CA-O 3.47Å; E662-K675 HydrophobicContact CG-CB 3.89Å; E662-K675 HydrophobicContact CG-CD 4.02Å; E662-K675 HydrophobicContact CG-CG 3.84Å; E662-K675 PolarHBondContact N-O 2.88Å; E662-K675 PolarHBondContact O-N 3.38Å; E662-K675 WeakPolarHBondContact OE1-CD 3.13Å; E662-K675 WeakPolarHBondContact OE1-CE 3.42Å; E662-K675 IonicContact OE1-NZ 2.7Å; E662-K675 PolarHBondContact OE1-NZ 2.85Å; D664-K675 HydrophobicContact CB-CB 4.09Å; K675-N715 VanDerWaalsContact CE-O 3.29Å; K675-N715 WeakPolarHBondContact CE-O 3.46Å; K675-N715 WeakPolarHBondContact CG-O 3.29Å; K675-D716 VanDerWaalsContact CE-OD1 3.24Å; K675-D716 WeakPolarHBondContact CE-OD1 3.47Å; K675-D716 IonicContact NZ-OD1 3.89Å; K675-D716 PolarHBondContact NZ-OD1 2.8Å; K675-D716 IonicContact NZ-OD2 3.66Å; K675-D716 PolarHBondContact NZ-OD2 2.04Å
676	Q	77.6	Confident	67	Low	32 Å²	32	76.4 Å²	76.4	15%	0.15	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	152.8	173.3	-173.6	175.5	14.9	0	0	111.3	G660 Y713 Y747	G660-Q676 CarbonylContact O-C 3.56Å; G660-Q676 WeakPolarHBondContact O-CA 3.25Å; Q676-Y713 HydrophobicContact CB-CD1 3.79Å; Q676-Y713 HydrophobicContact CB-CE1 3.84Å; Q676-Y713 HydrophobicContact CG-CD1 3.64Å; Q676-Y713 HydrophobicContact CG-CE1 3.4Å; Q676-Y713 HydrophobicContact CG-CG 4.44Å; Q676-Y713 VanDerWaalsContact OE1-CD1 3.25Å; Q676-Y747 PolarHBondContact NE2-OH 2.97Å
677	T	66.8	Low	66.4	Low	43 Å²	43	79.8 Å²	79.8	26%	0.264	40%	0.397	S	S	.	.			trans	-130.8	146.1	164.9	46.7	0	0	0	0	110.1	G660 Y661 E662	G660-T677 WeakPolarHBondContact CA-O 3.37Å; G660-T677 VanDerWaalsContact CA-OG1 3.32Å; G660-T677 WeakPolarHBondContact CA-OG1 3.26Å; G660-T677 PolarHBondContact O-N 2.92Å; G660-T677 PolarHBondContact O-OG1 3.15Å; Y661-T677 PolarHBondContact N-OG1 3.23Å; E662-T677 HydrophobicContact CG-CG2 4.07Å
678	E	53.8	Low	66.3	Low	175 Å²	175	78.6 Å²	78.6	82%	0.818	39%	0.393	S	S	*	.			trans	-70.8	130	-172.2	-65.9	-176.5	166.2	0	0	113.8
679	L	50.7	Low	65.6	Low	107 Å²	107	81.1 Å²	81.1	56%	0.56	42%	0.419	S	S	*	.			trans	-103.2	124	175	-104.3	159.7	0	0	0	110.5	I659 T681	I659-L679 HydrophobicContact CG2-CD1 4.2Å; I659-L679 HydrophobicContact CG2-CD2 3.84Å; I659-L679 HydrophobicContact CG2-CG 4.12Å; L679-T681 PolarHBondContact O-N 2.96Å
680	K	38.6	Very low	64.8	Low	203 Å²	203	82.8 Å²	82.8	88%	0.883	42%	0.423	S	S	*	.			trans	-86	97.9	178.2	-70.4	-177.5	177.2	178.3	0	111.8
681	T	40.7	Very low	63.8	Low	68 Å²	68	79.7 Å²	79.7	42%	0.417	41%	0.411	S	S	.	.			trans	-93.9	143.2	162.6	55.7	0	0	0	0	111.2	L679 E683	L679-T681 PolarHBondContact O-N 2.96Å; T681-E683 VanDerWaalsContact C-N 3.31Å; T681-E683 WeakPolarHBondContact CB-OE2 3.48Å; T681-E683 WeakPolarHBondContact CG2-OE2 3.28Å; T681-E683 PolarHBondContact O-N 3.36Å; T681-E683 PolarHBondContact OG1-OE2 3.41Å
682	I	42.3	Very low	63.1	Low	181 Å²	181	80 Å²	80	93%	0.928	41%	0.414	S	S	*	.			trans	-95.9	72	169.1	-54.1	179.7	0	0	0	107.4
683	E	50	Low	62.5	Low	84 Å²	84	80 Å²	80	39%	0.393	41%	0.414	S	S	.	.	S	Bend	trans	-105.9	-176.5	169.3	-70.6	165	127.3	0	0	108.8	T681 V685 L694	T681-E683 VanDerWaalsContact C-N 3.31Å; T681-E683 WeakPolarHBondContact CB-OE2 3.48Å; T681-E683 WeakPolarHBondContact CG2-OE2 3.28Å; T681-E683 PolarHBondContact O-N 3.36Å; T681-E683 PolarHBondContact OG1-OE2 3.41Å; E683-V685 PolarHBondContact O-N 2.84Å; E683-L694 HydrophobicContact CB-CD2 4.05Å
684	T	52.8	Low	61.8	Low	90 Å²	90	80.6 Å²	80.6	55%	0.552	42%	0.417	S	S	*	.			trans	-74.4	75.2	173.6	54.7	0	0	0	0	110.7	H686	T684-H686 PolarHBondContact O-N 3.49Å
685	V	52.8	Low	61.1	Low	70 Å²	70	81 Å²	81	42%	0.424	42%	0.423	S	S	.	.			trans	-64.4	115.9	179.6	170.4	0	0	0	0	110.2	E683 V692	E683-V685 PolarHBondContact O-N 2.84Å; V685-V692 HydrophobicContact CB-CG1 4.09Å; V685-V692 HydrophobicContact CG1-CB 4.47Å; V685-V692 HydrophobicContact CG1-CG1 3.75Å; V685-V692 HydrophobicContact CG1-CG2 3.93Å; V685-V692 HydrophobicContact CG2-CG1 3.92Å
686	H	59	Low	60.7	Low	111 Å²	111	81.4 Å²	81.4	51%	0.514	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	122.5	159.7	-75.3	-70.6	0	0	0	109.6	T684 C688 C693	T684-H686 PolarHBondContact O-N 3.49Å; H686-C688 PolarHBondContact O-N 3.39Å; H686-C693 HydrophobicContact CB-CB 4.45Å; H686-C693 PolarHBondContact N-O 3.19Å; H686-C693 VanDerWaalsContact N-O 3.12Å; H686-C693 PolarHBondContact O-N 2.85Å
687	E	58.5	Low	60.6	Low	174 Å²	174	80 Å²	80	81%	0.813	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.1	127.3	172.8	-75.2	-178.3	131.9	0	0	110.4
688	C	68.3	Low	61.3	Low	1 Å²	1	83.4 Å²	83.4	1%	0.007	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	73.7	178.7	-167.7	0	0	0	0	109.5	H686 Q690 S691 C693 C699 P735	H686-C688 PolarHBondContact O-N 3.39Å; C688-Q690 PolarHBondContact O-N 2.89Å; C688-S691 CarbonylContact C-O 3.5Å; C688-S691 WeakPolarHBondContact CA-O 3.4Å; C688-S691 PolarHBondContact N-O 2.89Å; C688-S691 PolarHBondContact O-N 3.45Å; C688-C693 VanDerWaalsContact CB-SG 3.54Å; C688-C699 WeakPolarHBondContact CA-SG 3.33Å; C688-C699 HydrophobicContact CB-CB 3.61Å; C688-C699 WeakPolarHBondContact CB-SG 3.26Å; C688-C699 WeakPolarHBondContact SG-CA 3.46Å; C688-C699 WeakPolarHBondContact SG-CB 3.47Å; C688-C699 CovalentContact SG-SG 2.04Å; C688-C699 PolarHBondContact SG-SG 3.38Å; C688-P735 WeakPolarHBondContact O-CB 3.46Å
689	G	65.3	Low	62.5	Low	53 Å²	53	77 Å²	77	55%	0.546	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.8	-109.8	-173.7	0	0	0	0	0	111.8
690	Q	63.4	Low	63.9	Low	150 Å²	150	73.7 Å²	73.7	70%	0.701	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	15.4	178.6	-62.2	176.5	-72.9	0	0	112.5	C688	C688-Q690 PolarHBondContact O-N 2.89Å
691	S	65.2	Low	65.5	Low	24 Å²	24	71.1 Å²	71.1	17%	0.168	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	161.3	-173.5	-66.1	0	0	0	0	111.1	C688	C688-S691 CarbonylContact C-O 3.5Å; C688-S691 WeakPolarHBondContact CA-O 3.4Å; C688-S691 PolarHBondContact N-O 2.89Å; C688-S691 PolarHBondContact O-N 3.45Å
692	V	74.7	Confident	66.6	Low	51 Å²	51	69.3 Å²	69.3	31%	0.309	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	132.1	-177.3	167	0	0	0	0	110	V685 L694 Y747	V685-V692 HydrophobicContact CB-CG1 4.09Å; V685-V692 HydrophobicContact CG1-CB 4.47Å; V685-V692 HydrophobicContact CG1-CG1 3.75Å; V685-V692 HydrophobicContact CG1-CG2 3.93Å; V685-V692 HydrophobicContact CG2-CG1 3.92Å; V692-L694 HydrophobicContact CG1-CD2 3.6Å; V692-L694 HydrophobicContact CG1-CG 4.39Å; V692-Y747 WeakPolarHBondContact O-CB 3.48Å; V692-Y747 VanDerWaalsContact O-CD1 3.27Å; V692-Y747 WeakPolarHBondContact O-CD1 3.06Å
693	C	78.8	Confident	67.5	Low	0 Å²	0	64.4 Å²	64.4	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	127.5	166.2	-54.5	0	0	0	0	110.1	H686 C688 G697 C737	H686-C693 HydrophobicContact CB-CB 4.45Å; H686-C693 PolarHBondContact N-O 3.19Å; H686-C693 VanDerWaalsContact N-O 3.12Å; H686-C693 PolarHBondContact O-N 2.85Å; C688-C693 VanDerWaalsContact CB-SG 3.54Å; C693-G697 WeakPolarHBondContact CB-O 3.29Å; C693-C737 WeakPolarHBondContact CA-SG 2.97Å; C693-C737 HydrophobicContact CB-CB 3.8Å; C693-C737 WeakPolarHBondContact CB-SG 3.35Å; C693-C737 WeakPolarHBondContact SG-CA 3.39Å; C693-C737 WeakPolarHBondContact SG-CB 3.1Å; C693-C737 CovalentContact SG-SG 2.04Å; C693-C737 PolarHBondContact SG-SG 3.02Å
694	L	75.1	Confident	67.6	Low	13 Å²	13	66.7 Å²	66.7	7%	0.068	36%	0.359	C	S	.	.			trans	-98.5	173.2	175.8	-48.6	172.9	0	0	0	110	E683 V692 G696 G697 Y747 E749	E683-L694 HydrophobicContact CB-CD2 4.05Å; V692-L694 HydrophobicContact CG1-CD2 3.6Å; V692-L694 HydrophobicContact CG1-CG 4.39Å; L694-G696 PolarHBondContact O-N 3.22Å; L694-G697 PolarHBondContact O-N 3.31Å; L694-Y747 WeakPolarHBondContact CA-O 3.46Å; L694-Y747 WeakPolarHBondContact CB-O 3.39Å; L694-Y747 WeakPolarHBondContact CG-O 3.31Å; L694-Y747 PolarHBondContact N-O 3.23Å; L694-E749 HydrophobicContact CD1-CB 4.02Å
695	N	70.4	Confident	67.2	Low	50 Å²	50	66 Å²	66	27%	0.267	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	31.5	169.5	-63	-46.2	0	0	0	115.8	Y743 C748	N695-Y743 HydrophobicContact CB-CD1 3.58Å; N695-Y743 HydrophobicContact CB-CD2 4.33Å; N695-Y743 HydrophobicContact CB-CE1 3.62Å; N695-Y743 HydrophobicContact CB-CE2 4.36Å; N695-Y743 HydrophobicContact CB-CG 3.97Å; N695-Y743 VanDerWaalsContact CG-CE1 3.47Å; N695-C748 PolarHBondContact ND2-O 3.18Å
696	G	69.6	Low	66.6	Low	29 Å²	29	69.1 Å²	69.1	30%	0.299	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.6	22.7	-180	0	0	0	0	0	115.1	L694 Q740	L694-G696 PolarHBondContact O-N 3.22Å; G696-Q740 WeakPolarHBondContact O-CG 3.47Å; G696-Q740 PolarHBondContact O-NE2 3.41Å
697	G	76.6	Confident	65.8	Low	2 Å²	2	65 Å²	65	2%	0.021	37%	0.367	C	S	.	.			trans	-64.5	137.4	171.2	0	0	0	0	0	112.6	C693 L694 Q738	C693-G697 WeakPolarHBondContact CB-O 3.29Å; L694-G697 PolarHBondContact O-N 3.31Å; G697-Q738 VanDerWaalsContact CA-O 3.31Å; G697-Q738 WeakPolarHBondContact CA-O 3.31Å
698	E	80.4	Confident	64.6	Low	115 Å²	115	62.1 Å²	62.1	54%	0.537	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	137.3	-178.7	-179.2	174.8	-162	0	0	111.2	V700 Q738	E698-V700 PolarHBondContact O-N 3.12Å; E698-Q738 HydrophobicContact CB-CB 4.37Å; E698-Q738 PolarHBondContact N-O 3.15Å; E698-Q738 WeakPolarHBondContact O-CB 3.45Å; E698-Q738 PolarHBondContact O-N 3.2Å; E698-Q738 PolarHBondContact OE2-NE2 3.1Å
699	C	80.3	Confident	62.9	Low	42 Å²	42	71.2 Å²	71.2	28%	0.284	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	115.8	179.8	-173.2	0	0	0	0	112.2	C688	C688-C699 WeakPolarHBondContact CA-SG 3.33Å; C688-C699 HydrophobicContact CB-CB 3.61Å; C688-C699 WeakPolarHBondContact CB-SG 3.26Å; C688-C699 WeakPolarHBondContact SG-CA 3.46Å; C688-C699 WeakPolarHBondContact SG-CB 3.47Å; C688-C699 CovalentContact SG-SG 2.04Å; C688-C699 PolarHBondContact SG-SG 3.38Å
700	V	80.3	Confident	61.4	Low	37 Å²	37	70.7 Å²	70.7	22%	0.224	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	138.6	-179.8	-65.7	0	0	0	0	112	E698 V702 P735 M736 Q738	E698-V700 PolarHBondContact O-N 3.12Å; V700-V702 HydrophobicContact CG2-CG2 3.98Å; V700-V702 PolarHBondContact O-N 3.36Å; V700-P735 CarbonylContact O-C 3.54Å; V700-P735 WeakPolarHBondContact O-CA 3.27Å; V700-M736 HydrophobicContact CG2-CB 4.31Å; V700-M736 WeakPolarHBondContact CG2-O 3.32Å; V700-M736 PolarHBondContact N-O 3.42Å; V700-M736 PolarHBondContact O-N 2.82Å; V700-Q738 HydrophobicContact CG1-CB 4.09Å; V700-Q738 HydrophobicContact CG2-CB 4.05Å
701	Y	71.4	Confident	60.1	Low	149 Å²	149	70.2 Å²	70.2	58%	0.584	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.4	93.6	179.3	-77.2	-87.7	0	0	0	111.1	R733 P735	Y701-R733 HydrophobicContact CD1-CB 4.33Å; Y701-P735 HydrophobicContact CD1-CB 4.49Å; Y701-P735 HydrophobicContact CE1-CB 4.22Å
702	V	64	Low	58.6	Low	29 Å²	29	72.1 Å²	72.1	18%	0.176	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	143.1	-177	-167.5	0	0	0	0	110.2	V700 L706 V707 R733 V734 M736	V700-V702 HydrophobicContact CG2-CG2 3.98Å; V700-V702 PolarHBondContact O-N 3.36Å; V702-L706 HydrophobicContact CG1-CB 3.77Å; V702-L706 HydrophobicContact CG1-CD2 4.3Å; V702-V707 HydrophobicContact CB-CG2 4.11Å; V702-V707 HydrophobicContact CG1-CG2 3.82Å; V702-R733 CarbonylContact O-C 3.34Å; V702-R733 VanDerWaalsContact O-CA 3.28Å; V702-R733 WeakPolarHBondContact O-CA 3.21Å; V702-V734 PolarHBondContact N-O 3.08Å; V702-V734 PolarHBondContact O-N 3.31Å; V702-M736 HydrophobicContact CB-SD 3.74Å; V702-M736 HydrophobicContact CG1-SD 4.31Å; V702-M736 HydrophobicContact CG2-CB 4.18Å; V702-M736 HydrophobicContact CG2-CE 4.33Å; V702-M736 HydrophobicContact CG2-CG 4.25Å; V702-M736 HydrophobicContact CG2-SD 3.56Å; V702-M736 VanDerWaalsContact CG2-SD 3.56Å
703	T	60.4	Low	56.6	Low	79 Å²	79	71.7 Å²	71.7	49%	0.485	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	143.1	173.9	51.8	0	0	0	0	110.8	G705 L706 N732 R733	T703-G705 PolarHBondContact O-N 3.15Å; T703-L706 PolarHBondContact O-N 3.34Å; T703-N732 WeakPolarHBondContact CA-O 3.4Å; T703-R733 HydrophobicContact CG2-CG 4.21Å
704	K	52.8	Low	54.5	Low	131 Å²	131	76 Å²	76	57%	0.57	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-53.9	-22.5	-174.5	-79.2	-166.2	171.1	-163.7	0	115.5	L706 N732 V734	K704-L706 PolarHBondContact O-N 3.38Å; K704-N732 PolarHBondContact N-O 2.95Å; K704-V734 HydrophobicContact CD-CG2 4.35Å; K704-V734 HydrophobicContact CG-CG2 3.6Å
705	G	43.8	Very low	52.5	Low	77 Å²	77	78.9 Å²	78.9	79%	0.794	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-75.3	1.6	177.6	0	0	0	0	0	116.1	T703	T703-G705 PolarHBondContact O-N 3.15Å
706	L	41.3	Very low	50.8	Low	134 Å²	134	80.4 Å²	80.4	70%	0.702	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-119.4	3.9	-176.7	-134.9	80.2	0	0	0	114.7	V702 T703 K704	V702-L706 HydrophobicContact CG1-CB 3.77Å; V702-L706 HydrophobicContact CG1-CD2 4.3Å; T703-L706 PolarHBondContact O-N 3.34Å; K704-L706 PolarHBondContact O-N 3.38Å
707	V	40.6	Very low	49.2	Very low	25 Å²	25	83 Å²	83	15%	0.152	44%	0.44	C	S	.	.			trans	-113.1	82.5	-164.5	-170.1	0	0	0	0	111.4	V702 I710 M736	V702-V707 HydrophobicContact CB-CG2 4.11Å; V702-V707 HydrophobicContact CG1-CG2 3.82Å; V707-I710 HydrophobicContact CG1-CB 3.88Å; V707-I710 HydrophobicContact CG1-CD1 4.28Å; V707-I710 HydrophobicContact CG1-CG1 4.05Å; V707-M736 HydrophobicContact CB-SD 4.15Å; V707-M736 HydrophobicContact CG1-CE 4.11Å; V707-M736 HydrophobicContact CG1-SD 3.58Å; V707-M736 VanDerWaalsContact CG1-SD 3.58Å; V707-M736 HydrophobicContact CG2-CE 4.49Å; V707-M736 HydrophobicContact CG2-SD 3.43Å; V707-M736 WeakPolarHBondContact CG2-SD 3.4Å
708	T	35.2	Very low	47.2	Very low	113 Å²	113	89.1 Å²	89.1	69%	0.693	48%	0.477	S	S	*	.	S	Bend	trans	-103.2	44.1	-176.1	59.1	0	0	0	0	113.6
709	Y	32.2	Very low	45.2	Very low	193 Å²	193	90.5 Å²	90.5	76%	0.757	49%	0.488	S	S	*	.	S	Bend	trans	-161.8	12.5	167.8	-136.1	-94	0	0	0	115.6
710	I	33.4	Very low	43	Very low	42 Å²	42	92.8 Å²	92.8	22%	0.215	50%	0.504	C	S	.	.			trans	-127.4	92	-174.2	-53.3	-171.1	0	0	0	110.7	V707 M736 L746	V707-I710 HydrophobicContact CG1-CB 3.88Å; V707-I710 HydrophobicContact CG1-CD1 4.28Å; V707-I710 HydrophobicContact CG1-CG1 4.05Å; I710-M736 HydrophobicContact CD1-CE 3.72Å; I710-M736 HydrophobicContact CD1-CG 4.04Å; I710-M736 HydrophobicContact CD1-SD 4.2Å; I710-L746 HydrophobicContact CB-CD1 4.45Å; I710-L746 HydrophobicContact CD1-CD1 4.34Å; I710-L746 HydrophobicContact CD1-CG 4.28Å; I710-L746 HydrophobicContact CG1-CD1 3.88Å; I710-L746 HydrophobicContact CG1-CG 4.27Å; I710-L746 HydrophobicContact CG2-CD1 4.3Å; I710-L746 HydrophobicContact CG2-CD2 4.09Å; I710-L746 HydrophobicContact CG2-CG 4.14Å
711	D	36.7	Very low	40.9	Very low	140 Å²	140	96.1 Å²	96.1	75%	0.749	53%	0.525	S	S	*	.			trans	-158.1	20.1	159.1	-102.6	-25.1	0	0	0	111.8
712	Q	33.8	Very low	39.2	Very low	64 Å²	64	96 Å²	96	30%	0.299	53%	0.534	S	S	.	.	S	Bend	trans	-94.3	-0.5	180	-116.8	-173.1	-26.4	0	0	114.2	F641 Y643 W674	F641-Q712 VanDerWaalsContact CG-NE2 3.31Å; Y643-Q712 VanDerWaalsContact OH-CD 3.26Å; Y643-Q712 VanDerWaalsContact OH-CG 3.26Å; Y643-Q712 WeakPolarHBondContact OH-CG 3.28Å; Y643-Q712 PolarHBondContact OH-NE2 3.45Å; Y643-Q712 PolarHBondContact OH-O 3.49Å; W674-Q712 HydrophobicContact CZ3-CG 4.31Å
713	Y	31.3	Very low	37.9	Very low	41 Å²	41	99.2 Å²	99.2	16%	0.161	56%	0.558	C	S	.	*	S	Bend	trans	-160.5	79.7	-171.4	-111.2	-4.4	0	0	0	109.9	Y661 Q676 Y747	Y661-Y713 HydrophobicContact CD1-CE1 4.07Å; Y661-Y713 HydrophobicContact CE1-CD1 4.18Å; Y661-Y713 AromaticContact CE1-CE1 3.24Å; Y661-Y713 HydrophobicContact CE1-CE1 3.24Å; Y661-Y713 AromaticContact CE1-CZ 3.76Å; Y661-Y713 AromaticContact CZ-CE1 3.55Å; Y661-Y713 AromaticContact CZ-CZ 3.53Å; Y661-Y713 PolarHBondContact OH-OH 2.83Å; Q676-Y713 HydrophobicContact CB-CD1 3.79Å; Q676-Y713 HydrophobicContact CB-CE1 3.84Å; Q676-Y713 HydrophobicContact CG-CD1 3.64Å; Q676-Y713 HydrophobicContact CG-CE1 3.4Å; Q676-Y713 HydrophobicContact CG-CG 4.44Å; Q676-Y713 VanDerWaalsContact OE1-CD1 3.25Å; Y713-Y747 AromaticContact CD2-CE2 3.8Å; Y713-Y747 HydrophobicContact CD2-CE2 3.8Å; Y713-Y747 HydrophobicContact CE2-CE2 4.13Å
714	N	34.8	Very low	36.7	Very low	92 Å²	92	102 Å²	102	49%	0.492	57%	0.57	S	S	.	*			trans	-175.8	84.7	163.3	-101.8	-40.3	0	0	0	109.3
715	N	32.6	Very low	35.9	Very low	72 Å²	72	103.2 Å²	103.2	39%	0.385	58%	0.583	S	S	.	*			trans	-144.7	54.5	173.8	-161	16.2	0	0	0	112.8	D664 K675	D664-N715 PolarHBondContact OD2-ND2 3.04Å; K675-N715 VanDerWaalsContact CE-O 3.29Å; K675-N715 WeakPolarHBondContact CE-O 3.46Å; K675-N715 WeakPolarHBondContact CG-O 3.29Å
716	D	36.5	Very low	35.5	Very low	83 Å²	83	107 Å²	107	44%	0.444	59%	0.585	S	S	.	*			trans	-115.7	91.7	164	-132.2	-26.6	0	0	0	112.7	K675	K675-D716 VanDerWaalsContact CE-OD1 3.24Å; K675-D716 WeakPolarHBondContact CE-OD1 3.47Å; K675-D716 IonicContact NZ-OD1 3.89Å; K675-D716 PolarHBondContact NZ-OD1 2.8Å; K675-D716 IonicContact NZ-OD2 3.66Å; K675-D716 PolarHBondContact NZ-OD2 2.04Å
717	T	34.1	Very low	35.5	Very low	84 Å²	84	104.1 Å²	104.1	52%	0.515	58%	0.576	S	S	.	*			trans	48.9	74.3	131.4	-37.9	0	0	0	0	118.2
718	T	36.4	Very low	35.4	Very low	129 Å²	129	107.9 Å²	107.9	79%	0.791	60%	0.603	S	S	*	*			trans	-95.8	88.5	146.6	42.3	0	0	0	0	110.5	S720	T718-S720 PolarHBondContact O-N 3.48Å
719	N	37	Very low	35.6	Very low	145 Å²	145	113.3 Å²	113.3	78%	0.775	61%	0.613	S	S	*	*			trans	-60.1	123.7	168.5	-98.7	-39.2	0	0	0	110.8
720	S	35.5	Very low	36.2	Very low	90 Å²	90	106.4 Å²	106.4	63%	0.629	60%	0.595	S	S	*	*			trans	63.3	125.7	135	-161.2	0	0	0	0	120.2	T718	T718-S720 PolarHBondContact O-N 3.48Å
721	T	35.3	Very low	36.8	Very low	107 Å²	107	113.7 Å²	113.7	66%	0.656	62%	0.622	S	S	*	*			trans	71.2	131.1	139.2	45.7	0	0	0	0	121.8
722	N	36.5	Very low	37.7	Very low	145 Å²	145	112.2 Å²	112.2	78%	0.775	61%	0.614	S	S	*	*			trans	66.7	115.5	148.9	-51.2	-17.2	0	0	0	116
723	S	35.6	Very low	38.9	Very low	97 Å²	97	116.4 Å²	116.4	68%	0.678	63%	0.627	S	S	*	*			cis	179.6	152	34.9	49.5	0	0	0	0	110.7
724	N	35.8	Very low	40.5	Very low	138 Å²	138	116.5 Å²	116.5	74%	0.738	63%	0.632	S	S	*	*			trans	43.4	98.6	145	-50.3	-6.6	0	0	0	118.6
725	N	35.2	Very low	42.2	Very low	156 Å²	156	113.9 Å²	113.9	83%	0.834	62%	0.62	S	S	*	*				173.4	167.2	106.6	-82.4	-20.9	0	0	0	112.9
726	D	35.5	Very low	44.1	Very low	156 Å²	156	112.6 Å²	112.6	83%	0.834	61%	0.612	S	S	*	*			trans	-48.5	124.6	-171.3	-65.1	-72.3	0	0	0	117.6
727	S	42	Very low	46.2	Very low	75 Å²	75	109.6 Å²	109.6	52%	0.524	60%	0.597	S	S	.	*			trans	-165.2	64.4	140.2	49.3	0	0	0	0	112.3	Y729 A730	S727-Y729 PolarHBondContact O-N 3.11Å; S727-A730 PolarHBondContact O-N 3.2Å
728	S	37.8	Very low	48.4	Very low	103 Å²	103	110.6 Å²	110.6	72%	0.72	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	31.2	-174.2	-169.5	0	0	0	0	116.6
729	Y	40.4	Very low	50.3	Low	227 Å²	227	106.3 Å²	106.3	89%	0.89	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.3	1.6	177.1	-67	-70.2	0	0	0	114.6	S727	S727-Y729 PolarHBondContact O-N 3.11Å
730	A	43.3	Very low	52	Low	48 Å²	48	103.9 Å²	103.9	40%	0.397	56%	0.555	S	S	.	*			trans	-84.3	-27.9	-171.8	0	0	0	0	0	115.6	S727 N732	S727-A730 PolarHBondContact O-N 3.2Å; A730-N732 VanDerWaalsContact C-N 3.29Å; A730-N732 PolarHBondContact O-N 3.04Å
731	Y	47.7	Very low	53.3	Low	195 Å²	195	105.3 Å²	105.3	77%	0.765	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	6.3	-156	-70.3	-80.8	0	0	0	118.3
732	N	54.2	Low	54.4	Low	110 Å²	110	101.6 Å²	101.6	59%	0.588	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.3	14.7	-171.8	-139.9	12.3	0	0	0	115	T703 K704 A730	T703-N732 WeakPolarHBondContact CA-O 3.4Å; K704-N732 PolarHBondContact N-O 2.95Å; A730-N732 VanDerWaalsContact C-N 3.29Å; A730-N732 PolarHBondContact O-N 3.04Å
733	R	59.2	Low	55.7	Low	152 Å²	152	99 Å²	99	57%	0.574	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.3	139.5	174.7	-69.1	-178.9	-66.8	-147.4	-0.6	110.9	Y701 V702 T703	Y701-R733 HydrophobicContact CD1-CB 4.33Å; V702-R733 CarbonylContact O-C 3.34Å; V702-R733 VanDerWaalsContact O-CA 3.28Å; V702-R733 WeakPolarHBondContact O-CA 3.21Å; T703-R733 HydrophobicContact CG2-CG 4.21Å
734	V	65.2	Low	56.9	Low	43 Å²	43	97.3 Å²	97.3	26%	0.261	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	132.4	178.3	-176.6	0	0	0	0	108.2	V702 K704	V702-V734 PolarHBondContact N-O 3.08Å; V702-V734 PolarHBondContact O-N 3.31Å; K704-V734 HydrophobicContact CD-CG2 4.35Å; K704-V734 HydrophobicContact CG-CG2 3.6Å
735	P	70.8	Confident	58.2	Low	37 Å²	37	92 Å²	92	24%	0.24	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	135.1	172.4	31	-33.6	0	0	0	110.5	C688 V700 Y701	C688-P735 WeakPolarHBondContact O-CB 3.46Å; V700-P735 CarbonylContact O-C 3.54Å; V700-P735 WeakPolarHBondContact O-CA 3.27Å; Y701-P735 HydrophobicContact CD1-CB 4.49Å; Y701-P735 HydrophobicContact CE1-CB 4.22Å
736	M	73	Confident	59.9	Low	44 Å²	44	86.5 Å²	86.5	22%	0.217	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	153.8	-179.5	-70.8	175.2	52.8	0	0	111.1	V700 V702 V707 I710	V700-M736 HydrophobicContact CG2-CB 4.31Å; V700-M736 WeakPolarHBondContact CG2-O 3.32Å; V700-M736 PolarHBondContact N-O 3.42Å; V700-M736 PolarHBondContact O-N 2.82Å; V702-M736 HydrophobicContact CB-SD 3.74Å; V702-M736 HydrophobicContact CG1-SD 4.31Å; V702-M736 HydrophobicContact CG2-CB 4.18Å; V702-M736 HydrophobicContact CG2-CE 4.33Å; V702-M736 HydrophobicContact CG2-CG 4.25Å; V702-M736 HydrophobicContact CG2-SD 3.56Å; V702-M736 VanDerWaalsContact CG2-SD 3.56Å; V707-M736 HydrophobicContact CB-SD 4.15Å; V707-M736 HydrophobicContact CG1-CE 4.11Å; V707-M736 HydrophobicContact CG1-SD 3.58Å; V707-M736 VanDerWaalsContact CG1-SD 3.58Å; V707-M736 HydrophobicContact CG2-CE 4.49Å; V707-M736 HydrophobicContact CG2-SD 3.43Å; V707-M736 WeakPolarHBondContact CG2-SD 3.4Å; I710-M736 HydrophobicContact CD1-CE 3.72Å; I710-M736 HydrophobicContact CD1-CG 4.04Å; I710-M736 HydrophobicContact CD1-SD 4.2Å
737	C	79.5	Confident	61.9	Low	21 Å²	21	80.3 Å²	80.3	14%	0.142	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	114.7	177.3	-59.9	0	0	0	0	111.7	C693 C739	C693-C737 WeakPolarHBondContact CA-SG 2.97Å; C693-C737 HydrophobicContact CB-CB 3.8Å; C693-C737 WeakPolarHBondContact CB-SG 3.35Å; C693-C737 WeakPolarHBondContact SG-CA 3.39Å; C693-C737 WeakPolarHBondContact SG-CB 3.1Å; C693-C737 CovalentContact SG-SG 2.04Å; C693-C737 PolarHBondContact SG-SG 3.02Å; C737-C739 PolarHBondContact O-N 2.76Å
738	Q	81.2	Confident	63.5	Low	104 Å²	104	76.8 Å²	76.8	49%	0.486	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	101.7	170.3	-177.1	177.8	-77.9	0	0	109.2	G697 E698 V700	G697-Q738 VanDerWaalsContact CA-O 3.31Å; G697-Q738 WeakPolarHBondContact CA-O 3.31Å; E698-Q738 HydrophobicContact CB-CB 4.37Å; E698-Q738 PolarHBondContact N-O 3.15Å; E698-Q738 WeakPolarHBondContact O-CB 3.45Å; E698-Q738 PolarHBondContact O-N 3.2Å; E698-Q738 PolarHBondContact OE2-NE2 3.1Å; V700-Q738 HydrophobicContact CG1-CB 4.09Å; V700-Q738 HydrophobicContact CG2-CB 4.05Å
739	C	75.7	Confident	65	Low	39 Å²	39	76.2 Å²	76.2	26%	0.264	39%	0.385	S	S	.	.			trans	-72.7	148.8	-173.5	-55.8	0	0	0	0	114.2	C737 C748	C737-C739 PolarHBondContact O-N 2.76Å; C739-C748 WeakPolarHBondContact CA-SG 3.22Å; C739-C748 HydrophobicContact CB-CB 3.79Å; C739-C748 WeakPolarHBondContact CB-SG 3.31Å; C739-C748 WeakPolarHBondContact SG-CA 3.34Å; C739-C748 WeakPolarHBondContact SG-CB 3.34Å; C739-C748 CovalentContact SG-SG 2.04Å; C739-C748 PolarHBondContact SG-SG 3.47Å
740	Q	73.4	Confident	66.2	Low	94 Å²	94	68.9 Å²	68.9	44%	0.439	36%	0.361	S	S	.	.			trans	-68.4	147.8	170.9	-62.7	-61.8	-27.6	0	0	111.2	G696 G742 Y743	G696-Q740 WeakPolarHBondContact O-CG 3.47Å; G696-Q740 PolarHBondContact O-NE2 3.41Å; Q740-G742 PolarHBondContact O-N 3.49Å; Q740-Y743 HydrophobicContact CB-CD2 4.19Å; Q740-Y743 PolarHBondContact O-N 3.49Å; Q740-Y743 VanDerWaalsContact O-N 3.07Å
741	P	63	Low	67.1	Low	121 Å²	121	70.1 Å²	70.1	79%	0.786	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	109.9	176.7	-25.6	34.9	0	0	0	112.3
742	G	57	Low	68	Low	29 Å²	29	61.8 Å²	61.8	30%	0.299	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	134.9	-27.6	-173.1	0	0	0	0	0	113.2	Q740	Q740-G742 PolarHBondContact O-N 3.49Å
743	Y	64.6	Low	68.7	Low	91 Å²	91	60.7 Å²	60.7	36%	0.357	34%	0.335	S	S	.	.			trans	-115.1	152	-172.9	-58.5	-92.4	0	0	0	112.3	N695 Q740 L750 T751	N695-Y743 HydrophobicContact CB-CD1 3.58Å; N695-Y743 HydrophobicContact CB-CD2 4.33Å; N695-Y743 HydrophobicContact CB-CE1 3.62Å; N695-Y743 HydrophobicContact CB-CE2 4.36Å; N695-Y743 HydrophobicContact CB-CG 3.97Å; N695-Y743 VanDerWaalsContact CG-CE1 3.47Å; Q740-Y743 HydrophobicContact CB-CD2 4.19Å; Q740-Y743 PolarHBondContact O-N 3.49Å; Q740-Y743 VanDerWaalsContact O-N 3.07Å; Y743-L750 WeakPolarHBondContact CA-O 3.44Å; Y743-T751 HydrophobicContact CD1-CG2 3.29Å; Y743-T751 HydrophobicContact CE1-CG2 3.5Å; Y743-T751 HydrophobicContact CG-CG2 4.08Å
744	T	59.6	Low	69.7	Low	61 Å²	61	56.5 Å²	56.5	37%	0.374	32%	0.319	S	S	.	.	B	Isolated β-bridge	trans	-151.8	-178.8	179.4	-171.8	0	0	0	0	111.1	C748 E749 L750 I783	T744-C748 CarbonylContact O-C 3.59Å; T744-C748 WeakPolarHBondContact O-CA 3.33Å; T744-E749 PolarHBondContact O-N 2.81Å; T744-E749 VanDerWaalsContact O-N 3.17Å; T744-L750 HydrophobicContact CG2-CB 3.85Å; T744-L750 PolarHBondContact N-O 3.31Å; T744-L750 WeakPolarHBondContact O-CB 3.48Å; T744-L750 PolarHBondContact O-N 3.38Å; T744-I783 HydrophobicContact CG2-CB 4.47Å; T744-I783 HydrophobicContact CG2-CD1 4.12Å; T744-I783 HydrophobicContact CG2-CG2 3.87Å
745	G	64.8	Low	70.7	Confident	26 Å²	26	55.5 Å²	55.5	27%	0.268	31%	0.314	S	S	.	.	S	Bend	trans	85.7	164.2	-168.5	0	0	0	0	0	113	Y747 C748	G745-Y747 PolarHBondContact O-N 3.48Å; G745-Y747 VanDerWaalsContact O-N 3.12Å; G745-C748 PolarHBondContact O-N 3.27Å; G745-C748 VanDerWaalsContact O-N 3.07Å
746	L	70	Confident	71.5	Confident	40 Å²	40	60.9 Å²	60.9	21%	0.209	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.9	-42.7	-173.4	-114.6	71.6	0	0	0	113.4	I710	I710-L746 HydrophobicContact CB-CD1 4.45Å; I710-L746 HydrophobicContact CD1-CD1 4.34Å; I710-L746 HydrophobicContact CD1-CG 4.28Å; I710-L746 HydrophobicContact CG1-CD1 3.88Å; I710-L746 HydrophobicContact CG1-CG 4.27Å; I710-L746 HydrophobicContact CG2-CD1 4.3Å; I710-L746 HydrophobicContact CG2-CD2 4.09Å; I710-L746 HydrophobicContact CG2-CG 4.14Å
747	Y	78	Confident	72.3	Confident	27 Å²	27	62.6 Å²	62.6	11%	0.106	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	10.7	-173.2	-47	-61	0	0	0	112.6	Q676 V692 L694 Y713 G745	Q676-Y747 PolarHBondContact NE2-OH 2.97Å; V692-Y747 WeakPolarHBondContact O-CB 3.48Å; V692-Y747 VanDerWaalsContact O-CD1 3.27Å; V692-Y747 WeakPolarHBondContact O-CD1 3.06Å; L694-Y747 WeakPolarHBondContact CA-O 3.46Å; L694-Y747 WeakPolarHBondContact CB-O 3.39Å; L694-Y747 WeakPolarHBondContact CG-O 3.31Å; L694-Y747 PolarHBondContact N-O 3.23Å; Y713-Y747 AromaticContact CD2-CE2 3.8Å; Y713-Y747 HydrophobicContact CD2-CE2 3.8Å; Y713-Y747 HydrophobicContact CE2-CE2 4.13Å; G745-Y747 PolarHBondContact O-N 3.48Å; G745-Y747 VanDerWaalsContact O-N 3.12Å
748	C	74.7	Confident	72.9	Confident	1 Å²	1	66 Å²	66	1%	0.007	36%	0.361	C	S	.	.	S	Bend	trans	65.3	31.8	-172.8	-45.9	0	0	0	0	114.6	N695 C739 T744 G745	N695-C748 PolarHBondContact ND2-O 3.18Å; C739-C748 WeakPolarHBondContact CA-SG 3.22Å; C739-C748 HydrophobicContact CB-CB 3.79Å; C739-C748 WeakPolarHBondContact CB-SG 3.31Å; C739-C748 WeakPolarHBondContact SG-CA 3.34Å; C739-C748 WeakPolarHBondContact SG-CB 3.34Å; C739-C748 CovalentContact SG-SG 2.04Å; C739-C748 PolarHBondContact SG-SG 3.47Å; T744-C748 CarbonylContact O-C 3.59Å; T744-C748 WeakPolarHBondContact O-CA 3.33Å; G745-C748 PolarHBondContact O-N 3.27Å; G745-C748 VanDerWaalsContact O-N 3.07Å
749	E	70.2	Confident	73.3	Confident	90 Å²	90	66.6 Å²	66.6	42%	0.421	38%	0.377	S	S	.	.			trans	-85	-19.8	-174.6	72.3	-158.3	132.1	0	0	114.8	L694 T744	L694-E749 HydrophobicContact CD1-CB 4.02Å; T744-E749 PolarHBondContact O-N 2.81Å; T744-E749 VanDerWaalsContact O-N 3.17Å
750	L	66.1	Low	74.1	Confident	74 Å²	74	68 Å²	68	39%	0.387	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-101.3	138.7	-170.1	-57.2	172.8	0	0	0	111.9	Y743 T744 I783	Y743-L750 WeakPolarHBondContact CA-O 3.44Å; T744-L750 HydrophobicContact CG2-CB 3.85Å; T744-L750 PolarHBondContact N-O 3.31Å; T744-L750 WeakPolarHBondContact O-CB 3.48Å; T744-L750 PolarHBondContact O-N 3.38Å; L750-I783 HydrophobicContact CB-CD1 4.28Å; L750-I783 HydrophobicContact CD1-CD1 3.43Å; L750-I783 VanDerWaalsContact CD1-CD1 3.43Å; L750-I783 HydrophobicContact CG-CD1 4.43Å
751	T	62.1	Low	75	Confident	73 Å²	73	65.5 Å²	65.5	45%	0.448	37%	0.37	S	S	.	.			trans	-141.1	140.6	176.1	61.4	0	0	0	0	111.5	Y743	Y743-T751 HydrophobicContact CD1-CG2 3.29Å; Y743-T751 HydrophobicContact CE1-CG2 3.5Å; Y743-T751 HydrophobicContact CG-CG2 4.08Å
752	G	65.6	Low	76.4	Confident	21 Å²	21	66 Å²	66	22%	0.216	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-94.3	130.8	170.4	0	0	0	0	0	111.3
753	V	69.8	Low	77.9	Confident	87 Å²	87	66 Å²	66	53%	0.527	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	123.7	-176.9	-178.9	0	0	0	0	111	Y780 C785	V753-Y780 PolarHBondContact N-O 3.09Å; V753-Y780 PolarHBondContact O-N 3.25Å; V753-C785 VanDerWaalsContact C-SG 3.53Å; V753-C785 PolarHBondContact N-SG 3.46Å; V753-C785 VanDerWaalsContact N-SG 3.44Å; V753-C785 PolarHBondContact O-SG 3.26Å; V753-C785 VanDerWaalsContact O-SG 3.4Å
754	W	80.5	Confident	79	Confident	64 Å²	64	68.1 Å²	68.1	24%	0.242	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	141.8	173.3	-74.3	108.9	0	0	0	112.3	R777 C779 C785 I786 G787	W754-R777 HydrophobicContact CD2-CG 4.37Å; W754-R777 HydrophobicContact CE3-CB 4.39Å; W754-R777 VanDerWaalsContact CE3-CD 3.43Å; W754-R777 HydrophobicContact CE3-CG 3.56Å; W754-R777 HydrophobicContact CZ3-CG 3.81Å; W754-C779 HydrophobicContact CE3-CB 4.38Å; W754-C779 HydrophobicContact CZ3-CB 4.16Å; W754-C785 HydrophobicContact CD2-CB 3.69Å; W754-C785 HydrophobicContact CE3-CB 4.19Å; W754-C785 HydrophobicContact CG-CB 4.18Å; W754-C785 HydrophobicContact CH2-CB 3.98Å; W754-C785 HydrophobicContact CZ2-CB 3.45Å; W754-C785 VanDerWaalsContact CZ2-CB 3.45Å; W754-C785 WeakPolarHBondContact CZ2-O 3.03Å; W754-C785 HydrophobicContact CZ3-CB 4.33Å; W754-I786 PolarHBondContact NE1-O 3.2Å; W754-G787 WeakPolarHBondContact CZ2-O 3.44Å
755	S	85.5	Confident	80.1	Confident	22 Å²	22	68.8 Å²	68.8	15%	0.154	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-67.6	164.7	163.2	81.6	0	0	0	0	111.6	S778 Y780	S755-S778 PolarHBondContact N-O 2.81Å; S755-S778 PolarHBondContact OG-N 3.18Å; S755-S778 PolarHBondContact OG-O 3.05Å; S755-Y780 VanDerWaalsContact CB-CE2 3.48Å
756	D	86.6	Confident	81	Confident	150 Å²	150	72.9 Å²	72.9	80%	0.802	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-52.9	154.3	159.5	-78.7	-51.1	0	0	0	111.8
757	W	90.4	Very high	81.8	Confident	79 Å²	79	73.1 Å²	73.1	30%	0.299	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-78.1	132.5	175.5	-78	103.3	0	0	0	111.8	R775 L776 R777 E791	W757-R775 HydrophobicContact CD2-CG 4.24Å; W757-R775 HydrophobicContact CE3-CB 4.19Å; W757-R775 HydrophobicContact CE3-CG 3.58Å; W757-R775 HydrophobicContact CZ3-CG 3.9Å; W757-L776 VanDerWaalsContact CE3-C 3.5Å; W757-R777 HydrophobicContact CD2-CB 4.11Å; W757-R777 HydrophobicContact CD2-CG 4.12Å; W757-R777 HydrophobicContact CE3-CB 3.86Å; W757-R777 HydrophobicContact CE3-CG 3.84Å; W757-R777 HydrophobicContact CH2-CG 3.82Å; W757-R777 HydrophobicContact CZ2-CG 4.09Å; W757-R777 VanDerWaalsContact CZ2-NE 3.3Å; W757-R777 HydrophobicContact CZ3-CB 4.18Å; W757-R777 HydrophobicContact CZ3-CG 3.68Å; W757-E791 HydrophobicContact CH2-CB 3.78Å; W757-E791 HydrophobicContact CZ2-CB 4.46Å; W757-E791 HydrophobicContact CZ3-CB 3.99Å
758	N	91.3	Very high	82	Confident	92 Å²	92	72.8 Å²	72.8	49%	0.492	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-60.8	154.7	167.3	-64.4	-11.8	0	0	0	111.3	R775 L776	N758-R775 WeakPolarHBondContact O-CB 3.4Å; N758-L776 VanDerWaalsContact CB-O 3.31Å; N758-L776 WeakPolarHBondContact CB-O 3.04Å; N758-L776 PolarHBondContact N-O 3.01Å
759	S	90.8	Very high	82.2	Confident	117 Å²	117	80.3 Å²	80.3	82%	0.818	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-53.1	142.9	171.3	-63.1	0	0	0	0	112.4
760	W	93	Very high	82.8	Confident	69 Å²	69	83.6 Å²	83.6	26%	0.261	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-60.4	140.1	173.5	-74.9	101.9	0	0	0	112.2	R773 S774 R775 E791 Q793	W760-R773 HydrophobicContact CD2-CG 4.3Å; W760-R773 HydrophobicContact CE3-CB 4.22Å; W760-R773 HydrophobicContact CE3-CG 3.63Å; W760-R773 HydrophobicContact CZ3-CG 4.07Å; W760-S774 WeakPolarHBondContact CA-O 3.28Å; W760-S774 VanDerWaalsContact CE3-C 3.45Å; W760-R775 HydrophobicContact CD2-CB 4.13Å; W760-R775 HydrophobicContact CD2-CG 4.03Å; W760-R775 HydrophobicContact CE3-CB 4.03Å; W760-R775 HydrophobicContact CE3-CG 3.95Å; W760-R775 HydrophobicContact CH2-CG 3.85Å; W760-R775 HydrophobicContact CZ2-CG 3.92Å; W760-R775 HydrophobicContact CZ3-CB 4.37Å; W760-R775 HydrophobicContact CZ3-CG 3.87Å; W760-E791 HydrophobicContact CH2-CB 4.27Å; W760-E791 HydrophobicContact CH2-CG 3.89Å; W760-E791 VanDerWaalsContact CH2-OE1 3.28Å; W760-E791 WeakPolarHBondContact CH2-OE1 3.44Å; W760-E791 WeakPolarHBondContact CZ2-OE1 3.38Å; W760-Q793 HydrophobicContact CH2-CB 3.58Å; W760-Q793 HydrophobicContact CZ2-CB 4.36Å; W760-Q793 HydrophobicContact CZ3-CB 3.72Å
761	S	92.1	Very high	83.9	Confident	42 Å²	42	81.2 Å²	81.2	29%	0.294	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-65	164.4	170.7	80.7	0	0	0	0	112.6	R773 S774	S761-R773 WeakPolarHBondContact O-CB 3.03Å; S761-R773 WeakPolarHBondContact OG-CA 3.22Å; S761-S774 PolarHBondContact N-O 2.74Å; S761-S774 PolarHBondContact OG-N 3.34Å
762	D	91.2	Very high	85.1	Confident	132 Å²	132	82.3 Å²	82.3	71%	0.706	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-58.7	152.6	160.9	-85.2	-52.4	0	0	0	112	Q764	D762-Q764 PolarHBondContact O-N 2.86Å
763	C	89.4	Confident	86.4	Confident	29 Å²	29	85.1 Å²	85.1	20%	0.196	44%	0.443	C	S	.	.			trans	-78.8	99.8	-179.7	-73.1	0	0	0	0	112.2	P765 R771 Y772 C795	C763-P765 CarbonylContact O-C 3.37Å; C763-R771 PolarHBondContact O-NH2 3.31Å; C763-Y772 CarbonylContact C-O 3.11Å; C763-Y772 WeakPolarHBondContact CA-O 3.44Å; C763-C795 HydrophobicContact CB-CB 3.57Å; C763-C795 WeakPolarHBondContact CB-SG 3.07Å; C763-C795 WeakPolarHBondContact SG-CB 3.04Å; C763-C795 CovalentContact SG-SG 2.03Å; C763-C795 PolarHBondContact SG-SG 3.43Å
764	Q	86.8	Confident	87.3	Confident	135 Å²	135	83.1 Å²	83.1	63%	0.631	43%	0.434	S	S	*	.	B	Isolated β-bridge	trans	-100.1	141.4	-178.1	-63.4	178.7	-4.1	0	0	112	D762 R771 Y772	D762-Q764 PolarHBondContact O-N 2.86Å; Q764-R771 WeakPolarHBondContact O-CA 3.23Å; Q764-Y772 PolarHBondContact N-O 2.76Å; Q764-Y772 PolarHBondContact O-N 3.37Å
765	P	84.3	Confident	88	Confident	75 Å²	75	83 Å²	83	49%	0.487	43%	0.433	S	S	.	.	S	Bend	cis	-62.6	159.1	-15.3	28.1	-36.1	0	0	0	112.4	C763 C767 R771	C763-P765 CarbonylContact O-C 3.37Å; P765-C767 WeakPolarHBondContact CG-O 3.48Å; P765-C767 PolarHBondContact O-N 2.8Å; P765-C767 VanDerWaalsContact O-N 3.11Å; P765-R771 WeakPolarHBondContact O-CG 3.31Å; P765-R771 PolarHBondContact O-NE 3.36Å
766	N	83.3	Confident	88.2	Confident	112 Å²	112	86.2 Å²	86.2	60%	0.599	45%	0.448	S	S	*	.	S	Bend	trans	-64.5	-18.4	-174.4	-109	-33.7	0	0	0	114.6	R771 R798	N766-R771 PolarHBondContact O-NH2 3.43Å; N766-R798 WeakPolarHBondContact O-CD 3.38Å; N766-R798 PolarHBondContact O-NH1 3.18Å
767	C	86.2	Confident	88.2	Confident	44 Å²	44	81.6 Å²	81.6	30%	0.297	42%	0.419	S	S	.	.	S	Bend	trans	-143.5	160.2	169.2	74.1	0	0	0	0	109.5	P765 R798 C800	P765-C767 WeakPolarHBondContact CG-O 3.48Å; P765-C767 PolarHBondContact O-N 2.8Å; P765-C767 VanDerWaalsContact O-N 3.11Å; C767-R798 CarbonylContact C-O 3.6Å; C767-R798 WeakPolarHBondContact CA-O 3.28Å; C767-R798 WeakPolarHBondContact CB-O 3.43Å; C767-C800 HydrophobicContact CB-CB 3.93Å; C767-C800 WeakPolarHBondContact CB-SG 3.45Å; C767-C800 WeakPolarHBondContact SG-CA 3.27Å; C767-C800 WeakPolarHBondContact SG-CB 3.5Å; C767-C800 CovalentContact SG-SG 2.04Å; C767-C800 PolarHBondContact SG-SG 3.47Å
768	G	81.8	Confident	88	Confident	21 Å²	21	80.8 Å²	80.8	22%	0.216	43%	0.426	C	S	.	.	B	Isolated β-bridge	trans	137.5	173.9	-176.7	0	0	0	0	0	112.6	P797 R798 C800	G768-P797 WeakPolarHBondContact O-CA 3.39Å; G768-R798 PolarHBondContact N-O 2.96Å; G768-R798 PolarHBondContact O-N 3.38Å; G768-C800 PolarHBondContact N-SG 2.86Å
769	L	79.2	Confident	87.4	Confident	158 Å²	158	78.8 Å²	78.8	83%	0.827	42%	0.419	S	S	*	.	S	Bend	trans	-83.7	-43.8	173.8	-66.8	175.7	0	0	0	112	P797	L769-P797 HydrophobicContact CD2-CB 4.28Å
770	K	82	Confident	86.5	Confident	159 Å²	159	80 Å²	80	69%	0.691	41%	0.406	S	S	*	.	S	Bend	trans	-94.2	122.6	169.5	-67.1	-174.9	174.6	-172.2	0	108.6	Y772	K770-Y772 HydrophobicContact CB-CE2 3.93Å
771	R	89.6	Confident	84.9	Confident	24 Å²	24	79.2 Å²	79.2	9%	0.091	42%	0.419	C	S	.	.			trans	-146.9	140.9	-179.9	-61	-179.7	65.3	-136.6	-0.6	108.1	C763 Q764 P765 N766 C795 P796	C763-R771 PolarHBondContact O-NH2 3.31Å; Q764-R771 WeakPolarHBondContact O-CA 3.23Å; P765-R771 WeakPolarHBondContact O-CG 3.31Å; P765-R771 PolarHBondContact O-NE 3.36Å; N766-R771 PolarHBondContact O-NH2 3.43Å; R771-C795 HydrophobicContact CB-CB 3.87Å; R771-C795 PolarHBondContact O-N 2.87Å; R771-P796 WeakPolarHBondContact CD-O 3.27Å; R771-P796 PolarHBondContact NH1-O 3.24Å
772	Y	87.8	Confident	83	Confident	96 Å²	96	85.8 Å²	85.8	38%	0.376	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	151.6	-171.6	-55.8	-86.4	0	0	0	111.2	C763 Q764 K770 I792 Q793 N794	C763-Y772 CarbonylContact C-O 3.11Å; C763-Y772 WeakPolarHBondContact CA-O 3.44Å; Q764-Y772 PolarHBondContact N-O 2.76Å; Q764-Y772 PolarHBondContact O-N 3.37Å; K770-Y772 HydrophobicContact CB-CE2 3.93Å; Y772-I792 HydrophobicContact CD1-CG2 4.09Å; Y772-I792 HydrophobicContact CG-CG2 4.47Å; Y772-Q793 WeakPolarHBondContact CA-O 3.44Å; Y772-N794 WeakPolarHBondContact CD1-OD1 3.47Å; Y772-N794 WeakPolarHBondContact CE1-OD1 3.49Å
773	R	92.2	Very high	81.2	Confident	80 Å²	80	83.1 Å²	83.1	30%	0.302	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	155.3	164.2	60.5	179.7	-169.4	167.5	0.6	109.7	W760 S761 I792 Q793	W760-R773 HydrophobicContact CD2-CG 4.3Å; W760-R773 HydrophobicContact CE3-CB 4.22Å; W760-R773 HydrophobicContact CE3-CG 3.63Å; W760-R773 HydrophobicContact CZ3-CG 4.07Å; S761-R773 WeakPolarHBondContact O-CB 3.03Å; S761-R773 WeakPolarHBondContact OG-CA 3.22Å; R773-I792 CarbonylContact O-C 3.49Å; R773-I792 WeakPolarHBondContact O-CA 3.46Å; R773-Q793 HydrophobicContact CG-CB 4.21Å; R773-Q793 VanDerWaalsContact CZ-OE1 3.27Å; R773-Q793 PolarHBondContact N-O 3.37Å; R773-Q793 PolarHBondContact O-N 3.33Å
774	S	90.4	Very high	79.6	Confident	46 Å²	46	84.6 Å²	84.6	32%	0.322	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	160.2	179.6	58.7	0	0	0	0	112.8	W760 S761 E791	W760-S774 WeakPolarHBondContact CA-O 3.28Å; W760-S774 VanDerWaalsContact CE3-C 3.45Å; S761-S774 PolarHBondContact N-O 2.74Å; S761-S774 PolarHBondContact OG-N 3.34Å; S774-E791 CarbonylContact C-O 3.43Å; S774-E791 WeakPolarHBondContact CA-O 3.47Å; S774-E791 WeakPolarHBondContact CB-O 3.03Å
775	R	93.5	Very high	78.7	Confident	61 Å²	61	79 Å²	79	23%	0.23	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	162.2	167.9	60.9	172.3	-176.4	172	-2.3	110.9	W757 N758 W760 K790 E791	W757-R775 HydrophobicContact CD2-CG 4.24Å; W757-R775 HydrophobicContact CE3-CB 4.19Å; W757-R775 HydrophobicContact CE3-CG 3.58Å; W757-R775 HydrophobicContact CZ3-CG 3.9Å; N758-R775 WeakPolarHBondContact O-CB 3.4Å; W760-R775 HydrophobicContact CD2-CB 4.13Å; W760-R775 HydrophobicContact CD2-CG 4.03Å; W760-R775 HydrophobicContact CE3-CB 4.03Å; W760-R775 HydrophobicContact CE3-CG 3.95Å; W760-R775 HydrophobicContact CH2-CG 3.85Å; W760-R775 HydrophobicContact CZ2-CG 3.92Å; W760-R775 HydrophobicContact CZ3-CB 4.37Å; W760-R775 HydrophobicContact CZ3-CG 3.87Å; R775-K790 WeakPolarHBondContact O-CA 3.2Å; R775-E791 HydrophobicContact CG-CB 3.87Å; R775-E791 IonicContact CZ-OE2 2.66Å; R775-E791 PolarHBondContact N-O 2.9Å; R775-E791 IonicContact NE-OE1 3.92Å; R775-E791 IonicContact NE-OE2 2.8Å; R775-E791 PolarHBondContact NE-OE2 3.02Å; R775-E791 IonicContact NH2-OE1 3.73Å; R775-E791 IonicContact NH2-OE2 2.72Å; R775-E791 PolarHBondContact NH2-OE2 3.18Å; R775-E791 PolarHBondContact O-N 3.31Å
776	L	89.7	Confident	77.6	Confident	90 Å²	90	80.6 Å²	80.6	47%	0.471	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	155.2	-174.4	-65.5	171.5	0	0	0	111	W757 N758 G789 K790	W757-L776 VanDerWaalsContact CE3-C 3.5Å; N758-L776 VanDerWaalsContact CB-O 3.31Å; N758-L776 WeakPolarHBondContact CB-O 3.04Å; N758-L776 PolarHBondContact N-O 3.01Å; L776-G789 CarbonylContact C-O 3.51Å; L776-G789 VanDerWaalsContact CA-O 3.29Å; L776-G789 WeakPolarHBondContact CA-O 3.44Å; L776-K790 HydrophobicContact CD2-CB 3.8Å; L776-K790 HydrophobicContact CD2-CG 3.91Å
777	R	87.9	Confident	76.9	Confident	52 Å²	52	77.9 Å²	77.9	20%	0.196	43%	0.433	C	S	.	.			trans	-145.1	153.5	169.4	59.1	175.7	177.5	162.6	7.4	110.1	W754 W757 S788 G789	W754-R777 HydrophobicContact CD2-CG 4.37Å; W754-R777 HydrophobicContact CE3-CB 4.39Å; W754-R777 VanDerWaalsContact CE3-CD 3.43Å; W754-R777 HydrophobicContact CE3-CG 3.56Å; W754-R777 HydrophobicContact CZ3-CG 3.81Å; W757-R777 HydrophobicContact CD2-CB 4.11Å; W757-R777 HydrophobicContact CD2-CG 4.12Å; W757-R777 HydrophobicContact CE3-CB 3.86Å; W757-R777 HydrophobicContact CE3-CG 3.84Å; W757-R777 HydrophobicContact CH2-CG 3.82Å; W757-R777 HydrophobicContact CZ2-CG 4.09Å; W757-R777 VanDerWaalsContact CZ2-NE 3.3Å; W757-R777 HydrophobicContact CZ3-CB 4.18Å; W757-R777 HydrophobicContact CZ3-CG 3.68Å; R777-S788 VanDerWaalsContact CZ-O 3.31Å; R777-S788 PolarHBondContact NE-O 2.8Å; R777-S788 PolarHBondContact NH2-O 3.35Å; R777-G789 PolarHBondContact N-O 3.31Å
778	S	85.3	Confident	76.3	Confident	63 Å²	63	79.1 Å²	79.1	44%	0.441	44%	0.443	S	S	.	.			trans	-98.5	155.3	178.1	-61.3	0	0	0	0	111.3	S755	S755-S778 PolarHBondContact N-O 2.81Å; S755-S778 PolarHBondContact OG-N 3.18Å; S755-S778 PolarHBondContact OG-O 3.05Å
779	C	78.1	Confident	76.4	Confident	50 Å²	50	79.3 Å²	79.3	34%	0.338	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	144.5	169.8	177.7	0	0	0	0	110.4	W754 C785	W754-C779 HydrophobicContact CE3-CB 4.38Å; W754-C779 HydrophobicContact CZ3-CB 4.16Å; C779-C785 WeakPolarHBondContact CA-SG 3.46Å; C779-C785 HydrophobicContact CB-CB 3.78Å; C779-C785 WeakPolarHBondContact CB-SG 2.99Å; C779-C785 WeakPolarHBondContact SG-CB 3.27Å; C779-C785 PolarHBondContact SG-N 2.91Å; C779-C785 CovalentContact SG-SG 2.03Å; C779-C785 PolarHBondContact SG-SG 3.31Å
780	Y	72	Confident	76.9	Confident	143 Å²	143	77.7 Å²	77.7	56%	0.561	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.4	126.9	172.7	-56.1	-61.2	0	0	0	110.1	V753 S755	V753-Y780 PolarHBondContact N-O 3.09Å; V753-Y780 PolarHBondContact O-N 3.25Å; S755-Y780 VanDerWaalsContact CB-CE2 3.48Å
781	G	61.1	Low	77.3	Confident	52 Å²	52	73 Å²	73	54%	0.536	41%	0.412	S	S	.	.	S	Bend	trans	134.5	154.3	-176.7	0	0	0	0	0	111.1	I783	G781-I783 PolarHBondContact O-N 2.73Å
782	D	51.7	Low	77.3	Confident	180 Å²	180	76.7 Å²	76.7	96%	0.963	43%	0.432	S	S	*	.	S	Bend	trans	-74.7	-9.7	-177.5	-54.6	-55.7	0	0	0	112.9
783	I	52.4	Low	77.4	Confident	75 Å²	75	75.9 Å²	75.9	39%	0.385	43%	0.432	S	S	.	.	S	Bend	trans	-124	137.8	173.1	-55.7	-179.9	0	0	0	109.2	T744 L750 G781	T744-I783 HydrophobicContact CG2-CB 4.47Å; T744-I783 HydrophobicContact CG2-CD1 4.12Å; T744-I783 HydrophobicContact CG2-CG2 3.87Å; L750-I783 HydrophobicContact CB-CD1 4.28Å; L750-I783 HydrophobicContact CD1-CD1 3.43Å; L750-I783 VanDerWaalsContact CD1-CD1 3.43Å; L750-I783 HydrophobicContact CG-CD1 4.43Å; G781-I783 PolarHBondContact O-N 2.73Å
784	G	57.4	Low	77.3	Confident	61 Å²	61	77.9 Å²	77.9	63%	0.629	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-60.2	142.6	-171.8	0	0	0	0	0	115
785	C	67.4	Low	77.3	Confident	17 Å²	17	76.2 Å²	76.2	12%	0.115	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-78.1	141.3	-177.8	-56.3	0	0	0	0	111.8	V753 W754 C779	V753-C785 VanDerWaalsContact C-SG 3.53Å; V753-C785 PolarHBondContact N-SG 3.46Å; V753-C785 VanDerWaalsContact N-SG 3.44Å; V753-C785 PolarHBondContact O-SG 3.26Å; V753-C785 VanDerWaalsContact O-SG 3.4Å; W754-C785 HydrophobicContact CD2-CB 3.69Å; W754-C785 HydrophobicContact CE3-CB 4.19Å; W754-C785 HydrophobicContact CG-CB 4.18Å; W754-C785 HydrophobicContact CH2-CB 3.98Å; W754-C785 HydrophobicContact CZ2-CB 3.45Å; W754-C785 VanDerWaalsContact CZ2-CB 3.45Å; W754-C785 WeakPolarHBondContact CZ2-O 3.03Å; W754-C785 HydrophobicContact CZ3-CB 4.33Å; C779-C785 WeakPolarHBondContact CA-SG 3.46Å; C779-C785 HydrophobicContact CB-CB 3.78Å; C779-C785 WeakPolarHBondContact CB-SG 2.99Å; C779-C785 WeakPolarHBondContact SG-CB 3.27Å; C779-C785 PolarHBondContact SG-N 2.91Å; C779-C785 CovalentContact SG-SG 2.03Å; C779-C785 PolarHBondContact SG-SG 3.31Å
786	I	60.8	Low	77.1	Confident	109 Å²	109	78 Å²	78	56%	0.559	46%	0.456	S	S	*	.	S	Bend	trans	-77.8	129.7	-176.9	-73.2	165.8	0	0	0	111.9	W754	W754-I786 PolarHBondContact NE1-O 3.2Å
787	G	68.2	Low	76.9	Confident	54 Å²	54	78 Å²	78	56%	0.557	46%	0.461	S	S	*	.	S	Bend	trans	105.8	178.3	-178.6	0	0	0	0	0	113.7	W754	W754-G787 WeakPolarHBondContact CZ2-O 3.44Å
788	S	73.7	Confident	76.9	Confident	70 Å²	70	82.3 Å²	82.3	49%	0.49	48%	0.478	S	S	.	.			trans	-78.1	140.8	-178.7	-177.6	0	0	0	0	112.7	R777 K790	R777-S788 VanDerWaalsContact CZ-O 3.31Å; R777-S788 PolarHBondContact NE-O 2.8Å; R777-S788 PolarHBondContact NH2-O 3.35Å; S788-K790 WeakPolarHBondContact CB-O 3.5Å; S788-K790 PolarHBondContact OG-N 2.91Å; S788-K790 PolarHBondContact OG-O 3.33Å
789	G	84.7	Confident	76.7	Confident	26 Å²	26	88.7 Å²	88.7	27%	0.268	50%	0.498	S	S	.	.	S	Bend	trans	-78	-4.2	165.5	0	0	0	0	0	114.1	L776 R777	L776-G789 CarbonylContact C-O 3.51Å; L776-G789 VanDerWaalsContact CA-O 3.29Å; L776-G789 WeakPolarHBondContact CA-O 3.44Å; R777-G789 PolarHBondContact N-O 3.31Å
790	K	88.9	Confident	76.7	Confident	123 Å²	123	88.9 Å²	88.9	54%	0.535	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	129.1	-173.5	179.2	-174.1	178.3	-168.5	0	110.9	R775 L776 S788	R775-K790 WeakPolarHBondContact O-CA 3.2Å; L776-K790 HydrophobicContact CD2-CB 3.8Å; L776-K790 HydrophobicContact CD2-CG 3.91Å; S788-K790 WeakPolarHBondContact CB-O 3.5Å; S788-K790 PolarHBondContact OG-N 2.91Å; S788-K790 PolarHBondContact OG-O 3.33Å
791	E	90.3	Very high	77.1	Confident	62 Å²	62	89.3 Å²	89.3	29%	0.29	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	144	173.7	-166.9	-172.5	142.4	0	0	110	W757 W760 S774 R775	W757-E791 HydrophobicContact CH2-CB 3.78Å; W757-E791 HydrophobicContact CZ2-CB 4.46Å; W757-E791 HydrophobicContact CZ3-CB 3.99Å; W760-E791 HydrophobicContact CH2-CB 4.27Å; W760-E791 HydrophobicContact CH2-CG 3.89Å; W760-E791 VanDerWaalsContact CH2-OE1 3.28Å; W760-E791 WeakPolarHBondContact CH2-OE1 3.44Å; W760-E791 WeakPolarHBondContact CZ2-OE1 3.38Å; S774-E791 CarbonylContact C-O 3.43Å; S774-E791 WeakPolarHBondContact CA-O 3.47Å; S774-E791 WeakPolarHBondContact CB-O 3.03Å; R775-E791 HydrophobicContact CG-CB 3.87Å; R775-E791 IonicContact CZ-OE2 2.66Å; R775-E791 PolarHBondContact N-O 2.9Å; R775-E791 IonicContact NE-OE1 3.92Å; R775-E791 IonicContact NE-OE2 2.8Å; R775-E791 PolarHBondContact NE-OE2 3.02Å; R775-E791 IonicContact NH2-OE1 3.73Å; R775-E791 IonicContact NH2-OE2 2.72Å; R775-E791 PolarHBondContact NH2-OE2 3.18Å; R775-E791 PolarHBondContact O-N 3.31Å
792	I	89.6	Confident	76.7	Confident	100 Å²	100	92.8 Å²	92.8	51%	0.513	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	134.1	179.4	-52.8	177	0	0	0	108.4	Y772 R773	Y772-I792 HydrophobicContact CD1-CG2 4.09Å; Y772-I792 HydrophobicContact CG-CG2 4.47Å; R773-I792 CarbonylContact O-C 3.49Å; R773-I792 WeakPolarHBondContact O-CA 3.46Å
793	Q	90.5	Very high	76.7	Confident	79 Å²	79	88.9 Å²	88.9	37%	0.369	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	139.1	179.7	-171.6	178.8	59.9	0	0	111.6	W760 Y772 R773	W760-Q793 HydrophobicContact CH2-CB 3.58Å; W760-Q793 HydrophobicContact CZ2-CB 4.36Å; W760-Q793 HydrophobicContact CZ3-CB 3.72Å; Y772-Q793 WeakPolarHBondContact CA-O 3.44Å; R773-Q793 HydrophobicContact CG-CB 4.21Å; R773-Q793 VanDerWaalsContact CZ-OE1 3.27Å; R773-Q793 PolarHBondContact N-O 3.37Å; R773-Q793 PolarHBondContact O-N 3.33Å
794	N	90.1	Very high	76.3	Confident	122 Å²	122	89.6 Å²	89.6	65%	0.652	51%	0.512	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.1	133.2	173.4	-66.2	-21.6	0	0	0	111	Y772	Y772-N794 WeakPolarHBondContact CD1-OD1 3.47Å; Y772-N794 WeakPolarHBondContact CE1-OD1 3.49Å
795	C	89.6	Confident	75.4	Confident	11 Å²	11	94.8 Å²	94.8	7%	0.074	53%	0.525	C	S	.	.	P	Polyproline II helix	trans	-99.1	151.9	171.5	-66.3	0	0	0	0	111.3	C763 R771	C763-C795 HydrophobicContact CB-CB 3.57Å; C763-C795 WeakPolarHBondContact CB-SG 3.07Å; C763-C795 WeakPolarHBondContact SG-CB 3.04Å; C763-C795 CovalentContact SG-SG 2.03Å; C763-C795 PolarHBondContact SG-SG 3.43Å; R771-C795 HydrophobicContact CB-CB 3.87Å; R771-C795 PolarHBondContact O-N 2.87Å
796	P	89.9	Confident	74.2	Confident	99 Å²	99	101.3 Å²	101.3	64%	0.643	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-55.6	138.7	176.5	-26.8	35	0	0	0	112.7	R771 R798	R771-P796 WeakPolarHBondContact CD-O 3.27Å; R771-P796 PolarHBondContact NH1-O 3.24Å; P796-R798 PolarHBondContact O-N 2.69Å
797	P	84.5	Confident	73.1	Confident	89 Å²	89	101.7 Å²	101.7	58%	0.578	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-62.4	137.3	177.9	27.5	-35.3	0	0	0	109.9	G768 L769	G768-P797 WeakPolarHBondContact O-CA 3.39Å; L769-P797 HydrophobicContact CD2-CB 4.28Å
798	R	87.9	Confident	71.8	Confident	144 Å²	144	106.2 Å²	106.2	54%	0.543	58%	0.576	S	S	.	*	B	Isolated β-bridge	trans	-127.4	117.6	-178.9	-170.6	-163.8	-164.7	175.5	3.8	108.5	N766 C767 G768 P796 C800	N766-R798 WeakPolarHBondContact O-CD 3.38Å; N766-R798 PolarHBondContact O-NH1 3.18Å; C767-R798 CarbonylContact C-O 3.6Å; C767-R798 WeakPolarHBondContact CA-O 3.28Å; C767-R798 WeakPolarHBondContact CB-O 3.43Å; G768-R798 PolarHBondContact N-O 2.96Å; G768-R798 PolarHBondContact O-N 3.38Å; P796-R798 PolarHBondContact O-N 2.69Å; R798-C800 PolarHBondContact O-N 2.91Å; R798-C800 VanDerWaalsContact O-N 3.16Å
799	K	82	Confident	70	Confident	197 Å²	197	109.8 Å²	109.8	86%	0.857	59%	0.59	S	S	*	*			trans	-55.1	119.2	-178	-170.4	173.5	-176.9	177.2	0	110
800	C	78.2	Confident	67.5	Low	53 Å²	53	115.5 Å²	115.5	36%	0.358	61%	0.614	S	S	.	*			trans	-66.6	143.5	171.7	-69.3	0	0	0	0	110	C767 G768 R798 T802	C767-C800 HydrophobicContact CB-CB 3.93Å; C767-C800 WeakPolarHBondContact CB-SG 3.45Å; C767-C800 WeakPolarHBondContact SG-CA 3.27Å; C767-C800 WeakPolarHBondContact SG-CB 3.5Å; C767-C800 CovalentContact SG-SG 2.04Å; C767-C800 PolarHBondContact SG-SG 3.47Å; G768-C800 PolarHBondContact N-SG 2.86Å; R798-C800 PolarHBondContact O-N 2.91Å; R798-C800 VanDerWaalsContact O-N 3.16Å; C800-T802 PolarHBondContact O-N 2.77Å; C800-T802 VanDerWaalsContact O-N 3.08Å
801	I	79.1	Confident	64.9	Low	153 Å²	153	120.5 Å²	120.5	79%	0.785	63%	0.63	S	S	*	*			trans	-71.9	104.6	170.6	-59.8	176.1	0	0	0	107.1	V803	I801-V803 VanDerWaalsContact C-N 3.25Å; I801-V803 HydrophobicContact CG2-CG2 4.01Å; I801-V803 PolarHBondContact O-N 2.04Å
802	T	53.2	Low	62	Low	124 Å²	124	123.7 Å²	123.7	76%	0.761	66%	0.656	S	S	*	*			trans	-71	84.3	169.2	49.6	0	0	0	0	108.6	C800 P804	C800-T802 PolarHBondContact O-N 2.77Å; C800-T802 VanDerWaalsContact O-N 3.08Å; T802-P804 WeakPolarHBondContact O-CD 3.22Å
803	V	51.8	Low	59.2	Low	99 Å²	99	126.7 Å²	126.7	60%	0.6	67%	0.672	S	S	*	*			trans	-63.7	117.7	170.8	-174.4	0	0	0	0	107.3	I801 L805	I801-V803 VanDerWaalsContact C-N 3.25Å; I801-V803 HydrophobicContact CG2-CG2 4.01Å; I801-V803 PolarHBondContact O-N 2.04Å; V803-L805 PolarHBondContact O-N 3.42Å; V803-L805 VanDerWaalsContact O-N 3.16Å
804	P	43.7	Very low	56.3	Low	90 Å²	90	131.3 Å²	131.3	58%	0.584	69%	0.693	S	S	*	*			trans	-68.1	116.2	-179.7	27.3	-33	0	0	0	109.1	T802 N806	T802-P804 WeakPolarHBondContact O-CD 3.22Å; P804-N806 PolarHBondContact O-N 2.04Å
805	L	38.8	Very low	53.5	Low	169 Å²	169	136.4 Å²	136.4	89%	0.885	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	26	-171.4	-146.9	83.1	0	0	0	114.3	V803	V803-L805 PolarHBondContact O-N 3.42Å; V803-L805 VanDerWaalsContact O-N 3.16Å
806	N	41.5	Very low	50.8	Low	155 Å²	155	142.1 Å²	142.1	83%	0.829	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.4	-7.4	-177.3	-74.5	8.8	0	0	0	113.6	P804	P804-N806 PolarHBondContact O-N 2.04Å
807	T	39.6	Very low	48	Very low	116 Å²	116	145.9 Å²	145.9	71%	0.712	74%	0.744	S	S	*	*	S	Bend	trans	-132.8	59.7	-176.3	57.9	0	0	0	0	112.4
808	L	41	Very low	45.7	Very low	149 Å²	149	150.9 Å²	150.9	78%	0.78	76%	0.757	S	S	*	*			trans	-148.5	40.2	165.7	-118.7	170.3	0	0	0	113.3
809	N	36	Very low	43.2	Very low	146 Å²	146	149.2 Å²	149.2	78%	0.781	76%	0.763	S	S	*	*			trans	-64.5	155.2	145.1	-73.5	-13.8	0	0	0	108.6
810	D	32.3	Very low	41	Very low	145 Å²	145	141.3 Å²	141.3	78%	0.775	74%	0.737	S	S	*	*			trans	60	79	164.7	-53	-41.5	0	0	0	118.6
811	R	32.6	Very low	39.5	Very low	229 Å²	229	142.8 Å²	142.8	86%	0.864	74%	0.742	S	S	*	*				-162.3	123.2	126.9	-103.8	155.4	-155.2	-127.2	3.6	111.8
812	P	30.6	Very low	37.9	Very low	128 Å²	128	144.8 Å²	144.8	83%	0.831	74%	0.741	S	S	*	*			trans	-87.4	124.9	-178.9	32.8	-32.3	0	0	0	112
813	I	30.8	Very low	37.9	Very low	164 Å²	164	144.6 Å²	144.6	84%	0.841	73%	0.731	S	S	*	*			trans	-116.5	100.2	166.5	-59.2	-177	0	0	0	109	R815	I813-R815 PolarHBondContact O-N 3.4Å
814	Q	29.8	Very low	38	Very low	176 Å²	176	145 Å²	145	82%	0.822	73%	0.729	S	S	*	*			trans	14.5	83.3	166.4	-53.8	-161.4	18.4	0	0	118
815	R	29.8	Very low	38.7	Very low	229 Å²	229	146.7 Å²	146.7	86%	0.864	73%	0.732	S	S	*	*				-68.4	126.1	124.3	-73	-172	-177.7	-169.1	0.2	106.8	I813 K817	I813-R815 PolarHBondContact O-N 3.4Å; R815-K817 PolarHBondContact O-N 2.91Å
816	T	33.9	Very low	39.6	Very low	130 Å²	130	147.9 Å²	147.9	80%	0.798	73%	0.725	S	S	*	*			trans	-60	97.5	152.2	36	0	0	0	0	106.5	F818	T816-F818 VanDerWaalsContact C-N 3.26Å; T816-F818 PolarHBondContact O-N 2.93Å
817	K	30.4	Very low	40.6	Very low	178 Å²	178	146.9 Å²	146.9	77%	0.774	71%	0.713	S	S	*	*			trans	-62.9	97.5	167.3	-75	-178.7	178.8	176.5	0	105.7	R815 T819	R815-K817 PolarHBondContact O-N 2.91Å; K817-T819 HydrophobicContact CB-CG2 4.12Å; K817-T819 PolarHBondContact O-N 3.07Å
818	F	37.3	Very low	41.7	Very low	195 Å²	195	146.2 Å²	146.2	86%	0.855	71%	0.705	S	S	*	*			trans	-64.2	95.2	153.8	-151.5	-90.9	0	0	0	104.8	T816 G820	T816-F818 VanDerWaalsContact C-N 3.26Å; T816-F818 PolarHBondContact O-N 2.93Å; F818-G820 PolarHBondContact O-N 3.12Å
819	T	34.3	Very low	43.2	Very low	109 Å²	109	141.1 Å²	141.1	67%	0.669	69%	0.689	S	S	*	*			trans	-70.8	66.5	169	47.5	0	0	0	0	106.8	K817 N821	K817-T819 HydrophobicContact CB-CG2 4.12Å; K817-T819 PolarHBondContact O-N 3.07Å; T819-N821 PolarHBondContact O-N 2.04Å
820	G	36.6	Very low	44.9	Very low	31 Å²	31	136.5 Å²	136.5	32%	0.32	67%	0.667	S	S	.	*			trans	-64.3	86	176.3	0	0	0	0	0	106.9	F818 Y822	F818-G820 PolarHBondContact O-N 3.12Å; G820-Y822 PolarHBondContact O-N 3.37Å; G820-Y822 VanDerWaalsContact O-N 3.1Å
821	N	45.5	Very low	46.7	Very low	83 Å²	83	133.5 Å²	133.5	44%	0.444	65%	0.651	S	S	.	*			trans	-46.2	115.8	-160.5	-177.4	6.5	0	0	0	109.8	T819 H823 L824	T819-N821 PolarHBondContact O-N 2.04Å; N821-H823 PolarHBondContact O-N 3.17Å; N821-H823 VanDerWaalsContact O-N 3.14Å; N821-H823 WeakPolarHBondContact OD1-CB 3.41Å; N821-H823 PolarHBondContact OD1-CD2 2.62Å; N821-H823 PolarHBondContact OD1-N 2.85Å; N821-L824 HydrophobicContact CB-CB 4.15Å; N821-L824 WeakPolarHBondContact O-CA 3.31Å; N821-L824 VanDerWaalsContact O-CB 3.27Å; N821-L824 WeakPolarHBondContact O-CB 3.36Å; N821-L824 PolarHBondContact O-N 2.91Å
822	Y	46.2	Very low	48.6	Very low	196 Å²	196	128 Å²	128	77%	0.769	64%	0.637	S	S	*	*	H	α-helix	trans	-58.7	-32.5	-176.2	-42.4	-72	0	0	0	110.5	G820 L824 I825 W826	G820-Y822 PolarHBondContact O-N 3.37Å; G820-Y822 VanDerWaalsContact O-N 3.1Å; Y822-L824 VanDerWaalsContact C-N 3.3Å; Y822-L824 PolarHBondContact O-N 2.9Å; Y822-I825 PolarHBondContact O-N 3.1Å; Y822-W826 WeakPolarHBondContact O-CB 3.42Å; Y822-W826 PolarHBondContact O-N 2.85Å
823	H	52.5	Low	50.9	Low	120 Å²	120	125 Å²	125	56%	0.556	62%	0.618	S	S	*	*	H	α-helix	trans	-58.6	-35.7	170.1	-65	-80.7	0	0	0	112.8	N821 W826 F827	N821-H823 PolarHBondContact O-N 3.17Å; N821-H823 VanDerWaalsContact O-N 3.14Å; N821-H823 WeakPolarHBondContact OD1-CB 3.41Å; N821-H823 PolarHBondContact OD1-CD2 2.62Å; N821-H823 PolarHBondContact OD1-N 2.85Å; H823-W826 CarbonylContact O-C 3.53Å; H823-W826 PolarHBondContact O-N 2.81Å; H823-F827 HydrophobicContact CB-CD2 4.26Å; H823-F827 VanDerWaalsContact O-CB 3.23Å; H823-F827 WeakPolarHBondContact O-CB 3.02Å; H823-F827 VanDerWaalsContact O-CD2 3.22Å; H823-F827 WeakPolarHBondContact O-CD2 3.5Å; H823-F827 PolarHBondContact O-N 3.32Å
824	L	53.9	Low	53.2	Low	108 Å²	108	121.5 Å²	121.5	57%	0.565	60%	0.6	S	S	*	*	H	α-helix	trans	-66.7	-41.9	179.6	-162.2	84.3	0	0	0	112	N821 Y822 W826 F827 L828	N821-L824 HydrophobicContact CB-CB 4.15Å; N821-L824 WeakPolarHBondContact O-CA 3.31Å; N821-L824 VanDerWaalsContact O-CB 3.27Å; N821-L824 WeakPolarHBondContact O-CB 3.36Å; N821-L824 PolarHBondContact O-N 2.91Å; Y822-L824 VanDerWaalsContact C-N 3.3Å; Y822-L824 PolarHBondContact O-N 2.9Å; L824-W826 VanDerWaalsContact C-N 3.33Å; L824-F827 PolarHBondContact O-N 2.03Å; L824-L828 HydrophobicContact CG-CD1 4.5Å; L824-L828 WeakPolarHBondContact O-CB 3.29Å; L824-L828 VanDerWaalsContact O-CG 3.31Å; L824-L828 WeakPolarHBondContact O-CG 3.34Å; L824-L828 PolarHBondContact O-N 3.14Å
825	I	59.5	Low	55.4	Low	124 Å²	124	118.6 Å²	118.6	64%	0.636	59%	0.586	S	S	*	*	H	α-helix	trans	-67.7	-37.8	175.4	-64.6	174.3	0	0	0	110.2	Y822 G829	Y822-I825 PolarHBondContact O-N 3.1Å; I825-G829 PolarHBondContact O-N 3.1Å
826	W	57.3	Low	57.6	Low	195 Å²	195	112.1 Å²	112.1	74%	0.739	57%	0.568	S	S	*	*	H	α-helix	trans	-70	-37.8	175.4	-143.1	68	0	0	0	112.4	Y822 H823 L824 G829 C830	Y822-W826 WeakPolarHBondContact O-CB 3.42Å; Y822-W826 PolarHBondContact O-N 2.85Å; H823-W826 CarbonylContact O-C 3.53Å; H823-W826 PolarHBondContact O-N 2.81Å; L824-W826 VanDerWaalsContact C-N 3.33Å; W826-G829 PolarHBondContact O-N 2.77Å; W826-C830 WeakPolarHBondContact O-CB 3.46Å; W826-C830 PolarHBondContact O-N 2.76Å; W826-C830 PolarHBondContact O-SG 3.43Å
827	F	63	Low	60	Low	134 Å²	134	109.6 Å²	109.6	59%	0.588	55%	0.552	S	S	*	*	H	α-helix	trans	-64.1	-44.8	172.7	-98.3	-75.7	0	0	0	110.8	H823 L824 G829 C830 L831	H823-F827 HydrophobicContact CB-CD2 4.26Å; H823-F827 VanDerWaalsContact O-CB 3.23Å; H823-F827 WeakPolarHBondContact O-CB 3.02Å; H823-F827 VanDerWaalsContact O-CD2 3.22Å; H823-F827 WeakPolarHBondContact O-CD2 3.5Å; H823-F827 PolarHBondContact O-N 3.32Å; L824-F827 PolarHBondContact O-N 2.03Å; F827-G829 VanDerWaalsContact C-N 3.35Å; F827-C830 CarbonylContact O-C 3.49Å; F827-C830 PolarHBondContact O-N 2.75Å; F827-L831 VanDerWaalsContact O-CB 3.31Å; F827-L831 WeakPolarHBondContact O-CB 3.2Å; F827-L831 VanDerWaalsContact O-CG 3.22Å; F827-L831 WeakPolarHBondContact O-CG 3.45Å; F827-L831 PolarHBondContact O-N 2.87Å
828	L	63	Low	62.5	Low	101 Å²	101	106 Å²	106	53%	0.529	54%	0.541	S	S	.	.	H	α-helix	trans	-63.1	-40.9	174.1	-73	165.9	0	0	0	111.6	L824 C830 L831 I832	L824-L828 HydrophobicContact CG-CD1 4.5Å; L824-L828 WeakPolarHBondContact O-CB 3.29Å; L824-L828 VanDerWaalsContact O-CG 3.31Å; L824-L828 WeakPolarHBondContact O-CG 3.34Å; L824-L828 PolarHBondContact O-N 3.14Å; L828-C830 VanDerWaalsContact C-N 3.31Å; L828-C830 PolarHBondContact O-N 3.4Å; L828-L831 PolarHBondContact O-N 3.38Å; L828-I832 PolarHBondContact O-N 2.95Å
829	G	71.4	Confident	64.7	Low	43 Å²	43	101.5 Å²	101.5	44%	0.443	52%	0.524	S	S	.	.	H	α-helix	trans	-63.6	-31.4	173.6	0	0	0	0	0	114.2	I825 W826 F827 P833	I825-G829 PolarHBondContact O-N 3.1Å; W826-G829 PolarHBondContact O-N 2.77Å; F827-G829 VanDerWaalsContact C-N 3.35Å; G829-P833 WeakPolarHBondContact O-CD 3.29Å
830	C	71.9	Confident	67	Low	48 Å²	48	100.6 Å²	100.6	32%	0.324	52%	0.515	S	S	.	.	H	α-helix	trans	-87.6	-24.8	175.2	-70.5	0	0	0	0	113.6	W826 F827 L828 P833 I834	W826-C830 WeakPolarHBondContact O-CB 3.46Å; W826-C830 PolarHBondContact O-N 2.76Å; W826-C830 PolarHBondContact O-SG 3.43Å; F827-C830 CarbonylContact O-C 3.49Å; F827-C830 PolarHBondContact O-N 2.75Å; L828-C830 VanDerWaalsContact C-N 3.31Å; L828-C830 PolarHBondContact O-N 3.4Å; C830-P833 VanDerWaalsContact O-CD 3.31Å; C830-P833 WeakPolarHBondContact O-CD 3.31Å; C830-P833 WeakPolarHBondContact O-CG 3.48Å; C830-I834 WeakPolarHBondContact O-CD1 3.41Å; C830-I834 WeakPolarHBondContact O-CG1 3.02Å; C830-I834 PolarHBondContact O-N 2.94Å
831	L	70.9	Confident	69.3	Low	83 Å²	83	103.7 Å²	103.7	44%	0.435	52%	0.523	S	S	.	.	H	α-helix	trans	-68.4	-37.9	176.8	-83.5	164.4	0	0	0	111.7	F827 L828 I834 E835	F827-L831 VanDerWaalsContact O-CB 3.31Å; F827-L831 WeakPolarHBondContact O-CB 3.2Å; F827-L831 VanDerWaalsContact O-CG 3.22Å; F827-L831 WeakPolarHBondContact O-CG 3.45Å; F827-L831 PolarHBondContact O-N 2.87Å; L828-L831 PolarHBondContact O-N 3.38Å; L831-I834 PolarHBondContact O-N 2.96Å; L831-E835 WeakPolarHBondContact O-CB 3.36Å; L831-E835 WeakPolarHBondContact O-CG 3.15Å; L831-E835 PolarHBondContact O-N 2.79Å
832	I	72.9	Confident	71.2	Confident	112 Å²	112	101.5 Å²	101.5	57%	0.574	52%	0.52	S	S	*	.	H	α-helix	trans	-57.1	-51.7	177.3	-67.8	160	0	0	0	112.8	L828 I834 E835 I836	L828-I832 PolarHBondContact O-N 2.95Å; I832-I834 VanDerWaalsContact C-N 3.34Å; I832-I834 PolarHBondContact O-N 3.35Å; I832-E835 PolarHBondContact O-N 3.12Å; I832-I836 HydrophobicContact CG2-CD1 4.12Å; I832-I836 WeakPolarHBondContact O-CG1 3.5Å; I832-I836 PolarHBondContact O-N 3.07Å; I832-I836 VanDerWaalsContact O-N 3.1Å
833	P	77.5	Confident	72.8	Confident	67 Å²	67	96.1 Å²	96.1	44%	0.435	51%	0.507	S	S	.	.	H	α-helix	trans	-69	-27.6	175	24.6	-32.4	0	0	0	113.4	G829 C830 I836 V837	G829-P833 WeakPolarHBondContact O-CD 3.29Å; C830-P833 VanDerWaalsContact O-CD 3.31Å; C830-P833 WeakPolarHBondContact O-CD 3.31Å; C830-P833 WeakPolarHBondContact O-CG 3.48Å; P833-I836 PolarHBondContact O-N 2.83Å; P833-V837 VanDerWaalsContact O-CG2 3.31Å; P833-V837 WeakPolarHBondContact O-CG2 3.33Å; P833-V837 PolarHBondContact O-N 3.44Å
834	I	79.2	Confident	74.2	Confident	90 Å²	90	94.2 Å²	94.2	46%	0.462	50%	0.501	S	S	.	.	H	α-helix	trans	-68.5	-44.6	174.1	-70	167.7	0	0	0	111.1	C830 L831 I832 I836 V837 L838	C830-I834 WeakPolarHBondContact O-CD1 3.41Å; C830-I834 WeakPolarHBondContact O-CG1 3.02Å; C830-I834 PolarHBondContact O-N 2.94Å; L831-I834 PolarHBondContact O-N 2.96Å; I832-I834 VanDerWaalsContact C-N 3.34Å; I832-I834 PolarHBondContact O-N 3.35Å; I834-I836 VanDerWaalsContact C-N 3.35Å; I834-I836 PolarHBondContact O-N 3.4Å; I834-V837 PolarHBondContact O-N 2.83Å; I834-L838 HydrophobicContact CG2-CD1 3.99Å; I834-L838 HydrophobicContact CG2-CG 4.38Å; I834-L838 WeakPolarHBondContact O-CB 3.41Å; I834-L838 WeakPolarHBondContact O-CG 3.44Å; I834-L838 PolarHBondContact O-N 3.45Å
835	E	76.2	Confident	75.4	Confident	114 Å²	114	91.6 Å²	91.6	53%	0.533	49%	0.494	S	S	.	.	H	α-helix	trans	-54.9	-48.9	171.1	-81.4	-73.7	145	0	0	110.9	L831 I832 V837 L838 I839	L831-E835 WeakPolarHBondContact O-CB 3.36Å; L831-E835 WeakPolarHBondContact O-CG 3.15Å; L831-E835 PolarHBondContact O-N 2.79Å; I832-E835 PolarHBondContact O-N 3.12Å; E835-V837 VanDerWaalsContact C-N 3.34Å; E835-V837 PolarHBondContact O-N 2.99Å; E835-L838 PolarHBondContact O-N 2.87Å; E835-I839 WeakPolarHBondContact O-CB 3.36Å; E835-I839 VanDerWaalsContact O-CG1 3.26Å; E835-I839 WeakPolarHBondContact O-CG1 3.28Å; E835-I839 PolarHBondContact O-N 2.85Å
836	I	76.9	Confident	76.2	Confident	93 Å²	93	93.7 Å²	93.7	48%	0.477	50%	0.496	S	S	.	.	H	α-helix	trans	-59.8	-43	177.7	-69.4	165.9	0	0	0	111.4	I832 P833 I834 I839 I840	I832-I836 HydrophobicContact CG2-CD1 4.12Å; I832-I836 WeakPolarHBondContact O-CG1 3.5Å; I832-I836 PolarHBondContact O-N 3.07Å; I832-I836 VanDerWaalsContact O-N 3.1Å; P833-I836 PolarHBondContact O-N 2.83Å; I834-I836 VanDerWaalsContact C-N 3.35Å; I834-I836 PolarHBondContact O-N 3.4Å; I836-I839 PolarHBondContact O-N 3.4Å; I836-I840 HydrophobicContact CG2-CD1 3.85Å; I836-I840 WeakPolarHBondContact O-CD1 3.41Å; I836-I840 VanDerWaalsContact O-CG1 3.25Å; I836-I840 WeakPolarHBondContact O-CG1 3.11Å; I836-I840 PolarHBondContact O-N 2.83Å
837	V	83.6	Confident	76.9	Confident	77 Å²	77	90.1 Å²	90.1	47%	0.467	49%	0.487	S	S	.	.	H	α-helix	trans	-66.5	-39.5	176.4	168.2	0	0	0	0	111.9	P833 I834 E835 I840 I841	P833-V837 VanDerWaalsContact O-CG2 3.31Å; P833-V837 WeakPolarHBondContact O-CG2 3.33Å; P833-V837 PolarHBondContact O-N 3.44Å; I834-V837 PolarHBondContact O-N 2.83Å; E835-V837 VanDerWaalsContact C-N 3.34Å; E835-V837 PolarHBondContact O-N 2.99Å; V837-I840 PolarHBondContact O-N 2.93Å; V837-I841 HydrophobicContact CG1-CD1 3.75Å; V837-I841 HydrophobicContact CG1-CG1 4.42Å; V837-I841 WeakPolarHBondContact O-CB 3.39Å; V837-I841 VanDerWaalsContact O-CG1 3.28Å; V837-I841 WeakPolarHBondContact O-CG1 3.34Å; V837-I841 PolarHBondContact O-N 2.67Å
838	L	83.9	Confident	77.4	Confident	102 Å²	102	90.6 Å²	90.6	53%	0.534	49%	0.489	S	S	.	.	H	α-helix	trans	-66.3	-38.4	175.6	-72.6	172.7	0	0	0	112	I834 E835 I841 G842	I834-L838 HydrophobicContact CG2-CD1 3.99Å; I834-L838 HydrophobicContact CG2-CG 4.38Å; I834-L838 WeakPolarHBondContact O-CB 3.41Å; I834-L838 WeakPolarHBondContact O-CG 3.44Å; I834-L838 PolarHBondContact O-N 3.45Å; E835-L838 PolarHBondContact O-N 2.87Å; L838-I841 PolarHBondContact O-N 2.85Å; L838-G842 PolarHBondContact O-N 2.96Å
839	I	82.9	Confident	77.6	Confident	101 Å²	101	93.5 Å²	93.5	52%	0.518	49%	0.494	S	S	.	.	H	α-helix	trans	-63.5	-45.5	173.1	-69.3	163.4	0	0	0	110.4	E835 I836 G842 V843	E835-I839 WeakPolarHBondContact O-CB 3.36Å; E835-I839 VanDerWaalsContact O-CG1 3.26Å; E835-I839 WeakPolarHBondContact O-CG1 3.28Å; E835-I839 PolarHBondContact O-N 2.85Å; I836-I839 PolarHBondContact O-N 3.4Å; I839-G842 PolarHBondContact O-N 2.92Å; I839-V843 WeakPolarHBondContact O-CG2 3.35Å; I839-V843 PolarHBondContact O-N 2.82Å
840	I	83.2	Confident	77.1	Confident	90 Å²	90	94.8 Å²	94.8	46%	0.462	49%	0.493	S	S	.	.	H	α-helix	trans	-61.6	-46.9	176.8	-70.7	164.1	0	0	0	111.2	I836 V837 G842 V843 I844	I836-I840 HydrophobicContact CG2-CD1 3.85Å; I836-I840 WeakPolarHBondContact O-CD1 3.41Å; I836-I840 VanDerWaalsContact O-CG1 3.25Å; I836-I840 WeakPolarHBondContact O-CG1 3.11Å; I836-I840 PolarHBondContact O-N 2.83Å; V837-I840 PolarHBondContact O-N 2.93Å; I840-G842 VanDerWaalsContact C-N 3.3Å; I840-G842 PolarHBondContact O-N 2.91Å; I840-V843 PolarHBondContact O-N 2.85Å; I840-I844 HydrophobicContact CG2-CD1 3.77Å; I840-I844 VanDerWaalsContact O-CG1 3.31Å; I840-I844 WeakPolarHBondContact O-CG1 3.46Å; I840-I844 PolarHBondContact O-N 2.87Å
841	I	84.6	Confident	76	Confident	97 Å²	97	98 Å²	98	50%	0.497	51%	0.506	S	S	.	.	H	α-helix	trans	-62.2	-39.9	175.7	-69.2	168	0	0	0	110.5	V837 L838 I844 A845	V837-I841 HydrophobicContact CG1-CD1 3.75Å; V837-I841 HydrophobicContact CG1-CG1 4.42Å; V837-I841 WeakPolarHBondContact O-CB 3.39Å; V837-I841 VanDerWaalsContact O-CG1 3.28Å; V837-I841 WeakPolarHBondContact O-CG1 3.34Å; V837-I841 PolarHBondContact O-N 2.67Å; L838-I841 PolarHBondContact O-N 2.85Å; I841-I844 PolarHBondContact O-N 2.97Å; I841-A845 WeakPolarHBondContact O-CB 3.33Å; I841-A845 PolarHBondContact O-N 2.67Å
842	G	84.2	Confident	75	Confident	37 Å²	37	100.7 Å²	100.7	38%	0.381	52%	0.515	S	S	.	.	H	α-helix	trans	-61.4	-43.8	175.9	0	0	0	0	0	113	L838 I839 I840 A845 Y846	L838-G842 PolarHBondContact O-N 2.96Å; I839-G842 PolarHBondContact O-N 2.92Å; I840-G842 VanDerWaalsContact C-N 3.3Å; I840-G842 PolarHBondContact O-N 2.91Å; G842-A845 PolarHBondContact O-N 2.8Å; G842-Y846 VanDerWaalsContact O-CB 3.25Å; G842-Y846 WeakPolarHBondContact O-CB 2.99Å; G842-Y846 PolarHBondContact O-N 2.96Å
843	V	80.7	Confident	73.5	Confident	82 Å²	82	102.4 Å²	102.4	50%	0.497	52%	0.518	S	S	.	.	H	α-helix	trans	-64.9	-47.7	175.1	171.1	0	0	0	0	111	I839 I840 A845 Y846 E847	I839-V843 WeakPolarHBondContact O-CG2 3.35Å; I839-V843 PolarHBondContact O-N 2.82Å; I840-V843 PolarHBondContact O-N 2.85Å; V843-A845 VanDerWaalsContact C-N 3.3Å; V843-A845 PolarHBondContact O-N 3.24Å; V843-Y846 PolarHBondContact O-N 2.84Å; V843-Y846 VanDerWaalsContact O-N 3.13Å; V843-E847 PolarHBondContact O-N 2.92Å
844	I	82.2	Confident	71.8	Confident	81 Å²	81	103.6 Å²	103.6	42%	0.415	53%	0.528	S	S	.	.	H	α-helix	trans	-62.5	-38.1	177.8	-66.3	165.7	0	0	0	111.3	I840 I841 K848	I840-I844 HydrophobicContact CG2-CD1 3.77Å; I840-I844 VanDerWaalsContact O-CG1 3.31Å; I840-I844 WeakPolarHBondContact O-CG1 3.46Å; I840-I844 PolarHBondContact O-N 2.87Å; I841-I844 PolarHBondContact O-N 2.97Å; I844-K848 HydrophobicContact CG2-CD 4.39Å; I844-K848 WeakPolarHBondContact O-CB 3Å; I844-K848 WeakPolarHBondContact O-CG 3.49Å; I844-K848 PolarHBondContact O-N 2.83Å; I844-K848 VanDerWaalsContact O-N 3.1Å
845	A	78.5	Confident	70.1	Confident	53 Å²	53	103.8 Å²	103.8	44%	0.438	54%	0.537	S	S	.	.	H	α-helix	trans	-69.4	-38.4	174.8	0	0	0	0	0	111.7	I841 G842 V843 K848 Y849	I841-A845 WeakPolarHBondContact O-CB 3.33Å; I841-A845 PolarHBondContact O-N 2.67Å; G842-A845 PolarHBondContact O-N 2.8Å; V843-A845 VanDerWaalsContact C-N 3.3Å; V843-A845 PolarHBondContact O-N 3.24Å; A845-K848 PolarHBondContact O-N 2.82Å; A845-Y849 WeakPolarHBondContact O-CB 3.47Å; A845-Y849 PolarHBondContact O-N 2.79Å
846	Y	76.2	Confident	68.2	Low	168 Å²	168	102.3 Å²	102.3	66%	0.659	54%	0.539	S	S	*	.	H	α-helix	trans	-66.1	-47.6	176.5	-175.3	-97.5	0	0	0	111.6	G842 V843 K848 Y849 V850	G842-Y846 VanDerWaalsContact O-CB 3.25Å; G842-Y846 WeakPolarHBondContact O-CB 2.99Å; G842-Y846 PolarHBondContact O-N 2.96Å; V843-Y846 PolarHBondContact O-N 2.84Å; V843-Y846 VanDerWaalsContact O-N 3.13Å; Y846-K848 VanDerWaalsContact C-N 3.35Å; Y846-K848 PolarHBondContact O-N 2.97Å; Y846-Y849 PolarHBondContact O-N 2.84Å; Y846-Y849 VanDerWaalsContact O-N 3.15Å; Y846-V850 HydrophobicContact CD1-CG2 4.05Å; Y846-V850 HydrophobicContact CD2-CG2 4.44Å; Y846-V850 HydrophobicContact CE1-CG2 3.7Å; Y846-V850 HydrophobicContact CE2-CG2 4.13Å; Y846-V850 HydrophobicContact CG-CG2 4.41Å; Y846-V850 WeakPolarHBondContact O-CB 3.35Å; Y846-V850 WeakPolarHBondContact O-CG2 3.05Å; Y846-V850 PolarHBondContact O-N 2.91Å
847	E	71.5	Confident	66.3	Low	119 Å²	119	102.5 Å²	102.5	56%	0.556	55%	0.549	S	S	*	.	H	α-helix	trans	-55.5	-49.9	172.8	-73.9	-166	135.4	0	0	111.1	V843 Y849 V850 L851	V843-E847 PolarHBondContact O-N 2.92Å; E847-Y849 VanDerWaalsContact C-N 3.32Å; E847-Y849 PolarHBondContact O-N 3.11Å; E847-V850 PolarHBondContact O-N 2.82Å; E847-L851 VanDerWaalsContact O-CB 3.28Å; E847-L851 WeakPolarHBondContact O-CB 3.44Å; E847-L851 VanDerWaalsContact O-CG 3.26Å; E847-L851 WeakPolarHBondContact O-CG 3.05Å; E847-L851 PolarHBondContact O-N 3.01Å
848	K	73.9	Confident	64.1	Low	145 Å²	145	104.3 Å²	104.3	63%	0.63	57%	0.565	S	S	*	*	H	α-helix	trans	-64.2	-33.4	177.7	-75.3	179.9	178	177.1	0	112.9	I844 A845 Y846 K852	I844-K848 HydrophobicContact CG2-CD 4.39Å; I844-K848 WeakPolarHBondContact O-CB 3Å; I844-K848 WeakPolarHBondContact O-CG 3.49Å; I844-K848 PolarHBondContact O-N 2.83Å; I844-K848 VanDerWaalsContact O-N 3.1Å; A845-K848 PolarHBondContact O-N 2.82Å; Y846-K848 VanDerWaalsContact C-N 3.35Å; Y846-K848 PolarHBondContact O-N 2.97Å; K848-K852 WeakPolarHBondContact O-CB 3.4Å; K848-K852 PolarHBondContact O-N 3.45Å
849	Y	68.6	Low	61.6	Low	162 Å²	162	105 Å²	105	64%	0.635	58%	0.578	S	S	*	*	H	α-helix	trans	-76	-38	178.3	-165.8	-89.6	0	0	0	112	A845 Y846 E847 K852 K853	A845-Y849 WeakPolarHBondContact O-CB 3.47Å; A845-Y849 PolarHBondContact O-N 2.79Å; Y846-Y849 PolarHBondContact O-N 2.84Å; Y846-Y849 VanDerWaalsContact O-N 3.15Å; E847-Y849 VanDerWaalsContact C-N 3.32Å; E847-Y849 PolarHBondContact O-N 3.11Å; Y849-K852 PolarHBondContact O-N 2.04Å; Y849-K853 HydrophobicContact CE1-CD 4.29Å; Y849-K853 VanDerWaalsContact O-CB 3.24Å; Y849-K853 WeakPolarHBondContact O-CB 3.44Å; Y849-K853 PolarHBondContact O-N 3.25Å
850	V	59.4	Low	59.2	Low	70 Å²	70	105.8 Å²	105.8	42%	0.424	59%	0.593	S	S	.	*	H	α-helix	trans	-65.2	-49.5	173	171.2	0	0	0	0	110.3	Y846 E847 K852 K853 S854	Y846-V850 HydrophobicContact CD1-CG2 4.05Å; Y846-V850 HydrophobicContact CD2-CG2 4.44Å; Y846-V850 HydrophobicContact CE1-CG2 3.7Å; Y846-V850 HydrophobicContact CE2-CG2 4.13Å; Y846-V850 HydrophobicContact CG-CG2 4.41Å; Y846-V850 WeakPolarHBondContact O-CB 3.35Å; Y846-V850 WeakPolarHBondContact O-CG2 3.05Å; Y846-V850 PolarHBondContact O-N 2.91Å; E847-V850 PolarHBondContact O-N 2.82Å; V850-K852 VanDerWaalsContact C-N 3.28Å; V850-K852 PolarHBondContact O-N 2.03Å; V850-K853 PolarHBondContact O-N 2.89Å; V850-S854 PolarHBondContact O-N 2.85Å; V850-S854 PolarHBondContact O-OG 3.37Å
851	L	49.8	Very low	56.9	Low	114 Å²	114	105.7 Å²	105.7	60%	0.597	61%	0.606	S	S	*	*	H	α-helix	trans	-62.5	-31.8	176.1	-71.8	167.5	0	0	0	112.9	E847 S854 S855	E847-L851 VanDerWaalsContact O-CB 3.28Å; E847-L851 WeakPolarHBondContact O-CB 3.44Å; E847-L851 VanDerWaalsContact O-CG 3.26Å; E847-L851 WeakPolarHBondContact O-CG 3.05Å; E847-L851 PolarHBondContact O-N 3.01Å; L851-S854 WeakPolarHBondContact CA-OG 3.1Å; L851-S854 PolarHBondContact O-OG 3.49Å; L851-S855 PolarHBondContact O-OG 3.08Å
852	K	50	Low	54.6	Low	141 Å²	141	106 Å²	106	61%	0.613	62%	0.617	S	S	*	*	H	α-helix	trans	-76.7	-37.5	173.9	-163.2	165.3	-171.9	175.9	0	112.2	K848 Y849 V850 S854 S855 S856	K848-K852 WeakPolarHBondContact O-CB 3.4Å; K848-K852 PolarHBondContact O-N 3.45Å; Y849-K852 PolarHBondContact O-N 2.04Å; V850-K852 VanDerWaalsContact C-N 3.28Å; V850-K852 PolarHBondContact O-N 2.03Å; K852-S854 VanDerWaalsContact C-N 3.28Å; K852-S854 PolarHBondContact O-N 3.23Å; K852-S855 WeakPolarHBondContact CA-OG 3.34Å; K852-S855 CarbonylContact O-C 3.57Å; K852-S855 PolarHBondContact O-N 3.16Å; K852-S855 PolarHBondContact O-OG 3.16Å; K852-S856 PolarHBondContact O-N 2.84Å; K852-S856 PolarHBondContact O-OG 2.93Å
853	K	41.8	Very low	52.4	Low	147 Å²	147	109 Å²	109	64%	0.639	63%	0.631	S	S	*	*	H	α-helix	trans	-68.8	-26.1	175.8	-164.7	167.7	-175.8	176.3	0	112.6	Y849 V850 S855	Y849-K853 HydrophobicContact CE1-CD 4.29Å; Y849-K853 VanDerWaalsContact O-CB 3.24Å; Y849-K853 WeakPolarHBondContact O-CB 3.44Å; Y849-K853 PolarHBondContact O-N 3.25Å; V850-K853 PolarHBondContact O-N 2.89Å; K853-S855 VanDerWaalsContact C-N 3.3Å
854	S	41.4	Very low	50.2	Low	93 Å²	93	112.9 Å²	112.9	65%	0.65	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-1.5	167.1	57.7	0	0	0	0	114.8	V850 L851 K852	V850-S854 PolarHBondContact O-N 2.85Å; V850-S854 PolarHBondContact O-OG 3.37Å; L851-S854 WeakPolarHBondContact CA-OG 3.1Å; L851-S854 PolarHBondContact O-OG 3.49Å; K852-S854 VanDerWaalsContact C-N 3.28Å; K852-S854 PolarHBondContact O-N 3.23Å
855	S	43	Very low	48.1	Very low	94 Å²	94	113.2 Å²	113.2	66%	0.657	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.5	4.4	179.3	52.8	0	0	0	0	114.7	L851 K852 K853	L851-S855 PolarHBondContact O-OG 3.08Å; K852-S855 WeakPolarHBondContact CA-OG 3.34Å; K852-S855 CarbonylContact O-C 3.57Å; K852-S855 PolarHBondContact O-N 3.16Å; K852-S855 PolarHBondContact O-OG 3.16Å; K853-S855 VanDerWaalsContact C-N 3.3Å
856	S	36.6	Very low	46.1	Very low	82 Å²	82	115.5 Å²	115.5	57%	0.573	67%	0.671	S	S	*	*			trans	-132.9	66.5	176.9	75.1	0	0	0	0	113.6	K852	K852-S856 PolarHBondContact O-N 2.84Å; K852-S856 PolarHBondContact O-OG 2.93Å
857	S	37.2	Very low	44.2	Very low	97 Å²	97	118.7 Å²	118.7	68%	0.678	68%	0.682	S	S	*	*	S	Bend	trans	-138	122.1	160.8	49.4	0	0	0	0	112
858	S	36.7	Very low	42.7	Very low	115 Å²	115	117.6 Å²	117.6	80%	0.804	69%	0.687	S	S	*	*			trans	50.9	84.1	164.6	55.9	0	0	0	0	118.7
859	S	31.5	Very low	41	Very low	116 Å²	116	115.7 Å²	115.7	81%	0.811	69%	0.692	S	S	*	*			trans	-77.1	128.3	149.5	52.5	0	0	0	0	111.6
860	S	33.5	Very low	39.7	Very low	118 Å²	118	112.8 Å²	112.8	83%	0.825	70%	0.695	S	S	*	*			trans	176.5	171.5	151.5	35.7	0	0	0	0	112.3
861	A	33.6	Very low	38.8	Very low	89 Å²	89	114.1 Å²	114.1	74%	0.736	71%	0.708	S	S	*	*			trans	73.2	60.7	168.3	0	0	0	0	0	119.8
862	S	35.9	Very low	38.4	Very low	104 Å²	104	114 Å²	114	73%	0.727	72%	0.716	S	S	*	*				42	117.7	125.6	59.9	0	0	0	0	123.1
863	S	37.8	Very low	38	Very low	98 Å²	98	112.1 Å²	112.1	69%	0.685	72%	0.721	S	S	*	*				78.8	124.7	122.7	67.8	0	0	0	0	123.9
864	L	34.7	Very low	38	Very low	164 Å²	164	109.9 Å²	109.9	86%	0.859	72%	0.724	S	S	*	*			trans	63.8	148.7	149	-84.9	74.3	0	0	0	119.1
865	S	37.8	Very low	38	Very low	89 Å²	89	109.9 Å²	109.9	62%	0.622	72%	0.724	S	S	*	*			cis	-168	148.4	-30.7	43.4	0	0	0	0	111.5
866	S	37.9	Very low	37.9	Very low	101 Å²	101	111.5 Å²	111.5	71%	0.706	73%	0.73	S	S	*	*			trans	56.6	104.5	147.9	63.1	0	0	0	0	121.2
867	R	36.9	Very low	38.1	Very low	235 Å²	235	112.7 Å²	112.7	89%	0.887	74%	0.738	S	S	*	*				101.3	143.1	108.4	-159.7	-175.7	-178.2	162.2	-0.1	119.5
868	S	38.2	Very low	38.4	Very low	95 Å²	95	119.9 Å²	119.9	66%	0.664	77%	0.768	S	S	*	*			trans	81.1	115	154.9	21.2	0	0	0	0	121.9
869	S	39.5	Very low	38.5	Very low	106 Å²	106	120.1 Å²	120.1	74%	0.741	77%	0.766	S	S	*	*				83	113.8	123.4	65.5	0	0	0	0	122.6
870	S	40.3	Very low	38.9	Very low	100 Å²	100	120.3 Å²	120.3	70%	0.699	76%	0.764	S	S	*	*				88.2	118.6	120.4	64	0	0	0	0	122.3
871	S	41	Very low	39.2	Very low	99 Å²	99	120.4 Å²	120.4	69%	0.692	76%	0.76	S	S	*	*				81.3	133.9	127	60.6	0	0	0	0	122.1
872	S	41.7	Very low	39.5	Very low	110 Å²	110	122.3 Å²	122.3	77%	0.769	76%	0.762	S	S	*	*			trans	65.2	142.1	151.3	41.2	0	0	0	0	119.1
873	S	41.2	Very low	39.7	Very low	102 Å²	102	123.4 Å²	123.4	71%	0.713	76%	0.764	S	S	*	*			cis	-168.3	173.2	-12.8	46.2	0	0	0	0	110.7
874	S	41.7	Very low	39.9	Very low	101 Å²	101	125.1 Å²	125.1	71%	0.706	77%	0.769	S	S	*	*			trans	15.4	141.7	146.1	59.9	0	0	0	0	120.6
875	S	41.1	Very low	40.2	Very low	92 Å²	92	122.4 Å²	122.4	64%	0.643	76%	0.763	S	S	*	*			cis	178	167.3	0.6	48	0	0	0	0	109.8
876	T	41.5	Very low	40.4	Very low	129 Å²	129	124.9 Å²	124.9	79%	0.791	77%	0.773	S	S	*	*			trans	59.8	149.9	152.8	45.5	0	0	0	0	118.9
877	S	41.5	Very low	40.6	Very low	106 Å²	106	126.9 Å²	126.9	74%	0.741	78%	0.779	S	S	*	*			cis	-172.7	140.7	-17.1	47.2	0	0	0	0	109.1
878	L	43	Very low	41	Very low	248 Å²	248	117.1 Å²	117.1	100%	1.298	77%	0.769	S	S	*	*			trans	-159.7	0	154.5	-113.9	165.4	0	0	0	108.9

Retrieved 878 of 878 residues in 767.7 ms (Link to these results)

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