A0A096NJC0_PAPAN Loading...

Scaffolding anchor of CK1 domain-containing protein

AlphaFold DB , UniProt , Accession A0A096NJC0, Species PAPAN (Papio anubis, Olive baboon), Gene n/a, Length 1,011 aa.

						>A0A096NJC0_PAPAN|A0A096NJC0
METSSMLSSLNDECKSDNYIEPHYKEWYRVAIDILIEHGLEAYQEFLVQERVSDFLAEEEINYILKNVQKVAQSTAHGTDDSCDDTSSSGTYWPVESDVEAPNLDLGWPYVMPGLLGGTHIDLLFHPPRAHLLTIKETIRKMIKEARKVIALVMDIFTDVDIFKEIVEASTRGVSVYILLDESNFNHFLNMTEKQGCSVQRLRNIRVRTVKGQDYLSKTGAKFHGKMEQKFLLVDCQKVMYGSYSYMWSFEKAHLSMVQIITGQLVESFDEEFRTLYARSCVPSSFAQEESARVKHGKALWENGTYQHSISSLASVSSQRNLFGRQDKIHKLDSSYFKNRGIYTLNEHDKYNIRSHRYKPHFVPNFNGPNTIRQFQPSQINENWKRHSYAGEQPETVPYLLLNRALNRTNNPPGNWKKPSDSLSVASSSREGYASHHNAPAQSFANRLAQRKTTNLADRNSNVRRSFNGTDNHIRFLQQRMPTLEHTTKSFLRNWRIESYLNDHSEAIPDSNGSALGDRFEGYDNPENLKANALYTHSRLRSSLVFKPSLPEQKEVNSCTTGSSNSTIIGSQGSETPKEVPDTPTNVQHLTDKPLPESVPKLPLQSEAPKMHTLQVPENHSVALNQTTNGHTESNNYIYTTLCVNKQTENLKNQQTENLLKRRSFPLFDNSRANLDPGNSKHYVYSTLTRNRVRQPEKPKEDLLKSSKSMHNVTHNLEEDEEEVTKENPPSSTTTKSISIAALLDVNKEESNKELTSKKEVKGSPSFLKKGSQKLRSLLSLTPDKKENLSKNKAPAFYRLCSSSDTLVSEGEENQKPKKSDTKVDSSPRRKHSSSLNSQCSIHKSKEDVTISPSQEINAPSDENKRTPSPGPVESKLLERAGDASAPRFNTEQIQYRDSREINAVVTPERRPTSSPRPTSNELLRSHSTDRRVYSRFEPFCKIESSIQPTSNMPNTSINRPEIKSATVSNSYGRSSPMLNYNTGVYRSYQPNENKFRGFMQKFGNFIHKNK
					

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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	39.1	Very low	36.7	Very low	234 Å²	234	142.5 Å²	142.5	100%	1.153	81%	0.808	S	S	*	*				0	87.6	0	-78.9	175.6	165	0	0	107.1
2	E	36.1	Very low	37.5	Very low	185 Å²	185	143.7 Å²	143.7	86%	0.864	81%	0.811	S	S	*	*			trans	-142.9	51.5	-161.6	-66.2	175.8	119.9	0	0	112.4
3	T	36.6	Very low	38.3	Very low	136 Å²	136	144 Å²	144	83%	0.834	80%	0.801	S	S	*	*			trans	-133.4	7.3	-174.1	49.1	0	0	0	0	115.1
4	S	34	Very low	39.1	Very low	118 Å²	118	142.4 Å²	142.4	83%	0.825	80%	0.803	S	S	*	*	S	Bend	trans	-105.4	12.9	-175.5	56	0	0	0	0	115.3
5	S	39.9	Very low	39.8	Very low	101 Å²	101	142.7 Å²	142.7	71%	0.706	79%	0.792	S	S	*	*	S	Bend	trans	-107.3	0	-174.5	-153.3	0	0	0	0	114.9
6	M	32.6	Very low	41.2	Very low	155 Å²	155	138.4 Å²	138.4	76%	0.764	78%	0.775	S	S	*	*	S	Bend	trans	-107.3	12	-169.4	-76.1	-77.3	104.2	0	0	115.3
7	L	34.7	Very low	42.3	Very low	151 Å²	151	140.4 Å²	140.4	79%	0.791	78%	0.783	S	S	*	*	S	Bend	trans	-114.5	-3.9	-176.4	-69.6	176.6	0	0	0	115.5	S9	L7-S9 VanDerWaalsContact C-N 3.35Å; L7-S9 PolarHBondContact O-N 2.73Å
8	S	35.8	Very low	43.8	Very low	120 Å²	120	141.1 Å²	141.1	84%	0.839	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-2.9	-179.1	-58.2	0	0	0	0	114.8
9	S	38.2	Very low	45.6	Very low	100 Å²	100	140.5 Å²	140.5	70%	0.699	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.6	3.9	-172.9	55.5	0	0	0	0	115.4	L7	L7-S9 VanDerWaalsContact C-N 3.35Å; L7-S9 PolarHBondContact O-N 2.73Å
10	L	35.7	Very low	47.2	Very low	143 Å²	143	141.1 Å²	141.1	75%	0.749	77%	0.771	S	S	*	*	S	Bend	trans	-113.9	3.4	-173.5	-91.5	168.7	0	0	0	115.8
11	N	40.6	Very low	48.6	Very low	125 Å²	125	141.1 Å²	141.1	67%	0.668	77%	0.766	S	S	*	*			trans	-106.8	64.8	172.4	-76.6	12.3	0	0	0	111.4	E13	N11-E13 PolarHBondContact O-N 3.49Å
12	D	46.3	Very low	50.3	Low	156 Å²	156	134.2 Å²	134.2	83%	0.834	74%	0.738	S	S	*	*			trans	-78.8	39.6	161.7	-142.7	5.8	0	0	0	110.4	C14	D12-C14 PolarHBondContact O-N 3.36Å
13	E	48.6	Very low	52.2	Low	148 Å²	148	133 Å²	133	69%	0.692	73%	0.733	S	S	*	*			trans	-77	83.9	-176.7	-72	-164.3	126.1	0	0	110.2	N11 K15	N11-E13 PolarHBondContact O-N 3.49Å; E13-K15 PolarHBondContact O-N 2.8Å
14	C	48.8	Very low	54.4	Low	121 Å²	121	133.7 Å²	133.7	82%	0.818	72%	0.721	S	S	*	*			trans	34.4	72.9	157.6	-163.9	0	0	0	0	114.5	D12 S16	D12-C14 PolarHBondContact O-N 3.36Å; C14-S16 PolarHBondContact O-N 3.1Å
15	K	49.9	Very low	56.8	Low	147 Å²	147	131.9 Å²	131.9	64%	0.639	70%	0.698	S	S	*	*			trans	-53.2	112.2	171.5	-63.9	-176.8	-177.2	-176.3	0	108.6	E13	E13-K15 PolarHBondContact O-N 2.8Å
16	S	61.9	Low	59	Low	74 Å²	74	131.1 Å²	131.1	52%	0.517	68%	0.684	S	S	.	*			trans	-64	148.9	175.4	53.2	0	0	0	0	110	C14 N18 Y19	C14-S16 PolarHBondContact O-N 3.1Å; S16-N18 PolarHBondContact O-N 3.07Å; S16-Y19 WeakPolarHBondContact O-CB 3.41Å; S16-Y19 PolarHBondContact O-N 3.11Å
17	D	60	Low	61.6	Low	173 Å²	173	127.3 Å²	127.3	93%	0.925	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58	-14.2	-175.4	-62.2	-52.9	0	0	0	114.8
18	N	69.8	Low	64.2	Low	152 Å²	152	122.9 Å²	122.9	81%	0.813	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	11.8	176.6	-61.5	-53.6	0	0	0	113.7	S16 I20	S16-N18 PolarHBondContact O-N 3.07Å; N18-I20 PolarHBondContact O-N 3.08Å
19	Y	77.6	Confident	66.7	Low	130 Å²	130	119.5 Å²	119.5	51%	0.51	60%	0.603	S	S	.	*			trans	-75.6	102.2	176	-177.9	-95.4	0	0	0	110.6	S16 E21	S16-Y19 WeakPolarHBondContact O-CB 3.41Å; S16-Y19 PolarHBondContact O-N 3.11Å; Y19-E21 HydrophobicContact CE1-CB 4.38Å
20	I	77.9	Confident	69.2	Low	153 Å²	153	116.6 Å²	116.6	79%	0.785	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-83.9	124.7	168.8	-57.4	176.7	0	0	0	107.9	N18	N18-I20 PolarHBondContact O-N 3.08Å
21	E	76.8	Confident	71.7	Confident	142 Å²	142	109.8 Å²	109.8	66%	0.664	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-66.2	141.5	177.7	-170.3	165	-147.6	0	0	111.1	Y19 H23	Y19-E21 HydrophobicContact CE1-CB 4.38Å; E21-H23 PolarHBondContact O-N 2.81Å
22	P	75.2	Confident	74.1	Confident	88 Å²	88	104.9 Å²	104.9	57%	0.571	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-54	128.6	179.2	-28.2	36.1	0	0	0	112.4	Y24	P22-Y24 PolarHBondContact O-N 2.9Å
23	H	74.6	Confident	76.1	Confident	160 Å²	160	97.9 Å²	97.9	74%	0.741	48%	0.481	S	S	*	.	S	Bend	trans	-66.3	-22.4	-174.6	-177.7	74.2	0	0	0	113.9	E21 K25	E21-H23 PolarHBondContact O-N 2.81Å; H23-K25 PolarHBondContact O-N 2.88Å
24	Y	83.5	Confident	78.1	Confident	151 Å²	151	92.5 Å²	92.5	59%	0.592	46%	0.457	S	S	*	.			trans	-65.5	125.3	-178.7	-175.5	-89.7	0	0	0	111.9	P22 E26 R29	P22-Y24 PolarHBondContact O-N 2.9Å; Y24-E26 HydrophobicContact CE1-CB 4.35Å; Y24-E26 WeakPolarHBondContact CE1-OE2 3.46Å; Y24-E26 PolarHBondContact OH-OE2 3.38Å; Y24-R29 WeakPolarHBondContact OH-CD 3.28Å
25	K	85	Confident	80	Confident	79 Å²	79	86.7 Å²	86.7	34%	0.343	42%	0.418	S	S	.	.			trans	-130.7	125.1	171.2	-48	-178.4	-162.5	159.9	0	109	H23 W27 Y28	H23-K25 PolarHBondContact O-N 2.88Å; K25-W27 HydrophobicContact CB-CD2 4.19Å; K25-W27 HydrophobicContact CB-CG 4.3Å; K25-W27 HydrophobicContact CD-CD2 4.45Å; K25-W27 HydrophobicContact CD-CH2 4.08Å; K25-W27 HydrophobicContact CD-CZ2 3.32Å; K25-W27 PolarHBondContact O-N 3.04Å; K25-Y28 HydrophobicContact CB-CD2 3.69Å; K25-Y28 HydrophobicContact CB-CE2 4.05Å; K25-Y28 HydrophobicContact CB-CG 4.41Å; K25-Y28 HydrophobicContact CD-CD2 4.01Å; K25-Y28 HydrophobicContact CD-CE2 3.46Å; K25-Y28 VanDerWaalsContact CD-CE2 3.46Å; K25-Y28 HydrophobicContact CG-CD2 3.97Å; K25-Y28 HydrophobicContact CG-CE2 3.83Å; K25-Y28 PolarHBondContact NZ-OH 3.08Å; K25-Y28 PolarHBondContact O-N 3.46Å
26	E	86.6	Confident	81.8	Confident	86 Å²	86	79.9 Å²	79.9	40%	0.402	39%	0.388	S	S	.	.	H	α-helix	trans	-58.9	-35.8	-177.3	-174.8	58.2	-149.8	0	0	112.2	Y24 Y28 R29 V30	Y24-E26 HydrophobicContact CE1-CB 4.35Å; Y24-E26 WeakPolarHBondContact CE1-OE2 3.46Å; Y24-E26 PolarHBondContact OH-OE2 3.38Å; E26-Y28 PolarHBondContact O-N 3.34Å; E26-R29 WeakPolarHBondContact O-CA 3.49Å; E26-R29 VanDerWaalsContact O-CB 3.29Å; E26-R29 WeakPolarHBondContact O-CB 3.46Å; E26-R29 PolarHBondContact O-N 3.38Å; E26-R29 IonicContact OE1-CZ 3.67Å; E26-R29 IonicContact OE1-NE 3.85Å; E26-R29 PolarHBondContact OE1-NE 2.94Å; E26-R29 IonicContact OE1-NH2 2.83Å; E26-R29 PolarHBondContact OE1-NH2 3.34Å; E26-R29 IonicContact OE2-NE 2.63Å; E26-V30 HydrophobicContact CG-CG2 4.24Å; E26-V30 WeakPolarHBondContact O-CG2 3.04Å; E26-V30 PolarHBondContact O-N 3.3Å
27	W	86.3	Confident	83	Confident	74 Å²	74	79.9 Å²	79.9	28%	0.28	38%	0.38	S	S	.	.	H	α-helix	trans	-65.4	-30.6	-179.8	54.5	-105.6	0	0	0	114.3	K25 R29 A31 E50 V52 F55	K25-W27 HydrophobicContact CB-CD2 4.19Å; K25-W27 HydrophobicContact CB-CG 4.3Å; K25-W27 HydrophobicContact CD-CD2 4.45Å; K25-W27 HydrophobicContact CD-CH2 4.08Å; K25-W27 HydrophobicContact CD-CZ2 3.32Å; K25-W27 PolarHBondContact O-N 3.04Å; W27-R29 VanDerWaalsContact C-N 3.27Å; W27-R29 PolarHBondContact O-N 2.97Å; W27-A31 VanDerWaalsContact O-CB 3.24Å; W27-A31 WeakPolarHBondContact O-CB 3.33Å; W27-A31 PolarHBondContact O-N 3.3Å; W27-E50 WeakPolarHBondContact CB-OE2 3.48Å; W27-V52 HydrophobicContact CD2-CG1 4.3Å; W27-V52 HydrophobicContact CD2-CG2 4.08Å; W27-V52 HydrophobicContact CE3-CB 4.44Å; W27-V52 HydrophobicContact CE3-CG1 3.48Å; W27-V52 VanDerWaalsContact CE3-CG1 3.48Å; W27-V52 HydrophobicContact CE3-CG2 4.04Å; W27-V52 HydrophobicContact CG-CG2 4.45Å; W27-V52 HydrophobicContact CH2-CG1 3.7Å; W27-V52 HydrophobicContact CZ2-CG1 4.47Å; W27-V52 HydrophobicContact CZ3-CB 4.38Å; W27-V52 HydrophobicContact CZ3-CG1 3.13Å; W27-V52 HydrophobicContact CZ3-CG2 4.33Å; W27-F55 HydrophobicContact CZ3-CD1 4.33Å
28	Y	88.3	Confident	84.2	Confident	58 Å²	58	78.2 Å²	78.2	23%	0.227	37%	0.366	C	S	.	.	H	α-helix	trans	-60.2	-42.4	170	-72.8	-47.5	0	0	0	110.6	K25 E26 I32 F55	K25-Y28 HydrophobicContact CB-CD2 3.69Å; K25-Y28 HydrophobicContact CB-CE2 4.05Å; K25-Y28 HydrophobicContact CB-CG 4.41Å; K25-Y28 HydrophobicContact CD-CD2 4.01Å; K25-Y28 HydrophobicContact CD-CE2 3.46Å; K25-Y28 VanDerWaalsContact CD-CE2 3.46Å; K25-Y28 HydrophobicContact CG-CD2 3.97Å; K25-Y28 HydrophobicContact CG-CE2 3.83Å; K25-Y28 PolarHBondContact NZ-OH 3.08Å; K25-Y28 PolarHBondContact O-N 3.46Å; E26-Y28 PolarHBondContact O-N 3.34Å; Y28-I32 WeakPolarHBondContact O-CD1 3.33Å; Y28-I32 VanDerWaalsContact O-CG1 3.28Å; Y28-I32 WeakPolarHBondContact O-CG1 3.4Å; Y28-I32 PolarHBondContact O-N 2.87Å; Y28-F55 HydrophobicContact CD1-CB 4.41Å; Y28-F55 AromaticContact CD1-CD1 3.77Å; Y28-F55 HydrophobicContact CD1-CD1 3.77Å; Y28-F55 AromaticContact CD1-CD2 3.48Å; Y28-F55 HydrophobicContact CD1-CD2 3.48Å; Y28-F55 VanDerWaalsContact CD1-CD2 3.48Å; Y28-F55 AromaticContact CD1-CE1 3.79Å; Y28-F55 HydrophobicContact CD1-CE1 3.79Å; Y28-F55 AromaticContact CD1-CE2 3.5Å; Y28-F55 HydrophobicContact CD1-CE2 3.5Å; Y28-F55 VanDerWaalsContact CD1-CE2 3.5Å; Y28-F55 AromaticContact CD1-CG 3.62Å; Y28-F55 HydrophobicContact CD1-CG 3.62Å; Y28-F55 AromaticContact CD1-CZ 3.66Å; Y28-F55 HydrophobicContact CD1-CZ 3.66Å; Y28-F55 HydrophobicContact CE1-CB 3.78Å; Y28-F55 AromaticContact CE1-CD1 3.91Å; Y28-F55 HydrophobicContact CE1-CD1 3.91Å; Y28-F55 AromaticContact CE1-CD2 3.63Å; Y28-F55 HydrophobicContact CE1-CD2 3.63Å; Y28-F55 HydrophobicContact CE1-CE1 4.4Å; Y28-F55 HydrophobicContact CE1-CE2 4.16Å; Y28-F55 AromaticContact CE1-CG 3.49Å; Y28-F55 HydrophobicContact CE1-CG 3.49Å; Y28-F55 VanDerWaalsContact CE1-CG 3.49Å; Y28-F55 HydrophobicContact CG-CE2 4.29Å; Y28-F55 HydrophobicContact CG-CZ 4.47Å
29	R	89.5	Confident	85.1	Confident	50 Å²	50	71.8 Å²	71.8	19%	0.189	34%	0.336	C	S	.	.	H	α-helix	trans	-69.7	-43.3	-177.6	-157.8	-157.4	59.3	56	22.4	111.3	Y24 E26 W27 I32 D33 Y215	Y24-R29 WeakPolarHBondContact OH-CD 3.28Å; E26-R29 WeakPolarHBondContact O-CA 3.49Å; E26-R29 VanDerWaalsContact O-CB 3.29Å; E26-R29 WeakPolarHBondContact O-CB 3.46Å; E26-R29 PolarHBondContact O-N 3.38Å; E26-R29 IonicContact OE1-CZ 3.67Å; E26-R29 IonicContact OE1-NE 3.85Å; E26-R29 PolarHBondContact OE1-NE 2.94Å; E26-R29 IonicContact OE1-NH2 2.83Å; E26-R29 PolarHBondContact OE1-NH2 3.34Å; E26-R29 IonicContact OE2-NE 2.63Å; W27-R29 VanDerWaalsContact C-N 3.27Å; W27-R29 PolarHBondContact O-N 2.97Å; R29-I32 PolarHBondContact O-N 3.09Å; R29-D33 IonicContact CZ-OD2 3.12Å; R29-D33 VanDerWaalsContact CZ-OD2 3.31Å; R29-D33 IonicContact NH1-OD1 3.87Å; R29-D33 IonicContact NH1-OD2 2.69Å; R29-D33 PolarHBondContact NH1-OD2 3.02Å; R29-D33 IonicContact NH2-OD2 3.27Å; R29-D33 PolarHBondContact NH2-OD2 3.04Å; R29-D33 PolarHBondContact O-N 3.18Å; R29-D33 VanDerWaalsContact O-N 3.08Å; R29-Y215 PolarHBondContact O-OH 3.44Å
30	V	89.6	Confident	85.6	Confident	39 Å²	39	68.9 Å²	68.9	24%	0.236	33%	0.329	C	S	.	.	H	α-helix	trans	-65.9	-42.2	175.8	177.2	0	0	0	0	111.7	E26 I32 D33 I34 F46	E26-V30 HydrophobicContact CG-CG2 4.24Å; E26-V30 WeakPolarHBondContact O-CG2 3.04Å; E26-V30 PolarHBondContact O-N 3.3Å; V30-I32 VanDerWaalsContact C-N 3.28Å; V30-I32 PolarHBondContact O-N 3.42Å; V30-D33 WeakPolarHBondContact O-CB 3.49Å; V30-D33 PolarHBondContact O-N 3.21Å; V30-I34 HydrophobicContact CG1-CD1 3.84Å; V30-I34 HydrophobicContact CG1-CG1 4.46Å; V30-I34 WeakPolarHBondContact O-CG1 3.32Å; V30-I34 PolarHBondContact O-N 3.38Å; V30-F46 HydrophobicContact CB-CZ 3.94Å; V30-F46 HydrophobicContact CG1-CE1 4.29Å; V30-F46 HydrophobicContact CG1-CE2 3.69Å; V30-F46 HydrophobicContact CG1-CZ 3.5Å; V30-F46 VanDerWaalsContact CG1-CZ 3.5Å
31	A	89.6	Confident	86.2	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-60.2	-39	176.3	0	0	0	0	0	111.9	W27 I34 L35 Y43 F46 F55	W27-A31 VanDerWaalsContact O-CB 3.24Å; W27-A31 WeakPolarHBondContact O-CB 3.33Å; W27-A31 PolarHBondContact O-N 3.3Å; A31-I34 PolarHBondContact O-N 3.23Å; A31-L35 WeakPolarHBondContact O-CB 3.39Å; A31-L35 PolarHBondContact O-N 2.73Å; A31-Y43 HydrophobicContact CB-CD2 4.03Å; A31-Y43 HydrophobicContact CB-CE2 3.75Å; A31-Y43 WeakPolarHBondContact O-CD2 3.04Å; A31-F46 HydrophobicContact CB-CD1 3.77Å; A31-F46 HydrophobicContact CB-CE1 3.72Å; A31-F55 HydrophobicContact CB-CE1 3.84Å; A31-F55 HydrophobicContact CB-CZ 4.02Å
32	I	89.4	Confident	86.7	Confident	22 Å²	22	63.4 Å²	63.4	11%	0.113	30%	0.303	C	S	.	.	H	α-helix	trans	-69.6	-38.5	176	-64.7	163.4	0	0	0	111.5	Y28 R29 V30 L35 I36 F55 L56 Y215 F223	Y28-I32 WeakPolarHBondContact O-CD1 3.33Å; Y28-I32 VanDerWaalsContact O-CG1 3.28Å; Y28-I32 WeakPolarHBondContact O-CG1 3.4Å; Y28-I32 PolarHBondContact O-N 2.87Å; R29-I32 PolarHBondContact O-N 3.09Å; V30-I32 VanDerWaalsContact C-N 3.28Å; V30-I32 PolarHBondContact O-N 3.42Å; I32-L35 PolarHBondContact O-N 2.82Å; I32-I36 HydrophobicContact CG2-CD1 3.8Å; I32-I36 HydrophobicContact CG2-CG1 4.43Å; I32-I36 WeakPolarHBondContact O-CB 3.42Å; I32-I36 WeakPolarHBondContact O-CD1 3.07Å; I32-I36 WeakPolarHBondContact O-CG1 3.48Å; I32-I36 PolarHBondContact O-N 3.06Å; I32-F55 HydrophobicContact CD1-CE2 4.48Å; I32-F55 HydrophobicContact CG1-CZ 4.3Å; I32-L56 HydrophobicContact CG1-CD1 4.5Å; I32-Y215 HydrophobicContact CD1-CE2 4.25Å; I32-Y215 HydrophobicContact CG2-CD1 4.32Å; I32-Y215 HydrophobicContact CG2-CE1 3.54Å; I32-Y215 HydrophobicContact CG2-CE2 4.23Å; I32-Y215 VanDerWaalsContact CG2-CZ 3.49Å; I32-Y215 WeakPolarHBondContact CG2-OH 3.3Å; I32-F223 HydrophobicContact CG2-CE1 4.3Å
33	D	89.3	Confident	87.4	Confident	9 Å²	9	59.2 Å²	59.2	5%	0.048	28%	0.276	C	S	.	.	H	α-helix	trans	-58	-48.3	171.7	-66.2	-41.5	0	0	0	110.9	R29 V30 L35 I36 E37 S217 K218	R29-D33 IonicContact CZ-OD2 3.12Å; R29-D33 VanDerWaalsContact CZ-OD2 3.31Å; R29-D33 IonicContact NH1-OD1 3.87Å; R29-D33 IonicContact NH1-OD2 2.69Å; R29-D33 PolarHBondContact NH1-OD2 3.02Å; R29-D33 IonicContact NH2-OD2 3.27Å; R29-D33 PolarHBondContact NH2-OD2 3.04Å; R29-D33 PolarHBondContact O-N 3.18Å; R29-D33 VanDerWaalsContact O-N 3.08Å; V30-D33 WeakPolarHBondContact O-CB 3.49Å; V30-D33 PolarHBondContact O-N 3.21Å; D33-L35 PolarHBondContact O-N 2.97Å; D33-I36 WeakPolarHBondContact O-CB 3.36Å; D33-I36 PolarHBondContact O-N 3.44Å; D33-I36 VanDerWaalsContact O-N 3.12Å; D33-E37 WeakPolarHBondContact O-CB 3.41Å; D33-E37 WeakPolarHBondContact O-CG 3.21Å; D33-E37 PolarHBondContact O-N 3Å; D33-S217 WeakPolarHBondContact OD1-CA 3.35Å; D33-S217 WeakPolarHBondContact OD1-CB 3.45Å; D33-K218 PolarHBondContact OD1-N 3.11Å; D33-K218 WeakPolarHBondContact OD2-CG 3.48Å
34	I	89.4	Confident	88.1	Confident	34 Å²	34	56.4 Å²	56.4	17%	0.174	26%	0.263	C	S	.	.	H	α-helix	trans	-63.4	-41.7	-179.5	-68.7	168.5	0	0	0	111.3	V30 A31 I36 E37 H38 G39 A42 F46	V30-I34 HydrophobicContact CG1-CD1 3.84Å; V30-I34 HydrophobicContact CG1-CG1 4.46Å; V30-I34 WeakPolarHBondContact O-CG1 3.32Å; V30-I34 PolarHBondContact O-N 3.38Å; A31-I34 PolarHBondContact O-N 3.23Å; I34-I36 VanDerWaalsContact C-N 3.29Å; I34-I36 PolarHBondContact O-N 2.68Å; I34-E37 PolarHBondContact O-N 3.16Å; I34-H38 PolarHBondContact O-N 3.11Å; I34-G39 PolarHBondContact O-N 3.23Å; I34-A42 HydrophobicContact CG2-CB 3.79Å; I34-F46 HydrophobicContact CD1-CB 3.96Å; I34-F46 HydrophobicContact CD1-CD1 4.2Å; I34-F46 HydrophobicContact CD1-CD2 3.25Å; I34-F46 HydrophobicContact CD1-CE2 3.7Å; I34-F46 HydrophobicContact CD1-CG 3.52Å; I34-F46 HydrophobicContact CD1-CZ 4.34Å; I34-F46 HydrophobicContact CG2-CB 4.47Å
35	L	89.5	Confident	88.4	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-60.8	-38.8	173.8	178.2	61.3	0	0	0	112	A31 I32 D33 G39 Y43 L56 I61 I64 L65	A31-L35 WeakPolarHBondContact O-CB 3.39Å; A31-L35 PolarHBondContact O-N 2.73Å; I32-L35 PolarHBondContact O-N 2.82Å; D33-L35 PolarHBondContact O-N 2.97Å; L35-G39 VanDerWaalsContact O-CA 3.26Å; L35-G39 WeakPolarHBondContact O-CA 3.15Å; L35-G39 PolarHBondContact O-N 2.79Å; L35-Y43 HydrophobicContact CB-CD2 3.96Å; L35-Y43 HydrophobicContact CB-CG 4.32Å; L35-Y43 HydrophobicContact CD1-CG 4.35Å; L35-L56 HydrophobicContact CD2-CD1 3.86Å; L35-I61 HydrophobicContact CD1-CG2 3.95Å; L35-I61 HydrophobicContact CD2-CG1 4.34Å; L35-I61 HydrophobicContact CD2-CG2 4.26Å; L35-I64 HydrophobicContact CD2-CD1 4.24Å; L35-I64 HydrophobicContact CD2-CG2 4.33Å; L35-L65 HydrophobicContact CD1-CD1 4.15Å; L35-L65 HydrophobicContact CD1-CD2 3.96Å; L35-L65 HydrophobicContact CD1-CG 4.11Å; L35-L65 HydrophobicContact CG-CD2 4.28Å; L35-L65 VanDerWaalsContact O-CD2 3.32Å; L35-L65 WeakPolarHBondContact O-CD2 3.46Å
36	I	88.7	Confident	88.6	Confident	4 Å²	4	53 Å²	53	2%	0.021	25%	0.254	C	S	.	.	H	α-helix	trans	-69.9	-39.3	177.6	-75.4	170.3	0	0	0	111.6	I32 D33 I34 I64 V68 K70 Y215 A221 F223	I32-I36 HydrophobicContact CG2-CD1 3.8Å; I32-I36 HydrophobicContact CG2-CG1 4.43Å; I32-I36 WeakPolarHBondContact O-CB 3.42Å; I32-I36 WeakPolarHBondContact O-CD1 3.07Å; I32-I36 WeakPolarHBondContact O-CG1 3.48Å; I32-I36 PolarHBondContact O-N 3.06Å; D33-I36 WeakPolarHBondContact O-CB 3.36Å; D33-I36 PolarHBondContact O-N 3.44Å; D33-I36 VanDerWaalsContact O-N 3.12Å; I34-I36 VanDerWaalsContact C-N 3.29Å; I34-I36 PolarHBondContact O-N 2.68Å; I36-I64 HydrophobicContact CG1-CG2 4.01Å; I36-V68 HydrophobicContact CD1-CG2 4.26Å; I36-V68 HydrophobicContact CG1-CG2 3.82Å; I36-V68 HydrophobicContact CG2-CG1 4.07Å; I36-K70 WeakPolarHBondContact O-CE 3.35Å; I36-K70 PolarHBondContact O-NZ 2.75Å; I36-Y215 HydrophobicContact CD1-CD1 4.33Å; I36-Y215 HydrophobicContact CD1-CE1 4.01Å; I36-A221 HydrophobicContact CG2-CB 3.89Å; I36-F223 HydrophobicContact CD1-CD1 4.28Å; I36-F223 HydrophobicContact CD1-CE1 4.09Å
37	E	86.8	Confident	88.8	Confident	73 Å²	73	49.5 Å²	49.5	34%	0.341	24%	0.237	S	C	.	.	H	α-helix	trans	-86	-53.3	-171.9	-72	171	-153.9	0	0	112.1	D33 I34 T219	D33-E37 WeakPolarHBondContact O-CB 3.41Å; D33-E37 WeakPolarHBondContact O-CG 3.21Å; D33-E37 PolarHBondContact O-N 3Å; I34-E37 PolarHBondContact O-N 3.16Å; E37-T219 VanDerWaalsContact CD-CG2 3.42Å; E37-T219 HydrophobicContact CG-CG2 3.94Å; E37-T219 WeakPolarHBondContact OE1-CB 3.48Å; E37-T219 WeakPolarHBondContact OE1-CG2 3.34Å; E37-T219 PolarHBondContact OE1-OG1 2.9Å
38	H	85.7	Confident	89	Confident	139 Å²	139	51.5 Å²	51.5	64%	0.644	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	-15.7	-171.9	-62.5	-76	0	0	0	114.4	I34 A42	I34-H38 PolarHBondContact O-N 3.11Å; H38-A42 HydrophobicContact CB-CB 3.38Å
39	G	87.5	Confident	89	Confident	16 Å²	16	56.3 Å²	56.3	17%	0.165	28%	0.282	C	S	.	.			trans	91.4	-165.1	175.6	0	0	0	0	0	114.9	I34 L35 Y43	I34-G39 PolarHBondContact O-N 3.23Å; L35-G39 VanDerWaalsContact O-CA 3.26Å; L35-G39 WeakPolarHBondContact O-CA 3.15Å; L35-G39 PolarHBondContact O-N 2.79Å; G39-Y43 PolarHBondContact O-N 3.3Å; G39-Y43 VanDerWaalsContact O-N 3.14Å
40	L	89.2	Confident	88.9	Confident	70 Å²	70	58.5 Å²	58.5	37%	0.366	29%	0.294	S	S	.	.	H	α-helix	trans	-66.2	-39.9	-168	-173	156.3	0	0	0	113.2	Y43 Q44 I61	L40-Y43 WeakPolarHBondContact O-CB 3.39Å; L40-Y43 PolarHBondContact O-N 3.01Å; L40-Q44 HydrophobicContact CD2-CG 4.26Å; L40-Q44 PolarHBondContact O-N 3.49Å; L40-I61 HydrophobicContact CD1-CG2 3.98Å; L40-I61 HydrophobicContact CG-CG2 4.41Å
41	E	88.7	Confident	88.6	Confident	159 Å²	159	67.5 Å²	67.5	74%	0.743	32%	0.324	S	S	*	.	H	α-helix	trans	-62.3	-51.9	-178.4	-64.1	173.9	173.4	0	0	110.8	Y43 Q44 E45	E41-Y43 VanDerWaalsContact C-N 3.31Å; E41-Y43 PolarHBondContact O-N 2.98Å; E41-Q44 PolarHBondContact O-N 3.1Å; E41-Q44 VanDerWaalsContact O-N 3.11Å; E41-E45 PolarHBondContact O-N 3.2Å
42	A	88.3	Confident	88.3	Confident	20 Å²	20	68.7 Å²	68.7	17%	0.165	33%	0.331	C	S	.	.	H	α-helix	trans	-65.6	-30.1	177.2	0	0	0	0	0	113.5	I34 H38 F46	I34-A42 HydrophobicContact CG2-CB 3.79Å; H38-A42 HydrophobicContact CB-CB 3.38Å; A42-F46 VanDerWaalsContact O-CB 3.3Å; A42-F46 WeakPolarHBondContact O-CB 3.42Å; A42-F46 PolarHBondContact O-N 3.18Å
43	Y	89.2	Confident	88.1	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-62	-44.9	170.6	173.2	-99.7	0	0	0	111.2	A31 L35 G39 L40 E41 F46 L47 D54 F55 L56 I61	A31-Y43 HydrophobicContact CB-CD2 4.03Å; A31-Y43 HydrophobicContact CB-CE2 3.75Å; A31-Y43 WeakPolarHBondContact O-CD2 3.04Å; L35-Y43 HydrophobicContact CB-CD2 3.96Å; L35-Y43 HydrophobicContact CB-CG 4.32Å; L35-Y43 HydrophobicContact CD1-CG 4.35Å; G39-Y43 PolarHBondContact O-N 3.3Å; G39-Y43 VanDerWaalsContact O-N 3.14Å; L40-Y43 WeakPolarHBondContact O-CB 3.39Å; L40-Y43 PolarHBondContact O-N 3.01Å; E41-Y43 VanDerWaalsContact C-N 3.31Å; E41-Y43 PolarHBondContact O-N 2.98Å; Y43-F46 PolarHBondContact O-N 3.47Å; Y43-L47 HydrophobicContact CD1-CD1 3.95Å; Y43-L47 HydrophobicContact CE1-CD1 3.45Å; Y43-L47 VanDerWaalsContact CE1-CD1 3.45Å; Y43-L47 HydrophobicContact CE1-CG 4.29Å; Y43-L47 WeakPolarHBondContact O-CG 3.26Å; Y43-L47 PolarHBondContact O-N 3.07Å; Y43-D54 PolarHBondContact OH-OD1 3.23Å; Y43-D54 VanDerWaalsContact OH-OD1 3.06Å; Y43-F55 AromaticContact CE2-CE1 3.89Å; Y43-F55 HydrophobicContact CE2-CE1 3.89Å; Y43-F55 HydrophobicContact CE2-CZ 4.2Å; Y43-F55 AromaticContact CZ-CE1 3.96Å; Y43-F55 WeakPolarHBondContact OH-CD1 3.32Å; Y43-F55 WeakPolarHBondContact OH-CE1 3.43Å; Y43-L56 HydrophobicContact CE2-CD1 4.02Å; Y43-I61 HydrophobicContact CD1-CD1 4.42Å; Y43-I61 HydrophobicContact CE1-CD1 3.96Å
44	Q	89.1	Confident	87.9	Confident	102 Å²	102	76.1 Å²	76.1	48%	0.477	38%	0.379	S	S	.	.	H	α-helix	trans	-67.6	-40.6	176.6	-69.6	-177.3	-15.7	0	0	112.3	L40 E41 F46 L47 V48	L40-Q44 HydrophobicContact CD2-CG 4.26Å; L40-Q44 PolarHBondContact O-N 3.49Å; E41-Q44 PolarHBondContact O-N 3.1Å; E41-Q44 VanDerWaalsContact O-N 3.11Å; Q44-F46 PolarHBondContact O-N 3.32Å; Q44-L47 PolarHBondContact O-N 2.78Å; Q44-V48 WeakPolarHBondContact O-CG2 3.15Å; Q44-V48 PolarHBondContact O-N 2.94Å
45	E	90.9	Very high	87.8	Confident	140 Å²	140	77.2 Å²	77.2	65%	0.654	38%	0.383	S	S	*	.	H	α-helix	trans	-60.2	-43.4	173.2	-69.8	-175.2	158.3	0	0	111.9	E41 V48 Q49	E41-E45 PolarHBondContact O-N 3.2Å; E45-V48 PolarHBondContact O-N 3.12Å; E45-Q49 WeakPolarHBondContact O-CB 3.3Å; E45-Q49 PolarHBondContact O-N 2.8Å
46	F	89.5	Confident	87.8	Confident	19 Å²	19	78.4 Å²	78.4	8%	0.083	39%	0.389	C	S	.	.	H	α-helix	trans	-62.5	-44.9	176.7	179.5	-100.6	0	0	0	112.6	V30 A31 I34 A42 Y43 Q44 V48 Q49 E50	V30-F46 HydrophobicContact CB-CZ 3.94Å; V30-F46 HydrophobicContact CG1-CE1 4.29Å; V30-F46 HydrophobicContact CG1-CE2 3.69Å; V30-F46 HydrophobicContact CG1-CZ 3.5Å; V30-F46 VanDerWaalsContact CG1-CZ 3.5Å; A31-F46 HydrophobicContact CB-CD1 3.77Å; A31-F46 HydrophobicContact CB-CE1 3.72Å; I34-F46 HydrophobicContact CD1-CB 3.96Å; I34-F46 HydrophobicContact CD1-CD1 4.2Å; I34-F46 HydrophobicContact CD1-CD2 3.25Å; I34-F46 HydrophobicContact CD1-CE2 3.7Å; I34-F46 HydrophobicContact CD1-CG 3.52Å; I34-F46 HydrophobicContact CD1-CZ 4.34Å; I34-F46 HydrophobicContact CG2-CB 4.47Å; A42-F46 VanDerWaalsContact O-CB 3.3Å; A42-F46 WeakPolarHBondContact O-CB 3.42Å; A42-F46 PolarHBondContact O-N 3.18Å; Y43-F46 PolarHBondContact O-N 3.47Å; Q44-F46 PolarHBondContact O-N 3.32Å; F46-V48 VanDerWaalsContact C-N 3.31Å; F46-V48 PolarHBondContact O-N 3.33Å; F46-Q49 PolarHBondContact O-N 3.3Å; F46-E50 HydrophobicContact CD2-CG 4.35Å; F46-E50 HydrophobicContact CE1-CG 4.3Å; F46-E50 HydrophobicContact CE2-CG 3.8Å; F46-E50 HydrophobicContact CZ-CG 3.77Å; F46-E50 WeakPolarHBondContact CZ-OE1 3.42Å; F46-E50 VanDerWaalsContact CZ-OE2 3.24Å; F46-E50 WeakPolarHBondContact CZ-OE2 3.33Å; F46-E50 PolarHBondContact O-N 2.86Å
47	L	89.6	Confident	87.8	Confident	11 Å²	11	80.7 Å²	80.7	6%	0.058	41%	0.408	C	S	.	.	H	α-helix	trans	-57.6	-43.6	174.5	-72.2	175.9	0	0	0	111.7	Y43 Q44 R51 V52 D54 F55	Y43-L47 HydrophobicContact CD1-CD1 3.95Å; Y43-L47 HydrophobicContact CE1-CD1 3.45Å; Y43-L47 VanDerWaalsContact CE1-CD1 3.45Å; Y43-L47 HydrophobicContact CE1-CG 4.29Å; Y43-L47 WeakPolarHBondContact O-CG 3.26Å; Y43-L47 PolarHBondContact O-N 3.07Å; Q44-L47 PolarHBondContact O-N 2.78Å; L47-R51 CarbonylContact O-C 3.55Å; L47-R51 WeakPolarHBondContact O-CA 3.48Å; L47-R51 PolarHBondContact O-N 2.94Å; L47-V52 HydrophobicContact CD2-CB 3.88Å; L47-V52 HydrophobicContact CD2-CG1 3.48Å; L47-V52 VanDerWaalsContact CD2-CG1 3.48Å; L47-V52 PolarHBondContact O-N 3.01Å; L47-D54 HydrophobicContact CD1-CB 3.85Å; L47-F55 HydrophobicContact CD2-CD1 4.29Å; L47-F55 HydrophobicContact CD2-CE1 4.37Å
48	V	90.6	Very high	87.9	Confident	116 Å²	116	84.8 Å²	84.8	70%	0.703	43%	0.427	S	S	*	.	H	α-helix	trans	-66	-40.9	176.1	171.7	0	0	0	0	111.6	Q44 E45 F46 R51	Q44-V48 WeakPolarHBondContact O-CG2 3.15Å; Q44-V48 PolarHBondContact O-N 2.94Å; E45-V48 PolarHBondContact O-N 3.12Å; F46-V48 VanDerWaalsContact C-N 3.31Å; F46-V48 PolarHBondContact O-N 3.33Å; V48-R51 PolarHBondContact O-N 3.08Å
49	Q	89.6	Confident	87.9	Confident	160 Å²	160	86 Å²	86	75%	0.748	43%	0.434	S	S	*	.	H	α-helix	trans	-66.4	-47.4	-178.8	-176.3	174.9	-5	0	0	112.5	E45 F46 R51	E45-Q49 WeakPolarHBondContact O-CB 3.3Å; E45-Q49 PolarHBondContact O-N 2.8Å; F46-Q49 PolarHBondContact O-N 3.3Å; Q49-R51 VanDerWaalsContact C-N 3.25Å; Q49-R51 PolarHBondContact O-N 2.59Å
50	E	86.8	Confident	88	Confident	95 Å²	95	90 Å²	90	44%	0.444	45%	0.447	S	S	.	.	H	α-helix	trans	-80.2	-5.2	175.8	-65.9	-154.8	153.8	0	0	113.4	W27 F46 V52	W27-E50 WeakPolarHBondContact CB-OE2 3.48Å; F46-E50 HydrophobicContact CD2-CG 4.35Å; F46-E50 HydrophobicContact CE1-CG 4.3Å; F46-E50 HydrophobicContact CE2-CG 3.8Å; F46-E50 HydrophobicContact CZ-CG 3.77Å; F46-E50 WeakPolarHBondContact CZ-OE1 3.42Å; F46-E50 VanDerWaalsContact CZ-OE2 3.24Å; F46-E50 WeakPolarHBondContact CZ-OE2 3.33Å; F46-E50 PolarHBondContact O-N 2.86Å; E50-V52 HydrophobicContact CB-CB 4.49Å; E50-V52 HydrophobicContact CB-CG2 3.65Å; E50-V52 PolarHBondContact O-N 3.3Å
51	R	83.7	Confident	88	Confident	229 Å²	229	87 Å²	87	86%	0.864	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	35.5	-174.9	-52.7	178.7	179.3	178.7	-0.6	112.9	L47 V48 Q49	L47-R51 CarbonylContact O-C 3.55Å; L47-R51 WeakPolarHBondContact O-CA 3.48Å; L47-R51 PolarHBondContact O-N 2.94Å; V48-R51 PolarHBondContact O-N 3.08Å; Q49-R51 VanDerWaalsContact C-N 3.25Å; Q49-R51 PolarHBondContact O-N 2.59Å
52	V	83.5	Confident	88.1	Confident	24 Å²	24	84 Å²	84	15%	0.145	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-87.8	141.4	-179	169.6	0	0	0	0	109.6	W27 L47 E50	W27-V52 HydrophobicContact CD2-CG1 4.3Å; W27-V52 HydrophobicContact CD2-CG2 4.08Å; W27-V52 HydrophobicContact CE3-CB 4.44Å; W27-V52 HydrophobicContact CE3-CG1 3.48Å; W27-V52 VanDerWaalsContact CE3-CG1 3.48Å; W27-V52 HydrophobicContact CE3-CG2 4.04Å; W27-V52 HydrophobicContact CG-CG2 4.45Å; W27-V52 HydrophobicContact CH2-CG1 3.7Å; W27-V52 HydrophobicContact CZ2-CG1 4.47Å; W27-V52 HydrophobicContact CZ3-CB 4.38Å; W27-V52 HydrophobicContact CZ3-CG1 3.13Å; W27-V52 HydrophobicContact CZ3-CG2 4.33Å; L47-V52 HydrophobicContact CD2-CB 3.88Å; L47-V52 HydrophobicContact CD2-CG1 3.48Å; L47-V52 VanDerWaalsContact CD2-CG1 3.48Å; L47-V52 PolarHBondContact O-N 3.01Å; E50-V52 HydrophobicContact CB-CB 4.49Å; E50-V52 HydrophobicContact CB-CG2 3.65Å; E50-V52 PolarHBondContact O-N 3.3Å
53	S	83.9	Confident	88	Confident	99 Å²	99	85 Å²	85	69%	0.692	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-75.2	136.5	170.3	-53.2	0	0	0	0	110.4
54	D	85.6	Confident	88	Confident	88 Å²	88	85.5 Å²	85.5	47%	0.471	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-53.7	140.8	171.8	-160.1	-14.6	0	0	0	110.7	Y43 L47 L56	Y43-D54 PolarHBondContact OH-OD1 3.23Å; Y43-D54 VanDerWaalsContact OH-OD1 3.06Å; L47-D54 HydrophobicContact CD1-CB 3.85Å; D54-L56 PolarHBondContact OD1-N 2.88Å
55	F	88.5	Confident	87.9	Confident	58 Å²	58	84.1 Å²	84.1	25%	0.254	42%	0.419	S	S	.	.			trans	-138.7	-7.7	-166.7	72.3	-88.6	0	0	0	113.9	W27 Y28 A31 I32 Y43 L47	W27-F55 HydrophobicContact CZ3-CD1 4.33Å; Y28-F55 HydrophobicContact CD1-CB 4.41Å; Y28-F55 AromaticContact CD1-CD1 3.77Å; Y28-F55 HydrophobicContact CD1-CD1 3.77Å; Y28-F55 AromaticContact CD1-CD2 3.48Å; Y28-F55 HydrophobicContact CD1-CD2 3.48Å; Y28-F55 VanDerWaalsContact CD1-CD2 3.48Å; Y28-F55 AromaticContact CD1-CE1 3.79Å; Y28-F55 HydrophobicContact CD1-CE1 3.79Å; Y28-F55 AromaticContact CD1-CE2 3.5Å; Y28-F55 HydrophobicContact CD1-CE2 3.5Å; Y28-F55 VanDerWaalsContact CD1-CE2 3.5Å; Y28-F55 AromaticContact CD1-CG 3.62Å; Y28-F55 HydrophobicContact CD1-CG 3.62Å; Y28-F55 AromaticContact CD1-CZ 3.66Å; Y28-F55 HydrophobicContact CD1-CZ 3.66Å; Y28-F55 HydrophobicContact CE1-CB 3.78Å; Y28-F55 AromaticContact CE1-CD1 3.91Å; Y28-F55 HydrophobicContact CE1-CD1 3.91Å; Y28-F55 AromaticContact CE1-CD2 3.63Å; Y28-F55 HydrophobicContact CE1-CD2 3.63Å; Y28-F55 HydrophobicContact CE1-CE1 4.4Å; Y28-F55 HydrophobicContact CE1-CE2 4.16Å; Y28-F55 AromaticContact CE1-CG 3.49Å; Y28-F55 HydrophobicContact CE1-CG 3.49Å; Y28-F55 VanDerWaalsContact CE1-CG 3.49Å; Y28-F55 HydrophobicContact CG-CE2 4.29Å; Y28-F55 HydrophobicContact CG-CZ 4.47Å; A31-F55 HydrophobicContact CB-CE1 3.84Å; A31-F55 HydrophobicContact CB-CZ 4.02Å; I32-F55 HydrophobicContact CD1-CE2 4.48Å; I32-F55 HydrophobicContact CG1-CZ 4.3Å; Y43-F55 AromaticContact CE2-CE1 3.89Å; Y43-F55 HydrophobicContact CE2-CE1 3.89Å; Y43-F55 HydrophobicContact CE2-CZ 4.2Å; Y43-F55 AromaticContact CZ-CE1 3.96Å; Y43-F55 WeakPolarHBondContact OH-CD1 3.32Å; Y43-F55 WeakPolarHBondContact OH-CE1 3.43Å; L47-F55 HydrophobicContact CD2-CD1 4.29Å; L47-F55 HydrophobicContact CD2-CE1 4.37Å
56	L	88.5	Confident	87.7	Confident	25 Å²	25	86 Å²	86	13%	0.131	43%	0.425	C	S	.	.	S	Bend	trans	-105.5	138.1	174	-63.8	176.3	0	0	0	109	I32 L35 Y43 D54 I61 I64	I32-L56 HydrophobicContact CG1-CD1 4.5Å; L35-L56 HydrophobicContact CD2-CD1 3.86Å; Y43-L56 HydrophobicContact CE2-CD1 4.02Å; D54-L56 PolarHBondContact OD1-N 2.88Å; L56-I61 HydrophobicContact CB-CD1 4.09Å; L56-I61 HydrophobicContact CB-CG1 3.63Å; L56-I61 HydrophobicContact CD1-CG1 4.09Å; L56-I64 HydrophobicContact CD1-CD1 4.14Å
57	A	89.3	Confident	87.5	Confident	51 Å²	51	87.7 Å²	87.7	42%	0.421	44%	0.435	S	S	.	.			trans	-69.4	151.4	168.4	0	0	0	0	0	110.4	E59 E60 I61	A57-E59 PolarHBondContact O-N 3.41Å; A57-E59 VanDerWaalsContact O-N 3.1Å; A57-E60 HydrophobicContact CB-CG 4.16Å; A57-E60 PolarHBondContact N-OE2 3.22Å; A57-E60 WeakPolarHBondContact O-CA 3.49Å; A57-E60 WeakPolarHBondContact O-CB 3.4Å; A57-E60 PolarHBondContact O-N 3.12Å; A57-I61 PolarHBondContact O-N 3.46Å
58	E	88.3	Confident	87.2	Confident	160 Å²	160	88.4 Å²	88.4	75%	0.748	44%	0.44	S	S	*	.	H	α-helix	trans	-52.6	-35.5	173.4	-65	178.7	-164.6	0	0	112	E60 N62	E58-E60 VanDerWaalsContact C-N 3.35Å; E58-E60 PolarHBondContact O-N 2.99Å; E58-N62 WeakPolarHBondContact O-CB 3.21Å; E58-N62 PolarHBondContact O-N 3.43Å; E58-N62 PolarHBondContact O-ND2 3.27Å
59	E	86.7	Confident	86.8	Confident	165 Å²	165	89.9 Å²	89.9	77%	0.771	44%	0.439	S	S	*	.	H	α-helix	trans	-64.3	-35.7	175.1	-62.4	-170.6	-170.3	0	0	113	A57 Y63	A57-E59 PolarHBondContact O-N 3.41Å; A57-E59 VanDerWaalsContact O-N 3.1Å; E59-Y63 VanDerWaalsContact O-CB 3.23Å; E59-Y63 WeakPolarHBondContact O-CB 3.36Å; E59-Y63 PolarHBondContact O-N 3.43Å
60	E	88.9	Confident	86.1	Confident	98 Å²	98	88.1 Å²	88.1	46%	0.458	43%	0.429	S	S	.	.	H	α-helix	trans	-76.2	-42.9	178.3	-64	175.9	124.9	0	0	111	A57 E58 N62 Y63 I64	A57-E60 HydrophobicContact CB-CG 4.16Å; A57-E60 PolarHBondContact N-OE2 3.22Å; A57-E60 WeakPolarHBondContact O-CA 3.49Å; A57-E60 WeakPolarHBondContact O-CB 3.4Å; A57-E60 PolarHBondContact O-N 3.12Å; E58-E60 VanDerWaalsContact C-N 3.35Å; E58-E60 PolarHBondContact O-N 2.99Å; E60-N62 VanDerWaalsContact C-N 3.34Å; E60-N62 PolarHBondContact O-N 2.93Å; E60-Y63 PolarHBondContact O-N 2.97Å; E60-Y63 VanDerWaalsContact O-N 3.12Å; E60-I64 VanDerWaalsContact O-CG1 3.31Å; E60-I64 WeakPolarHBondContact O-CG1 3.41Å; E60-I64 PolarHBondContact O-N 3.37Å
61	I	89.3	Confident	85.2	Confident	7 Å²	7	88 Å²	88	4%	0.036	44%	0.435	C	S	.	.	H	α-helix	trans	-56.1	-50.5	173.1	-65.5	174.6	0	0	0	109.9	L35 L40 Y43 L56 A57 Y63 I64 L65	L35-I61 HydrophobicContact CD1-CG2 3.95Å; L35-I61 HydrophobicContact CD2-CG1 4.34Å; L35-I61 HydrophobicContact CD2-CG2 4.26Å; L40-I61 HydrophobicContact CD1-CG2 3.98Å; L40-I61 HydrophobicContact CG-CG2 4.41Å; Y43-I61 HydrophobicContact CD1-CD1 4.42Å; Y43-I61 HydrophobicContact CE1-CD1 3.96Å; L56-I61 HydrophobicContact CB-CD1 4.09Å; L56-I61 HydrophobicContact CB-CG1 3.63Å; L56-I61 HydrophobicContact CD1-CG1 4.09Å; A57-I61 PolarHBondContact O-N 3.46Å; I61-Y63 VanDerWaalsContact C-N 3.33Å; I61-Y63 PolarHBondContact O-N 3.15Å; I61-I64 PolarHBondContact O-N 3.33Å; I61-L65 HydrophobicContact CG2-CD1 4Å; I61-L65 WeakPolarHBondContact O-CB 3.48Å; I61-L65 WeakPolarHBondContact O-CG 3.49Å; I61-L65 PolarHBondContact O-N 3.06Å
62	N	89.3	Confident	83.5	Confident	96 Å²	96	81.2 Å²	81.2	51%	0.513	43%	0.427	S	S	.	.	H	α-helix	trans	-64.7	-34.4	176	-79.4	-70	0	0	0	112.8	E58 E60 K66	E58-N62 WeakPolarHBondContact O-CB 3.21Å; E58-N62 PolarHBondContact O-N 3.43Å; E58-N62 PolarHBondContact O-ND2 3.27Å; E60-N62 VanDerWaalsContact C-N 3.34Å; E60-N62 PolarHBondContact O-N 2.93Å; N62-K66 WeakPolarHBondContact O-CB 3.48Å; N62-K66 PolarHBondContact O-N 2.94Å; N62-K66 VanDerWaalsContact O-N 3.15Å
63	Y	87.3	Confident	81.6	Confident	41 Å²	41	88.8 Å²	88.8	16%	0.161	46%	0.461	C	S	.	.	H	α-helix	trans	-67.4	-45	175.6	-177.7	-94.5	0	0	0	112	E59 E60 I61 K66 N67 H224 K226	E59-Y63 VanDerWaalsContact O-CB 3.23Å; E59-Y63 WeakPolarHBondContact O-CB 3.36Å; E59-Y63 PolarHBondContact O-N 3.43Å; E60-Y63 PolarHBondContact O-N 2.97Å; E60-Y63 VanDerWaalsContact O-N 3.12Å; I61-Y63 VanDerWaalsContact C-N 3.33Å; I61-Y63 PolarHBondContact O-N 3.15Å; Y63-K66 PolarHBondContact O-N 3.14Å; Y63-N67 VanDerWaalsContact CD2-ND2 3.27Å; Y63-N67 WeakPolarHBondContact CD2-ND2 3.49Å; Y63-N67 VanDerWaalsContact CE2-ND2 3.33Å; Y63-N67 WeakPolarHBondContact CE2-ND2 3.46Å; Y63-N67 WeakPolarHBondContact O-CB 3.48Å; Y63-N67 PolarHBondContact O-N 3.11Å; Y63-N67 PolarHBondContact O-ND2 3.25Å; Y63-H224 WeakPolarHBondContact CE1-O 3.4Å; Y63-H224 PolarHBondContact OH-O 3.24Å; Y63-H224 VanDerWaalsContact OH-O 3.08Å; Y63-K226 VanDerWaalsContact CE2-CE 3.49Å; Y63-K226 HydrophobicContact CE2-CG 4.33Å
64	I	88.9	Confident	79.2	Confident	11 Å²	11	88.9 Å²	88.9	6%	0.056	46%	0.461	C	S	.	.	H	α-helix	trans	-60.5	-58.1	176.8	-67.8	165.1	0	0	0	109.1	L35 I36 L56 E60 I61 K66 N67 V68 F223	L35-I64 HydrophobicContact CD2-CD1 4.24Å; L35-I64 HydrophobicContact CD2-CG2 4.33Å; I36-I64 HydrophobicContact CG1-CG2 4.01Å; L56-I64 HydrophobicContact CD1-CD1 4.14Å; E60-I64 VanDerWaalsContact O-CG1 3.31Å; E60-I64 WeakPolarHBondContact O-CG1 3.41Å; E60-I64 PolarHBondContact O-N 3.37Å; I61-I64 PolarHBondContact O-N 3.33Å; I64-K66 PolarHBondContact O-N 2.92Å; I64-N67 PolarHBondContact O-N 3.24Å; I64-N67 VanDerWaalsContact O-N 3.08Å; I64-V68 HydrophobicContact CG2-CG2 3.71Å; I64-V68 WeakPolarHBondContact O-CB 3.24Å; I64-V68 WeakPolarHBondContact O-CG2 3.15Å; I64-V68 PolarHBondContact O-N 3.23Å; I64-F223 HydrophobicContact CD1-CZ 4.17Å; I64-F223 HydrophobicContact CG1-CE1 4.17Å; I64-F223 HydrophobicContact CG1-CE2 4.03Å; I64-F223 HydrophobicContact CG1-CZ 3.82Å; I64-F223 HydrophobicContact CG2-CD1 4.21Å; I64-F223 HydrophobicContact CG2-CE1 4Å
65	L	87.6	Confident	76.8	Confident	74 Å²	74	90.9 Å²	90.9	39%	0.387	48%	0.477	S	S	.	.	H	α-helix	trans	-55.3	-31.1	-178.3	-69.2	173.3	0	0	0	113.4	L35 I61	L35-L65 HydrophobicContact CD1-CD1 4.15Å; L35-L65 HydrophobicContact CD1-CD2 3.96Å; L35-L65 HydrophobicContact CD1-CG 4.11Å; L35-L65 HydrophobicContact CG-CD2 4.28Å; L35-L65 VanDerWaalsContact O-CD2 3.32Å; L35-L65 WeakPolarHBondContact O-CD2 3.46Å; I61-L65 HydrophobicContact CG2-CD1 4Å; I61-L65 WeakPolarHBondContact O-CB 3.48Å; I61-L65 WeakPolarHBondContact O-CG 3.49Å; I61-L65 PolarHBondContact O-N 3.06Å
66	K	87.1	Confident	74.3	Confident	178 Å²	178	91.6 Å²	91.6	77%	0.774	49%	0.493	S	S	*	.	H	α-helix	trans	-83.8	-31	179	-176.3	175.2	178.4	-179.8	0	114.8	N62 Y63 I64	N62-K66 WeakPolarHBondContact O-CB 3.48Å; N62-K66 PolarHBondContact O-N 2.94Å; N62-K66 VanDerWaalsContact O-N 3.15Å; Y63-K66 PolarHBondContact O-N 3.14Å; I64-K66 PolarHBondContact O-N 2.92Å
67	N	84	Confident	71.9	Confident	55 Å²	55	99.2 Å²	99.2	29%	0.294	53%	0.528	S	S	.	.	H	α-helix	trans	-108.8	0.1	-173	-61.9	-86.2	0	0	0	113.7	Y63 I64 Q69	Y63-N67 VanDerWaalsContact CD2-ND2 3.27Å; Y63-N67 WeakPolarHBondContact CD2-ND2 3.49Å; Y63-N67 VanDerWaalsContact CE2-ND2 3.33Å; Y63-N67 WeakPolarHBondContact CE2-ND2 3.46Å; Y63-N67 WeakPolarHBondContact O-CB 3.48Å; Y63-N67 PolarHBondContact O-N 3.11Å; Y63-N67 PolarHBondContact O-ND2 3.25Å; I64-N67 PolarHBondContact O-N 3.24Å; I64-N67 VanDerWaalsContact O-N 3.08Å; N67-Q69 PolarHBondContact O-N 3.39Å; N67-Q69 VanDerWaalsContact O-N 3.12Å
68	V	84.8	Confident	69.2	Low	26 Å²	26	99.9 Å²	99.9	16%	0.158	54%	0.54	C	S	.	.			trans	-64.4	107.4	171.1	161.2	0	0	0	0	110.7	I36 I64 K70 A221 F223	I36-V68 HydrophobicContact CD1-CG2 4.26Å; I36-V68 HydrophobicContact CG1-CG2 3.82Å; I36-V68 HydrophobicContact CG2-CG1 4.07Å; I64-V68 HydrophobicContact CG2-CG2 3.71Å; I64-V68 WeakPolarHBondContact O-CB 3.24Å; I64-V68 WeakPolarHBondContact O-CG2 3.15Å; I64-V68 PolarHBondContact O-N 3.23Å; V68-K70 HydrophobicContact CG1-CG 3.71Å; V68-K70 PolarHBondContact O-N 3.16Å; V68-A221 HydrophobicContact CG1-CB 4.19Å; V68-F223 HydrophobicContact CG2-CB 4.22Å; V68-F223 HydrophobicContact CG2-CD1 3.88Å; V68-F223 HydrophobicContact CG2-CG 4.4Å
69	Q	80.2	Confident	66.7	Low	148 Å²	148	98.9 Å²	98.9	69%	0.692	55%	0.545	S	S	*	.	B	Isolated β-bridge	trans	-80.7	92.4	164	-171.1	167.2	51.3	0	0	108.3	N67 V71 K222	N67-Q69 PolarHBondContact O-N 3.39Å; N67-Q69 VanDerWaalsContact O-N 3.12Å; Q69-V71 PolarHBondContact O-N 2.97Å; Q69-K222 PolarHBondContact N-O 3.41Å; Q69-K222 PolarHBondContact O-N 3.16Å
70	K	75.8	Confident	64.3	Low	123 Å²	123	98.5 Å²	98.5	54%	0.535	55%	0.548	S	S	.	.			trans	-61.9	127.8	166.1	-60.6	-162.7	175.2	-168.5	0	108	I36 V68 A72 A221	I36-K70 WeakPolarHBondContact O-CE 3.35Å; I36-K70 PolarHBondContact O-NZ 2.75Å; V68-K70 HydrophobicContact CG1-CG 3.71Å; V68-K70 PolarHBondContact O-N 3.16Å; K70-A72 PolarHBondContact O-N 2.75Å; K70-A72 VanDerWaalsContact O-N 3.09Å; K70-A221 HydrophobicContact CG-CB 4.37Å
71	V	67.8	Low	61.8	Low	93 Å²	93	101.2 Å²	101.2	56%	0.564	57%	0.566	S	S	*	*			trans	-66.1	112.3	173.7	173.6	0	0	0	0	107.2	Q69 Q73 G220	Q69-V71 PolarHBondContact O-N 2.97Å; V71-Q73 PolarHBondContact O-N 2.88Å; V71-G220 VanDerWaalsContact CG2-O 3.28Å; V71-G220 WeakPolarHBondContact CG2-O 3.33Å
72	A	47.9	Very low	59.1	Low	85 Å²	85	105.8 Å²	105.8	70%	0.702	60%	0.598	S	S	*	*			trans	-60.4	121.2	170.9	0	0	0	0	0	108	K70 S74	K70-A72 PolarHBondContact O-N 2.75Å; K70-A72 VanDerWaalsContact O-N 3.09Å; A72-S74 PolarHBondContact O-N 3.33Å
73	Q	44.2	Very low	56.8	Low	184 Å²	184	107.1 Å²	107.1	86%	0.86	61%	0.614	S	S	*	*			trans	-59.4	110.7	169	-73.7	-177.4	-12.1	0	0	107.3	V71 T75	V71-Q73 PolarHBondContact O-N 2.88Å; Q73-T75 VanDerWaalsContact C-N 3.33Å; Q73-T75 PolarHBondContact O-N 2.63Å; Q73-T75 PolarHBondContact O-OG1 3.29Å
74	S	32.4	Very low	54.2	Low	100 Å²	100	111.6 Å²	111.6	70%	0.699	64%	0.64	S	S	*	*			trans	-72.1	89.8	-178.7	168.9	0	0	0	0	109	A72 A76	A72-S74 PolarHBondContact O-N 3.33Å; S74-A76 PolarHBondContact O-N 2.83Å
75	T	36.4	Very low	52	Low	131 Å²	131	117.5 Å²	117.5	80%	0.804	67%	0.672	S	S	*	*			trans	-70.3	39.3	169.2	-5	0	0	0	0	112.6	Q73 H77	Q73-T75 VanDerWaalsContact C-N 3.33Å; Q73-T75 PolarHBondContact O-N 2.63Å; Q73-T75 PolarHBondContact O-OG1 3.29Å; T75-H77 PolarHBondContact O-N 3.32Å
76	A	35.6	Very low	49.6	Very low	72 Å²	72	119.1 Å²	119.1	60%	0.595	69%	0.685	S	S	*	*			trans	-68.6	115.7	155.2	0	0	0	0	0	107	S74 G78	S74-A76 PolarHBondContact O-N 2.83Å; A76-G78 PolarHBondContact O-N 3.36Å
77	H	37.3	Very low	47.9	Very low	185 Å²	185	116 Å²	116	86%	0.856	69%	0.686	S	S	*	*			trans	-68.1	79.5	166	-82	-71.8	0	0	0	109.4	T75	T75-H77 PolarHBondContact O-N 3.32Å
78	G	34.1	Very low	45.8	Very low	65 Å²	65	118.8 Å²	118.8	67%	0.67	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-69.6	120.7	149.5	0	0	0	0	0	107.3	A76	A76-G78 PolarHBondContact O-N 3.36Å
79	T	34.7	Very low	44.2	Very low	139 Å²	139	123.7 Å²	123.7	85%	0.853	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-62.6	140.8	169.3	-56.2	0	0	0	0	109.2	D81	T79-D81 PolarHBondContact O-N 3.37Å
80	D	37.5	Very low	42.2	Very low	157 Å²	157	119.4 Å²	119.4	84%	0.84	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-51.2	135.9	177.8	-71.9	-65	0	0	0	112.8
81	D	34.9	Very low	40.9	Very low	155 Å²	155	120.1 Å²	120.1	83%	0.829	76%	0.756	S	S	*	*			trans	-150	156.7	131.5	-149.2	-16.7	0	0	0	110.2	T79	T79-D81 PolarHBondContact O-N 3.37Å
82	S	32.8	Very low	39.5	Very low	103 Å²	103	124.9 Å²	124.9	72%	0.72	77%	0.765	S	S	*	*			trans	59.1	76.7	-175.7	62.8	0	0	0	0	116.5	D84	S82-D84 PolarHBondContact O-N 3.21Å
83	C	40.7	Very low	39.5	Very low	124 Å²	124	131.3 Å²	131.3	84%	0.838	77%	0.771	S	S	*	*			trans	-76.9	108.7	148.6	-179	0	0	0	0	108.4
84	D	33.8	Very low	39.5	Very low	135 Å²	135	127 Å²	127	72%	0.722	76%	0.759	S	S	*	*			trans	-124.3	78.8	175.8	-140.6	-2.1	0	0	0	108.8	S82 T86	S82-D84 PolarHBondContact O-N 3.21Å; D84-T86 PolarHBondContact O-N 3.24Å
85	D	41.6	Very low	40	Very low	136 Å²	136	127.7 Å²	127.7	73%	0.727	76%	0.759	S	S	*	*			trans	-76.8	68.7	-177.1	-171.6	9.5	0	0	0	111.5
86	T	38.3	Very low	40.5	Very low	107 Å²	107	129.4 Å²	129.4	66%	0.656	76%	0.758	S	S	*	*			trans	-103.5	69.8	170.2	64.2	0	0	0	0	111	D84 S88	D84-T86 PolarHBondContact O-N 3.24Å; T86-S88 PolarHBondContact O-N 3.5Å
87	S	50.3	Low	41	Very low	114 Å²	114	130.5 Å²	130.5	80%	0.797	76%	0.761	S	S	*	*			trans	-58.4	99	162.1	-76	0	0	0	0	110.6
88	S	40.7	Very low	41.6	Very low	112 Å²	112	129.7 Å²	129.7	78%	0.783	76%	0.763	S	S	*	*			trans	-136.6	117.7	175.1	-158.2	0	0	0	0	111.9	T86	T86-S88 PolarHBondContact O-N 3.5Å
89	S	51.1	Low	42.4	Very low	129 Å²	129	131.1 Å²	131.1	90%	0.902	76%	0.759	S	S	*	*			trans	-69	134.5	178	179.4	0	0	0	0	111.3
90	G	37.3	Very low	43.1	Very low	58 Å²	58	131.9 Å²	131.9	60%	0.598	75%	0.752	S	S	*	*			trans	-178.8	42.9	-176.4	0	0	0	0	0	118.4	Y92	G90-Y92 PolarHBondContact O-N 3.18Å
91	T	48.8	Very low	44.2	Very low	139 Å²	139	127.1 Å²	127.1	85%	0.853	74%	0.735	S	S	*	*			trans	34.3	70.6	162	46.1	0	0	0	0	116.6
92	Y	38.8	Very low	45.5	Very low	193 Å²	193	121.6 Å²	121.6	76%	0.757	71%	0.707	S	S	*	*			trans	-126.6	89.1	155.9	-168.7	-103.3	0	0	0	109.7	G90 P94	G90-Y92 PolarHBondContact O-N 3.18Å; Y92-P94 HydrophobicContact CD1-CG 4.49Å; Y92-P94 HydrophobicContact CE1-CB 4.42Å; Y92-P94 HydrophobicContact CE1-CG 4.33Å; Y92-P94 WeakPolarHBondContact O-CD 3.27Å
93	W	48.3	Very low	46.9	Very low	219 Å²	219	122.2 Å²	122.2	83%	0.83	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-69.2	123.5	154.9	-60.4	99.7	0	0	0	106.6	V95	W93-V95 PolarHBondContact O-N 2.65Å; W93-V95 VanDerWaalsContact O-N 3.1Å
94	P	43.5	Very low	48.8	Very low	94 Å²	94	118.2 Å²	118.2	61%	0.61	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-58.8	116.1	156.9	-14.2	29.6	0	0	0	105.9	Y92 E96	Y92-P94 HydrophobicContact CD1-CG 4.49Å; Y92-P94 HydrophobicContact CE1-CB 4.42Å; Y92-P94 HydrophobicContact CE1-CG 4.33Å; Y92-P94 WeakPolarHBondContact O-CD 3.27Å; P94-E96 PolarHBondContact O-N 2.96Å
95	V	44.1	Very low	50.8	Low	114 Å²	114	115.6 Å²	115.6	69%	0.691	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-47.7	132.1	176.6	-176	0	0	0	0	108	W93 S97	W93-V95 PolarHBondContact O-N 2.65Å; W93-V95 VanDerWaalsContact O-N 3.1Å; V95-S97 PolarHBondContact O-N 2.74Å; V95-S97 VanDerWaalsContact O-N 3.14Å
96	E	45.9	Very low	52.5	Low	168 Å²	168	111.1 Å²	111.1	79%	0.785	63%	0.634	S	S	*	*	S	Bend	trans	-48.4	124.8	-169.2	-75.4	88.6	154.1	0	0	110.7	P94 D98	P94-E96 PolarHBondContact O-N 2.96Å; E96-D98 PolarHBondContact O-N 3.08Å
97	S	47.3	Very low	54.4	Low	95 Å²	95	107.8 Å²	107.8	66%	0.664	62%	0.621	S	S	*	*			trans	-43.5	125.3	-160.6	52.5	0	0	0	0	113.8	V95 V99	V95-S97 PolarHBondContact O-N 2.74Å; V95-S97 VanDerWaalsContact O-N 3.14Å; S97-V99 PolarHBondContact O-N 3.4Å
98	D	48.3	Very low	56.1	Low	167 Å²	167	104.8 Å²	104.8	89%	0.893	59%	0.593	S	S	*	*			trans	-62.9	61.1	165.8	-75.4	-47.9	0	0	0	111.3	E96 E100	E96-D98 PolarHBondContact O-N 3.08Å; D98-E100 PolarHBondContact O-N 3.31Å; D98-E100 VanDerWaalsContact O-N 3.08Å
99	V	52.4	Low	57.9	Low	96 Å²	96	100.1 Å²	100.1	58%	0.582	56%	0.56	S	S	*	*			trans	-71.9	98.6	165	176.7	0	0	0	0	105.7	S97 A101	S97-V99 PolarHBondContact O-N 3.4Å; V99-A101 PolarHBondContact O-N 2.89Å
100	E	49.3	Very low	58.8	Low	154 Å²	154	103.2 Å²	103.2	72%	0.72	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-47	116.3	175.2	-172.4	-172.4	158.2	0	0	109.2	D98 P102 N103	D98-E100 PolarHBondContact O-N 3.31Å; D98-E100 VanDerWaalsContact O-N 3.08Å; E100-P102 VanDerWaalsContact O-N 3.16Å; E100-N103 PolarHBondContact OE1-ND2 3.37Å
101	A	60.4	Low	60.1	Low	57 Å²	57	101.8 Å²	101.8	47%	0.471	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-53	123.6	-173.8	0	0	0	0	0	109.4	V99 N103 A278	V99-A101 PolarHBondContact O-N 2.89Å; A101-N103 PolarHBondContact O-N 3.24Å; A101-A278 HydrophobicContact CB-CB 3.9Å
102	P	62.3	Low	60.7	Low	39 Å²	39	99.4 Å²	99.4	25%	0.253	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-55.6	116.3	-172	-27	36.4	0	0	0	110.2	E100 L104 Y277	E100-P102 VanDerWaalsContact O-N 3.16Å; P102-L104 PolarHBondContact O-N 3.47Å; P102-Y277 HydrophobicContact CB-CD1 4.19Å; P102-Y277 HydrophobicContact CB-CE1 4.07Å; P102-Y277 WeakPolarHBondContact O-CD1 3.45Å; P102-Y277 WeakPolarHBondContact O-CE1 3.39Å
103	N	62.4	Low	61.8	Low	117 Å²	117	95 Å²	95	63%	0.626	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-49.1	128.8	-177.9	-79.1	-80.6	0	0	0	110.2	E100 A101 D105	E100-N103 PolarHBondContact OE1-ND2 3.37Å; A101-N103 PolarHBondContact O-N 3.24Å; N103-D105 VanDerWaalsContact C-N 3.32Å; N103-D105 WeakPolarHBondContact O-CA 3.42Å; N103-D105 WeakPolarHBondContact O-CB 3.31Å; N103-D105 PolarHBondContact O-N 3Å
104	L	80.6	Confident	62.3	Low	39 Å²	39	87 Å²	87	20%	0.204	49%	0.493	C	S	.	.			trans	-67.4	91.8	-177.6	-72.1	160.2	0	0	0	109.2	P102 L106 G107 W108 Y177 F273 R274 Y277	P102-L104 PolarHBondContact O-N 3.47Å; L104-L106 VanDerWaalsContact C-N 3.3Å; L104-L106 PolarHBondContact O-N 3.07Å; L104-G107 WeakPolarHBondContact O-CA 3.38Å; L104-G107 PolarHBondContact O-N 3.13Å; L104-W108 HydrophobicContact CB-CB 4.43Å; L104-W108 HydrophobicContact CB-CE3 4.3Å; L104-W108 HydrophobicContact CD1-CB 4.22Å; L104-W108 HydrophobicContact CD1-CD2 3.7Å; L104-W108 HydrophobicContact CD1-CE3 3.69Å; L104-W108 HydrophobicContact CD1-CG 3.94Å; L104-W108 HydrophobicContact CD1-CZ3 4.23Å; L104-W108 HydrophobicContact CD2-CE3 3.96Å; L104-W108 HydrophobicContact CD2-CZ3 3.94Å; L104-W108 HydrophobicContact CG-CE3 4.2Å; L104-Y177 HydrophobicContact CB-CE1 4.35Å; L104-Y177 HydrophobicContact CD2-CD1 4.17Å; L104-Y177 HydrophobicContact CD2-CE1 3.9Å; L104-Y177 PolarHBondContact O-OH 2.78Å; L104-F273 HydrophobicContact CD2-CE1 4.31Å; L104-R274 HydrophobicContact CD1-CG 4.21Å; L104-Y277 HydrophobicContact CD2-CD1 3.67Å; L104-Y277 HydrophobicContact CD2-CD2 4.21Å; L104-Y277 HydrophobicContact CD2-CE1 3.75Å; L104-Y277 HydrophobicContact CD2-CE2 4.33Å; L104-Y277 HydrophobicContact CD2-CG 3.91Å; L104-Y277 HydrophobicContact CG-CD1 4.4Å; L104-Y277 HydrophobicContact CG-CE1 4.49Å
105	D	75.3	Confident	63.2	Low	80 Å²	80	89 Å²	89	43%	0.428	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-10.2	-153.1	47.4	-34	0	0	0	114.4	N103 Y177 R206 Y277	N103-D105 VanDerWaalsContact C-N 3.32Å; N103-D105 WeakPolarHBondContact O-CA 3.42Å; N103-D105 WeakPolarHBondContact O-CB 3.31Å; N103-D105 PolarHBondContact O-N 3Å; D105-Y177 PolarHBondContact N-OH 3.08Å; D105-R206 IonicContact OD1-NE 3.31Å; D105-R206 IonicContact OD2-CZ 3.36Å; D105-R206 IonicContact OD2-NE 3.51Å; D105-R206 PolarHBondContact OD2-NE 3.38Å; D105-R206 IonicContact OD2-NH2 3.37Å; D105-R206 PolarHBondContact OD2-NH2 3.22Å; D105-Y277 PolarHBondContact OD1-OH 3.44Å
106	L	77.8	Confident	64.3	Low	42 Å²	42	85.5 Å²	85.5	22%	0.22	48%	0.475	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	10.7	168.8	-52.3	-176.2	0	0	0	112.7	L104 S175 Y177 R203 N204 R206	L104-L106 VanDerWaalsContact C-N 3.3Å; L104-L106 PolarHBondContact O-N 3.07Å; L106-S175 WeakPolarHBondContact CB-OG 3.47Å; L106-S175 WeakPolarHBondContact O-CB 3.4Å; L106-S175 PolarHBondContact O-OG 2.83Å; L106-Y177 VanDerWaalsContact C-OH 3.28Å; L106-Y177 WeakPolarHBondContact CA-OH 3.4Å; L106-Y177 HydrophobicContact CB-CE1 4.27Å; L106-Y177 HydrophobicContact CB-CE2 4.37Å; L106-Y177 WeakPolarHBondContact CB-OH 3.45Å; L106-Y177 HydrophobicContact CG-CE1 4.34Å; L106-Y177 PolarHBondContact N-OH 3.47Å; L106-R203 VanDerWaalsContact CD2-O 3.22Å; L106-R203 WeakPolarHBondContact CD2-O 3.24Å; L106-N204 WeakPolarHBondContact CD1-O 3.47Å; L106-R206 HydrophobicContact CD1-CG 3.65Å; L106-R206 HydrophobicContact CD2-CG 4.47Å; L106-R206 HydrophobicContact CG-CG 3.77Å
107	G	77.6	Confident	65.5	Low	37 Å²	37	80 Å²	80	38%	0.381	46%	0.464	S	S	.	.			trans	81.2	163.5	-174.7	0	0	0	0	0	113.9	L104 Y177	L104-G107 WeakPolarHBondContact O-CA 3.38Å; L104-G107 PolarHBondContact O-N 3.13Å; G107-Y177 PolarHBondContact N-OH 2.82Å; G107-Y177 VanDerWaalsContact N-OH 3.12Å; G107-Y177 PolarHBondContact O-OH 2.98Å
108	W	84.9	Confident	67.2	Low	51 Å²	51	79 Å²	79	19%	0.193	47%	0.469	C	S	.	.			trans	-141.9	149.9	-179.2	-157.4	-100.8	0	0	0	110.6	L104 V149 A151 Y177 L233 C236 D270 F273 R274	L104-W108 HydrophobicContact CB-CB 4.43Å; L104-W108 HydrophobicContact CB-CE3 4.3Å; L104-W108 HydrophobicContact CD1-CB 4.22Å; L104-W108 HydrophobicContact CD1-CD2 3.7Å; L104-W108 HydrophobicContact CD1-CE3 3.69Å; L104-W108 HydrophobicContact CD1-CG 3.94Å; L104-W108 HydrophobicContact CD1-CZ3 4.23Å; L104-W108 HydrophobicContact CD2-CE3 3.96Å; L104-W108 HydrophobicContact CD2-CZ3 3.94Å; L104-W108 HydrophobicContact CG-CE3 4.2Å; W108-V149 HydrophobicContact CE3-CG1 3.86Å; W108-V149 HydrophobicContact CH2-CG1 4.34Å; W108-V149 HydrophobicContact CZ3-CG1 3.77Å; W108-A151 HydrophobicContact CH2-CB 3.52Å; W108-A151 HydrophobicContact CZ2-CB 4.47Å; W108-A151 HydrophobicContact CZ3-CB 4.13Å; W108-Y177 HydrophobicContact CE3-CD2 4.07Å; W108-Y177 AromaticContact CE3-CE2 3.63Å; W108-Y177 HydrophobicContact CE3-CE2 3.63Å; W108-Y177 AromaticContact CZ3-CD2 3.56Å; W108-Y177 HydrophobicContact CZ3-CD2 3.56Å; W108-Y177 AromaticContact CZ3-CE2 3.64Å; W108-Y177 HydrophobicContact CZ3-CE2 3.64Å; W108-Y177 HydrophobicContact CZ3-CG 4.29Å; W108-L233 HydrophobicContact CH2-CD2 4.37Å; W108-L233 HydrophobicContact CZ2-CD2 3.94Å; W108-C236 PolarHBondContact NE1-SG 3.09Å; W108-C236 VanDerWaalsContact NE1-SG 3.37Å; W108-D270 VanDerWaalsContact CE2-OD1 3.31Å; W108-D270 VanDerWaalsContact CZ2-OD1 3.31Å; W108-D270 WeakPolarHBondContact CZ2-OD1 3.36Å; W108-D270 PolarHBondContact NE1-OD1 3.36Å; W108-F273 AromaticContact CH2-CD1 3.32Å; W108-F273 HydrophobicContact CH2-CD1 3.32Å; W108-F273 AromaticContact CH2-CE1 3.6Å; W108-F273 HydrophobicContact CH2-CE1 3.6Å; W108-F273 HydrophobicContact CH2-CG 4.12Å; W108-F273 HydrophobicContact CZ2-CD1 4.08Å; W108-F273 HydrophobicContact CZ3-CD1 4.02Å; W108-F273 AromaticContact CZ3-CE1 3.84Å; W108-F273 HydrophobicContact CZ3-CE1 3.84Å; W108-R274 VanDerWaalsContact CD1-NH2 3.29Å
109	P	79.3	Confident	69.2	Low	15 Å²	15	74 Å²	74	10%	0.097	45%	0.445	C	S	.	.			trans	-68.9	133.5	173.5	-15	32.6	0	0	0	110	V111 K148 V149 C236	P109-V111 PolarHBondContact O-N 2.78Å; P109-V111 VanDerWaalsContact O-N 3.15Å; P109-K148 HydrophobicContact CB-CD 4.42Å; P109-K148 HydrophobicContact CG-CD 4.4Å; P109-V149 HydrophobicContact CG-CB 4.17Å; P109-V149 HydrophobicContact CG-CG2 3.92Å; P109-C236 HydrophobicContact CB-CB 4.38Å; P109-C236 HydrophobicContact CG-CB 4.34Å
110	Y	69.6	Low	71.2	Confident	194 Å²	194	74.4 Å²	74.4	76%	0.761	44%	0.44	S	S	*	.			trans	-72.9	108.3	169.1	-172.9	-111.3	0	0	0	109.5	M112	Y110-M112 HydrophobicContact CD1-CG 4.21Å; Y110-M112 HydrophobicContact CE1-CE 3.82Å; Y110-M112 HydrophobicContact CE1-CG 3.79Å; Y110-M112 HydrophobicContact CE1-SD 3.78Å; Y110-M112 WeakPolarHBondContact OH-CE 3.24Å
111	V	66.1	Low	73.4	Confident	27 Å²	27	70.7 Å²	70.7	16%	0.164	42%	0.424	C	S	.	.			trans	-88.2	134	170.9	-168.9	0	0	0	0	107.8	P109 L116 C236 E267	P109-V111 PolarHBondContact O-N 2.78Å; P109-V111 VanDerWaalsContact O-N 3.15Å; V111-L116 HydrophobicContact CG1-CD1 4.06Å; V111-C236 HydrophobicContact CG2-CB 3.44Å; V111-C236 VanDerWaalsContact CG2-CB 3.44Å; V111-E267 HydrophobicContact CG1-CG 4.17Å
112	M	59.5	Low	75	Confident	89 Å²	89	71.9 Å²	71.9	44%	0.438	42%	0.423	S	S	.	.			trans	-94.9	113.4	168.9	-74.7	-100.1	57.4	0	0	107.5	Y110 G114 L115	Y110-M112 HydrophobicContact CD1-CG 4.21Å; Y110-M112 HydrophobicContact CE1-CE 3.82Å; Y110-M112 HydrophobicContact CE1-CG 3.79Å; Y110-M112 HydrophobicContact CE1-SD 3.78Å; Y110-M112 WeakPolarHBondContact OH-CE 3.24Å; M112-G114 PolarHBondContact O-N 3.04Å; M112-L115 HydrophobicContact CB-CB 3.95Å; M112-L115 HydrophobicContact CB-CD2 3.98Å; M112-L115 HydrophobicContact CG-CD2 4.5Å; M112-L115 VanDerWaalsContact O-CB 3.25Å; M112-L115 WeakPolarHBondContact O-CB 3.45Å; M112-L115 PolarHBondContact O-N 2.83Å; M112-L115 VanDerWaalsContact O-N 3.12Å
113	P	62.2	Low	76.6	Confident	102 Å²	102	74 Å²	74	66%	0.662	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	135.9	-177.1	-26.7	35.5	0	0	0	112.1	L115 E267	P113-L115 PolarHBondContact O-N 3.4Å; P113-E267 WeakPolarHBondContact CA-OE2 3.36Å
114	G	60.1	Low	78.1	Confident	50 Å²	50	69.2 Å²	69.2	52%	0.515	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.7	9	-178.7	0	0	0	0	0	115.5	M112 E267	M112-G114 PolarHBondContact O-N 3.04Å; G114-E267 PolarHBondContact N-OE1 2.89Å; G114-E267 PolarHBondContact N-OE2 3.22Å
115	L	62.3	Low	78.7	Confident	136 Å²	136	69.4 Å²	69.4	71%	0.712	41%	0.405	S	S	*	.			trans	-82.9	-21.5	170.6	-171.2	62.7	0	0	0	112.1	M112 P113	M112-L115 HydrophobicContact CB-CB 3.95Å; M112-L115 HydrophobicContact CB-CD2 3.98Å; M112-L115 HydrophobicContact CG-CD2 4.5Å; M112-L115 VanDerWaalsContact O-CB 3.25Å; M112-L115 WeakPolarHBondContact O-CB 3.45Å; M112-L115 PolarHBondContact O-N 2.83Å; M112-L115 VanDerWaalsContact O-N 3.12Å; P113-L115 PolarHBondContact O-N 3.4Å
116	L	65.8	Low	79.5	Confident	40 Å²	40	66.5 Å²	66.5	21%	0.209	39%	0.389	C	S	.	.	S	Bend	trans	-77.6	130	172.5	-79.6	74.2	0	0	0	109.6	V111 G263 V266	V111-L116 HydrophobicContact CG1-CD1 4.06Å; L116-G263 WeakPolarHBondContact CD2-O 3.35Å; L116-V266 HydrophobicContact CD2-CB 4.2Å
117	G	71.9	Confident	80.2	Confident	53 Å²	53	68.2 Å²	68.2	55%	0.546	40%	0.402	S	S	.	.			trans	-68	-178.2	178.3	0	0	0	0	0	114	T119 G263 Q264	G117-T119 PolarHBondContact O-N 3.02Å; G117-G263 CarbonylContact O-C 3.54Å; G117-G263 WeakPolarHBondContact O-CA 3.25Å; G117-Q264 PolarHBondContact O-N 3.27Å
118	G	82.9	Confident	80.8	Confident	75 Å²	75	69.5 Å²	69.5	77%	0.773	40%	0.404	S	S	*	.	S	Bend	trans	-50.5	135.5	-176.8	0	0	0	0	0	113.7	H120	G118-H120 PolarHBondContact O-N 3.42Å
119	T	91.4	Very high	80.7	Confident	62 Å²	62	76.1 Å²	76.1	38%	0.38	43%	0.429	S	S	.	.			trans	-61.6	129.8	-172.9	-55.6	0	0	0	0	112.6	G117 I121 I261 T262 L265	G117-T119 PolarHBondContact O-N 3.02Å; T119-I121 HydrophobicContact CG2-CD1 4.16Å; T119-I121 HydrophobicContact CG2-CG1 3.89Å; T119-I261 HydrophobicContact CG2-CG2 4.03Å; T119-T262 CarbonylContact C-O 3.58Å; T119-T262 VanDerWaalsContact CA-O 3.27Å; T119-T262 WeakPolarHBondContact CA-O 3.35Å; T119-L265 HydrophobicContact CG2-CB 3.53Å; T119-L265 HydrophobicContact CG2-CD2 4.03Å; T119-L265 HydrophobicContact CG2-CG 4.44Å; T119-L265 PolarHBondContact OG1-N 2.69Å
120	H	93.7	Very high	80.8	Confident	103 Å²	103	80.3 Å²	80.3	48%	0.477	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	138.2	171.1	-168.4	-88.2	0	0	0	109.8	G118 D122 I261 T262	G118-H120 PolarHBondContact O-N 3.42Å; H120-D122 IonicContact CE1-OD1 2.75Å; H120-D122 PolarHBondContact CE1-OD1 3.18Å; H120-D122 IonicContact CE1-OD2 3.26Å; H120-D122 PolarHBondContact CE1-OD2 3.35Å; H120-D122 VanDerWaalsContact CE1-OD2 3.24Å; H120-D122 IonicContact ND1-OD2 3.41Å; H120-D122 PolarHBondContact ND1-OD2 3.19Å; H120-I261 WeakPolarHBondContact O-CA 3.33Å; H120-T262 PolarHBondContact N-O 3.28Å; H120-T262 PolarHBondContact O-N 3.31Å
121	I	95.6	Very high	81.2	Confident	77 Å²	77	73 Å²	73	40%	0.395	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	113.3	-177.4	-51.7	-174.6	0	0	0	110.2	T119 L123 Q259 I260 I261 L265	T119-I121 HydrophobicContact CG2-CD1 4.16Å; T119-I121 HydrophobicContact CG2-CG1 3.89Å; I121-L123 HydrophobicContact CG2-CD2 4.4Å; I121-Q259 HydrophobicContact CG2-CB 3.91Å; I121-Q259 HydrophobicContact CG2-CG 4.41Å; I121-I260 WeakPolarHBondContact CA-O 3.35Å; I121-I261 HydrophobicContact CD1-CG1 4.46Å; I121-I261 HydrophobicContact CG1-CG1 4.23Å; I121-I261 HydrophobicContact CG2-CG1 4.2Å; I121-L265 HydrophobicContact CD1-CD2 4.22Å
122	D	93.6	Very high	81.9	Confident	82 Å²	82	80.1 Å²	80.1	44%	0.439	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	139.9	171	-67.1	-69.5	0	0	0	111.1	H120 Q259 I260	H120-D122 IonicContact CE1-OD1 2.75Å; H120-D122 PolarHBondContact CE1-OD1 3.18Å; H120-D122 IonicContact CE1-OD2 3.26Å; H120-D122 PolarHBondContact CE1-OD2 3.35Å; H120-D122 VanDerWaalsContact CE1-OD2 3.24Å; H120-D122 IonicContact ND1-OD2 3.41Å; H120-D122 PolarHBondContact ND1-OD2 3.19Å; D122-Q259 CarbonylContact O-C 3.55Å; D122-Q259 WeakPolarHBondContact O-CA 3.33Å; D122-I260 HydrophobicContact CB-CB 4.24Å; D122-I260 PolarHBondContact N-O 3.05Å; D122-I260 PolarHBondContact O-N 2.88Å
123	L	95.3	Very high	83.2	Confident	82 Å²	82	79.2 Å²	79.2	43%	0.429	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	125.3	177.5	-59.8	-177.1	0	0	0	111.9	I121 F125 Q259	I121-L123 HydrophobicContact CG2-CD2 4.4Å; L123-F125 HydrophobicContact CB-CE2 3.94Å; L123-F125 HydrophobicContact CB-CZ 4.19Å; L123-F125 HydrophobicContact CD1-CZ 4.47Å; L123-Q259 HydrophobicContact CD2-CB 4.33Å; L123-Q259 HydrophobicContact CD2-CG 3.71Å
124	L	94.4	Very high	84.7	Confident	18 Å²	18	75.7 Å²	75.7	9%	0.094	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	145.8	172.8	-57	178.5	0	0	0	110.4	H131 I135 T138 M257 V258 I260	L124-H131 HydrophobicContact CD2-CB 3.64Å; L124-H131 VanDerWaalsContact CD2-CG 3.5Å; L124-I135 HydrophobicContact CB-CG1 4.19Å; L124-T138 HydrophobicContact CD1-CG2 3.76Å; L124-M257 CarbonylContact O-C 3.52Å; L124-M257 VanDerWaalsContact O-CA 3.3Å; L124-M257 WeakPolarHBondContact O-CA 3.02Å; L124-M257 WeakPolarHBondContact O-CG 3.38Å; L124-V258 HydrophobicContact CB-CG2 3.91Å; L124-V258 HydrophobicContact CD1-CG2 4.44Å; L124-V258 PolarHBondContact N-O 2.9Å; L124-V258 PolarHBondContact O-N 3.01Å; L124-I260 HydrophobicContact CD1-CD1 3.94Å; L124-I260 HydrophobicContact CD1-CG1 3.84Å; L124-I260 HydrophobicContact CG-CG1 4.24Å
125	F	94.5	Very high	86.4	Confident	42 Å²	42	73.3 Å²	73.3	18%	0.184	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	152.9	-176.9	-60.7	-91.9	0	0	0	111	L123 P127 P128 R129 H131 S256 M257	L123-F125 HydrophobicContact CB-CE2 3.94Å; L123-F125 HydrophobicContact CB-CZ 4.19Å; L123-F125 HydrophobicContact CD1-CZ 4.47Å; F125-P127 CarbonylContact C-O 3.58Å; F125-P127 CarbonylContact O-C 3.56Å; F125-P128 WeakPolarHBondContact O-CA 3.28Å; F125-R129 HydrophobicContact CB-CG 4Å; F125-R129 HydrophobicContact CD2-CG 4.31Å; F125-R129 HydrophobicContact CG-CG 4.24Å; F125-H131 AromaticContact CD2-NE2 3.99Å; F125-H131 PolarHBondContact N-CE1 3.44Å; F125-H131 PolarHBondContact N-NE2 3.46Å; F125-H131 PolarHBondContact O-CE1 2.97Å; F125-S256 WeakPolarHBondContact CA-O 3.4Å; F125-M257 HydrophobicContact CD1-CB 4.06Å; F125-M257 HydrophobicContact CD1-CG 3.89Å; F125-M257 HydrophobicContact CD1-SD 4.32Å; F125-M257 HydrophobicContact CE1-CB 4.19Å; F125-M257 HydrophobicContact CE1-CG 3.66Å; F125-M257 HydrophobicContact CE1-SD 3.51Å; F125-M257 VanDerWaalsContact CE1-SD 3.51Å; F125-M257 HydrophobicContact CZ-CG 4.18Å; F125-M257 HydrophobicContact CZ-SD 3.88Å
126	H	92.2	Very high	88	Confident	20 Å²	20	68.1 Å²	68.1	9%	0.093	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	126.7	165.5	-165.2	80.8	0	0	0	110.2	I135 F250 E251 L255 S256	H126-I135 HydrophobicContact CB-CD1 3.78Å; H126-I135 HydrophobicContact CB-CG1 4.2Å; H126-F250 PolarHBondContact CD2-O 2.85Å; H126-F250 PolarHBondContact NE2-O 3.12Å; H126-E251 IonicContact CE1-OE1 2.68Å; H126-E251 PolarHBondContact NE2-O 3.28Å; H126-L255 WeakPolarHBondContact O-CA 3.44Å; H126-S256 PolarHBondContact N-O 3.13Å; H126-S256 PolarHBondContact O-N 2.93Å
127	P	91.7	Very high	89.4	Confident	77 Å²	77	70.7 Å²	70.7	50%	0.5	41%	0.405	S	S	.	.	S	Bend	cis	-58	153	-6.8	-25.3	35.8	0	0	0	114	F125 L255	F125-P127 CarbonylContact C-O 3.58Å; F125-P127 CarbonylContact O-C 3.56Å; P127-L255 VanDerWaalsContact CD-CD2 3.46Å; P127-L255 HydrophobicContact CG-CD2 4.4Å
128	P	90.4	Very high	90.5	Very high	65 Å²	65	68.9 Å²	68.9	42%	0.422	38%	0.384	S	S	.	.			trans	-65.7	146.2	-173.4	27	-35.9	0	0	0	113	F125 H131 T134	F125-P128 WeakPolarHBondContact O-CA 3.28Å; P128-H131 VanDerWaalsContact CA-CE1 3.45Å; P128-H131 WeakPolarHBondContact CA-CE1 3.35Å; P128-T134 HydrophobicContact CG-CG2 4.2Å
129	R	83.3	Confident	91.2	Very high	190 Å²	190	65.3 Å²	65.3	72%	0.717	35%	0.347	S	S	*	.			trans	-105.6	-89.9	-176.7	-66	-176.8	-178.2	-167.6	0.4	112.8	F125 H131	F125-R129 HydrophobicContact CB-CG 4Å; F125-R129 HydrophobicContact CD2-CG 4.31Å; F125-R129 HydrophobicContact CG-CG 4.24Å; R129-H131 PolarHBondContact N-NE2 3.01Å
130	A	79.5	Confident	91.4	Very high	103 Å²	103	66.2 Å²	66.2	85%	0.851	34%	0.343	S	S	*	.	S	Bend	trans	-110.7	-2.6	-177.1	0	0	0	0	0	113.3
131	H	78.7	Confident	91.5	Very high	40 Å²	40	66.2 Å²	66.2	19%	0.185	34%	0.342	C	S	.	.	S	Bend	trans	-94.1	140.9	179.4	47.5	86	0	0	0	110.4	L124 F125 P128 R129 L133	L124-H131 HydrophobicContact CD2-CB 3.64Å; L124-H131 VanDerWaalsContact CD2-CG 3.5Å; F125-H131 AromaticContact CD2-NE2 3.99Å; F125-H131 PolarHBondContact N-CE1 3.44Å; F125-H131 PolarHBondContact N-NE2 3.46Å; F125-H131 PolarHBondContact O-CE1 2.97Å; P128-H131 VanDerWaalsContact CA-CE1 3.45Å; P128-H131 WeakPolarHBondContact CA-CE1 3.35Å; R129-H131 PolarHBondContact N-NE2 3.01Å; H131-L133 VanDerWaalsContact C-N 3.32Å; H131-L133 PolarHBondContact ND1-O 3.39Å; H131-L133 PolarHBondContact O-N 3.4Å
132	L	80.3	Confident	91.5	Very high	177 Å²	177	62.7 Å²	62.7	93%	0.927	32%	0.324	S	S	*	.	S	Bend	trans	-73.2	-18.6	-171.9	-62.7	176.3	0	0	0	114.7
133	L	88.5	Confident	91.7	Very high	69 Å²	69	58.8 Å²	58.8	36%	0.361	30%	0.303	S	S	.	.	S	Bend	trans	-113.6	144.7	-178.9	-59.7	178.4	0	0	0	110.3	H131 E137 K141	H131-L133 VanDerWaalsContact C-N 3.32Å; H131-L133 PolarHBondContact ND1-O 3.39Å; H131-L133 PolarHBondContact O-N 3.4Å; L133-E137 HydrophobicContact CB-CB 4.34Å; L133-E137 HydrophobicContact CD2-CB 4.44Å; L133-K141 HydrophobicContact CD1-CD 4.07Å
134	T	93.3	Very high	91.7	Very high	29 Å²	29	60.1 Å²	60.1	18%	0.178	31%	0.305	C	S	.	.			trans	-69.5	168.4	166.2	59.5	0	0	0	0	111.8	P128 E137 T138	P128-T134 HydrophobicContact CG-CG2 4.2Å; T134-E137 WeakPolarHBondContact CB-OE2 3.39Å; T134-E137 WeakPolarHBondContact CG2-OE2 3.47Å; T134-E137 PolarHBondContact N-OE2 3.49Å; T134-E137 WeakPolarHBondContact OG1-CB 3.35Å; T134-E137 VanDerWaalsContact OG1-CD 3.24Å; T134-E137 WeakPolarHBondContact OG1-CG 3.42Å; T134-E137 PolarHBondContact OG1-N 2.93Å; T134-E137 VanDerWaalsContact OG1-N 3.1Å; T134-E137 PolarHBondContact OG1-OE2 3.46Å; T134-T138 WeakPolarHBondContact O-CB 3.39Å; T134-T138 PolarHBondContact O-N 2.77Å; T134-T138 PolarHBondContact O-OG1 3.28Å
135	I	95.6	Very high	91.8	Very high	0 Å²	0	63 Å²	63	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-60.1	-48.1	172.3	-61.4	-176.3	0	0	0	110	L124 H126 E137 T138 I139 M240 Y244 V258	L124-I135 HydrophobicContact CB-CG1 4.19Å; H126-I135 HydrophobicContact CB-CD1 3.78Å; H126-I135 HydrophobicContact CB-CG1 4.2Å; I135-E137 PolarHBondContact O-N 3.18Å; I135-T138 WeakPolarHBondContact O-CB 3.27Å; I135-T138 PolarHBondContact O-N 3.06Å; I135-T138 VanDerWaalsContact O-N 3.1Å; I135-I139 HydrophobicContact CG2-CD1 3.85Å; I135-I139 HydrophobicContact CG2-CG1 4.39Å; I135-I139 WeakPolarHBondContact O-CG1 3.49Å; I135-I139 PolarHBondContact O-N 3.08Å; I135-M240 HydrophobicContact CG2-SD 4.29Å; I135-Y244 HydrophobicContact CB-CD2 4.03Å; I135-Y244 HydrophobicContact CB-CE2 4.28Å; I135-Y244 HydrophobicContact CB-CG 4.48Å; I135-Y244 HydrophobicContact CD1-CD2 4.2Å; I135-Y244 HydrophobicContact CG2-CD1 4.03Å; I135-Y244 HydrophobicContact CG2-CD2 3.69Å; I135-Y244 HydrophobicContact CG2-CE1 4.49Å; I135-Y244 HydrophobicContact CG2-CE2 4.16Å; I135-Y244 HydrophobicContact CG2-CG 3.64Å; I135-V258 HydrophobicContact CB-CG2 4.48Å; I135-V258 HydrophobicContact CD1-CG1 4.23Å; I135-V258 HydrophobicContact CD1-CG2 3.96Å; I135-V258 HydrophobicContact CG1-CG2 3.97Å; I135-V258 HydrophobicContact CG2-CG1 4.06Å; I135-V258 HydrophobicContact CG2-CG2 3.86Å
136	K	95.5	Very high	91.8	Very high	26 Å²	26	61.1 Å²	61.1	11%	0.113	31%	0.311	C	S	.	.	H	α-helix	trans	-60.8	-41.8	178.5	-177.5	165.5	173.6	172	0	113.6	T138 I139 R140 D159 D161 I162 E251	K136-T138 VanDerWaalsContact C-N 3.31Å; K136-T138 PolarHBondContact O-N 2.85Å; K136-I139 PolarHBondContact O-N 3.4Å; K136-R140 VanDerWaalsContact O-CG 3.31Å; K136-R140 WeakPolarHBondContact O-CG 3.39Å; K136-R140 PolarHBondContact O-N 3.32Å; K136-D159 WeakPolarHBondContact CE-OD1 3.28Å; K136-D159 WeakPolarHBondContact CE-OD2 3.07Å; K136-D159 VanDerWaalsContact NZ-CG 3.31Å; K136-D159 IonicContact NZ-OD1 3.4Å; K136-D159 PolarHBondContact NZ-OD1 2.88Å; K136-D159 VanDerWaalsContact NZ-OD1 3.14Å; K136-D159 IonicContact NZ-OD2 3.75Å; K136-D159 PolarHBondContact NZ-OD2 2.72Å; K136-D161 WeakPolarHBondContact CE-OD2 3.45Å; K136-D161 IonicContact NZ-OD2 3.15Å; K136-D161 PolarHBondContact NZ-OD2 2.56Å; K136-I162 HydrophobicContact CG-CD1 4.33Å; K136-I162 HydrophobicContact CG-CG1 4.41Å; K136-E251 VanDerWaalsContact CB-OE1 3.25Å; K136-E251 WeakPolarHBondContact CB-OE1 3.42Å; K136-E251 HydrophobicContact CD-CG 3.79Å
137	E	95.1	Very high	91.8	Very high	94 Å²	94	70.3 Å²	70.3	44%	0.439	34%	0.344	S	S	.	.	H	α-helix	trans	-65	-36.5	174.2	-71.9	162.1	135.2	0	0	112.1	L133 T134 I135 R140 K141	L133-E137 HydrophobicContact CB-CB 4.34Å; L133-E137 HydrophobicContact CD2-CB 4.44Å; T134-E137 WeakPolarHBondContact CB-OE2 3.39Å; T134-E137 WeakPolarHBondContact CG2-OE2 3.47Å; T134-E137 PolarHBondContact N-OE2 3.49Å; T134-E137 WeakPolarHBondContact OG1-CB 3.35Å; T134-E137 VanDerWaalsContact OG1-CD 3.24Å; T134-E137 WeakPolarHBondContact OG1-CG 3.42Å; T134-E137 PolarHBondContact OG1-N 2.93Å; T134-E137 VanDerWaalsContact OG1-N 3.1Å; T134-E137 PolarHBondContact OG1-OE2 3.46Å; I135-E137 PolarHBondContact O-N 3.18Å; E137-R140 PolarHBondContact O-N 3.14Å; E137-K141 VanDerWaalsContact O-CB 3.28Å; E137-K141 WeakPolarHBondContact O-CB 3.5Å; E137-K141 PolarHBondContact O-N 3.33Å
138	T	95.7	Very high	91.8	Very high	16 Å²	16	73 Å²	73	10%	0.098	35%	0.348	C	S	.	.	H	α-helix	trans	-69.2	-40.6	176.9	-53	0	0	0	0	111.8	L124 T134 I135 K136 K141 M142 M240 I260	L124-T138 HydrophobicContact CD1-CG2 3.76Å; T134-T138 WeakPolarHBondContact O-CB 3.39Å; T134-T138 PolarHBondContact O-N 2.77Å; T134-T138 PolarHBondContact O-OG1 3.28Å; I135-T138 WeakPolarHBondContact O-CB 3.27Å; I135-T138 PolarHBondContact O-N 3.06Å; I135-T138 VanDerWaalsContact O-N 3.1Å; K136-T138 VanDerWaalsContact C-N 3.31Å; K136-T138 PolarHBondContact O-N 2.85Å; T138-K141 PolarHBondContact O-N 3.1Å; T138-M142 HydrophobicContact CG2-SD 4.46Å; T138-M142 WeakPolarHBondContact O-CG 3.41Å; T138-M142 PolarHBondContact O-N 2.79Å; T138-M240 HydrophobicContact CG2-CE 3.65Å; T138-I260 HydrophobicContact CG2-CD1 3.94Å
139	I	96.4	Very high	92	Very high	0 Å²	0	70.2 Å²	70.2	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-55.4	-54.2	171.8	-70.1	161.8	0	0	0	109.8	I135 K136 K141 M142 I143 I162 L232 M240 Y244 Y246	I135-I139 HydrophobicContact CG2-CD1 3.85Å; I135-I139 HydrophobicContact CG2-CG1 4.39Å; I135-I139 WeakPolarHBondContact O-CG1 3.49Å; I135-I139 PolarHBondContact O-N 3.08Å; K136-I139 PolarHBondContact O-N 3.4Å; I139-K141 VanDerWaalsContact C-N 3.31Å; I139-K141 PolarHBondContact O-N 2.7Å; I139-M142 PolarHBondContact O-N 2.72Å; I139-I143 HydrophobicContact CG2-CD1 3.61Å; I139-I143 WeakPolarHBondContact O-CG1 3.3Å; I139-I143 PolarHBondContact O-N 3.1Å; I139-I162 HydrophobicContact CD1-CD1 4.19Å; I139-I162 HydrophobicContact CG2-CD1 4.06Å; I139-I162 HydrophobicContact CG2-CG1 4.07Å; I139-I162 HydrophobicContact CG2-CG2 3.77Å; I139-L232 HydrophobicContact CG2-CD2 4.29Å; I139-M240 HydrophobicContact CD1-SD 4.08Å; I139-M240 HydrophobicContact CG1-CE 3.74Å; I139-M240 HydrophobicContact CG1-SD 3.35Å; I139-M240 WeakPolarHBondContact CG1-SD 3.3Å; I139-Y244 HydrophobicContact CD1-CD1 3.7Å; I139-Y244 HydrophobicContact CD1-CE1 3.54Å; I139-Y246 HydrophobicContact CD1-CD1 4.12Å; I139-Y246 HydrophobicContact CD1-CE1 3.42Å; I139-Y246 VanDerWaalsContact CD1-CE1 3.42Å; I139-Y246 HydrophobicContact CG1-CE1 4.14Å; I139-Y246 HydrophobicContact CG2-CE1 4.39Å; I139-Y246 HydrophobicContact CG2-CE2 4.23Å; I139-Y246 WeakPolarHBondContact CG2-OH 3.15Å
140	R	96.4	Very high	92.7	Very high	81 Å²	81	61.2 Å²	61.2	31%	0.306	30%	0.296	S	S	.	.	H	α-helix	trans	-62.3	-37.7	-179.5	-67.1	179.9	61.9	-161.2	-0.2	112	K136 E137 I143 K144 I162 E165	K136-R140 VanDerWaalsContact O-CG 3.31Å; K136-R140 WeakPolarHBondContact O-CG 3.39Å; K136-R140 PolarHBondContact O-N 3.32Å; E137-R140 PolarHBondContact O-N 3.14Å; R140-I143 PolarHBondContact O-N 3.5Å; R140-K144 WeakPolarHBondContact O-CG 3.45Å; R140-K144 PolarHBondContact O-N 2.81Å; R140-I162 HydrophobicContact CG-CG1 4.39Å; R140-E165 HydrophobicContact CB-CG 4.22Å; R140-E165 HydrophobicContact CG-CG 3.98Å; R140-E165 IonicContact CZ-OE1 2.8Å; R140-E165 IonicContact NE-OE1 2.69Å; R140-E165 PolarHBondContact NE-OE1 3.04Å; R140-E165 VanDerWaalsContact NE-OE1 3.15Å; R140-E165 IonicContact NH2-OE1 3.56Å; R140-E165 PolarHBondContact NH2-OE1 3.45Å
141	K	95.9	Very high	93.5	Very high	102 Å²	102	56.3 Å²	56.3	44%	0.443	26%	0.256	S	S	.	.	H	α-helix	trans	-62.1	-47.1	173.6	178.5	176.3	171.2	179.5	0	111.7	L133 E137 T138 I139 I143 K144 E145	L133-K141 HydrophobicContact CD1-CD 4.07Å; E137-K141 VanDerWaalsContact O-CB 3.28Å; E137-K141 WeakPolarHBondContact O-CB 3.5Å; E137-K141 PolarHBondContact O-N 3.33Å; T138-K141 PolarHBondContact O-N 3.1Å; I139-K141 VanDerWaalsContact C-N 3.31Å; I139-K141 PolarHBondContact O-N 2.7Å; K141-I143 VanDerWaalsContact C-N 3.35Å; K141-I143 PolarHBondContact O-N 2.9Å; K141-K144 PolarHBondContact O-N 3.49Å; K141-E145 WeakPolarHBondContact CE-OE1 3.47Å; K141-E145 HydrophobicContact CG-CG 4.4Å; K141-E145 IonicContact NZ-OE1 3.24Å; K141-E145 WeakPolarHBondContact O-CB 3.29Å; K141-E145 WeakPolarHBondContact O-CG 3.49Å; K141-E145 PolarHBondContact O-N 2.94Å
142	M	96.1	Very high	94.4	Very high	3 Å²	3	54.4 Å²	54.4	2%	0.015	25%	0.247	C	C	.	.	H	α-helix	trans	-61.2	-41.7	177.6	-74.1	178.4	50.9	0	0	112.3	T138 I139 K144 E145 A146 L232 V234 K238 M240 I260	T138-M142 HydrophobicContact CG2-SD 4.46Å; T138-M142 WeakPolarHBondContact O-CG 3.41Å; T138-M142 PolarHBondContact O-N 2.79Å; I139-M142 PolarHBondContact O-N 2.72Å; M142-K144 VanDerWaalsContact C-N 3.34Å; M142-K144 PolarHBondContact O-N 2.73Å; M142-E145 PolarHBondContact O-N 2.69Å; M142-A146 PolarHBondContact O-N 3.06Å; M142-A146 VanDerWaalsContact O-N 3.1Å; M142-L232 HydrophobicContact CB-CD2 4.25Å; M142-L232 HydrophobicContact CE-CD2 4.13Å; M142-L232 HydrophobicContact CE-CG 4.24Å; M142-V234 HydrophobicContact CB-CG2 4.3Å; M142-V234 HydrophobicContact CE-CG2 4.06Å; M142-K238 HydrophobicContact CE-CD 3.8Å; M142-K238 HydrophobicContact CE-CG 3.88Å; M142-K238 HydrophobicContact CG-CD 3.79Å; M142-K238 HydrophobicContact SD-CD 3.77Å; M142-K238 HydrophobicContact SD-CG 4.33Å; M142-M240 HydrophobicContact CE-CB 3.91Å; M142-M240 HydrophobicContact SD-CB 4.01Å; M142-M240 HydrophobicContact SD-CE 4.02Å; M142-I260 HydrophobicContact SD-CD1 4.21Å
143	I	96.5	Very high	95.2	Very high	0 Å²	0	46 Å²	46	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-67.8	-32.2	177.3	-66.6	160.8	0	0	0	112.1	I139 R140 K141 I150 I162 E165 I166 A169 R172 L232	I139-I143 HydrophobicContact CG2-CD1 3.61Å; I139-I143 WeakPolarHBondContact O-CG1 3.3Å; I139-I143 PolarHBondContact O-N 3.1Å; R140-I143 PolarHBondContact O-N 3.5Å; K141-I143 VanDerWaalsContact C-N 3.35Å; K141-I143 PolarHBondContact O-N 2.9Å; I143-I150 HydrophobicContact CB-CD1 4.49Å; I143-I150 HydrophobicContact CG2-CD1 3.97Å; I143-I162 HydrophobicContact CD1-CG2 3.85Å; I143-E165 HydrophobicContact CB-CB 4.4Å; I143-E165 VanDerWaalsContact CG2-C 3.45Å; I143-E165 HydrophobicContact CG2-CB 3.74Å; I143-E165 VanDerWaalsContact CG2-O 3.25Å; I143-E165 WeakPolarHBondContact CG2-O 3.38Å; I143-I166 HydrophobicContact CD1-CD1 4.23Å; I143-I166 HydrophobicContact CD1-CG1 3.81Å; I143-I166 HydrophobicContact CG1-CG1 4.33Å; I143-I166 HydrophobicContact CG2-CG1 4.03Å; I143-A169 HydrophobicContact CG2-CB 4.19Å; I143-R172 PolarHBondContact O-NH2 3.1Å; I143-L232 HydrophobicContact CD1-CD2 4.32Å; I143-L232 HydrophobicContact CG1-CD2 4.07Å
144	K	96.1	Very high	95.6	Very high	110 Å²	110	42.9 Å²	42.9	48%	0.478	19%	0.186	S	C	.	.	H	α-helix	trans	-72.9	-35.8	170.8	-73.3	-178.8	-170.1	-59.1	0	113.2	R140 K141 M142 A146 E165 R172	R140-K144 WeakPolarHBondContact O-CG 3.45Å; R140-K144 PolarHBondContact O-N 2.81Å; K141-K144 PolarHBondContact O-N 3.49Å; M142-K144 VanDerWaalsContact C-N 3.34Å; M142-K144 PolarHBondContact O-N 2.73Å; K144-A146 VanDerWaalsContact C-N 3.3Å; K144-E165 WeakPolarHBondContact CE-OE1 3.32Å; K144-E165 WeakPolarHBondContact CE-OE2 3.42Å; K144-E165 IonicContact NZ-OE1 3.02Å; K144-E165 PolarHBondContact NZ-OE1 2.8Å; K144-E165 IonicContact NZ-OE2 3.05Å; K144-E165 PolarHBondContact NZ-OE2 2.86Å; K144-R172 PolarHBondContact O-NH2 3.33Å
145	E	95.3	Very high	95.6	Very high	79 Å²	79	42.7 Å²	42.7	37%	0.369	18%	0.184	S	C	.	.	H	α-helix	trans	-70.7	-24	178.2	-76.7	176.2	176.2	0	0	113.2	K141 M142 R147 K238	K141-E145 WeakPolarHBondContact CE-OE1 3.47Å; K141-E145 HydrophobicContact CG-CG 4.4Å; K141-E145 IonicContact NZ-OE1 3.24Å; K141-E145 WeakPolarHBondContact O-CB 3.29Å; K141-E145 WeakPolarHBondContact O-CG 3.49Å; K141-E145 PolarHBondContact O-N 2.94Å; M142-E145 PolarHBondContact O-N 2.69Å; E145-R147 WeakPolarHBondContact O-CG 3.49Å; E145-K238 IonicContact OE2-NZ 3.9Å; E145-K238 PolarHBondContact OE2-NZ 2.82Å
146	A	95.3	Very high	95.6	Very high	3 Å²	3	44.5 Å²	44.5	3%	0.025	19%	0.193	C	C	.	.			trans	-58.4	134	-178.8	0	0	0	0	0	113.8	M142 K144 I150 R172 V174 V234	M142-A146 PolarHBondContact O-N 3.06Å; M142-A146 VanDerWaalsContact O-N 3.1Å; K144-A146 VanDerWaalsContact C-N 3.3Å; A146-I150 HydrophobicContact CB-CD1 3.77Å; A146-I150 HydrophobicContact CB-CG1 3.61Å; A146-R172 PolarHBondContact O-NH2 3.06Å; A146-V174 HydrophobicContact CB-CG1 4.22Å; A146-V174 WeakPolarHBondContact O-CG2 3.32Å; A146-V234 HydrophobicContact CB-CG1 3.54Å
147	R	92.6	Very high	95.6	Very high	212 Å²	212	43.4 Å²	43.4	80%	0.8	19%	0.189	S	C	*	.	S	Bend	trans	-121.2	-25.3	-172.9	-57.1	-173.5	179	-175.5	-1.6	115.4	E145 D235	E145-R147 WeakPolarHBondContact O-CG 3.49Å; R147-D235 PolarHBondContact N-OD1 3.05Å; R147-D235 PolarHBondContact N-OD2 3.47Å
148	K	91.4	Very high	95.7	Very high	134 Å²	134	41.2 Å²	41.2	58%	0.583	18%	0.182	S	C	*	.	S	Bend	trans	-127.3	-59.4	-175.7	-61.9	179.5	179.8	176.3	0	111.3	P109 S175 D235	P109-K148 HydrophobicContact CB-CD 4.42Å; P109-K148 HydrophobicContact CG-CD 4.4Å; K148-S175 PolarHBondContact O-N 3.02Å; K148-D235 WeakPolarHBondContact CA-OD1 3.5Å; K148-D235 WeakPolarHBondContact CB-OD1 3.43Å; K148-D235 PolarHBondContact N-OD1 2.97Å
149	V	95.1	Very high	95.7	Very high	7 Å²	7	41 Å²	41	4%	0.042	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	137.2	-170.6	-179.4	0	0	0	0	111.9	W108 P109 S175 Y177 D235	W108-V149 HydrophobicContact CE3-CG1 3.86Å; W108-V149 HydrophobicContact CH2-CG1 4.34Å; W108-V149 HydrophobicContact CZ3-CG1 3.77Å; P109-V149 HydrophobicContact CG-CB 4.17Å; P109-V149 HydrophobicContact CG-CG2 3.92Å; V149-S175 CarbonylContact C-O 3.56Å; V149-S175 VanDerWaalsContact CA-O 3.28Å; V149-S175 WeakPolarHBondContact CA-O 3.47Å; V149-Y177 HydrophobicContact CG1-CD2 3.97Å; V149-Y177 HydrophobicContact CG1-CE2 3.96Å; V149-D235 PolarHBondContact N-OD1 2.94Å; V149-D235 PolarHBondContact O-N 3.09Å
150	I	97	Very high	95.7	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	129.5	164.3	-68.1	163.9	0	0	0	107.7	I143 A146 A169 V174 S175 V176 Y177 L232	I143-I150 HydrophobicContact CB-CD1 4.49Å; I143-I150 HydrophobicContact CG2-CD1 3.97Å; A146-I150 HydrophobicContact CB-CD1 3.77Å; A146-I150 HydrophobicContact CB-CG1 3.61Å; I150-A169 HydrophobicContact CD1-CB 3.54Å; I150-V174 HydrophobicContact CD1-CG1 4Å; I150-V174 HydrophobicContact CG1-CG1 3.92Å; I150-S175 PolarHBondContact N-O 3.02Å; I150-V176 HydrophobicContact CB-CG1 4.33Å; I150-V176 HydrophobicContact CB-CG2 4.41Å; I150-V176 HydrophobicContact CD1-CG2 4.49Å; I150-V176 HydrophobicContact CG2-CG1 4.24Å; I150-V176 CarbonylContact O-C 3.52Å; I150-V176 WeakPolarHBondContact O-CA 3.28Å; I150-Y177 PolarHBondContact O-N 3.36Å; I150-L232 HydrophobicContact CG2-CD1 3.71Å
151	A	96.6	Very high	95.6	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.008	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	119	172.8	0	0	0	0	0	108.6	W108 Y177 L233 F273	W108-A151 HydrophobicContact CH2-CB 3.52Å; W108-A151 HydrophobicContact CZ2-CB 4.47Å; W108-A151 HydrophobicContact CZ3-CB 4.13Å; A151-Y177 WeakPolarHBondContact CA-O 3.47Å; A151-L233 HydrophobicContact CB-CB 4.09Å; A151-L233 HydrophobicContact CB-CD2 4.19Å; A151-L233 HydrophobicContact CB-CG 4.4Å; A151-L233 PolarHBondContact N-O 3.28Å; A151-L233 PolarHBondContact O-N 3.22Å; A151-F273 HydrophobicContact CB-CD1 4.14Å; A151-F273 HydrophobicContact CB-CD2 3.86Å; A151-F273 HydrophobicContact CB-CE1 3.99Å; A151-F273 HydrophobicContact CB-CE2 3.7Å; A151-F273 HydrophobicContact CB-CG 4.08Å; A151-F273 HydrophobicContact CB-CZ 3.78Å
152	L	97.3	Very high	95.6	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	124.1	-174.4	175.4	60.3	0	0	0	109.2	M154 F157 I166 Y177 I178 L179 L232 Y246	L152-M154 HydrophobicContact CD1-CB 4.32Å; L152-M154 HydrophobicContact CD1-CE 3.9Å; L152-M154 HydrophobicContact CG-CB 4.36Å; L152-F157 HydrophobicContact CD2-CD1 4.05Å; L152-F157 HydrophobicContact CD2-CE1 3.74Å; L152-F157 HydrophobicContact CD2-CZ 4.49Å; L152-I166 HydrophobicContact CD2-CD1 3.8Å; L152-Y177 PolarHBondContact N-O 3.25Å; L152-I178 HydrophobicContact CB-CG2 4.45Å; L152-I178 HydrophobicContact CD2-CG2 4.13Å; L152-I178 HydrophobicContact CG-CG2 4.33Å; L152-I178 CarbonylContact O-C 3.59Å; L152-I178 WeakPolarHBondContact O-CA 3.37Å; L152-L179 PolarHBondContact O-N 3.02Å; L152-L232 HydrophobicContact CB-CD1 4.44Å; L152-L232 HydrophobicContact CD1-CB 4.26Å; L152-L232 HydrophobicContact CD1-CD1 4.37Å; L152-Y246 HydrophobicContact CD1-CD2 4.41Å; L152-Y246 HydrophobicContact CD1-CE2 3.61Å; L152-Y246 HydrophobicContact CD2-CD2 4.15Å; L152-Y246 HydrophobicContact CD2-CE2 3.77Å; L152-Y246 HydrophobicContact CG-CE2 4.37Å
153	V	97.2	Very high	95.6	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	128	166.7	-168.6	0	0	0	0	106.8	L179 M227 Q229 K230 F231 F273 L276	V153-L179 WeakPolarHBondContact CA-O 3.26Å; V153-L179 HydrophobicContact CG1-CB 4.4Å; V153-L179 HydrophobicContact CG2-CB 4.43Å; V153-L179 HydrophobicContact CG2-CD1 4.39Å; V153-M227 HydrophobicContact CG1-CE 3.49Å; V153-M227 VanDerWaalsContact CG1-CE 3.49Å; V153-M227 HydrophobicContact CG1-SD 3.47Å; V153-M227 WeakPolarHBondContact CG1-SD 3.47Å; V153-Q229 HydrophobicContact CG1-CB 4.43Å; V153-Q229 HydrophobicContact CG1-CG 4.2Å; V153-Q229 WeakPolarHBondContact CG1-O 3.28Å; V153-K230 CarbonylContact O-C 3.56Å; V153-K230 VanDerWaalsContact O-CA 3.27Å; V153-K230 WeakPolarHBondContact O-CA 3.37Å; V153-F231 HydrophobicContact CB-CD1 4.12Å; V153-F231 HydrophobicContact CB-CE1 4.08Å; V153-F231 HydrophobicContact CB-CG 4.49Å; V153-F231 HydrophobicContact CB-CZ 4.42Å; V153-F231 HydrophobicContact CG2-CD1 4.1Å; V153-F231 HydrophobicContact CG2-CD2 4.32Å; V153-F231 HydrophobicContact CG2-CE1 3.64Å; V153-F231 HydrophobicContact CG2-CE2 3.88Å; V153-F231 HydrophobicContact CG2-CG 4.42Å; V153-F231 HydrophobicContact CG2-CZ 3.52Å; V153-F231 PolarHBondContact N-O 3.13Å; V153-F231 PolarHBondContact O-N 2.86Å; V153-F273 HydrophobicContact CG2-CD2 3.54Å; V153-F273 HydrophobicContact CG2-CE2 3.8Å; V153-L276 HydrophobicContact CG1-CD1 3.96Å; V153-L276 HydrophobicContact CG2-CD1 4.22Å
154	M	96.8	Very high	95.6	Very high	3 Å²	3	45.6 Å²	45.6	2%	0.015	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	142.9	-175.2	-169.3	56.5	51.1	0	0	112.3	L152 F157 L179 L180 D181 M227 K230 Y246	L152-M154 HydrophobicContact CD1-CB 4.32Å; L152-M154 HydrophobicContact CD1-CE 3.9Å; L152-M154 HydrophobicContact CG-CB 4.36Å; M154-F157 HydrophobicContact CG-CB 4.25Å; M154-L179 PolarHBondContact N-O 2.85Å; M154-L180 HydrophobicContact CB-CD2 3.96Å; M154-L180 WeakPolarHBondContact O-CA 3.48Å; M154-D181 PolarHBondContact O-N 2.98Å; M154-M227 VanDerWaalsContact O-CE 3.26Å; M154-M227 WeakPolarHBondContact O-CE 3.4Å; M154-K230 HydrophobicContact CE-CB 4.03Å; M154-K230 HydrophobicContact SD-CB 4.09Å; M154-Y246 HydrophobicContact CE-CD1 3.42Å; M154-Y246 VanDerWaalsContact CE-CD1 3.42Å; M154-Y246 HydrophobicContact CE-CD2 4.08Å; M154-Y246 HydrophobicContact CE-CE1 3.37Å; M154-Y246 HydrophobicContact CE-CE2 4.06Å; M154-Y246 HydrophobicContact CE-CG 3.79Å; M154-Y246 HydrophobicContact CG-CG 4.26Å; M154-Y246 HydrophobicContact SD-CD1 3.9Å; M154-Y246 HydrophobicContact SD-CE1 4.44Å; M154-Y246 HydrophobicContact SD-CG 4.02Å
155	D	94.3	Very high	95.6	Very high	25 Å²	25	41 Å²	41	13%	0.134	19%	0.19	C	C	.	.	S	Bend	trans	-75	-55.8	175.1	51.7	1.4	0	0	0	111.6	N184 K230 S245	D155-N184 VanDerWaalsContact O-CB 3.27Å; D155-N184 WeakPolarHBondContact O-CB 3.3Å; D155-K230 WeakPolarHBondContact OD2-CE 3.47Å; D155-K230 IonicContact OD2-NZ 2.72Å; D155-K230 PolarHBondContact OD2-NZ 3.12Å; D155-S245 WeakPolarHBondContact OD1-CB 3.27Å; D155-S245 PolarHBondContact OD1-OG 3.14Å; D155-S245 PolarHBondContact OD2-OG 3.15Å
156	I	94.3	Very high	95.6	Very high	38 Å²	38	37.3 Å²	37.3	20%	0.195	17%	0.173	C	C	.	.			trans	-131.9	121.2	-177.8	-55.8	-178.9	0	0	0	109.4	T158 N184 Y246 M247	I156-T158 HydrophobicContact CG2-CG2 4.3Å; I156-N184 HydrophobicContact CG1-CB 4.07Å; I156-Y246 CarbonylContact O-C 3.56Å; I156-Y246 PolarHBondContact O-N 2.9Å; I156-Y246 VanDerWaalsContact O-N 3.12Å; I156-M247 HydrophobicContact CB-SD 4.12Å; I156-M247 HydrophobicContact CD1-CE 4.5Å; I156-M247 HydrophobicContact CD1-SD 4.07Å; I156-M247 HydrophobicContact CG2-CB 4.34Å; I156-M247 HydrophobicContact CG2-CE 4.34Å; I156-M247 HydrophobicContact CG2-SD 3.96Å
157	F	96.3	Very high	95.6	Very high	3 Å²	3	38.5 Å²	38.5	1%	0.013	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-122.6	104.5	177.1	-167.6	-177.7	0	0	0	111.3	L152 M154 D159 I162 F163 I166 I178 L180 F188 Y246	L152-F157 HydrophobicContact CD2-CD1 4.05Å; L152-F157 HydrophobicContact CD2-CE1 3.74Å; L152-F157 HydrophobicContact CD2-CZ 4.49Å; M154-F157 HydrophobicContact CG-CB 4.25Å; F157-D159 WeakPolarHBondContact CE2-O 3.42Å; F157-I162 HydrophobicContact CE2-CB 4.14Å; F157-I162 HydrophobicContact CE2-CG2 4.11Å; F157-I162 HydrophobicContact CZ-CB 4.45Å; F157-I162 HydrophobicContact CZ-CG2 4.03Å; F157-F163 HydrophobicContact CE2-CB 4.04Å; F157-F163 HydrophobicContact CZ-CB 3.85Å; F157-F163 HydrophobicContact CZ-CD2 4.36Å; F157-I166 HydrophobicContact CE1-CD1 3.89Å; F157-I166 HydrophobicContact CZ-CD1 3.83Å; F157-I178 HydrophobicContact CE1-CD1 4.43Å; F157-L180 HydrophobicContact CB-CD2 3.93Å; F157-L180 HydrophobicContact CD1-CD2 4.4Å; F157-F188 HydrophobicContact CB-CD2 3.93Å; F157-F188 AromaticContact CD1-CD2 3.74Å; F157-F188 HydrophobicContact CD1-CD2 3.74Å; F157-F188 AromaticContact CD1-CE2 3.66Å; F157-F188 HydrophobicContact CD1-CE2 3.66Å; F157-F188 HydrophobicContact CE1-CD2 4.43Å; F157-F188 AromaticContact CE1-CE2 3.94Å; F157-F188 HydrophobicContact CE1-CE2 3.94Å; F157-F188 AromaticContact CG-CD2 3.85Å; F157-F188 HydrophobicContact CG-CD2 3.85Å; F157-F188 HydrophobicContact CG-CE2 4.19Å; F157-F188 VanDerWaalsContact O-CA 3.28Å; F157-F188 WeakPolarHBondContact O-CA 3.4Å; F157-F188 WeakPolarHBondContact O-CB 3.44Å; F157-Y246 AromaticContact CD2-CD2 3.96Å; F157-Y246 HydrophobicContact CD2-CD2 3.96Å; F157-Y246 HydrophobicContact CD2-CG 4.3Å; F157-Y246 HydrophobicContact CE1-CD2 4.44Å; F157-Y246 AromaticContact CE2-CD2 3.85Å; F157-Y246 HydrophobicContact CE2-CD2 3.85Å; F157-Y246 HydrophobicContact CE2-CG 4.48Å; F157-Y246 HydrophobicContact CG-CD2 4.32Å; F157-Y246 HydrophobicContact CZ-CD2 4.09Å
158	T	96.2	Very high	95.7	Very high	48 Å²	48	33.2 Å²	33.2	29%	0.294	16%	0.164	S	C	.	.			trans	-132.6	-2.2	176.9	54.2	0	0	0	0	113.9	I156 V160 H187 M191 Y246 M247	I156-T158 HydrophobicContact CG2-CG2 4.3Å; T158-V160 PolarHBondContact O-N 2.88Å; T158-H187 HydrophobicContact CG2-CB 3.77Å; T158-M191 WeakPolarHBondContact O-CG 3.34Å; T158-Y246 PolarHBondContact N-O 3.07Å; T158-M247 WeakPolarHBondContact OG1-CA 3.41Å; T158-M247 WeakPolarHBondContact OG1-CB 3.5Å
159	D	96.2	Very high	95.9	Very high	11 Å²	11	26.9 Å²	26.9	6%	0.059	14%	0.137	C	C	.	.			trans	-74.5	110.8	178.6	-166.4	-70.3	0	0	0	112.9	K136 F157 D161 I162 F163 Y246	K136-D159 WeakPolarHBondContact CE-OD1 3.28Å; K136-D159 WeakPolarHBondContact CE-OD2 3.07Å; K136-D159 VanDerWaalsContact NZ-CG 3.31Å; K136-D159 IonicContact NZ-OD1 3.4Å; K136-D159 PolarHBondContact NZ-OD1 2.88Å; K136-D159 VanDerWaalsContact NZ-OD1 3.14Å; K136-D159 IonicContact NZ-OD2 3.75Å; K136-D159 PolarHBondContact NZ-OD2 2.72Å; F157-D159 WeakPolarHBondContact CE2-O 3.42Å; D159-D161 PolarHBondContact O-N 2.85Å; D159-D161 WeakPolarHBondContact OD1-CB 3.23Å; D159-D161 PolarHBondContact OD1-N 2.79Å; D159-I162 HydrophobicContact CB-CB 4.29Å; D159-I162 HydrophobicContact CB-CD1 3.96Å; D159-I162 HydrophobicContact CB-CG1 4.27Å; D159-I162 WeakPolarHBondContact OD1-CG1 3.18Å; D159-I162 PolarHBondContact OD1-N 3.26Å; D159-F163 WeakPolarHBondContact O-CB 3.32Å; D159-F163 PolarHBondContact O-N 2.93Å; D159-Y246 PolarHBondContact N-O 3.33Å
160	V	96.1	Very high	95.9	Very high	49 Å²	49	26.8 Å²	26.8	30%	0.297	14%	0.137	S	C	.	.	H	α-helix	trans	-66	-34.1	-178.1	174.4	0	0	0	0	112.8	T158 K164 M191 Q195	T158-V160 PolarHBondContact O-N 2.88Å; V160-K164 VanDerWaalsContact O-CB 3.3Å; V160-K164 WeakPolarHBondContact O-CB 3.37Å; V160-K164 PolarHBondContact O-N 3.17Å; V160-M191 HydrophobicContact CG2-CG 3.89Å; V160-M191 HydrophobicContact CG2-SD 4.04Å; V160-Q195 VanDerWaalsContact CG1-CD 3.5Å; V160-Q195 HydrophobicContact CG1-CG 3.95Å; V160-Q195 HydrophobicContact CG2-CG 4.17Å
161	D	95.4	Very high	95.7	Very high	77 Å²	77	31.3 Å²	31.3	41%	0.412	16%	0.164	S	C	.	.	H	α-helix	trans	-68.9	-45.1	-179.3	-61.9	-55	0	0	0	110.4	K136 D159 K164 E165	K136-D161 WeakPolarHBondContact CE-OD2 3.45Å; K136-D161 IonicContact NZ-OD2 3.15Å; K136-D161 PolarHBondContact NZ-OD2 2.56Å; D159-D161 PolarHBondContact O-N 2.85Å; D159-D161 WeakPolarHBondContact OD1-CB 3.23Å; D159-D161 PolarHBondContact OD1-N 2.79Å; D161-K164 PolarHBondContact O-N 3.07Å; D161-E165 WeakPolarHBondContact O-CG 3.42Å; D161-E165 PolarHBondContact O-N 3.02Å; D161-E165 VanDerWaalsContact O-N 3.16Å
162	I	96.6	Very high	95.6	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-65.6	-43.9	177.9	-61.1	168.7	0	0	0	109.8	K136 I139 R140 I143 F157 D159 K164 E165 I166 Y246	K136-I162 HydrophobicContact CG-CD1 4.33Å; K136-I162 HydrophobicContact CG-CG1 4.41Å; I139-I162 HydrophobicContact CD1-CD1 4.19Å; I139-I162 HydrophobicContact CG2-CD1 4.06Å; I139-I162 HydrophobicContact CG2-CG1 4.07Å; I139-I162 HydrophobicContact CG2-CG2 3.77Å; R140-I162 HydrophobicContact CG-CG1 4.39Å; I143-I162 HydrophobicContact CD1-CG2 3.85Å; F157-I162 HydrophobicContact CE2-CB 4.14Å; F157-I162 HydrophobicContact CE2-CG2 4.11Å; F157-I162 HydrophobicContact CZ-CB 4.45Å; F157-I162 HydrophobicContact CZ-CG2 4.03Å; D159-I162 HydrophobicContact CB-CB 4.29Å; D159-I162 HydrophobicContact CB-CD1 3.96Å; D159-I162 HydrophobicContact CB-CG1 4.27Å; D159-I162 WeakPolarHBondContact OD1-CG1 3.18Å; D159-I162 PolarHBondContact OD1-N 3.26Å; I162-K164 VanDerWaalsContact C-N 3.33Å; I162-K164 PolarHBondContact O-N 2.91Å; I162-E165 PolarHBondContact O-N 3.03Å; I162-I166 HydrophobicContact CG2-CD1 4.31Å; I162-I166 WeakPolarHBondContact O-CG1 3.22Å; I162-I166 PolarHBondContact O-N 3.3Å; I162-I166 VanDerWaalsContact O-N 3.14Å; I162-Y246 HydrophobicContact CB-CD2 4.48Å; I162-Y246 HydrophobicContact CD1-CD1 4.19Å; I162-Y246 HydrophobicContact CD1-CD2 4.2Å; I162-Y246 HydrophobicContact CD1-CG 4Å; I162-Y246 HydrophobicContact CG2-CD2 3.67Å; I162-Y246 HydrophobicContact CG2-CE2 3.61Å
163	F	95.9	Very high	95.3	Very high	6 Å²	6	38.3 Å²	38.3	3%	0.026	21%	0.205	C	C	.	.	H	α-helix	trans	-58.9	-42.8	175.6	179	-112.5	0	0	0	112.4	F157 D159 E165 I166 V167 F188 M191 T192 C197	F157-F163 HydrophobicContact CE2-CB 4.04Å; F157-F163 HydrophobicContact CZ-CB 3.85Å; F157-F163 HydrophobicContact CZ-CD2 4.36Å; D159-F163 WeakPolarHBondContact O-CB 3.32Å; D159-F163 PolarHBondContact O-N 2.93Å; F163-E165 VanDerWaalsContact C-N 3.34Å; F163-E165 PolarHBondContact O-N 3.43Å; F163-I166 PolarHBondContact O-N 3.08Å; F163-I166 VanDerWaalsContact O-N 3.12Å; F163-V167 HydrophobicContact CD1-CG2 4.24Å; F163-V167 HydrophobicContact CD2-CG2 4.34Å; F163-V167 HydrophobicContact CE1-CG2 3.74Å; F163-V167 HydrophobicContact CE2-CG2 3.86Å; F163-V167 HydrophobicContact CZ-CG2 3.52Å; F163-V167 WeakPolarHBondContact O-CG2 3.35Å; F163-V167 PolarHBondContact O-N 3.43Å; F163-F188 AromaticContact CD2-CE2 3.83Å; F163-F188 HydrophobicContact CD2-CE2 3.83Å; F163-F188 HydrophobicContact CD2-CZ 4.16Å; F163-F188 AromaticContact CE2-CE2 3.99Å; F163-F188 HydrophobicContact CE2-CE2 3.99Å; F163-F188 AromaticContact CE2-CZ 3.84Å; F163-F188 HydrophobicContact CE2-CZ 3.84Å; F163-M191 HydrophobicContact CB-CE 3.78Å; F163-M191 HydrophobicContact CB-SD 4.17Å; F163-M191 HydrophobicContact CD1-CE 4.08Å; F163-M191 HydrophobicContact CD1-SD 3.9Å; F163-M191 HydrophobicContact CD2-CE 4.13Å; F163-M191 HydrophobicContact CG-CE 3.72Å; F163-M191 HydrophobicContact CG-SD 4.1Å; F163-T192 HydrophobicContact CD1-CG2 4.33Å; F163-T192 HydrophobicContact CD2-CG2 4.3Å; F163-T192 HydrophobicContact CE1-CG2 3.74Å; F163-T192 HydrophobicContact CE2-CG2 3.71Å; F163-T192 HydrophobicContact CZ-CG2 3.4Å; F163-T192 VanDerWaalsContact CZ-CG2 3.4Å; F163-C197 HydrophobicContact CE1-CB 3.99Å; F163-C197 HydrophobicContact CZ-CB 4.37Å
164	K	95.1	Very high	95.2	Very high	152 Å²	152	38.4 Å²	38.4	66%	0.661	21%	0.205	S	C	*	.	H	α-helix	trans	-61.4	-39.3	177.4	-175.3	172.6	-179.6	175	0	112.8	V160 D161 I162 I166 V167 E168	V160-K164 VanDerWaalsContact O-CB 3.3Å; V160-K164 WeakPolarHBondContact O-CB 3.37Å; V160-K164 PolarHBondContact O-N 3.17Å; D161-K164 PolarHBondContact O-N 3.07Å; I162-K164 VanDerWaalsContact C-N 3.33Å; I162-K164 PolarHBondContact O-N 2.91Å; K164-I166 VanDerWaalsContact C-N 3.32Å; K164-V167 PolarHBondContact O-N 3.39Å; K164-E168 WeakPolarHBondContact O-CB 3.33Å; K164-E168 PolarHBondContact O-N 3.25Å
165	E	96.5	Very high	95.1	Very high	14 Å²	14	39.2 Å²	39.2	7%	0.065	21%	0.211	C	C	.	.	H	α-helix	trans	-66.6	-32.8	175.2	-63	-71.4	-174.6	0	0	112.4	R140 I143 K144 D161 I162 F163 A169	R140-E165 HydrophobicContact CB-CG 4.22Å; R140-E165 HydrophobicContact CG-CG 3.98Å; R140-E165 IonicContact CZ-OE1 2.8Å; R140-E165 IonicContact NE-OE1 2.69Å; R140-E165 PolarHBondContact NE-OE1 3.04Å; R140-E165 VanDerWaalsContact NE-OE1 3.15Å; R140-E165 IonicContact NH2-OE1 3.56Å; R140-E165 PolarHBondContact NH2-OE1 3.45Å; I143-E165 HydrophobicContact CB-CB 4.4Å; I143-E165 VanDerWaalsContact CG2-C 3.45Å; I143-E165 HydrophobicContact CG2-CB 3.74Å; I143-E165 VanDerWaalsContact CG2-O 3.25Å; I143-E165 WeakPolarHBondContact CG2-O 3.38Å; K144-E165 WeakPolarHBondContact CE-OE1 3.32Å; K144-E165 WeakPolarHBondContact CE-OE2 3.42Å; K144-E165 IonicContact NZ-OE1 3.02Å; K144-E165 PolarHBondContact NZ-OE1 2.8Å; K144-E165 IonicContact NZ-OE2 3.05Å; K144-E165 PolarHBondContact NZ-OE2 2.86Å; D161-E165 WeakPolarHBondContact O-CG 3.42Å; D161-E165 PolarHBondContact O-N 3.02Å; D161-E165 VanDerWaalsContact O-N 3.16Å; I162-E165 PolarHBondContact O-N 3.03Å; F163-E165 VanDerWaalsContact C-N 3.34Å; F163-E165 PolarHBondContact O-N 3.43Å; E165-A169 PolarHBondContact O-N 3.39Å
166	I	96.4	Very high	95.2	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-72	-42.6	175.5	-65.8	178.4	0	0	0	111.1	I143 L152 F157 I162 F163 K164 E168 A169 S170 V176 I178 I205	I143-I166 HydrophobicContact CD1-CD1 4.23Å; I143-I166 HydrophobicContact CD1-CG1 3.81Å; I143-I166 HydrophobicContact CG1-CG1 4.33Å; I143-I166 HydrophobicContact CG2-CG1 4.03Å; L152-I166 HydrophobicContact CD2-CD1 3.8Å; F157-I166 HydrophobicContact CE1-CD1 3.89Å; F157-I166 HydrophobicContact CZ-CD1 3.83Å; I162-I166 HydrophobicContact CG2-CD1 4.31Å; I162-I166 WeakPolarHBondContact O-CG1 3.22Å; I162-I166 PolarHBondContact O-N 3.3Å; I162-I166 VanDerWaalsContact O-N 3.14Å; F163-I166 PolarHBondContact O-N 3.08Å; F163-I166 VanDerWaalsContact O-N 3.12Å; K164-I166 VanDerWaalsContact C-N 3.32Å; I166-E168 VanDerWaalsContact C-N 3.3Å; I166-E168 PolarHBondContact O-N 3.03Å; I166-A169 WeakPolarHBondContact O-CB 3.49Å; I166-A169 PolarHBondContact O-N 3.18Å; I166-A169 VanDerWaalsContact O-N 3.15Å; I166-S170 PolarHBondContact O-N 2.97Å; I166-V176 HydrophobicContact CG2-CB 4.33Å; I166-V176 HydrophobicContact CG2-CG1 3.52Å; I166-V176 HydrophobicContact CG2-CG2 4.03Å; I166-I178 HydrophobicContact CG2-CD1 4.3Å; I166-I205 HydrophobicContact CG2-CD1 4.25Å
167	V	95.3	Very high	95.3	Very high	29 Å²	29	36.2 Å²	36.2	18%	0.176	20%	0.196	C	C	.	.	H	α-helix	trans	-60.2	-43.7	173.2	174.9	0	0	0	0	110.2	F163 K164 A169 S170 T171 L202 I205	F163-V167 HydrophobicContact CD1-CG2 4.24Å; F163-V167 HydrophobicContact CD2-CG2 4.34Å; F163-V167 HydrophobicContact CE1-CG2 3.74Å; F163-V167 HydrophobicContact CE2-CG2 3.86Å; F163-V167 HydrophobicContact CZ-CG2 3.52Å; F163-V167 WeakPolarHBondContact O-CG2 3.35Å; F163-V167 PolarHBondContact O-N 3.43Å; K164-V167 PolarHBondContact O-N 3.39Å; V167-A169 PolarHBondContact O-N 3.22Å; V167-S170 WeakPolarHBondContact O-CB 3.35Å; V167-S170 PolarHBondContact O-N 3.07Å; V167-S170 VanDerWaalsContact O-N 3.11Å; V167-S170 PolarHBondContact O-OG 3.15Å; V167-T171 PolarHBondContact O-N 2.98Å; V167-T171 VanDerWaalsContact O-N 3.07Å; V167-L202 HydrophobicContact CG1-CD1 4.29Å; V167-L202 HydrophobicContact CG2-CD1 3.98Å; V167-I205 HydrophobicContact CG2-CD1 4.39Å
168	E	94.8	Very high	95.3	Very high	101 Å²	101	36.1 Å²	36.1	47%	0.472	20%	0.195	S	C	.	.	H	α-helix	trans	-61.8	-38.2	173.2	-177.8	63.7	-167.6	0	0	112.4	K164 I166 S170 T171 R172	K164-E168 WeakPolarHBondContact O-CB 3.33Å; K164-E168 PolarHBondContact O-N 3.25Å; I166-E168 VanDerWaalsContact C-N 3.3Å; I166-E168 PolarHBondContact O-N 3.03Å; E168-S170 VanDerWaalsContact C-N 3.3Å; E168-S170 PolarHBondContact O-N 3.18Å; E168-T171 PolarHBondContact O-N 2.84Å; E168-T171 PolarHBondContact O-OG1 3.5Å; E168-R172 WeakPolarHBondContact O-CG 3.47Å; E168-R172 PolarHBondContact O-N 2.86Å; E168-R172 VanDerWaalsContact O-N 3.14Å
169	A	95.4	Very high	95.3	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62	-40.1	172.2	0	0	0	0	0	111.9	I143 I150 E165 I166 V167 T171 R172 G173 V174	I143-A169 HydrophobicContact CG2-CB 4.19Å; I150-A169 HydrophobicContact CD1-CB 3.54Å; E165-A169 PolarHBondContact O-N 3.39Å; I166-A169 WeakPolarHBondContact O-CB 3.49Å; I166-A169 PolarHBondContact O-N 3.18Å; I166-A169 VanDerWaalsContact O-N 3.15Å; V167-A169 PolarHBondContact O-N 3.22Å; A169-T171 VanDerWaalsContact C-N 3.33Å; A169-T171 PolarHBondContact O-N 3.13Å; A169-R172 WeakPolarHBondContact O-CB 3.42Å; A169-R172 PolarHBondContact O-N 2.96Å; A169-G173 PolarHBondContact O-N 2.88Å; A169-V174 HydrophobicContact CB-CB 4.16Å; A169-V174 HydrophobicContact CB-CG2 4.31Å; A169-V174 VanDerWaalsContact O-CB 3.25Å; A169-V174 WeakPolarHBondContact O-CB 3.32Å; A169-V174 WeakPolarHBondContact O-CG2 3.31Å; A169-V174 PolarHBondContact O-N 3.31Å
170	S	94.1	Very high	95.3	Very high	6 Å²	6	33.4 Å²	33.4	4%	0.042	18%	0.179	C	C	.	.	H	α-helix	trans	-65	-33.6	177.9	85.5	0	0	0	0	113.2	I166 V167 E168 G173 N204	I166-S170 PolarHBondContact O-N 2.97Å; V167-S170 WeakPolarHBondContact O-CB 3.35Å; V167-S170 PolarHBondContact O-N 3.07Å; V167-S170 VanDerWaalsContact O-N 3.11Å; V167-S170 PolarHBondContact O-OG 3.15Å; E168-S170 VanDerWaalsContact C-N 3.3Å; E168-S170 PolarHBondContact O-N 3.18Å; S170-G173 PolarHBondContact O-N 3.43Å; S170-N204 PolarHBondContact O-ND2 3.12Å
171	T	93.3	Very high	95.2	Very high	95 Å²	95	31.2 Å²	31.2	58%	0.583	17%	0.166	S	C	*	.	H	α-helix	trans	-74.7	-28.9	175	59.5	0	0	0	0	112.5	V167 E168 A169 G173	V167-T171 PolarHBondContact O-N 2.98Å; V167-T171 VanDerWaalsContact O-N 3.07Å; E168-T171 PolarHBondContact O-N 2.84Å; E168-T171 PolarHBondContact O-OG1 3.5Å; A169-T171 VanDerWaalsContact C-N 3.33Å; A169-T171 PolarHBondContact O-N 3.13Å; T171-G173 PolarHBondContact O-N 2.59Å
172	R	94	Very high	95	Very high	102 Å²	102	30 Å²	30	39%	0.385	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-6.2	167.5	-62.3	-171.9	-38.8	-101.2	9.1	113.6	I143 K144 A146 E168 A169 V174	I143-R172 PolarHBondContact O-NH2 3.1Å; K144-R172 PolarHBondContact O-NH2 3.33Å; A146-R172 PolarHBondContact O-NH2 3.06Å; E168-R172 WeakPolarHBondContact O-CG 3.47Å; E168-R172 PolarHBondContact O-N 2.86Å; E168-R172 VanDerWaalsContact O-N 3.14Å; A169-R172 WeakPolarHBondContact O-CB 3.42Å; A169-R172 PolarHBondContact O-N 2.96Å; R172-V174 HydrophobicContact CB-CG2 4.45Å
173	G	91.6	Very high	94.6	Very high	46 Å²	46	32.2 Å²	32.2	47%	0.474	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.8	15.4	-177.4	0	0	0	0	0	114.6	A169 S170 T171	A169-G173 PolarHBondContact O-N 2.88Å; S170-G173 PolarHBondContact O-N 3.43Å; T171-G173 PolarHBondContact O-N 2.59Å
174	V	95.4	Very high	94.3	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.012	18%	0.18	C	C	.	.			trans	-76.6	129.5	170.9	-175.3	0	0	0	0	108.7	A146 I150 A169 R172	A146-V174 HydrophobicContact CB-CG1 4.22Å; A146-V174 WeakPolarHBondContact O-CG2 3.32Å; I150-V174 HydrophobicContact CD1-CG1 4Å; I150-V174 HydrophobicContact CG1-CG1 3.92Å; A169-V174 HydrophobicContact CB-CB 4.16Å; A169-V174 HydrophobicContact CB-CG2 4.31Å; A169-V174 VanDerWaalsContact O-CB 3.25Å; A169-V174 WeakPolarHBondContact O-CB 3.32Å; A169-V174 WeakPolarHBondContact O-CG2 3.31Å; A169-V174 PolarHBondContact O-N 3.31Å; R172-V174 HydrophobicContact CB-CG2 4.45Å
175	S	94.8	Very high	94.2	Very high	20 Å²	20	26.5 Å²	26.5	14%	0.14	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	124.5	174.5	-62.4	0	0	0	0	110.2	L106 K148 V149 I150	L106-S175 WeakPolarHBondContact CB-OG 3.47Å; L106-S175 WeakPolarHBondContact O-CB 3.4Å; L106-S175 PolarHBondContact O-OG 2.83Å; K148-S175 PolarHBondContact O-N 3.02Å; V149-S175 CarbonylContact C-O 3.56Å; V149-S175 VanDerWaalsContact CA-O 3.28Å; V149-S175 WeakPolarHBondContact CA-O 3.47Å; I150-S175 PolarHBondContact N-O 3.02Å
176	V	96.2	Very high	94	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	129	-178	-172.4	0	0	0	0	110.5	I150 I166 I178 N204 I205 R206	I150-V176 HydrophobicContact CB-CG1 4.33Å; I150-V176 HydrophobicContact CB-CG2 4.41Å; I150-V176 HydrophobicContact CD1-CG2 4.49Å; I150-V176 HydrophobicContact CG2-CG1 4.24Å; I150-V176 CarbonylContact O-C 3.52Å; I150-V176 WeakPolarHBondContact O-CA 3.28Å; I166-V176 HydrophobicContact CG2-CB 4.33Å; I166-V176 HydrophobicContact CG2-CG1 3.52Å; I166-V176 HydrophobicContact CG2-CG2 4.03Å; V176-I178 HydrophobicContact CG1-CD1 4.12Å; V176-I178 HydrophobicContact CG1-CG1 3.75Å; V176-N204 PolarHBondContact N-O 2.72Å; V176-I205 HydrophobicContact CB-CB 4.36Å; V176-I205 HydrophobicContact CB-CG1 4.04Å; V176-I205 HydrophobicContact CB-CG2 4.21Å; V176-I205 HydrophobicContact CG1-CG2 4.22Å; V176-I205 HydrophobicContact CG2-CG1 4.25Å; V176-I205 CarbonylContact O-C 3.48Å; V176-I205 WeakPolarHBondContact O-CA 3.37Å; V176-R206 PolarHBondContact O-N 3.27Å
177	Y	95.9	Very high	93.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	129.6	168.7	-54.2	-94	0	0	0	109	L104 D105 L106 G107 W108 V149 I150 A151 L152 R206 Y277	L104-Y177 HydrophobicContact CB-CE1 4.35Å; L104-Y177 HydrophobicContact CD2-CD1 4.17Å; L104-Y177 HydrophobicContact CD2-CE1 3.9Å; L104-Y177 PolarHBondContact O-OH 2.78Å; D105-Y177 PolarHBondContact N-OH 3.08Å; L106-Y177 VanDerWaalsContact C-OH 3.28Å; L106-Y177 WeakPolarHBondContact CA-OH 3.4Å; L106-Y177 HydrophobicContact CB-CE1 4.27Å; L106-Y177 HydrophobicContact CB-CE2 4.37Å; L106-Y177 WeakPolarHBondContact CB-OH 3.45Å; L106-Y177 HydrophobicContact CG-CE1 4.34Å; L106-Y177 PolarHBondContact N-OH 3.47Å; G107-Y177 PolarHBondContact N-OH 2.82Å; G107-Y177 VanDerWaalsContact N-OH 3.12Å; G107-Y177 PolarHBondContact O-OH 2.98Å; W108-Y177 HydrophobicContact CE3-CD2 4.07Å; W108-Y177 AromaticContact CE3-CE2 3.63Å; W108-Y177 HydrophobicContact CE3-CE2 3.63Å; W108-Y177 AromaticContact CZ3-CD2 3.56Å; W108-Y177 HydrophobicContact CZ3-CD2 3.56Å; W108-Y177 AromaticContact CZ3-CE2 3.64Å; W108-Y177 HydrophobicContact CZ3-CE2 3.64Å; W108-Y177 HydrophobicContact CZ3-CG 4.29Å; V149-Y177 HydrophobicContact CG1-CD2 3.97Å; V149-Y177 HydrophobicContact CG1-CE2 3.96Å; I150-Y177 PolarHBondContact O-N 3.36Å; A151-Y177 WeakPolarHBondContact CA-O 3.47Å; L152-Y177 PolarHBondContact N-O 3.25Å; Y177-R206 CarbonylContact C-O 3.53Å; Y177-R206 HydrophobicContact CD1-CB 4.03Å; Y177-R206 HydrophobicContact CD1-CG 3.95Å; Y177-R206 HydrophobicContact CE1-CG 4.09Å; Y177-Y277 AromaticContact CD1-CE2 3.65Å; Y177-Y277 HydrophobicContact CD1-CE2 3.65Å; Y177-Y277 AromaticContact CD1-CZ 3.76Å; Y177-Y277 HydrophobicContact CE1-CE2 4.42Å; Y177-Y277 HydrophobicContact CG-CE2 4.41Å
178	I	96.4	Very high	93.8	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	116.9	-179.4	-47.2	-176.6	0	0	0	108.5	L152 F157 I166 V176 L180 I205 R206 V207 R208	L152-I178 HydrophobicContact CB-CG2 4.45Å; L152-I178 HydrophobicContact CD2-CG2 4.13Å; L152-I178 HydrophobicContact CG-CG2 4.33Å; L152-I178 CarbonylContact O-C 3.59Å; L152-I178 WeakPolarHBondContact O-CA 3.37Å; F157-I178 HydrophobicContact CE1-CD1 4.43Å; I166-I178 HydrophobicContact CG2-CD1 4.3Å; V176-I178 HydrophobicContact CG1-CD1 4.12Å; V176-I178 HydrophobicContact CG1-CG1 3.75Å; I178-L180 HydrophobicContact CG2-CD1 4.46Å; I178-L180 HydrophobicContact CG2-CD2 3.8Å; I178-L180 HydrophobicContact CG2-CG 3.9Å; I178-I205 HydrophobicContact CD1-CG2 3.96Å; I178-I205 HydrophobicContact CG1-CG2 4.27Å; I178-R206 PolarHBondContact N-O 3.21Å; I178-V207 HydrophobicContact CB-CG1 4.29Å; I178-V207 HydrophobicContact CB-CG2 4.31Å; I178-V207 HydrophobicContact CD1-CG2 4.22Å; I178-V207 HydrophobicContact CG2-CG1 4.49Å; I178-V207 WeakPolarHBondContact O-CA 3.46Å; I178-R208 PolarHBondContact O-N 2.89Å
179	L	96.1	Very high	93.7	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	121.3	170	-61.1	-173.8	0	0	0	108.6	L152 V153 M154 R208 V210 F273 L276 Y277	L152-L179 PolarHBondContact O-N 3.02Å; V153-L179 WeakPolarHBondContact CA-O 3.26Å; V153-L179 HydrophobicContact CG1-CB 4.4Å; V153-L179 HydrophobicContact CG2-CB 4.43Å; V153-L179 HydrophobicContact CG2-CD1 4.39Å; M154-L179 PolarHBondContact N-O 2.85Å; L179-R208 WeakPolarHBondContact CA-O 3.45Å; L179-R208 HydrophobicContact CD2-CB 3.81Å; L179-V210 HydrophobicContact CB-CG2 4.1Å; L179-V210 HydrophobicContact CD1-CG2 4.26Å; L179-V210 HydrophobicContact CD2-CG2 4.27Å; L179-V210 HydrophobicContact CG-CG2 4.45Å; L179-F273 HydrophobicContact CD1-CD2 4.22Å; L179-F273 HydrophobicContact CD1-CE2 3.75Å; L179-F273 HydrophobicContact CD1-CZ 4.01Å; L179-F273 HydrophobicContact CG-CE2 3.85Å; L179-F273 HydrophobicContact CG-CZ 3.97Å; L179-L276 HydrophobicContact CD1-CB 3.56Å; L179-Y277 HydrophobicContact CD2-CD2 3.83Å; L179-Y277 HydrophobicContact CD2-CE2 4.4Å; L179-Y277 HydrophobicContact CG-CD2 4.46Å
180	L	95.8	Very high	93.7	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.01	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	150.6	177.9	-61.9	-179.9	0	0	0	110.9	M154 F157 I178 E182 F185 F188 V207 R208 T209 V210	M154-L180 HydrophobicContact CB-CD2 3.96Å; M154-L180 WeakPolarHBondContact O-CA 3.48Å; F157-L180 HydrophobicContact CB-CD2 3.93Å; F157-L180 HydrophobicContact CD1-CD2 4.4Å; I178-L180 HydrophobicContact CG2-CD1 4.46Å; I178-L180 HydrophobicContact CG2-CD2 3.8Å; I178-L180 HydrophobicContact CG2-CG 3.9Å; L180-E182 PolarHBondContact O-N 3.45Å; L180-F185 HydrophobicContact CB-CD2 4.41Å; L180-F185 HydrophobicContact CD1-CD2 3.92Å; L180-F185 HydrophobicContact CD1-CE2 4.33Å; L180-F188 HydrophobicContact CD1-CB 3.68Å; L180-F188 HydrophobicContact CD1-CD1 3.62Å; L180-F188 HydrophobicContact CD1-CD2 4.05Å; L180-F188 HydrophobicContact CD1-CE1 4.25Å; L180-F188 HydrophobicContact CD1-CG 3.5Å; L180-F188 VanDerWaalsContact CD1-CG 3.5Å; L180-V207 HydrophobicContact CD1-CG1 3.98Å; L180-V207 HydrophobicContact CG-CG1 4.4Å; L180-R208 PolarHBondContact N-O 3.19Å; L180-T209 CarbonylContact O-C 3.58Å; L180-T209 VanDerWaalsContact O-CA 3.27Å; L180-T209 WeakPolarHBondContact O-CA 3.38Å; L180-V210 PolarHBondContact O-N 2.88Å
181	D	94.3	Very high	93.7	Very high	3 Å²	3	33.2 Å²	33.2	2%	0.016	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	132.1	166.5	174.7	78.2	0	0	0	110.4	M154 S183 N184 F185 K226 M227	M154-D181 PolarHBondContact O-N 2.98Å; D181-S183 PolarHBondContact O-N 2.9Å; D181-S183 WeakPolarHBondContact OD2-CA 3.44Å; D181-S183 WeakPolarHBondContact OD2-CB 3.39Å; D181-S183 PolarHBondContact OD2-N 2.88Å; D181-S183 PolarHBondContact OD2-OG 2.8Å; D181-N184 HydrophobicContact CB-CB 4.39Å; D181-N184 PolarHBondContact O-N 2.96Å; D181-N184 PolarHBondContact OD2-N 2.69Å; D181-N184 VanDerWaalsContact OD2-N 3.13Å; D181-N184 PolarHBondContact OD2-ND2 3.31Å; D181-F185 PolarHBondContact O-N 2.94Å; D181-K226 VanDerWaalsContact OD1-CA 3.3Å; D181-K226 WeakPolarHBondContact OD1-CA 3.48Å; D181-M227 HydrophobicContact CB-CB 4.3Å; D181-M227 PolarHBondContact OD1-N 3.45Å
182	E	90.9	Very high	93.7	Very high	52 Å²	52	28.7 Å²	28.7	24%	0.243	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-43.8	-177	-172.2	-159.6	-135.5	0	0	112.5	L180 N184 F185 T209 V210 K211 H224	L180-E182 PolarHBondContact O-N 3.45Å; E182-N184 PolarHBondContact O-N 2.84Å; E182-F185 WeakPolarHBondContact O-CB 3.2Å; E182-F185 PolarHBondContact O-N 3.47Å; E182-T209 HydrophobicContact CB-CG2 4.36Å; E182-T209 HydrophobicContact CG-CG2 4.46Å; E182-V210 PolarHBondContact N-O 2.91Å; E182-V210 VanDerWaalsContact N-O 3.07Å; E182-K211 HydrophobicContact CB-CG 4.39Å; E182-K211 WeakPolarHBondContact OE1-CE 3.41Å; E182-K211 IonicContact OE1-NZ 2.71Å; E182-K211 PolarHBondContact OE1-NZ 3.28Å; E182-K211 IonicContact OE2-NZ 2.75Å; E182-K211 PolarHBondContact OE2-NZ 3.38Å; E182-H224 IonicContact OE2-CE1 3.14Å; E182-H224 PolarHBondContact OE2-CE1 3.04Å; E182-H224 IonicContact OE2-NE2 2.7Å; E182-H224 PolarHBondContact OE2-NE2 2.85Å
183	S	87.4	Confident	93.6	Very high	46 Å²	46	29.3 Å²	29.3	32%	0.322	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-26.2	-176.3	77.1	0	0	0	0	112.4	D181	D181-S183 PolarHBondContact O-N 2.9Å; D181-S183 WeakPolarHBondContact OD2-CA 3.44Å; D181-S183 WeakPolarHBondContact OD2-CB 3.39Å; D181-S183 PolarHBondContact OD2-N 2.88Å; D181-S183 PolarHBondContact OD2-OG 2.8Å
184	N	89.9	Confident	93.7	Very high	32 Å²	32	35 Å²	35	17%	0.171	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-12.4	-180	-72	-74.5	0	0	0	114.7	D155 I156 D181 E182 N186 H187	D155-N184 VanDerWaalsContact O-CB 3.27Å; D155-N184 WeakPolarHBondContact O-CB 3.3Å; I156-N184 HydrophobicContact CG1-CB 4.07Å; D181-N184 HydrophobicContact CB-CB 4.39Å; D181-N184 PolarHBondContact O-N 2.96Å; D181-N184 PolarHBondContact OD2-N 2.69Å; D181-N184 VanDerWaalsContact OD2-N 3.13Å; D181-N184 PolarHBondContact OD2-ND2 3.31Å; E182-N184 PolarHBondContact O-N 2.84Å; N184-N186 PolarHBondContact O-N 2.67Å; N184-N186 VanDerWaalsContact O-N 3.09Å; N184-H187 WeakPolarHBondContact O-CB 3.27Å; N184-H187 PolarHBondContact O-N 2.99Å; N184-H187 PolarHBondContact O-ND1 2.8Å; N184-H187 VanDerWaalsContact O-ND1 3.15Å
185	F	92.9	Very high	93.5	Very high	5 Å²	5	39.9 Å²	39.9	2%	0.022	20%	0.198	C	C	.	.	H	α-helix	trans	-50.9	-38.2	-174.8	176.6	-98.6	0	0	0	114.3	L180 D181 E182 H187 F188 L189 V207 T209 P283 F286	L180-F185 HydrophobicContact CB-CD2 4.41Å; L180-F185 HydrophobicContact CD1-CD2 3.92Å; L180-F185 HydrophobicContact CD1-CE2 4.33Å; D181-F185 PolarHBondContact O-N 2.94Å; E182-F185 WeakPolarHBondContact O-CB 3.2Å; E182-F185 PolarHBondContact O-N 3.47Å; F185-H187 PolarHBondContact O-N 3.35Å; F185-H187 VanDerWaalsContact O-N 3.17Å; F185-F188 HydrophobicContact CE2-CD1 4.12Å; F185-F188 WeakPolarHBondContact O-CB 3.47Å; F185-F188 PolarHBondContact O-N 3.05Å; F185-L189 HydrophobicContact CE1-CB 4.16Å; F185-L189 HydrophobicContact CE1-CD2 4.22Å; F185-L189 HydrophobicContact CZ-CB 4.5Å; F185-L189 PolarHBondContact O-N 2.85Å; F185-L189 VanDerWaalsContact O-N 3.07Å; F185-V207 HydrophobicContact CE2-CG1 3.89Å; F185-T209 HydrophobicContact CB-CG2 3.6Å; F185-T209 HydrophobicContact CD1-CG2 4.41Å; F185-T209 HydrophobicContact CD2-CG2 3.52Å; F185-T209 HydrophobicContact CE2-CG2 4.35Å; F185-T209 HydrophobicContact CG-CG2 3.56Å; F185-P283 HydrophobicContact CD1-CB 3.95Å; F185-P283 HydrophobicContact CD2-CB 4.15Å; F185-P283 HydrophobicContact CD2-CG 4.19Å; F185-P283 HydrophobicContact CE1-CB 3.49Å; F185-P283 VanDerWaalsContact CE1-CB 3.49Å; F185-P283 HydrophobicContact CE1-CG 4.28Å; F185-P283 HydrophobicContact CE2-CB 3.71Å; F185-P283 HydrophobicContact CE2-CG 3.58Å; F185-P283 HydrophobicContact CG-CB 4.28Å; F185-P283 HydrophobicContact CZ-CB 3.36Å; F185-P283 HydrophobicContact CZ-CG 3.64Å; F185-F286 HydrophobicContact CE2-CZ 4.42Å; F185-F286 HydrophobicContact CZ-CE1 4.01Å; F185-F286 HydrophobicContact CZ-CE2 4.05Å; F185-F286 AromaticContact CZ-CZ 3.68Å; F185-F286 HydrophobicContact CZ-CZ 3.68Å
186	N	92.2	Very high	93.1	Very high	81 Å²	81	42.3 Å²	42.3	43%	0.433	23%	0.226	S	C	.	.	H	α-helix	trans	-61.4	-26.2	-179	-67.9	-49.2	0	0	0	113	N184 N190 S285	N184-N186 PolarHBondContact O-N 2.67Å; N184-N186 VanDerWaalsContact O-N 3.09Å; N186-N190 WeakPolarHBondContact O-CB 3.38Å; N186-N190 PolarHBondContact O-N 3.37Å; N186-N190 VanDerWaalsContact O-N 3.08Å; N186-N190 PolarHBondContact O-ND2 3.12Å; N186-S285 PolarHBondContact OD1-OG 3.41Å
187	H	93.7	Very high	92.6	Very high	101 Å²	101	43.6 Å²	43.6	47%	0.468	24%	0.235	S	C	.	.	H	α-helix	trans	-68.5	-38	174.1	-57.7	110.4	0	0	0	112.2	T158 N184 F185 M191	T158-H187 HydrophobicContact CG2-CB 3.77Å; N184-H187 WeakPolarHBondContact O-CB 3.27Å; N184-H187 PolarHBondContact O-N 2.99Å; N184-H187 PolarHBondContact O-ND1 2.8Å; N184-H187 VanDerWaalsContact O-ND1 3.15Å; F185-H187 PolarHBondContact O-N 3.35Å; F185-H187 VanDerWaalsContact O-N 3.17Å; H187-M191 PolarHBondContact O-N 2.91Å
188	F	94.8	Very high	92.1	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.009	25%	0.246	C	C	.	.	H	α-helix	trans	-67.8	-45.7	174.5	172.2	-98.2	0	0	0	111.4	F157 F163 L180 F185 N190 M191 T192 V207	F157-F188 HydrophobicContact CB-CD2 3.93Å; F157-F188 AromaticContact CD1-CD2 3.74Å; F157-F188 HydrophobicContact CD1-CD2 3.74Å; F157-F188 AromaticContact CD1-CE2 3.66Å; F157-F188 HydrophobicContact CD1-CE2 3.66Å; F157-F188 HydrophobicContact CE1-CD2 4.43Å; F157-F188 AromaticContact CE1-CE2 3.94Å; F157-F188 HydrophobicContact CE1-CE2 3.94Å; F157-F188 AromaticContact CG-CD2 3.85Å; F157-F188 HydrophobicContact CG-CD2 3.85Å; F157-F188 HydrophobicContact CG-CE2 4.19Å; F157-F188 VanDerWaalsContact O-CA 3.28Å; F157-F188 WeakPolarHBondContact O-CA 3.4Å; F157-F188 WeakPolarHBondContact O-CB 3.44Å; F163-F188 AromaticContact CD2-CE2 3.83Å; F163-F188 HydrophobicContact CD2-CE2 3.83Å; F163-F188 HydrophobicContact CD2-CZ 4.16Å; F163-F188 AromaticContact CE2-CE2 3.99Å; F163-F188 HydrophobicContact CE2-CE2 3.99Å; F163-F188 AromaticContact CE2-CZ 3.84Å; F163-F188 HydrophobicContact CE2-CZ 3.84Å; L180-F188 HydrophobicContact CD1-CB 3.68Å; L180-F188 HydrophobicContact CD1-CD1 3.62Å; L180-F188 HydrophobicContact CD1-CD2 4.05Å; L180-F188 HydrophobicContact CD1-CE1 4.25Å; L180-F188 HydrophobicContact CD1-CG 3.5Å; L180-F188 VanDerWaalsContact CD1-CG 3.5Å; F185-F188 HydrophobicContact CE2-CD1 4.12Å; F185-F188 WeakPolarHBondContact O-CB 3.47Å; F185-F188 PolarHBondContact O-N 3.05Å; F188-N190 PolarHBondContact O-N 2.8Å; F188-M191 HydrophobicContact CD2-CE 3.65Å; F188-M191 HydrophobicContact CE2-CE 3.79Å; F188-M191 WeakPolarHBondContact O-CB 3.44Å; F188-M191 PolarHBondContact O-N 3.3Å; F188-T192 HydrophobicContact CD1-CG2 4.33Å; F188-T192 HydrophobicContact CD2-CG2 4.32Å; F188-T192 HydrophobicContact CE1-CG2 3.86Å; F188-T192 HydrophobicContact CE2-CG2 3.86Å; F188-T192 HydrophobicContact CZ-CG2 3.61Å; F188-T192 PolarHBondContact O-N 2.83Å; F188-V207 HydrophobicContact CD1-CG1 4.43Å; F188-V207 HydrophobicContact CE1-CG1 3.96Å; F188-V207 HydrophobicContact CE1-CG2 4.17Å; F188-V207 HydrophobicContact CZ-CG2 4.34Å
189	L	93.5	Very high	91.5	Very high	16 Å²	16	45.3 Å²	45.3	8%	0.084	25%	0.247	C	C	.	.	H	α-helix	trans	-57.5	-52.4	177.8	-178.1	55.7	0	0	0	111.2	F185 M191 T192 E193 F286	F185-L189 HydrophobicContact CE1-CB 4.16Å; F185-L189 HydrophobicContact CE1-CD2 4.22Å; F185-L189 HydrophobicContact CZ-CB 4.5Å; F185-L189 PolarHBondContact O-N 2.85Å; F185-L189 VanDerWaalsContact O-N 3.07Å; L189-M191 PolarHBondContact O-N 3.31Å; L189-M191 VanDerWaalsContact O-N 3.13Å; L189-T192 PolarHBondContact O-N 3.21Å; L189-T192 PolarHBondContact O-OG1 2.7Å; L189-E193 HydrophobicContact CD1-CG 4.21Å; L189-E193 WeakPolarHBondContact O-CG 3.39Å; L189-E193 PolarHBondContact O-N 2.91Å; L189-F286 HydrophobicContact CD1-CE1 3.92Å
190	N	94	Very high	91	Very high	79 Å²	79	48.3 Å²	48.3	42%	0.422	26%	0.261	S	S	.	.	H	α-helix	trans	-56.3	-29.3	175.4	-81.2	-60.2	0	0	0	113.7	N186 F188 K194	N186-N190 WeakPolarHBondContact O-CB 3.38Å; N186-N190 PolarHBondContact O-N 3.37Å; N186-N190 VanDerWaalsContact O-N 3.08Å; N186-N190 PolarHBondContact O-ND2 3.12Å; F188-N190 PolarHBondContact O-N 2.8Å; N190-K194 WeakPolarHBondContact O-CB 3.47Å; N190-K194 VanDerWaalsContact O-CD 3.24Å; N190-K194 WeakPolarHBondContact O-CD 3.49Å; N190-K194 WeakPolarHBondContact O-CG 3.45Å; N190-K194 PolarHBondContact O-N 2.92Å
191	M	95.3	Very high	90.5	Very high	12 Å²	12	57 Å²	57	6%	0.059	29%	0.293	C	S	.	.	H	α-helix	trans	-75	-46.4	175.1	176.9	-80	-64.2	0	0	111.3	T158 V160 F163 H187 F188 L189 E193 K194 Q195	T158-M191 WeakPolarHBondContact O-CG 3.34Å; V160-M191 HydrophobicContact CG2-CG 3.89Å; V160-M191 HydrophobicContact CG2-SD 4.04Å; F163-M191 HydrophobicContact CB-CE 3.78Å; F163-M191 HydrophobicContact CB-SD 4.17Å; F163-M191 HydrophobicContact CD1-CE 4.08Å; F163-M191 HydrophobicContact CD1-SD 3.9Å; F163-M191 HydrophobicContact CD2-CE 4.13Å; F163-M191 HydrophobicContact CG-CE 3.72Å; F163-M191 HydrophobicContact CG-SD 4.1Å; H187-M191 PolarHBondContact O-N 2.91Å; F188-M191 HydrophobicContact CD2-CE 3.65Å; F188-M191 HydrophobicContact CE2-CE 3.79Å; F188-M191 WeakPolarHBondContact O-CB 3.44Å; F188-M191 PolarHBondContact O-N 3.3Å; L189-M191 PolarHBondContact O-N 3.31Å; L189-M191 VanDerWaalsContact O-N 3.13Å; M191-E193 PolarHBondContact O-N 2.75Å; M191-K194 PolarHBondContact O-N 2.98Å; M191-Q195 WeakPolarHBondContact O-CG 3.47Å; M191-Q195 PolarHBondContact O-N 3.2Å; M191-Q195 HydrophobicContact SD-CG 4.39Å
192	T	93	Very high	90.2	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.006	30%	0.303	C	S	.	.	H	α-helix	trans	-64.8	-39.7	-179.8	61.1	0	0	0	0	112.2	F163 F188 L189 Q195 G196 C197	F163-T192 HydrophobicContact CD1-CG2 4.33Å; F163-T192 HydrophobicContact CD2-CG2 4.3Å; F163-T192 HydrophobicContact CE1-CG2 3.74Å; F163-T192 HydrophobicContact CE2-CG2 3.71Å; F163-T192 HydrophobicContact CZ-CG2 3.4Å; F163-T192 VanDerWaalsContact CZ-CG2 3.4Å; F188-T192 HydrophobicContact CD1-CG2 4.33Å; F188-T192 HydrophobicContact CD2-CG2 4.32Å; F188-T192 HydrophobicContact CE1-CG2 3.86Å; F188-T192 HydrophobicContact CE2-CG2 3.86Å; F188-T192 HydrophobicContact CZ-CG2 3.61Å; F188-T192 PolarHBondContact O-N 2.83Å; L189-T192 PolarHBondContact O-N 3.21Å; L189-T192 PolarHBondContact O-OG1 2.7Å; T192-Q195 PolarHBondContact O-N 3.06Å; T192-G196 PolarHBondContact O-N 3.27Å; T192-C197 WeakPolarHBondContact O-CB 3.38Å; T192-C197 PolarHBondContact O-N 3.25Å
193	E	91.9	Very high	90	Very high	114 Å²	114	67 Å²	67	53%	0.533	33%	0.332	S	S	.	.	H	α-helix	trans	-62.6	-43	174.1	-70.7	177.9	178.4	0	0	112.7	L189 M191 Q195 G196	L189-E193 HydrophobicContact CD1-CG 4.21Å; L189-E193 WeakPolarHBondContact O-CG 3.39Å; L189-E193 PolarHBondContact O-N 2.91Å; M191-E193 PolarHBondContact O-N 2.75Å; E193-Q195 PolarHBondContact O-N 3.07Å; E193-G196 WeakPolarHBondContact O-CA 3.42Å; E193-G196 PolarHBondContact O-N 3.23Å
194	K	93.2	Very high	90.2	Very high	165 Å²	165	67.9 Å²	67.9	72%	0.717	33%	0.332	S	S	*	.	H	α-helix	trans	-63.9	-22.2	175.3	-75.4	170.3	-169.4	174.6	0	113.6	N190 M191 G196	N190-K194 WeakPolarHBondContact O-CB 3.47Å; N190-K194 VanDerWaalsContact O-CD 3.24Å; N190-K194 WeakPolarHBondContact O-CD 3.49Å; N190-K194 WeakPolarHBondContact O-CG 3.45Å; N190-K194 PolarHBondContact O-N 2.92Å; M191-K194 PolarHBondContact O-N 2.98Å; K194-G196 VanDerWaalsContact C-N 3.33Å
195	Q	90.9	Very high	90.4	Very high	106 Å²	106	66.7 Å²	66.7	50%	0.495	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	5.7	171.6	-61.5	-56.3	-56.9	0	0	113.1	V160 M191 T192 E193 C197	V160-Q195 VanDerWaalsContact CG1-CD 3.5Å; V160-Q195 HydrophobicContact CG1-CG 3.95Å; V160-Q195 HydrophobicContact CG2-CG 4.17Å; M191-Q195 WeakPolarHBondContact O-CG 3.47Å; M191-Q195 PolarHBondContact O-N 3.2Å; M191-Q195 HydrophobicContact SD-CG 4.39Å; T192-Q195 PolarHBondContact O-N 3.06Å; E193-Q195 PolarHBondContact O-N 3.07Å; Q195-C197 HydrophobicContact CB-CB 4.43Å; Q195-C197 PolarHBondContact O-N 3.14Å
196	G	86.7	Confident	90.4	Very high	71 Å²	71	70.7 Å²	70.7	73%	0.732	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.3	13.8	-174.7	0	0	0	0	0	113.9	T192 E193 K194	T192-G196 PolarHBondContact O-N 3.27Å; E193-G196 WeakPolarHBondContact O-CA 3.42Å; E193-G196 PolarHBondContact O-N 3.23Å; K194-G196 VanDerWaalsContact C-N 3.33Å
197	C	85.7	Confident	90.5	Very high	27 Å²	27	67.4 Å²	67.4	18%	0.182	32%	0.324	C	S	.	.			trans	-98.4	94.5	-171.3	-166.1	0	0	0	0	110.8	F163 T192 Q195 V199	F163-C197 HydrophobicContact CE1-CB 3.99Å; F163-C197 HydrophobicContact CZ-CB 4.37Å; T192-C197 WeakPolarHBondContact O-CB 3.38Å; T192-C197 PolarHBondContact O-N 3.25Å; Q195-C197 HydrophobicContact CB-CB 4.43Å; Q195-C197 PolarHBondContact O-N 3.14Å; C197-V199 VanDerWaalsContact C-N 3.27Å; C197-V199 PolarHBondContact O-N 3.2Å
198	S	85.6	Confident	90.5	Very high	33 Å²	33	64.3 Å²	64.3	23%	0.231	31%	0.308	C	S	.	.			trans	-69.6	86.7	169.1	175.8	0	0	0	0	109.4	Q200 R201	S198-Q200 VanDerWaalsContact C-OE1 3.27Å; S198-Q200 PolarHBondContact O-N 3.25Å; S198-Q200 VanDerWaalsContact O-N 3.13Å; S198-Q200 PolarHBondContact OG-OE1 3.17Å; S198-R201 WeakPolarHBondContact O-CB 3.37Å; S198-R201 PolarHBondContact O-N 3.49Å; S198-R201 WeakPolarHBondContact OG-CG 3.44Å; S198-R201 PolarHBondContact OG-NE 3.25Å; S198-R201 VanDerWaalsContact OG-NE 3.16Å
199	V	84.8	Confident	90.4	Very high	4 Å²	4	64.5 Å²	64.5	2%	0.024	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-55.8	-28.9	-176.3	64.5	0	0	0	0	112.6	C197 R201 L202 V207 F286	C197-V199 VanDerWaalsContact C-N 3.27Å; C197-V199 PolarHBondContact O-N 3.2Å; V199-R201 PolarHBondContact O-N 2.92Å; V199-R201 VanDerWaalsContact O-N 3.09Å; V199-L202 WeakPolarHBondContact O-CB 3.28Å; V199-L202 PolarHBondContact O-N 2.95Å; V199-V207 HydrophobicContact CG2-CG2 3.86Å; V199-F286 HydrophobicContact CG1-CE1 4.08Å; V199-F286 HydrophobicContact CG1-CZ 3.6Å
200	Q	84.1	Confident	90.4	Very high	63 Å²	63	63.9 Å²	63.9	29%	0.294	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-61.4	-17.4	175.1	-43.1	89.8	-27.8	0	0	113.6	S198 F286 E289	S198-Q200 VanDerWaalsContact C-OE1 3.27Å; S198-Q200 PolarHBondContact O-N 3.25Å; S198-Q200 VanDerWaalsContact O-N 3.13Å; S198-Q200 PolarHBondContact OG-OE1 3.17Å; Q200-F286 HydrophobicContact CG-CD1 3.61Å; Q200-F286 HydrophobicContact CG-CD2 4.43Å; Q200-F286 HydrophobicContact CG-CE1 3.64Å; Q200-F286 HydrophobicContact CG-CE2 4.47Å; Q200-F286 HydrophobicContact CG-CG 4.04Å; Q200-F286 HydrophobicContact CG-CZ 4.1Å; Q200-E289 PolarHBondContact NE2-OE2 3.32Å; Q200-E289 VanDerWaalsContact NE2-OE2 3.16Å
201	R	86.8	Confident	90.3	Very high	183 Å²	183	63 Å²	63	69%	0.691	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-89	-14.7	178.1	-59	177.2	-167.7	-159.6	-2.4	112.9	S198 V199 R203	S198-R201 WeakPolarHBondContact O-CB 3.37Å; S198-R201 PolarHBondContact O-N 3.49Å; S198-R201 WeakPolarHBondContact OG-CG 3.44Å; S198-R201 PolarHBondContact OG-NE 3.25Å; S198-R201 VanDerWaalsContact OG-NE 3.16Å; V199-R201 PolarHBondContact O-N 2.92Å; V199-R201 VanDerWaalsContact O-N 3.09Å; R201-R203 PolarHBondContact O-N 3.28Å; R201-R203 VanDerWaalsContact O-N 3.1Å
202	L	87	Confident	89.9	Confident	43 Å²	43	63 Å²	63	23%	0.225	30%	0.302	C	S	.	.			trans	-81.8	89.3	-176	-60.7	-179.6	0	0	0	110.1	V167 V199 N204 I205	V167-L202 HydrophobicContact CG1-CD1 4.29Å; V167-L202 HydrophobicContact CG2-CD1 3.98Å; V199-L202 WeakPolarHBondContact O-CB 3.28Å; V199-L202 PolarHBondContact O-N 2.95Å; L202-N204 PolarHBondContact O-N 2.73Å; L202-I205 HydrophobicContact CB-CB 4.2Å; L202-I205 HydrophobicContact CB-CD1 4.27Å; L202-I205 HydrophobicContact CB-CG1 4.04Å; L202-I205 HydrophobicContact CD1-CD1 3.7Å; L202-I205 HydrophobicContact CD1-CG1 4.39Å; L202-I205 PolarHBondContact O-N 3.08Å
203	R	87	Confident	89.7	Confident	224 Å²	224	71.2 Å²	71.2	85%	0.845	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-30	-176.9	-66.1	-175.3	178.6	-174.7	-1.6	114.4	L106 R201 I205	L106-R203 VanDerWaalsContact CD2-O 3.22Å; L106-R203 WeakPolarHBondContact CD2-O 3.24Å; R201-R203 PolarHBondContact O-N 3.28Å; R201-R203 VanDerWaalsContact O-N 3.1Å; R203-I205 VanDerWaalsContact C-N 3.31Å
204	N	91.3	Very high	89.4	Confident	63 Å²	63	70 Å²	70	34%	0.337	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	9.5	-179.9	-63.5	-1.1	0	0	0	113.3	L106 S170 V176 L202	L106-N204 WeakPolarHBondContact CD1-O 3.47Å; S170-N204 PolarHBondContact O-ND2 3.12Å; V176-N204 PolarHBondContact N-O 2.72Å; L202-N204 PolarHBondContact O-N 2.73Å
205	I	94.2	Very high	89.1	Confident	8 Å²	8	64.7 Å²	64.7	4%	0.041	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	126.3	174.4	-50	-167.8	0	0	0	110.1	I166 V167 V176 I178 L202 R203 V207	I166-I205 HydrophobicContact CG2-CD1 4.25Å; V167-I205 HydrophobicContact CG2-CD1 4.39Å; V176-I205 HydrophobicContact CB-CB 4.36Å; V176-I205 HydrophobicContact CB-CG1 4.04Å; V176-I205 HydrophobicContact CB-CG2 4.21Å; V176-I205 HydrophobicContact CG1-CG2 4.22Å; V176-I205 HydrophobicContact CG2-CG1 4.25Å; V176-I205 CarbonylContact O-C 3.48Å; V176-I205 WeakPolarHBondContact O-CA 3.37Å; I178-I205 HydrophobicContact CD1-CG2 3.96Å; I178-I205 HydrophobicContact CG1-CG2 4.27Å; L202-I205 HydrophobicContact CB-CB 4.2Å; L202-I205 HydrophobicContact CB-CD1 4.27Å; L202-I205 HydrophobicContact CB-CG1 4.04Å; L202-I205 HydrophobicContact CD1-CD1 3.7Å; L202-I205 HydrophobicContact CD1-CG1 4.39Å; L202-I205 PolarHBondContact O-N 3.08Å; R203-I205 VanDerWaalsContact C-N 3.31Å; I205-V207 HydrophobicContact CG2-CG2 3.85Å
206	R	92.3	Very high	88.8	Confident	89 Å²	89	64.3 Å²	64.3	34%	0.336	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	119.7	167.5	-46.9	-57	-83.9	129.7	-3.8	108.3	D105 L106 V176 Y177 I178	D105-R206 IonicContact OD1-NE 3.31Å; D105-R206 IonicContact OD2-CZ 3.36Å; D105-R206 IonicContact OD2-NE 3.51Å; D105-R206 PolarHBondContact OD2-NE 3.38Å; D105-R206 IonicContact OD2-NH2 3.37Å; D105-R206 PolarHBondContact OD2-NH2 3.22Å; L106-R206 HydrophobicContact CD1-CG 3.65Å; L106-R206 HydrophobicContact CD2-CG 4.47Å; L106-R206 HydrophobicContact CG-CG 3.77Å; V176-R206 PolarHBondContact O-N 3.27Å; Y177-R206 CarbonylContact C-O 3.53Å; Y177-R206 HydrophobicContact CD1-CB 4.03Å; Y177-R206 HydrophobicContact CD1-CG 3.95Å; Y177-R206 HydrophobicContact CE1-CG 4.09Å; I178-R206 PolarHBondContact N-O 3.21Å
207	V	94.2	Very high	88.9	Confident	12 Å²	12	61.4 Å²	61.4	7%	0.073	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	125.4	172	-167.8	0	0	0	0	108.1	I178 L180 F185 F188 V199 I205 P283 F286	I178-V207 HydrophobicContact CB-CG1 4.29Å; I178-V207 HydrophobicContact CB-CG2 4.31Å; I178-V207 HydrophobicContact CD1-CG2 4.22Å; I178-V207 HydrophobicContact CG2-CG1 4.49Å; I178-V207 WeakPolarHBondContact O-CA 3.46Å; L180-V207 HydrophobicContact CD1-CG1 3.98Å; L180-V207 HydrophobicContact CG-CG1 4.4Å; F185-V207 HydrophobicContact CE2-CG1 3.89Å; F188-V207 HydrophobicContact CD1-CG1 4.43Å; F188-V207 HydrophobicContact CE1-CG1 3.96Å; F188-V207 HydrophobicContact CE1-CG2 4.17Å; F188-V207 HydrophobicContact CZ-CG2 4.34Å; V199-V207 HydrophobicContact CG2-CG2 3.86Å; I205-V207 HydrophobicContact CG2-CG2 3.85Å; V207-P283 WeakPolarHBondContact O-CD 3.34Å; V207-F286 HydrophobicContact CB-CE2 4.44Å
208	R	93.5	Very high	88.8	Confident	35 Å²	35	67.5 Å²	67.5	13%	0.132	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	154.7	-178.6	-63.1	-179.5	72.4	101.5	-3.8	109.8	I178 L179 L180 S280 C281	I178-R208 PolarHBondContact O-N 2.89Å; L179-R208 WeakPolarHBondContact CA-O 3.45Å; L179-R208 HydrophobicContact CD2-CB 3.81Å; L180-R208 PolarHBondContact N-O 3.19Å; R208-S280 WeakPolarHBondContact CD-OG 3.42Å; R208-S280 PolarHBondContact NE-O 3.43Å; R208-S280 PolarHBondContact NE-OG 2.89Å; R208-S280 PolarHBondContact NH2-O 2.91Å; R208-C281 CarbonylContact C-O 3.59Å; R208-C281 WeakPolarHBondContact CA-O 3.35Å; R208-C281 VanDerWaalsContact CB-O 3.28Å; R208-C281 WeakPolarHBondContact CB-O 3.35Å
209	T	94.2	Very high	88.5	Confident	7 Å²	7	69.7 Å²	69.7	4%	0.043	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	135.8	179.8	39.8	0	0	0	0	111.4	L180 E182 F185 S280 C281 P283	L180-T209 CarbonylContact O-C 3.58Å; L180-T209 VanDerWaalsContact O-CA 3.27Å; L180-T209 WeakPolarHBondContact O-CA 3.38Å; E182-T209 HydrophobicContact CB-CG2 4.36Å; E182-T209 HydrophobicContact CG-CG2 4.46Å; F185-T209 HydrophobicContact CB-CG2 3.6Å; F185-T209 HydrophobicContact CD1-CG2 4.41Å; F185-T209 HydrophobicContact CD2-CG2 3.52Å; F185-T209 HydrophobicContact CE2-CG2 4.35Å; F185-T209 HydrophobicContact CG-CG2 3.56Å; T209-S280 CarbonylContact O-C 3.59Å; T209-S280 WeakPolarHBondContact O-CA 3.13Å; T209-C281 PolarHBondContact N-O 2.62Å; T209-C281 PolarHBondContact O-N 2.53Å; T209-C281 PolarHBondContact OG1-O 3.06Å; T209-P283 HydrophobicContact CG2-CB 4.01Å; T209-P283 HydrophobicContact CG2-CG 4.04Å
210	V	93.6	Very high	88.4	Confident	2 Å²	2	71 Å²	71	1%	0.012	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	139	176.1	179.6	0	0	0	0	109.1	L179 L180 E182 M227 L276	L179-V210 HydrophobicContact CB-CG2 4.1Å; L179-V210 HydrophobicContact CD1-CG2 4.26Å; L179-V210 HydrophobicContact CD2-CG2 4.27Å; L179-V210 HydrophobicContact CG-CG2 4.45Å; L180-V210 PolarHBondContact O-N 2.88Å; E182-V210 PolarHBondContact N-O 2.91Å; E182-V210 VanDerWaalsContact N-O 3.07Å; V210-M227 HydrophobicContact CB-CB 4.29Å; V210-M227 HydrophobicContact CB-CG 4.35Å; V210-M227 HydrophobicContact CB-SD 3.57Å; V210-M227 VanDerWaalsContact CB-SD 3.57Å; V210-M227 HydrophobicContact CG1-CB 4.14Å; V210-M227 HydrophobicContact CG1-CG 4.12Å; V210-M227 HydrophobicContact CG1-SD 3.81Å; V210-M227 HydrophobicContact CG2-SD 3.84Å; V210-L276 HydrophobicContact CG1-CD2 4.39Å
211	K	90.9	Very high	88.5	Confident	62 Å²	62	68.1 Å²	68.1	27%	0.27	32%	0.319	S	S	.	.			trans	-98.7	144.1	165.9	-66.1	171.6	-177.3	-74	0	108.9	E182 H224 R279	E182-K211 HydrophobicContact CB-CG 4.39Å; E182-K211 WeakPolarHBondContact OE1-CE 3.41Å; E182-K211 IonicContact OE1-NZ 2.71Å; E182-K211 PolarHBondContact OE1-NZ 3.28Å; E182-K211 IonicContact OE2-NZ 2.75Å; E182-K211 PolarHBondContact OE2-NZ 3.38Å; K211-H224 HydrophobicContact CB-CB 4.29Å; K211-H224 PolarHBondContact NZ-CD2 2.91Å; K211-H224 VanDerWaalsContact NZ-CD2 3.33Å; K211-H224 PolarHBondContact NZ-NE2 3.22Å; K211-R279 PolarHBondContact O-NE 3.46Å
212	G	87.8	Confident	88.6	Confident	12 Å²	12	64.2 Å²	64.2	12%	0.124	31%	0.307	C	S	.	.			trans	-64.8	-172.9	164	0	0	0	0	0	111.5	G225 R279	G212-G225 VanDerWaalsContact CA-O 3.28Å; G212-G225 WeakPolarHBondContact CA-O 3.44Å; G212-G225 PolarHBondContact N-O 3.14Å; G212-R279 PolarHBondContact O-NH2 3.45Å
213	Q	87.2	Confident	88.7	Confident	172 Å²	172	63.4 Å²	63.4	80%	0.804	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-61.4	143.6	-178.4	-63.2	177.4	5.1	0	0	111.9	H224 G225	Q213-H224 CarbonylContact O-C 3.58Å; Q213-H224 VanDerWaalsContact O-CA 3.3Å; Q213-H224 WeakPolarHBondContact O-CA 3.27Å; Q213-G225 PolarHBondContact O-N 2.85Å
214	D	86.6	Confident	88.9	Confident	88 Å²	88	54.3 Å²	54.3	47%	0.471	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	121.4	179.2	-53.6	-79	0	0	0	110.5	R279	D214-R279 IonicContact OD1-NH2 2.72Å; D214-R279 IonicContact OD2-CZ 3.18Å; D214-R279 IonicContact OD2-NH1 2.65Å; D214-R279 IonicContact OD2-NH2 3.98Å; D214-R279 PolarHBondContact OD2-NH2 3.42Å
215	Y	86.2	Confident	88.7	Confident	54 Å²	54	52.6 Å²	52.6	21%	0.212	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	141.7	171.9	-175.3	-84.4	0	0	0	110.7	R29 I32 I36 K222 F223	R29-Y215 PolarHBondContact O-OH 3.44Å; I32-Y215 HydrophobicContact CD1-CE2 4.25Å; I32-Y215 HydrophobicContact CG2-CD1 4.32Å; I32-Y215 HydrophobicContact CG2-CE1 3.54Å; I32-Y215 HydrophobicContact CG2-CE2 4.23Å; I32-Y215 VanDerWaalsContact CG2-CZ 3.49Å; I32-Y215 WeakPolarHBondContact CG2-OH 3.3Å; I36-Y215 HydrophobicContact CD1-CD1 4.33Å; I36-Y215 HydrophobicContact CD1-CE1 4.01Å; Y215-K222 WeakPolarHBondContact O-CA 3.38Å; Y215-F223 AromaticContact CD1-CD1 3.91Å; Y215-F223 HydrophobicContact CD1-CD1 3.91Å; Y215-F223 AromaticContact CD1-CE1 3.27Å; Y215-F223 HydrophobicContact CD1-CE1 3.27Å; Y215-F223 AromaticContact CD1-CZ 3.88Å; Y215-F223 HydrophobicContact CD1-CZ 3.88Å; Y215-F223 HydrophobicContact CD2-CE1 4.44Å; Y215-F223 HydrophobicContact CD2-CZ 4.25Å; Y215-F223 HydrophobicContact CE1-CE1 4.07Å; Y215-F223 HydrophobicContact CG-CD1 4.27Å; Y215-F223 AromaticContact CG-CE1 3.52Å; Y215-F223 HydrophobicContact CG-CE1 3.52Å; Y215-F223 HydrophobicContact CG-CE2 4.44Å; Y215-F223 AromaticContact CG-CZ 3.62Å; Y215-F223 HydrophobicContact CG-CZ 3.62Å; Y215-F223 PolarHBondContact N-O 3.35Å; Y215-F223 PolarHBondContact O-N 3.07Å
216	L	86.3	Confident	88.5	Confident	98 Å²	98	56.6 Å²	56.6	51%	0.513	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	121.2	-179.7	-53.4	178.6	0	0	0	109.8	K222	L216-K222 HydrophobicContact CD2-CB 4.27Å; L216-K222 HydrophobicContact CD2-CD 3.45Å; L216-K222 VanDerWaalsContact CD2-CD 3.45Å; L216-K222 HydrophobicContact CD2-CG 3.62Å
217	S	86.8	Confident	88.5	Confident	11 Å²	11	52.8 Å²	52.8	8%	0.077	27%	0.269	C	S	.	.			trans	-78.1	167	173.2	74.1	0	0	0	0	112.6	D33 T219 G220 A221	D33-S217 WeakPolarHBondContact OD1-CA 3.35Å; D33-S217 WeakPolarHBondContact OD1-CB 3.45Å; S217-T219 PolarHBondContact O-N 2.95Å; S217-T219 PolarHBondContact OG-N 3.47Å; S217-T219 PolarHBondContact OG-OG1 3.46Å; S217-G220 PolarHBondContact O-N 2.89Å; S217-G220 PolarHBondContact OG-N 2.87Å; S217-A221 PolarHBondContact N-O 3.45Å; S217-A221 WeakPolarHBondContact OG-CB 3.11Å; S217-A221 PolarHBondContact OG-N 2.96Å; S217-A221 PolarHBondContact OG-O 2.92Å
218	K	83.8	Confident	88.3	Confident	155 Å²	155	58.8 Å²	58.8	67%	0.674	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-42	167	-77.5	-86.7	-175.5	165.3	0	112.5	D33 G220	D33-K218 PolarHBondContact OD1-N 3.11Å; D33-K218 WeakPolarHBondContact OD2-CG 3.48Å; K218-G220 PolarHBondContact O-N 3.48Å
219	T	80.8	Confident	88.2	Confident	79 Å²	79	59.5 Å²	59.5	49%	0.485	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	2.1	175.5	30.4	0	0	0	0	114.6	E37 S217 A221	E37-T219 VanDerWaalsContact CD-CG2 3.42Å; E37-T219 HydrophobicContact CG-CG2 3.94Å; E37-T219 WeakPolarHBondContact OE1-CB 3.48Å; E37-T219 WeakPolarHBondContact OE1-CG2 3.34Å; E37-T219 PolarHBondContact OE1-OG1 2.9Å; S217-T219 PolarHBondContact O-N 2.95Å; S217-T219 PolarHBondContact OG-N 3.47Å; S217-T219 PolarHBondContact OG-OG1 3.46Å; T219-A221 PolarHBondContact O-N 3.15Å
220	G	82.4	Confident	88.3	Confident	30 Å²	30	60.9 Å²	60.9	31%	0.309	31%	0.307	S	S	.	.			trans	72.6	4.6	179.8	0	0	0	0	0	114.6	V71 S217 K218 K222	V71-G220 VanDerWaalsContact CG2-O 3.28Å; V71-G220 WeakPolarHBondContact CG2-O 3.33Å; S217-G220 PolarHBondContact O-N 2.89Å; S217-G220 PolarHBondContact OG-N 2.87Å; K218-G220 PolarHBondContact O-N 3.48Å; G220-K222 VanDerWaalsContact O-CG 3.32Å; G220-K222 WeakPolarHBondContact O-CG 3.42Å
221	A	86.5	Confident	88.5	Confident	4 Å²	4	60.9 Å²	60.9	3%	0.033	31%	0.307	C	S	.	.			trans	-68.3	147	172.5	0	0	0	0	0	110.1	I36 V68 K70 S217 T219	I36-A221 HydrophobicContact CG2-CB 3.89Å; V68-A221 HydrophobicContact CG1-CB 4.19Å; K70-A221 HydrophobicContact CG-CB 4.37Å; S217-A221 PolarHBondContact N-O 3.45Å; S217-A221 WeakPolarHBondContact OG-CB 3.11Å; S217-A221 PolarHBondContact OG-N 2.96Å; S217-A221 PolarHBondContact OG-O 2.92Å; T219-A221 PolarHBondContact O-N 3.15Å
222	K	89.1	Confident	88.8	Confident	100 Å²	100	58 Å²	58	44%	0.435	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	139.7	-168	-47.5	-164.7	177.4	-157.5	0	111.6	Q69 Y215 L216 G220	Q69-K222 PolarHBondContact N-O 3.41Å; Q69-K222 PolarHBondContact O-N 3.16Å; Y215-K222 WeakPolarHBondContact O-CA 3.38Å; L216-K222 HydrophobicContact CD2-CB 4.27Å; L216-K222 HydrophobicContact CD2-CD 3.45Å; L216-K222 VanDerWaalsContact CD2-CD 3.45Å; L216-K222 HydrophobicContact CD2-CG 3.62Å; G220-K222 VanDerWaalsContact O-CG 3.32Å; G220-K222 WeakPolarHBondContact O-CG 3.42Å
223	F	89	Confident	89.2	Confident	26 Å²	26	57.5 Å²	57.5	11%	0.114	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	165.5	162.8	71.1	-93.2	0	0	0	108.6	I32 I36 I64 V68 Y215	I32-F223 HydrophobicContact CG2-CE1 4.3Å; I36-F223 HydrophobicContact CD1-CD1 4.28Å; I36-F223 HydrophobicContact CD1-CE1 4.09Å; I64-F223 HydrophobicContact CD1-CZ 4.17Å; I64-F223 HydrophobicContact CG1-CE1 4.17Å; I64-F223 HydrophobicContact CG1-CE2 4.03Å; I64-F223 HydrophobicContact CG1-CZ 3.82Å; I64-F223 HydrophobicContact CG2-CD1 4.21Å; I64-F223 HydrophobicContact CG2-CE1 4Å; V68-F223 HydrophobicContact CG2-CB 4.22Å; V68-F223 HydrophobicContact CG2-CD1 3.88Å; V68-F223 HydrophobicContact CG2-CG 4.4Å; Y215-F223 AromaticContact CD1-CD1 3.91Å; Y215-F223 HydrophobicContact CD1-CD1 3.91Å; Y215-F223 AromaticContact CD1-CE1 3.27Å; Y215-F223 HydrophobicContact CD1-CE1 3.27Å; Y215-F223 AromaticContact CD1-CZ 3.88Å; Y215-F223 HydrophobicContact CD1-CZ 3.88Å; Y215-F223 HydrophobicContact CD2-CE1 4.44Å; Y215-F223 HydrophobicContact CD2-CZ 4.25Å; Y215-F223 HydrophobicContact CE1-CE1 4.07Å; Y215-F223 HydrophobicContact CG-CD1 4.27Å; Y215-F223 AromaticContact CG-CE1 3.52Å; Y215-F223 HydrophobicContact CG-CE1 3.52Å; Y215-F223 HydrophobicContact CG-CE2 4.44Å; Y215-F223 AromaticContact CG-CZ 3.62Å; Y215-F223 HydrophobicContact CG-CZ 3.62Å; Y215-F223 PolarHBondContact N-O 3.35Å; Y215-F223 PolarHBondContact O-N 3.07Å
224	H	89.6	Confident	89.6	Confident	33 Å²	33	49.5 Å²	49.5	15%	0.153	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	150	177	50.1	64.3	0	0	0	111.3	Y63 E182 K211 Q213	Y63-H224 WeakPolarHBondContact CE1-O 3.4Å; Y63-H224 PolarHBondContact OH-O 3.24Å; Y63-H224 VanDerWaalsContact OH-O 3.08Å; E182-H224 IonicContact OE2-CE1 3.14Å; E182-H224 PolarHBondContact OE2-CE1 3.04Å; E182-H224 IonicContact OE2-NE2 2.7Å; E182-H224 PolarHBondContact OE2-NE2 2.85Å; K211-H224 HydrophobicContact CB-CB 4.29Å; K211-H224 PolarHBondContact NZ-CD2 2.91Å; K211-H224 VanDerWaalsContact NZ-CD2 3.33Å; K211-H224 PolarHBondContact NZ-NE2 3.22Å; Q213-H224 CarbonylContact O-C 3.58Å; Q213-H224 VanDerWaalsContact O-CA 3.3Å; Q213-H224 WeakPolarHBondContact O-CA 3.27Å
225	G	88.8	Confident	89.9	Confident	27 Å²	27	46.2 Å²	46.2	28%	0.278	23%	0.234	S	C	.	.			trans	-67.1	177.2	168.8	0	0	0	0	0	113	G212 Q213	G212-G225 VanDerWaalsContact CA-O 3.28Å; G212-G225 WeakPolarHBondContact CA-O 3.44Å; G212-G225 PolarHBondContact N-O 3.14Å; Q213-G225 PolarHBondContact O-N 2.85Å
226	K	89.7	Confident	90.1	Very high	92 Å²	92	44.1 Å²	44.1	40%	0.4	23%	0.227	S	C	.	.			trans	-91.8	161.8	172.3	-59.9	170.4	-167.8	157.5	0	111	Y63 D181 E228	Y63-K226 VanDerWaalsContact CE2-CE 3.49Å; Y63-K226 HydrophobicContact CE2-CG 4.33Å; D181-K226 VanDerWaalsContact OD1-CA 3.3Å; D181-K226 WeakPolarHBondContact OD1-CA 3.48Å; K226-E228 HydrophobicContact CB-CG 4.31Å
227	M	92.4	Very high	90.3	Very high	9 Å²	9	44.3 Å²	44.3	4%	0.044	23%	0.225	C	C	.	.			trans	-92.8	95.6	165.1	-175.2	-165	71.1	0	0	109.9	V153 M154 D181 V210 Q229	V153-M227 HydrophobicContact CG1-CE 3.49Å; V153-M227 VanDerWaalsContact CG1-CE 3.49Å; V153-M227 HydrophobicContact CG1-SD 3.47Å; V153-M227 WeakPolarHBondContact CG1-SD 3.47Å; M154-M227 VanDerWaalsContact O-CE 3.26Å; M154-M227 WeakPolarHBondContact O-CE 3.4Å; D181-M227 HydrophobicContact CB-CB 4.3Å; D181-M227 PolarHBondContact OD1-N 3.45Å; V210-M227 HydrophobicContact CB-CB 4.29Å; V210-M227 HydrophobicContact CB-CG 4.35Å; V210-M227 HydrophobicContact CB-SD 3.57Å; V210-M227 VanDerWaalsContact CB-SD 3.57Å; V210-M227 HydrophobicContact CG1-CB 4.14Å; V210-M227 HydrophobicContact CG1-CG 4.12Å; V210-M227 HydrophobicContact CG1-SD 3.81Å; V210-M227 HydrophobicContact CG2-SD 3.84Å; M227-Q229 VanDerWaalsContact C-N 3.33Å; M227-Q229 HydrophobicContact CG-CB 4.33Å
228	E	89.2	Confident	90.7	Very high	139 Å²	139	46.1 Å²	46.1	65%	0.65	23%	0.232	S	C	*	.			trans	-86.4	-3.7	178.5	-54.1	-155.9	150.7	0	0	114	K226	K226-E228 HydrophobicContact CB-CG 4.31Å
229	Q	91.9	Very high	91.3	Very high	50 Å²	50	38.7 Å²	38.7	23%	0.234	20%	0.2	C	C	.	.			trans	-68.5	135.8	176.4	178.6	61.6	-65.9	0	0	110.9	V153 M227 F231 L276	V153-Q229 HydrophobicContact CG1-CB 4.43Å; V153-Q229 HydrophobicContact CG1-CG 4.2Å; V153-Q229 WeakPolarHBondContact CG1-O 3.28Å; M227-Q229 VanDerWaalsContact C-N 3.33Å; M227-Q229 HydrophobicContact CG-CB 4.33Å; Q229-F231 HydrophobicContact CG-CD1 3.81Å; Q229-F231 HydrophobicContact CG-CE1 3.74Å; Q229-L276 HydrophobicContact CG-CD1 4.09Å
230	K	95.8	Very high	92.1	Very high	35 Å²	35	35.3 Å²	35.3	15%	0.152	18%	0.178	C	C	.	.			trans	-150.2	112.2	-177.5	40.3	-178.7	159.4	-161.5	0	112.9	V153 M154 D155 Y241 G242 S243 S245	V153-K230 CarbonylContact O-C 3.56Å; V153-K230 VanDerWaalsContact O-CA 3.27Å; V153-K230 WeakPolarHBondContact O-CA 3.37Å; M154-K230 HydrophobicContact CE-CB 4.03Å; M154-K230 HydrophobicContact SD-CB 4.09Å; D155-K230 WeakPolarHBondContact OD2-CE 3.47Å; D155-K230 IonicContact OD2-NZ 2.72Å; D155-K230 PolarHBondContact OD2-NZ 3.12Å; K230-Y241 WeakPolarHBondContact O-CD2 3.45Å; K230-G242 WeakPolarHBondContact CD-O 3.32Å; K230-G242 WeakPolarHBondContact CG-O 3.49Å; K230-S243 PolarHBondContact NZ-O 3.14Å; K230-S243 VanDerWaalsContact NZ-O 3.14Å; K230-S245 PolarHBondContact NZ-OG 2.87Å
231	F	97.3	Very high	92.8	Very high	2 Å²	2	38 Å²	38	1%	0.009	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	154.5	175.9	63.3	-93.8	0	0	0	112.8	V153 Q229 L233 V239 M240 Y241 F269 E272 F273 L276	V153-F231 HydrophobicContact CB-CD1 4.12Å; V153-F231 HydrophobicContact CB-CE1 4.08Å; V153-F231 HydrophobicContact CB-CG 4.49Å; V153-F231 HydrophobicContact CB-CZ 4.42Å; V153-F231 HydrophobicContact CG2-CD1 4.1Å; V153-F231 HydrophobicContact CG2-CD2 4.32Å; V153-F231 HydrophobicContact CG2-CE1 3.64Å; V153-F231 HydrophobicContact CG2-CE2 3.88Å; V153-F231 HydrophobicContact CG2-CG 4.42Å; V153-F231 HydrophobicContact CG2-CZ 3.52Å; V153-F231 PolarHBondContact N-O 3.13Å; V153-F231 PolarHBondContact O-N 2.86Å; Q229-F231 HydrophobicContact CG-CD1 3.81Å; Q229-F231 HydrophobicContact CG-CE1 3.74Å; F231-L233 HydrophobicContact CD2-CB 4.27Å; F231-L233 HydrophobicContact CE2-CB 4.3Å; F231-V239 HydrophobicContact CB-CG1 4.2Å; F231-M240 CarbonylContact C-O 3.5Å; F231-M240 WeakPolarHBondContact CA-O 3.42Å; F231-M240 WeakPolarHBondContact CB-O 3.28Å; F231-Y241 HydrophobicContact CB-CD2 4.33Å; F231-F269 HydrophobicContact CB-CD1 4.26Å; F231-F269 HydrophobicContact CB-CE1 4.24Å; F231-F269 AromaticContact CD1-CD1 3.83Å; F231-F269 HydrophobicContact CD1-CD1 3.83Å; F231-F269 HydrophobicContact CD1-CE1 4.07Å; F231-F269 AromaticContact CD2-CD1 3.9Å; F231-F269 HydrophobicContact CD2-CD1 3.9Å; F231-F269 HydrophobicContact CE1-CD1 4.03Å; F231-F269 HydrophobicContact CE2-CB 4.3Å; F231-F269 HydrophobicContact CE2-CD1 4.11Å; F231-F269 AromaticContact CG-CD1 3.75Å; F231-F269 HydrophobicContact CG-CD1 3.75Å; F231-F269 HydrophobicContact CG-CE1 4.12Å; F231-F269 HydrophobicContact CZ-CD1 4.16Å; F231-E272 HydrophobicContact CE1-CG 4.03Å; F231-E272 HydrophobicContact CZ-CG 4.21Å; F231-F273 HydrophobicContact CE2-CB 4.17Å; F231-F273 HydrophobicContact CE2-CD2 4.2Å; F231-F273 HydrophobicContact CZ-CB 4.07Å; F231-F273 HydrophobicContact CZ-CD2 4.3Å; F231-L276 HydrophobicContact CE1-CD1 4.39Å
232	L	97.7	Very high	93.2	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	106.6	174.7	170.5	65.4	0	0	0	109	I139 M142 I143 I150 L152 V234 V239 M240	I139-L232 HydrophobicContact CG2-CD2 4.29Å; M142-L232 HydrophobicContact CB-CD2 4.25Å; M142-L232 HydrophobicContact CE-CD2 4.13Å; M142-L232 HydrophobicContact CE-CG 4.24Å; I143-L232 HydrophobicContact CD1-CD2 4.32Å; I143-L232 HydrophobicContact CG1-CD2 4.07Å; I150-L232 HydrophobicContact CG2-CD1 3.71Å; L152-L232 HydrophobicContact CB-CD1 4.44Å; L152-L232 HydrophobicContact CD1-CB 4.26Å; L152-L232 HydrophobicContact CD1-CD1 4.37Å; L232-V234 HydrophobicContact CD1-CG2 4.09Å; L232-V234 HydrophobicContact CD2-CG2 4.45Å; L232-V234 HydrophobicContact CG-CG2 4.01Å; L232-V239 CarbonylContact O-C 3.57Å; L232-V239 VanDerWaalsContact O-CA 3.31Å; L232-V239 WeakPolarHBondContact O-CA 3.28Å; L232-M240 HydrophobicContact CB-CB 4.4Å; L232-M240 PolarHBondContact N-O 3.4Å; L232-M240 PolarHBondContact O-N 3Å
233	L	96.6	Very high	93.5	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.01	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	126	174.3	173	68.2	0	0	0	109.4	W108 A151 F231 V239 V266 D270 F273	W108-L233 HydrophobicContact CH2-CD2 4.37Å; W108-L233 HydrophobicContact CZ2-CD2 3.94Å; A151-L233 HydrophobicContact CB-CB 4.09Å; A151-L233 HydrophobicContact CB-CD2 4.19Å; A151-L233 HydrophobicContact CB-CG 4.4Å; A151-L233 PolarHBondContact N-O 3.28Å; A151-L233 PolarHBondContact O-N 3.22Å; F231-L233 HydrophobicContact CD2-CB 4.27Å; F231-L233 HydrophobicContact CE2-CB 4.3Å; L233-V239 HydrophobicContact CB-CG2 4.25Å; L233-V239 HydrophobicContact CD1-CG2 3.47Å; L233-V239 VanDerWaalsContact CD1-CG2 3.47Å; L233-V239 HydrophobicContact CG-CG2 4.48Å; L233-V266 HydrophobicContact CD1-CG1 3.64Å; L233-D270 HydrophobicContact CD2-CB 4.11Å; L233-F273 HydrophobicContact CD2-CB 4.48Å
234	V	95.4	Very high	93.9	Very high	4 Å²	4	35.4 Å²	35.4	2%	0.024	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	126.9	-179.5	178.4	0	0	0	0	110.9	M142 A146 L232 C236 Q237 K238	M142-V234 HydrophobicContact CB-CG2 4.3Å; M142-V234 HydrophobicContact CE-CG2 4.06Å; A146-V234 HydrophobicContact CB-CG1 3.54Å; L232-V234 HydrophobicContact CD1-CG2 4.09Å; L232-V234 HydrophobicContact CD2-CG2 4.45Å; L232-V234 HydrophobicContact CG-CG2 4.01Å; V234-C236 PolarHBondContact O-N 2.93Å; V234-Q237 VanDerWaalsContact O-CG 3.29Å; V234-Q237 WeakPolarHBondContact O-CG 3.27Å; V234-Q237 PolarHBondContact O-N 2.89Å; V234-K238 PolarHBondContact N-O 3.38Å; V234-K238 PolarHBondContact O-N 2.93Å
235	D	93	Very high	94.2	Very high	20 Å²	20	33.9 Å²	33.9	11%	0.107	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.6	21.8	176.6	-68.4	-27.5	0	0	0	115	R147 K148 V149 Q237	R147-D235 PolarHBondContact N-OD1 3.05Å; R147-D235 PolarHBondContact N-OD2 3.47Å; K148-D235 WeakPolarHBondContact CA-OD1 3.5Å; K148-D235 WeakPolarHBondContact CB-OD1 3.43Å; K148-D235 PolarHBondContact N-OD1 2.97Å; V149-D235 PolarHBondContact N-OD1 2.94Å; V149-D235 PolarHBondContact O-N 3.09Å; D235-Q237 HydrophobicContact CB-CG 3.87Å; D235-Q237 PolarHBondContact O-N 2.74Å
236	C	90.2	Very high	94.5	Very high	9 Å²	9	32.9 Å²	32.9	6%	0.061	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	31.6	-171.9	-54.1	0	0	0	0	114.4	W108 P109 V111 V234 D270	W108-C236 PolarHBondContact NE1-SG 3.09Å; W108-C236 VanDerWaalsContact NE1-SG 3.37Å; P109-C236 HydrophobicContact CB-CB 4.38Å; P109-C236 HydrophobicContact CG-CB 4.34Å; V111-C236 HydrophobicContact CG2-CB 3.44Å; V111-C236 VanDerWaalsContact CG2-CB 3.44Å; V234-C236 PolarHBondContact O-N 2.93Å; C236-D270 PolarHBondContact SG-OD1 2.82Å
237	Q	91	Very high	94.8	Very high	102 Å²	102	30.6 Å²	30.6	48%	0.477	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-127.5	-20.2	-179	57.4	171.6	-15.1	0	0	114.4	V234 D235	V234-Q237 VanDerWaalsContact O-CG 3.29Å; V234-Q237 WeakPolarHBondContact O-CG 3.27Å; V234-Q237 PolarHBondContact O-N 2.89Å; D235-Q237 HydrophobicContact CB-CG 3.87Å; D235-Q237 PolarHBondContact O-N 2.74Å
238	K	94	Very high	94.9	Very high	49 Å²	49	39 Å²	39	21%	0.213	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	130.1	-172.8	-172.8	-172.3	-61.5	-176.8	0	109.8	M142 E145 V234 I260 I261 T262	M142-K238 HydrophobicContact CE-CD 3.8Å; M142-K238 HydrophobicContact CE-CG 3.88Å; M142-K238 HydrophobicContact CG-CD 3.79Å; M142-K238 HydrophobicContact SD-CD 3.77Å; M142-K238 HydrophobicContact SD-CG 4.33Å; E145-K238 IonicContact OE2-NZ 3.9Å; E145-K238 PolarHBondContact OE2-NZ 2.82Å; V234-K238 PolarHBondContact N-O 3.38Å; V234-K238 PolarHBondContact O-N 2.93Å; K238-I260 HydrophobicContact CD-CG2 4.31Å; K238-I260 HydrophobicContact CG-CG2 4.15Å; K238-I261 WeakPolarHBondContact CA-O 3.39Å; K238-T262 HydrophobicContact CB-CG2 4.13Å; K238-T262 HydrophobicContact CG-CG2 3.93Å
239	V	97	Very high	95.2	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	142.4	174.3	170	0	0	0	0	109.4	F231 L232 L233 I260 I261 V266 F269	F231-V239 HydrophobicContact CB-CG1 4.2Å; L232-V239 CarbonylContact O-C 3.57Å; L232-V239 VanDerWaalsContact O-CA 3.31Å; L232-V239 WeakPolarHBondContact O-CA 3.28Å; L233-V239 HydrophobicContact CB-CG2 4.25Å; L233-V239 HydrophobicContact CD1-CG2 3.47Å; L233-V239 VanDerWaalsContact CD1-CG2 3.47Å; L233-V239 HydrophobicContact CG-CG2 4.48Å; V239-I260 WeakPolarHBondContact O-CA 3.22Å; V239-I261 HydrophobicContact CB-CB 4.22Å; V239-I261 PolarHBondContact N-O 2.71Å; V239-I261 PolarHBondContact O-N 3.14Å; V239-V266 HydrophobicContact CG2-CB 4.45Å; V239-V266 HydrophobicContact CG2-CG1 4.1Å; V239-V266 HydrophobicContact CG2-CG2 4.13Å; V239-F269 HydrophobicContact CB-CD2 4.47Å; V239-F269 HydrophobicContact CG1-CD1 4.02Å; V239-F269 HydrophobicContact CG1-CD2 4.06Å; V239-F269 HydrophobicContact CG1-CE1 4.2Å; V239-F269 HydrophobicContact CG1-CE2 4.25Å; V239-F269 HydrophobicContact CG1-CG 3.95Å; V239-F269 HydrophobicContact CG1-CZ 4.31Å; V239-F269 HydrophobicContact CG2-CB 3.76Å; V239-F269 HydrophobicContact CG2-CD2 4.22Å; V239-F269 HydrophobicContact CG2-CG 4.02Å
240	M	97.1	Very high	95.3	Very high	7 Å²	7	32 Å²	32	3%	0.034	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	122.5	157.6	176.5	-171.8	-75.1	0	0	108.3	I135 T138 I139 M142 F231 L232 V258 Q259 I260	I135-M240 HydrophobicContact CG2-SD 4.29Å; T138-M240 HydrophobicContact CG2-CE 3.65Å; I139-M240 HydrophobicContact CD1-SD 4.08Å; I139-M240 HydrophobicContact CG1-CE 3.74Å; I139-M240 HydrophobicContact CG1-SD 3.35Å; I139-M240 WeakPolarHBondContact CG1-SD 3.3Å; M142-M240 HydrophobicContact CE-CB 3.91Å; M142-M240 HydrophobicContact SD-CB 4.01Å; M142-M240 HydrophobicContact SD-CE 4.02Å; F231-M240 CarbonylContact C-O 3.5Å; F231-M240 WeakPolarHBondContact CA-O 3.42Å; F231-M240 WeakPolarHBondContact CB-O 3.28Å; L232-M240 HydrophobicContact CB-CB 4.4Å; L232-M240 PolarHBondContact N-O 3.4Å; L232-M240 PolarHBondContact O-N 3Å; M240-V258 HydrophobicContact CE-CG2 4.18Å; M240-V258 HydrophobicContact CG-CB 3.83Å; M240-V258 HydrophobicContact CG-CG1 4.18Å; M240-V258 HydrophobicContact CG-CG2 3.9Å; M240-V258 HydrophobicContact SD-CB 4.34Å; M240-V258 HydrophobicContact SD-CG1 4.32Å; M240-V258 HydrophobicContact SD-CG2 4Å; M240-Q259 VanDerWaalsContact CA-O 3.31Å; M240-Q259 WeakPolarHBondContact CA-O 3.25Å; M240-I260 HydrophobicContact CB-CD1 4Å; M240-I260 HydrophobicContact CE-CD1 3.42Å; M240-I260 VanDerWaalsContact CE-CD1 3.42Å; M240-I260 HydrophobicContact CG-CD1 3.91Å
241	Y	97.4	Very high	95.1	Very high	88 Å²	88	31.9 Å²	31.9	35%	0.345	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	142.9	-179.6	163	-112	0	0	0	110.3	K230 F231 V258 Q259 F269	K230-Y241 WeakPolarHBondContact O-CD2 3.45Å; F231-Y241 HydrophobicContact CB-CD2 4.33Å; Y241-V258 CarbonylContact O-C 3.57Å; Y241-V258 VanDerWaalsContact O-CA 3.28Å; Y241-V258 WeakPolarHBondContact O-CA 3.48Å; Y241-V258 WeakPolarHBondContact O-CB 3.41Å; Y241-Q259 PolarHBondContact N-O 2.99Å; Y241-Q259 PolarHBondContact O-N 2.77Å; Y241-F269 HydrophobicContact CD1-CZ 4.04Å; Y241-F269 HydrophobicContact CD2-CE1 4.03Å; Y241-F269 HydrophobicContact CD2-CZ 4.31Å; Y241-F269 AromaticContact CG-CE1 3.92Å; Y241-F269 HydrophobicContact CG-CE1 3.92Å; Y241-F269 AromaticContact CG-CZ 3.79Å; Y241-F269 HydrophobicContact CG-CZ 3.79Å
242	G	95.4	Very high	94.9	Very high	17 Å²	17	37.8 Å²	37.8	18%	0.175	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	155	-159.8	173.4	0	0	0	0	0	114.6	K230 Y244 M257	K230-G242 WeakPolarHBondContact CD-O 3.32Å; K230-G242 WeakPolarHBondContact CG-O 3.49Å; G242-Y244 PolarHBondContact O-N 2.7Å; G242-M257 CarbonylContact C-O 3.51Å; G242-M257 WeakPolarHBondContact CA-O 3.31Å
243	S	95.5	Very high	94.7	Very high	51 Å²	51	41 Å²	41	36%	0.357	20%	0.204	S	C	.	.	S	Bend	trans	-82.8	-11	-169.1	61	0	0	0	0	115.7	K230 S245 F250 S256 M257	K230-S243 PolarHBondContact NZ-O 3.14Å; K230-S243 VanDerWaalsContact NZ-O 3.14Å; S243-S245 PolarHBondContact O-N 3.14Å; S243-F250 WeakPolarHBondContact O-CE1 3.48Å; S243-S256 WeakPolarHBondContact OG-CA 3.19Å; S243-S256 WeakPolarHBondContact OG-CB 3.45Å; S243-M257 PolarHBondContact N-O 2.72Å; S243-M257 PolarHBondContact OG-N 3.01Å; S243-M257 VanDerWaalsContact OG-N 3.11Å; S243-M257 PolarHBondContact OG-O 3.43Å
244	Y	96.2	Very high	94.6	Very high	6 Å²	6	45 Å²	45	2%	0.024	22%	0.222	C	C	.	.			trans	-72.9	113	-174.7	-176.1	-79.1	0	0	0	112.5	I135 I139 G242 Y246 F250	I135-Y244 HydrophobicContact CB-CD2 4.03Å; I135-Y244 HydrophobicContact CB-CE2 4.28Å; I135-Y244 HydrophobicContact CB-CG 4.48Å; I135-Y244 HydrophobicContact CD1-CD2 4.2Å; I135-Y244 HydrophobicContact CG2-CD1 4.03Å; I135-Y244 HydrophobicContact CG2-CD2 3.69Å; I135-Y244 HydrophobicContact CG2-CE1 4.49Å; I135-Y244 HydrophobicContact CG2-CE2 4.16Å; I135-Y244 HydrophobicContact CG2-CG 3.64Å; I139-Y244 HydrophobicContact CD1-CD1 3.7Å; I139-Y244 HydrophobicContact CD1-CE1 3.54Å; G242-Y244 PolarHBondContact O-N 2.7Å; Y244-Y246 AromaticContact CD1-CD1 3.85Å; Y244-Y246 HydrophobicContact CD1-CD1 3.85Å; Y244-Y246 HydrophobicContact CD1-CE1 4.09Å; Y244-Y246 AromaticContact CE1-CD1 3.82Å; Y244-Y246 HydrophobicContact CE1-CD1 3.82Å; Y244-Y246 HydrophobicContact CE1-CE1 4.26Å; Y244-F250 HydrophobicContact CD2-CB 3.97Å; Y244-F250 HydrophobicContact CD2-CD1 4.4Å; Y244-F250 HydrophobicContact CE2-CB 3.85Å; Y244-F250 HydrophobicContact CG-CB 4.46Å
245	S	95.8	Very high	94.6	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.014	26%	0.257	C	S	.	.			trans	-90.6	150.5	171.9	-52	0	0	0	0	111.8	D155 K230 S243 M247 F250	D155-S245 WeakPolarHBondContact OD1-CB 3.27Å; D155-S245 PolarHBondContact OD1-OG 3.14Å; D155-S245 PolarHBondContact OD2-OG 3.15Å; K230-S245 PolarHBondContact NZ-OG 2.87Å; S243-S245 PolarHBondContact O-N 3.14Å; S245-M247 VanDerWaalsContact C-N 3.26Å; S245-M247 PolarHBondContact O-N 3.21Å; S245-F250 WeakPolarHBondContact O-CB 3.47Å
246	Y	96	Very high	94.6	Very high	5 Å²	5	51.2 Å²	51.2	2%	0.02	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-83.2	63.6	-171.1	-72.1	9.7	0	0	0	112.4	I139 L152 M154 I156 F157 T158 D159 I162 Y244	I139-Y246 HydrophobicContact CD1-CD1 4.12Å; I139-Y246 HydrophobicContact CD1-CE1 3.42Å; I139-Y246 VanDerWaalsContact CD1-CE1 3.42Å; I139-Y246 HydrophobicContact CG1-CE1 4.14Å; I139-Y246 HydrophobicContact CG2-CE1 4.39Å; I139-Y246 HydrophobicContact CG2-CE2 4.23Å; I139-Y246 WeakPolarHBondContact CG2-OH 3.15Å; L152-Y246 HydrophobicContact CD1-CD2 4.41Å; L152-Y246 HydrophobicContact CD1-CE2 3.61Å; L152-Y246 HydrophobicContact CD2-CD2 4.15Å; L152-Y246 HydrophobicContact CD2-CE2 3.77Å; L152-Y246 HydrophobicContact CG-CE2 4.37Å; M154-Y246 HydrophobicContact CE-CD1 3.42Å; M154-Y246 VanDerWaalsContact CE-CD1 3.42Å; M154-Y246 HydrophobicContact CE-CD2 4.08Å; M154-Y246 HydrophobicContact CE-CE1 3.37Å; M154-Y246 HydrophobicContact CE-CE2 4.06Å; M154-Y246 HydrophobicContact CE-CG 3.79Å; M154-Y246 HydrophobicContact CG-CG 4.26Å; M154-Y246 HydrophobicContact SD-CD1 3.9Å; M154-Y246 HydrophobicContact SD-CE1 4.44Å; M154-Y246 HydrophobicContact SD-CG 4.02Å; I156-Y246 CarbonylContact O-C 3.56Å; I156-Y246 PolarHBondContact O-N 2.9Å; I156-Y246 VanDerWaalsContact O-N 3.12Å; F157-Y246 AromaticContact CD2-CD2 3.96Å; F157-Y246 HydrophobicContact CD2-CD2 3.96Å; F157-Y246 HydrophobicContact CD2-CG 4.3Å; F157-Y246 HydrophobicContact CE1-CD2 4.44Å; F157-Y246 AromaticContact CE2-CD2 3.85Å; F157-Y246 HydrophobicContact CE2-CD2 3.85Å; F157-Y246 HydrophobicContact CE2-CG 4.48Å; F157-Y246 HydrophobicContact CG-CD2 4.32Å; F157-Y246 HydrophobicContact CZ-CD2 4.09Å; T158-Y246 PolarHBondContact N-O 3.07Å; D159-Y246 PolarHBondContact N-O 3.33Å; I162-Y246 HydrophobicContact CB-CD2 4.48Å; I162-Y246 HydrophobicContact CD1-CD1 4.19Å; I162-Y246 HydrophobicContact CD1-CD2 4.2Å; I162-Y246 HydrophobicContact CD1-CG 4Å; I162-Y246 HydrophobicContact CG2-CD2 3.67Å; I162-Y246 HydrophobicContact CG2-CE2 3.61Å; Y244-Y246 AromaticContact CD1-CD1 3.85Å; Y244-Y246 HydrophobicContact CD1-CD1 3.85Å; Y244-Y246 HydrophobicContact CD1-CE1 4.09Å; Y244-Y246 AromaticContact CE1-CD1 3.82Å; Y244-Y246 HydrophobicContact CE1-CD1 3.82Å; Y244-Y246 HydrophobicContact CE1-CE1 4.26Å
247	M	95.4	Very high	94.9	Very high	44 Å²	44	54.1 Å²	54.1	22%	0.217	27%	0.269	C	S	.	.	S	Bend	trans	-145.4	157.3	-177.4	65.6	-172.2	-61	0	0	112.9	I156 T158 S245 S249 F250	I156-M247 HydrophobicContact CB-SD 4.12Å; I156-M247 HydrophobicContact CD1-CE 4.5Å; I156-M247 HydrophobicContact CD1-SD 4.07Å; I156-M247 HydrophobicContact CG2-CB 4.34Å; I156-M247 HydrophobicContact CG2-CE 4.34Å; I156-M247 HydrophobicContact CG2-SD 3.96Å; T158-M247 WeakPolarHBondContact OG1-CA 3.41Å; T158-M247 WeakPolarHBondContact OG1-CB 3.5Å; S245-M247 VanDerWaalsContact C-N 3.26Å; S245-M247 PolarHBondContact O-N 3.21Å; M247-S249 VanDerWaalsContact C-N 3.26Å; M247-S249 WeakPolarHBondContact CE-OG 3.08Å; M247-S249 PolarHBondContact O-N 3.1Å; M247-S249 VanDerWaalsContact O-N 3.15Å; M247-F250 HydrophobicContact CG-CD2 3.65Å; M247-F250 HydrophobicContact CG-CE2 4.34Å; M247-F250 PolarHBondContact O-N 3.44Å; M247-F250 VanDerWaalsContact O-N 3.14Å; M247-F250 HydrophobicContact SD-CD2 4Å; M247-F250 HydrophobicContact SD-CE2 4.1Å
248	W	95.3	Very high	95.2	Very high	185 Å²	185	49.5 Å²	49.5	70%	0.701	25%	0.248	S	C	*	.	H	α-helix	trans	-57.2	-30.9	-174.8	176.3	94.3	0	0	0	114.9	F250 E251 K252	W248-F250 VanDerWaalsContact C-N 3.33Å; W248-F250 PolarHBondContact O-N 2.96Å; W248-E251 VanDerWaalsContact O-CB 3.32Å; W248-E251 WeakPolarHBondContact O-CB 3.36Å; W248-E251 PolarHBondContact O-N 3.16Å; W248-E251 VanDerWaalsContact O-N 3.1Å; W248-K252 HydrophobicContact CD2-CB 4.45Å; W248-K252 HydrophobicContact CD2-CG 4.3Å; W248-K252 HydrophobicContact CH2-CB 4.05Å; W248-K252 HydrophobicContact CZ2-CB 3.87Å; W248-K252 HydrophobicContact CZ2-CG 3.84Å; W248-K252 HydrophobicContact CZ3-CB 4.42Å; W248-K252 PolarHBondContact O-N 2.94Å
249	S	95.4	Very high	95.3	Very high	18 Å²	18	49.7 Å²	49.7	13%	0.126	25%	0.25	C	C	.	.	H	α-helix	trans	-69	-29.9	-179.7	63.6	0	0	0	0	112.9	M247 E251 K252 A253 H254	M247-S249 VanDerWaalsContact C-N 3.26Å; M247-S249 WeakPolarHBondContact CE-OG 3.08Å; M247-S249 PolarHBondContact O-N 3.1Å; M247-S249 VanDerWaalsContact O-N 3.15Å; S249-E251 PolarHBondContact O-N 2.79Å; S249-K252 PolarHBondContact O-N 3.32Å; S249-A253 WeakPolarHBondContact O-CA 3.23Å; S249-A253 WeakPolarHBondContact O-CB 3.11Å; S249-A253 PolarHBondContact O-N 3.44Å; S249-H254 VanDerWaalsContact C-CD2 3.46Å; S249-H254 VanDerWaalsContact CB-NE2 3.28Å; S249-H254 WeakPolarHBondContact CB-NE2 3.06Å; S249-H254 PolarHBondContact O-CD2 3.34Å; S249-H254 PolarHBondContact O-N 3.46Å; S249-H254 PolarHBondContact OG-CD2 2.93Å; S249-H254 PolarHBondContact OG-NE2 3.18Å
250	F	94.3	Very high	95.3	Very high	26 Å²	26	50.7 Å²	50.7	11%	0.114	26%	0.255	C	S	.	.	H	α-helix	trans	-71.8	-21.4	172.1	-82.8	-92.5	0	0	0	112.7	H126 S243 Y244 S245 M247 W248 H254	H126-F250 PolarHBondContact CD2-O 2.85Å; H126-F250 PolarHBondContact NE2-O 3.12Å; S243-F250 WeakPolarHBondContact O-CE1 3.48Å; Y244-F250 HydrophobicContact CD2-CB 3.97Å; Y244-F250 HydrophobicContact CD2-CD1 4.4Å; Y244-F250 HydrophobicContact CE2-CB 3.85Å; Y244-F250 HydrophobicContact CG-CB 4.46Å; S245-F250 WeakPolarHBondContact O-CB 3.47Å; M247-F250 HydrophobicContact CG-CD2 3.65Å; M247-F250 HydrophobicContact CG-CE2 4.34Å; M247-F250 PolarHBondContact O-N 3.44Å; M247-F250 VanDerWaalsContact O-N 3.14Å; M247-F250 HydrophobicContact SD-CD2 4Å; M247-F250 HydrophobicContact SD-CE2 4.1Å; W248-F250 VanDerWaalsContact C-N 3.33Å; W248-F250 PolarHBondContact O-N 2.96Å; F250-H254 HydrophobicContact CD1-CB 4Å; F250-H254 AromaticContact CD2-CD2 3.57Å; F250-H254 HydrophobicContact CE1-CB 4.08Å; F250-H254 AromaticContact CE2-CD2 3.61Å; F250-H254 HydrophobicContact CG-CB 4.33Å; F250-H254 AromaticContact CG-CD2 3.98Å; F250-H254 HydrophobicContact CZ-CB 4.47Å
251	E	91.6	Very high	95.2	Very high	31 Å²	31	50.4 Å²	50.4	15%	0.145	25%	0.253	C	S	.	.	H	α-helix	trans	-79	-27.6	172.2	-98	-68.4	130	0	0	113.1	H126 K136 W248 S249	H126-E251 IonicContact CE1-OE1 2.68Å; H126-E251 PolarHBondContact NE2-O 3.28Å; K136-E251 VanDerWaalsContact CB-OE1 3.25Å; K136-E251 WeakPolarHBondContact CB-OE1 3.42Å; K136-E251 HydrophobicContact CD-CG 3.79Å; W248-E251 VanDerWaalsContact O-CB 3.32Å; W248-E251 WeakPolarHBondContact O-CB 3.36Å; W248-E251 PolarHBondContact O-N 3.16Å; W248-E251 VanDerWaalsContact O-N 3.1Å; S249-E251 PolarHBondContact O-N 2.79Å
252	K	93.4	Very high	95	Very high	126 Å²	126	48.4 Å²	48.4	55%	0.548	25%	0.25	S	S	.	.	H	α-helix	trans	-132.9	-14.4	-165.2	-58.4	-67	154.5	-101.2	0	117	W248 S249	W248-K252 HydrophobicContact CD2-CB 4.45Å; W248-K252 HydrophobicContact CD2-CG 4.3Å; W248-K252 HydrophobicContact CH2-CB 4.05Å; W248-K252 HydrophobicContact CZ2-CB 3.87Å; W248-K252 HydrophobicContact CZ2-CG 3.84Å; W248-K252 HydrophobicContact CZ3-CB 4.42Å; W248-K252 PolarHBondContact O-N 2.94Å; S249-K252 PolarHBondContact O-N 3.32Å
253	A	93.7	Very high	94.7	Very high	70 Å²	70	48.2 Å²	48.2	58%	0.579	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-129.2	-46.6	-175.6	0	0	0	0	0	113.6	S249	S249-A253 WeakPolarHBondContact O-CA 3.23Å; S249-A253 WeakPolarHBondContact O-CB 3.11Å; S249-A253 PolarHBondContact O-N 3.44Å
254	H	94.2	Very high	94.5	Very high	84 Å²	84	50.8 Å²	50.8	39%	0.389	25%	0.254	S	S	.	.			trans	-85.8	145.9	-174.2	-52.3	-58.1	0	0	0	113	S249 F250	S249-H254 VanDerWaalsContact C-CD2 3.46Å; S249-H254 VanDerWaalsContact CB-NE2 3.28Å; S249-H254 WeakPolarHBondContact CB-NE2 3.06Å; S249-H254 PolarHBondContact O-CD2 3.34Å; S249-H254 PolarHBondContact O-N 3.46Å; S249-H254 PolarHBondContact OG-CD2 2.93Å; S249-H254 PolarHBondContact OG-NE2 3.18Å; F250-H254 HydrophobicContact CD1-CB 4Å; F250-H254 AromaticContact CD2-CD2 3.57Å; F250-H254 HydrophobicContact CE1-CB 4.08Å; F250-H254 AromaticContact CE2-CD2 3.61Å; F250-H254 HydrophobicContact CG-CB 4.33Å; F250-H254 AromaticContact CG-CD2 3.98Å; F250-H254 HydrophobicContact CZ-CB 4.47Å
255	L	94.3	Very high	94.3	Very high	145 Å²	145	53.4 Å²	53.4	76%	0.759	27%	0.268	S	S	*	.			trans	-85.7	133.8	165.5	-53.4	-177.2	0	0	0	108.7	H126 P127	H126-L255 WeakPolarHBondContact O-CA 3.44Å; P127-L255 VanDerWaalsContact CD-CD2 3.46Å; P127-L255 HydrophobicContact CG-CD2 4.4Å
256	S	94.6	Very high	94.1	Very high	10 Å²	10	53.3 Å²	53.3	7%	0.07	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	164.8	-179.3	55.5	0	0	0	0	113.3	F125 H126 S243	F125-S256 WeakPolarHBondContact CA-O 3.4Å; H126-S256 PolarHBondContact N-O 3.13Å; H126-S256 PolarHBondContact O-N 2.93Å; S243-S256 WeakPolarHBondContact OG-CA 3.19Å; S243-S256 WeakPolarHBondContact OG-CB 3.45Å
257	M	95.4	Very high	93.8	Very high	71 Å²	71	54.7 Å²	54.7	35%	0.35	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	140.4	179.3	-177.3	-175.7	71.1	0	0	109.2	L124 F125 G242 S243	L124-M257 CarbonylContact O-C 3.52Å; L124-M257 VanDerWaalsContact O-CA 3.3Å; L124-M257 WeakPolarHBondContact O-CA 3.02Å; L124-M257 WeakPolarHBondContact O-CG 3.38Å; F125-M257 HydrophobicContact CD1-CB 4.06Å; F125-M257 HydrophobicContact CD1-CG 3.89Å; F125-M257 HydrophobicContact CD1-SD 4.32Å; F125-M257 HydrophobicContact CE1-CB 4.19Å; F125-M257 HydrophobicContact CE1-CG 3.66Å; F125-M257 HydrophobicContact CE1-SD 3.51Å; F125-M257 VanDerWaalsContact CE1-SD 3.51Å; F125-M257 HydrophobicContact CZ-CG 4.18Å; F125-M257 HydrophobicContact CZ-SD 3.88Å; G242-M257 CarbonylContact C-O 3.51Å; G242-M257 WeakPolarHBondContact CA-O 3.31Å; S243-M257 PolarHBondContact N-O 2.72Å; S243-M257 PolarHBondContact OG-N 3.01Å; S243-M257 VanDerWaalsContact OG-N 3.11Å; S243-M257 PolarHBondContact OG-O 3.43Å
258	V	96.8	Very high	93.6	Very high	4 Å²	4	55.6 Å²	55.6	2%	0.024	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	154.9	168.3	-61.2	0	0	0	0	111.4	L124 I135 M240 Y241	L124-V258 HydrophobicContact CB-CG2 3.91Å; L124-V258 HydrophobicContact CD1-CG2 4.44Å; L124-V258 PolarHBondContact N-O 2.9Å; L124-V258 PolarHBondContact O-N 3.01Å; I135-V258 HydrophobicContact CB-CG2 4.48Å; I135-V258 HydrophobicContact CD1-CG1 4.23Å; I135-V258 HydrophobicContact CD1-CG2 3.96Å; I135-V258 HydrophobicContact CG1-CG2 3.97Å; I135-V258 HydrophobicContact CG2-CG1 4.06Å; I135-V258 HydrophobicContact CG2-CG2 3.86Å; M240-V258 HydrophobicContact CE-CG2 4.18Å; M240-V258 HydrophobicContact CG-CB 3.83Å; M240-V258 HydrophobicContact CG-CG1 4.18Å; M240-V258 HydrophobicContact CG-CG2 3.9Å; M240-V258 HydrophobicContact SD-CB 4.34Å; M240-V258 HydrophobicContact SD-CG1 4.32Å; M240-V258 HydrophobicContact SD-CG2 4Å; Y241-V258 CarbonylContact O-C 3.57Å; Y241-V258 VanDerWaalsContact O-CA 3.28Å; Y241-V258 WeakPolarHBondContact O-CA 3.48Å; Y241-V258 WeakPolarHBondContact O-CB 3.41Å
259	Q	96.4	Very high	93.5	Very high	54 Å²	54	47.8 Å²	47.8	25%	0.252	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	126.9	175.9	-51.9	-168.5	-20.2	0	0	108.1	I121 D122 L123 M240 Y241 I261	I121-Q259 HydrophobicContact CG2-CB 3.91Å; I121-Q259 HydrophobicContact CG2-CG 4.41Å; D122-Q259 CarbonylContact O-C 3.55Å; D122-Q259 WeakPolarHBondContact O-CA 3.33Å; L123-Q259 HydrophobicContact CD2-CB 4.33Å; L123-Q259 HydrophobicContact CD2-CG 3.71Å; M240-Q259 VanDerWaalsContact CA-O 3.31Å; M240-Q259 WeakPolarHBondContact CA-O 3.25Å; Y241-Q259 PolarHBondContact N-O 2.99Å; Y241-Q259 PolarHBondContact O-N 2.77Å; Q259-I261 HydrophobicContact CB-CD1 4.19Å; Q259-I261 HydrophobicContact CB-CG1 4Å
260	I	96.4	Very high	93.4	Very high	21 Å²	21	47.3 Å²	47.3	11%	0.108	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	110.8	167.2	-48.4	-58.2	0	0	0	107.2	I121 D122 L124 T138 M142 K238 V239 M240	I121-I260 WeakPolarHBondContact CA-O 3.35Å; D122-I260 HydrophobicContact CB-CB 4.24Å; D122-I260 PolarHBondContact N-O 3.05Å; D122-I260 PolarHBondContact O-N 2.88Å; L124-I260 HydrophobicContact CD1-CD1 3.94Å; L124-I260 HydrophobicContact CD1-CG1 3.84Å; L124-I260 HydrophobicContact CG-CG1 4.24Å; T138-I260 HydrophobicContact CG2-CD1 3.94Å; M142-I260 HydrophobicContact SD-CD1 4.21Å; K238-I260 HydrophobicContact CD-CG2 4.31Å; K238-I260 HydrophobicContact CG-CG2 4.15Å; V239-I260 WeakPolarHBondContact O-CA 3.22Å; M240-I260 HydrophobicContact CB-CD1 4Å; M240-I260 HydrophobicContact CE-CD1 3.42Å; M240-I260 VanDerWaalsContact CE-CD1 3.42Å; M240-I260 HydrophobicContact CG-CD1 3.91Å
261	I	95.8	Very high	93.1	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	130.4	-172.5	-57.7	170.5	0	0	0	108.7	T119 H120 I121 K238 V239 Q259 L265 V266 F269	T119-I261 HydrophobicContact CG2-CG2 4.03Å; H120-I261 WeakPolarHBondContact O-CA 3.33Å; I121-I261 HydrophobicContact CD1-CG1 4.46Å; I121-I261 HydrophobicContact CG1-CG1 4.23Å; I121-I261 HydrophobicContact CG2-CG1 4.2Å; K238-I261 WeakPolarHBondContact CA-O 3.39Å; V239-I261 HydrophobicContact CB-CB 4.22Å; V239-I261 PolarHBondContact N-O 2.71Å; V239-I261 PolarHBondContact O-N 3.14Å; Q259-I261 HydrophobicContact CB-CD1 4.19Å; Q259-I261 HydrophobicContact CB-CG1 4Å; I261-L265 HydrophobicContact CD1-CD2 4.23Å; I261-L265 HydrophobicContact CG2-CB 3.95Å; I261-L265 HydrophobicContact CG2-CD2 3.9Å; I261-L265 HydrophobicContact CG2-CG 4.04Å; I261-V266 HydrophobicContact CG2-CG2 4.36Å; I261-F269 HydrophobicContact CD1-CE2 3.65Å; I261-F269 HydrophobicContact CD1-CZ 4.02Å
262	T	93.6	Very high	93.2	Very high	46 Å²	46	53.9 Å²	53.9	28%	0.282	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	163	170	60.1	0	0	0	0	109.9	T119 H120 K238	T119-T262 CarbonylContact C-O 3.58Å; T119-T262 VanDerWaalsContact CA-O 3.27Å; T119-T262 WeakPolarHBondContact CA-O 3.35Å; H120-T262 PolarHBondContact N-O 3.28Å; H120-T262 PolarHBondContact O-N 3.31Å; K238-T262 HydrophobicContact CB-CG2 4.13Å; K238-T262 HydrophobicContact CG-CG2 3.93Å
263	G	89.8	Confident	93.2	Very high	12 Å²	12	47.9 Å²	47.9	12%	0.124	26%	0.257	C	S	.	.	S	Bend	trans	87.7	-166.8	-173.3	0	0	0	0	0	112.7	L116 G117 L265 V266	L116-G263 WeakPolarHBondContact CD2-O 3.35Å; G117-G263 CarbonylContact O-C 3.54Å; G117-G263 WeakPolarHBondContact O-CA 3.25Å; G263-L265 VanDerWaalsContact C-N 3.27Å; G263-L265 PolarHBondContact O-N 2.75Å; G263-V266 WeakPolarHBondContact O-CB 3.49Å; G263-V266 WeakPolarHBondContact O-CG2 3.14Å; G263-V266 PolarHBondContact O-N 3.15Å
264	Q	89.3	Confident	93.1	Very high	106 Å²	106	48.7 Å²	48.7	50%	0.495	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-35.5	-166	-167.7	-178.5	1.9	0	0	115.3	G117 V266 E267	G117-Q264 PolarHBondContact O-N 3.27Å; Q264-V266 PolarHBondContact O-N 3.37Å; Q264-E267 VanDerWaalsContact O-CB 3.28Å; Q264-E267 WeakPolarHBondContact O-CB 3.46Å; Q264-E267 WeakPolarHBondContact O-CG 3.13Å; Q264-E267 PolarHBondContact O-N 3.12Å
265	L	92.1	Very high	92.9	Very high	60 Å²	60	48.7 Å²	48.7	31%	0.314	25%	0.251	S	S	.	.	H	α-helix	trans	-59.4	-19.6	179.6	-176.3	57.7	0	0	0	113.9	T119 I121 I261 G263 E267 S268 F269	T119-L265 HydrophobicContact CG2-CB 3.53Å; T119-L265 HydrophobicContact CG2-CD2 4.03Å; T119-L265 HydrophobicContact CG2-CG 4.44Å; T119-L265 PolarHBondContact OG1-N 2.69Å; I121-L265 HydrophobicContact CD1-CD2 4.22Å; I261-L265 HydrophobicContact CD1-CD2 4.23Å; I261-L265 HydrophobicContact CG2-CB 3.95Å; I261-L265 HydrophobicContact CG2-CD2 3.9Å; I261-L265 HydrophobicContact CG2-CG 4.04Å; G263-L265 VanDerWaalsContact C-N 3.27Å; G263-L265 PolarHBondContact O-N 2.75Å; L265-E267 PolarHBondContact O-N 2.73Å; L265-S268 PolarHBondContact O-N 2.98Å; L265-F269 HydrophobicContact CG-CD2 4.41Å; L265-F269 HydrophobicContact CG-CE2 4.18Å; L265-F269 WeakPolarHBondContact O-CD2 3.39Å
266	V	92.5	Very high	92.8	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.006	22%	0.22	C	C	.	.	H	α-helix	trans	-62.2	-28.6	172.7	175.8	0	0	0	0	111.9	L116 L233 V239 I261 G263 Q264 S268 F269 D270	L116-V266 HydrophobicContact CD2-CB 4.2Å; L233-V266 HydrophobicContact CD1-CG1 3.64Å; V239-V266 HydrophobicContact CG2-CB 4.45Å; V239-V266 HydrophobicContact CG2-CG1 4.1Å; V239-V266 HydrophobicContact CG2-CG2 4.13Å; I261-V266 HydrophobicContact CG2-CG2 4.36Å; G263-V266 WeakPolarHBondContact O-CB 3.49Å; G263-V266 WeakPolarHBondContact O-CG2 3.14Å; G263-V266 PolarHBondContact O-N 3.15Å; Q264-V266 PolarHBondContact O-N 3.37Å; V266-S268 VanDerWaalsContact C-N 3.33Å; V266-S268 PolarHBondContact O-N 2.94Å; V266-F269 PolarHBondContact O-N 2.98Å; V266-D270 VanDerWaalsContact O-CB 3.3Å; V266-D270 WeakPolarHBondContact O-CB 3.31Å; V266-D270 PolarHBondContact O-N 3.02Å
267	E	89.1	Confident	92.6	Very high	33 Å²	33	42.5 Å²	42.5	15%	0.154	22%	0.217	C	C	.	.	H	α-helix	trans	-64.1	-36.8	177.3	-60.8	176.4	-169.7	0	0	111.4	V111 P113 G114 Q264 L265 D270 E271	V111-E267 HydrophobicContact CG1-CG 4.17Å; P113-E267 WeakPolarHBondContact CA-OE2 3.36Å; G114-E267 PolarHBondContact N-OE1 2.89Å; G114-E267 PolarHBondContact N-OE2 3.22Å; Q264-E267 VanDerWaalsContact O-CB 3.28Å; Q264-E267 WeakPolarHBondContact O-CB 3.46Å; Q264-E267 WeakPolarHBondContact O-CG 3.13Å; Q264-E267 PolarHBondContact O-N 3.12Å; L265-E267 PolarHBondContact O-N 2.73Å; E267-D270 WeakPolarHBondContact O-CB 3.36Å; E267-D270 PolarHBondContact O-N 3.06Å; E267-E271 PolarHBondContact O-N 2.89Å
268	S	91.5	Very high	92.3	Very high	63 Å²	63	40.6 Å²	40.6	44%	0.441	21%	0.213	S	C	.	.	H	α-helix	trans	-71.7	-33.5	176.5	-50.1	0	0	0	0	113.4	L265 V266 D270 E272	L265-S268 PolarHBondContact O-N 2.98Å; V266-S268 VanDerWaalsContact C-N 3.33Å; V266-S268 PolarHBondContact O-N 2.94Å; S268-D270 VanDerWaalsContact C-N 3.35Å; S268-E272 WeakPolarHBondContact O-CB 3.49Å; S268-E272 PolarHBondContact O-N 2.88Å
269	F	93.9	Very high	91.9	Very high	22 Å²	22	45.5 Å²	45.5	10%	0.096	23%	0.232	C	C	.	.	H	α-helix	trans	-73.2	-28.9	172	-79.4	-83	0	0	0	112.4	F231 V239 Y241 I261 L265 V266 F273	F231-F269 HydrophobicContact CB-CD1 4.26Å; F231-F269 HydrophobicContact CB-CE1 4.24Å; F231-F269 AromaticContact CD1-CD1 3.83Å; F231-F269 HydrophobicContact CD1-CD1 3.83Å; F231-F269 HydrophobicContact CD1-CE1 4.07Å; F231-F269 AromaticContact CD2-CD1 3.9Å; F231-F269 HydrophobicContact CD2-CD1 3.9Å; F231-F269 HydrophobicContact CE1-CD1 4.03Å; F231-F269 HydrophobicContact CE2-CB 4.3Å; F231-F269 HydrophobicContact CE2-CD1 4.11Å; F231-F269 AromaticContact CG-CD1 3.75Å; F231-F269 HydrophobicContact CG-CD1 3.75Å; F231-F269 HydrophobicContact CG-CE1 4.12Å; F231-F269 HydrophobicContact CZ-CD1 4.16Å; V239-F269 HydrophobicContact CB-CD2 4.47Å; V239-F269 HydrophobicContact CG1-CD1 4.02Å; V239-F269 HydrophobicContact CG1-CD2 4.06Å; V239-F269 HydrophobicContact CG1-CE1 4.2Å; V239-F269 HydrophobicContact CG1-CE2 4.25Å; V239-F269 HydrophobicContact CG1-CG 3.95Å; V239-F269 HydrophobicContact CG1-CZ 4.31Å; V239-F269 HydrophobicContact CG2-CB 3.76Å; V239-F269 HydrophobicContact CG2-CD2 4.22Å; V239-F269 HydrophobicContact CG2-CG 4.02Å; Y241-F269 HydrophobicContact CD1-CZ 4.04Å; Y241-F269 HydrophobicContact CD2-CE1 4.03Å; Y241-F269 HydrophobicContact CD2-CZ 4.31Å; Y241-F269 AromaticContact CG-CE1 3.92Å; Y241-F269 HydrophobicContact CG-CE1 3.92Å; Y241-F269 AromaticContact CG-CZ 3.79Å; Y241-F269 HydrophobicContact CG-CZ 3.79Å; I261-F269 HydrophobicContact CD1-CE2 3.65Å; I261-F269 HydrophobicContact CD1-CZ 4.02Å; L265-F269 HydrophobicContact CG-CD2 4.41Å; L265-F269 HydrophobicContact CG-CE2 4.18Å; L265-F269 WeakPolarHBondContact O-CD2 3.39Å; V266-F269 PolarHBondContact O-N 2.98Å; F269-F273 WeakPolarHBondContact O-CB 3.25Å; F269-F273 PolarHBondContact O-N 2.8Å
270	D	92	Very high	91.6	Very high	7 Å²	7	43.1 Å²	43.1	4%	0.037	22%	0.221	C	C	.	.	H	α-helix	trans	-72.5	-32.8	173.6	179.4	72.1	0	0	0	111.5	W108 L233 C236 V266 E267 S268 R274	W108-D270 VanDerWaalsContact CE2-OD1 3.31Å; W108-D270 VanDerWaalsContact CZ2-OD1 3.31Å; W108-D270 WeakPolarHBondContact CZ2-OD1 3.36Å; W108-D270 PolarHBondContact NE1-OD1 3.36Å; L233-D270 HydrophobicContact CD2-CB 4.11Å; C236-D270 PolarHBondContact SG-OD1 2.82Å; V266-D270 VanDerWaalsContact O-CB 3.3Å; V266-D270 WeakPolarHBondContact O-CB 3.31Å; V266-D270 PolarHBondContact O-N 3.02Å; E267-D270 WeakPolarHBondContact O-CB 3.36Å; E267-D270 PolarHBondContact O-N 3.06Å; S268-D270 VanDerWaalsContact C-N 3.35Å; D270-R274 VanDerWaalsContact CG-NH2 3.28Å; D270-R274 WeakPolarHBondContact O-CG 3.4Å; D270-R274 PolarHBondContact O-NH1 2.73Å; D270-R274 VanDerWaalsContact O-NH1 3.12Å; D270-R274 IonicContact OD1-CZ 3.63Å; D270-R274 IonicContact OD1-NH1 3.12Å; D270-R274 IonicContact OD1-NH2 3.63Å; D270-R274 PolarHBondContact OD1-NH2 3.48Å; D270-R274 IonicContact OD2-CZ 3.62Å; D270-R274 IonicContact OD2-NH1 4Å; D270-R274 PolarHBondContact OD2-NH1 3.15Å; D270-R274 IonicContact OD2-NH2 2.69Å; D270-R274 PolarHBondContact OD2-NH2 2.9Å
271	E	89.9	Confident	91.4	Very high	127 Å²	127	45.5 Å²	45.5	59%	0.593	24%	0.239	S	C	*	.	H	α-helix	trans	-68.6	-55.2	167.2	-178.8	171.4	-149.1	0	0	112.3	E267 F273 R274 T275	E267-E271 PolarHBondContact O-N 2.89Å; E271-F273 PolarHBondContact O-N 3.02Å; E271-R274 WeakPolarHBondContact O-CA 3.38Å; E271-R274 WeakPolarHBondContact O-CB 3.08Å; E271-R274 PolarHBondContact O-N 2.61Å; E271-T275 PolarHBondContact O-N 3.11Å; E271-T275 VanDerWaalsContact O-N 3.08Å; E271-T275 PolarHBondContact O-OG1 3.37Å
272	E	92.8	Very high	91.1	Very high	68 Å²	68	49.5 Å²	49.5	32%	0.318	26%	0.263	S	S	.	.	H	α-helix	trans	-54.7	-39.7	177.6	173.2	65	176.1	0	0	112	F231 S268 R274 T275 L276	F231-E272 HydrophobicContact CE1-CG 4.03Å; F231-E272 HydrophobicContact CZ-CG 4.21Å; S268-E272 WeakPolarHBondContact O-CB 3.49Å; S268-E272 PolarHBondContact O-N 2.88Å; E272-R274 VanDerWaalsContact C-N 3.32Å; E272-R274 PolarHBondContact O-N 2.83Å; E272-T275 PolarHBondContact O-N 2.94Å; E272-L276 HydrophobicContact CG-CD1 4.06Å; E272-L276 HydrophobicContact CG-CG 4.47Å; E272-L276 WeakPolarHBondContact O-CG 3.35Å; E272-L276 PolarHBondContact O-N 3.01Å
273	F	93.8	Very high	90.9	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-60.8	-39.1	174.9	-171.8	-90.4	0	0	0	112.6	L104 W108 A151 V153 L179 F231 L233 F269 E271 Y277	L104-F273 HydrophobicContact CD2-CE1 4.31Å; W108-F273 AromaticContact CH2-CD1 3.32Å; W108-F273 HydrophobicContact CH2-CD1 3.32Å; W108-F273 AromaticContact CH2-CE1 3.6Å; W108-F273 HydrophobicContact CH2-CE1 3.6Å; W108-F273 HydrophobicContact CH2-CG 4.12Å; W108-F273 HydrophobicContact CZ2-CD1 4.08Å; W108-F273 HydrophobicContact CZ3-CD1 4.02Å; W108-F273 AromaticContact CZ3-CE1 3.84Å; W108-F273 HydrophobicContact CZ3-CE1 3.84Å; A151-F273 HydrophobicContact CB-CD1 4.14Å; A151-F273 HydrophobicContact CB-CD2 3.86Å; A151-F273 HydrophobicContact CB-CE1 3.99Å; A151-F273 HydrophobicContact CB-CE2 3.7Å; A151-F273 HydrophobicContact CB-CG 4.08Å; A151-F273 HydrophobicContact CB-CZ 3.78Å; V153-F273 HydrophobicContact CG2-CD2 3.54Å; V153-F273 HydrophobicContact CG2-CE2 3.8Å; L179-F273 HydrophobicContact CD1-CD2 4.22Å; L179-F273 HydrophobicContact CD1-CE2 3.75Å; L179-F273 HydrophobicContact CD1-CZ 4.01Å; L179-F273 HydrophobicContact CG-CE2 3.85Å; L179-F273 HydrophobicContact CG-CZ 3.97Å; F231-F273 HydrophobicContact CE2-CB 4.17Å; F231-F273 HydrophobicContact CE2-CD2 4.2Å; F231-F273 HydrophobicContact CZ-CB 4.07Å; F231-F273 HydrophobicContact CZ-CD2 4.3Å; L233-F273 HydrophobicContact CD2-CB 4.48Å; F269-F273 WeakPolarHBondContact O-CB 3.25Å; F269-F273 PolarHBondContact O-N 2.8Å; E271-F273 PolarHBondContact O-N 3.02Å; F273-Y277 AromaticContact CE1-CD2 3.98Å; F273-Y277 HydrophobicContact CE1-CD2 3.98Å; F273-Y277 HydrophobicContact CE1-CG 4.43Å; F273-Y277 HydrophobicContact CZ-CD2 4.16Å; F273-Y277 WeakPolarHBondContact O-CB 3.42Å; F273-Y277 PolarHBondContact O-N 3.21Å
274	R	90.8	Very high	90.6	Very high	88 Å²	88	50.7 Å²	50.7	33%	0.332	27%	0.271	S	S	.	.	H	α-helix	trans	-66.9	-42.2	176.6	-68.7	-180	-170.7	98.9	6.7	111.4	L104 W108 D270 E271 E272 Y277 A278	L104-R274 HydrophobicContact CD1-CG 4.21Å; W108-R274 VanDerWaalsContact CD1-NH2 3.29Å; D270-R274 VanDerWaalsContact CG-NH2 3.28Å; D270-R274 WeakPolarHBondContact O-CG 3.4Å; D270-R274 PolarHBondContact O-NH1 2.73Å; D270-R274 VanDerWaalsContact O-NH1 3.12Å; D270-R274 IonicContact OD1-CZ 3.63Å; D270-R274 IonicContact OD1-NH1 3.12Å; D270-R274 IonicContact OD1-NH2 3.63Å; D270-R274 PolarHBondContact OD1-NH2 3.48Å; D270-R274 IonicContact OD2-CZ 3.62Å; D270-R274 IonicContact OD2-NH1 4Å; D270-R274 PolarHBondContact OD2-NH1 3.15Å; D270-R274 IonicContact OD2-NH2 2.69Å; D270-R274 PolarHBondContact OD2-NH2 2.9Å; E271-R274 WeakPolarHBondContact O-CA 3.38Å; E271-R274 WeakPolarHBondContact O-CB 3.08Å; E271-R274 PolarHBondContact O-N 2.61Å; E272-R274 VanDerWaalsContact C-N 3.32Å; E272-R274 PolarHBondContact O-N 2.83Å; R274-Y277 PolarHBondContact O-N 2.83Å; R274-A278 WeakPolarHBondContact O-CB 3.41Å; R274-A278 PolarHBondContact O-N 3.26Å
275	T	90.1	Very high	90.3	Very high	83 Å²	83	47.1 Å²	47.1	51%	0.509	26%	0.258	S	S	.	.	H	α-helix	trans	-61.4	-44.5	176.7	-56.1	0	0	0	0	111.3	E271 E272 A278 R279	E271-T275 PolarHBondContact O-N 3.11Å; E271-T275 VanDerWaalsContact O-N 3.08Å; E271-T275 PolarHBondContact O-OG1 3.37Å; E272-T275 PolarHBondContact O-N 2.94Å; T275-A278 WeakPolarHBondContact O-CB 3.36Å; T275-A278 PolarHBondContact O-N 3.16Å; T275-R279 PolarHBondContact O-N 2.8Å
276	L	92.1	Very high	89.7	Confident	21 Å²	21	45.7 Å²	45.7	11%	0.11	25%	0.249	C	C	.	.	H	α-helix	trans	-68	-36	174.1	-65.2	174.3	0	0	0	112.3	V153 L179 V210 Q229 F231 E272 A278 R279 S280	V153-L276 HydrophobicContact CG1-CD1 3.96Å; V153-L276 HydrophobicContact CG2-CD1 4.22Å; L179-L276 HydrophobicContact CD1-CB 3.56Å; V210-L276 HydrophobicContact CG1-CD2 4.39Å; Q229-L276 HydrophobicContact CG-CD1 4.09Å; F231-L276 HydrophobicContact CE1-CD1 4.39Å; E272-L276 HydrophobicContact CG-CD1 4.06Å; E272-L276 HydrophobicContact CG-CG 4.47Å; E272-L276 WeakPolarHBondContact O-CG 3.35Å; E272-L276 PolarHBondContact O-N 3.01Å; L276-A278 VanDerWaalsContact C-N 3.3Å; L276-A278 PolarHBondContact O-N 3.2Å; L276-R279 PolarHBondContact O-N 3.34Å; L276-S280 VanDerWaalsContact O-CB 3.31Å; L276-S280 WeakPolarHBondContact O-CB 3.35Å; L276-S280 PolarHBondContact O-N 3.07Å
277	Y	91.5	Very high	88.3	Confident	4 Å²	4	48.2 Å²	48.2	2%	0.016	27%	0.27	C	S	.	.	H	α-helix	trans	-64.7	-35.7	173.3	-157	-102.6	0	0	0	111.3	P102 L104 D105 Y177 L179 F273 R274 S280	P102-Y277 HydrophobicContact CB-CD1 4.19Å; P102-Y277 HydrophobicContact CB-CE1 4.07Å; P102-Y277 WeakPolarHBondContact O-CD1 3.45Å; P102-Y277 WeakPolarHBondContact O-CE1 3.39Å; L104-Y277 HydrophobicContact CD2-CD1 3.67Å; L104-Y277 HydrophobicContact CD2-CD2 4.21Å; L104-Y277 HydrophobicContact CD2-CE1 3.75Å; L104-Y277 HydrophobicContact CD2-CE2 4.33Å; L104-Y277 HydrophobicContact CD2-CG 3.91Å; L104-Y277 HydrophobicContact CG-CD1 4.4Å; L104-Y277 HydrophobicContact CG-CE1 4.49Å; D105-Y277 PolarHBondContact OD1-OH 3.44Å; Y177-Y277 AromaticContact CD1-CE2 3.65Å; Y177-Y277 HydrophobicContact CD1-CE2 3.65Å; Y177-Y277 AromaticContact CD1-CZ 3.76Å; Y177-Y277 HydrophobicContact CE1-CE2 4.42Å; Y177-Y277 HydrophobicContact CG-CE2 4.41Å; L179-Y277 HydrophobicContact CD2-CD2 3.83Å; L179-Y277 HydrophobicContact CD2-CE2 4.4Å; L179-Y277 HydrophobicContact CG-CD2 4.46Å; F273-Y277 AromaticContact CE1-CD2 3.98Å; F273-Y277 HydrophobicContact CE1-CD2 3.98Å; F273-Y277 HydrophobicContact CE1-CG 4.43Å; F273-Y277 HydrophobicContact CZ-CD2 4.16Å; F273-Y277 WeakPolarHBondContact O-CB 3.42Å; F273-Y277 PolarHBondContact O-N 3.21Å; R274-Y277 PolarHBondContact O-N 2.83Å; Y277-S280 PolarHBondContact O-N 3.37Å; Y277-S280 PolarHBondContact O-OG 3.04Å
278	A	88.4	Confident	86.7	Confident	32 Å²	32	54 Å²	54	26%	0.264	30%	0.297	S	S	.	.	H	α-helix	trans	-63.7	-44.7	173.1	0	0	0	0	0	113	A101 R274 T275 L276 S280	A101-A278 HydrophobicContact CB-CB 3.9Å; R274-A278 WeakPolarHBondContact O-CB 3.41Å; R274-A278 PolarHBondContact O-N 3.26Å; T275-A278 WeakPolarHBondContact O-CB 3.36Å; T275-A278 PolarHBondContact O-N 3.16Å; L276-A278 VanDerWaalsContact C-N 3.3Å; L276-A278 PolarHBondContact O-N 3.2Å; A278-S280 VanDerWaalsContact C-N 3.29Å; A278-S280 PolarHBondContact O-N 3.05Å
279	R	88.2	Confident	84.8	Confident	107 Å²	107	54 Å²	54	40%	0.404	29%	0.29	S	S	.	.	H	α-helix	trans	-72.9	-18.3	174.7	-171.8	167.5	176.9	77.8	7.3	113.7	K211 G212 D214 T275 L276	K211-R279 PolarHBondContact O-NE 3.46Å; G212-R279 PolarHBondContact O-NH2 3.45Å; D214-R279 IonicContact OD1-NH2 2.72Å; D214-R279 IonicContact OD2-CZ 3.18Å; D214-R279 IonicContact OD2-NH1 2.65Å; D214-R279 IonicContact OD2-NH2 3.98Å; D214-R279 PolarHBondContact OD2-NH2 3.42Å; T275-R279 PolarHBondContact O-N 2.8Å; L276-R279 PolarHBondContact O-N 3.34Å
280	S	91.1	Very high	82.7	Confident	4 Å²	4	59.8 Å²	59.8	3%	0.028	32%	0.317	C	S	.	.			trans	-73.8	142.7	-173.7	75.5	0	0	0	0	114.1	R208 T209 L276 Y277 A278	R208-S280 WeakPolarHBondContact CD-OG 3.42Å; R208-S280 PolarHBondContact NE-O 3.43Å; R208-S280 PolarHBondContact NE-OG 2.89Å; R208-S280 PolarHBondContact NH2-O 2.91Å; T209-S280 CarbonylContact O-C 3.59Å; T209-S280 WeakPolarHBondContact O-CA 3.13Å; L276-S280 VanDerWaalsContact O-CB 3.31Å; L276-S280 WeakPolarHBondContact O-CB 3.35Å; L276-S280 PolarHBondContact O-N 3.07Å; Y277-S280 PolarHBondContact O-N 3.37Å; Y277-S280 PolarHBondContact O-OG 3.04Å; A278-S280 VanDerWaalsContact C-N 3.29Å; A278-S280 PolarHBondContact O-N 3.05Å
281	C	90.4	Very high	80.5	Confident	71 Å²	71	62.9 Å²	62.9	48%	0.48	34%	0.34	S	S	.	.	B	Isolated β-bridge	trans	-105.8	162.9	175.2	-72.6	0	0	0	0	112.2	R208 T209	R208-C281 CarbonylContact C-O 3.59Å; R208-C281 WeakPolarHBondContact CA-O 3.35Å; R208-C281 VanDerWaalsContact CB-O 3.28Å; R208-C281 WeakPolarHBondContact CB-O 3.35Å; T209-C281 PolarHBondContact N-O 2.62Å; T209-C281 PolarHBondContact O-N 2.53Å; T209-C281 PolarHBondContact OG1-O 3.06Å
282	V	90	Very high	78.2	Confident	85 Å²	85	59.6 Å²	59.6	52%	0.515	33%	0.334	S	S	.	.			trans	-68.6	135	164.3	179	0	0	0	0	108.4	S284	V282-S284 PolarHBondContact O-N 3.39Å
283	P	89.5	Confident	75.8	Confident	1 Å²	1	62.3 Å²	62.3	1%	0.006	34%	0.341	C	S	.	.			trans	-62.9	131	-178.1	-19.5	31.8	0	0	0	111.7	F185 V207 T209 S285 F286	F185-P283 HydrophobicContact CD1-CB 3.95Å; F185-P283 HydrophobicContact CD2-CB 4.15Å; F185-P283 HydrophobicContact CD2-CG 4.19Å; F185-P283 HydrophobicContact CE1-CB 3.49Å; F185-P283 VanDerWaalsContact CE1-CB 3.49Å; F185-P283 HydrophobicContact CE1-CG 4.28Å; F185-P283 HydrophobicContact CE2-CB 3.71Å; F185-P283 HydrophobicContact CE2-CG 3.58Å; F185-P283 HydrophobicContact CG-CB 4.28Å; F185-P283 HydrophobicContact CZ-CB 3.36Å; F185-P283 HydrophobicContact CZ-CG 3.64Å; V207-P283 WeakPolarHBondContact O-CD 3.34Å; T209-P283 HydrophobicContact CG2-CB 4.01Å; T209-P283 HydrophobicContact CG2-CG 4.04Å; P283-S285 VanDerWaalsContact C-N 3.25Å; P283-S285 PolarHBondContact O-N 2.99Å; P283-F286 HydrophobicContact CB-CD2 4.11Å; P283-F286 HydrophobicContact CB-CE2 4.38Å; P283-F286 HydrophobicContact CB-CG 4.49Å; P283-F286 HydrophobicContact CG-CD2 3.85Å; P283-F286 HydrophobicContact CG-CE2 3.86Å; P283-F286 WeakPolarHBondContact O-CB 3.39Å; P283-F286 PolarHBondContact O-N 2.9Å
284	S	84.4	Confident	73.4	Confident	82 Å²	82	67.7 Å²	67.7	57%	0.573	37%	0.374	S	S	*	.	H	α-helix	trans	-55.9	-37.7	-175.2	51.7	0	0	0	0	113.2	V282 F286 A287 Q288	V282-S284 PolarHBondContact O-N 3.39Å; S284-F286 PolarHBondContact O-N 2.89Å; S284-A287 PolarHBondContact O-N 2.63Å; S284-A287 VanDerWaalsContact O-N 3.1Å; S284-Q288 PolarHBondContact O-N 3.09Å
285	S	81.5	Confident	71	Confident	31 Å²	31	71.3 Å²	71.3	22%	0.217	39%	0.392	C	S	.	.	H	α-helix	trans	-60.3	-24	177.1	-33.7	0	0	0	0	113.7	N186 P283	N186-S285 PolarHBondContact OD1-OG 3.41Å; P283-S285 VanDerWaalsContact C-N 3.25Å; P283-S285 PolarHBondContact O-N 2.99Å
286	F	80.3	Confident	68.3	Low	29 Å²	29	76.3 Å²	76.3	13%	0.127	41%	0.41	C	S	.	.	H	α-helix	trans	-82.1	-34.2	174.8	-64.6	-21.1	0	0	0	112.8	F185 L189 V199 Q200 V207 P283 S284 Q288 E289 E290	F185-F286 HydrophobicContact CE2-CZ 4.42Å; F185-F286 HydrophobicContact CZ-CE1 4.01Å; F185-F286 HydrophobicContact CZ-CE2 4.05Å; F185-F286 AromaticContact CZ-CZ 3.68Å; F185-F286 HydrophobicContact CZ-CZ 3.68Å; L189-F286 HydrophobicContact CD1-CE1 3.92Å; V199-F286 HydrophobicContact CG1-CE1 4.08Å; V199-F286 HydrophobicContact CG1-CZ 3.6Å; Q200-F286 HydrophobicContact CG-CD1 3.61Å; Q200-F286 HydrophobicContact CG-CD2 4.43Å; Q200-F286 HydrophobicContact CG-CE1 3.64Å; Q200-F286 HydrophobicContact CG-CE2 4.47Å; Q200-F286 HydrophobicContact CG-CG 4.04Å; Q200-F286 HydrophobicContact CG-CZ 4.1Å; V207-F286 HydrophobicContact CB-CE2 4.44Å; P283-F286 HydrophobicContact CB-CD2 4.11Å; P283-F286 HydrophobicContact CB-CE2 4.38Å; P283-F286 HydrophobicContact CB-CG 4.49Å; P283-F286 HydrophobicContact CG-CD2 3.85Å; P283-F286 HydrophobicContact CG-CE2 3.86Å; P283-F286 WeakPolarHBondContact O-CB 3.39Å; P283-F286 PolarHBondContact O-N 2.9Å; S284-F286 PolarHBondContact O-N 2.89Å; F286-Q288 PolarHBondContact O-N 3.15Å; F286-E289 PolarHBondContact O-N 2.93Å; F286-E289 VanDerWaalsContact O-N 3.11Å; F286-E290 PolarHBondContact O-N 2.83Å
287	A	63.1	Low	65.5	Low	54 Å²	54	77.9 Å²	77.9	45%	0.446	43%	0.431	S	S	.	.	H	α-helix	trans	-62.9	-31.8	179.2	0	0	0	0	0	112.2	S284 E290 S291	S284-A287 PolarHBondContact O-N 2.63Å; S284-A287 VanDerWaalsContact O-N 3.1Å; A287-E290 PolarHBondContact O-N 2.73Å; A287-S291 WeakPolarHBondContact O-CB 3.28Å; A287-S291 PolarHBondContact O-N 3.31Å
288	Q	55.8	Low	62.8	Low	155 Å²	155	87.2 Å²	87.2	72%	0.724	47%	0.472	S	S	*	.	H	α-helix	trans	-66.5	-38.2	174.3	-169.8	173.3	0.3	0	0	112.4	S284 F286 A292	S284-Q288 PolarHBondContact O-N 3.09Å; F286-Q288 PolarHBondContact O-N 3.15Å; Q288-A292 WeakPolarHBondContact O-CB 3.39Å; Q288-A292 PolarHBondContact O-N 3.27Å
289	E	52.3	Low	60	Low	63 Å²	63	90.6 Å²	90.6	29%	0.294	50%	0.499	S	S	.	.	H	α-helix	trans	-72.7	-34.1	176.1	-150.7	-152.4	151.6	0	0	111.8	Q200 F286 A292 R293	Q200-E289 PolarHBondContact NE2-OE2 3.32Å; Q200-E289 VanDerWaalsContact NE2-OE2 3.16Å; F286-E289 PolarHBondContact O-N 2.93Å; F286-E289 VanDerWaalsContact O-N 3.11Å; E289-A292 WeakPolarHBondContact O-CB 3.45Å; E289-A292 PolarHBondContact O-N 3.04Å; E289-R293 WeakPolarHBondContact O-CG 3.29Å; E289-R293 PolarHBondContact O-N 3.34Å; E289-R293 IonicContact OE1-CZ 3.12Å; E289-R293 IonicContact OE1-NE 2.79Å; E289-R293 PolarHBondContact OE1-NE 3.46Å; E289-R293 IonicContact OE1-NH2 2.68Å; E289-R293 PolarHBondContact OE1-NH2 3.27Å; E289-R293 IonicContact OE2-CZ 3.71Å; E289-R293 IonicContact OE2-NE 3.92Å; E289-R293 IonicContact OE2-NH2 3Å; E289-R293 PolarHBondContact OE2-NH2 3.34Å
290	E	49.1	Very low	57.4	Low	143 Å²	143	91.5 Å²	91.5	67%	0.668	51%	0.512	S	S	*	.	H	α-helix	trans	-64.9	-44	175.6	-166.9	151.8	-131.3	0	0	111.2	F286 A287 A292 R293 V294	F286-E290 PolarHBondContact O-N 2.83Å; A287-E290 PolarHBondContact O-N 2.73Å; E290-A292 VanDerWaalsContact C-N 3.32Å; E290-A292 PolarHBondContact O-N 2.94Å; E290-R293 PolarHBondContact O-N 3.33Å; E290-V294 PolarHBondContact O-N 2.92Å
291	S	45.1	Very low	54.4	Low	73 Å²	73	102.8 Å²	102.8	51%	0.51	55%	0.554	S	S	.	*	H	α-helix	trans	-60.6	-37.1	170.1	-175.4	0	0	0	0	112.9	A287	A287-S291 WeakPolarHBondContact O-CB 3.28Å; A287-S291 PolarHBondContact O-N 3.31Å
292	A	42.3	Very low	51.5	Low	57 Å²	57	108 Å²	108	47%	0.471	57%	0.571	S	S	.	*	H	α-helix	trans	-68.4	-41.4	175.4	0	0	0	0	0	112.8	Q288 E289 E290 V294 K295	Q288-A292 WeakPolarHBondContact O-CB 3.39Å; Q288-A292 PolarHBondContact O-N 3.27Å; E289-A292 WeakPolarHBondContact O-CB 3.45Å; E289-A292 PolarHBondContact O-N 3.04Å; E290-A292 VanDerWaalsContact C-N 3.32Å; E290-A292 PolarHBondContact O-N 2.94Å; A292-V294 VanDerWaalsContact C-N 3.28Å; A292-V294 PolarHBondContact O-N 2.88Å; A292-K295 WeakPolarHBondContact O-CB 3.3Å; A292-K295 PolarHBondContact O-N 3.1Å; A292-K295 VanDerWaalsContact O-N 3.08Å
293	R	43.1	Very low	48.6	Very low	125 Å²	125	112 Å²	112	47%	0.472	59%	0.589	S	S	.	*	H	α-helix	trans	-65.7	-26.9	-179.9	-73.7	176.5	-174.8	179.5	8.4	113.2	E289 E290 K295	E289-R293 WeakPolarHBondContact O-CG 3.29Å; E289-R293 PolarHBondContact O-N 3.34Å; E289-R293 IonicContact OE1-CZ 3.12Å; E289-R293 IonicContact OE1-NE 2.79Å; E289-R293 PolarHBondContact OE1-NE 3.46Å; E289-R293 IonicContact OE1-NH2 2.68Å; E289-R293 PolarHBondContact OE1-NH2 3.27Å; E289-R293 IonicContact OE2-CZ 3.71Å; E289-R293 IonicContact OE2-NE 3.92Å; E289-R293 IonicContact OE2-NH2 3Å; E289-R293 PolarHBondContact OE2-NH2 3.34Å; E290-R293 PolarHBondContact O-N 3.33Å; R293-K295 PolarHBondContact O-N 3.48Å
294	V	41.6	Very low	45.8	Very low	114 Å²	114	115 Å²	115	69%	0.691	62%	0.62	S	S	*	*	H	α-helix	trans	-63.6	-28.5	172.5	171.9	0	0	0	0	112.1	E290 A292 H296 G297	E290-V294 PolarHBondContact O-N 2.92Å; A292-V294 VanDerWaalsContact C-N 3.28Å; A292-V294 PolarHBondContact O-N 2.88Å; V294-H296 PolarHBondContact O-N 3.26Å; V294-G297 PolarHBondContact O-N 2.88Å
295	K	41.1	Very low	43.2	Very low	163 Å²	163	117.4 Å²	117.4	71%	0.709	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	12	-174.1	-62.6	-171.3	177.2	-174.3	0	115.8	A292 R293	A292-K295 WeakPolarHBondContact O-CB 3.3Å; A292-K295 PolarHBondContact O-N 3.1Å; A292-K295 VanDerWaalsContact O-N 3.08Å; R293-K295 PolarHBondContact O-N 3.48Å
296	H	33.9	Very low	40.6	Very low	189 Å²	189	126.5 Å²	126.5	88%	0.875	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.8	13.6	172.4	-83.6	15.8	0	0	0	114.3	V294	V294-H296 PolarHBondContact O-N 3.26Å
297	G	32.5	Very low	38.4	Very low	54 Å²	54	132.8 Å²	132.8	56%	0.557	69%	0.693	S	S	*	*	S	Bend	trans	-94.7	138.9	153.4	0	0	0	0	0	110.4	V294 A299	V294-G297 PolarHBondContact O-N 2.88Å; G297-A299 PolarHBondContact O-N 2.87Å; G297-A299 VanDerWaalsContact O-N 3.08Å
298	K	34.9	Very low	36.7	Very low	200 Å²	200	138.3 Å²	138.3	87%	0.87	71%	0.709	S	S	*	*			trans	-66.3	108.1	168.7	-82.7	-167.2	174.4	-170.1	0	109.4	L300	K298-L300 PolarHBondContact O-N 2.87Å; K298-L300 VanDerWaalsContact O-N 3.11Å
299	A	29.3	Very low	35.5	Very low	103 Å²	103	135.7 Å²	135.7	85%	0.851	71%	0.708	S	S	*	*			trans	-66.2	105.2	159.6	0	0	0	0	0	107.9	G297	G297-A299 PolarHBondContact O-N 2.87Å; G297-A299 VanDerWaalsContact O-N 3.08Å
300	L	34.1	Very low	34.5	Very low	126 Å²	126	139.8 Å²	139.8	66%	0.66	73%	0.73	S	S	*	*			trans	-107.1	29.3	178.9	-162	99.2	0	0	0	111.8	K298	K298-L300 PolarHBondContact O-N 2.87Å; K298-L300 VanDerWaalsContact O-N 3.11Å
301	W	29.4	Very low	33.5	Very low	241 Å²	241	137.5 Å²	137.5	91%	0.913	73%	0.73	S	S	*	*			trans	-145	98.8	173.2	-63.3	114.1	0	0	0	109.3
302	E	27.5	Very low	32.9	Very low	181 Å²	181	139.3 Å²	139.3	85%	0.846	74%	0.743	S	S	*	*			trans	-135.2	118.7	164.5	-179.5	166.1	-139.4	0	0	107.8
303	N	29.6	Very low	32.4	Very low	168 Å²	168	145.2 Å²	145.2	90%	0.898	77%	0.765	S	S	*	*			trans	170.6	132.1	153.9	-93.1	-28.6	0	0	0	109.9
304	G	30.4	Very low	31.7	Very low	63 Å²	63	143.5 Å²	143.5	65%	0.649	78%	0.778	S	S	*	*			trans	102.9	70.7	146.3	0	0	0	0	0	120.4
305	T	30	Very low	31	Very low	133 Å²	133	143.5 Å²	143.5	82%	0.816	78%	0.783	S	S	*	*			trans	69.2	158.3	135	45.5	0	0	0	0	123
306	Y	27.5	Very low	30.4	Very low	222 Å²	222	143.1 Å²	143.1	87%	0.871	79%	0.794	S	S	*	*			trans	78	109.8	172.6	-76.3	-77.2	0	0	0	119.8
307	Q	35.1	Very low	30.1	Very low	162 Å²	162	139.2 Å²	139.2	76%	0.757	79%	0.788	S	S	*	*			trans	-70.4	144.6	156.7	-61.1	162.2	-69.2	0	0	109.6
308	H	26.8	Very low	30.1	Very low	169 Å²	169	141.7 Å²	141.7	78%	0.782	80%	0.797	S	S	*	*				168.8	153.3	114.1	-90.4	-71.2	0	0	0	111.7
309	S	30.9	Very low	30.1	Very low	100 Å²	100	139.6 Å²	139.6	70%	0.699	79%	0.79	S	S	*	*			trans	75.6	120.1	153.3	-64.3	0	0	0	0	121.6
310	I	30.4	Very low	30.1	Very low	149 Å²	149	144.6 Å²	144.6	76%	0.764	79%	0.787	S	S	*	*			trans	80.8	91.4	134.6	-60.3	170.5	0	0	0	118
311	S	29	Very low	30.1	Very low	95 Å²	95	146.5 Å²	146.5	66%	0.664	80%	0.798	S	S	*	*			trans	25.4	136.2	130.1	66.8	0	0	0	0	122.3
312	S	31.8	Very low	30.2	Very low	112 Å²	112	142.8 Å²	142.8	78%	0.783	80%	0.795	S	S	*	*			trans	58.6	92.2	131.8	-55.3	0	0	0	0	119.5
313	L	31.5	Very low	30.5	Very low	180 Å²	180	144.9 Å²	144.9	94%	0.942	80%	0.801	S	S	*	*			trans	-132.9	118	140.4	-81.1	-178.7	0	0	0	111.1
314	A	29.1	Very low	30.5	Very low	89 Å²	89	140.3 Å²	140.3	74%	0.736	79%	0.794	S	S	*	*			trans	-85.7	176.6	161.5	0	0	0	0	0	110.5
315	S	27.1	Very low	30.5	Very low	115 Å²	115	148.7 Å²	148.7	80%	0.804	81%	0.806	S	S	*	*			trans	74.4	84.5	166.1	-55.9	0	0	0	0	118.2
316	V	27.3	Very low	30.7	Very low	155 Å²	155	151.1 Å²	151.1	94%	0.939	81%	0.808	S	S	*	*				-119.6	132.5	126.8	-179.8	0	0	0	0	107.7
317	S	28.4	Very low	30.8	Very low	106 Å²	106	147.9 Å²	147.9	74%	0.741	81%	0.806	S	S	*	*			trans	-104.9	161.3	-168.5	58.9	0	0	0	0	113.5
318	S	31.5	Very low	30.8	Very low	106 Å²	106	148.6 Å²	148.6	74%	0.741	81%	0.806	S	S	*	*			trans	43.2	91.1	150.2	-165.8	0	0	0	0	118.5
319	Q	35.1	Very low	30.8	Very low	156 Å²	156	148.5 Å²	148.5	73%	0.729	81%	0.81	S	S	*	*			trans	-178.9	106.5	136	-106.9	170.2	71	0	0	114.3
320	R	30.7	Very low	31	Very low	209 Å²	209	151.3 Å²	151.3	79%	0.789	81%	0.812	S	S	*	*				161.9	149.7	119.7	-90.2	170.6	178.6	77.3	4	113.5
321	N	33.4	Very low	30.9	Very low	166 Å²	166	153.7 Å²	153.7	89%	0.888	82%	0.817	S	S	*	*			trans	-70.2	144.3	165.9	-62	-43.7	0	0	0	110.5
322	L	31.2	Very low	31.3	Very low	163 Å²	163	157.8 Å²	157.8	85%	0.853	83%	0.83	S	S	*	*			trans	-129.4	56.2	179.6	-104.4	167.5	0	0	0	113.3
323	F	33.3	Very low	31	Very low	224 Å²	224	159.9 Å²	159.9	98%	0.982	83%	0.833	S	S	*	*			trans	-138.2	73.9	157.5	-83.6	-66.7	0	0	0	110
324	G	30.1	Very low	30.9	Very low	72 Å²	72	155.8 Å²	155.8	74%	0.742	82%	0.819	S	S	*	*			trans	-120.4	147.5	164.5	0	0	0	0	0	108.9
325	R	31.1	Very low	30.9	Very low	239 Å²	239	156.4 Å²	156.4	90%	0.902	82%	0.818	S	S	*	*			trans	-67.9	152.5	-174.5	-72.4	-176.3	172	-136.5	-1.8	112.3
326	Q	33	Very low	31.3	Very low	185 Å²	185	160.9 Å²	160.9	86%	0.864	82%	0.819	S	S	*	*			trans	-63.4	138.3	155.8	-69.2	-178.3	-15.2	0	0	109.3
327	D	30.9	Very low	31.6	Very low	154 Å²	154	161.3 Å²	161.3	82%	0.824	81%	0.808	S	S	*	*			trans	-137	145.4	151.2	-94.5	-53	0	0	0	109.1
328	K	33.4	Very low	31.8	Very low	176 Å²	176	164.3 Å²	164.3	77%	0.765	81%	0.808	S	S	*	*			trans	-84.8	122.2	-171.9	-67	176.2	-179.6	175.2	0	111
329	I	28.7	Very low	31.6	Very low	168 Å²	168	165.5 Å²	165.5	86%	0.862	81%	0.806	S	S	*	*			trans	-85.9	109.9	161.3	-59.7	178.2	0	0	0	108.1
330	H	33.8	Very low	31.4	Very low	158 Å²	158	169.5 Å²	169.5	73%	0.731	81%	0.814	S	S	*	*			trans	-76.5	136.3	164.4	-83.4	-108.6	0	0	0	109.5
331	K	29.6	Very low	31.2	Very low	200 Å²	200	163 Å²	163	87%	0.87	81%	0.813	S	S	*	*			trans	-66.3	136.4	165.5	-66.8	-178	176.5	-174.8	0	109.5
332	L	35.6	Very low	30.9	Very low	181 Å²	181	162.3 Å²	162.3	95%	0.948	81%	0.807	S	S	*	*			trans	-141.5	156.3	138.8	-94.5	-177.1	0	0	0	109.3
333	D	27.2	Very low	30.8	Very low	156 Å²	156	164.6 Å²	164.6	83%	0.834	81%	0.806	S	S	*	*			trans	-101.2	-176.1	-164.7	-141.4	-54.9	0	0	0	112.8
334	S	28.7	Very low	30.9	Very low	93 Å²	93	159.5 Å²	159.5	65%	0.65	79%	0.794	S	S	*	*			trans	-87.1	170.5	-167.6	62.1	0	0	0	0	115.4
335	S	29	Very low	30.9	Very low	103 Å²	103	163.1 Å²	163.1	72%	0.72	80%	0.795	S	S	*	*			trans	78.2	124.5	171.9	80.1	0	0	0	0	117.9
336	Y	34.3	Very low	31	Very low	209 Å²	209	157.6 Å²	157.6	82%	0.82	78%	0.783	S	S	*	*				-164.8	120.2	118.4	-110.2	-78.3	0	0	0	112
337	F	35.5	Very low	31.1	Very low	163 Å²	163	155.2 Å²	155.2	72%	0.715	77%	0.772	S	S	*	*			trans	30.4	112	155.1	-78.8	-106.4	0	0	0	124.3
338	K	30.7	Very low	31.5	Very low	170 Å²	170	154.9 Å²	154.9	74%	0.739	77%	0.765	S	S	*	*				39.8	117.7	116.9	-71.1	179.2	176.3	173.3	0	121.8
339	N	28	Very low	31.5	Very low	130 Å²	130	150.7 Å²	150.7	70%	0.695	75%	0.751	S	S	*	*				80	116.1	122.5	-69.8	-10.9	0	0	0	124
340	R	30.8	Very low	31.9	Very low	241 Å²	241	149 Å²	149	91%	0.909	74%	0.738	S	S	*	*			trans	84.5	113.2	132.1	-69.4	179.7	176.9	-164.7	-1.1	121.6
341	G	26.1	Very low	32	Very low	73 Å²	73	150 Å²	150	75%	0.753	74%	0.736	S	S	*	*			trans	120.9	156.9	136.1	0	0	0	0	0	117
342	I	28.9	Very low	31.8	Very low	150 Å²	150	147.5 Å²	147.5	77%	0.769	73%	0.733	S	S	*	*			cis	-164.6	133.7	-25.4	-136.4	171.4	0	0	0	110.1
343	Y	29.1	Very low	31.9	Very low	211 Å²	211	145.4 Å²	145.4	83%	0.827	72%	0.721	S	S	*	*			trans	60.8	165.4	178.2	-70.2	-101	0	0	0	115.8
344	T	34.5	Very low	31.9	Very low	118 Å²	118	147 Å²	147	72%	0.724	72%	0.715	S	S	*	*			cis	-137.4	150.3	16.6	52.8	0	0	0	0	114.2
345	L	29.4	Very low	31.8	Very low	148 Å²	148	147.1 Å²	147.1	78%	0.775	72%	0.716	S	S	*	*			trans	47.5	125.4	131	-161.6	80.8	0	0	0	119.6
346	N	34	Very low	31.8	Very low	122 Å²	122	148.4 Å²	148.4	65%	0.652	71%	0.71	S	S	*	*			cis	-166.5	177	-17	-109.5	17.1	0	0	0	105.1
347	E	35.6	Very low	31.5	Very low	135 Å²	135	149 Å²	149	63%	0.631	71%	0.711	S	S	*	*			cis	-147.6	-151.2	2.7	-131.4	160.4	75.4	0	0	106.8
348	H	38.3	Very low	31	Very low	148 Å²	148	150.4 Å²	150.4	69%	0.685	71%	0.713	S	S	*	*			cis	-144.8	127.6	0.3	-158.3	69.9	0	0	0	105.1
349	D	33.9	Very low	31	Very low	87 Å²	87	151.1 Å²	151.1	47%	0.465	72%	0.716	S	S	.	*				48.8	130.8	90.1	-83.6	-3.4	0	0	0	115.5
350	K	36.2	Very low	31.5	Very low	133 Å²	133	149.3 Å²	149.3	58%	0.578	71%	0.711	S	S	*	*			cis	-166.1	156.7	-5.3	-121.3	160.1	-170.2	128.1	0	107.3
351	Y	35.7	Very low	31.3	Very low	180 Å²	180	145.7 Å²	145.7	71%	0.706	70%	0.704	S	S	*	*			cis	-120.1	-166.7	4.9	-74.4	-87.3	0	0	0	109.1
352	N	27.1	Very low	31.4	Very low	147 Å²	147	151.6 Å²	151.6	79%	0.786	71%	0.71	S	S	*	*			cis	63.4	153.9	25.9	-57	-84	0	0	0	114.3
353	I	35.9	Very low	31.2	Very low	137 Å²	137	150.5 Å²	150.5	70%	0.703	71%	0.71	S	S	*	*			cis	-140.4	156.4	10.9	-52.6	159.8	0	0	0	105.7
354	R	28.3	Very low	32.1	Very low	190 Å²	190	145.3 Å²	145.3	72%	0.717	70%	0.702	S	S	*	*			cis	-156.3	160	28	-139	164	-174.8	131	1.5	107.3	H356	R354-H356 PolarHBondContact NE-CD2 3.21Å; R354-H356 PolarHBondContact NE-NE2 3.22Å; R354-H356 PolarHBondContact NH2-NE2 2.98Å
355	S	26.2	Very low	31.6	Very low	94 Å²	94	146 Å²	146	66%	0.657	70%	0.701	S	S	*	*			cis	86.4	154	11.5	87.4	0	0	0	0	118.8
356	H	29.7	Very low	31.5	Very low	131 Å²	131	147.2 Å²	147.2	61%	0.606	70%	0.7	S	S	*	*			trans	90.9	140.8	-170.1	-57.9	-41.5	0	0	0	116.2	R354	R354-H356 PolarHBondContact NE-CD2 3.21Å; R354-H356 PolarHBondContact NE-NE2 3.22Å; R354-H356 PolarHBondContact NH2-NE2 2.98Å
357	R	26.8	Very low	31.3	Very low	221 Å²	221	148.5 Å²	148.5	83%	0.834	71%	0.707	S	S	*	*			cis	-153.8	130.6	2.4	-116.9	176.5	-168.1	-178.4	4.7	108
358	Y	26.5	Very low	30.8	Very low	193 Å²	193	145.4 Å²	145.4	76%	0.757	71%	0.711	S	S	*	*				97.2	122.3	86	-111.9	-126.9	0	0	0	118.3
359	K	30.3	Very low	31	Very low	184 Å²	184	143.8 Å²	143.8	80%	0.8	71%	0.714	S	S	*	*			trans	79.5	155.7	146.6	-76.7	-164.3	171	-171.1	0	123.4
360	P	38.6	Very low	30.7	Very low	93 Å²	93	146.5 Å²	146.5	60%	0.604	73%	0.728	S	S	*	*			trans	-142	-164.7	-152.1	35.3	-8.9	0	0	0	116.9
361	H	26.7	Very low	30.5	Very low	165 Å²	165	146 Å²	146	76%	0.764	74%	0.737	S	S	*	*			trans	72.9	145.6	171.9	-53.7	-61.9	0	0	0	115.7
362	F	26.8	Very low	30.3	Very low	197 Å²	197	144.4 Å²	144.4	86%	0.864	74%	0.739	S	S	*	*				-155.5	-179.3	56	-109.1	-95.9	0	0	0	115.2
363	V	25.3	Very low	30.3	Very low	127 Å²	127	147.2 Å²	147.2	77%	0.77	74%	0.739	S	S	*	*			trans	-149.6	-179.4	170.8	-124.6	0	0	0	0	106.8
364	P	48.6	Very low	29.8	Very low	101 Å²	101	146 Å²	146	66%	0.656	73%	0.73	S	S	*	*			cis	-126	-135.8	-27.2	28.2	-2.8	0	0	0	109.8
365	N	24.4	Very low	29.8	Very low	134 Å²	134	145.6 Å²	145.6	72%	0.717	73%	0.734	S	S	*	*			trans	80.8	156.1	152.4	-72.8	6.5	0	0	0	121.3
366	F	27.8	Very low	29.8	Very low	172 Å²	172	149.6 Å²	149.6	75%	0.754	74%	0.742	S	S	*	*			cis	-172.9	173.8	-35.1	-136.3	-100.6	0	0	0	108.4
367	N	27.8	Very low	30.4	Very low	150 Å²	150	148.6 Å²	148.6	80%	0.802	75%	0.747	S	S	*	*			trans	69	149.5	176.1	-48.1	-33.8	0	0	0	115
368	G	25.8	Very low	30.4	Very low	69 Å²	69	142.1 Å²	142.1	71%	0.711	74%	0.736	S	S	*	*			cis	115.6	155.4	10.3	0	0	0	0	0	111.3
369	P	43.2	Very low	30.5	Very low	114 Å²	114	141.5 Å²	141.5	74%	0.74	74%	0.74	S	S	*	*			cis	-140.7	178.5	-1.7	44.7	-27.3	0	0	0	116.5
370	N	27.1	Very low	30.4	Very low	144 Å²	144	139.2 Å²	139.2	77%	0.77	74%	0.735	S	S	*	*			trans	61.5	156.4	140.9	-69	-5.4	0	0	0	125.5
371	T	32.8	Very low	30.1	Very low	122 Å²	122	140.7 Å²	140.7	75%	0.748	74%	0.738	S	S	*	*			trans	66.2	119.5	161	41.7	0	0	0	0	118.4
372	I	30.1	Very low	30.5	Very low	148 Å²	148	139.5 Å²	139.5	76%	0.759	73%	0.732	S	S	*	*			cis	91.1	139.4	37.9	-66	167.5	0	0	0	113.2
373	R	26.9	Very low	30.8	Very low	206 Å²	206	135.8 Å²	135.8	78%	0.777	72%	0.722	S	S	*	*			trans	78	144.5	170.2	-86.1	171.3	-178.7	-119.1	10.4	116.1
374	Q	25.5	Very low	31	Very low	110 Å²	110	140.3 Å²	140.3	51%	0.514	73%	0.725	S	S	.	*			cis	-162.2	167.3	-4.7	-146.4	162.2	-26.5	0	0	113.7
375	F	29	Very low	30.4	Very low	182 Å²	182	143.8 Å²	143.8	80%	0.798	73%	0.73	S	S	*	*			trans	81.9	133.8	152.8	-73.2	-60.3	0	0	0	123.6
376	Q	26.1	Very low	31.1	Very low	178 Å²	178	149.1 Å²	149.1	83%	0.832	74%	0.74	S	S	*	*			trans	-83.1	-175.2	159.4	-113.9	-177.7	-20.6	0	0	110.4
377	P	42.6	Very low	31.9	Very low	111 Å²	111	149.9 Å²	149.9	72%	0.721	75%	0.746	S	S	*	*			cis	-124.4	-128.8	-1.1	27.9	-1	0	0	0	110.7
378	S	26.8	Very low	32.2	Very low	85 Å²	85	148.2 Å²	148.2	59%	0.594	75%	0.745	S	S	*	*			cis	-169.9	141.5	-3.3	29.1	0	0	0	0	112.8
379	Q	28.8	Very low	32.7	Very low	180 Å²	180	155.7 Å²	155.7	84%	0.841	75%	0.754	S	S	*	*			trans	61.8	175.5	145.8	-67.9	172.2	-13.3	0	0	120
380	I	28.5	Very low	32.2	Very low	135 Å²	135	155 Å²	155	69%	0.692	76%	0.757	S	S	*	*				-165.7	160.1	-58	-143.3	164.8	0	0	0	109.5
381	N	32	Very low	32.3	Very low	125 Å²	125	151.4 Å²	151.4	67%	0.668	76%	0.755	S	S	*	*			trans	65.2	164.9	167.9	-72	18.1	0	0	0	117.9
382	E	34.5	Very low	32.2	Very low	139 Å²	139	155.2 Å²	155.2	65%	0.65	76%	0.764	S	S	*	*			cis	-155	146.7	0.5	-133.4	164.9	-95.1	0	0	115.8
383	N	33.7	Very low	32.4	Very low	119 Å²	119	156.4 Å²	156.4	64%	0.636	77%	0.766	S	S	*	*			trans	11.4	144.5	148.7	-54	-20.3	0	0	0	124.3
384	W	29.7	Very low	33.2	Very low	222 Å²	222	152.3 Å²	152.3	84%	0.841	77%	0.767	S	S	*	*				171.9	169.2	99.8	-91.4	107.2	0	0	0	115.7
385	K	36	Very low	33.4	Very low	175 Å²	175	155.8 Å²	155.8	76%	0.761	78%	0.783	S	S	*	*			trans	-90.9	156.9	-172.5	-58.2	174.3	176.8	178.8	0	114.8
386	R	39.3	Very low	33.5	Very low	246 Å²	246	153.4 Å²	153.4	93%	0.928	78%	0.784	S	S	*	*				176.4	151	121.7	-94.5	157	-165.9	-88.5	2.5	113.8
387	H	43.2	Very low	33.9	Very low	188 Å²	188	151.4 Å²	151.4	87%	0.87	78%	0.783	S	S	*	*			trans	-110	151.3	166.4	-63.5	-91.3	0	0	0	110.6
388	S	35.9	Very low	33.9	Very low	114 Å²	114	150.7 Å²	150.7	80%	0.797	78%	0.779	S	S	*	*			trans	154.5	153.9	157.2	-77.3	0	0	0	0	110.5
389	Y	35.2	Very low	33.9	Very low	226 Å²	226	156.5 Å²	156.5	89%	0.886	79%	0.789	S	S	*	*			cis	-158.7	-172.8	-30.1	-130.8	-84.8	0	0	0	107.6
390	A	33.5	Very low	34	Very low	99 Å²	99	154.2 Å²	154.2	82%	0.818	78%	0.782	S	S	*	*			trans	-65.6	177.2	-169.6	0	0	0	0	0	118.9
391	G	29	Very low	33.9	Very low	70 Å²	70	154.8 Å²	154.8	72%	0.722	79%	0.785	S	S	*	*			trans	132.9	102.5	171.6	0	0	0	0	0	111.1
392	E	29.3	Very low	33.9	Very low	201 Å²	201	155.2 Å²	155.2	94%	0.939	79%	0.787	S	S	*	*				103.8	152.8	52	-170.6	160.3	-142.5	0	0	111.6
393	Q	35.8	Very low	34	Very low	173 Å²	173	156.2 Å²	156.2	81%	0.808	80%	0.797	S	S	*	*			trans	-83.1	170.7	-167	-60	-80.4	-12	0	0	112.3
394	P	42.3	Very low	33.8	Very low	121 Å²	121	161.5 Å²	161.5	79%	0.786	81%	0.808	S	S	*	*				-142.3	175	87.1	37.7	-21.3	0	0	0	115.9
395	E	30.9	Very low	33.6	Very low	182 Å²	182	154.5 Å²	154.5	85%	0.85	80%	0.797	S	S	*	*			trans	-64.7	159.9	-179.8	-48	168.3	123.3	0	0	114.1
396	T	30.9	Very low	33.2	Very low	133 Å²	133	153.2 Å²	153.2	82%	0.816	80%	0.798	S	S	*	*				-178	122.6	128.3	-75.7	0	0	0	0	111.6
397	V	33.7	Very low	32.7	Very low	136 Å²	136	148.2 Å²	148.2	82%	0.824	79%	0.79	S	S	*	*			trans	-103.4	146.9	148.6	-100.3	0	0	0	0	106.2
398	P	42.1	Very low	31.8	Very low	96 Å²	96	149.7 Å²	149.7	62%	0.623	79%	0.788	S	S	*	*				-162.8	-177.6	66.5	42.1	-19.3	0	0	0	119.6
399	Y	28.6	Very low	31.3	Very low	206 Å²	206	149.2 Å²	149.2	81%	0.808	78%	0.78	S	S	*	*			trans	79.8	143.4	135.4	-95.5	-51.2	0	0	0	124
400	L	30.4	Very low	31.2	Very low	133 Å²	133	145.6 Å²	145.6	70%	0.696	78%	0.776	S	S	*	*			trans	72.6	103.7	148.9	-63.1	176.5	0	0	0	121.8
401	L	26.9	Very low	30.9	Very low	146 Å²	146	148.2 Å²	148.2	76%	0.764	78%	0.776	S	S	*	*				82.5	155.4	118.5	-79.5	176.5	0	0	0	123.1
402	L	31.4	Very low	31.9	Very low	134 Å²	134	150.5 Å²	150.5	70%	0.702	78%	0.779	S	S	*	*			trans	73.4	97.2	155.5	-114.2	69	0	0	0	119.4	R404	L402-R404 PolarHBondContact O-N 3Å
403	N	35.5	Very low	33	Very low	161 Å²	161	146.8 Å²	146.8	86%	0.861	77%	0.772	S	S	*	*			trans	-52.4	124.3	143.9	-71.6	-57.7	0	0	0	110.5
404	R	30.5	Very low	32.8	Very low	230 Å²	230	142 Å²	142	87%	0.868	77%	0.769	S	S	*	*			trans	-138.2	93.4	157.3	-144.9	179.2	-160.4	168.6	6.4	106.6	L402	L402-R404 PolarHBondContact O-N 3Å
405	A	25.1	Very low	32.2	Very low	74 Å²	74	142.4 Å²	142.4	61%	0.612	77%	0.765	S	S	*	*				67.2	96.1	59.8	0	0	0	0	0	113.2
406	L	27.4	Very low	32.2	Very low	149 Å²	149	144.8 Å²	144.8	78%	0.78	77%	0.766	S	S	*	*			trans	69.4	142.9	134.4	-74.9	163.8	0	0	0	120.9
407	N	28.6	Very low	32.1	Very low	141 Å²	141	147.9 Å²	147.9	75%	0.754	77%	0.768	S	S	*	*			trans	75.4	154.4	156.7	-57.5	-30.9	0	0	0	115.7
408	R	24.8	Very low	32	Very low	219 Å²	219	150.3 Å²	150.3	83%	0.826	77%	0.767	S	S	*	*			cis	-155.4	179.6	23.3	-151.2	178	-174	-166.7	3.3	112.4
409	T	26.1	Very low	32	Very low	104 Å²	104	151.8 Å²	151.8	64%	0.638	78%	0.777	S	S	*	*			trans	74	120.1	148.5	36.5	0	0	0	0	121.4
410	N	32.3	Very low	32.1	Very low	149 Å²	149	145.8 Å²	145.8	80%	0.797	77%	0.765	S	S	*	*				110.1	100	127.2	-67.6	1.8	0	0	0	122
411	N	28.2	Very low	31.9	Very low	154 Å²	154	146 Å²	146	82%	0.824	77%	0.767	S	S	*	*			trans	-53.6	174	134.2	-69	-16.8	0	0	0	111.6
412	P	48.8	Very low	32	Very low	119 Å²	119	143.2 Å²	143.2	77%	0.773	76%	0.76	S	S	*	*			cis	-138.3	-176	27	39.2	-17.9	0	0	0	115.9
413	P	53.6	Low	31.9	Very low	122 Å²	122	143.7 Å²	143.7	79%	0.792	76%	0.762	S	S	*	*			cis	-112.4	-160.5	1.9	46	-34.4	0	0	0	111.9
414	G	31.1	Very low	31.5	Very low	73 Å²	73	140.8 Å²	140.8	75%	0.753	75%	0.754	S	S	*	*			cis	167.8	-160.5	2	0	0	0	0	0	111
415	N	30.2	Very low	31.5	Very low	130 Å²	130	136.3 Å²	136.3	70%	0.695	75%	0.752	S	S	*	*			cis	-160.9	81.4	-10.6	-151.3	20.5	0	0	0	113.1
416	W	29.8	Very low	31.5	Very low	232 Å²	232	136.3 Å²	136.3	88%	0.879	75%	0.753	S	S	*	*			trans	71.4	148	173.4	-51	85.3	0	0	0	117.3
417	K	29.5	Very low	31.4	Very low	197 Å²	197	133.7 Å²	133.7	86%	0.857	75%	0.746	S	S	*	*			cis	-131.5	168.6	12.9	-75.9	-176.3	175.6	179.6	0	114.1
418	K	31.4	Very low	31.4	Very low	187 Å²	187	132.1 Å²	132.1	81%	0.813	75%	0.747	S	S	*	*			trans	-44.9	156.5	164.6	-104.4	-176.3	176.3	-170.5	0	114
419	P	41.6	Very low	31.6	Very low	128 Å²	128	126.2 Å²	126.2	83%	0.831	74%	0.739	S	S	*	*				-114.8	-142.9	51.4	42.3	-37.2	0	0	0	115.5
420	S	30.7	Very low	31.8	Very low	80 Å²	80	130.5 Å²	130.5	56%	0.559	74%	0.743	S	S	*	*			trans	-163.5	-175	-167.8	50	0	0	0	0	112.2
421	D	27	Very low	31.5	Very low	138 Å²	138	129.1 Å²	129.1	74%	0.738	73%	0.732	S	S	*	*			trans	84.1	150.9	158.8	-64.7	-67.8	0	0	0	121.7
422	S	28.4	Very low	31.5	Very low	86 Å²	86	124.9 Å²	124.9	60%	0.601	73%	0.725	S	S	*	*				-171.6	176.1	-50.8	46.7	0	0	0	0	110.8
423	L	29	Very low	30.6	Very low	145 Å²	145	128.3 Å²	128.3	76%	0.759	72%	0.724	S	S	*	*			trans	62.4	99.4	155.8	-72.8	163	0	0	0	121.7
424	S	28.3	Very low	29.4	Very low	99 Å²	99	126.6 Å²	126.6	69%	0.692	72%	0.72	S	S	*	*				55.5	-168.5	119.1	73.6	0	0	0	0	121.2
425	V	28.8	Very low	29.2	Very low	136 Å²	136	127.7 Å²	127.7	82%	0.824	72%	0.716	S	S	*	*			trans	71.6	133.7	175.8	-178.7	0	0	0	0	116.1
426	A	25.7	Very low	29.2	Very low	75 Å²	75	128.6 Å²	128.6	62%	0.62	72%	0.716	S	S	*	*			cis	-166.5	-169.5	-21.9	0	0	0	0	0	109.4
427	S	26.2	Very low	29.2	Very low	93 Å²	93	124.6 Å²	124.6	65%	0.65	71%	0.706	S	S	*	*			trans	40.6	109.6	138.3	59.3	0	0	0	0	118.2
428	S	27.8	Very low	29.1	Very low	108 Å²	108	122.2 Å²	122.2	76%	0.755	70%	0.703	S	S	*	*				72.1	170.1	86.1	89	0	0	0	0	113.1
429	S	29.8	Very low	28.9	Very low	95 Å²	95	117.7 Å²	117.7	66%	0.664	70%	0.701	S	S	*	*			cis	-162.7	144	4.9	17.1	0	0	0	0	109.9
430	R	29.9	Very low	29.2	Very low	194 Å²	194	117.4 Å²	117.4	73%	0.732	70%	0.699	S	S	*	*				65.8	125.7	126.1	-169.3	177	-179.1	-133.5	-24.8	120.2
431	E	25.6	Very low	29.2	Very low	120 Å²	120	117.6 Å²	117.6	56%	0.561	71%	0.705	S	S	*	*			trans	65.8	147.5	153.9	-70.5	155.9	-157.3	0	0	118.7	Y433	E431-Y433 HydrophobicContact CB-CD2 4.26Å; E431-Y433 HydrophobicContact CB-CE2 4.22Å; E431-Y433 HydrophobicContact CG-CD2 4.25Å; E431-Y433 HydrophobicContact CG-CE2 3.77Å
432	G	27.9	Very low	29.5	Very low	66 Å²	66	120.1 Å²	120.1	68%	0.68	71%	0.713	S	S	*	*			cis	154.1	-164	-10.5	0	0	0	0	0	114.9
433	Y	30.8	Very low	29.6	Very low	191 Å²	191	120.2 Å²	120.2	75%	0.749	71%	0.713	S	S	*	*			trans	72.7	124	161.3	-70	-76.7	0	0	0	121.3	E431	E431-Y433 HydrophobicContact CB-CD2 4.26Å; E431-Y433 HydrophobicContact CB-CE2 4.22Å; E431-Y433 HydrophobicContact CG-CD2 4.25Å; E431-Y433 HydrophobicContact CG-CE2 3.77Å
434	A	28.2	Very low	29.6	Very low	85 Å²	85	122.9 Å²	122.9	70%	0.702	72%	0.719	S	S	*	*				81.5	85.8	124.7	0	0	0	0	0	121.7
435	S	27.1	Very low	29.7	Very low	96 Å²	96	122.1 Å²	122.1	67%	0.671	72%	0.719	S	S	*	*				78.5	163.7	105	-146	0	0	0	0	122
436	H	30	Very low	29.6	Very low	149 Å²	149	123.4 Å²	123.4	69%	0.69	72%	0.721	S	S	*	*			trans	74.8	114.7	153.3	-73.1	-57.2	0	0	0	122.5
437	H	29	Very low	29.9	Very low	148 Å²	148	130.9 Å²	130.9	69%	0.685	73%	0.733	S	S	*	*				94.1	117.1	126.8	-80.6	-56.1	0	0	0	122.5
438	N	28.5	Very low	30.2	Very low	147 Å²	147	133.6 Å²	133.6	79%	0.786	74%	0.74	S	S	*	*			trans	93.6	144.2	135.7	-60.5	-11.3	0	0	0	120.4
439	A	26.3	Very low	30.3	Very low	92 Å²	92	132.4 Å²	132.4	76%	0.76	74%	0.737	S	S	*	*			trans	-104.7	-161.3	175.7	0	0	0	0	0	108.1
440	P	47.8	Very low	30.4	Very low	123 Å²	123	134.7 Å²	134.7	80%	0.799	74%	0.737	S	S	*	*			cis	-142.5	-149	13.5	44.6	-22.5	0	0	0	114.4
441	A	32.2	Very low	30.4	Very low	84 Å²	84	135.2 Å²	135.2	69%	0.694	74%	0.739	S	S	*	*			trans	77.5	133.9	171.9	0	0	0	0	0	116.5
442	Q	32.9	Very low	30.7	Very low	190 Å²	190	138.1 Å²	138.1	89%	0.888	75%	0.75	S	S	*	*			cis	72.5	136.5	44.5	-70.8	-168.1	9.5	0	0	113.4
443	S	30.8	Very low	30.7	Very low	88 Å²	88	140.3 Å²	140.3	62%	0.615	75%	0.75	S	S	*	*			cis	-159.8	138.8	-3	-166.8	0	0	0	0	113.1
444	F	28.8	Very low	30.7	Very low	201 Å²	201	138.1 Å²	138.1	88%	0.882	76%	0.757	S	S	*	*			trans	64.2	164.3	147.9	-85.3	-129.3	0	0	0	121.4
445	A	28.9	Very low	30.9	Very low	83 Å²	83	141.6 Å²	141.6	69%	0.686	76%	0.763	S	S	*	*			trans	46.9	87.3	167.4	0	0	0	0	0	117.3
446	N	28.2	Very low	30.9	Very low	163 Å²	163	145.2 Å²	145.2	87%	0.872	77%	0.774	S	S	*	*				-152.7	132.3	73	-91.3	-45.3	0	0	0	113.2
447	R	32.1	Very low	30.9	Very low	232 Å²	232	141.7 Å²	141.7	88%	0.875	77%	0.771	S	S	*	*			trans	-139.7	135.5	175	-163.2	-168.2	-67.1	-159.8	0.8	107.1
448	L	31.1	Very low	30.9	Very low	150 Å²	150	141.9 Å²	141.9	79%	0.785	78%	0.777	S	S	*	*			trans	68.9	148.7	-159.7	-60.5	78.4	0	0	0	112.2
449	A	30.1	Very low	31.1	Very low	84 Å²	84	145.9 Å²	145.9	69%	0.694	78%	0.781	S	S	*	*			cis	-134.7	123	-2.7	0	0	0	0	0	109.7
450	Q	31.9	Very low	31.4	Very low	142 Å²	142	147.5 Å²	147.5	66%	0.664	78%	0.777	S	S	*	*				85.7	116.3	97.7	-75.9	-156.5	35.6	0	0	117.3
451	R	31	Very low	30.8	Very low	206 Å²	206	147.6 Å²	147.6	78%	0.777	78%	0.781	S	S	*	*			trans	84.9	125.7	132	-75.2	179.3	172.3	-179.6	-1	122
452	K	31	Very low	30.8	Very low	181 Å²	181	150.4 Å²	150.4	79%	0.787	78%	0.784	S	S	*	*			trans	72.4	145.1	143.4	-68.7	-173.3	173	-169.8	0	117.6
453	T	28.7	Very low	30.8	Very low	112 Å²	112	148 Å²	148	69%	0.687	78%	0.782	S	S	*	*			cis	-166.6	136.4	-13.6	16.4	0	0	0	0	110.2
454	T	30.7	Very low	31.1	Very low	145 Å²	145	155.1 Å²	155.1	89%	0.89	80%	0.795	S	S	*	*			trans	-163.7	167.4	151.3	15.2	0	0	0	0	109.7
455	N	30.9	Very low	31.6	Very low	157 Å²	157	156.9 Å²	156.9	84%	0.84	80%	0.796	S	S	*	*			trans	-129.6	-178	-163.2	-71.1	-51.7	0	0	0	113.9
456	L	27.3	Very low	31.8	Very low	173 Å²	173	158.2 Å²	158.2	91%	0.906	80%	0.8	S	S	*	*			trans	93.7	121.9	166.6	-149.7	71.7	0	0	0	114.4
457	A	31.5	Very low	32.3	Very low	74 Å²	74	160.1 Å²	160.1	61%	0.612	80%	0.801	S	S	*	*			cis	-151.8	176.1	-8.5	0	0	0	0	0	112.5
458	D	29.4	Very low	32.8	Very low	153 Å²	153	156.2 Å²	156.2	82%	0.818	80%	0.798	S	S	*	*			trans	57.8	91.9	159.5	-60.6	-11.7	0	0	0	120.9
459	R	31.3	Very low	33.7	Very low	230 Å²	230	153.3 Å²	153.3	87%	0.868	80%	0.804	S	S	*	*			trans	-169	140.1	135.6	-109.8	163.9	176.1	133	-2.6	114.8
460	N	33.1	Very low	34.7	Very low	127 Å²	127	154 Å²	154	68%	0.679	80%	0.799	S	S	*	*			trans	57.6	100.3	149.9	-56.4	-8.6	0	0	0	119.8	N462	N460-N462 VanDerWaalsContact C-N 3.31Å; N460-N462 PolarHBondContact O-N 3.44Å
461	S	34.1	Very low	35.4	Very low	125 Å²	125	150.9 Å²	150.9	87%	0.874	79%	0.788	S	S	*	*			trans	-76.5	66.6	169	58.2	0	0	0	0	113.8	V463	S461-V463 PolarHBondContact O-N 3.48Å
462	N	32.5	Very low	36.1	Very low	142 Å²	142	147.2 Å²	147.2	76%	0.759	78%	0.783	S	S	*	*			trans	-79.7	90.8	170.8	-84.8	-49	0	0	0	111.4	N460	N460-N462 VanDerWaalsContact C-N 3.31Å; N460-N462 PolarHBondContact O-N 3.44Å
463	V	32.8	Very low	36.9	Very low	141 Å²	141	145.9 Å²	145.9	86%	0.855	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-74.7	142.2	164.6	-179.2	0	0	0	0	109.2	S461	S461-V463 PolarHBondContact O-N 3.48Å
464	R	38.3	Very low	37.7	Very low	236 Å²	236	145.4 Å²	145.4	89%	0.891	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-74.7	142.9	-161	-72.6	-177.9	168.1	-157.6	-4.1	114.2
465	R	38.8	Very low	38.4	Very low	238 Å²	238	144.8 Å²	144.8	90%	0.898	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-56.9	133.6	156.9	-57.6	173.5	-172.5	161.4	1.5	109.6
466	S	32.9	Very low	38.9	Very low	111 Å²	111	143.3 Å²	143.3	78%	0.776	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-69.8	145.7	154.2	41.8	0	0	0	0	109.3	N468	S466-N468 PolarHBondContact O-N 3.02Å
467	F	40	Very low	39.8	Very low	204 Å²	204	141.4 Å²	141.4	90%	0.895	73%	0.73	S	S	*	*	S	Bend	trans	-79.9	103.5	168.2	-98.1	-110.1	0	0	0	108.5
468	N	42	Very low	40.6	Very low	150 Å²	150	144.8 Å²	144.8	80%	0.802	73%	0.733	S	S	*	*			trans	-169.9	136.2	143.8	-92.3	-16.6	0	0	0	109	S466 T470	S466-N468 PolarHBondContact O-N 3.02Å; N468-T470 PolarHBondContact O-N 3.18Å
469	G	50.3	Low	41.5	Very low	88 Å²	88	145 Å²	145	91%	0.907	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	58.1	-156.5	0	0	0	0	0	117.1
470	T	50.2	Low	42.4	Very low	98 Å²	98	143.5 Å²	143.5	60%	0.601	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.9	-15.8	-178.1	50.6	0	0	0	0	116.5	N468 N472 H473	N468-T470 PolarHBondContact O-N 3.18Å; T470-N472 PolarHBondContact O-N 2.91Å; T470-N472 VanDerWaalsContact O-N 3.07Å; T470-H473 PolarHBondContact O-N 3.03Å
471	D	47	Very low	43	Very low	78 Å²	78	141.6 Å²	141.6	42%	0.417	71%	0.711	S	S	.	*	H	α-helix	trans	-55.8	-29.2	-176.2	-175.1	34.5	0	0	0	114.4	R475	D471-R475 VanDerWaalsContact CG-NH1 3.34Å; D471-R475 VanDerWaalsContact CG-NH2 3.32Å; D471-R475 PolarHBondContact O-N 2.83Å; D471-R475 IonicContact OD1-CZ 2.83Å; D471-R475 IonicContact OD1-NH1 3.89Å; D471-R475 IonicContact OD1-NH2 2.7Å; D471-R475 PolarHBondContact OD1-NH2 3.47Å; D471-R475 IonicContact OD2-CZ 3.12Å; D471-R475 IonicContact OD2-NH1 3.51Å; D471-R475 PolarHBondContact OD2-NH1 2.86Å; D471-R475 IonicContact OD2-NH2 2.91Å; D471-R475 PolarHBondContact OD2-NH2 3.04Å
472	N	45.6	Very low	44	Very low	128 Å²	128	137.8 Å²	137.8	68%	0.684	68%	0.683	S	S	*	*	H	α-helix	trans	-69.4	-34.4	-179.4	-71.9	-14	0	0	0	113.8	T470 F476	T470-N472 PolarHBondContact O-N 2.91Å; T470-N472 VanDerWaalsContact O-N 3.07Å; N472-F476 PolarHBondContact O-N 3.37Å
473	H	48.3	Very low	45.3	Very low	153 Å²	153	134.9 Å²	134.9	71%	0.708	67%	0.671	S	S	*	*	H	α-helix	trans	-72.7	-37.8	178.8	-86.2	35.8	0	0	0	111.8	T470 R475 F476 L477	T470-H473 PolarHBondContact O-N 3.03Å; H473-R475 PolarHBondContact O-N 3.3Å; H473-F476 PolarHBondContact O-N 3.47Å; H473-F476 VanDerWaalsContact O-N 3.16Å; H473-L477 PolarHBondContact O-N 3.05Å
474	I	45.4	Very low	46.4	Very low	103 Å²	103	130.6 Å²	130.6	53%	0.528	64%	0.643	S	S	.	*	H	α-helix	trans	-62	-44.5	178.8	-58.4	176	0	0	0	110.2	F476 Q478	I474-F476 PolarHBondContact O-N 2.83Å; I474-Q478 WeakPolarHBondContact O-CB 3.48Å; I474-Q478 PolarHBondContact O-N 3.17Å; I474-Q478 VanDerWaalsContact O-N 3.07Å
475	R	45.7	Very low	47.2	Very low	131 Å²	131	125.3 Å²	125.3	49%	0.494	63%	0.628	S	S	.	*	H	α-helix	trans	-63.7	-36	174.3	-69.1	-161.9	-175.5	92.3	22.4	113.5	D471 H473 Q478 Q479	D471-R475 VanDerWaalsContact CG-NH1 3.34Å; D471-R475 VanDerWaalsContact CG-NH2 3.32Å; D471-R475 PolarHBondContact O-N 2.83Å; D471-R475 IonicContact OD1-CZ 2.83Å; D471-R475 IonicContact OD1-NH1 3.89Å; D471-R475 IonicContact OD1-NH2 2.7Å; D471-R475 PolarHBondContact OD1-NH2 3.47Å; D471-R475 IonicContact OD2-CZ 3.12Å; D471-R475 IonicContact OD2-NH1 3.51Å; D471-R475 PolarHBondContact OD2-NH1 2.86Å; D471-R475 IonicContact OD2-NH2 2.91Å; D471-R475 PolarHBondContact OD2-NH2 3.04Å; H473-R475 PolarHBondContact O-N 3.3Å; R475-Q478 PolarHBondContact O-N 3.1Å; R475-Q479 WeakPolarHBondContact O-CG 3.47Å; R475-Q479 PolarHBondContact O-N 3.42Å; R475-Q479 VanDerWaalsContact O-N 3.16Å
476	F	41.1	Very low	48	Very low	127 Å²	127	121.3 Å²	121.3	56%	0.557	62%	0.62	S	S	*	*	H	α-helix	trans	-70.2	-39.3	-179	-153.6	-94.6	0	0	0	112.3	N472 H473 I474 Q479	N472-F476 PolarHBondContact O-N 3.37Å; H473-F476 PolarHBondContact O-N 3.47Å; H473-F476 VanDerWaalsContact O-N 3.16Å; I474-F476 PolarHBondContact O-N 2.83Å; F476-Q479 PolarHBondContact O-N 2.87Å
477	L	45.4	Very low	49.5	Very low	133 Å²	133	116.9 Å²	116.9	70%	0.696	59%	0.588	S	S	*	*	H	α-helix	trans	-63	-43.1	170.8	-75.8	166.9	0	0	0	111.6	H473 Q479 R480	H473-L477 PolarHBondContact O-N 3.05Å; L477-Q479 PolarHBondContact O-N 3.44Å; L477-R480 PolarHBondContact O-N 2.75Å
478	Q	49.2	Very low	51	Low	145 Å²	145	111.1 Å²	111.1	68%	0.678	57%	0.569	S	S	*	*	H	α-helix	trans	-66.3	-22	-178.5	-161.8	170.6	16.2	0	0	113.4	I474 R475	I474-Q478 WeakPolarHBondContact O-CB 3.48Å; I474-Q478 PolarHBondContact O-N 3.17Å; I474-Q478 VanDerWaalsContact O-N 3.07Å; R475-Q478 PolarHBondContact O-N 3.1Å
479	Q	48.3	Very low	52.2	Low	157 Å²	157	113.1 Å²	113.1	73%	0.734	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-5	176.5	-76.9	-177.3	-18.5	0	0	115	R475 F476 L477	R475-Q479 WeakPolarHBondContact O-CG 3.47Å; R475-Q479 PolarHBondContact O-N 3.42Å; R475-Q479 VanDerWaalsContact O-N 3.16Å; F476-Q479 PolarHBondContact O-N 2.87Å; L477-Q479 PolarHBondContact O-N 3.44Å
480	R	49.3	Very low	52.5	Low	199 Å²	199	112.5 Å²	112.5	75%	0.751	55%	0.552	S	S	*	*	S	Bend	trans	-118.1	9.7	-178.7	-77.9	-172.2	170.5	-169.5	-2.3	115.3	L477 P482	L477-R480 PolarHBondContact O-N 2.75Å; R480-P482 VanDerWaalsContact O-CD 3.22Å; R480-P482 WeakPolarHBondContact O-CD 3.36Å
481	M	45.3	Very low	53.6	Low	87 Å²	87	111.6 Å²	111.6	43%	0.429	54%	0.54	S	S	.	.			trans	-78.3	114.1	173.1	-75.2	-160.9	136.8	0	0	111.9	R829	M481-R829 VanDerWaalsContact CA-O 3.28Å; M481-R829 WeakPolarHBondContact CA-O 3.31Å; M481-R829 WeakPolarHBondContact CB-O 3.34Å; M481-R829 HydrophobicContact CE-CB 3.88Å; M481-R829 WeakPolarHBondContact CG-O 3.45Å
482	P	55.9	Low	55	Low	44 Å²	44	108.5 Å²	108.5	29%	0.286	52%	0.524	S	S	.	.			trans	-67.5	142.5	169.5	27.8	-34.7	0	0	0	111.3	R480 T487 F491 P828 R829 R830	R480-P482 VanDerWaalsContact O-CD 3.22Å; R480-P482 WeakPolarHBondContact O-CD 3.36Å; P482-T487 HydrophobicContact CB-CG2 4.33Å; P482-T487 HydrophobicContact CG-CG2 4.03Å; P482-F491 HydrophobicContact CG-CE1 4.36Å; P482-P828 HydrophobicContact CG-CB 3.47Å; P482-P828 VanDerWaalsContact CG-CB 3.47Å; P482-P828 HydrophobicContact CG-CG 4Å; P482-R829 WeakPolarHBondContact CD-O 3.42Å; P482-R830 VanDerWaalsContact O-CA 3.27Å; P482-R830 WeakPolarHBondContact O-CA 3.34Å; P482-R830 PolarHBondContact O-N 2.89Å
483	T	59.2	Low	56.2	Low	81 Å²	81	110.9 Å²	110.9	50%	0.497	52%	0.523	S	S	.	.			trans	-62.9	142.4	177.2	44.3	0	0	0	0	111.5	E485 H486 K831	T483-E485 VanDerWaalsContact C-N 3.25Å; T483-E485 PolarHBondContact O-N 2.64Å; T483-H486 PolarHBondContact O-N 3.1Å; T483-K831 WeakPolarHBondContact CA-O 3.4Å
484	L	55.6	Low	57.3	Low	51 Å²	51	107 Å²	107	27%	0.267	51%	0.508	S	S	.	.	G	3₁₀ helix	trans	-62.5	-29.6	-167.6	166.2	59.9	0	0	0	113	H486 T487 R830 K831 H832	L484-H486 PolarHBondContact O-N 2.87Å; L484-H486 VanDerWaalsContact O-N 3.07Å; L484-T487 WeakPolarHBondContact CD1-OG1 3.31Å; L484-T487 PolarHBondContact O-N 3.46Å; L484-T487 PolarHBondContact O-OG1 3.02Å; L484-R830 HydrophobicContact CB-CB 4.46Å; L484-R830 HydrophobicContact CB-CG 4.49Å; L484-R830 HydrophobicContact CD1-CG 3.8Å; L484-R830 VanDerWaalsContact CD1-NE 3.31Å; L484-K831 VanDerWaalsContact CB-C 3.46Å; L484-K831 PolarHBondContact N-O 3.26Å; L484-H832 HydrophobicContact CB-CB 3.96Å; L484-H832 HydrophobicContact CD2-CB 3.9Å; L484-H832 HydrophobicContact CG-CB 4.3Å; L484-H832 WeakPolarHBondContact CG-CD2 3.48Å
485	E	56.6	Low	58.4	Low	126 Å²	126	105.9 Å²	105.9	59%	0.589	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-55.4	-18.2	175.1	34.6	-145.2	114.2	0	0	116	T483 H832	T483-E485 VanDerWaalsContact C-N 3.25Å; T483-E485 PolarHBondContact O-N 2.64Å; E485-H832 WeakPolarHBondContact CB-CE1 3.19Å; E485-H832 IonicContact OE1-CE1 2.74Å; E485-H832 PolarHBondContact OE1-CE1 3.41Å; E485-H832 IonicContact OE1-ND1 2.73Å; E485-H832 PolarHBondContact OE1-ND1 2.83Å; E485-H832 IonicContact OE2-CE1 3.18Å
486	H	54.1	Low	59.6	Low	154 Å²	154	106.3 Å²	106.3	71%	0.713	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-119.9	12.9	176.1	-65	-16.9	0	0	0	113.9	T483 L484	T483-H486 PolarHBondContact O-N 3.1Å; L484-H486 PolarHBondContact O-N 2.87Å; L484-H486 VanDerWaalsContact O-N 3.07Å
487	T	65.2	Low	61.1	Low	18 Å²	18	104 Å²	104	11%	0.11	49%	0.491	C	S	.	.			trans	-94.5	107.5	179.6	60.9	0	0	0	0	113.2	P482 L484 F491 L492 R830	P482-T487 HydrophobicContact CB-CG2 4.33Å; P482-T487 HydrophobicContact CG-CG2 4.03Å; L484-T487 WeakPolarHBondContact CD1-OG1 3.31Å; L484-T487 PolarHBondContact O-N 3.46Å; L484-T487 PolarHBondContact O-OG1 3.02Å; T487-F491 HydrophobicContact CG2-CD1 4.22Å; T487-F491 HydrophobicContact CG2-CE1 4.32Å; T487-L492 HydrophobicContact CG2-CD2 4.39Å; T487-R830 HydrophobicContact CG2-CG 4.39Å
488	T	71.8	Confident	61.6	Low	83 Å²	83	99.4 Å²	99.4	51%	0.509	47%	0.466	S	S	.	.			trans	-69.3	151.7	177.4	60.2	0	0	0	0	112.3	S490 F491 L492	T488-S490 PolarHBondContact O-N 2.95Å; T488-S490 VanDerWaalsContact O-N 3.17Å; T488-S490 PolarHBondContact OG1-OG 3.28Å; T488-F491 WeakPolarHBondContact O-CB 3.46Å; T488-F491 PolarHBondContact O-N 2.69Å; T488-F491 VanDerWaalsContact OG1-CB 3.3Å; T488-F491 WeakPolarHBondContact OG1-CB 3.36Å; T488-L492 WeakPolarHBondContact O-CD1 3.5Å; T488-L492 VanDerWaalsContact O-CG 3.27Å; T488-L492 WeakPolarHBondContact O-CG 3.28Å; T488-L492 PolarHBondContact O-N 3.17Å
489	K	66.7	Low	62.3	Low	192 Å²	192	95 Å²	95	84%	0.835	45%	0.452	S	S	*	.	H	α-helix	trans	-58.4	-29.8	-179.2	-77.2	-177.7	177.4	177.5	0	113.5	R493	K489-R493 PolarHBondContact O-N 3.16Å
490	S	57.7	Low	62.8	Low	74 Å²	74	95.5 Å²	95.5	52%	0.517	45%	0.448	S	S	.	.	H	α-helix	trans	-70.5	-49.8	176	46.1	0	0	0	0	112.5	T488 L492 R493 N494	T488-S490 PolarHBondContact O-N 2.95Å; T488-S490 VanDerWaalsContact O-N 3.17Å; T488-S490 PolarHBondContact OG1-OG 3.28Å; S490-L492 PolarHBondContact O-N 3.07Å; S490-L492 VanDerWaalsContact O-N 3.14Å; S490-R493 WeakPolarHBondContact O-CA 3.47Å; S490-R493 WeakPolarHBondContact O-CB 3.49Å; S490-R493 PolarHBondContact O-N 3.2Å; S490-N494 PolarHBondContact O-N 3.46Å; S490-N494 PolarHBondContact O-OD1 3.33Å
491	F	73.1	Confident	63.5	Low	79 Å²	79	92 Å²	92	35%	0.346	44%	0.444	S	S	.	.	H	α-helix	trans	-50.6	-39.2	175	-164.9	-150.5	0	0	0	111.3	P482 T487 T488 W495 P828	P482-F491 HydrophobicContact CG-CE1 4.36Å; T487-F491 HydrophobicContact CG2-CD1 4.22Å; T487-F491 HydrophobicContact CG2-CE1 4.32Å; T488-F491 WeakPolarHBondContact O-CB 3.46Å; T488-F491 PolarHBondContact O-N 2.69Å; T488-F491 VanDerWaalsContact OG1-CB 3.3Å; T488-F491 WeakPolarHBondContact OG1-CB 3.36Å; F491-W495 PolarHBondContact O-N 3.31Å; F491-P828 HydrophobicContact CD1-CG 3.53Å; F491-P828 VanDerWaalsContact CD2-CD 3.48Å; F491-P828 HydrophobicContact CD2-CG 3.84Å; F491-P828 HydrophobicContact CE1-CB 4.38Å; F491-P828 HydrophobicContact CE1-CG 3.5Å; F491-P828 VanDerWaalsContact CE1-CG 3.5Å; F491-P828 HydrophobicContact CE2-CG 3.76Å; F491-P828 HydrophobicContact CG-CG 3.71Å; F491-P828 HydrophobicContact CZ-CB 4.2Å; F491-P828 HydrophobicContact CZ-CG 3.59Å; F491-P828 WeakPolarHBondContact O-CD 3.34Å
492	L	76.8	Confident	63.8	Low	14 Å²	14	93.1 Å²	93.1	7%	0.073	45%	0.451	C	S	.	.	H	α-helix	trans	-79.7	-20.3	178.9	-60.3	168.7	0	0	0	115.4	T487 T488 S490 R829 R830	T487-L492 HydrophobicContact CG2-CD2 4.39Å; T488-L492 WeakPolarHBondContact O-CD1 3.5Å; T488-L492 VanDerWaalsContact O-CG 3.27Å; T488-L492 WeakPolarHBondContact O-CG 3.28Å; T488-L492 PolarHBondContact O-N 3.17Å; S490-L492 PolarHBondContact O-N 3.07Å; S490-L492 VanDerWaalsContact O-N 3.14Å; L492-R829 HydrophobicContact CD2-CG 4.01Å; L492-R829 PolarHBondContact O-NH2 3.24Å; L492-R830 HydrophobicContact CD1-CG 4.49Å; L492-R830 HydrophobicContact CD2-CG 3.38Å
493	R	69.4	Low	63.4	Low	177 Å²	177	95.4 Å²	95.4	67%	0.668	46%	0.461	S	S	*	.	H	α-helix	trans	-80.6	-47	172	-176.6	-175	-179.7	-166.7	0.8	109.6	K489 S490 W495 R496 I497	K489-R493 PolarHBondContact O-N 3.16Å; S490-R493 WeakPolarHBondContact O-CA 3.47Å; S490-R493 WeakPolarHBondContact O-CB 3.49Å; S490-R493 PolarHBondContact O-N 3.2Å; R493-W495 VanDerWaalsContact C-N 3.34Å; R493-W495 PolarHBondContact O-N 3.01Å; R493-R496 WeakPolarHBondContact O-CB 3.28Å; R493-R496 PolarHBondContact O-N 3.01Å; R493-R496 VanDerWaalsContact O-N 3.13Å; R493-I497 HydrophobicContact CG-CD1 4.03Å; R493-I497 WeakPolarHBondContact O-CG1 3.45Å; R493-I497 PolarHBondContact O-N 2.98Å
494	N	71.3	Confident	63	Low	73 Å²	73	98.5 Å²	98.5	39%	0.39	47%	0.47	S	S	.	.	H	α-helix	trans	-56.1	-47.6	175.2	-75.7	35.8	0	0	0	110.9	S490 R496 I497 E498	S490-N494 PolarHBondContact O-N 3.46Å; S490-N494 PolarHBondContact O-OD1 3.33Å; N494-R496 VanDerWaalsContact C-N 3.29Å; N494-R496 PolarHBondContact O-N 3.06Å; N494-I497 CarbonylContact O-C 3.59Å; N494-I497 WeakPolarHBondContact O-CA 3.36Å; N494-I497 WeakPolarHBondContact O-CB 3.33Å; N494-I497 PolarHBondContact O-N 3.12Å; N494-E498 WeakPolarHBondContact O-CB 3.21Å; N494-E498 WeakPolarHBondContact O-CG 3.38Å; N494-E498 PolarHBondContact O-N 3.44Å
495	W	69.7	Low	62.7	Low	79 Å²	79	100.7 Å²	100.7	30%	0.299	49%	0.489	S	S	.	.	H	α-helix	trans	-65.1	-31	178.2	-163.1	73.9	0	0	0	114	F491 R493 I497 S499 S827 P828 R829	F491-W495 PolarHBondContact O-N 3.31Å; R493-W495 VanDerWaalsContact C-N 3.34Å; R493-W495 PolarHBondContact O-N 3.01Å; W495-I497 VanDerWaalsContact C-N 3.31Å; W495-S499 WeakPolarHBondContact O-CB 3.25Å; W495-S499 PolarHBondContact O-N 3.02Å; W495-S827 WeakPolarHBondContact CA-OG 3.3Å; W495-S827 VanDerWaalsContact CB-OG 3.23Å; W495-S827 WeakPolarHBondContact CB-OG 3.45Å; W495-S827 PolarHBondContact N-OG 3Å; W495-P828 WeakPolarHBondContact CB-O 2.84Å; W495-P828 VanDerWaalsContact CD1-CA 3.49Å; W495-P828 VanDerWaalsContact CD2-O 3.26Å; W495-R829 HydrophobicContact CD2-CG 4.32Å; W495-R829 HydrophobicContact CE3-CB 4.27Å; W495-R829 HydrophobicContact CE3-CG 3.74Å; W495-R829 HydrophobicContact CZ3-CB 4.25Å; W495-R829 HydrophobicContact CZ3-CG 3.99Å
496	R	70.9	Confident	62.2	Low	139 Å²	139	104.1 Å²	104.1	53%	0.525	51%	0.505	S	S	.	.	H	α-helix	trans	-64.6	-41.4	172.4	-172.7	-177.3	-85.3	146.6	-10.1	110.2	R493 N494 Y500	R493-R496 WeakPolarHBondContact O-CB 3.28Å; R493-R496 PolarHBondContact O-N 3.01Å; R493-R496 VanDerWaalsContact O-N 3.13Å; N494-R496 VanDerWaalsContact C-N 3.29Å; N494-R496 PolarHBondContact O-N 3.06Å; R496-Y500 HydrophobicContact CG-CD2 4.03Å; R496-Y500 HydrophobicContact CG-CE2 3.58Å; R496-Y500 WeakPolarHBondContact O-CD2 3.33Å; R496-Y500 PolarHBondContact O-N 3.22Å
497	I	71.2	Confident	61.3	Low	79 Å²	79	100.2 Å²	100.2	41%	0.405	50%	0.5	S	S	.	.	H	α-helix	trans	-68.4	-49.4	178.7	-65.4	163.3	0	0	0	110.2	R493 N494 W495 S499 Y500 L501	R493-I497 HydrophobicContact CG-CD1 4.03Å; R493-I497 WeakPolarHBondContact O-CG1 3.45Å; R493-I497 PolarHBondContact O-N 2.98Å; N494-I497 CarbonylContact O-C 3.59Å; N494-I497 WeakPolarHBondContact O-CA 3.36Å; N494-I497 WeakPolarHBondContact O-CB 3.33Å; N494-I497 PolarHBondContact O-N 3.12Å; W495-I497 VanDerWaalsContact C-N 3.31Å; I497-S499 VanDerWaalsContact C-N 3.32Å; I497-S499 PolarHBondContact O-N 2.81Å; I497-Y500 PolarHBondContact O-N 2.86Å; I497-L501 HydrophobicContact CG2-CD1 3.71Å; I497-L501 HydrophobicContact CG2-CG 4.3Å; I497-L501 WeakPolarHBondContact O-CG 3.43Å; I497-L501 PolarHBondContact O-N 2.68Å
498	E	56.4	Low	59.9	Low	36 Å²	36	106.5 Å²	106.5	17%	0.168	53%	0.531	C	S	.	.	H	α-helix	trans	-64.5	-33.1	178.5	-71.6	157.6	-170.4	0	0	112.6	N494 Y500 L501 N502 S826 S827	N494-E498 WeakPolarHBondContact O-CB 3.21Å; N494-E498 WeakPolarHBondContact O-CG 3.38Å; N494-E498 PolarHBondContact O-N 3.44Å; E498-Y500 VanDerWaalsContact C-N 3.31Å; E498-L501 PolarHBondContact O-N 3Å; E498-N502 WeakPolarHBondContact O-CB 3.36Å; E498-N502 PolarHBondContact O-N 2.99Å; E498-N502 PolarHBondContact O-ND2 2.97Å; E498-S826 WeakPolarHBondContact OE1-CB 3.45Å; E498-S826 PolarHBondContact OE1-OG 3.47Å; E498-S826 WeakPolarHBondContact OE2-CB 3.45Å; E498-S827 WeakPolarHBondContact OE2-CB 3.43Å; E498-S827 PolarHBondContact OE2-OG 2.88Å
499	S	63.7	Low	58.3	Low	53 Å²	53	108.7 Å²	108.7	37%	0.371	55%	0.547	S	S	.	.	H	α-helix	trans	-69.7	-25.3	172.6	-175.2	0	0	0	0	113.3	W495 I497	W495-S499 WeakPolarHBondContact O-CB 3.25Å; W495-S499 PolarHBondContact O-N 3.02Å; I497-S499 VanDerWaalsContact C-N 3.32Å; I497-S499 PolarHBondContact O-N 2.81Å
500	Y	58.8	Low	56.6	Low	167 Å²	167	106.7 Å²	106.7	66%	0.655	55%	0.545	S	S	*	.	H	α-helix	trans	-88.7	-24.2	172.6	-71.4	-51.9	0	0	0	112.7	R496 I497 E498	R496-Y500 HydrophobicContact CG-CD2 4.03Å; R496-Y500 HydrophobicContact CG-CE2 3.58Å; R496-Y500 WeakPolarHBondContact O-CD2 3.33Å; R496-Y500 PolarHBondContact O-N 3.22Å; I497-Y500 PolarHBondContact O-N 2.86Å; E498-Y500 VanDerWaalsContact C-N 3.31Å
501	L	64.6	Low	55.4	Low	127 Å²	127	108.6 Å²	108.6	67%	0.665	56%	0.558	S	S	*	*	H	α-helix	trans	-83.5	-25.5	177.2	-69.6	174	0	0	0	113.4	I497 E498	I497-L501 HydrophobicContact CG2-CD1 3.71Å; I497-L501 HydrophobicContact CG2-CG 4.3Å; I497-L501 WeakPolarHBondContact O-CG 3.43Å; I497-L501 PolarHBondContact O-N 2.68Å; E498-L501 PolarHBondContact O-N 3Å
502	N	50.7	Low	53.4	Low	109 Å²	109	113.3 Å²	113.3	58%	0.583	59%	0.587	S	S	*	*	S	Bend	trans	-100.3	13.8	176	-61.9	-54.3	0	0	0	113	E498 H504	E498-N502 WeakPolarHBondContact O-CB 3.36Å; E498-N502 PolarHBondContact O-N 2.99Å; E498-N502 PolarHBondContact O-ND2 2.97Å; N502-H504 VanDerWaalsContact C-N 3.32Å; N502-H504 PolarHBondContact O-N 3.38Å
503	D	48.9	Very low	51.3	Low	92 Å²	92	115.6 Å²	115.6	49%	0.492	61%	0.614	S	S	.	*			trans	-79.5	79.7	-179.4	-151.3	-29.3	0	0	0	110.3	S505	D503-S505 PolarHBondContact O-N 2.82Å; D503-S505 VanDerWaalsContact O-N 3.09Å; D503-S505 WeakPolarHBondContact OD1-CB 3.35Å; D503-S505 PolarHBondContact OD1-OG 2.89Å
504	H	49.9	Very low	49.5	Very low	147 Å²	147	113.1 Å²	113.1	68%	0.681	62%	0.624	S	S	*	*			trans	-81.8	36.4	179.5	-60.4	-43.3	0	0	0	112.9	N502 E506	N502-H504 VanDerWaalsContact C-N 3.32Å; N502-H504 PolarHBondContact O-N 3.38Å; H504-E506 VanDerWaalsContact C-N 3.3Å; H504-E506 PolarHBondContact O-N 2.79Å
505	S	48.7	Very low	47.6	Very low	97 Å²	97	113.9 Å²	113.9	68%	0.678	64%	0.64	S	S	*	*			trans	-73	-17.3	-178.6	39.8	0	0	0	0	114	D503	D503-S505 PolarHBondContact O-N 2.82Å; D503-S505 VanDerWaalsContact O-N 3.09Å; D503-S505 WeakPolarHBondContact OD1-CB 3.35Å; D503-S505 PolarHBondContact OD1-OG 2.89Å
506	E	46.4	Very low	45.7	Very low	198 Å²	198	118.9 Å²	118.9	93%	0.925	67%	0.672	S	S	*	*	S	Bend	trans	-109.4	74.1	166	-69.1	-165.4	167	0	0	111.8	H504	H504-E506 VanDerWaalsContact C-N 3.3Å; H504-E506 PolarHBondContact O-N 2.79Å
507	A	34.7	Very low	43.8	Very low	72 Å²	72	115.4 Å²	115.4	60%	0.595	68%	0.679	S	S	*	*			trans	-128.9	112.9	165.7	0	0	0	0	0	109.9
508	I	35.7	Very low	41.8	Very low	150 Å²	150	118 Å²	118	77%	0.769	69%	0.694	S	S	*	*			trans	-62.7	131.2	177	-63.3	171.6	0	0	0	108.8	D510	I508-D510 PolarHBondContact O-N 3.06Å
509	P	38.5	Very low	40.5	Very low	129 Å²	129	125.1 Å²	125.1	84%	0.838	72%	0.719	S	S	*	*			trans	-79.6	64.2	-174.1	33.1	-37.1	0	0	0	113	S511	P509-S511 PolarHBondContact O-N 3.26Å; P509-S511 VanDerWaalsContact O-N 3.16Å
510	D	30.7	Very low	38.8	Very low	149 Å²	149	130.7 Å²	130.7	80%	0.797	74%	0.737	S	S	*	*			trans	-73.1	96.8	164.8	-91	-26.4	0	0	0	110.3	I508	I508-D510 PolarHBondContact O-N 3.06Å
511	S	32.7	Very low	37.5	Very low	114 Å²	114	130.1 Å²	130.1	80%	0.797	74%	0.74	S	S	*	*			trans	-175.7	136.9	140.3	36.7	0	0	0	0	114.3	P509	P509-S511 PolarHBondContact O-N 3.26Å; P509-S511 VanDerWaalsContact O-N 3.16Å
512	N	32.2	Very low	35.7	Very low	179 Å²	179	126.7 Å²	126.7	96%	0.957	74%	0.736	S	S	*	*			trans	-91.4	126.8	148.1	-79.3	-71.1	0	0	0	108.5
513	G	32	Very low	34.8	Very low	62 Å²	62	131.7 Å²	131.7	64%	0.639	75%	0.748	S	S	*	*			trans	-179.9	106.5	170.6	0	0	0	0	0	110.5
514	S	31.4	Very low	33.8	Very low	124 Å²	124	134.8 Å²	134.8	87%	0.867	76%	0.764	S	S	*	*				82.9	146.4	69	72.9	0	0	0	0	113.1
515	A	32.7	Very low	32.6	Very low	89 Å²	89	134.8 Å²	134.8	74%	0.736	77%	0.769	S	S	*	*			cis	-168.4	152.1	-24.4	0	0	0	0	0	109.8
516	L	28.8	Very low	32.6	Very low	185 Å²	185	134.4 Å²	134.4	97%	0.969	77%	0.765	S	S	*	*			trans	-171	135.4	150.3	-135.8	67.4	0	0	0	110.2
517	G	31	Very low	31.8	Very low	66 Å²	66	132.1 Å²	132.1	68%	0.68	75%	0.754	S	S	*	*			cis	-179.7	-178.7	-6.4	0	0	0	0	0	112.6
518	D	28.4	Very low	31.7	Very low	134 Å²	134	133.7 Å²	133.7	72%	0.717	75%	0.752	S	S	*	*			trans	68.2	139	-178.3	-107.8	15.7	0	0	0	116.2
519	R	30.7	Very low	31.5	Very low	185 Å²	185	133.3 Å²	133.3	70%	0.698	75%	0.751	S	S	*	*			cis	-163.1	138.3	-2.8	-166.6	-175.9	-80.9	-142.3	-6	113.4
520	F	27.2	Very low	31	Very low	170 Å²	170	135.5 Å²	135.5	75%	0.746	75%	0.748	S	S	*	*			trans	56.7	157.6	156	-86.9	-131.8	0	0	0	119.5
521	E	31	Very low	31.1	Very low	154 Å²	154	133 Å²	133	72%	0.72	75%	0.747	S	S	*	*			cis	179.8	148.1	-22.5	177.4	171.1	-106.7	0	0	106.2
522	G	28.1	Very low	30.9	Very low	55 Å²	55	135 Å²	135	57%	0.567	75%	0.75	S	S	*	*			cis	170.4	167.4	-6.2	0	0	0	0	0	110.9
523	Y	30.2	Very low	30.7	Very low	215 Å²	215	130.9 Å²	130.9	84%	0.843	74%	0.74	S	S	*	*			trans	67.8	149.7	178	-65.2	-90.7	0	0	0	116.3
524	D	28.2	Very low	30.7	Very low	156 Å²	156	135.9 Å²	135.9	83%	0.834	75%	0.751	S	S	*	*			cis	-115.5	167	16.4	-75	-51.5	0	0	0	116.3
525	N	24.9	Very low	30.4	Very low	147 Å²	147	139.9 Å²	139.9	79%	0.786	75%	0.749	S	S	*	*			trans	-171.7	173.6	179	-157.8	26.8	0	0	0	108.5
526	P	49.6	Very low	30.2	Very low	89 Å²	89	142.3 Å²	142.3	58%	0.578	75%	0.754	S	S	*	*			cis	-119.1	-174	-20.5	23.5	1.8	0	0	0	113
527	E	29.6	Very low	30.3	Very low	150 Å²	150	141.5 Å²	141.5	70%	0.701	75%	0.745	S	S	*	*				167.9	155.4	94.2	-89.9	-72.2	81.8	0	0	109.2
528	N	31.6	Very low	30.3	Very low	105 Å²	105	142.8 Å²	142.8	56%	0.561	74%	0.744	S	S	*	*			cis	-147.6	-114.4	-18.3	-161.3	-37.6	0	0	0	108.5
529	L	31.4	Very low	30.3	Very low	143 Å²	143	148.2 Å²	148.2	75%	0.749	76%	0.755	S	S	*	*			cis	-148.9	82.6	-8.8	-152.8	177.6	0	0	0	111.5
530	K	29.6	Very low	30.5	Very low	174 Å²	174	147.1 Å²	147.1	76%	0.757	76%	0.762	S	S	*	*			trans	46.8	122.8	155.2	-56.4	173.7	-174	172.2	0	122.1
531	A	31.5	Very low	30.6	Very low	96 Å²	96	150.8 Å²	150.8	79%	0.793	77%	0.771	S	S	*	*				-171.3	140.3	114.4	0	0	0	0	0	108.8
532	N	28.2	Very low	30.4	Very low	158 Å²	158	148.7 Å²	148.7	85%	0.845	77%	0.773	S	S	*	*			cis	110.2	120.2	23.8	-103.6	13.5	0	0	0	112.8
533	A	29.6	Very low	30.5	Very low	91 Å²	91	151.8 Å²	151.8	75%	0.752	79%	0.786	S	S	*	*			trans	61.5	133.6	175.4	0	0	0	0	0	116.5
534	L	30.2	Very low	30.7	Very low	167 Å²	167	149 Å²	149	87%	0.874	79%	0.785	S	S	*	*			cis	69.1	89.3	37.9	-62.6	176.5	0	0	0	115.3
535	Y	26.8	Very low	30.8	Very low	208 Å²	208	148.5 Å²	148.5	82%	0.816	79%	0.787	S	S	*	*			trans	-170.6	125.3	134	-131	-97.8	0	0	0	112.4
536	T	28	Very low	31.3	Very low	140 Å²	140	150.6 Å²	150.6	86%	0.859	79%	0.789	S	S	*	*			trans	-169.3	93.6	150.1	15.1	0	0	0	0	111.9
537	H	31.5	Very low	30.3	Very low	168 Å²	168	156 Å²	156	78%	0.778	80%	0.804	S	S	*	*			trans	-98.2	163.7	140.7	-52.2	-71.3	0	0	0	106.4
538	S	29.5	Very low	30.3	Very low	94 Å²	94	154.5 Å²	154.5	66%	0.657	81%	0.807	S	S	*	*			cis	-157.4	166.9	12.7	67.6	0	0	0	0	111.1
539	R	29.9	Very low	30.2	Very low	248 Å²	248	155.2 Å²	155.2	94%	0.936	82%	0.821	S	S	*	*			trans	-137	105.7	140.6	-89.8	-170.7	171.7	-179.3	-3.5	108.4
540	L	34.5	Very low	30.5	Very low	162 Å²	162	156.4 Å²	156.4	85%	0.848	83%	0.827	S	S	*	*			trans	-109.5	132.4	166.3	-72	173.4	0	0	0	108.2
541	R	28.1	Very low	30.8	Very low	247 Å²	247	153.5 Å²	153.5	93%	0.932	83%	0.826	S	S	*	*			trans	-91.5	126.7	157	-122.6	-174.9	-172.1	-137.7	0.5	107.3
542	S	28.4	Very low	30.7	Very low	109 Å²	109	157.1 Å²	157.1	76%	0.762	83%	0.826	S	S	*	*			trans	-82.1	147.5	179.2	46.6	0	0	0	0	111.5
543	S	30.3	Very low	30.6	Very low	121 Å²	121	157.9 Å²	157.9	85%	0.846	83%	0.825	S	S	*	*			trans	-130.1	112.3	159.3	52.3	0	0	0	0	107.8
544	L	33.7	Very low	30.6	Very low	157 Å²	157	160.8 Å²	160.8	82%	0.822	82%	0.82	S	S	*	*			trans	-136.6	117.6	-178.8	-94.3	165.3	0	0	0	109.2
545	V	29	Very low	30.5	Very low	145 Å²	145	160.3 Å²	160.3	88%	0.879	81%	0.814	S	S	*	*			trans	-101.7	133.4	166.1	176.2	0	0	0	0	107.4
546	F	36.8	Very low	30.6	Very low	190 Å²	190	156 Å²	156	83%	0.833	81%	0.808	S	S	*	*			trans	-64.7	154	-170.3	-69.5	-104.4	0	0	0	114.3
547	K	28.2	Very low	30.6	Very low	204 Å²	204	156 Å²	156	89%	0.887	80%	0.803	S	S	*	*				-143	145.1	123.8	-75.9	-148.6	174	-168.7	0	111.4
548	P	30.6	Very low	30.5	Very low	118 Å²	118	152.6 Å²	152.6	77%	0.766	80%	0.799	S	S	*	*			trans	-99.8	167.6	179.9	39.2	-35.5	0	0	0	113.3
549	S	29.2	Very low	30.5	Very low	120 Å²	120	153.5 Å²	153.5	84%	0.839	80%	0.804	S	S	*	*			trans	-149.7	112.9	161.1	57.5	0	0	0	0	110.5
550	L	37.2	Very low	30.6	Very low	168 Å²	168	147.4 Å²	147.4	88%	0.88	79%	0.794	S	S	*	*			trans	-98.2	152.6	169.6	-74.7	169.7	0	0	0	110.3
551	P	35	Very low	30.4	Very low	113 Å²	113	146.1 Å²	146.1	73%	0.734	79%	0.793	S	S	*	*				-126.5	163.5	120.2	36.5	-30.6	0	0	0	110.3
552	E	29.6	Very low	30.3	Very low	171 Å²	171	137.3 Å²	137.3	80%	0.799	78%	0.779	S	S	*	*			cis	-173.6	168.2	-15	176.1	175.1	-175.9	0	0	106
553	Q	27.4	Very low	30.4	Very low	175 Å²	175	137.5 Å²	137.5	82%	0.818	78%	0.78	S	S	*	*			trans	90	136.3	172.5	-55.8	-172.9	9.8	0	0	117
554	K	28.1	Very low	30.5	Very low	151 Å²	151	136.3 Å²	136.3	66%	0.657	77%	0.772	S	S	*	*			cis	-164.3	122.4	-13.5	174	175.6	180	-177	0	111.7
555	E	29.5	Very low	30.3	Very low	158 Å²	158	136.1 Å²	136.1	74%	0.738	77%	0.772	S	S	*	*			trans	60	171.9	163.7	-59.5	156	-166.9	0	0	115.1
556	V	29.4	Very low	30.4	Very low	116 Å²	116	133.5 Å²	133.5	70%	0.703	76%	0.76	S	S	*	*			cis	-144.2	138.4	13.3	-175.3	0	0	0	0	110.9
557	N	27.3	Very low	30.1	Very low	140 Å²	140	130.3 Å²	130.3	75%	0.749	76%	0.756	S	S	*	*			trans	47.3	97.6	154.2	-59.5	-2.9	0	0	0	124.3
558	S	29.4	Very low	30.2	Very low	98 Å²	98	127.3 Å²	127.3	69%	0.685	75%	0.748	S	S	*	*				59.8	145.8	107.8	73.7	0	0	0	0	125.1
559	C	29.8	Very low	30.3	Very low	113 Å²	113	129.4 Å²	129.4	76%	0.764	75%	0.752	S	S	*	*			trans	78.2	143.3	155.6	-61.5	0	0	0	0	117.8
560	T	31.4	Very low	30.2	Very low	120 Å²	120	126.6 Å²	126.6	74%	0.736	74%	0.741	S	S	*	*			cis	-160	166.1	-6.6	9.6	0	0	0	0	111.5
561	T	30.1	Very low	29.9	Very low	135 Å²	135	124 Å²	124	83%	0.828	74%	0.738	S	S	*	*			trans	15.6	139.8	141.1	-40.8	0	0	0	0	119.5
562	G	26.8	Very low	29.7	Very low	62 Å²	62	128.1 Å²	128.1	64%	0.639	75%	0.747	S	S	*	*			cis	134.9	177.3	12.6	0	0	0	0	0	110.9
563	S	29.2	Very low	29.8	Very low	112 Å²	112	123.9 Å²	123.9	78%	0.783	75%	0.749	S	S	*	*			trans	69.1	133.2	-175	-158.3	0	0	0	0	114.4
564	S	32.8	Very low	30	Very low	96 Å²	96	121 Å²	121	67%	0.671	75%	0.748	S	S	*	*			cis	94.3	132.3	24.1	-55.9	0	0	0	0	115.2
565	N	29.8	Very low	30.2	Very low	153 Å²	153	122 Å²	122	82%	0.818	76%	0.755	S	S	*	*			trans	73.2	160.1	160.3	-56.1	-11.3	0	0	0	118.4
566	S	31.3	Very low	30.3	Very low	91 Å²	91	120.1 Å²	120.1	64%	0.636	76%	0.755	S	S	*	*			cis	-175.1	140.3	-42.9	53.7	0	0	0	0	111.7
567	T	30.2	Very low	31.1	Very low	122 Å²	122	120 Å²	120	75%	0.748	76%	0.756	S	S	*	*			trans	66.1	148.8	154.2	29.8	0	0	0	0	122.8
568	I	30.7	Very low	31.4	Very low	141 Å²	141	120.7 Å²	120.7	72%	0.723	75%	0.752	S	S	*	*			trans	82.4	126.5	144.1	-77.2	163.8	0	0	0	120.2
569	I	31.3	Very low	31.3	Very low	163 Å²	163	122.6 Å²	122.6	84%	0.836	75%	0.751	S	S	*	*			trans	31.3	133.6	147.6	-51.3	169.9	0	0	0	118.3
570	G	28.4	Very low	31.6	Very low	60 Å²	60	123.5 Å²	123.5	62%	0.619	75%	0.753	S	S	*	*			cis	139.7	154.8	4.5	0	0	0	0	0	112.6
571	S	30.5	Very low	32.8	Very low	115 Å²	115	122.8 Å²	122.8	80%	0.804	75%	0.75	S	S	*	*			trans	79	138.6	171.8	81.3	0	0	0	0	120.9
572	Q	30.5	Very low	32.7	Very low	198 Å²	198	123.8 Å²	123.8	93%	0.925	75%	0.75	S	S	*	*			trans	62.8	151.7	160.1	-60.1	-166.3	25.4	0	0	122.1
573	G	31.1	Very low	33.2	Very low	82 Å²	82	126.6 Å²	126.6	85%	0.845	76%	0.755	S	S	*	*			trans	120	98	153.8	0	0	0	0	0	116.3
574	S	32.3	Very low	34.3	Very low	114 Å²	114	126.7 Å²	126.7	80%	0.797	75%	0.753	S	S	*	*			trans	-135.1	133.5	175	57.9	0	0	0	0	112.1
575	E	31.8	Very low	34.2	Very low	172 Å²	172	128.4 Å²	128.4	80%	0.804	76%	0.759	S	S	*	*			trans	178.7	126.4	141.2	-101.3	176.4	179.7	0	0	110.1
576	T	31.6	Very low	34	Very low	119 Å²	119	127 Å²	127	73%	0.73	75%	0.752	S	S	*	*				67.2	172.8	87.2	79	0	0	0	0	114.2
577	P	46.5	Very low	34	Very low	113 Å²	113	128.7 Å²	128.7	73%	0.734	76%	0.758	S	S	*	*			cis	-117.6	-148.7	-6.5	32.3	-8.2	0	0	0	111.1
578	K	33	Very low	34	Very low	155 Å²	155	129 Å²	129	67%	0.674	75%	0.751	S	S	*	*			cis	-162.2	176.7	9.1	-153.9	177.6	168	-75.3	0	110.5
579	E	28.2	Very low	33.9	Very low	138 Å²	138	129.5 Å²	129.5	65%	0.645	75%	0.75	S	S	*	*			trans	71	156.4	170.5	-36.4	-52.5	16.5	0	0	116.4
580	V	36.7	Very low	33.7	Very low	133 Å²	133	128.4 Å²	128.4	81%	0.806	75%	0.745	S	S	*	*			cis	-144.3	159.7	-6.1	99.2	0	0	0	0	109
581	P	56.1	Low	33.6	Very low	104 Å²	104	130.8 Å²	130.8	68%	0.675	75%	0.748	S	S	*	*			trans	-120.3	178	-159.4	43.2	-32.4	0	0	0	115.9
582	D	28.5	Very low	33.5	Very low	157 Å²	157	132.5 Å²	132.5	84%	0.84	75%	0.748	S	S	*	*				-146.8	171.9	128	-131.6	-34.8	0	0	0	112.3
583	T	36.8	Very low	33.4	Very low	120 Å²	120	131.9 Å²	131.9	74%	0.736	74%	0.742	S	S	*	*			trans	-110.5	168.5	-160.8	37.9	0	0	0	0	114.3
584	P	51.7	Low	33.5	Very low	115 Å²	115	133.5 Å²	133.5	75%	0.747	74%	0.738	S	S	*	*			cis	-115.5	-149.8	12.3	23.4	3.4	0	0	0	112
585	T	30.2	Very low	33.5	Very low	131 Å²	131	135.8 Å²	135.8	80%	0.804	74%	0.74	S	S	*	*			cis	-157.8	168.8	21	-39.8	0	0	0	0	113.3
586	N	27	Very low	33.9	Very low	124 Å²	124	132.8 Å²	132.8	66%	0.663	74%	0.736	S	S	*	*			trans	-94.9	155.9	-178.4	-138.6	-3.7	0	0	0	110.3
587	V	31.3	Very low	33.5	Very low	126 Å²	126	135.3 Å²	135.3	76%	0.764	74%	0.739	S	S	*	*			cis	-160	161.6	32.8	179.5	0	0	0	0	108.2
588	Q	30.1	Very low	32.5	Very low	128 Å²	128	134.6 Å²	134.6	60%	0.598	74%	0.737	S	S	*	*			cis	-177.1	149.3	-38.9	-167	176.8	-27	0	0	109.7
589	H	27.8	Very low	32.3	Very low	152 Å²	152	133.8 Å²	133.8	70%	0.704	75%	0.745	S	S	*	*			trans	78.8	131.7	155.6	-84.8	-37.5	0	0	0	126.5
590	L	28.1	Very low	33	Very low	140 Å²	140	132.1 Å²	132.1	73%	0.733	75%	0.746	S	S	*	*			trans	90.4	92.6	135.5	-99.9	131.2	0	0	0	123.8
591	T	26.5	Very low	32.6	Very low	110 Å²	110	134.4 Å²	134.4	68%	0.675	75%	0.745	S	S	*	*				47.1	144.3	118.6	-19.7	0	0	0	0	124.3
592	D	28.1	Very low	31.3	Very low	151 Å²	151	136.7 Å²	136.7	81%	0.807	75%	0.75	S	S	*	*			trans	98.4	155.5	141.4	-98.3	-46.2	0	0	0	123
593	K	28.1	Very low	32.2	Very low	186 Å²	186	134.4 Å²	134.4	81%	0.809	74%	0.744	S	S	*	*			trans	-67.7	164.7	173.1	-74.2	179	178.9	177.2	0	111.1
594	P	34.1	Very low	31.8	Very low	116 Å²	116	135.2 Å²	135.2	75%	0.753	74%	0.743	S	S	*	*			cis	-153.3	-161.1	37	44.8	-22.3	0	0	0	117
595	L	31.8	Very low	30.8	Very low	161 Å²	161	137.6 Å²	137.6	84%	0.843	74%	0.744	S	S	*	*			trans	-90.2	141.3	152.9	-160.4	89.6	0	0	0	108.1
596	P	39.2	Very low	30.8	Very low	109 Å²	109	135.5 Å²	135.5	71%	0.708	74%	0.736	S	S	*	*				-154.4	-152.2	105.9	42.1	-22.2	0	0	0	113.9
597	E	23	Very low	30.8	Very low	172 Å²	172	137.6 Å²	137.6	80%	0.804	74%	0.741	S	S	*	*			trans	-102.4	160.1	-163.9	-57.2	153.6	97	0	0	116
598	S	25.4	Very low	31.1	Very low	99 Å²	99	135.6 Å²	135.6	69%	0.692	74%	0.738	S	S	*	*			trans	67.5	122.6	137.8	68.2	0	0	0	0	123.8
599	V	28.7	Very low	31.6	Very low	138 Å²	138	134.6 Å²	134.6	84%	0.836	74%	0.742	S	S	*	*			trans	72.4	158.4	130	174.6	0	0	0	0	117.1
600	P	44.3	Very low	31.7	Very low	102 Å²	102	136.7 Å²	136.7	66%	0.662	75%	0.75	S	S	*	*			cis	-129.1	162.6	-10.5	28.9	-7.3	0	0	0	118.9
601	K	27	Very low	31.6	Very low	182 Å²	182	138.1 Å²	138.1	79%	0.791	76%	0.755	S	S	*	*			trans	67.6	121.9	136	-75.3	175.4	174.7	178.2	0	125.7
602	L	29.8	Very low	31.6	Very low	151 Å²	151	140.4 Å²	140.4	79%	0.791	76%	0.757	S	S	*	*				75.3	160.5	126.1	-71.8	172.5	0	0	0	121.3
603	P	47.4	Very low	31.4	Very low	110 Å²	110	138.3 Å²	138.3	71%	0.714	75%	0.75	S	S	*	*			cis	-134.6	174.3	-9.9	36.4	-18	0	0	0	117.5
604	L	28.9	Very low	31.4	Very low	136 Å²	136	136.7 Å²	136.7	71%	0.712	75%	0.75	S	S	*	*			trans	112.8	116	130.2	-153.4	66.9	0	0	0	121
605	Q	30.1	Very low	31	Very low	165 Å²	165	140.5 Å²	140.5	77%	0.771	76%	0.757	S	S	*	*			trans	58.4	147.1	154.1	-72.5	168	-0.9	0	0	121.5
606	S	29.5	Very low	30.9	Very low	88 Å²	88	138.8 Å²	138.8	62%	0.615	75%	0.753	S	S	*	*			cis	-174.6	-174.4	-47.7	53.6	0	0	0	0	107.6
607	E	28.6	Very low	30.8	Very low	167 Å²	167	138.2 Å²	138.2	78%	0.78	75%	0.749	S	S	*	*			cis	-162.4	168.8	6	-146.7	150.3	119.8	0	0	112.4
608	A	35.7	Very low	31	Very low	85 Å²	85	138.6 Å²	138.6	70%	0.702	75%	0.751	S	S	*	*			trans	66.6	153.9	150.5	0	0	0	0	0	121.2
609	P	42.3	Very low	31	Very low	106 Å²	106	140.2 Å²	140.2	69%	0.688	75%	0.752	S	S	*	*			cis	-141.7	163.9	-32.1	37.9	-21	0	0	0	116.5
610	K	28.5	Very low	31	Very low	196 Å²	196	141.9 Å²	141.9	85%	0.852	75%	0.751	S	S	*	*			trans	69.8	153.1	150.2	-75.3	165.2	-177.1	178.9	0	119.5
611	M	25.7	Very low	30.1	Very low	170 Å²	170	141.8 Å²	141.8	84%	0.837	75%	0.752	S	S	*	*			cis	-162.9	176.3	-27	-121.9	-57.1	-151.9	0	0	111.3
612	H	27.1	Very low	30	Very low	158 Å²	158	140 Å²	140	73%	0.731	76%	0.756	S	S	*	*			trans	-83.9	154	-169.4	-102.8	-80.8	0	0	0	117.8
613	T	24.5	Very low	29.9	Very low	107 Å²	107	136.8 Å²	136.8	66%	0.656	75%	0.751	S	S	*	*				77.7	129	128.9	-65.7	0	0	0	0	123.1
614	L	27.7	Very low	29	Very low	153 Å²	153	138.5 Å²	138.5	80%	0.801	75%	0.754	S	S	*	*			trans	33.1	127.5	150.8	-64.3	168.1	0	0	0	121.7
615	Q	25.7	Very low	29.1	Very low	195 Å²	195	138 Å²	138	91%	0.911	75%	0.752	S	S	*	*				-151.4	152.8	127.6	-115.9	170.7	23.5	0	0	112.4
616	V	28.8	Very low	29.1	Very low	125 Å²	125	137.7 Å²	137.7	76%	0.758	75%	0.751	S	S	*	*			trans	-119.6	132.4	174.9	168.2	0	0	0	0	104
617	P	39	Very low	28.9	Very low	97 Å²	97	139.5 Å²	139.5	63%	0.63	76%	0.758	S	S	*	*				-158.7	173.9	85.8	43.7	-23.2	0	0	0	119.5
618	E	25.4	Very low	28.9	Very low	181 Å²	181	137.2 Å²	137.2	85%	0.846	76%	0.756	S	S	*	*			trans	71.4	153.5	140	-81.8	167.6	150.6	0	0	123.3
619	N	27	Very low	28.5	Very low	132 Å²	132	141.1 Å²	141.1	71%	0.706	77%	0.765	S	S	*	*			trans	-100.1	154.9	-179.9	-52.2	-82.7	0	0	0	109.7
620	H	28.7	Very low	27.9	Very low	174 Å²	174	139.7 Å²	139.7	81%	0.806	77%	0.77	S	S	*	*				165.2	138.2	108.3	-85.7	-66.4	0	0	0	113.9
621	S	25.2	Very low	27.9	Very low	99 Å²	99	139.5 Å²	139.5	69%	0.692	77%	0.771	S	S	*	*			trans	59.6	115.1	141.1	68.7	0	0	0	0	123.1
622	V	25.6	Very low	28	Very low	144 Å²	144	137.6 Å²	137.6	87%	0.873	77%	0.769	S	S	*	*				81.6	146.7	116.9	170.8	0	0	0	0	120.3
623	A	27	Very low	28.2	Very low	84 Å²	84	139.2 Å²	139.2	69%	0.694	78%	0.777	S	S	*	*			trans	88.3	95.5	158.1	0	0	0	0	0	121.7
624	L	28.9	Very low	28.4	Very low	146 Å²	146	139.2 Å²	139.2	76%	0.764	78%	0.781	S	S	*	*				85.8	147.8	112.3	-148.5	75	0	0	0	120.3
625	N	30.3	Very low	28.5	Very low	127 Å²	127	139.3 Å²	139.3	68%	0.679	78%	0.783	S	S	*	*			trans	70.8	140.3	171.4	-51.8	-46.8	0	0	0	116.7
626	Q	29	Very low	28.5	Very low	158 Å²	158	137.2 Å²	137.2	74%	0.738	78%	0.778	S	S	*	*			cis	174.3	139.5	-33.4	-113.3	-174.3	28	0	0	105.6
627	T	26.3	Very low	28.7	Very low	126 Å²	126	141.2 Å²	141.2	77%	0.773	78%	0.781	S	S	*	*			trans	73.7	148.4	164.1	63	0	0	0	0	121.6
628	T	29.3	Very low	28.2	Very low	119 Å²	119	144.9 Å²	144.9	73%	0.73	79%	0.793	S	S	*	*			trans	68.7	95.7	166.2	46.2	0	0	0	0	121.5
629	N	27	Very low	28.2	Very low	166 Å²	166	145.9 Å²	145.9	89%	0.888	79%	0.791	S	S	*	*			trans	61.3	123.7	131.5	-56.5	-5.7	0	0	0	121.9
630	G	28.3	Very low	28.1	Very low	77 Å²	77	144.3 Å²	144.3	79%	0.794	79%	0.786	S	S	*	*			trans	161.7	90.6	155.4	0	0	0	0	0	115.9
631	H	30.3	Very low	27.9	Very low	191 Å²	191	141.9 Å²	141.9	88%	0.884	78%	0.784	S	S	*	*			trans	14.6	124.6	165.3	-76.3	-73.4	0	0	0	120.9
632	T	27.9	Very low	28.1	Very low	131 Å²	131	144.4 Å²	144.4	80%	0.804	79%	0.788	S	S	*	*				-162.1	172.8	111	-67.3	0	0	0	0	108
633	E	29.6	Very low	28.1	Very low	192 Å²	192	142.7 Å²	142.7	90%	0.897	78%	0.782	S	S	*	*			trans	69	99.6	174.9	-51.7	-164	172.2	0	0	116.9
634	S	30	Very low	28.1	Very low	106 Å²	106	144.2 Å²	144.2	74%	0.741	78%	0.782	S	S	*	*			trans	-110.7	112.5	178.2	57.2	0	0	0	0	112.3
635	N	28.8	Very low	28.1	Very low	156 Å²	156	143.1 Å²	143.1	83%	0.834	78%	0.777	S	S	*	*			trans	179.6	113.6	131.8	-92.3	-28.6	0	0	0	110.7
636	N	27.2	Very low	28.2	Very low	151 Å²	151	144.8 Å²	144.8	81%	0.807	78%	0.778	S	S	*	*			trans	-156.6	157.4	166.8	-113.9	-43.4	0	0	0	111.8
637	Y	31.4	Very low	28.2	Very low	209 Å²	209	145.4 Å²	145.4	82%	0.82	78%	0.781	S	S	*	*			trans	-42.3	153.2	-176.1	-63.6	-97.9	0	0	0	117.4
638	I	28.5	Very low	28.3	Very low	174 Å²	174	144.9 Å²	144.9	89%	0.892	78%	0.778	S	S	*	*				-167.1	165.3	126.5	-105.5	160.4	0	0	0	115.7
639	Y	25.3	Very low	28.3	Very low	202 Å²	202	147.5 Å²	147.5	79%	0.792	78%	0.782	S	S	*	*			trans	-50.8	150.2	-175.8	-108.2	-133.7	0	0	0	121
640	T	24.6	Very low	28.4	Very low	98 Å²	98	145.8 Å²	145.8	60%	0.601	77%	0.773	S	S	*	*			trans	41.5	124.6	135.3	65.6	0	0	0	0	124.8
641	T	25.7	Very low	28.5	Very low	124 Å²	124	148.3 Å²	148.3	76%	0.761	77%	0.767	S	S	*	*				78.2	145.2	126.6	59.3	0	0	0	0	124.4
642	L	29	Very low	28.4	Very low	151 Å²	151	147.2 Å²	147.2	79%	0.791	76%	0.76	S	S	*	*			trans	82.5	91.4	152.6	-72.9	166.6	0	0	0	121.5
643	C	25.8	Very low	28.5	Very low	109 Å²	109	147 Å²	147	74%	0.736	75%	0.754	S	S	*	*				74.9	125.4	112.1	-82.8	0	0	0	0	124.5
644	V	27.7	Very low	28.5	Very low	115 Å²	115	145.5 Å²	145.5	70%	0.697	75%	0.747	S	S	*	*				108.4	131.2	122.2	161.5	0	0	0	0	120.8
645	N	27.7	Very low	28.6	Very low	124 Å²	124	147.7 Å²	147.7	66%	0.663	75%	0.746	S	S	*	*			trans	67.9	137.5	164.1	-72.3	-25.1	0	0	0	118.4
646	K	32	Very low	28.5	Very low	161 Å²	161	145.5 Å²	145.5	70%	0.7	74%	0.738	S	S	*	*			cis	179.6	167.5	4.8	-116.9	169	-174.6	177.7	0	109.2
647	Q	29.1	Very low	28.7	Very low	171 Å²	171	146.1 Å²	146.1	80%	0.799	74%	0.736	S	S	*	*			trans	72.3	116.7	160.3	-74	161.1	-32.9	0	0	116.9
648	T	28.5	Very low	28.7	Very low	116 Å²	116	142.5 Å²	142.5	71%	0.712	73%	0.731	S	S	*	*				83.8	115.5	64.3	-63.6	0	0	0	0	109.2
649	E	29.4	Very low	28.9	Very low	174 Å²	174	142.4 Å²	142.4	81%	0.813	73%	0.731	S	S	*	*				-137.2	144.4	58.4	-75.5	-176.8	152.9	0	0	113.1
650	N	29.5	Very low	29.5	Very low	130 Å²	130	141.2 Å²	141.2	70%	0.695	74%	0.738	S	S	*	*				57.4	135.1	84.1	-64.2	-38.1	0	0	0	114.6
651	L	30.9	Very low	29.8	Very low	129 Å²	129	145 Å²	145	68%	0.675	75%	0.746	S	S	*	*			cis	-161.7	145.6	11.8	-154.4	71.7	0	0	0	115.1
652	K	28.7	Very low	30.4	Very low	169 Å²	169	151.1 Å²	151.1	74%	0.735	76%	0.755	S	S	*	*			trans	79.1	145.7	145.2	-97.1	171.3	-163.9	171.7	0	125.3
653	N	28.8	Very low	30.5	Very low	127 Å²	127	155.1 Å²	155.1	68%	0.679	76%	0.759	S	S	*	*			trans	72	118.8	161.5	-56.4	-4.4	0	0	0	117.2
654	Q	31.1	Very low	30.8	Very low	160 Å²	160	155.4 Å²	155.4	75%	0.748	76%	0.763	S	S	*	*				70.5	132.4	61.3	-70.7	-170.9	-30.9	0	0	113.2
655	Q	30	Very low	30.9	Very low	151 Å²	151	159.5 Å²	159.5	71%	0.706	77%	0.771	S	S	*	*			cis	-157.7	153.5	17.8	-135.4	169.5	-1.1	0	0	113.5
656	T	28.3	Very low	31.3	Very low	110 Å²	110	158.4 Å²	158.4	68%	0.675	77%	0.771	S	S	*	*			trans	42.7	114.5	156.6	46.6	0	0	0	0	120.3
657	E	31.8	Very low	31.2	Very low	165 Å²	165	159 Å²	159	77%	0.771	78%	0.781	S	S	*	*				59.2	117.7	69.4	-60.6	-168.9	171.3	0	0	115
658	N	30.3	Very low	31.3	Very low	133 Å²	133	159.5 Å²	159.5	71%	0.711	78%	0.781	S	S	*	*				-168.1	144.1	70.7	-98.6	-87	0	0	0	112.9
659	L	33	Very low	31.3	Very low	171 Å²	171	161.5 Å²	161.5	90%	0.895	79%	0.788	S	S	*	*			trans	-128.4	144.1	162.3	-96.8	169.4	0	0	0	109.8
660	L	38.5	Very low	31.3	Very low	177 Å²	177	160.2 Å²	160.2	93%	0.927	79%	0.786	S	S	*	*			trans	-82.5	149.2	-164.6	-84	166.8	0	0	0	114.7
661	K	31.2	Very low	31.3	Very low	178 Å²	178	159.9 Å²	159.9	77%	0.774	79%	0.794	S	S	*	*			trans	-90.5	137.6	-169.2	-55.8	157.4	-175.3	166.5	0	111.7
662	R	36.9	Very low	31.3	Very low	253 Å²	253	165.4 Å²	165.4	96%	0.955	81%	0.806	S	S	*	*				-137.5	132.9	126.7	-70.4	-160.2	174.3	-154.4	-2.5	108.9
663	R	31.5	Very low	31.5	Very low	234 Å²	234	160.9 Å²	160.9	88%	0.883	80%	0.8	S	S	*	*			trans	-115.6	137	177.1	-75.4	-175.8	174.4	177.7	-3.1	109.2
664	S	31.9	Very low	31.5	Very low	115 Å²	115	162 Å²	162	80%	0.804	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-75	160.7	157	42.8	0	0	0	0	110.4
665	F	30.7	Very low	31.6	Very low	201 Å²	201	162 Å²	162	88%	0.882	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-85.6	141.3	172	-77	-94.7	0	0	0	110.4
666	P	36.1	Very low	31.5	Very low	101 Å²	101	161.3 Å²	161.3	66%	0.656	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-81.4	155.8	179.1	33.8	-35.4	0	0	0	112.6
667	L	28.4	Very low	32.2	Very low	174 Å²	174	162 Å²	162	91%	0.911	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-66.7	143.9	165.4	-131.8	71.1	0	0	0	110
668	F	31.3	Very low	32	Very low	181 Å²	181	157.3 Å²	157.3	79%	0.794	81%	0.814	S	S	*	*			trans	-109.3	123.6	167.5	-99.6	-86	0	0	0	109.4
669	D	28.2	Very low	32	Very low	159 Å²	159	158.9 Å²	158.9	85%	0.85	82%	0.822	S	S	*	*			trans	-112.1	149.2	166.9	-157.1	-9.8	0	0	0	108.9
670	N	29.5	Very low	31.8	Very low	146 Å²	146	154.2 Å²	154.2	78%	0.781	80%	0.804	S	S	*	*			trans	-123.2	112.5	-161.4	-92.3	-54.3	0	0	0	113.3
671	S	29.8	Very low	31.7	Very low	123 Å²	123	155.7 Å²	155.7	86%	0.86	80%	0.803	S	S	*	*			trans	-130.3	144.6	167.6	62.3	0	0	0	0	113.1
672	R	31.8	Very low	31.9	Very low	246 Å²	246	153.6 Å²	153.6	93%	0.928	80%	0.796	S	S	*	*			trans	-72.6	165.3	-170	-68.5	170.9	-178.4	170.4	-0.5	113.2
673	A	31.8	Very low	31.8	Very low	74 Å²	74	148.9 Å²	148.9	61%	0.612	78%	0.779	S	S	*	*			cis	-179.9	170.3	-20.4	0	0	0	0	0	109.4
674	N	28.6	Very low	31.9	Very low	151 Å²	151	143.9 Å²	143.9	81%	0.807	77%	0.774	S	S	*	*			trans	67.5	152.1	157.9	-62	-9.6	0	0	0	117.2
675	L	33.2	Very low	31.9	Very low	159 Å²	159	146.3 Å²	146.3	83%	0.832	77%	0.767	S	S	*	*			cis	-150.7	166.7	5.3	-126.5	160.8	0	0	0	110.8
676	D	28.6	Very low	31.9	Very low	137 Å²	137	141.3 Å²	141.3	73%	0.733	76%	0.756	S	S	*	*			trans	-69.2	171.7	177	-110.2	-55.5	0	0	0	113.6	G678	D676-G678 PolarHBondContact OD1-N 3.15Å
677	P	43.3	Very low	31.6	Very low	123 Å²	123	143 Å²	143	80%	0.799	77%	0.765	S	S	*	*			cis	-143.2	140.6	38.4	38.4	-16.6	0	0	0	120.4
678	G	27.8	Very low	32	Very low	67 Å²	67	142.3 Å²	142.3	69%	0.691	76%	0.761	S	S	*	*				84.1	112.1	116.9	0	0	0	0	0	122	D676	D676-G678 PolarHBondContact OD1-N 3.15Å
679	N	29.6	Very low	32.2	Very low	167 Å²	167	139.3 Å²	139.3	89%	0.893	76%	0.758	S	S	*	*				-150	148.6	111.5	-157.3	-5.6	0	0	0	111.7
680	S	29.8	Very low	32.2	Very low	73 Å²	73	143.1 Å²	143.1	51%	0.51	76%	0.76	S	S	.	*			trans	-70.2	157.6	-178.9	-140.6	0	0	0	0	111.5	H682	S680-H682 PolarHBondContact OG-CD2 3.47Å
681	K	35.2	Very low	32.2	Very low	207 Å²	207	143.1 Å²	143.1	90%	0.9	76%	0.76	S	S	*	*				-144.5	150.8	55.3	-73.7	175.2	-178.7	174.7	0	115.8
682	H	36.7	Very low	32.1	Very low	135 Å²	135	149.3 Å²	149.3	63%	0.625	77%	0.765	S	S	*	*			trans	-91.1	178.6	-175.6	-70.1	-131.3	0	0	0	111.6	S680	S680-H682 PolarHBondContact OG-CD2 3.47Å
683	Y	34.4	Very low	31.9	Very low	154 Å²	154	144 Å²	144	60%	0.604	76%	0.76	S	S	*	*			cis	-159.4	-176.3	-11.7	-114.3	-159.3	0	0	0	106.1	Y685	Y683-Y685 AromaticContact CD1-CD2 3.81Å; Y683-Y685 HydrophobicContact CD1-CD2 3.81Å; Y683-Y685 AromaticContact CD1-CE2 3.99Å; Y683-Y685 HydrophobicContact CD1-CE2 3.99Å; Y683-Y685 AromaticContact CE1-CD2 3.69Å; Y683-Y685 HydrophobicContact CE1-CD2 3.69Å; Y683-Y685 AromaticContact CE1-CE2 3.38Å; Y683-Y685 HydrophobicContact CE1-CE2 3.38Å; Y683-Y685 HydrophobicContact CE1-CG 4.49Å; Y683-Y685 AromaticContact CE1-CZ 3.96Å; Y683-Y685 HydrophobicContact CE2-CE2 4.09Å; Y683-Y685 HydrophobicContact CG-CD2 4.31Å; Y683-Y685 AromaticContact CZ-CE2 3.44Å; Y683-Y685 VanDerWaalsContact CZ-CE2 3.44Å
684	V	33.6	Very low	31.6	Very low	128 Å²	128	151.7 Å²	151.7	78%	0.776	77%	0.773	S	S	*	*				-164.1	124.8	51.6	175.4	0	0	0	0	105.6
685	Y	31	Very low	31.5	Very low	167 Å²	167	152.5 Å²	152.5	66%	0.655	77%	0.772	S	S	*	*				59	142.8	86.2	-86.1	-119.7	0	0	0	115.3	Y683	Y683-Y685 AromaticContact CD1-CD2 3.81Å; Y683-Y685 HydrophobicContact CD1-CD2 3.81Å; Y683-Y685 AromaticContact CD1-CE2 3.99Å; Y683-Y685 HydrophobicContact CD1-CE2 3.99Å; Y683-Y685 AromaticContact CE1-CD2 3.69Å; Y683-Y685 HydrophobicContact CE1-CD2 3.69Å; Y683-Y685 AromaticContact CE1-CE2 3.38Å; Y683-Y685 HydrophobicContact CE1-CE2 3.38Å; Y683-Y685 HydrophobicContact CE1-CG 4.49Å; Y683-Y685 AromaticContact CE1-CZ 3.96Å; Y683-Y685 HydrophobicContact CE2-CE2 4.09Å; Y683-Y685 HydrophobicContact CG-CD2 4.31Å; Y683-Y685 AromaticContact CZ-CE2 3.44Å; Y683-Y685 VanDerWaalsContact CZ-CE2 3.44Å
686	S	31.7	Very low	31.5	Very low	95 Å²	95	150.5 Å²	150.5	66%	0.664	77%	0.769	S	S	*	*			cis	-170.9	164.6	-5.3	44.3	0	0	0	0	112.7
687	T	30.6	Very low	31.2	Very low	136 Å²	136	153.2 Å²	153.2	83%	0.834	78%	0.777	S	S	*	*			trans	-121.1	132.4	167.2	47.6	0	0	0	0	112.1
688	L	36.8	Very low	30.5	Very low	160 Å²	160	156.9 Å²	156.9	84%	0.838	78%	0.78	S	S	*	*			trans	-154.4	157.7	171.5	-76	-176.5	0	0	0	107.7
689	T	33.5	Very low	30.9	Very low	119 Å²	119	159.4 Å²	159.4	73%	0.73	78%	0.784	S	S	*	*			cis	-145.9	164.7	8.7	-13.2	0	0	0	0	110.4
690	R	30	Very low	30.8	Very low	238 Å²	238	158.8 Å²	158.8	90%	0.898	77%	0.774	S	S	*	*			trans	-133.1	125.9	162.9	179.3	178	179.8	163.7	2.4	110.2
691	N	29.4	Very low	30.8	Very low	146 Å²	146	162.4 Å²	162.4	78%	0.781	78%	0.783	S	S	*	*			trans	-82.4	142.5	178.8	-70.5	-15.5	0	0	0	112.5
692	R	27.9	Very low	30.3	Very low	254 Å²	254	158.9 Å²	158.9	96%	0.958	77%	0.774	S	S	*	*			trans	-149.5	140.6	157.4	-149.9	-179.5	-165	-164.5	4.5	108.7
693	V	27.3	Very low	30	Very low	135 Å²	135	159.6 Å²	159.6	82%	0.818	78%	0.781	S	S	*	*			trans	-125.6	130.9	-171.5	173.3	0	0	0	0	110.8
694	R	24.7	Very low	29.8	Very low	235 Å²	235	157.8 Å²	157.8	89%	0.887	78%	0.781	S	S	*	*			trans	-164.7	123.1	143	-117.5	-179.4	-178.1	-170.3	-0.6	112.8
695	Q	27.5	Very low	29.7	Very low	167 Å²	167	160.4 Å²	160.4	78%	0.78	78%	0.782	S	S	*	*			trans	33.4	124.3	138	-66.7	-73.2	-3.6	0	0	120.5
696	P	32	Very low	29.6	Very low	118 Å²	118	157.1 Å²	157.1	77%	0.766	78%	0.784	S	S	*	*			trans	-117.3	159.8	142.5	37.9	-29.1	0	0	0	112.8
697	E	22.1	Very low	29.7	Very low	193 Å²	193	157.3 Å²	157.3	90%	0.902	79%	0.785	S	S	*	*			trans	-88.4	-179	172.9	-69.6	-169.8	98.4	0	0	113.4
698	K	30.1	Very low	29.7	Very low	200 Å²	200	159.7 Å²	159.7	87%	0.87	78%	0.784	S	S	*	*			trans	-73.6	164.1	-167.3	-52.6	175.5	-176.8	175.8	0	113.8
699	P	34.6	Very low	29.2	Very low	120 Å²	120	156.7 Å²	156.7	78%	0.779	78%	0.776	S	S	*	*				-145.2	142.7	97.7	36.7	-21.5	0	0	0	118
700	K	28.8	Very low	29.2	Very low	155 Å²	155	157.9 Å²	157.9	67%	0.674	78%	0.775	S	S	*	*			trans	45	130.3	139.5	-76.6	172.2	151.4	-75.8	0	125
701	E	28.8	Very low	29.2	Very low	149 Å²	149	153.4 Å²	153.4	70%	0.696	76%	0.764	S	S	*	*			trans	64	121.5	134.7	-73.7	138.2	-159.4	0	0	120.7
702	D	26	Very low	29.1	Very low	133 Å²	133	152.3 Å²	152.3	71%	0.711	76%	0.759	S	S	*	*			cis	-140.1	-108.2	-13.5	-170.7	53	0	0	0	111.1	L704	D702-L704 PolarHBondContact OD2-N 2.86Å
703	L	29	Very low	29.2	Very low	149 Å²	149	145.8 Å²	145.8	78%	0.78	75%	0.746	S	S	*	*			cis	-139.3	126.3	-2.5	-109.7	96.3	0	0	0	111.9
704	L	31	Very low	29.2	Very low	116 Å²	116	144.8 Å²	144.8	61%	0.607	74%	0.741	S	S	*	*			trans	45.7	121.6	152.2	-63.9	-174.6	0	0	0	123.2	D702	D702-L704 PolarHBondContact OD2-N 2.86Å
705	K	30.9	Very low	29.5	Very low	184 Å²	184	142 Å²	142	80%	0.8	74%	0.738	S	S	*	*			trans	74.9	138.9	137.9	-68.7	168.7	-177.3	171.6	0	118.7
706	S	29.3	Very low	29.3	Very low	98 Å²	98	140.9 Å²	140.9	69%	0.685	74%	0.737	S	S	*	*			cis	-166.3	153.2	-1.1	55.8	0	0	0	0	114.9
707	S	33.4	Very low	29.3	Very low	99 Å²	99	142.2 Å²	142.2	69%	0.692	74%	0.737	S	S	*	*			trans	66.3	144.4	150.2	-62.6	0	0	0	0	119
708	K	30.8	Very low	29.6	Very low	185 Å²	185	140 Å²	140	80%	0.804	73%	0.726	S	S	*	*			cis	-160.4	134.2	-9	-97	162.3	-174.5	-179.6	0	104.3
709	S	26.5	Very low	29.6	Very low	98 Å²	98	138.2 Å²	138.2	69%	0.685	72%	0.721	S	S	*	*				48.8	133.3	74.7	-142	0	0	0	0	113.5
710	M	32.3	Very low	29.4	Very low	143 Å²	143	138.6 Å²	138.6	70%	0.704	72%	0.717	S	S	*	*			cis	-125.4	-161	26.1	-48.9	-74.5	-74.9	0	0	110.2
711	H	30.5	Very low	29.6	Very low	144 Å²	144	139.1 Å²	139.1	67%	0.667	72%	0.722	S	S	*	*			cis	-149	-137.6	-0.4	-145	-16.7	0	0	0	114.2
712	N	27.9	Very low	29.7	Very low	124 Å²	124	139.3 Å²	139.3	66%	0.663	72%	0.723	S	S	*	*			trans	-135	140.3	-150.5	-75.6	15.3	0	0	0	115.9
713	V	28.9	Very low	29.8	Very low	116 Å²	116	140.2 Å²	140.2	70%	0.703	72%	0.723	S	S	*	*				60.3	128.2	121.1	-169.5	0	0	0	0	122.2
714	T	28.6	Very low	29.8	Very low	114 Å²	114	137.6 Å²	137.6	70%	0.699	71%	0.712	S	S	*	*			trans	60.1	135.2	157	51.6	0	0	0	0	122.6
715	H	30	Very low	29.7	Very low	178 Å²	178	137.5 Å²	137.5	82%	0.824	72%	0.717	S	S	*	*				-168.4	176.5	100.9	-114.2	-97	0	0	0	113.5
716	N	24.6	Very low	29.5	Very low	143 Å²	143	136 Å²	136	77%	0.765	71%	0.71	S	S	*	*			trans	-105.8	-169.1	173.3	-67.9	-33.9	0	0	0	110.8
717	L	30.3	Very low	29.4	Very low	145 Å²	145	137.7 Å²	137.7	76%	0.759	71%	0.707	S	S	*	*			trans	76	156.5	176.2	-83.9	75.8	0	0	0	114.8
718	E	30.1	Very low	29.1	Very low	146 Å²	146	140 Å²	140	68%	0.682	71%	0.712	S	S	*	*			cis	-169.7	168.5	-31.7	-139.1	151.8	-144.8	0	0	107
719	E	30.1	Very low	30.2	Very low	164 Å²	164	136.6 Å²	136.6	77%	0.766	71%	0.709	S	S	*	*			trans	60.6	169.1	163.1	-63	172.2	172.7	0	0	116.7
720	D	30.7	Very low	31.1	Very low	128 Å²	128	137.6 Å²	137.6	68%	0.684	71%	0.713	S	S	*	*			cis	-154.5	167.5	-46.2	-106	-20.7	0	0	0	109.3
721	E	31.4	Very low	30.9	Very low	166 Å²	166	135.5 Å²	135.5	78%	0.776	71%	0.712	S	S	*	*			trans	50.7	157.6	147.1	-71.6	-175	177.9	0	0	121
722	E	31.4	Very low	30.7	Very low	153 Å²	153	132.9 Å²	132.9	72%	0.715	71%	0.71	S	S	*	*			cis	-159.2	-174.9	-23.9	-126.5	-168.5	173.7	0	0	109.4
723	E	28.2	Very low	30.8	Very low	152 Å²	152	132.9 Å²	132.9	71%	0.71	72%	0.715	S	S	*	*			trans	29.9	149.3	137.5	-68.1	-98.8	115.8	0	0	122.7
724	V	29.6	Very low	31	Very low	93 Å²	93	132.7 Å²	132.7	56%	0.564	71%	0.714	S	S	*	*			cis	-169	150.9	-11.4	87.8	0	0	0	0	112.8
725	T	28.8	Very low	31	Very low	114 Å²	114	132.6 Å²	132.6	70%	0.699	71%	0.714	S	S	*	*			trans	60.3	172.9	165.1	67.8	0	0	0	0	118
726	K	27.3	Very low	31.1	Very low	153 Å²	153	133.5 Å²	133.5	67%	0.665	72%	0.715	S	S	*	*			cis	-155.2	173.1	4.2	-134.7	157.1	-162.2	-60.3	0	108.2
727	E	27	Very low	31.3	Very low	133 Å²	133	131 Å²	131	62%	0.621	71%	0.709	S	S	*	*			cis	-141.5	-140	3.7	-171.1	64.8	-66	0	0	107.7
728	N	25.8	Very low	31.2	Very low	147 Å²	147	132 Å²	132	79%	0.786	71%	0.713	S	S	*	*			trans	-136.3	-140	168.1	-76.2	-87.7	0	0	0	111.5
729	P	55.3	Low	31	Very low	115 Å²	115	129.9 Å²	129.9	75%	0.747	72%	0.715	S	S	*	*				-114	-166.6	-122.4	41.5	-22.4	0	0	0	112.9
730	P	45.2	Very low	31.4	Very low	119 Å²	119	130.2 Å²	130.2	77%	0.773	72%	0.72	S	S	*	*				-154.9	177.2	81.4	42	-21.1	0	0	0	118.3
731	S	26.9	Very low	31.3	Very low	98 Å²	98	128.3 Å²	128.3	69%	0.685	72%	0.722	S	S	*	*			trans	-27.6	140.3	168.6	60.7	0	0	0	0	123.8
732	S	27.6	Very low	31.2	Very low	89 Å²	89	124.8 Å²	124.8	62%	0.622	72%	0.721	S	S	*	*				75	128.3	120.1	71.4	0	0	0	0	124.8
733	T	29.9	Very low	31.1	Very low	124 Å²	124	124.9 Å²	124.9	76%	0.761	73%	0.726	S	S	*	*			trans	69.1	160.5	138.4	54.9	0	0	0	0	118.8
734	T	32.1	Very low	31.2	Very low	112 Å²	112	124 Å²	124	69%	0.687	73%	0.725	S	S	*	*			cis	-156.4	141.5	14	-17.7	0	0	0	0	113.3
735	T	28.3	Very low	31.1	Very low	113 Å²	113	126 Å²	126	69%	0.693	73%	0.733	S	S	*	*			trans	35.5	138	144.8	54.9	0	0	0	0	124.4
736	K	31.8	Very low	31.3	Very low	196 Å²	196	126.7 Å²	126.7	85%	0.852	74%	0.737	S	S	*	*				175.6	154.9	121.9	-93	151.3	-172.8	175.9	0	110.9
737	S	30.2	Very low	31.5	Very low	90 Å²	90	125.5 Å²	125.5	63%	0.629	74%	0.738	S	S	*	*			cis	-179.4	158.8	-27.7	51.8	0	0	0	0	111.6
738	I	27.8	Very low	31.9	Very low	167 Å²	167	126.3 Å²	126.3	86%	0.856	74%	0.739	S	S	*	*			trans	87.1	157.9	155.8	-66.1	154.7	0	0	0	119.1
739	S	26.2	Very low	32.2	Very low	102 Å²	102	125.4 Å²	125.4	71%	0.713	73%	0.73	S	S	*	*			trans	-107.8	158.7	-148.3	-43.5	0	0	0	0	117.2
740	I	37.2	Very low	31.1	Very low	170 Å²	170	128.5 Å²	128.5	87%	0.872	73%	0.734	S	S	*	*			trans	4.6	125.3	136.4	-54.3	164.5	0	0	0	117.7
741	A	30.3	Very low	30.3	Very low	89 Å²	89	127.2 Å²	127.2	74%	0.736	73%	0.729	S	S	*	*			trans	-177.6	165	132	0	0	0	0	0	112.4
742	A	28.6	Very low	30.2	Very low	92 Å²	92	128.6 Å²	128.6	76%	0.76	73%	0.728	S	S	*	*			trans	69.4	153.3	161.3	0	0	0	0	0	119.2
743	L	28.9	Very low	30.5	Very low	154 Å²	154	132.6 Å²	132.6	81%	0.806	73%	0.734	S	S	*	*			cis	-158.2	166.2	-19.6	-107.5	173.1	0	0	0	110.8
744	L	30.8	Very low	30.6	Very low	133 Å²	133	133.3 Å²	133.3	70%	0.696	73%	0.729	S	S	*	*			trans	-11.3	150.8	167.1	-62.6	168.8	0	0	0	123.6
745	D	27.5	Very low	30.5	Very low	137 Å²	137	134.9 Å²	134.9	73%	0.733	73%	0.732	S	S	*	*			trans	42.7	124.3	133.5	-52	-15.5	0	0	0	122.4
746	V	33.3	Very low	30.4	Very low	128 Å²	128	135.5 Å²	135.5	78%	0.776	74%	0.736	S	S	*	*				-161.2	119.5	119.7	129.2	0	0	0	0	110.6
747	N	30.9	Very low	30.4	Very low	128 Å²	128	131.2 Å²	131.2	68%	0.684	73%	0.731	S	S	*	*			trans	29	144.2	132.4	-65.2	-45.7	0	0	0	119.7
748	K	35	Very low	30.3	Very low	150 Å²	150	136.2 Å²	136.2	65%	0.652	74%	0.742	S	S	*	*			cis	-174.3	165.1	16.1	-115.2	171.3	-178.7	-75.1	0	105.8
749	E	32	Very low	30.2	Very low	128 Å²	128	136.6 Å²	136.6	60%	0.598	74%	0.737	S	S	*	*			cis	-163.1	166.3	-8.5	-152.2	143.2	-136.1	0	0	106.6
750	E	32.5	Very low	30.2	Very low	179 Å²	179	138.7 Å²	138.7	84%	0.836	74%	0.736	S	S	*	*			trans	34.6	136	152.9	-75.6	175.9	167.3	0	0	122.8
751	S	28.6	Very low	29.7	Very low	93 Å²	93	135.9 Å²	135.9	65%	0.65	73%	0.726	S	S	*	*			cis	-163.6	163.5	11.3	53.4	0	0	0	0	114.4
752	N	25.7	Very low	29.8	Very low	126 Å²	126	141.4 Å²	141.4	67%	0.674	73%	0.734	S	S	*	*			trans	84.4	81	154.3	-61.9	-47.7	0	0	0	122.4
753	K	33.5	Very low	29.8	Very low	173 Å²	173	141 Å²	141	75%	0.752	74%	0.738	S	S	*	*				66.4	165.8	120.1	-65.2	168.8	168.6	-87	0	119.6
754	E	31.4	Very low	29.8	Very low	139 Å²	139	139.3 Å²	139.3	65%	0.65	74%	0.739	S	S	*	*			cis	-170.2	169	-27.8	-99.7	-178	90.2	0	0	105.8
755	L	31.2	Very low	30.5	Very low	145 Å²	145	138.7 Å²	138.7	76%	0.759	74%	0.743	S	S	*	*			cis	-174.1	152.9	-34.1	175.2	59.1	0	0	0	106.8
756	T	25.5	Very low	30.6	Very low	126 Å²	126	137.1 Å²	137.1	77%	0.773	74%	0.743	S	S	*	*			trans	-98.5	136.1	175.6	49.3	0	0	0	0	114.2
757	S	31.3	Very low	30.8	Very low	107 Å²	107	140 Å²	140	75%	0.748	75%	0.745	S	S	*	*			trans	102.2	141.2	157.5	83.7	0	0	0	0	120.3
758	K	28.7	Very low	31.4	Very low	195 Å²	195	140.5 Å²	140.5	85%	0.848	75%	0.747	S	S	*	*			trans	84.1	117.4	163.9	-59	-179.6	-177.5	173.8	0	120.4
759	K	25.9	Very low	31.6	Very low	175 Å²	175	142.1 Å²	142.1	76%	0.761	75%	0.754	S	S	*	*			trans	81	109.5	137.1	-151.7	168	-169.6	-78.7	0	120.1
760	E	25.4	Very low	32	Very low	146 Å²	146	145.6 Å²	145.6	68%	0.682	77%	0.767	S	S	*	*			trans	70.8	130.2	142.6	-75.4	178	142.5	0	0	123.7
761	V	27.2	Very low	32.1	Very low	111 Å²	111	140.5 Å²	140.5	67%	0.673	76%	0.763	S	S	*	*			trans	82.6	110.7	136.8	171.9	0	0	0	0	120.6
762	K	32	Very low	32.8	Very low	205 Å²	205	141.1 Å²	141.1	89%	0.891	77%	0.767	S	S	*	*			trans	57.8	122.8	149.1	-63.6	168.4	-169.3	172.1	0	120
763	G	27.8	Very low	33.6	Very low	82 Å²	82	142.5 Å²	142.5	85%	0.845	77%	0.77	S	S	*	*			trans	-179.5	113.1	160.1	0	0	0	0	0	114.9
764	S	29.3	Very low	33.8	Very low	120 Å²	120	142.1 Å²	142.1	84%	0.839	77%	0.768	S	S	*	*			trans	-85.1	166.1	166.2	-35.3	0	0	0	0	109.6
765	P	46.1	Very low	34.2	Very low	119 Å²	119	142.5 Å²	142.5	77%	0.773	77%	0.774	S	S	*	*				-140	166.8	63.6	37.2	-19	0	0	0	116
766	S	30.2	Very low	34.8	Very low	104 Å²	104	146.4 Å²	146.4	73%	0.727	78%	0.778	S	S	*	*			trans	-96.9	130.1	-174.8	56	0	0	0	0	114.1
767	F	35.9	Very low	35.3	Very low	190 Å²	190	145.2 Å²	145.2	83%	0.833	78%	0.775	S	S	*	*			trans	-129.2	131.7	151.5	-72.1	-92.4	0	0	0	108.1
768	L	44.6	Very low	35.4	Very low	138 Å²	138	147 Å²	147	72%	0.723	78%	0.775	S	S	*	*			cis	-139.2	-104	-4.7	-144.8	177.5	0	0	0	111.4
769	K	38.5	Very low	35.7	Very low	184 Å²	184	145.2 Å²	145.2	80%	0.8	77%	0.774	S	S	*	*			trans	-152.8	153	-175.1	-67.2	169.5	-178.9	171.6	0	107.5
770	K	40.9	Very low	35.8	Very low	200 Å²	200	141.6 Å²	141.6	87%	0.87	77%	0.771	S	S	*	*			cis	-133.9	160	8.2	-56.2	166.9	-174.7	173	0	106.8
771	G	33.8	Very low	36.1	Very low	73 Å²	73	142.4 Å²	142.4	75%	0.753	78%	0.779	S	S	*	*			cis	108.1	137.1	21.9	0	0	0	0	0	110.1
772	S	44.6	Very low	36.4	Very low	106 Å²	106	143.2 Å²	143.2	74%	0.741	79%	0.785	S	S	*	*			cis	-171.6	177.3	3.5	59.6	0	0	0	0	112.5
773	Q	41.5	Very low	37.9	Very low	154 Å²	154	138.6 Å²	138.6	72%	0.72	78%	0.775	S	S	*	*			trans	75.4	155.3	-178.7	-56.4	-175.1	98.3	0	0	113.9
774	K	39.2	Very low	38	Very low	165 Å²	165	140.5 Å²	140.5	72%	0.717	77%	0.766	S	S	*	*			cis	-163.3	155.8	-13.7	-111.5	170.7	176.9	158.6	0	106.1
775	L	39.4	Very low	38.3	Very low	147 Å²	147	143.4 Å²	143.4	77%	0.77	76%	0.764	S	S	*	*			cis	-155.5	-148.1	-14	-139.5	178.5	0	0	0	107.8
776	R	43.8	Very low	37.7	Very low	228 Å²	228	146.7 Å²	146.7	86%	0.86	77%	0.766	S	S	*	*			trans	-145.3	166.2	169.2	-69.6	-173.5	171.4	-177	-3.7	108.2
777	S	35.7	Very low	37.8	Very low	100 Å²	100	149.3 Å²	149.3	70%	0.699	77%	0.767	S	S	*	*				171.2	169.3	67.7	46.8	0	0	0	0	108.2
778	L	33.8	Very low	37.4	Very low	145 Å²	145	146.3 Å²	146.3	76%	0.759	76%	0.759	S	S	*	*				-165	154.8	58.4	-85.2	171.4	0	0	0	114.2
779	L	33.2	Very low	36.7	Very low	158 Å²	158	147.2 Å²	147.2	83%	0.827	76%	0.764	S	S	*	*			trans	68	165.7	147.1	-68.6	166.8	0	0	0	121.1
780	S	28	Very low	36.5	Very low	99 Å²	99	143.9 Å²	143.9	69%	0.692	76%	0.764	S	S	*	*			trans	-173.6	177.8	-152.1	53.5	0	0	0	0	112.6
781	L	33.5	Very low	36.3	Very low	163 Å²	163	143.9 Å²	143.9	85%	0.853	76%	0.764	S	S	*	*			trans	107.5	164	165.8	-57	178.2	0	0	0	117.6
782	T	32.2	Very low	36.1	Very low	128 Å²	128	148.7 Å²	148.7	79%	0.785	77%	0.773	S	S	*	*			trans	-135.6	-153	-153.1	48.2	0	0	0	0	110.8
783	P	64.1	Low	35.5	Very low	107 Å²	107	153 Å²	153	70%	0.695	78%	0.778	S	S	*	*				-111.8	-174.9	-79.6	37.8	-23.2	0	0	0	112.1
784	D	30.7	Very low	34.8	Very low	123 Å²	123	150.2 Å²	150.2	66%	0.658	78%	0.781	S	S	*	*				176	160.9	121.3	-117.9	-12.9	0	0	0	119.3
785	K	34.1	Very low	35	Very low	180 Å²	180	148 Å²	148	78%	0.783	78%	0.784	S	S	*	*			trans	73.1	135.2	146.6	-74.2	174.6	-176.1	83.3	0	124.7
786	K	34.7	Very low	34.3	Very low	189 Å²	189	145 Å²	145	82%	0.822	78%	0.78	S	S	*	*			trans	-64.3	166.4	172.9	-47.9	164.1	177.2	176.1	0	112.4
787	E	31	Very low	33.5	Very low	158 Å²	158	143.6 Å²	143.6	74%	0.738	78%	0.78	S	S	*	*				-169.7	146.1	65.7	-80.8	-160.2	141.2	0	0	116.4
788	N	28	Very low	33	Very low	128 Å²	128	148.1 Å²	148.1	68%	0.684	78%	0.784	S	S	*	*			trans	49.4	137.9	135.5	-65.4	-36.9	0	0	0	125.6
789	L	29.7	Very low	32.6	Very low	157 Å²	157	151.2 Å²	151.2	82%	0.822	79%	0.785	S	S	*	*			trans	96.5	125.3	135.4	-84.9	166.6	0	0	0	123.5
790	S	33.8	Very low	32.7	Very low	114 Å²	114	149.7 Å²	149.7	80%	0.797	78%	0.777	S	S	*	*			trans	106	139.9	139.2	81.1	0	0	0	0	119.2
791	K	36.9	Very low	32.6	Very low	199 Å²	199	149.5 Å²	149.5	87%	0.865	78%	0.775	S	S	*	*			trans	-105.3	138.4	175.3	-57.7	168.2	-179.7	174.5	0	107.6
792	N	29.8	Very low	32.5	Very low	175 Å²	175	145.7 Å²	145.7	94%	0.936	76%	0.762	S	S	*	*			trans	-156.3	167.1	154.4	-112.2	-36.6	0	0	0	113.1
793	K	32.4	Very low	32.4	Very low	196 Å²	196	145.4 Å²	145.4	85%	0.852	77%	0.765	S	S	*	*			trans	-138.5	97.3	-149.3	-173.1	-177.2	-178.3	-178.1	0	113.8
794	A	27.1	Very low	31.1	Very low	96 Å²	96	146 Å²	146	79%	0.793	77%	0.772	S	S	*	*			trans	60.4	-175.2	168.4	0	0	0	0	0	114.8
795	P	42.2	Very low	31	Very low	119 Å²	119	146.8 Å²	146.8	77%	0.773	78%	0.776	S	S	*	*			cis	-127.9	179.7	-19.7	26.3	-4.4	0	0	0	114.2
796	A	25.2	Very low	31	Very low	82 Å²	82	144.2 Å²	144.2	68%	0.678	78%	0.775	S	S	*	*			trans	68.4	111.8	147.1	0	0	0	0	0	122.4
797	F	28	Very low	30.9	Very low	199 Å²	199	141.8 Å²	141.8	87%	0.873	77%	0.771	S	S	*	*			trans	54	128.4	137.9	-73.4	-89.8	0	0	0	122.2
798	Y	24.7	Very low	30.8	Very low	196 Å²	196	140.6 Å²	140.6	77%	0.769	77%	0.774	S	S	*	*				-160.7	139	119.6	-121.3	-86.8	0	0	0	114.1
799	R	25.7	Very low	31	Very low	210 Å²	210	138.6 Å²	138.6	79%	0.792	77%	0.77	S	S	*	*			trans	13.1	152.2	166.8	-68.2	177.6	-178.5	159.4	1.8	125.1
800	L	34.4	Very low	31	Very low	125 Å²	125	140.2 Å²	140.2	65%	0.654	77%	0.773	S	S	*	*			trans	-77.3	165.7	168.4	-56.2	68.9	0	0	0	113.2	P817	L800-P817 HydrophobicContact CD2-CG 4.39Å
801	C	25.6	Very low	31	Very low	95 Å²	95	138.6 Å²	138.6	64%	0.642	78%	0.775	S	S	*	*				-159	177.8	124.3	-104.1	0	0	0	0	114.2	K816	C801-K816 PolarHBondContact SG-NZ 3.01Å; C801-K816 VanDerWaalsContact SG-NZ 3.39Å
802	S	32.8	Very low	30.9	Very low	84 Å²	84	138.2 Å²	138.2	59%	0.587	78%	0.776	S	S	*	*			trans	-142.4	148.9	-170.7	-179.8	0	0	0	0	109.2
803	S	29.6	Very low	31.1	Very low	121 Å²	121	137.4 Å²	137.4	85%	0.846	77%	0.767	S	S	*	*			trans	-123.5	150.9	174.4	-57.5	0	0	0	0	111.7
804	S	36.1	Very low	31.1	Very low	120 Å²	120	133.2 Å²	133.2	84%	0.839	75%	0.753	S	S	*	*			trans	-159.3	151.4	173.2	-56.4	0	0	0	0	108
805	D	29.2	Very low	31.4	Very low	139 Å²	139	135.8 Å²	135.8	74%	0.743	75%	0.749	S	S	*	*			trans	-138.2	139.9	174.1	-137.3	-17.6	0	0	0	104.9	L807	D805-L807 PolarHBondContact OD1-N 3.47Å
806	T	34.5	Very low	30.8	Very low	126 Å²	126	136.6 Å²	136.6	77%	0.773	74%	0.74	S	S	*	*				-133.4	131.5	54.4	50.9	0	0	0	0	116
807	L	32.4	Very low	31.4	Very low	138 Å²	138	136 Å²	136	72%	0.723	73%	0.729	S	S	*	*			trans	55.6	123.4	136.4	-58.5	-178	0	0	0	123.1	D805	D805-L807 PolarHBondContact OD1-N 3.47Å
808	V	28.7	Very low	31.7	Very low	134 Å²	134	134.2 Å²	134.2	81%	0.812	72%	0.721	S	S	*	*			trans	71	127.7	141.6	178.3	0	0	0	0	117.6
809	S	31.5	Very low	32	Very low	85 Å²	85	133.4 Å²	133.4	59%	0.594	72%	0.722	S	S	*	*			cis	-150.4	156.7	-2.9	43.4	0	0	0	0	113.4
810	E	30.2	Very low	32.2	Very low	192 Å²	192	127.7 Å²	127.7	90%	0.897	71%	0.714	S	S	*	*			trans	56.3	138.1	148.6	-69.9	156.6	-117.5	0	0	121.7
811	G	34.6	Very low	31.8	Very low	80 Å²	80	129.9 Å²	129.9	83%	0.825	73%	0.727	S	S	*	*			trans	130.7	112.3	170.4	0	0	0	0	0	114.7
812	E	34.2	Very low	32	Very low	190 Å²	190	131.1 Å²	131.1	89%	0.888	73%	0.731	S	S	*	*			trans	-67.3	157.2	173.2	-63.7	154.1	136.5	0	0	111.3
813	E	34	Very low	31.9	Very low	159 Å²	159	136.2 Å²	136.2	74%	0.743	74%	0.743	S	S	*	*			cis	-154.5	167.5	6.4	-139.4	-167.1	144.2	0	0	111.1
814	N	32.8	Very low	31.9	Very low	108 Å²	108	135.9 Å²	135.9	58%	0.578	74%	0.735	S	S	*	*			trans	52.7	84.9	154.4	-65.9	-37.1	0	0	0	121.9
815	Q	32.5	Very low	31.4	Very low	149 Å²	149	136.7 Å²	136.7	70%	0.696	73%	0.73	S	S	*	*				41	138.1	107.9	-64.5	-162.9	92.8	0	0	120.1
816	K	30.6	Very low	31.3	Very low	137 Å²	137	132.7 Å²	132.7	60%	0.596	71%	0.713	S	S	*	*			cis	171.4	175.3	-2.8	-118.6	179.1	-164.2	162.7	0	106.6	C801	C801-K816 PolarHBondContact SG-NZ 3.01Å; C801-K816 VanDerWaalsContact SG-NZ 3.39Å
817	P	38.3	Very low	31	Very low	68 Å²	68	128.2 Å²	128.2	44%	0.442	69%	0.687	S	S	.	*				-140.8	165.9	-71.7	40.2	-20.6	0	0	0	116.1	L800	L800-P817 HydrophobicContact CD2-CG 4.39Å
818	K	32.7	Very low	31.4	Very low	162 Å²	162	122.2 Å²	122.2	70%	0.704	66%	0.656	S	S	*	*			trans	64.6	159.1	147.1	-78.8	170.7	-175.6	178.6	0	117.5
819	K	31.5	Very low	31.3	Very low	179 Å²	179	119.1 Å²	119.1	78%	0.778	63%	0.63	S	S	*	*			cis	-151.6	124.2	7.8	-121.4	179	179.3	-174.5	0	106.3
820	S	29.7	Very low	31.2	Very low	91 Å²	91	120 Å²	120	64%	0.636	62%	0.62	S	S	*	*				75.2	91.9	93.8	78.4	0	0	0	0	117.1
821	D	26.7	Very low	31	Very low	171 Å²	171	118.3 Å²	118.3	91%	0.914	61%	0.61	S	S	*	*			trans	-81.3	160.4	147.7	-78.8	-54.1	0	0	0	110.2
822	T	29.3	Very low	30.7	Very low	120 Å²	120	118.4 Å²	118.4	74%	0.736	59%	0.589	S	S	*	*			trans	-140.7	111.6	-172.9	-60.7	0	0	0	0	113.9
823	K	29.9	Very low	30.5	Very low	191 Å²	191	114.4 Å²	114.4	83%	0.83	58%	0.582	S	S	*	*			trans	75.3	162.3	149.9	-101.2	-172.4	174.8	-169.7	0	121.6
824	V	30.3	Very low	30.1	Very low	115 Å²	115	112.1 Å²	112.1	70%	0.697	58%	0.583	S	S	*	*			trans	75.9	114.8	158.9	159.1	0	0	0	0	114.6
825	D	25.6	Very low	29.9	Very low	136 Å²	136	111.3 Å²	111.3	73%	0.727	59%	0.586	S	S	*	*				75.1	129.4	61.1	-74.1	-31	0	0	0	111.9
826	S	27.3	Very low	29.7	Very low	56 Å²	56	111.1 Å²	111.1	39%	0.392	59%	0.589	S	S	.	*			cis	-154.6	174.8	-10.8	-22.2	0	0	0	0	112.5	E498	E498-S826 WeakPolarHBondContact OE1-CB 3.45Å; E498-S826 PolarHBondContact OE1-OG 3.47Å; E498-S826 WeakPolarHBondContact OE2-CB 3.45Å
827	S	29.2	Very low	29.4	Very low	32 Å²	32	111.2 Å²	111.2	22%	0.224	60%	0.596	C	S	.	*			trans	62.3	170.6	138.1	100.2	0	0	0	0	121.3	W495 E498	W495-S827 WeakPolarHBondContact CA-OG 3.3Å; W495-S827 VanDerWaalsContact CB-OG 3.23Å; W495-S827 WeakPolarHBondContact CB-OG 3.45Å; W495-S827 PolarHBondContact N-OG 3Å; E498-S827 WeakPolarHBondContact OE2-CB 3.43Å; E498-S827 PolarHBondContact OE2-OG 2.88Å
828	P	38.9	Very low	29	Very low	11 Å²	11	113.2 Å²	113.2	7%	0.071	61%	0.612	C	S	.	*			trans	-146.5	-173.1	-155.2	49.9	-34.6	0	0	0	117.7	P482 F491 W495	P482-P828 HydrophobicContact CG-CB 3.47Å; P482-P828 VanDerWaalsContact CG-CB 3.47Å; P482-P828 HydrophobicContact CG-CG 4Å; F491-P828 HydrophobicContact CD1-CG 3.53Å; F491-P828 VanDerWaalsContact CD2-CD 3.48Å; F491-P828 HydrophobicContact CD2-CG 3.84Å; F491-P828 HydrophobicContact CE1-CB 4.38Å; F491-P828 HydrophobicContact CE1-CG 3.5Å; F491-P828 VanDerWaalsContact CE1-CG 3.5Å; F491-P828 HydrophobicContact CE2-CG 3.76Å; F491-P828 HydrophobicContact CG-CG 3.71Å; F491-P828 HydrophobicContact CZ-CB 4.2Å; F491-P828 HydrophobicContact CZ-CG 3.59Å; F491-P828 WeakPolarHBondContact O-CD 3.34Å; W495-P828 WeakPolarHBondContact CB-O 2.84Å; W495-P828 VanDerWaalsContact CD1-CA 3.49Å; W495-P828 VanDerWaalsContact CD2-O 3.26Å
829	R	26.9	Very low	28.8	Very low	69 Å²	69	113.8 Å²	113.8	26%	0.26	62%	0.617	S	S	.	*			trans	-137.4	137.2	138.4	-96.6	-177.8	-169.7	144.8	13.7	111.5	M481 P482 L492 W495	M481-R829 VanDerWaalsContact CA-O 3.28Å; M481-R829 WeakPolarHBondContact CA-O 3.31Å; M481-R829 WeakPolarHBondContact CB-O 3.34Å; M481-R829 HydrophobicContact CE-CB 3.88Å; M481-R829 WeakPolarHBondContact CG-O 3.45Å; P482-R829 WeakPolarHBondContact CD-O 3.42Å; L492-R829 HydrophobicContact CD2-CG 4.01Å; L492-R829 PolarHBondContact O-NH2 3.24Å; W495-R829 HydrophobicContact CD2-CG 4.32Å; W495-R829 HydrophobicContact CE3-CB 4.27Å; W495-R829 HydrophobicContact CE3-CG 3.74Å; W495-R829 HydrophobicContact CZ3-CB 4.25Å; W495-R829 HydrophobicContact CZ3-CG 3.99Å
830	R	30.3	Very low	28.5	Very low	103 Å²	103	110.5 Å²	110.5	39%	0.389	62%	0.616	S	S	.	*				46.4	123.1	98.5	-57.8	-175.9	155.2	-163	-13	115.2	P482 L484 T487 L492	P482-R830 VanDerWaalsContact O-CA 3.27Å; P482-R830 WeakPolarHBondContact O-CA 3.34Å; P482-R830 PolarHBondContact O-N 2.89Å; L484-R830 HydrophobicContact CB-CB 4.46Å; L484-R830 HydrophobicContact CB-CG 4.49Å; L484-R830 HydrophobicContact CD1-CG 3.8Å; L484-R830 VanDerWaalsContact CD1-NE 3.31Å; T487-R830 HydrophobicContact CG2-CG 4.39Å; L492-R830 HydrophobicContact CD1-CG 4.49Å; L492-R830 HydrophobicContact CD2-CG 3.38Å
831	K	25.2	Very low	28.4	Very low	158 Å²	158	110.3 Å²	110.3	69%	0.687	61%	0.614	S	S	*	*				-144.5	159.8	100.8	-64.4	-159	-179.9	-177.7	0	110.7	T483 L484	T483-K831 WeakPolarHBondContact CA-O 3.4Å; L484-K831 VanDerWaalsContact CB-C 3.46Å; L484-K831 PolarHBondContact N-O 3.26Å
832	H	28.9	Very low	28.6	Very low	82 Å²	82	109.2 Å²	109.2	38%	0.38	61%	0.607	S	S	.	*			trans	-110.8	169.7	154.1	-90	-66.6	0	0	0	107.3	L484 E485	L484-H832 HydrophobicContact CB-CB 3.96Å; L484-H832 HydrophobicContact CD2-CB 3.9Å; L484-H832 HydrophobicContact CG-CB 4.3Å; L484-H832 WeakPolarHBondContact CG-CD2 3.48Å; E485-H832 WeakPolarHBondContact CB-CE1 3.19Å; E485-H832 IonicContact OE1-CE1 2.74Å; E485-H832 PolarHBondContact OE1-CE1 3.41Å; E485-H832 IonicContact OE1-ND1 2.73Å; E485-H832 PolarHBondContact OE1-ND1 2.83Å; E485-H832 IonicContact OE2-CE1 3.18Å
833	S	30.2	Very low	28.4	Very low	105 Å²	105	109.6 Å²	109.6	73%	0.734	60%	0.6	S	S	*	*			trans	55.3	99.8	136.5	66.3	0	0	0	0	119.7
834	S	26	Very low	28.5	Very low	111 Å²	111	108.5 Å²	108.5	78%	0.776	60%	0.595	S	S	*	*				-61.4	167	116.8	56.5	0	0	0	0	110.2
835	S	28.6	Very low	28.4	Very low	92 Å²	92	107.5 Å²	107.5	64%	0.643	59%	0.593	S	S	*	*			cis	-169.8	153	29.8	52.9	0	0	0	0	113.1
836	L	27.7	Very low	28.7	Very low	144 Å²	144	108.3 Å²	108.3	75%	0.754	59%	0.59	S	S	*	*			trans	58.7	111.4	135.5	-67.7	166.8	0	0	0	122.8
837	N	24.8	Very low	28.8	Very low	140 Å²	140	112.2 Å²	112.2	75%	0.749	60%	0.602	S	S	*	*				57.6	152.9	115.9	-68.5	4.4	0	0	0	125.1
838	S	28.9	Very low	28.7	Very low	110 Å²	110	117.2 Å²	117.2	77%	0.769	63%	0.626	S	S	*	*			trans	87.7	148.4	153.4	83.3	0	0	0	0	117.9
839	Q	28.9	Very low	28.1	Very low	173 Å²	173	121.8 Å²	121.8	81%	0.808	65%	0.654	S	S	*	*			cis	-167	161.7	-19.1	-119.8	179.6	-11.3	0	0	111.4
840	C	24.5	Very low	28.1	Very low	111 Å²	111	123.9 Å²	123.9	75%	0.75	68%	0.675	S	S	*	*			trans	68.3	156.4	153.3	-73.8	0	0	0	0	120.2
841	S	29	Very low	27.9	Very low	86 Å²	86	126.2 Å²	126.2	60%	0.601	69%	0.693	S	S	*	*			cis	-177.1	165.7	-15.9	52.8	0	0	0	0	114
842	I	29.5	Very low	27.9	Very low	148 Å²	148	123.7 Å²	123.7	76%	0.759	70%	0.696	S	S	*	*			trans	81.6	148	144.4	-106.1	169.4	0	0	0	116.6
843	H	26.7	Very low	28.3	Very low	129 Å²	129	125.4 Å²	125.4	60%	0.597	71%	0.714	S	S	*	*			cis	-171.9	153.7	-3.6	-150.4	25.2	0	0	0	114.4
844	K	30.8	Very low	28.1	Very low	167 Å²	167	124.9 Å²	124.9	73%	0.726	71%	0.71	S	S	*	*			trans	66.6	159.9	148.2	-82.7	178.5	179.2	142	0	120.5
845	S	28.9	Very low	28.1	Very low	94 Å²	94	127 Å²	127	66%	0.657	71%	0.708	S	S	*	*			cis	-172.9	164	-9.8	48.2	0	0	0	0	115.2
846	K	31.5	Very low	27.9	Very low	153 Å²	153	129.5 Å²	129.5	67%	0.665	71%	0.709	S	S	*	*			trans	80.8	128	144.8	-87.9	-172.6	172.2	-75.6	0	121.9
847	E	30.6	Very low	27.8	Very low	138 Å²	138	127.9 Å²	127.9	65%	0.645	70%	0.7	S	S	*	*				52.4	148.3	124.4	-70	156.1	-149.4	0	0	121
848	D	26.5	Very low	27.9	Very low	137 Å²	137	127.9 Å²	127.9	73%	0.733	70%	0.7	S	S	*	*			cis	-162.4	177.3	6.8	-136.7	-28.4	0	0	0	114.7
849	V	26.5	Very low	27.8	Very low	108 Å²	108	126.5 Å²	126.5	66%	0.655	70%	0.696	S	S	*	*			trans	76.2	107.2	141.4	157.9	0	0	0	0	122.9
850	T	26.1	Very low	28.6	Very low	112 Å²	112	124.1 Å²	124.1	69%	0.687	70%	0.695	S	S	*	*			trans	88.1	127.9	135	55.4	0	0	0	0	126.6
851	I	26.9	Very low	28.6	Very low	153 Å²	153	124.4 Å²	124.4	79%	0.785	70%	0.698	S	S	*	*			trans	86.9	111.6	131.2	-69.5	165.4	0	0	0	120.8
852	S	25.4	Very low	28.8	Very low	105 Å²	105	127.6 Å²	127.6	73%	0.734	71%	0.708	S	S	*	*			trans	-39.5	177.6	153.7	-33.5	0	0	0	0	116.3
853	P	36.6	Very low	28.8	Very low	117 Å²	117	128.2 Å²	128.2	76%	0.76	71%	0.708	S	S	*	*			cis	-128.8	-161.5	5.8	47.7	-31.5	0	0	0	111
854	S	26.8	Very low	28.8	Very low	94 Å²	94	127.6 Å²	127.6	66%	0.657	71%	0.709	S	S	*	*			cis	-150.1	151.1	-9.4	29.4	0	0	0	0	105.5
855	Q	26	Very low	28.8	Very low	157 Å²	157	128 Å²	128	73%	0.734	71%	0.711	S	S	*	*				53.1	112	69.8	-126.5	-171.7	-62.2	0	0	109.5
856	E	23.4	Very low	28.7	Very low	143 Å²	143	135.2 Å²	135.2	67%	0.668	72%	0.724	S	S	*	*				149.5	153.2	97.1	-85.8	-141.8	158.8	0	0	109.3
857	I	26	Very low	28.4	Very low	110 Å²	110	134.3 Å²	134.3	56%	0.564	73%	0.731	S	S	*	*			cis	-165.1	148.8	-18.7	-132.7	-175.8	0	0	0	111.8
858	N	25.8	Very low	28.6	Very low	141 Å²	141	133.5 Å²	133.5	75%	0.754	74%	0.738	S	S	*	*			trans	48.5	-158.5	151.3	-50.7	-23.1	0	0	0	117.9
859	A	27	Very low	28.5	Very low	81 Å²	81	132 Å²	132	67%	0.669	74%	0.738	S	S	*	*			cis	-166.3	-170.1	11.3	0	0	0	0	0	111.2
860	P	45.9	Very low	29.5	Very low	123 Å²	123	132.8 Å²	132.8	80%	0.799	75%	0.746	S	S	*	*			cis	-137	-175.4	-37.7	36.6	-19.5	0	0	0	113.1
861	S	25.5	Very low	29.6	Very low	116 Å²	116	130.9 Å²	130.9	81%	0.811	75%	0.748	S	S	*	*			trans	-158.1	144.1	147	54.3	0	0	0	0	109.4
862	D	32.4	Very low	30.5	Very low	153 Å²	153	129.6 Å²	129.6	82%	0.818	75%	0.75	S	S	*	*			cis	-158.2	179.8	-20.1	-157.4	-12.4	0	0	0	108.6
863	E	28.7	Very low	30.8	Very low	162 Å²	162	130.1 Å²	130.1	76%	0.757	75%	0.748	S	S	*	*			trans	70.5	143.5	174.6	-61.8	-157.9	168.7	0	0	117.2
864	N	28.1	Very low	30.4	Very low	116 Å²	116	132.7 Å²	132.7	62%	0.62	75%	0.75	S	S	*	*			cis	-158.4	165.5	15.6	-144.4	-51.7	0	0	0	113.5
865	K	30.2	Very low	30.8	Very low	174 Å²	174	133 Å²	133	76%	0.757	75%	0.752	S	S	*	*			trans	75.6	119	159.2	-65	173.2	-175.6	165.1	0	122.6
866	R	27	Very low	31	Very low	247 Å²	247	134.8 Å²	134.8	93%	0.932	76%	0.758	S	S	*	*			trans	78.8	136.6	140.3	-71.8	-176.8	172.2	174.8	-3.3	121.1
867	T	24.5	Very low	32	Very low	134 Å²	134	135.9 Å²	135.9	82%	0.822	77%	0.767	S	S	*	*			trans	-82.3	172.2	173	40.8	0	0	0	0	111.9
868	P	35.5	Very low	32.1	Very low	121 Å²	121	139.1 Å²	139.1	79%	0.786	79%	0.785	S	S	*	*			cis	-137.2	-171.4	21.1	43.1	-23.3	0	0	0	117.9
869	S	25.1	Very low	32.7	Very low	104 Å²	104	141.2 Å²	141.2	73%	0.727	79%	0.79	S	S	*	*			trans	-78.9	-168.6	176.7	61	0	0	0	0	114.5
870	P	47.5	Very low	32.7	Very low	126 Å²	126	148.8 Å²	148.8	82%	0.818	80%	0.801	S	S	*	*			cis	-129.5	-175.8	-22	28.8	-7.4	0	0	0	113
871	G	26.5	Very low	31.9	Very low	72 Å²	72	147.5 Å²	147.5	74%	0.742	80%	0.801	S	S	*	*			trans	163.8	136.8	160.8	0	0	0	0	0	116.4
872	P	45.7	Very low	32.2	Very low	125 Å²	125	145.3 Å²	145.3	81%	0.812	80%	0.797	S	S	*	*			trans	-131.6	-166.5	-170.5	27.8	-2.6	0	0	0	115.5
873	V	32.6	Very low	32	Very low	117 Å²	117	146 Å²	146	71%	0.709	80%	0.801	S	S	*	*			trans	114.9	127.5	144.7	-175.2	0	0	0	0	119.1
874	E	27.5	Very low	32.2	Very low	170 Å²	170	142.9 Å²	142.9	79%	0.794	80%	0.803	S	S	*	*			trans	74.1	154.5	153.7	-84.2	165.1	-142.1	0	0	126.1
875	S	36.2	Very low	32.4	Very low	100 Å²	100	143.2 Å²	143.2	70%	0.699	81%	0.814	S	S	*	*			trans	-116.8	172.4	-169.1	55.8	0	0	0	0	111.5
876	K	29.3	Very low	32.5	Very low	195 Å²	195	138.9 Å²	138.9	85%	0.848	81%	0.811	S	S	*	*			trans	-163.8	153.8	140.4	-108.6	142.5	-172.1	157.1	0	112.8
877	L	44.3	Very low	33.1	Very low	166 Å²	166	133 Å²	133	87%	0.869	80%	0.804	S	S	*	*			trans	-100.7	151	172.4	-88.7	152.9	0	0	0	110
878	L	29.3	Very low	33.4	Very low	178 Å²	178	136.1 Å²	136.1	93%	0.932	80%	0.801	S	S	*	*			trans	-159	155.9	148.7	-142.2	76.6	0	0	0	111.4
879	E	36.9	Very low	33.1	Very low	186 Å²	186	140.5 Å²	140.5	87%	0.869	81%	0.808	S	S	*	*			trans	-137.8	145.4	-176.4	176.4	-172	-171.6	0	0	109.4
880	R	28.7	Very low	33.4	Very low	239 Å²	239	140.1 Å²	140.1	90%	0.902	80%	0.798	S	S	*	*			trans	-165.1	121.5	167.4	-162.6	167.5	-175	158.7	3.1	115.9
881	A	28.9	Very low	32.8	Very low	96 Å²	96	141 Å²	141	79%	0.793	80%	0.801	S	S	*	*			trans	49.5	149.1	152.7	0	0	0	0	0	121.2
882	G	30.5	Very low	33.5	Very low	71 Å²	71	143 Å²	143	73%	0.732	79%	0.791	S	S	*	*			cis	128	125.2	-11.5	0	0	0	0	0	115.1
883	D	28.9	Very low	33	Very low	168 Å²	168	144.2 Å²	144.2	90%	0.898	79%	0.786	S	S	*	*			trans	-172.1	155.5	151.7	-120.5	-25.8	0	0	0	114.6
884	A	33.3	Very low	33.4	Very low	96 Å²	96	144.8 Å²	144.8	79%	0.793	78%	0.784	S	S	*	*			trans	39.5	142.5	160.9	0	0	0	0	0	122.4
885	S	31.3	Very low	33.6	Very low	122 Å²	122	143 Å²	143	85%	0.853	78%	0.775	S	S	*	*			cis	-155.3	164.6	1.9	51.2	0	0	0	0	112.2
886	A	33.3	Very low	33.5	Very low	84 Å²	84	145.5 Å²	145.5	69%	0.694	77%	0.771	S	S	*	*			trans	-111.4	-172.8	-178.5	0	0	0	0	0	111.4
887	P	38.7	Very low	33.8	Very low	122 Å²	122	144.6 Å²	144.6	79%	0.792	76%	0.762	S	S	*	*			cis	-109.9	163.6	20.5	43	-34.6	0	0	0	114
888	R	32.5	Very low	33.1	Very low	201 Å²	201	142.3 Å²	142.3	76%	0.758	75%	0.75	S	S	*	*			cis	76.3	110.5	33.1	-98.3	-170.1	175.6	174.4	0.8	117.5
889	F	28.8	Very low	33.5	Very low	213 Å²	213	138 Å²	138	93%	0.934	74%	0.735	S	S	*	*				-141.9	137.3	127.8	-105.1	-78.2	0	0	0	108.9
890	N	31.3	Very low	33.2	Very low	96 Å²	96	139.6 Å²	139.6	51%	0.513	73%	0.733	S	S	.	*			trans	-105.3	157.1	179.7	-87	14	0	0	0	111.4	E892	N890-E892 HydrophobicContact CB-CG 4.44Å; N890-E892 WeakPolarHBondContact CB-OE1 3.27Å; N890-E892 PolarHBondContact ND2-OE1 3.16Å
891	T	34.1	Very low	33.4	Very low	143 Å²	143	136.4 Å²	136.4	88%	0.877	73%	0.728	S	S	*	*			trans	-122.5	164.3	143.9	52.5	0	0	0	0	108.6
892	E	40.6	Very low	33.6	Very low	114 Å²	114	137.6 Å²	137.6	53%	0.533	72%	0.72	S	S	.	*			trans	-142.8	139.6	-151.3	-68.8	-71	166.6	0	0	113.9	N890	N890-E892 HydrophobicContact CB-CG 4.44Å; N890-E892 WeakPolarHBondContact CB-OE1 3.27Å; N890-E892 PolarHBondContact ND2-OE1 3.16Å
893	Q	35.8	Very low	33.5	Very low	152 Å²	152	141.3 Å²	141.3	71%	0.71	72%	0.723	S	S	*	*			trans	70.2	166.7	138.7	-68.4	168.6	37.5	0	0	117.8
894	I	41.4	Very low	33.5	Very low	129 Å²	129	137.4 Å²	137.4	66%	0.662	71%	0.714	S	S	*	*			cis	-158.2	157.8	-0.1	-125.5	168.7	0	0	0	106.5
895	Q	31.3	Very low	33.2	Very low	131 Å²	131	139.4 Å²	139.4	61%	0.612	72%	0.716	S	S	*	*			cis	-156.5	-135.6	-11.7	-143.8	170.8	-3	0	0	106.3
896	Y	34.6	Very low	33	Very low	154 Å²	154	139.9 Å²	139.9	60%	0.604	71%	0.714	S	S	*	*			cis	-166.1	152.3	-5.7	-133.1	-30.2	0	0	0	110.9
897	R	34.4	Very low	32.6	Very low	176 Å²	176	141.9 Å²	141.9	66%	0.664	72%	0.717	S	S	*	*			trans	65.5	145	149.3	-61.7	-148.2	130	99.1	11.9	121.7
898	D	31.1	Very low	33.3	Very low	118 Å²	118	141.4 Å²	141.4	63%	0.631	72%	0.715	S	S	*	*			cis	-174.5	166.6	-15.7	-104	1.4	0	0	0	106.8
899	S	37.9	Very low	33	Very low	87 Å²	87	138.8 Å²	138.8	61%	0.608	71%	0.711	S	S	*	*			cis	-173.6	-171.3	-22.4	58.3	0	0	0	0	109.1
900	R	29.7	Very low	32.8	Very low	219 Å²	219	138.3 Å²	138.3	83%	0.826	70%	0.703	S	S	*	*			trans	82.8	99.1	166.7	-58.2	-174.3	176.8	-165.1	-4.2	120.9
901	E	32.7	Very low	32.4	Very low	172 Å²	172	144.8 Å²	144.8	80%	0.804	72%	0.72	S	S	*	*				35.2	152	102.2	-58.1	-175.4	117.5	0	0	120.5
902	I	33.2	Very low	32.6	Very low	122 Å²	122	142.7 Å²	142.7	63%	0.626	71%	0.709	S	S	*	*			cis	-163.4	153	24.1	-140.8	159.1	0	0	0	113.2
903	N	29.4	Very low	31.8	Very low	149 Å²	149	143 Å²	143	80%	0.797	72%	0.719	S	S	*	*			trans	58.5	156.4	158.6	-64.6	-16.6	0	0	0	121.3
904	A	27.6	Very low	31.4	Very low	86 Å²	86	140.8 Å²	140.8	71%	0.711	72%	0.72	S	S	*	*			cis	-166.2	158.7	-17.5	0	0	0	0	0	113.3
905	V	27.3	Very low	30.7	Very low	137 Å²	137	140 Å²	140	83%	0.83	73%	0.726	S	S	*	*			trans	-6.6	142	162.7	-136.2	0	0	0	0	118.8
906	V	27.8	Very low	31.2	Very low	132 Å²	132	139.5 Å²	139.5	80%	0.8	73%	0.734	S	S	*	*				-164.6	168.3	66.2	175.5	0	0	0	0	113.3
907	T	24.4	Very low	30.8	Very low	126 Å²	126	141.5 Å²	141.5	77%	0.773	74%	0.741	S	S	*	*			trans	-100.9	-153.4	-173.3	49	0	0	0	0	114.9
908	P	54.3	Low	30.7	Very low	113 Å²	113	138.9 Å²	138.9	73%	0.734	75%	0.747	S	S	*	*				-127.3	-153.7	-80.9	41.5	-23.6	0	0	0	115.4
909	E	25	Very low	30.7	Very low	146 Å²	146	137.9 Å²	137.9	68%	0.682	75%	0.745	S	S	*	*			trans	75	161.5	179.8	-65.8	-156.2	93	0	0	116.1
910	R	24.5	Very low	30	Very low	202 Å²	202	138.9 Å²	138.9	76%	0.762	75%	0.752	S	S	*	*			cis	-154.6	171.7	10.1	-145.5	166	-130.6	173	14.4	114.9
911	R	23.2	Very low	29.7	Very low	232 Å²	232	134.8 Å²	134.8	88%	0.875	75%	0.746	S	S	*	*			trans	-54.7	179.5	156.7	-103.8	-174.5	-173.1	-176	4.5	114.1
912	P	38.8	Very low	29.4	Very low	99 Å²	99	134.2 Å²	134.2	64%	0.643	74%	0.744	S	S	*	*			cis	-146.4	178.5	-19	41	-21	0	0	0	117.8
913	T	24.1	Very low	29.2	Very low	120 Å²	120	136.1 Å²	136.1	74%	0.736	75%	0.754	S	S	*	*			trans	25.6	122.5	143.2	61.9	0	0	0	0	125.2
914	S	25.9	Very low	29.3	Very low	107 Å²	107	136.5 Å²	136.5	75%	0.748	76%	0.755	S	S	*	*				101.6	153	113.8	74.5	0	0	0	0	124.4
915	S	28.2	Very low	29.3	Very low	112 Å²	112	142.7 Å²	142.7	78%	0.783	76%	0.761	S	S	*	*			trans	82.8	157.5	162.7	84.4	0	0	0	0	118.2
916	P	40.2	Very low	29.3	Very low	120 Å²	120	140.6 Å²	140.6	78%	0.779	75%	0.752	S	S	*	*			cis	-127.5	176.5	-14.9	25	-2.4	0	0	0	115.1
917	R	28.1	Very low	29.3	Very low	196 Å²	196	142 Å²	142	74%	0.74	75%	0.749	S	S	*	*			trans	-72.3	157.5	168.9	-169.6	-176.2	173.3	166.8	0.7	111	T919	R917-T919 HydrophobicContact CG-CG2 4.19Å; R917-T919 PolarHBondContact NE-OG1 3.18Å; R917-T919 VanDerWaalsContact NE-OG1 3.07Å; R917-T919 PolarHBondContact NH2-OG1 3.34Å; R917-T919 VanDerWaalsContact NH2-OG1 3.1Å
918	P	32.5	Very low	29.6	Very low	122 Å²	122	140.4 Å²	140.4	79%	0.792	74%	0.743	S	S	*	*				-136.1	166.7	113.4	38.4	-29.9	0	0	0	113.8
919	T	30.4	Very low	28.4	Very low	96 Å²	96	140.6 Å²	140.6	59%	0.589	74%	0.742	S	S	*	*			trans	-146.1	117.8	176.2	45.7	0	0	0	0	111.5	R917	R917-T919 HydrophobicContact CG-CG2 4.19Å; R917-T919 PolarHBondContact NE-OG1 3.18Å; R917-T919 VanDerWaalsContact NE-OG1 3.07Å; R917-T919 PolarHBondContact NH2-OG1 3.34Å; R917-T919 VanDerWaalsContact NH2-OG1 3.1Å
920	S	23.1	Very low	29.1	Very low	108 Å²	108	141.1 Å²	141.1	76%	0.755	75%	0.75	S	S	*	*			trans	-166	111.4	166.6	50.2	0	0	0	0	107.5
921	N	24.1	Very low	30	Very low	134 Å²	134	142.1 Å²	142.1	72%	0.717	75%	0.754	S	S	*	*				75.5	118.8	80.9	-88.1	51.9	0	0	0	115
922	E	25.8	Very low	31.1	Very low	160 Å²	160	142.2 Å²	142.2	75%	0.748	75%	0.754	S	S	*	*			trans	57.8	112.2	139.5	-60.4	172.3	110.8	0	0	120.6
923	L	29.7	Very low	31.7	Very low	162 Å²	162	143 Å²	143	85%	0.848	76%	0.757	S	S	*	*				-175.5	129.9	104.1	-88.2	160.1	0	0	0	106.8
924	L	30.6	Very low	32.4	Very low	156 Å²	156	147.5 Å²	147.5	82%	0.817	76%	0.762	S	S	*	*			cis	72.2	140.8	43	-122.3	-173.5	0	0	0	114.2
925	R	27.3	Very low	32.6	Very low	217 Å²	217	147.7 Å²	147.7	82%	0.819	76%	0.763	S	S	*	*			trans	77.8	142.1	-168.2	-146.8	158.6	-78.2	-178.8	-4.1	111.1
926	S	26.7	Very low	33	Very low	92 Å²	92	153 Å²	153	64%	0.643	77%	0.766	S	S	*	*			cis	-154.6	134.9	37.6	51.8	0	0	0	0	116.8
927	H	28	Very low	33	Very low	163 Å²	163	157.6 Å²	157.6	76%	0.755	77%	0.774	S	S	*	*			trans	61.1	159	140.4	-54.1	-41.6	0	0	0	120.3
928	S	30.5	Very low	33.5	Very low	91 Å²	91	156.9 Å²	156.9	64%	0.636	78%	0.779	S	S	*	*			cis	-167.8	158.2	-27.6	53.9	0	0	0	0	112.2
929	T	29.8	Very low	34.2	Very low	118 Å²	118	155.6 Å²	155.6	72%	0.724	77%	0.771	S	S	*	*			trans	55	127.6	145.3	50.8	0	0	0	0	123.9
930	D	39.4	Very low	34.3	Very low	157 Å²	157	159.9 Å²	159.9	84%	0.84	78%	0.782	S	S	*	*			trans	89.8	160.7	136.5	-91.9	-61.1	0	0	0	125.3
931	R	44.8	Very low	34.9	Very low	223 Å²	223	160 Å²	160	84%	0.842	78%	0.781	S	S	*	*			trans	-139.9	154.6	-160.3	-83.3	175.9	156.1	-176.6	-5.7	113.8
932	R	46	Very low	35.5	Very low	234 Å²	234	161.6 Å²	161.6	88%	0.883	78%	0.782	S	S	*	*			trans	74.6	152.3	167.8	-74.1	-178.1	-80	-159.9	-6.1	117
933	V	50.2	Low	36.3	Very low	116 Å²	116	160.2 Å²	160.2	70%	0.703	78%	0.778	S	S	*	*			cis	-178.7	150.3	-46.3	133.2	0	0	0	0	108.2
934	Y	39.3	Very low	36.5	Very low	214 Å²	214	159.6 Å²	159.6	84%	0.839	77%	0.771	S	S	*	*			trans	69.1	134	179	-83.3	-64.4	0	0	0	117.9
935	S	29.5	Very low	36.7	Very low	111 Å²	111	157.9 Å²	157.9	78%	0.776	77%	0.772	S	S	*	*				-140.8	167.1	113	-166	0	0	0	0	109.8
936	R	37.3	Very low	36.8	Very low	222 Å²	222	152 Å²	152	84%	0.838	77%	0.765	S	S	*	*			trans	-81.5	174.2	159.4	-57.9	174.8	-164.9	161.9	6.1	107.5
937	F	39.7	Very low	37.1	Very low	217 Å²	217	155.6 Å²	155.6	95%	0.952	77%	0.774	S	S	*	*	S	Bend	trans	-52.7	147.4	-179.6	-78.8	-101.6	0	0	0	112.2
938	E	38.8	Very low	37	Very low	181 Å²	181	156 Å²	156	85%	0.846	78%	0.777	S	S	*	*			trans	-40.2	164.2	-164	-70.2	-165.8	134	0	0	119.6
939	P	47.3	Very low	37.7	Very low	96 Å²	96	156 Å²	156	62%	0.623	78%	0.775	S	S	*	*			cis	-129.1	-166.5	0.2	19	6.9	0	0	0	115.4
940	F	32.1	Very low	37.6	Very low	186 Å²	186	155.4 Å²	155.4	82%	0.816	77%	0.771	S	S	*	*			trans	94.3	100.8	163.4	-57.6	-78.9	0	0	0	121
941	C	35.9	Very low	37	Very low	110 Å²	110	153.7 Å²	153.7	74%	0.743	77%	0.771	S	S	*	*			trans	70.5	162.7	140.3	-67.4	0	0	0	0	120.9
942	K	36.2	Very low	36.2	Very low	168 Å²	168	149.1 Å²	149.1	73%	0.73	76%	0.763	S	S	*	*			cis	-172.2	161	-25.4	-108.6	-178.5	177.8	-175.1	0	110.7
943	I	43.3	Very low	35.6	Very low	130 Å²	130	146.3 Å²	146.3	67%	0.667	76%	0.762	S	S	*	*			trans	69.3	147.2	146.4	-72.7	169.6	0	0	0	120.8
944	E	34.7	Very low	35.3	Very low	149 Å²	149	145.2 Å²	145.2	70%	0.696	76%	0.758	S	S	*	*				175.2	148.4	-50.8	-94.5	143.1	60.7	0	0	110.4
945	S	33.4	Very low	34.7	Very low	120 Å²	120	141.5 Å²	141.5	84%	0.839	75%	0.752	S	S	*	*			trans	68.5	159.1	173.1	86.6	0	0	0	0	117.4
946	S	30.5	Very low	34.5	Very low	95 Å²	95	143 Å²	143	66%	0.664	76%	0.757	S	S	*	*			cis	-170.3	-176.9	-24.6	53.8	0	0	0	0	111.2
947	I	32.8	Very low	34.1	Very low	166 Å²	166	136.8 Å²	136.8	85%	0.851	75%	0.748	S	S	*	*			trans	91.4	145	160	-63.7	159.6	0	0	0	119.1
948	Q	25.9	Very low	33.6	Very low	173 Å²	173	133.3 Å²	133.3	81%	0.808	74%	0.738	S	S	*	*			trans	-123.9	-154	-175.8	-134.3	-170.9	2.4	0	0	107.1
949	P	45.5	Very low	33.2	Very low	90 Å²	90	132.4 Å²	132.4	58%	0.584	74%	0.739	S	S	*	*			cis	-131.8	-170.5	-36.7	30.7	-8	0	0	0	113.2
950	T	26.5	Very low	32.4	Very low	106 Å²	106	136.1 Å²	136.1	65%	0.65	74%	0.74	S	S	*	*			trans	43.3	131.3	144.6	52.9	0	0	0	0	123.6
951	S	27.7	Very low	32.8	Very low	120 Å²	120	133 Å²	133	84%	0.839	74%	0.739	S	S	*	*			trans	-125.2	153.9	135.4	61.9	0	0	0	0	109.2
952	N	28.6	Very low	32.4	Very low	127 Å²	127	133.1 Å²	133.1	68%	0.679	73%	0.728	S	S	*	*			trans	-144.2	139.4	-162.4	-51	-70.5	0	0	0	115.4
953	M	31.7	Very low	32.3	Very low	175 Å²	175	131.9 Å²	131.9	86%	0.862	73%	0.728	S	S	*	*			trans	62.1	-167.2	152	-65.3	-86	99	0	0	115.5
954	P	45	Very low	31.6	Very low	93 Å²	93	134.3 Å²	134.3	60%	0.604	73%	0.734	S	S	*	*				-137.3	-174.4	-105.2	41	-19.5	0	0	0	116.1
955	N	25.7	Very low	31.5	Very low	136 Å²	136	132.3 Å²	132.3	73%	0.727	74%	0.736	S	S	*	*			trans	61.2	137.1	151.8	-70.7	-12.1	0	0	0	121.4
956	T	26.4	Very low	31.3	Very low	142 Å²	142	130.8 Å²	130.8	87%	0.871	73%	0.731	S	S	*	*			trans	64.8	155	155.7	58.5	0	0	0	0	116.3
957	S	27.5	Very low	31.5	Very low	93 Å²	93	132.1 Å²	132.1	65%	0.65	74%	0.735	S	S	*	*			cis	-152.8	160.7	16	62.9	0	0	0	0	112.8
958	I	29.4	Very low	31.6	Very low	144 Å²	144	130.7 Å²	130.7	74%	0.738	73%	0.734	S	S	*	*			trans	37.1	115.6	137.6	-57.5	163.1	0	0	0	118.2
959	N	31.2	Very low	31.7	Very low	162 Å²	162	127.6 Å²	127.6	87%	0.866	73%	0.732	S	S	*	*				-158.1	153	112.3	-113.8	-44	0	0	0	115.6
960	R	30.6	Very low	31	Very low	173 Å²	173	130.2 Å²	130.2	65%	0.653	74%	0.741	S	S	*	*			trans	-104.3	157.4	173.8	-131	171.1	170.9	-137.3	-11.4	107.4	E962	R960-E962 HydrophobicContact CG-CB 4.37Å; R960-E962 IonicContact CZ-OE1 2.61Å; R960-E962 IonicContact CZ-OE2 3.19Å; R960-E962 IonicContact NH1-OE1 3.37Å; R960-E962 PolarHBondContact NH1-OE1 3.29Å; R960-E962 IonicContact NH1-OE2 2.73Å; R960-E962 PolarHBondContact NH1-OE2 3.39Å; R960-E962 IonicContact NH2-OE1 2.83Å; R960-E962 PolarHBondContact NH2-OE1 3.35Å; R960-E962 IonicContact NH2-OE2 2.79Å
961	P	40	Very low	31.2	Very low	121 Å²	121	130.1 Å²	130.1	79%	0.786	74%	0.744	S	S	*	*				-138.9	140.7	75.1	42.3	-28.3	0	0	0	111.5
962	E	28	Very low	31.3	Very low	113 Å²	113	135.7 Å²	135.7	53%	0.528	75%	0.748	S	S	.	*				48.3	109.4	67.3	-161.2	153.2	-115	0	0	112.5	R960	R960-E962 HydrophobicContact CG-CB 4.37Å; R960-E962 IonicContact CZ-OE1 2.61Å; R960-E962 IonicContact CZ-OE2 3.19Å; R960-E962 IonicContact NH1-OE1 3.37Å; R960-E962 PolarHBondContact NH1-OE1 3.29Å; R960-E962 IonicContact NH1-OE2 2.73Å; R960-E962 PolarHBondContact NH1-OE2 3.39Å; R960-E962 IonicContact NH2-OE1 2.83Å; R960-E962 PolarHBondContact NH2-OE1 3.35Å; R960-E962 IonicContact NH2-OE2 2.79Å
963	I	33.3	Very low	31.3	Very low	142 Å²	142	133 Å²	133	73%	0.728	75%	0.751	S	S	*	*				-161.5	127.3	97.8	-93	161.8	0	0	0	109.8
964	K	29.8	Very low	31.3	Very low	181 Å²	181	136.5 Å²	136.5	79%	0.787	76%	0.755	S	S	*	*			trans	41.2	153.5	138.1	-54.9	178.8	-171.6	175.3	0	122
965	S	31.3	Very low	30.6	Very low	107 Å²	107	137.7 Å²	137.7	75%	0.748	77%	0.765	S	S	*	*			cis	172.4	129.9	-33.8	52.1	0	0	0	0	109.7
966	A	31	Very low	31	Very low	87 Å²	87	136.6 Å²	136.6	72%	0.719	77%	0.768	S	S	*	*			trans	-179.4	95.9	156.2	0	0	0	0	0	109.2
967	T	33.1	Very low	31.8	Very low	124 Å²	124	136 Å²	136	76%	0.761	77%	0.767	S	S	*	*				78.2	111.3	83.2	56	0	0	0	0	117.1
968	V	35.9	Very low	31.9	Very low	136 Å²	136	139.4 Å²	139.4	82%	0.824	78%	0.775	S	S	*	*				81.3	138.4	127.4	172.5	0	0	0	0	116.7
969	S	27	Very low	32.1	Very low	108 Å²	108	138.8 Å²	138.8	76%	0.755	77%	0.772	S	S	*	*			cis	-141.6	166	15.7	-169	0	0	0	0	114.7
970	N	30.5	Very low	31.9	Very low	145 Å²	145	138 Å²	138	78%	0.775	77%	0.768	S	S	*	*			trans	-59.5	163.5	151.7	-67.3	-40.7	0	0	0	110.6
971	S	31	Very low	31.9	Very low	104 Å²	104	138.8 Å²	138.8	73%	0.727	77%	0.772	S	S	*	*				-179.7	158.6	59	54	0	0	0	0	116.3
972	Y	31	Very low	31.3	Very low	236 Å²	236	140.3 Å²	140.3	93%	0.925	77%	0.774	S	S	*	*			trans	12.8	140	151.7	-64.2	-82.9	0	0	0	123.8
973	G	28.4	Very low	31.4	Very low	72 Å²	72	140.6 Å²	140.6	74%	0.742	78%	0.783	S	S	*	*			trans	137.5	108.8	161	0	0	0	0	0	110.8
974	R	32.3	Very low	31.3	Very low	248 Å²	248	136.9 Å²	136.9	94%	0.936	78%	0.78	S	S	*	*			cis	75.9	129.5	47.4	-156.5	-175	-162.8	-146	6.3	113.9
975	S	28.9	Very low	31.5	Very low	118 Å²	118	135.5 Å²	135.5	83%	0.825	79%	0.787	S	S	*	*			trans	86.3	150.3	170.9	77.4	0	0	0	0	118.1
976	S	35.4	Very low	31.4	Very low	112 Å²	112	140.6 Å²	140.6	78%	0.783	79%	0.791	S	S	*	*			trans	-105.5	173.3	-179.2	-43.9	0	0	0	0	110.4
977	P	41.9	Very low	31.4	Very low	131 Å²	131	146.8 Å²	146.8	85%	0.851	80%	0.796	S	S	*	*			trans	-133	165.8	137.2	37	-27.1	0	0	0	114
978	M	29.3	Very low	31.2	Very low	164 Å²	164	145.8 Å²	145.8	81%	0.808	79%	0.794	S	S	*	*			trans	-97.8	156	170.3	-63.8	-178	77.3	0	0	111.4
979	L	34.4	Very low	31.1	Very low	131 Å²	131	148.7 Å²	148.7	69%	0.686	79%	0.792	S	S	*	*			trans	24.1	126.3	143.9	-58.2	173.4	0	0	0	119.4
980	N	26.7	Very low	31.4	Very low	146 Å²	146	152.3 Å²	152.3	78%	0.781	80%	0.797	S	S	*	*				-171	165.8	96.4	-99.5	-43.9	0	0	0	116.2
981	Y	30.3	Very low	31.9	Very low	188 Å²	188	151 Å²	151	74%	0.737	80%	0.796	S	S	*	*			trans	-59.9	145.8	-170.1	-73.1	-101.2	0	0	0	118.4
982	N	27.7	Very low	32	Very low	154 Å²	154	154 Å²	154	82%	0.824	80%	0.804	S	S	*	*				175.7	164.8	100.1	-90.7	-59.8	0	0	0	110.8
983	T	29.7	Very low	32.4	Very low	118 Å²	118	151.1 Å²	151.1	72%	0.724	80%	0.799	S	S	*	*			cis	-172.7	133.8	-39.2	-89.2	0	0	0	0	107.3
984	G	30.9	Very low	33.1	Very low	65 Å²	65	155.1 Å²	155.1	67%	0.67	80%	0.803	S	S	*	*			trans	162.2	133.2	166.1	0	0	0	0	0	119.3
985	V	33.8	Very low	34	Very low	152 Å²	152	153.2 Å²	153.2	92%	0.921	80%	0.801	S	S	*	*			trans	76.8	141.7	158.1	-167.7	0	0	0	0	118.6
986	Y	30.1	Very low	34.9	Very low	214 Å²	214	156.4 Å²	156.4	84%	0.839	80%	0.801	S	S	*	*			trans	-85.4	147.6	-169.7	-88.1	-127.3	0	0	0	114.7
987	R	30.9	Very low	35.3	Very low	217 Å²	217	161 Å²	161	82%	0.819	80%	0.801	S	S	*	*				-160.9	140.3	116.6	-110.1	-179	-170.4	-154.5	3.7	112.1
988	S	29	Very low	35.5	Very low	103 Å²	103	157.6 Å²	157.6	72%	0.72	79%	0.789	S	S	*	*			trans	-113.2	137.5	176.4	53.3	0	0	0	0	110.5
989	Y	34.4	Very low	36.3	Very low	197 Å²	197	157.7 Å²	157.7	77%	0.773	79%	0.786	S	S	*	*			trans	-129.2	136.4	169.6	-96	-87	0	0	0	111.1
990	Q	33.1	Very low	37	Very low	184 Å²	184	159.6 Å²	159.6	86%	0.86	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-97.8	164.7	172.6	-95.8	-178.7	-74.5	0	0	111
991	P	40.2	Very low	38.1	Very low	117 Å²	117	160 Å²	160	76%	0.76	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-76.1	168.8	-174.1	31.6	-36.9	0	0	0	114.5
992	N	32.6	Very low	38.9	Very low	168 Å²	168	160.2 Å²	160.2	90%	0.898	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-59.7	144.3	-178.4	-91	-39.6	0	0	0	114.8
993	E	39.9	Very low	39.8	Very low	174 Å²	174	161.1 Å²	161.1	81%	0.813	79%	0.792	S	S	*	*			trans	-115.9	152.5	164.7	-69.9	-161.7	154.1	0	0	112.7
994	N	44.5	Very low	40.4	Very low	156 Å²	156	158.9 Å²	158.9	83%	0.834	79%	0.792	S	S	*	*			trans	-83	120.6	-172	-74.3	-39.3	0	0	0	113.6	F996	N994-F996 PolarHBondContact O-N 2.86Å
995	K	50.6	Low	41.1	Very low	208 Å²	208	163 Å²	163	90%	0.904	80%	0.799	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	50	-175.4	-62.1	-177	179.6	177.1	0	115.2
996	F	46.7	Very low	41.6	Very low	186 Å²	186	165.4 Å²	165.4	82%	0.816	80%	0.797	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126	-16.5	173.7	-127.9	-93.9	0	0	0	115	N994	N994-F996 PolarHBondContact O-N 2.86Å
997	R	44.6	Very low	42.2	Very low	209 Å²	209	162.7 Å²	162.7	79%	0.789	80%	0.796	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-24.1	-177.2	-148.3	173.3	-160.8	-95.8	2.2	114.2
998	G	46.1	Very low	42.6	Very low	58 Å²	58	161.9 Å²	161.9	60%	0.598	80%	0.801	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-14	-171.5	0	0	0	0	0	116.6
999	F	46.9	Very low	43.1	Very low	167 Å²	167	166.1 Å²	166.1	73%	0.732	81%	0.806	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-40.5	-172.9	-154.9	-97.3	0	0	0	113	Q1001	F999-Q1001 VanDerWaalsContact C-N 3.3Å; F999-Q1001 PolarHBondContact O-N 3.4Å
1000	M	48.3	Very low	43.1	Very low	170 Å²	170	164 Å²	164	84%	0.837	81%	0.809	S	S	*	*	G	3₁₀ helix	trans	-72.6	-21.5	-179.1	-64.8	179.9	73.5	0	0	113.3	K1002	M1000-K1002 VanDerWaalsContact C-N 3.28Å; M1000-K1002 PolarHBondContact O-N 3.31Å
1001	Q	49.9	Very low	43.1	Very low	156 Å²	156	169 Å²	169	73%	0.729	83%	0.827	S	S	*	*	G	3₁₀ helix	trans	-81.9	1.9	-174	-153.3	169.3	2.4	0	0	114.4	F999	F999-Q1001 VanDerWaalsContact C-N 3.3Å; F999-Q1001 PolarHBondContact O-N 3.4Å
1002	K	47.4	Very low	43.3	Very low	192 Å²	192	171.7 Å²	171.7	84%	0.835	83%	0.831	S	S	*	*	G	3₁₀ helix	trans	-106.2	-3.2	178.5	-85.8	-169.8	172	-174.5	0	116.1	M1000	M1000-K1002 VanDerWaalsContact C-N 3.28Å; M1000-K1002 PolarHBondContact O-N 3.31Å
1003	F	45.7	Very low	43.8	Very low	173 Å²	173	171.8 Å²	171.8	76%	0.759	83%	0.827	S	S	*	*	S	Bend	trans	-99.3	-16.9	176.7	-85.8	-85.2	0	0	0	114.6	N1005	F1003-N1005 VanDerWaalsContact C-N 3.32Å; F1003-N1005 PolarHBondContact O-N 3.1Å; F1003-N1005 VanDerWaalsContact O-N 3.1Å
1004	G	43.8	Very low	44	Very low	71 Å²	71	171.7 Å²	171.7	73%	0.732	83%	0.828	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	35.3	-170.4	0	0	0	0	0	116.7
1005	N	45.3	Very low	44	Very low	152 Å²	152	172.6 Å²	172.6	81%	0.813	83%	0.828	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.8	25.3	-178	-133.7	6.5	0	0	0	116.5	F1003	F1003-N1005 VanDerWaalsContact C-N 3.32Å; F1003-N1005 PolarHBondContact O-N 3.1Å; F1003-N1005 VanDerWaalsContact O-N 3.1Å
1006	F	43.5	Very low	43.6	Very low	201 Å²	201	170.4 Å²	170.4	88%	0.882	82%	0.823	S	S	*	*	S	Bend	trans	-134.2	157.9	156.2	-89.9	-90.8	0	0	0	108.1
1007	I	42.3	Very low	43.4	Very low	157 Å²	157	169.4 Å²	169.4	81%	0.805	82%	0.823	S	S	*	*			trans	81.1	65.7	-169.3	-45.4	169.4	0	0	0	113.5
1008	H	41	Very low	43.3	Very low	200 Å²	200	166.6 Å²	166.6	93%	0.926	83%	0.826	S	S	*	*			trans	-136.4	74.4	139.1	-111.7	56.9	0	0	0	108.3
1009	K	37.7	Very low	43.1	Very low	192 Å²	192	174.9 Å²	174.9	84%	0.835	84%	0.843	S	S	*	*	S	Bend	trans	-161.2	119.6	171.8	-113.1	166.6	-174.7	176.2	0	110.1
1010	N	35.8	Very low	42.8	Very low	154 Å²	154	175.6 Å²	175.6	82%	0.824	85%	0.853	S	S	*	*			trans	75.1	109.6	171.9	-54.1	-13.9	0	0	0	117.4
1011	K	32.9	Very low	42.3	Very low	289 Å²	289	176.1 Å²	176.1	100%	1.257	85%	0.854	S	S	*	*			trans	73.9	0	174	-63.4	-173.5	176.3	-178.5	0	115.8

Retrieved 1,011 of 1,011 residues in 153.6 ms (Link to these results)

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