A0A5K4EP04_SCHMA Loading...

Putative sh2a

AlphaFold DB , UniProt , Accession A0A5K4EP04, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,049 aa.

						>A0A5K4EP04_SCHMA|A0A5K4EP04
MQEQSKRQKFLSMVEKMYVEPEELEELTEHEKFALFSAIKSEQIKRYNKWIADQEHFSKNTDNGKSNNNQPKKRVNYLCGPDGKLIVTTALAPDYDRTIHSDGCRSLETAPNISSKSIVLIREFESTTKSSEPNGMDSTITADSTTPTKTTIATTTTTAITTPTTVKSIFTTNVTFSTTTLTNTINSCSVANNTTNVSYSTDNAIMTYRDDKQRHENNVRLIQPNLIQGSFDSSVSEYDSASYTYDSSSYSFSSTTAPTNSSINTASKTIDSSISDVLSIGNNNSISPLNNNYRNIGNNSSNNNNINNNYIDHTFILSPTPFKRKLNLNQQTNNHFIPSLSNTINYNDNTTSCNVPTMNGHCQNCHNIIDNNNNNNNNNKINNDHNNKNIQSQTNGQYISIIKSFVQDNENNQNSFKKINNSSAPIITNETVATMTKNVTQPNHFYSPEIETTLNLYSQSNDFHSNNSNNNNARIDVQRKGGGRGVQVDNQEEITQFKNNNIDINMHRNDYKHQESDNTDTLIVCISNNNRNNTSVIMKTTTPYDNNDNSNNRYVDTNNIIMRTTNSDHNNIDVSSSINSNTSSIVSNNRNYYLDLDKQLNNNKRINNNSMNLKNSYESKNAFELTTHNRPNNSNNSTITILTDPSNTTNQGSDVSIDDAMPLSTITTTNKTLKRFVLTRSPLSSPPVTTPTSVSPAPYHQNHHINERTPPSSVMDNTNSSITKSHFNRISLLNNPYNLSHQNYGQIDPSFSSSTSELDKISSSITFSSNPSDYIIKTSFTKQPEPQQSRQEKKQPSSLINHQQSQQRITLNNNNNNNLSSLQQHSNYTDNSHTLNPTFSTTNSPPSIFPRPAFWTPDVRTSRKINNIIQEDPKTKVYKWFESYEAARLLVDFGLPITGFSPNLSSLTFSRVPEWFHGFLSREQAERLLTKSDKNGSFLLHLNESFLGYVISLFTSSYCNHFLVSVIAVKQTNSGSRNTTKSTYQLYGVANPEQFTDLRDLVKFYSVHSLGRNNNQQLLLYPVGQENPTLPDYLDIFYSRPDSNSSTRL
					

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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	61.7	Low	82.7	Confident	191 Å²	191	116 Å²	116	94%	0.941	55%	0.55	S	S	*	*				0	-82.3	0	-67.2	-157.1	-69.5	0	0	112.9	E3 Q4 S5	M1-E3 VanDerWaalsContact C-N 3.34Å; M1-E3 PolarHBondContact O-N 3.37Å; M1-Q4 WeakPolarHBondContact O-CB 3.41Å; M1-Q4 PolarHBondContact O-N 3.24Å; M1-S5 PolarHBondContact O-N 3.16Å
2	Q	77.1	Confident	83.2	Confident	176 Å²	176	109 Å²	109	82%	0.822	52%	0.523	S	S	*	.	H	α-helix	trans	-50.6	-46.4	-172.8	-78.3	179.6	-18.7	0	0	114.2	Q4 S5 K6	Q2-Q4 PolarHBondContact O-N 3.06Å; Q2-S5 WeakPolarHBondContact O-CB 3.49Å; Q2-S5 PolarHBondContact O-N 3.5Å; Q2-K6 PolarHBondContact O-N 3.29Å
3	E	79.4	Confident	83.8	Confident	117 Å²	117	100.8 Å²	100.8	55%	0.547	48%	0.483	S	S	.	.	H	α-helix	trans	-64.7	-38.9	178.8	-159.1	-156.1	147	0	0	113.2	M1 S5 K6 R7	M1-E3 VanDerWaalsContact C-N 3.34Å; M1-E3 PolarHBondContact O-N 3.37Å; E3-S5 VanDerWaalsContact C-N 3.32Å; E3-S5 PolarHBondContact O-N 3.43Å; E3-K6 PolarHBondContact O-N 3.27Å; E3-R7 WeakPolarHBondContact O-CG 3.48Å; E3-R7 PolarHBondContact O-N 3.11Å; E3-R7 IonicContact OE1-CZ 3.04Å; E3-R7 IonicContact OE1-NE 3.15Å; E3-R7 PolarHBondContact OE1-NE 2.9Å; E3-R7 IonicContact OE1-NH2 3.95Å; E3-R7 PolarHBondContact OE1-NH2 2.84Å
4	Q	80.7	Confident	84.4	Confident	132 Å²	132	95.1 Å²	95.1	62%	0.617	46%	0.458	S	S	*	.	H	α-helix	trans	-65.3	-37.6	173.6	-70.1	163.7	-50.7	0	0	111.2	M1 Q2 R7 Q8	M1-Q4 WeakPolarHBondContact O-CB 3.41Å; M1-Q4 PolarHBondContact O-N 3.24Å; Q2-Q4 PolarHBondContact O-N 3.06Å; Q4-R7 PolarHBondContact O-N 2.87Å; Q4-Q8 WeakPolarHBondContact O-CG 3.47Å; Q4-Q8 PolarHBondContact O-N 3.17Å
5	S	85.3	Confident	84.7	Confident	79 Å²	79	98.2 Å²	98.2	55%	0.552	47%	0.472	S	S	*	.	H	α-helix	trans	-62.5	-47.8	173.1	-172.4	0	0	0	0	111.2	M1 Q2 E3 R7 Q8 K9	M1-S5 PolarHBondContact O-N 3.16Å; Q2-S5 WeakPolarHBondContact O-CB 3.49Å; Q2-S5 PolarHBondContact O-N 3.5Å; E3-S5 VanDerWaalsContact C-N 3.32Å; E3-S5 PolarHBondContact O-N 3.43Å; S5-R7 PolarHBondContact O-N 3.02Å; S5-Q8 PolarHBondContact O-N 3.06Å; S5-K9 WeakPolarHBondContact O-CB 2.89Å; S5-K9 PolarHBondContact O-N 2.95Å
6	K	84.5	Confident	85	Confident	83 Å²	83	99.9 Å²	99.9	36%	0.361	48%	0.477	S	S	.	.	H	α-helix	trans	-55	-47.7	172	-88.5	-165	156.8	-157.3	0	112.1	Q2 E3 Q8 K9 F10 E31	Q2-K6 PolarHBondContact O-N 3.29Å; E3-K6 PolarHBondContact O-N 3.27Å; K6-Q8 PolarHBondContact O-N 2.64Å; K6-K9 PolarHBondContact O-N 3.47Å; K6-F10 WeakPolarHBondContact O-CB 3.35Å; K6-F10 PolarHBondContact O-N 2.79Å; K6-E31 VanDerWaalsContact NZ-CD 3.33Å; K6-E31 IonicContact NZ-OE1 2.68Å; K6-E31 PolarHBondContact NZ-OE1 3.01Å; K6-E31 IonicContact NZ-OE2 3.63Å; K6-E31 PolarHBondContact NZ-OE2 3.34Å; K6-E31 VanDerWaalsContact NZ-OE2 3.12Å
7	R	86.6	Confident	85.2	Confident	157 Å²	157	96.1 Å²	96.1	59%	0.592	46%	0.459	S	S	*	.	H	α-helix	trans	-61.4	-42	178	-71.3	176.4	-175	-143.7	7.4	112.1	E3 Q4 S5 L11	E3-R7 WeakPolarHBondContact O-CG 3.48Å; E3-R7 PolarHBondContact O-N 3.11Å; E3-R7 IonicContact OE1-CZ 3.04Å; E3-R7 IonicContact OE1-NE 3.15Å; E3-R7 PolarHBondContact OE1-NE 2.9Å; E3-R7 IonicContact OE1-NH2 3.95Å; E3-R7 PolarHBondContact OE1-NH2 2.84Å; Q4-R7 PolarHBondContact O-N 2.87Å; S5-R7 PolarHBondContact O-N 3.02Å; R7-L11 VanDerWaalsContact O-CG 3.31Å; R7-L11 WeakPolarHBondContact O-CG 3.33Å; R7-L11 PolarHBondContact O-N 3.49Å
8	Q	87.4	Confident	85.3	Confident	133 Å²	133	98.4 Å²	98.4	62%	0.621	46%	0.463	S	S	*	.	H	α-helix	trans	-69.1	-39.5	175.9	-67.8	-68.3	13.6	0	0	112.4	Q4 S5 K6 L11 S12	Q4-Q8 WeakPolarHBondContact O-CG 3.47Å; Q4-Q8 PolarHBondContact O-N 3.17Å; S5-Q8 PolarHBondContact O-N 3.06Å; K6-Q8 PolarHBondContact O-N 2.64Å; Q8-L11 PolarHBondContact O-N 3.34Å; Q8-S12 PolarHBondContact O-N 2.72Å
9	K	87.5	Confident	85.5	Confident	56 Å²	56	94.5 Å²	94.5	24%	0.243	45%	0.447	C	S	.	.	H	α-helix	trans	-57.8	-51.1	174.1	-164.8	174.8	-174	178.3	0	110.4	S5 K6 L11 S12 M13 E23 E26	S5-K9 WeakPolarHBondContact O-CB 2.89Å; S5-K9 PolarHBondContact O-N 2.95Å; K6-K9 PolarHBondContact O-N 3.47Å; K9-L11 PolarHBondContact O-N 3Å; K9-S12 PolarHBondContact O-N 2.88Å; K9-S12 VanDerWaalsContact O-N 3.16Å; K9-S12 PolarHBondContact O-OG 2.67Å; K9-M13 HydrophobicContact CD-CE 4.32Å; K9-M13 HydrophobicContact CG-CE 3.89Å; K9-M13 WeakPolarHBondContact O-CG 3.19Å; K9-M13 PolarHBondContact O-N 3.18Å; K9-E23 VanDerWaalsContact CE-CD 3.4Å; K9-E23 VanDerWaalsContact CE-CG 3.46Å; K9-E23 WeakPolarHBondContact CE-OE1 3.36Å; K9-E23 IonicContact NZ-OE1 2.84Å; K9-E26 IonicContact NZ-OE1 2.93Å; K9-E26 IonicContact NZ-OE2 2.76Å; K9-E26 PolarHBondContact NZ-OE2 3.37Å
10	F	90.3	Very high	85.5	Confident	50 Å²	50	94.6 Å²	94.6	22%	0.219	45%	0.446	C	S	.	.	H	α-helix	trans	-56	-47.7	174.4	-174.7	-76.7	0	0	0	113	K6 S12 M13 V14 A34 L35 A38	K6-F10 WeakPolarHBondContact O-CB 3.35Å; K6-F10 PolarHBondContact O-N 2.79Å; F10-S12 VanDerWaalsContact C-N 3.32Å; F10-S12 PolarHBondContact O-N 3.12Å; F10-M13 WeakPolarHBondContact O-CB 3.42Å; F10-M13 PolarHBondContact O-N 2.7Å; F10-V14 HydrophobicContact CD1-CG2 4.21Å; F10-V14 HydrophobicContact CE1-CG2 4.01Å; F10-V14 WeakPolarHBondContact O-CG2 3.5Å; F10-V14 PolarHBondContact O-N 2.83Å; F10-V14 VanDerWaalsContact O-N 3.12Å; F10-A34 HydrophobicContact CE2-CB 4.26Å; F10-A34 HydrophobicContact CZ-CB 4.27Å; F10-L35 HydrophobicContact CD1-CD1 4.49Å; F10-L35 HydrophobicContact CD2-CB 4.14Å; F10-L35 HydrophobicContact CD2-CD1 4.01Å; F10-L35 HydrophobicContact CE1-CD1 4.46Å; F10-L35 HydrophobicContact CE2-CB 3.59Å; F10-L35 HydrophobicContact CE2-CD1 4Å; F10-L35 HydrophobicContact CE2-CG 4.37Å; F10-L35 HydrophobicContact CG-CD1 4.27Å; F10-L35 HydrophobicContact CZ-CB 4.16Å; F10-L35 HydrophobicContact CZ-CD1 4.22Å; F10-A38 HydrophobicContact CE1-CB 4.11Å; F10-A38 HydrophobicContact CZ-CB 4.16Å
11	L	89.4	Confident	85.6	Confident	102 Å²	102	94.2 Å²	94.2	53%	0.534	45%	0.452	S	S	.	.	H	α-helix	trans	-61.1	-41.3	176.5	-73.4	171	0	0	0	111.7	R7 Q8 K9 M13 V14 E15	R7-L11 VanDerWaalsContact O-CG 3.31Å; R7-L11 WeakPolarHBondContact O-CG 3.33Å; R7-L11 PolarHBondContact O-N 3.49Å; Q8-L11 PolarHBondContact O-N 3.34Å; K9-L11 PolarHBondContact O-N 3Å; L11-M13 VanDerWaalsContact C-N 3.34Å; L11-M13 PolarHBondContact O-N 2.87Å; L11-V14 PolarHBondContact O-N 2.93Å; L11-E15 PolarHBondContact O-N 3.3Å
12	S	88.1	Confident	86.7	Confident	32 Å²	32	93 Å²	93	22%	0.224	44%	0.444	C	S	.	.	H	α-helix	trans	-65.7	-34.5	177.9	84.1	0	0	0	0	113	Q8 K9 F10 E15 K16	Q8-S12 PolarHBondContact O-N 2.72Å; K9-S12 PolarHBondContact O-N 2.88Å; K9-S12 VanDerWaalsContact O-N 3.16Å; K9-S12 PolarHBondContact O-OG 2.67Å; F10-S12 VanDerWaalsContact C-N 3.32Å; F10-S12 PolarHBondContact O-N 3.12Å; S12-E15 PolarHBondContact O-N 2.89Å; S12-K16 VanDerWaalsContact O-CB 3.26Å; S12-K16 WeakPolarHBondContact O-CB 3.39Å; S12-K16 WeakPolarHBondContact O-CD 3.48Å; S12-K16 WeakPolarHBondContact O-CG 3.28Å; S12-K16 PolarHBondContact O-N 2.65Å
13	M	91.4	Very high	87	Confident	2 Å²	2	86 Å²	86	1%	0.01	41%	0.411	C	S	.	.	H	α-helix	trans	-64.8	-44.6	173.8	-67.3	155.8	166.3	0	0	111.5	K9 F10 L11 M17 Y18 V19 E23 L27 L35	K9-M13 HydrophobicContact CD-CE 4.32Å; K9-M13 HydrophobicContact CG-CE 3.89Å; K9-M13 WeakPolarHBondContact O-CG 3.19Å; K9-M13 PolarHBondContact O-N 3.18Å; F10-M13 WeakPolarHBondContact O-CB 3.42Å; F10-M13 PolarHBondContact O-N 2.7Å; L11-M13 VanDerWaalsContact C-N 3.34Å; L11-M13 PolarHBondContact O-N 2.87Å; M13-M17 PolarHBondContact O-N 3.39Å; M13-Y18 WeakPolarHBondContact CA-O 3.39Å; M13-Y18 PolarHBondContact O-N 2.83Å; M13-V19 HydrophobicContact CB-CG2 4.33Å; M13-V19 HydrophobicContact CE-CG1 3.97Å; M13-V19 HydrophobicContact CG-CG1 4.36Å; M13-V19 HydrophobicContact SD-CG1 4.22Å; M13-E23 HydrophobicContact CE-CB 3.37Å; M13-E23 HydrophobicContact CE-CG 4.12Å; M13-E23 VanDerWaalsContact CE-OE2 3.29Å; M13-E23 WeakPolarHBondContact CE-OE2 3.36Å; M13-L27 HydrophobicContact CE-CD1 4.48Å; M13-L27 HydrophobicContact SD-CD1 4.49Å; M13-L35 HydrophobicContact CB-CD1 3.86Å; M13-L35 HydrophobicContact CB-CD2 4.46Å; M13-L35 HydrophobicContact SD-CD1 4.22Å; M13-L35 HydrophobicContact SD-CD2 3.63Å
14	V	91.4	Very high	87.3	Confident	22 Å²	22	82.5 Å²	82.5	13%	0.133	40%	0.397	C	S	.	.	H	α-helix	trans	-64.7	-39.9	175.7	178.3	0	0	0	0	110.8	F10 L11 M17 L35 A38 I39 E42	F10-V14 HydrophobicContact CD1-CG2 4.21Å; F10-V14 HydrophobicContact CE1-CG2 4.01Å; F10-V14 WeakPolarHBondContact O-CG2 3.5Å; F10-V14 PolarHBondContact O-N 2.83Å; F10-V14 VanDerWaalsContact O-N 3.12Å; L11-V14 PolarHBondContact O-N 2.93Å; V14-M17 WeakPolarHBondContact O-CE 3.46Å; V14-M17 PolarHBondContact O-N 3.06Å; V14-L35 HydrophobicContact CG2-CD1 3.79Å; V14-A38 HydrophobicContact CG1-CB 4.46Å; V14-A38 HydrophobicContact CG2-CB 3.68Å; V14-I39 HydrophobicContact CG2-CG1 4.2Å; V14-E42 HydrophobicContact CG1-CB 4.01Å; V14-E42 HydrophobicContact CG1-CG 4.22Å
15	E	89.2	Confident	87.5	Confident	141 Å²	141	84 Å²	84	66%	0.659	40%	0.403	S	S	*	.	H	α-helix	trans	-64.7	-50.2	176.6	-174.2	175.3	-163	0	0	112.2	L11 S12 M17 R46	L11-E15 PolarHBondContact O-N 3.3Å; S12-E15 PolarHBondContact O-N 2.89Å; E15-M17 PolarHBondContact O-N 3.09Å; E15-R46 PolarHBondContact O-NH1 2.91Å; E15-R46 PolarHBondContact O-NH2 3.49Å
16	K	89.7	Confident	87.5	Confident	126 Å²	126	86 Å²	86	55%	0.548	40%	0.404	S	S	.	.	H	α-helix	trans	-66	-20.7	178.8	-70.4	168.2	-177.4	175.2	0	113.7	S12 Y18	S12-K16 VanDerWaalsContact O-CB 3.26Å; S12-K16 WeakPolarHBondContact O-CB 3.39Å; S12-K16 WeakPolarHBondContact O-CD 3.48Å; S12-K16 WeakPolarHBondContact O-CG 3.28Å; S12-K16 PolarHBondContact O-N 2.65Å; K16-Y18 PolarHBondContact O-N 2.87Å
17	M	88.8	Confident	87.5	Confident	35 Å²	35	82.9 Å²	82.9	17%	0.172	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	25.2	-169.5	-55	-100.2	84.3	0	0	113.7	M13 V14 E15 I39 E42 Q43	M13-M17 PolarHBondContact O-N 3.39Å; V14-M17 WeakPolarHBondContact O-CE 3.46Å; V14-M17 PolarHBondContact O-N 3.06Å; E15-M17 PolarHBondContact O-N 3.09Å; M17-I39 HydrophobicContact CE-CB 4.3Å; M17-I39 HydrophobicContact CE-CG1 4.46Å; M17-I39 HydrophobicContact CE-CG2 3.94Å; M17-I39 WeakPolarHBondContact CE-O 3.48Å; M17-E42 HydrophobicContact CE-CB 3.64Å; M17-E42 HydrophobicContact CE-CG 3.53Å; M17-E42 HydrophobicContact SD-CG 4.25Å; M17-Q43 HydrophobicContact CE-CG 4.15Å; M17-Q43 HydrophobicContact SD-CB 4.45Å; M17-Q43 HydrophobicContact SD-CG 3.53Å; M17-Q43 VanDerWaalsContact SD-CG 3.53Å
18	Y	87.1	Confident	87.7	Confident	137 Å²	137	79.2 Å²	79.2	54%	0.537	39%	0.387	S	S	.	.			trans	-143.8	147.6	-176.7	-176.1	-108.5	0	0	0	109.6	M13 K16 E20	M13-Y18 WeakPolarHBondContact CA-O 3.39Å; M13-Y18 PolarHBondContact O-N 2.83Å; K16-Y18 PolarHBondContact O-N 2.87Å; Y18-E20 HydrophobicContact CD1-CG 4.28Å; Y18-E20 HydrophobicContact CE1-CG 3.63Å
19	V	88.1	Confident	87.6	Confident	25 Å²	25	79.4 Å²	79.4	15%	0.152	39%	0.387	C	S	.	.			trans	-133.3	125.5	179.1	-165.3	0	0	0	0	106.3	M13 L24 L35 I39	M13-V19 HydrophobicContact CB-CG2 4.33Å; M13-V19 HydrophobicContact CE-CG1 3.97Å; M13-V19 HydrophobicContact CG-CG1 4.36Å; M13-V19 HydrophobicContact SD-CG1 4.22Å; V19-L24 HydrophobicContact CG1-CB 4.01Å; V19-L24 HydrophobicContact CG1-CD1 4.17Å; V19-L35 HydrophobicContact CG1-CD2 3.94Å; V19-L35 HydrophobicContact CG2-CD2 3.83Å; V19-L35 HydrophobicContact CG2-CG 4.37Å; V19-I39 HydrophobicContact CG2-CD1 3.58Å
20	E	87	Confident	87.7	Confident	95 Å²	95	84 Å²	84	44%	0.444	41%	0.409	S	S	.	.			trans	-74.5	141.9	175.1	-73.1	167	-154.2	0	0	109.3	Y18 E22 E23 L24	Y18-E20 HydrophobicContact CD1-CG 4.28Å; Y18-E20 HydrophobicContact CE1-CG 3.63Å; E20-E22 VanDerWaalsContact C-N 3.29Å; E20-E22 PolarHBondContact O-N 3.47Å; E20-E23 HydrophobicContact CB-CG 3.91Å; E20-E23 PolarHBondContact N-OE2 2.98Å; E20-E23 WeakPolarHBondContact O-CB 2.81Å; E20-E23 PolarHBondContact O-N 2.84Å; E20-L24 PolarHBondContact O-N 3.48Å
21	P	86.9	Confident	87.7	Confident	87 Å²	87	84 Å²	84	57%	0.565	41%	0.41	S	S	*	.	H	α-helix	trans	-57.3	-39.7	-173	-27.4	35.6	0	0	0	113.8	E23 L24 E25	P21-E23 PolarHBondContact O-N 3.44Å; P21-L24 WeakPolarHBondContact O-CB 3.29Å; P21-L24 PolarHBondContact O-N 2.9Å; P21-L24 VanDerWaalsContact O-N 3.16Å; P21-E25 PolarHBondContact O-N 3.16Å
22	E	85.6	Confident	87.7	Confident	165 Å²	165	80.8 Å²	80.8	77%	0.771	39%	0.392	S	S	*	.	H	α-helix	trans	-63.2	-41.2	177.5	-60.5	178.2	-167.5	0	0	111.3	E20 L24 E25 E26	E20-E22 VanDerWaalsContact C-N 3.29Å; E20-E22 PolarHBondContact O-N 3.47Å; E22-L24 VanDerWaalsContact C-N 3.29Å; E22-L24 PolarHBondContact O-N 3.23Å; E22-E25 PolarHBondContact O-N 3.02Å; E22-E26 PolarHBondContact O-N 3.31Å
23	E	83.1	Confident	87.8	Confident	29 Å²	29	86.4 Å²	86.4	14%	0.136	41%	0.413	C	S	.	.	H	α-helix	trans	-68.9	-27.4	175.3	-52.5	-175.2	121.6	0	0	112.9	K9 M13 E20 P21 L27	K9-E23 VanDerWaalsContact CE-CD 3.4Å; K9-E23 VanDerWaalsContact CE-CG 3.46Å; K9-E23 WeakPolarHBondContact CE-OE1 3.36Å; K9-E23 IonicContact NZ-OE1 2.84Å; M13-E23 HydrophobicContact CE-CB 3.37Å; M13-E23 HydrophobicContact CE-CG 4.12Å; M13-E23 VanDerWaalsContact CE-OE2 3.29Å; M13-E23 WeakPolarHBondContact CE-OE2 3.36Å; E20-E23 HydrophobicContact CB-CG 3.91Å; E20-E23 PolarHBondContact N-OE2 2.98Å; E20-E23 WeakPolarHBondContact O-CB 2.81Å; E20-E23 PolarHBondContact O-N 2.84Å; P21-E23 PolarHBondContact O-N 3.44Å; E23-L27 WeakPolarHBondContact O-CG 3.34Å
24	L	85.2	Confident	87.7	Confident	45 Å²	45	88.2 Å²	88.2	24%	0.236	43%	0.427	C	S	.	.	H	α-helix	trans	-72.4	-36.2	174.2	-171.8	70.2	0	0	0	111	V19 E20 P21 E22 E26 L27 K32 F36	V19-L24 HydrophobicContact CG1-CB 4.01Å; V19-L24 HydrophobicContact CG1-CD1 4.17Å; E20-L24 PolarHBondContact O-N 3.48Å; P21-L24 WeakPolarHBondContact O-CB 3.29Å; P21-L24 PolarHBondContact O-N 2.9Å; P21-L24 VanDerWaalsContact O-N 3.16Å; E22-L24 VanDerWaalsContact C-N 3.29Å; E22-L24 PolarHBondContact O-N 3.23Å; L24-E26 VanDerWaalsContact C-N 3.34Å; L24-L27 PolarHBondContact O-N 3.42Å; L24-K32 HydrophobicContact CD1-CB 4.49Å; L24-K32 HydrophobicContact CD1-CD 4.36Å; L24-K32 HydrophobicContact CD1-CG 3.9Å; L24-K32 HydrophobicContact CG-CD 4.47Å; L24-K32 HydrophobicContact CG-CG 4.47Å; L24-K32 WeakPolarHBondContact O-CE 3.31Å; L24-F36 HydrophobicContact CD1-CE1 4.38Å; L24-F36 HydrophobicContact CD1-CE2 4.36Å; L24-F36 HydrophobicContact CD1-CZ 3.78Å; L24-F36 HydrophobicContact CD2-CZ 4.09Å
25	E	85.2	Confident	87.7	Confident	162 Å²	162	87.1 Å²	87.1	76%	0.757	42%	0.421	S	S	*	.	H	α-helix	trans	-69.5	-27.3	177.1	-71.5	-174.1	-168.7	0	0	113.3	P21 E22 L27	P21-E25 PolarHBondContact O-N 3.16Å; E22-E25 PolarHBondContact O-N 3.02Å; E25-L27 PolarHBondContact O-N 2.92Å
26	E	84.7	Confident	87.8	Confident	121 Å²	121	85.5 Å²	85.5	57%	0.565	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-15.9	172.1	-71.2	-177.1	167	0	0	114.8	K9 E22 L24	K9-E26 IonicContact NZ-OE1 2.93Å; K9-E26 IonicContact NZ-OE2 2.76Å; K9-E26 PolarHBondContact NZ-OE2 3.37Å; E22-E26 PolarHBondContact O-N 3.31Å; L24-E26 VanDerWaalsContact C-N 3.34Å
27	L	85.1	Confident	87.7	Confident	18 Å²	18	81.8 Å²	81.8	9%	0.094	40%	0.402	C	S	.	.	S	Bend	trans	-93.5	137.8	-175.7	-64.8	167.8	0	0	0	111	M13 E23 L24 E25 E31 K32 L35	M13-L27 HydrophobicContact CE-CD1 4.48Å; M13-L27 HydrophobicContact SD-CD1 4.49Å; E23-L27 WeakPolarHBondContact O-CG 3.34Å; L24-L27 PolarHBondContact O-N 3.42Å; E25-L27 PolarHBondContact O-N 2.92Å; L27-E31 HydrophobicContact CB-CB 4Å; L27-E31 HydrophobicContact CD2-CB 3.91Å; L27-E31 HydrophobicContact CG-CB 4.49Å; L27-K32 HydrophobicContact CB-CG 3.82Å; L27-K32 WeakPolarHBondContact O-CE 3.41Å; L27-L35 HydrophobicContact CD1-CD2 3.62Å
28	T	89.6	Confident	87.9	Confident	81 Å²	81	81.5 Å²	81.5	50%	0.497	41%	0.405	S	S	.	.			trans	-64.7	155.8	168.8	58.4	0	0	0	0	110.8	H30 E31 K32	T28-H30 PolarHBondContact O-N 2.96Å; T28-H30 VanDerWaalsContact O-N 3.09Å; T28-E31 WeakPolarHBondContact CB-OE2 3.48Å; T28-E31 WeakPolarHBondContact CG2-OE2 3.45Å; T28-E31 PolarHBondContact N-OE2 2.99Å; T28-E31 CarbonylContact O-C 3.58Å; T28-E31 WeakPolarHBondContact O-CA 3.34Å; T28-E31 WeakPolarHBondContact O-CB 3.46Å; T28-E31 PolarHBondContact O-N 3.23Å; T28-E31 VanDerWaalsContact OG1-CG 3.28Å; T28-E31 WeakPolarHBondContact OG1-CG 3.42Å; T28-E31 PolarHBondContact OG1-N 3.41Å; T28-E31 PolarHBondContact OG1-OE2 2.85Å; T28-K32 WeakPolarHBondContact O-CG 3.38Å; T28-K32 PolarHBondContact O-N 3.31Å
29	E	87	Confident	88.1	Confident	137 Å²	137	75.8 Å²	75.8	64%	0.64	38%	0.384	S	S	*	.	H	α-helix	trans	-54.4	-33.1	179.2	-66.1	-54.7	129	0	0	113.5	K32 F33	E29-K32 WeakPolarHBondContact OE1-CD 3.26Å; E29-K32 IonicContact OE1-NZ 2.64Å; E29-K32 PolarHBondContact OE1-NZ 2.78Å; E29-F33 WeakPolarHBondContact O-CB 3.14Å; E29-F33 PolarHBondContact O-N 2.82Å
30	H	88.3	Confident	88.2	Confident	152 Å²	152	81 Å²	81	70%	0.704	41%	0.405	S	S	*	.	H	α-helix	trans	-68.7	-43.8	173.6	-175.6	-83.8	0	0	0	112.5	T28 F33 A34	T28-H30 PolarHBondContact O-N 2.96Å; T28-H30 VanDerWaalsContact O-N 3.09Å; H30-F33 PolarHBondContact O-N 3.43Å; H30-A34 WeakPolarHBondContact O-CB 3.5Å; H30-A34 PolarHBondContact O-N 2.93Å
31	E	90.1	Very high	88.1	Confident	49 Å²	49	80.1 Å²	80.1	23%	0.229	41%	0.409	C	S	.	.	H	α-helix	trans	-63.9	-39.8	173.7	-71	167.1	118.7	0	0	111.7	K6 L27 T28 A34 L35	K6-E31 VanDerWaalsContact NZ-CD 3.33Å; K6-E31 IonicContact NZ-OE1 2.68Å; K6-E31 PolarHBondContact NZ-OE1 3.01Å; K6-E31 IonicContact NZ-OE2 3.63Å; K6-E31 PolarHBondContact NZ-OE2 3.34Å; K6-E31 VanDerWaalsContact NZ-OE2 3.12Å; L27-E31 HydrophobicContact CB-CB 4Å; L27-E31 HydrophobicContact CD2-CB 3.91Å; L27-E31 HydrophobicContact CG-CB 4.49Å; T28-E31 WeakPolarHBondContact CB-OE2 3.48Å; T28-E31 WeakPolarHBondContact CG2-OE2 3.45Å; T28-E31 PolarHBondContact N-OE2 2.99Å; T28-E31 CarbonylContact O-C 3.58Å; T28-E31 WeakPolarHBondContact O-CA 3.34Å; T28-E31 WeakPolarHBondContact O-CB 3.46Å; T28-E31 PolarHBondContact O-N 3.23Å; T28-E31 VanDerWaalsContact OG1-CG 3.28Å; T28-E31 WeakPolarHBondContact OG1-CG 3.42Å; T28-E31 PolarHBondContact OG1-N 3.41Å; T28-E31 PolarHBondContact OG1-OE2 2.85Å; E31-A34 PolarHBondContact O-N 2.89Å; E31-L35 WeakPolarHBondContact O-CB 3.46Å; E31-L35 PolarHBondContact O-N 3.41Å
32	K	91.3	Very high	88.3	Confident	36 Å²	36	77.6 Å²	77.6	16%	0.157	39%	0.389	C	S	.	.	H	α-helix	trans	-59.7	-49.2	173.1	-68.4	176.9	-178.7	162.3	0	111.5	L24 L27 T28 E29 A34 L35 F36	L24-K32 HydrophobicContact CD1-CB 4.49Å; L24-K32 HydrophobicContact CD1-CD 4.36Å; L24-K32 HydrophobicContact CD1-CG 3.9Å; L24-K32 HydrophobicContact CG-CD 4.47Å; L24-K32 HydrophobicContact CG-CG 4.47Å; L24-K32 WeakPolarHBondContact O-CE 3.31Å; L27-K32 HydrophobicContact CB-CG 3.82Å; L27-K32 WeakPolarHBondContact O-CE 3.41Å; T28-K32 WeakPolarHBondContact O-CG 3.38Å; T28-K32 PolarHBondContact O-N 3.31Å; E29-K32 WeakPolarHBondContact OE1-CD 3.26Å; E29-K32 IonicContact OE1-NZ 2.64Å; E29-K32 PolarHBondContact OE1-NZ 2.78Å; K32-A34 VanDerWaalsContact C-N 3.32Å; K32-A34 PolarHBondContact O-N 3.38Å; K32-L35 WeakPolarHBondContact O-CB 3.49Å; K32-L35 PolarHBondContact O-N 2.91Å; K32-L35 VanDerWaalsContact O-N 3.14Å; K32-F36 HydrophobicContact CB-CD2 4.42Å; K32-F36 HydrophobicContact CB-CE2 4.09Å; K32-F36 WeakPolarHBondContact O-CD2 3.32Å; K32-F36 WeakPolarHBondContact O-CG 3.46Å; K32-F36 PolarHBondContact O-N 3.12Å
33	F	88.5	Confident	88.5	Confident	150 Å²	150	74.5 Å²	74.5	66%	0.658	38%	0.375	S	S	*	.	H	α-helix	trans	-61.6	-40.4	179.1	-174.2	-93.3	0	0	0	112.1	E29 H30 S37	E29-F33 WeakPolarHBondContact O-CB 3.14Å; E29-F33 PolarHBondContact O-N 2.82Å; H30-F33 PolarHBondContact O-N 3.43Å; F33-S37 VanDerWaalsContact O-CB 3.32Å; F33-S37 WeakPolarHBondContact O-CB 3.36Å; F33-S37 PolarHBondContact O-N 2.78Å; F33-S37 PolarHBondContact O-OG 2.87Å
34	A	89.7	Confident	88.8	Confident	39 Å²	39	77.3 Å²	77.3	32%	0.322	39%	0.39	S	S	.	.	H	α-helix	trans	-63.1	-42.9	172.6	0	0	0	0	0	111.9	F10 H30 E31 K32 S37 A38	F10-A34 HydrophobicContact CE2-CB 4.26Å; F10-A34 HydrophobicContact CZ-CB 4.27Å; H30-A34 WeakPolarHBondContact O-CB 3.5Å; H30-A34 PolarHBondContact O-N 2.93Å; E31-A34 PolarHBondContact O-N 2.89Å; K32-A34 VanDerWaalsContact C-N 3.32Å; K32-A34 PolarHBondContact O-N 3.38Å; A34-S37 PolarHBondContact O-N 3.14Å; A34-A38 WeakPolarHBondContact O-CB 3.46Å; A34-A38 PolarHBondContact O-N 2.78Å
35	L	91.3	Very high	89	Confident	0 Å²	0	81.3 Å²	81.3	0%	0	41%	0.405	C	S	.	.	H	α-helix	trans	-63.6	-48.3	178.5	-178.8	58.1	0	0	0	111.9	F10 M13 V14 V19 L27 E31 K32 S37 A38 I39	F10-L35 HydrophobicContact CD1-CD1 4.49Å; F10-L35 HydrophobicContact CD2-CB 4.14Å; F10-L35 HydrophobicContact CD2-CD1 4.01Å; F10-L35 HydrophobicContact CE1-CD1 4.46Å; F10-L35 HydrophobicContact CE2-CB 3.59Å; F10-L35 HydrophobicContact CE2-CD1 4Å; F10-L35 HydrophobicContact CE2-CG 4.37Å; F10-L35 HydrophobicContact CG-CD1 4.27Å; F10-L35 HydrophobicContact CZ-CB 4.16Å; F10-L35 HydrophobicContact CZ-CD1 4.22Å; M13-L35 HydrophobicContact CB-CD1 3.86Å; M13-L35 HydrophobicContact CB-CD2 4.46Å; M13-L35 HydrophobicContact SD-CD1 4.22Å; M13-L35 HydrophobicContact SD-CD2 3.63Å; V14-L35 HydrophobicContact CG2-CD1 3.79Å; V19-L35 HydrophobicContact CG1-CD2 3.94Å; V19-L35 HydrophobicContact CG2-CD2 3.83Å; V19-L35 HydrophobicContact CG2-CG 4.37Å; L27-L35 HydrophobicContact CD1-CD2 3.62Å; E31-L35 WeakPolarHBondContact O-CB 3.46Å; E31-L35 PolarHBondContact O-N 3.41Å; K32-L35 WeakPolarHBondContact O-CB 3.49Å; K32-L35 PolarHBondContact O-N 2.91Å; K32-L35 VanDerWaalsContact O-N 3.14Å; L35-S37 VanDerWaalsContact C-N 3.29Å; L35-S37 PolarHBondContact O-N 3.42Å; L35-A38 PolarHBondContact O-N 3.4Å; L35-I39 HydrophobicContact CD1-CD1 3.89Å; L35-I39 HydrophobicContact CD1-CG1 4.19Å; L35-I39 HydrophobicContact CG-CD1 3.9Å; L35-I39 WeakPolarHBondContact O-CB 3.37Å; L35-I39 WeakPolarHBondContact O-CG1 3.09Å; L35-I39 PolarHBondContact O-N 3.29Å
36	F	90.8	Very high	89.3	Confident	106 Å²	106	77.9 Å²	77.9	47%	0.465	39%	0.385	S	S	.	.	H	α-helix	trans	-61.7	-37.8	175.9	-66.4	-51.4	0	0	0	112.2	L24 K32 K40	L24-F36 HydrophobicContact CD1-CE1 4.38Å; L24-F36 HydrophobicContact CD1-CE2 4.36Å; L24-F36 HydrophobicContact CD1-CZ 3.78Å; L24-F36 HydrophobicContact CD2-CZ 4.09Å; K32-F36 HydrophobicContact CB-CD2 4.42Å; K32-F36 HydrophobicContact CB-CE2 4.09Å; K32-F36 WeakPolarHBondContact O-CD2 3.32Å; K32-F36 WeakPolarHBondContact O-CG 3.46Å; K32-F36 PolarHBondContact O-N 3.12Å; F36-K40 VanDerWaalsContact O-CB 3.25Å; F36-K40 WeakPolarHBondContact O-CB 3.41Å; F36-K40 PolarHBondContact O-N 3.33Å
37	S	89.3	Confident	89.4	Confident	49 Å²	49	78.3 Å²	78.3	34%	0.343	38%	0.383	S	S	.	.	H	α-helix	trans	-66.5	-40.6	175.8	-61	0	0	0	0	112.3	F33 A34 L35 S41	F33-S37 VanDerWaalsContact O-CB 3.32Å; F33-S37 WeakPolarHBondContact O-CB 3.36Å; F33-S37 PolarHBondContact O-N 2.78Å; F33-S37 PolarHBondContact O-OG 2.87Å; A34-S37 PolarHBondContact O-N 3.14Å; L35-S37 VanDerWaalsContact C-N 3.29Å; L35-S37 PolarHBondContact O-N 3.42Å; S37-S41 WeakPolarHBondContact O-CB 3.16Å; S37-S41 PolarHBondContact O-N 3.25Å; S37-S41 PolarHBondContact O-OG 2.97Å
38	A	91.7	Very high	89.5	Confident	29 Å²	29	82 Å²	82	24%	0.24	40%	0.402	C	S	.	.	H	α-helix	trans	-67	-47.5	175.6	0	0	0	0	0	111.9	F10 V14 A34 L35 K40 S41 E42	F10-A38 HydrophobicContact CE1-CB 4.11Å; F10-A38 HydrophobicContact CZ-CB 4.16Å; V14-A38 HydrophobicContact CG1-CB 4.46Å; V14-A38 HydrophobicContact CG2-CB 3.68Å; A34-A38 WeakPolarHBondContact O-CB 3.46Å; A34-A38 PolarHBondContact O-N 2.78Å; L35-A38 PolarHBondContact O-N 3.4Å; A38-K40 PolarHBondContact O-N 2.87Å; A38-S41 PolarHBondContact O-N 3.45Å; A38-E42 PolarHBondContact O-N 3.28Å
39	I	91.8	Very high	89.3	Confident	16 Å²	16	84.6 Å²	84.6	8%	0.082	41%	0.407	C	S	.	.	H	α-helix	trans	-57.8	-48.2	175.4	-71.5	171.3	0	0	0	110.5	V14 M17 V19 L35 S41 E42 Q43	V14-I39 HydrophobicContact CG2-CG1 4.2Å; M17-I39 HydrophobicContact CE-CB 4.3Å; M17-I39 HydrophobicContact CE-CG1 4.46Å; M17-I39 HydrophobicContact CE-CG2 3.94Å; M17-I39 WeakPolarHBondContact CE-O 3.48Å; V19-I39 HydrophobicContact CG2-CD1 3.58Å; L35-I39 HydrophobicContact CD1-CD1 3.89Å; L35-I39 HydrophobicContact CD1-CG1 4.19Å; L35-I39 HydrophobicContact CG-CD1 3.9Å; L35-I39 WeakPolarHBondContact O-CB 3.37Å; L35-I39 WeakPolarHBondContact O-CG1 3.09Å; L35-I39 PolarHBondContact O-N 3.29Å; I39-S41 VanDerWaalsContact C-N 3.3Å; I39-S41 PolarHBondContact O-N 3.44Å; I39-E42 PolarHBondContact O-N 2.93Å; I39-Q43 HydrophobicContact CG2-CG 4.36Å; I39-Q43 WeakPolarHBondContact O-CB 3.28Å; I39-Q43 VanDerWaalsContact O-CG 3.28Å; I39-Q43 WeakPolarHBondContact O-CG 3.45Å; I39-Q43 PolarHBondContact O-N 2.89Å
40	K	90.1	Very high	89.4	Confident	136 Å²	136	83.7 Å²	83.7	59%	0.591	40%	0.398	S	S	*	.	H	α-helix	trans	-61.5	-37.4	178.3	-173.9	174.6	-178.8	178.1	0	112.7	F36 A38 I44	F36-K40 VanDerWaalsContact O-CB 3.25Å; F36-K40 WeakPolarHBondContact O-CB 3.41Å; F36-K40 PolarHBondContact O-N 3.33Å; A38-K40 PolarHBondContact O-N 2.87Å; K40-I44 HydrophobicContact CG-CD1 4.36Å; K40-I44 WeakPolarHBondContact O-CG1 3.25Å; K40-I44 PolarHBondContact O-N 2.9Å; K40-I44 VanDerWaalsContact O-N 3.13Å
41	S	86	Confident	89	Confident	76 Å²	76	79.2 Å²	79.2	53%	0.531	38%	0.378	S	S	.	.	H	α-helix	trans	-68.5	-43.3	178	-58.1	0	0	0	0	112	S37 A38 I39 I44 K45	S37-S41 WeakPolarHBondContact O-CB 3.16Å; S37-S41 PolarHBondContact O-N 3.25Å; S37-S41 PolarHBondContact O-OG 2.97Å; A38-S41 PolarHBondContact O-N 3.45Å; I39-S41 VanDerWaalsContact C-N 3.3Å; I39-S41 PolarHBondContact O-N 3.44Å; S41-I44 PolarHBondContact O-N 3.34Å; S41-K45 WeakPolarHBondContact O-CB 3.4Å; S41-K45 PolarHBondContact O-N 3.39Å
42	E	90.9	Very high	88.7	Confident	33 Å²	33	79 Å²	79	15%	0.154	39%	0.385	C	S	.	.	H	α-helix	trans	-69.9	-33.5	176.6	178.2	64.1	-165.7	0	0	112	V14 M17 A38 I39 K45 R46	V14-E42 HydrophobicContact CG1-CB 4.01Å; V14-E42 HydrophobicContact CG1-CG 4.22Å; M17-E42 HydrophobicContact CE-CB 3.64Å; M17-E42 HydrophobicContact CE-CG 3.53Å; M17-E42 HydrophobicContact SD-CG 4.25Å; A38-E42 PolarHBondContact O-N 3.28Å; I39-E42 PolarHBondContact O-N 2.93Å; E42-K45 PolarHBondContact O-N 3.01Å; E42-K45 IonicContact OE1-NZ 3.62Å; E42-K45 WeakPolarHBondContact OE2-CD 3.42Å; E42-K45 WeakPolarHBondContact OE2-CE 3.38Å; E42-K45 IonicContact OE2-NZ 2.65Å; E42-K45 PolarHBondContact OE2-NZ 3.01Å; E42-R46 WeakPolarHBondContact O-CB 3.42Å; E42-R46 WeakPolarHBondContact O-CG 3.43Å; E42-R46 PolarHBondContact O-N 2.89Å; E42-R46 IonicContact OE1-CZ 3.12Å; E42-R46 IonicContact OE1-NE 3.17Å; E42-R46 PolarHBondContact OE1-NE 3.14Å; E42-R46 IonicContact OE1-NH2 2.89Å; E42-R46 PolarHBondContact OE1-NH2 3.41Å
43	Q	89.5	Confident	88.2	Confident	100 Å²	100	80.7 Å²	80.7	47%	0.467	40%	0.396	S	S	.	.	H	α-helix	trans	-59	-48.6	169.2	-76.9	173.9	-9.1	0	0	111.9	M17 I39 K45 R46 Y47	M17-Q43 HydrophobicContact CE-CG 4.15Å; M17-Q43 HydrophobicContact SD-CB 4.45Å; M17-Q43 HydrophobicContact SD-CG 3.53Å; M17-Q43 VanDerWaalsContact SD-CG 3.53Å; I39-Q43 HydrophobicContact CG2-CG 4.36Å; I39-Q43 WeakPolarHBondContact O-CB 3.28Å; I39-Q43 VanDerWaalsContact O-CG 3.28Å; I39-Q43 WeakPolarHBondContact O-CG 3.45Å; I39-Q43 PolarHBondContact O-N 2.89Å; Q43-K45 VanDerWaalsContact C-N 3.34Å; Q43-K45 PolarHBondContact O-N 3.14Å; Q43-R46 PolarHBondContact O-N 2.92Å; Q43-Y47 WeakPolarHBondContact O-CB 3.26Å; Q43-Y47 PolarHBondContact O-N 2.74Å
44	I	88.1	Confident	87.6	Confident	89 Å²	89	77.9 Å²	77.9	46%	0.456	39%	0.385	S	S	.	.	H	α-helix	trans	-61.6	-43.4	177.5	-68.3	164	0	0	0	110.6	K40 S41 Y47 N48	K40-I44 HydrophobicContact CG-CD1 4.36Å; K40-I44 WeakPolarHBondContact O-CG1 3.25Å; K40-I44 PolarHBondContact O-N 2.9Å; K40-I44 VanDerWaalsContact O-N 3.13Å; S41-I44 PolarHBondContact O-N 3.34Å; I44-Y47 PolarHBondContact O-N 3.28Å; I44-N48 WeakPolarHBondContact O-CB 3.48Å; I44-N48 PolarHBondContact O-N 3.42Å; I44-N48 PolarHBondContact O-OD1 2.78Å
45	K	91.1	Very high	86.7	Confident	129 Å²	129	80.7 Å²	80.7	56%	0.561	39%	0.391	S	S	*	.	H	α-helix	trans	-60.6	-44	176	174.4	177.5	147.9	-145.8	0	112.4	S41 E42 Q43 K49	S41-K45 WeakPolarHBondContact O-CB 3.4Å; S41-K45 PolarHBondContact O-N 3.39Å; E42-K45 PolarHBondContact O-N 3.01Å; E42-K45 IonicContact OE1-NZ 3.62Å; E42-K45 WeakPolarHBondContact OE2-CD 3.42Å; E42-K45 WeakPolarHBondContact OE2-CE 3.38Å; E42-K45 IonicContact OE2-NZ 2.65Å; E42-K45 PolarHBondContact OE2-NZ 3.01Å; Q43-K45 VanDerWaalsContact C-N 3.34Å; Q43-K45 PolarHBondContact O-N 3.14Å; K45-K49 PolarHBondContact O-N 3.03Å
46	R	89.9	Confident	85.4	Confident	89 Å²	89	86.4 Å²	86.4	34%	0.336	42%	0.418	S	S	.	.	H	α-helix	trans	-66.1	-41	176.1	-71.8	177.4	-169.9	-168.7	9.9	112.2	E15 E42 Q43 K49 W50	E15-R46 PolarHBondContact O-NH1 2.91Å; E15-R46 PolarHBondContact O-NH2 3.49Å; E42-R46 WeakPolarHBondContact O-CB 3.42Å; E42-R46 WeakPolarHBondContact O-CG 3.43Å; E42-R46 PolarHBondContact O-N 2.89Å; E42-R46 IonicContact OE1-CZ 3.12Å; E42-R46 IonicContact OE1-NE 3.17Å; E42-R46 PolarHBondContact OE1-NE 3.14Å; E42-R46 IonicContact OE1-NH2 2.89Å; E42-R46 PolarHBondContact OE1-NH2 3.41Å; Q43-R46 PolarHBondContact O-N 2.92Å; R46-K49 PolarHBondContact O-N 2.83Å; R46-W50 WeakPolarHBondContact O-CB 3.39Å; R46-W50 PolarHBondContact O-N 3.43Å
47	Y	86.8	Confident	83.9	Confident	130 Å²	130	88.9 Å²	88.9	51%	0.51	43%	0.428	S	S	.	.	H	α-helix	trans	-62.8	-48.6	174.9	179.3	-98.4	0	0	0	112.1	Q43 I44 K49 W50 I51	Q43-Y47 WeakPolarHBondContact O-CB 3.26Å; Q43-Y47 PolarHBondContact O-N 2.74Å; I44-Y47 PolarHBondContact O-N 3.28Å; Y47-K49 VanDerWaalsContact C-N 3.31Å; Y47-K49 PolarHBondContact O-N 2.8Å; Y47-W50 HydrophobicContact CD2-CE3 4.35Å; Y47-W50 HydrophobicContact CE2-CE3 4.24Å; Y47-W50 HydrophobicContact CE2-CZ3 4.12Å; Y47-W50 WeakPolarHBondContact O-CB 3.47Å; Y47-W50 PolarHBondContact O-N 3.09Å; Y47-W50 VanDerWaalsContact O-N 3.1Å; Y47-I51 HydrophobicContact CD1-CG1 4.22Å; Y47-I51 HydrophobicContact CE1-CD1 4.28Å; Y47-I51 HydrophobicContact CE1-CG1 3.79Å; Y47-I51 HydrophobicContact CE2-CD1 4.31Å; Y47-I51 HydrophobicContact CE2-CG1 4.36Å; Y47-I51 WeakPolarHBondContact O-CG1 3.32Å; Y47-I51 PolarHBondContact O-N 2.94Å
48	N	87.8	Confident	82.2	Confident	95 Å²	95	90.4 Å²	90.4	51%	0.508	44%	0.439	S	S	.	.	H	α-helix	trans	-61.2	-39.7	178.6	-69.7	-3.7	0	0	0	111.8	I44 I51 A52	I44-N48 WeakPolarHBondContact O-CB 3.48Å; I44-N48 PolarHBondContact O-N 3.42Å; I44-N48 PolarHBondContact O-OD1 2.78Å; N48-I51 PolarHBondContact O-N 2.94Å; N48-A52 PolarHBondContact O-N 3.07Å; N48-A52 VanDerWaalsContact O-N 3.1Å
49	K	85.8	Confident	80.4	Confident	137 Å²	137	95.4 Å²	95.4	60%	0.596	46%	0.456	S	S	*	.	H	α-helix	trans	-62.1	-46.5	172.4	-178.1	177.2	175.3	-179.2	0	111.6	K45 R46 Y47 I51 A52 D53	K45-K49 PolarHBondContact O-N 3.03Å; R46-K49 PolarHBondContact O-N 2.83Å; Y47-K49 VanDerWaalsContact C-N 3.31Å; Y47-K49 PolarHBondContact O-N 2.8Å; K49-I51 VanDerWaalsContact C-N 3.31Å; K49-I51 PolarHBondContact O-N 3.32Å; K49-A52 PolarHBondContact O-N 2.76Å; K49-A52 VanDerWaalsContact O-N 3.15Å; K49-D53 VanDerWaalsContact CE-OD2 3.31Å; K49-D53 WeakPolarHBondContact CE-OD2 3.34Å; K49-D53 WeakPolarHBondContact O-CB 3.37Å; K49-D53 VanDerWaalsContact O-CG 3.31Å; K49-D53 PolarHBondContact O-N 3.31Å
50	W	87.8	Confident	78.4	Confident	117 Å²	117	100.6 Å²	100.6	44%	0.443	48%	0.484	S	S	.	.	H	α-helix	trans	-61.6	-36.5	179.4	177	85.7	0	0	0	113	R46 Y47 Q54	R46-W50 WeakPolarHBondContact O-CB 3.39Å; R46-W50 PolarHBondContact O-N 3.43Å; Y47-W50 HydrophobicContact CD2-CE3 4.35Å; Y47-W50 HydrophobicContact CE2-CE3 4.24Å; Y47-W50 HydrophobicContact CE2-CZ3 4.12Å; Y47-W50 WeakPolarHBondContact O-CB 3.47Å; Y47-W50 PolarHBondContact O-N 3.09Å; Y47-W50 VanDerWaalsContact O-N 3.1Å; W50-Q54 VanDerWaalsContact CE2-NE2 3.34Å; W50-Q54 WeakPolarHBondContact O-CG 3.32Å; W50-Q54 PolarHBondContact O-N 3.46Å
51	I	81.2	Confident	76.3	Confident	58 Å²	58	99 Å²	99	30%	0.297	49%	0.486	S	S	.	.	H	α-helix	trans	-63.1	-48.6	171.4	-66.5	-66.1	0	0	0	111	Y47 N48 K49 D53 Q54 E55	Y47-I51 HydrophobicContact CD1-CG1 4.22Å; Y47-I51 HydrophobicContact CE1-CD1 4.28Å; Y47-I51 HydrophobicContact CE1-CG1 3.79Å; Y47-I51 HydrophobicContact CE2-CD1 4.31Å; Y47-I51 HydrophobicContact CE2-CG1 4.36Å; Y47-I51 WeakPolarHBondContact O-CG1 3.32Å; Y47-I51 PolarHBondContact O-N 2.94Å; N48-I51 PolarHBondContact O-N 2.94Å; K49-I51 VanDerWaalsContact C-N 3.31Å; K49-I51 PolarHBondContact O-N 3.32Å; I51-D53 PolarHBondContact O-N 2.83Å; I51-Q54 PolarHBondContact O-N 2.85Å; I51-E55 PolarHBondContact O-N 3.21Å
52	A	82.4	Confident	74.4	Confident	44 Å²	44	101.9 Å²	101.9	36%	0.364	50%	0.495	S	S	.	.	H	α-helix	trans	-61.5	-43.6	177.8	0	0	0	0	0	112.3	N48 K49 Q54 E55 H56	N48-A52 PolarHBondContact O-N 3.07Å; N48-A52 VanDerWaalsContact O-N 3.1Å; K49-A52 PolarHBondContact O-N 2.76Å; K49-A52 VanDerWaalsContact O-N 3.15Å; A52-Q54 VanDerWaalsContact C-N 3.33Å; A52-Q54 PolarHBondContact O-N 3.31Å; A52-E55 PolarHBondContact O-N 2.73Å; A52-H56 PolarHBondContact O-CD2 3.03Å; A52-H56 VanDerWaalsContact O-CD2 3.31Å; A52-H56 PolarHBondContact O-N 3.13Å
53	D	82.4	Confident	72.1	Confident	72 Å²	72	106.3 Å²	106.3	39%	0.385	52%	0.519	S	S	.	.	H	α-helix	trans	-60.2	-41.8	175.8	-69.6	-21.7	0	0	0	110.7	K49 I51 H56 F57	K49-D53 VanDerWaalsContact CE-OD2 3.31Å; K49-D53 WeakPolarHBondContact CE-OD2 3.34Å; K49-D53 WeakPolarHBondContact O-CB 3.37Å; K49-D53 VanDerWaalsContact O-CG 3.31Å; K49-D53 PolarHBondContact O-N 3.31Å; I51-D53 PolarHBondContact O-N 2.83Å; D53-H56 PolarHBondContact O-N 3.48Å; D53-F57 VanDerWaalsContact O-CD2 3.29Å; D53-F57 WeakPolarHBondContact O-CD2 3.43Å; D53-F57 PolarHBondContact O-N 2.93Å
54	Q	74.5	Confident	69.7	Low	91 Å²	91	105.4 Å²	105.4	43%	0.425	54%	0.537	S	S	.	.	H	α-helix	trans	-65.3	-39.2	174.4	-79.6	-146.8	46.4	0	0	113.7	W50 I51 A52 H56 F57 S58	W50-Q54 VanDerWaalsContact CE2-NE2 3.34Å; W50-Q54 WeakPolarHBondContact O-CG 3.32Å; W50-Q54 PolarHBondContact O-N 3.46Å; I51-Q54 PolarHBondContact O-N 2.85Å; A52-Q54 VanDerWaalsContact C-N 3.33Å; A52-Q54 PolarHBondContact O-N 3.31Å; Q54-H56 VanDerWaalsContact C-N 3.31Å; Q54-H56 PolarHBondContact O-N 3.35Å; Q54-F57 PolarHBondContact O-N 2.95Å; Q54-S58 WeakPolarHBondContact O-CB 3.2Å; Q54-S58 PolarHBondContact O-N 3.04Å; Q54-S58 PolarHBondContact O-OG 3.16Å
55	E	72.6	Confident	67.5	Low	98 Å²	98	111.3 Å²	111.3	46%	0.458	56%	0.559	S	S	.	*	H	α-helix	trans	-62.6	-38.4	173.4	-81.8	-162	-136.8	0	0	112.1	I51 A52 S58 K59	I51-E55 PolarHBondContact O-N 3.21Å; A52-E55 PolarHBondContact O-N 2.73Å; E55-S58 PolarHBondContact O-N 3.37Å; E55-K59 WeakPolarHBondContact O-CD 3.33Å; E55-K59 VanDerWaalsContact O-CG 3.28Å; E55-K59 WeakPolarHBondContact O-CG 3.5Å; E55-K59 PolarHBondContact O-N 3.23Å; E55-K59 IonicContact OE2-NZ 2.68Å; E55-K59 PolarHBondContact OE2-NZ 2.95Å
56	H	62.7	Low	64.8	Low	120 Å²	120	109.9 Å²	109.9	56%	0.556	57%	0.566	S	S	*	*	H	α-helix	trans	-68.3	-40.7	174.8	-85.6	-77.3	0	0	0	112.5	A52 D53 Q54 S58 K59 N60	A52-H56 PolarHBondContact O-CD2 3.03Å; A52-H56 VanDerWaalsContact O-CD2 3.31Å; A52-H56 PolarHBondContact O-N 3.13Å; D53-H56 PolarHBondContact O-N 3.48Å; Q54-H56 VanDerWaalsContact C-N 3.31Å; Q54-H56 PolarHBondContact O-N 3.35Å; H56-S58 VanDerWaalsContact C-N 3.31Å; H56-S58 PolarHBondContact O-N 2.75Å; H56-K59 PolarHBondContact O-N 2.85Å; H56-N60 PolarHBondContact O-N 3.12Å; H56-N60 PolarHBondContact O-ND2 2.87Å
57	F	58.9	Low	62.3	Low	158 Å²	158	112 Å²	112	69%	0.693	58%	0.584	S	S	*	*	H	α-helix	trans	-60.9	-41.1	172	-88.5	-70.2	0	0	0	112.1	D53 Q54 K59 N60	D53-F57 VanDerWaalsContact O-CD2 3.29Å; D53-F57 WeakPolarHBondContact O-CD2 3.43Å; D53-F57 PolarHBondContact O-N 2.93Å; Q54-F57 PolarHBondContact O-N 2.95Å; F57-K59 PolarHBondContact O-N 3.13Å; F57-N60 PolarHBondContact O-N 3.03Å
58	S	55.3	Low	60.4	Low	82 Å²	82	112.2 Å²	112.2	57%	0.573	59%	0.594	S	S	*	*	H	α-helix	trans	-69.6	-18.5	-178.9	-55.4	0	0	0	0	114	Q54 E55 H56	Q54-S58 WeakPolarHBondContact O-CB 3.2Å; Q54-S58 PolarHBondContact O-N 3.04Å; Q54-S58 PolarHBondContact O-OG 3.16Å; E55-S58 PolarHBondContact O-N 3.37Å; H56-S58 VanDerWaalsContact C-N 3.31Å; H56-S58 PolarHBondContact O-N 2.75Å
59	K	53	Low	58	Low	134 Å²	134	114.6 Å²	114.6	58%	0.583	61%	0.606	S	S	*	*	H	α-helix	trans	-96.1	-9.2	178.6	-69	163.1	-166.4	163.5	0	113.3	E55 H56 F57	E55-K59 WeakPolarHBondContact O-CD 3.33Å; E55-K59 VanDerWaalsContact O-CG 3.28Å; E55-K59 WeakPolarHBondContact O-CG 3.5Å; E55-K59 PolarHBondContact O-N 3.23Å; E55-K59 IonicContact OE2-NZ 2.68Å; E55-K59 PolarHBondContact OE2-NZ 2.95Å; H56-K59 PolarHBondContact O-N 2.85Å; F57-K59 PolarHBondContact O-N 3.13Å
60	N	50.5	Low	56.4	Low	125 Å²	125	116 Å²	116	67%	0.668	62%	0.615	S	S	*	*	S	Bend	trans	-107.6	1.2	-173.3	-78.2	-17.3	0	0	0	114.9	H56 F57	H56-N60 PolarHBondContact O-N 3.12Å; H56-N60 PolarHBondContact O-ND2 2.87Å; F57-N60 PolarHBondContact O-N 3.03Å
61	T	45.9	Very low	54.4	Low	103 Å²	103	116 Å²	116	63%	0.632	63%	0.63	S	S	*	*	S	Bend	trans	-88.3	-12.2	-175	43.5	0	0	0	0	116	N63	T61-N63 VanDerWaalsContact C-N 3.34Å; T61-N63 PolarHBondContact O-N 2.82Å
62	D	45.3	Very low	52.9	Low	135 Å²	135	122 Å²	122	72%	0.722	65%	0.654	S	S	*	*	S	Bend	trans	-88	7.1	-166.3	-69.4	4	0	0	0	114.6
63	N	42	Very low	51	Low	126 Å²	126	130 Å²	130	67%	0.674	68%	0.68	S	S	*	*	S	Bend	trans	-143	102.5	178.5	-68.2	-94.8	0	0	0	111.6	T61	T61-N63 VanDerWaalsContact C-N 3.34Å; T61-N63 PolarHBondContact O-N 2.82Å
64	G	40.4	Very low	49	Very low	81 Å²	81	136.4 Å²	136.4	84%	0.835	70%	0.699	S	S	*	*			trans	158.7	123.2	169.9	0	0	0	0	0	114.2
65	K	41.2	Very low	48	Very low	213 Å²	213	137.3 Å²	137.3	93%	0.926	71%	0.711	S	S	*	*			trans	-84.7	136.4	178	-67.3	174.3	-179.8	174.3	0	111.3
66	S	34.3	Very low	47	Very low	99 Å²	99	138.7 Å²	138.7	69%	0.692	72%	0.722	S	S	*	*			trans	26.1	117.1	144.9	-155.9	0	0	0	0	119.4
67	N	38.4	Very low	47.2	Very low	135 Å²	135	140.7 Å²	140.7	72%	0.722	73%	0.725	S	S	*	*				-176.7	153.8	105.4	-90.1	-9.6	0	0	0	114.3
68	N	45.5	Very low	47.5	Very low	134 Å²	134	139.7 Å²	139.7	72%	0.717	73%	0.726	S	S	*	*			trans	65.9	105.5	154.8	-60.2	-5.1	0	0	0	121.5
69	N	37.8	Very low	48.3	Very low	145 Å²	145	139 Å²	139	78%	0.775	72%	0.721	S	S	*	*				60.8	66.7	125.1	-58.9	-1.8	0	0	0	119.7
70	Q	53.5	Low	49.2	Very low	165 Å²	165	133.3 Å²	133.3	77%	0.771	70%	0.701	S	S	*	*			trans	-136.3	133.7	138.5	-78.1	-59.2	-45.7	0	0	110	K72	Q70-K72 PolarHBondContact O-N 2.99Å
71	P	44.3	Very low	49.9	Very low	117 Å²	117	134.7 Å²	134.7	76%	0.76	72%	0.716	S	S	*	*			trans	-72.4	89.7	176	30	-33.6	0	0	0	110.1	K73	P71-K73 PolarHBondContact O-N 2.65Å; P71-K73 VanDerWaalsContact O-N 3.1Å
72	K	49.8	Very low	51.3	Low	186 Å²	186	134.3 Å²	134.3	81%	0.809	71%	0.71	S	S	*	*			trans	-54.8	117.9	171.4	-71.6	-174.2	177.7	-178.5	0	108.8	Q70 R74	Q70-K72 PolarHBondContact O-N 2.99Å; K72-R74 VanDerWaalsContact C-N 3.32Å; K72-R74 PolarHBondContact O-N 3.24Å
73	K	42.2	Very low	52.3	Low	210 Å²	210	130.2 Å²	130.2	91%	0.913	70%	0.7	S	S	*	*			trans	-64.4	85.8	-178.8	-67.3	180	-179.8	176.1	0	110.9	P71	P71-K73 PolarHBondContact O-N 2.65Å; P71-K73 VanDerWaalsContact O-N 3.1Å
74	R	42	Very low	53.4	Low	207 Å²	207	129.9 Å²	129.9	78%	0.781	69%	0.693	S	S	*	*			trans	-81.8	115.9	173	-70	177.6	64.4	170.1	1.5	109	K72 N76	K72-R74 VanDerWaalsContact C-N 3.32Å; K72-R74 PolarHBondContact O-N 3.24Å; R74-N76 PolarHBondContact O-N 3.23Å
75	V	53.4	Low	54.2	Low	111 Å²	111	130.1 Å²	130.1	67%	0.673	67%	0.674	S	S	*	*			trans	-74.1	102.8	164.4	179	0	0	0	0	107.1	Y77	V75-Y77 HydrophobicContact CG1-CD1 4.5Å; V75-Y77 HydrophobicContact CG1-CE1 4.18Å
76	N	50.2	Low	55.2	Low	127 Å²	127	124 Å²	124	68%	0.679	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-84.2	117.8	168.3	-69.3	-12.3	0	0	0	107.6	R74	R74-N76 PolarHBondContact O-N 3.23Å
77	Y	66.9	Low	56.4	Low	161 Å²	161	124.9 Å²	124.9	63%	0.631	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-74.8	137.3	170.3	-61.2	-79.1	0	0	0	109.6	V75 C79 L85	V75-Y77 HydrophobicContact CG1-CD1 4.5Å; V75-Y77 HydrophobicContact CG1-CE1 4.18Å; Y77-C79 PolarHBondContact O-N 2.79Å; Y77-L85 HydrophobicContact CD1-CD1 4.23Å; Y77-L85 HydrophobicContact CD1-CD2 3.82Å; Y77-L85 HydrophobicContact CD1-CG 4.19Å; Y77-L85 HydrophobicContact CD2-CD1 4.31Å; Y77-L85 HydrophobicContact CE1-CD2 4.32Å; Y77-L85 HydrophobicContact CG-CD1 3.79Å; Y77-L85 HydrophobicContact CG-CD2 4.25Å; Y77-L85 HydrophobicContact CG-CG 4.2Å
78	L	66	Low	56.9	Low	137 Å²	137	123.8 Å²	123.8	72%	0.717	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-66.3	122.3	164.6	-84.4	154.4	0	0	0	108.2	I86	L78-I86 HydrophobicContact CB-CB 4.2Å; L78-I86 HydrophobicContact CB-CD1 4.23Å; L78-I86 HydrophobicContact CB-CG1 4.3Å; L78-I86 PolarHBondContact O-N 3.02Å
79	C	71.2	Confident	56.8	Low	68 Å²	68	122.6 Å²	122.6	46%	0.459	65%	0.648	S	S	.	*	B	Isolated β-bridge	trans	-106.2	144.8	168.4	-73.6	0	0	0	0	110.4	Y77 G83 K84	Y77-C79 PolarHBondContact O-N 2.79Å; C79-G83 PolarHBondContact SG-O 2.68Å; C79-G83 VanDerWaalsContact SG-O 3.37Å; C79-K84 CarbonylContact C-O 3.51Å; C79-K84 WeakPolarHBondContact CA-O 3.49Å
80	G	72.7	Confident	56.7	Low	15 Å²	15	120.4 Å²	120.4	16%	0.155	65%	0.65	C	S	.	*			trans	-72.5	174.4	173	0	0	0	0	0	112.1	D82 G83 K84 I86	G80-D82 PolarHBondContact O-N 2.76Å; G80-G83 PolarHBondContact O-N 2.89Å; G80-K84 PolarHBondContact N-O 3Å; G80-I86 VanDerWaalsContact N-CG1 3.33Å
81	P	65	Low	56	Low	153 Å²	153	119 Å²	119	99%	0.994	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	-15	174.5	-23.7	34.8	0	0	0	114.4
82	D	75.4	Confident	55.5	Low	95 Å²	95	117 Å²	117	51%	0.508	64%	0.64	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.8	7.2	175.8	68.9	-14.5	0	0	0	113.6	G80 K84	G80-D82 PolarHBondContact O-N 2.76Å; D82-K84 PolarHBondContact O-N 3.13Å; D82-K84 WeakPolarHBondContact OD1-CB 3.39Å; D82-K84 PolarHBondContact OD1-N 3.38Å; D82-K84 VanDerWaalsContact OD1-N 3.11Å; D82-K84 WeakPolarHBondContact OD2-CD 3.49Å; D82-K84 WeakPolarHBondContact OD2-CE 3.45Å; D82-K84 WeakPolarHBondContact OD2-CG 3.22Å; D82-K84 IonicContact OD2-NZ 3.71Å; D82-K84 PolarHBondContact OD2-NZ 3.37Å
83	G	67.2	Low	55	Low	49 Å²	49	113 Å²	113	51%	0.505	63%	0.633	S	S	.	*	S	Bend	trans	75.8	-4.2	-179.4	0	0	0	0	0	115.4	C79 G80	C79-G83 PolarHBondContact SG-O 2.68Å; C79-G83 VanDerWaalsContact SG-O 3.37Å; G80-G83 PolarHBondContact O-N 2.89Å
84	K	64.4	Low	54.9	Low	120 Å²	120	110.5 Å²	110.5	52%	0.522	63%	0.63	S	S	.	*			trans	-76.7	150.8	178.1	-59.9	-168.3	-164.2	98.6	0	111.1	C79 G80 D82 I86	C79-K84 CarbonylContact C-O 3.51Å; C79-K84 WeakPolarHBondContact CA-O 3.49Å; G80-K84 PolarHBondContact N-O 3Å; D82-K84 PolarHBondContact O-N 3.13Å; D82-K84 WeakPolarHBondContact OD1-CB 3.39Å; D82-K84 PolarHBondContact OD1-N 3.38Å; D82-K84 VanDerWaalsContact OD1-N 3.11Å; D82-K84 WeakPolarHBondContact OD2-CD 3.49Å; D82-K84 WeakPolarHBondContact OD2-CE 3.45Å; D82-K84 WeakPolarHBondContact OD2-CG 3.22Å; D82-K84 IonicContact OD2-NZ 3.71Å; D82-K84 PolarHBondContact OD2-NZ 3.37Å; K84-I86 PolarHBondContact O-N 3.05Å
85	L	57.5	Low	54.3	Low	85 Å²	85	110.6 Å²	110.6	45%	0.445	63%	0.632	S	S	.	*	B	Isolated β-bridge	trans	-56.1	128.8	170.6	-122	77.3	0	0	0	110.2	Y77 V87	Y77-L85 HydrophobicContact CD1-CD1 4.23Å; Y77-L85 HydrophobicContact CD1-CD2 3.82Å; Y77-L85 HydrophobicContact CD1-CG 4.19Å; Y77-L85 HydrophobicContact CD2-CD1 4.31Å; Y77-L85 HydrophobicContact CE1-CD2 4.32Å; Y77-L85 HydrophobicContact CG-CD1 3.79Å; Y77-L85 HydrophobicContact CG-CD2 4.25Å; Y77-L85 HydrophobicContact CG-CG 4.2Å; L85-V87 VanDerWaalsContact C-N 3.33Å; L85-V87 HydrophobicContact CB-CG2 4.21Å; L85-V87 HydrophobicContact CD2-CG2 4.5Å; L85-V87 PolarHBondContact O-N 3.19Å
86	I	61.9	Low	53.5	Low	84 Å²	84	112.5 Å²	112.5	43%	0.431	64%	0.638	S	S	.	*			trans	-76.3	89.9	169.3	-52.1	-174.3	0	0	0	108	L78 G80 K84 T88	L78-I86 HydrophobicContact CB-CB 4.2Å; L78-I86 HydrophobicContact CB-CD1 4.23Å; L78-I86 HydrophobicContact CB-CG1 4.3Å; L78-I86 PolarHBondContact O-N 3.02Å; G80-I86 VanDerWaalsContact N-CG1 3.33Å; K84-I86 PolarHBondContact O-N 3.05Å; I86-T88 VanDerWaalsContact C-N 3.27Å; I86-T88 WeakPolarHBondContact CG2-OG1 3.46Å; I86-T88 PolarHBondContact O-N 2.95Å; I86-T88 VanDerWaalsContact O-N 3.12Å
87	V	58.1	Low	52.6	Low	118 Å²	118	116.5 Å²	116.5	72%	0.715	64%	0.644	S	S	*	*			trans	-83.4	76.5	169.9	-172.4	0	0	0	0	108.5	L85 T89	L85-V87 VanDerWaalsContact C-N 3.33Å; L85-V87 HydrophobicContact CB-CG2 4.21Å; L85-V87 HydrophobicContact CD2-CG2 4.5Å; L85-V87 PolarHBondContact O-N 3.19Å; V87-T89 PolarHBondContact O-N 3.23Å; V87-T89 VanDerWaalsContact O-N 3.15Å
88	T	49.7	Very low	51.2	Low	112 Å²	112	115.6 Å²	115.6	69%	0.687	66%	0.655	S	S	*	*			trans	-66.1	111.8	167.5	-56.7	0	0	0	0	108.2	I86 A90	I86-T88 VanDerWaalsContact C-N 3.27Å; I86-T88 WeakPolarHBondContact CG2-OG1 3.46Å; I86-T88 PolarHBondContact O-N 2.95Å; I86-T88 VanDerWaalsContact O-N 3.12Å; T88-A90 PolarHBondContact O-N 3.21Å
89	T	42.7	Very low	49.5	Very low	109 Å²	109	115.9 Å²	115.9	67%	0.669	66%	0.656	S	S	*	*			trans	-60.7	121.5	162.6	37.5	0	0	0	0	107.9	V87 L91	V87-T89 PolarHBondContact O-N 3.23Å; V87-T89 VanDerWaalsContact O-N 3.15Å; T89-L91 PolarHBondContact O-N 2.65Å
90	A	37.3	Very low	47.9	Very low	100 Å²	100	120.7 Å²	120.7	83%	0.826	67%	0.671	S	S	*	*			trans	-70	78.5	167.3	0	0	0	0	0	108.5	T88 A92	T88-A90 PolarHBondContact O-N 3.21Å; A90-A92 PolarHBondContact O-N 2.87Å
91	L	38.9	Very low	46.1	Very low	136 Å²	136	123.7 Å²	123.7	71%	0.712	69%	0.69	S	S	*	*			trans	-51.9	122.6	152.3	-71.2	169.2	0	0	0	105.9	T89	T89-L91 PolarHBondContact O-N 2.65Å
92	A	34.1	Very low	44.8	Very low	74 Å²	74	124 Å²	124	61%	0.612	68%	0.683	S	S	*	*			trans	-56.6	138.7	166.1	0	0	0	0	0	107	A90 D94	A90-A92 PolarHBondContact O-N 2.87Å; A92-D94 PolarHBondContact O-N 3.35Å
93	P	39.1	Very low	42.8	Very low	102 Å²	102	122.9 Å²	122.9	66%	0.662	69%	0.694	S	S	*	*			trans	-63.3	112.6	177.8	25.9	-32.8	0	0	0	108.2	Y95	P93-Y95 HydrophobicContact CB-CD2 4.01Å; P93-Y95 HydrophobicContact CB-CE2 4.21Å; P93-Y95 HydrophobicContact CG-CD2 4.18Å; P93-Y95 HydrophobicContact CG-CE2 4.36Å; P93-Y95 PolarHBondContact O-N 3.26Å
94	D	38.7	Very low	41	Very low	158 Å²	158	126.4 Å²	126.4	85%	0.845	71%	0.71	S	S	*	*			trans	-66.7	81.3	173.7	-83.2	-37	0	0	0	109.3	A92 D96	A92-D94 PolarHBondContact O-N 3.35Å; D94-D96 PolarHBondContact O-N 3.22Å
95	Y	31	Very low	39.4	Very low	208 Å²	208	131.6 Å²	131.6	82%	0.816	73%	0.726	S	S	*	*			trans	-76.1	75.5	165.4	-92.1	-82.9	0	0	0	109.3	P93	P93-Y95 HydrophobicContact CB-CD2 4.01Å; P93-Y95 HydrophobicContact CB-CE2 4.21Å; P93-Y95 HydrophobicContact CG-CD2 4.18Å; P93-Y95 HydrophobicContact CG-CE2 4.36Å; P93-Y95 PolarHBondContact O-N 3.26Å
96	D	35.6	Very low	38.2	Very low	152 Å²	152	132.6 Å²	132.6	81%	0.813	74%	0.74	S	S	*	*			trans	-129.2	156.8	149.5	-146.8	-9.5	0	0	0	112	D94	D94-D96 PolarHBondContact O-N 3.22Å
97	R	31.8	Very low	36.8	Very low	211 Å²	211	135.1 Å²	135.1	80%	0.796	75%	0.753	S	S	*	*			trans	-119.9	112.6	-147.4	-50.9	174.6	-168.7	178.9	2.1	112.8
98	T	36.2	Very low	35.5	Very low	141 Å²	141	137 Å²	137	87%	0.865	75%	0.754	S	S	*	*			trans	-137.9	71.3	159.6	33.2	0	0	0	0	112.1
99	I	32	Very low	34.7	Very low	143 Å²	143	138 Å²	138	73%	0.733	76%	0.761	S	S	*	*			trans	26.8	114.2	138.3	-53.8	168.4	0	0	0	117.1
100	H	35.7	Very low	34.1	Very low	169 Å²	169	136.9 Å²	136.9	78%	0.782	76%	0.762	S	S	*	*			trans	177.9	106.2	132.8	-94.3	-62.7	0	0	0	107.8
101	S	35.9	Very low	33.9	Very low	78 Å²	78	137.7 Å²	137.7	55%	0.545	76%	0.759	S	S	.	*				62.2	118.2	86.9	70.8	0	0	0	0	113.3
102	D	37.5	Very low	33.5	Very low	161 Å²	161	138.6 Å²	138.6	86%	0.861	76%	0.764	S	S	*	*			cis	-156.5	161.8	10.4	-74.2	-49.4	0	0	0	112.8
103	G	33.7	Very low	33.3	Very low	71 Å²	71	143 Å²	143	73%	0.732	78%	0.776	S	S	*	*			trans	75.6	146.5	158.2	0	0	0	0	0	118.2
104	C	30.2	Very low	32.7	Very low	123 Å²	123	143.3 Å²	143.3	83%	0.831	78%	0.781	S	S	*	*			cis	-148.4	132.9	-4.5	-93.7	0	0	0	0	112.4
105	R	30.4	Very low	32.4	Very low	229 Å²	229	141.4 Å²	141.4	86%	0.864	78%	0.78	S	S	*	*			trans	25.3	109.4	135.6	-70.2	178.6	176.6	-118.2	-1.2	118.4
106	S	32.1	Very low	32.4	Very low	105 Å²	105	141 Å²	141	73%	0.734	78%	0.782	S	S	*	*				79.3	139	105.7	71.3	0	0	0	0	115.7
107	L	32.8	Very low	32	Very low	137 Å²	137	138.4 Å²	138.4	72%	0.717	78%	0.776	S	S	*	*			cis	-150.7	157.2	47	-161.9	67	0	0	0	113.8
108	E	30.6	Very low	31.9	Very low	157 Å²	157	134.5 Å²	134.5	73%	0.734	77%	0.77	S	S	*	*			trans	-8.4	153.3	163.9	-59.2	144.3	-173.2	0	0	119.7
109	T	33.1	Very low	31.5	Very low	135 Å²	135	133.5 Å²	133.5	83%	0.828	76%	0.763	S	S	*	*			cis	-157.6	155.9	33.6	-35.7	0	0	0	0	112
110	A	29.1	Very low	31.4	Very low	84 Å²	84	134.2 Å²	134.2	69%	0.694	77%	0.768	S	S	*	*			trans	-120.4	173.9	171.7	0	0	0	0	0	111.1
111	P	34.2	Very low	31.1	Very low	117 Å²	117	131.5 Å²	131.5	76%	0.76	76%	0.758	S	S	*	*				-156	159.1	85.6	40.2	-20.4	0	0	0	118.9
112	N	29.2	Very low	30.7	Very low	155 Å²	155	136.6 Å²	136.6	83%	0.829	77%	0.765	S	S	*	*			trans	23.5	124	148.4	-78.4	-48	0	0	0	122.7
113	I	30.6	Very low	30.3	Very low	166 Å²	166	138 Å²	138	85%	0.851	77%	0.767	S	S	*	*			trans	-126.9	126.3	137.1	-65.4	179.6	0	0	0	108
114	S	27.3	Very low	30.2	Very low	109 Å²	109	141.7 Å²	141.7	76%	0.762	76%	0.763	S	S	*	*			trans	-84.6	149.1	177.5	73.3	0	0	0	0	112.2
115	S	32.1	Very low	30.2	Very low	119 Å²	119	145.1 Å²	145.1	83%	0.832	77%	0.767	S	S	*	*			trans	-152.8	148	167.4	-85	0	0	0	0	111.3
116	K	30.3	Very low	30.2	Very low	198 Å²	198	138.2 Å²	138.2	86%	0.861	75%	0.753	S	S	*	*			trans	-85.8	144.3	-160.5	-62.6	178.5	-179.7	-179.9	0	112.7
117	S	26.5	Very low	30	Very low	99 Å²	99	139.8 Å²	139.8	69%	0.692	76%	0.759	S	S	*	*			trans	-58.2	157.8	-174.5	40.2	0	0	0	0	115	R851	S117-R851 PolarHBondContact O-NH1 3.28Å; S117-R851 PolarHBondContact O-NH2 2.93Å
118	I	29.7	Very low	29.9	Very low	128 Å²	128	138.2 Å²	138.2	66%	0.656	76%	0.755	S	S	*	*			trans	-124.3	127.5	166.5	-55.1	-177.3	0	0	0	106.5
119	V	28.7	Very low	29.8	Very low	120 Å²	120	141 Å²	141	73%	0.727	77%	0.765	S	S	*	*			trans	-92.8	131.2	173.6	178.9	0	0	0	0	108	I121	V119-I121 HydrophobicContact CG1-CG1 4.45Å
120	L	30.4	Very low	29.7	Very low	159 Å²	159	138.6 Å²	138.6	83%	0.832	75%	0.753	S	S	*	*			trans	-126.1	121.8	166.5	-68.9	175.6	0	0	0	107.2
121	I	28.5	Very low	30	Very low	111 Å²	111	140.5 Å²	140.5	57%	0.569	76%	0.761	S	S	*	*			trans	-81.3	132.5	174.5	-62.3	-166.7	0	0	0	108.5	V119 T856	V119-I121 HydrophobicContact CG1-CG1 4.45Å; I121-T856 HydrophobicContact CB-CG2 4.28Å; I121-T856 HydrophobicContact CD1-CG2 3.51Å; I121-T856 HydrophobicContact CG1-CG2 3.85Å
122	R	28.7	Very low	30	Very low	186 Å²	186	143.5 Å²	143.5	70%	0.702	77%	0.765	S	S	*	*			trans	-108.2	122.8	159.5	-81.3	-173.2	-77.3	-171.4	-2.8	107.6	F124	R122-F124 HydrophobicContact CB-CD2 3.93Å; R122-F124 HydrophobicContact CB-CE2 3.75Å
123	E	29.2	Very low	30.3	Very low	191 Å²	191	141.2 Å²	141.2	89%	0.893	76%	0.759	S	S	*	*			trans	-72.8	127.4	158.9	-67.8	179.3	138.4	0	0	107.5
124	F	29.7	Very low	30.5	Very low	148 Å²	148	140.3 Å²	140.3	65%	0.649	76%	0.756	S	S	*	*			trans	-115.9	101.9	174.7	-84.1	-87.8	0	0	0	107.8	R122 S126	R122-F124 HydrophobicContact CB-CD2 3.93Å; R122-F124 HydrophobicContact CB-CE2 3.75Å; F124-S126 PolarHBondContact O-N 3.06Å
125	E	30.9	Very low	30.9	Very low	195 Å²	195	137.8 Å²	137.8	91%	0.911	75%	0.747	S	S	*	*			trans	-77.2	78.7	161.1	-73	-154.5	123.6	0	0	109.4	T127	E125-T127 PolarHBondContact O-N 2.89Å; E125-T127 VanDerWaalsContact O-N 3.13Å
126	S	29.8	Very low	31.1	Very low	83 Å²	83	140.4 Å²	140.4	58%	0.58	75%	0.748	S	S	*	*			trans	-73.2	101.8	172.4	54.7	0	0	0	0	109.9	F124 T128	F124-S126 PolarHBondContact O-N 3.06Å; S126-T128 PolarHBondContact O-N 2.71Å
127	T	29.2	Very low	31.1	Very low	139 Å²	139	137.5 Å²	137.5	85%	0.853	74%	0.742	S	S	*	*			trans	-71.3	73.6	169.8	38.3	0	0	0	0	110.9	E125 K129	E125-T127 PolarHBondContact O-N 2.89Å; E125-T127 VanDerWaalsContact O-N 3.13Å; T127-K129 PolarHBondContact O-N 3.05Å
128	T	29.9	Very low	31.5	Very low	104 Å²	104	137.5 Å²	137.5	64%	0.638	74%	0.742	S	S	*	*			trans	-67.4	90.9	-178.3	51.1	0	0	0	0	112.1	S126 S130	S126-T128 PolarHBondContact O-N 2.71Å; T128-S130 PolarHBondContact O-N 2.59Å
129	K	29.5	Very low	31.5	Very low	216 Å²	216	137.3 Å²	137.3	94%	0.939	75%	0.747	S	S	*	*			trans	-74.9	73.3	157.3	-76.2	-172.6	175.8	179.9	0	109.7	T127	T127-K129 PolarHBondContact O-N 3.05Å
130	S	31.2	Very low	31.7	Very low	83 Å²	83	138.5 Å²	138.5	58%	0.58	75%	0.748	S	S	*	*			trans	-116.8	86.7	177.3	55.9	0	0	0	0	110.7	T128 E132	T128-S130 PolarHBondContact O-N 2.59Å; S130-E132 PolarHBondContact O-N 3.44Å
131	S	34.7	Very low	31.8	Very low	124 Å²	124	136.9 Å²	136.9	87%	0.867	75%	0.745	S	S	*	*			trans	-78.3	98.1	164.2	52.4	0	0	0	0	109
132	E	33.3	Very low	31.9	Very low	181 Å²	181	135.8 Å²	135.8	85%	0.846	75%	0.752	S	S	*	*			trans	-70.5	154.1	180	-85.8	-164.3	130.8	0	0	113.7	S130	S130-E132 PolarHBondContact O-N 3.44Å
133	P	37.2	Very low	32.2	Very low	106 Å²	106	134.8 Å²	134.8	69%	0.688	76%	0.76	S	S	*	*			trans	-100.3	164.3	-165.3	39.6	-37	0	0	0	114.5
134	N	34.2	Very low	32.5	Very low	148 Å²	148	130.1 Å²	130.1	79%	0.791	75%	0.749	S	S	*	*			trans	-155.5	146.6	144.1	-73.8	-80.2	0	0	0	106.5
135	G	35.2	Very low	32.8	Very low	56 Å²	56	129.4 Å²	129.4	58%	0.577	76%	0.757	S	S	*	*			cis	136.3	103.6	-4.2	0	0	0	0	0	111.6
136	M	36.2	Very low	33.1	Very low	174 Å²	174	126.1 Å²	126.1	86%	0.857	75%	0.751	S	S	*	*			trans	63.8	154.6	176.4	-72.9	81.5	175.2	0	0	115.4
137	D	31.4	Very low	33.8	Very low	136 Å²	136	127 Å²	127	73%	0.727	75%	0.754	S	S	*	*			cis	-156.6	-176.2	-13.2	-126.4	-44.3	0	0	0	110.9
138	S	33.8	Very low	34.1	Very low	99 Å²	99	125.9 Å²	125.9	69%	0.692	75%	0.747	S	S	*	*			trans	67.5	113.7	169.1	61.6	0	0	0	0	116.8
139	T	29.1	Very low	34.3	Very low	125 Å²	125	129.5 Å²	129.5	77%	0.767	75%	0.754	S	S	*	*			cis	89.3	154.6	49	65.2	0	0	0	0	115.2
140	I	32.6	Very low	34.6	Very low	145 Å²	145	124.8 Å²	124.8	74%	0.744	74%	0.744	S	S	*	*			trans	94.2	111.9	167.8	-57.3	174.8	0	0	0	117.1
141	T	34.1	Very low	34.7	Very low	125 Å²	125	125.5 Å²	125.5	77%	0.767	75%	0.745	S	S	*	*			trans	45.5	124.9	160.1	55.6	0	0	0	0	120.4
142	A	30.7	Very low	34.5	Very low	87 Å²	87	126.4 Å²	126.4	72%	0.719	74%	0.738	S	S	*	*			cis	88.5	152.5	46.1	0	0	0	0	0	114.3
143	D	34.1	Very low	34.5	Very low	165 Å²	165	122 Å²	122	88%	0.882	73%	0.733	S	S	*	*			trans	67.4	140	-177.9	-66.5	-18.3	0	0	0	116.7
144	S	36	Very low	34.1	Very low	94 Å²	94	121.8 Å²	121.8	66%	0.657	73%	0.73	S	S	*	*			cis	-156.7	176.2	-3.1	54.2	0	0	0	0	113.5
145	T	36.5	Very low	34.1	Very low	132 Å²	132	120.3 Å²	120.3	81%	0.81	73%	0.726	S	S	*	*			trans	60.3	87.5	160.3	49.5	0	0	0	0	119.8
146	T	36.6	Very low	33.9	Very low	127 Å²	127	122.7 Å²	122.7	78%	0.779	73%	0.73	S	S	*	*			trans	-77.4	-160.3	138.6	63.2	0	0	0	0	108.7
147	P	43.7	Very low	33.7	Very low	102 Å²	102	119.6 Å²	119.6	66%	0.662	72%	0.721	S	S	*	*			cis	-127.1	-179.4	-16.6	23.5	1.4	0	0	0	112.4
148	T	35.1	Very low	33.6	Very low	114 Å²	114	118.9 Å²	118.9	70%	0.699	72%	0.721	S	S	*	*				160.6	154.7	93.7	42.4	0	0	0	0	108.4
149	K	35.4	Very low	33.4	Very low	181 Å²	181	118.4 Å²	118.4	79%	0.787	72%	0.724	S	S	*	*			cis	-162.8	162.1	-6.5	-125.3	176.6	-179.6	178.2	0	111.7
150	T	34.7	Very low	33.5	Very low	117 Å²	117	120.5 Å²	120.5	72%	0.718	73%	0.729	S	S	*	*			trans	75	132.3	137.3	-74.6	0	0	0	0	119.1
151	T	34.7	Very low	33.5	Very low	98 Å²	98	119.2 Å²	119.2	60%	0.601	73%	0.728	S	S	*	*			cis	-165.4	129.8	-3.6	-102.6	0	0	0	0	108.9
152	I	30.4	Very low	33.3	Very low	142 Å²	142	119.8 Å²	119.8	73%	0.728	73%	0.731	S	S	*	*				57.4	131.8	106.7	-50.2	168	0	0	0	113.1
153	A	32	Very low	33.6	Very low	89 Å²	89	121.2 Å²	121.2	74%	0.736	73%	0.733	S	S	*	*			cis	-119.4	153.4	25.6	0	0	0	0	0	112.9
154	T	30.4	Very low	33.6	Very low	101 Å²	101	120.4 Å²	120.4	62%	0.62	73%	0.734	S	S	*	*			cis	69.1	120.3	43.8	-42	0	0	0	0	110.3
155	T	33.2	Very low	33.2	Very low	118 Å²	118	122.2 Å²	122.2	72%	0.724	74%	0.742	S	S	*	*			cis	-145.3	134.8	49.5	-40.2	0	0	0	0	109
156	T	30.9	Very low	32.8	Very low	106 Å²	106	122.1 Å²	122.1	65%	0.65	74%	0.74	S	S	*	*				52.3	140.6	76	2	0	0	0	0	113.5
157	T	31.4	Very low	32.4	Very low	109 Å²	109	124.7 Å²	124.7	67%	0.669	74%	0.741	S	S	*	*			cis	-155.5	161	16.8	-31.7	0	0	0	0	111.6
158	T	30.7	Very low	31.6	Very low	120 Å²	120	124.9 Å²	124.9	74%	0.736	75%	0.745	S	S	*	*			trans	19.8	119.4	151.2	49.2	0	0	0	0	120.3
159	A	29.6	Very low	31.3	Very low	90 Å²	90	125.5 Å²	125.5	74%	0.744	74%	0.742	S	S	*	*				94.2	-175.7	68.2	0	0	0	0	0	113.6
160	I	31.6	Very low	30.9	Very low	169 Å²	169	126 Å²	126	87%	0.867	75%	0.745	S	S	*	*			trans	86.9	126.1	-174.5	-53	175.6	0	0	0	115.2
161	T	31.3	Very low	30.5	Very low	118 Å²	118	125.6 Å²	125.6	72%	0.724	74%	0.742	S	S	*	*			trans	-75.9	145	-178.4	47.4	0	0	0	0	114.3
162	T	31.3	Very low	30.3	Very low	136 Å²	136	126.5 Å²	126.5	83%	0.834	75%	0.748	S	S	*	*				174.2	160.3	116.8	30.1	0	0	0	0	111.5
163	P	35.8	Very low	30.1	Very low	118 Å²	118	127 Å²	127	77%	0.766	75%	0.752	S	S	*	*			trans	-105	135.8	-175.2	36.7	-29.2	0	0	0	114.2
164	T	33.5	Very low	29.9	Very low	147 Å²	147	128.5 Å²	128.5	90%	0.902	75%	0.752	S	S	*	*			trans	-144	142.5	163.6	44	0	0	0	0	112.9
165	T	29.4	Very low	29.8	Very low	133 Å²	133	129.4 Å²	129.4	82%	0.816	76%	0.757	S	S	*	*			trans	-75.6	150.1	178.1	-39.7	0	0	0	0	112.2
166	V	28.1	Very low	29.4	Very low	129 Å²	129	132.8 Å²	132.8	78%	0.782	76%	0.762	S	S	*	*				160	126.4	125.3	162.1	0	0	0	0	112.4
167	K	27.6	Very low	29.2	Very low	181 Å²	181	132.7 Å²	132.7	79%	0.787	77%	0.766	S	S	*	*			trans	-8.9	127.8	158.6	-54.2	168.3	-177.3	175.4	0	117.3
168	S	27.3	Very low	28.9	Very low	107 Å²	107	133.6 Å²	133.6	75%	0.748	77%	0.771	S	S	*	*			trans	-106.6	144.8	136.3	-173.1	0	0	0	0	108.9
169	I	27	Very low	28.9	Very low	126 Å²	126	134 Å²	134	65%	0.646	77%	0.774	S	S	*	*			trans	-109.2	118.2	-175.3	-64.5	170.4	0	0	0	108.4	T171	I169-T171 HydrophobicContact CG2-CG2 3.8Å
170	F	28	Very low	28.6	Very low	191 Å²	191	136.1 Å²	136.1	84%	0.838	78%	0.778	S	S	*	*			trans	-109.1	88.5	163.3	-89.6	-78.6	0	0	0	110	T172	F170-T172 PolarHBondContact O-N 3.29Å
171	T	26.6	Very low	28.5	Very low	110 Å²	110	136.1 Å²	136.1	68%	0.675	78%	0.779	S	S	*	*			trans	-76.2	99	165	42.5	0	0	0	0	109.6	I169 N173	I169-T171 HydrophobicContact CG2-CG2 3.8Å; T171-N173 PolarHBondContact O-N 2.91Å
172	T	29.3	Very low	28.3	Very low	116 Å²	116	136.8 Å²	136.8	71%	0.712	78%	0.783	S	S	*	*			trans	-86.5	101.8	164	49.9	0	0	0	0	109.5	F170 V174	F170-T172 PolarHBondContact O-N 3.29Å; T172-V174 PolarHBondContact O-N 3.43Å; T172-V174 VanDerWaalsContact O-N 3.07Å
173	N	26.3	Very low	28.1	Very low	152 Å²	152	137.2 Å²	137.2	81%	0.813	78%	0.78	S	S	*	*			trans	-66.9	102.8	168.5	-66.7	-18.6	0	0	0	108.8	T171	T171-N173 PolarHBondContact O-N 2.91Å
174	V	29.2	Very low	27.8	Very low	122 Å²	122	138.1 Å²	138.1	74%	0.739	78%	0.784	S	S	*	*			trans	-100.5	104.2	169.7	-178.2	0	0	0	0	108	T172	T172-V174 PolarHBondContact O-N 3.43Å; T172-V174 VanDerWaalsContact O-N 3.07Å
175	T	27.5	Very low	27.6	Very low	119 Å²	119	137.3 Å²	137.3	73%	0.73	77%	0.773	S	S	*	*			trans	-63.8	133.4	-178.3	-41.7	0	0	0	0	110.9	S177	T175-S177 PolarHBondContact O-N 2.78Å
176	F	24.8	Very low	27.6	Very low	189 Å²	189	133 Å²	133	83%	0.829	74%	0.744	S	S	*	*			trans	-71.5	97.7	170.2	-76.9	-89.2	0	0	0	110.1	T178	F176-T178 PolarHBondContact O-N 2.9Å
177	S	27.8	Very low	27.7	Very low	104 Å²	104	131 Å²	131	73%	0.727	74%	0.736	S	S	*	*			trans	-71.3	89.2	171.3	-65.5	0	0	0	0	110.8	T175 T179	T175-S177 PolarHBondContact O-N 2.78Å; S177-T179 PolarHBondContact O-N 3.22Å; S177-T179 VanDerWaalsContact O-N 3.13Å
178	T	24.9	Very low	27.6	Very low	128 Å²	128	128.5 Å²	128.5	79%	0.785	74%	0.74	S	S	*	*			trans	-72.9	96.7	173.1	51.2	0	0	0	0	110.8	F176	F176-T178 PolarHBondContact O-N 2.9Å
179	T	29.7	Very low	27.7	Very low	129 Å²	129	128.5 Å²	128.5	79%	0.791	74%	0.74	S	S	*	*			trans	-104.4	91.9	172.2	53.6	0	0	0	0	111.1	S177	S177-T179 PolarHBondContact O-N 3.22Å; S177-T179 VanDerWaalsContact O-N 3.13Å
180	T	24.7	Very low	27.8	Very low	134 Å²	134	128.6 Å²	128.6	82%	0.822	75%	0.746	S	S	*	*			trans	-65.2	132.7	161.8	47.6	0	0	0	0	110.3
181	L	28.6	Very low	27.8	Very low	170 Å²	170	123.2 Å²	123.2	89%	0.89	74%	0.737	S	S	*	*			trans	-150.6	149.4	160.2	-111	162	0	0	0	109.8
182	T	27.7	Very low	27.9	Very low	131 Å²	131	124.7 Å²	124.7	80%	0.804	74%	0.74	S	S	*	*			trans	-108.3	162.5	-158.1	43.6	0	0	0	0	114.4
183	N	26.7	Very low	28.1	Very low	145 Å²	145	127.1 Å²	127.1	78%	0.775	75%	0.749	S	S	*	*			trans	-55.1	143.9	-178.6	-62.9	-25.6	0	0	0	114.6
184	T	28.5	Very low	28.2	Very low	138 Å²	138	125.1 Å²	125.1	85%	0.847	74%	0.743	S	S	*	*			trans	-135	136.8	132.7	-38.7	0	0	0	0	108.2
185	I	28.9	Very low	28.4	Very low	130 Å²	130	126.4 Å²	126.4	67%	0.667	75%	0.751	S	S	*	*			trans	-114.2	163.1	179.3	-32.2	177.1	0	0	0	107.7
186	N	30.1	Very low	28.4	Very low	42 Å²	42	127.3 Å²	127.3	23%	0.225	75%	0.751	C	S	.	*				159.5	119.1	118.7	173.2	112.9	0	0	0	114	T350 T351 S352	N186-T350 PolarHBondContact OD1-N 3.35Å; N186-T350 VanDerWaalsContact OD1-N 3.16Å; N186-T351 VanDerWaalsContact CB-N 3.34Å; N186-T351 PolarHBondContact ND2-N 3.29Å; N186-T351 VanDerWaalsContact ND2-N 3.18Å; N186-S352 WeakPolarHBondContact O-CA 3.44Å
187	S	29.5	Very low	28.7	Very low	88 Å²	88	125 Å²	125	62%	0.615	75%	0.752	S	S	*	*			trans	28	128.8	137.4	-34.8	0	0	0	0	121.7
188	C	26.8	Very low	28.6	Very low	128 Å²	128	125.2 Å²	125.2	87%	0.865	75%	0.754	S	S	*	*				-156.4	170.2	121.2	-115.9	0	0	0	0	110.5
189	S	28.4	Very low	28.8	Very low	106 Å²	106	129.8 Å²	129.8	74%	0.741	76%	0.758	S	S	*	*			trans	-132.3	170.4	-153	53.4	0	0	0	0	115.3
190	V	29.7	Very low	28.8	Very low	129 Å²	129	128.8 Å²	128.8	78%	0.782	76%	0.757	S	S	*	*				157.5	126.6	127.7	159.1	0	0	0	0	112.9
191	A	27.6	Very low	29	Very low	77 Å²	77	128 Å²	128	64%	0.636	75%	0.752	S	S	*	*			trans	46.8	155.3	148.9	0	0	0	0	0	122.9
192	N	30.1	Very low	29.2	Very low	141 Å²	141	127.1 Å²	127.1	75%	0.754	75%	0.748	S	S	*	*			cis	-165.8	140	-19.8	-100.7	-10.6	0	0	0	108.5
193	N	32.6	Very low	29.2	Very low	167 Å²	167	128.2 Å²	128.2	89%	0.893	75%	0.749	S	S	*	*				179.2	147.1	126.4	-94.2	-13.8	0	0	0	110.9
194	T	28.5	Very low	29.5	Very low	110 Å²	110	126.2 Å²	126.2	68%	0.675	75%	0.752	S	S	*	*			trans	-121.4	144.1	-159.7	39.9	0	0	0	0	114.4
195	T	33.3	Very low	29.4	Very low	149 Å²	149	126.7 Å²	126.7	91%	0.914	75%	0.748	S	S	*	*			trans	-146.8	126.4	144.3	16.5	0	0	0	0	107.9
196	N	26.9	Very low	29.3	Very low	139 Å²	139	128.9 Å²	128.9	74%	0.743	76%	0.758	S	S	*	*			trans	-106.4	133.2	-164.6	-66.1	-21.3	0	0	0	113
197	V	32.1	Very low	29.4	Very low	140 Å²	140	132.8 Å²	132.8	85%	0.848	78%	0.783	S	S	*	*			trans	-138.2	133	141.5	-176.4	0	0	0	0	107.1
198	S	26.3	Very low	29.2	Very low	108 Å²	108	138.7 Å²	138.7	76%	0.755	79%	0.794	S	S	*	*			trans	-111.7	143.9	-168.6	47.9	0	0	0	0	113.6
199	Y	28.6	Very low	29.3	Very low	225 Å²	225	144.4 Å²	144.4	88%	0.882	80%	0.797	S	S	*	*			trans	-122.4	129	160.2	-75.9	-79	0	0	0	108.2
200	S	29.8	Very low	29.4	Very low	108 Å²	108	145.7 Å²	145.7	76%	0.755	80%	0.795	S	S	*	*			trans	-97	140.1	177.5	-159.7	0	0	0	0	110.7
201	T	28.6	Very low	29.6	Very low	117 Å²	117	147.5 Å²	147.5	72%	0.718	80%	0.801	S	S	*	*			trans	-128.1	100.5	-179.7	54.2	0	0	0	0	110.7	N203	T201-N203 PolarHBondContact O-N 3.47Å
202	D	32.8	Very low	29.7	Very low	151 Å²	151	152.5 Å²	152.5	81%	0.807	81%	0.808	S	S	*	*			trans	-87.8	99.5	-179.3	-63.9	-32.4	0	0	0	111.3	A204	D202-A204 PolarHBondContact O-N 2.99Å
203	N	28.3	Very low	29.8	Very low	155 Å²	155	153 Å²	153	83%	0.829	81%	0.806	S	S	*	*			trans	-84.5	105.8	170.6	-81.9	-33.2	0	0	0	110.5	T201	T201-N203 PolarHBondContact O-N 3.47Å
204	A	32.4	Very low	29.5	Very low	102 Å²	102	154.3 Å²	154.3	84%	0.843	80%	0.798	S	S	*	*			trans	-100	97.4	173.9	0	0	0	0	0	111.4	D202	D202-A204 PolarHBondContact O-N 2.99Å
205	I	25.9	Very low	29.7	Very low	148 Å²	148	157 Å²	157	76%	0.759	80%	0.803	S	S	*	*			trans	-84.7	125.9	168.1	-59.8	172.4	0	0	0	108.3
206	M	27.2	Very low	29.4	Very low	176 Å²	176	158 Å²	158	87%	0.867	80%	0.797	S	S	*	*			trans	-138.5	146.1	164.8	-97.3	-64	167.3	0	0	110.9
207	T	31.7	Very low	29.6	Very low	124 Å²	124	159.2 Å²	159.2	76%	0.761	80%	0.804	S	S	*	*			trans	-97.2	156.5	-161.1	43.7	0	0	0	0	113.8
208	Y	26	Very low	29.3	Very low	213 Å²	213	159.7 Å²	159.7	84%	0.835	80%	0.802	S	S	*	*			trans	-73.9	143.9	174	-78.3	-104.3	0	0	0	112
209	R	29.5	Very low	29.5	Very low	248 Å²	248	161.3 Å²	161.3	94%	0.936	81%	0.806	S	S	*	*			trans	-131.7	125.5	142.3	-88.6	-169.8	173.3	179.2	-1.7	108.4
210	D	29.1	Very low	29.4	Very low	132 Å²	132	159.9 Å²	159.9	71%	0.706	80%	0.799	S	S	*	*			trans	-82.9	142.1	163.1	-81.4	-59.6	0	0	0	109.3
211	D	34.5	Very low	29.2	Very low	168 Å²	168	161.9 Å²	161.9	90%	0.898	80%	0.801	S	S	*	*			trans	-143.9	121.4	148.8	-111.5	-43.6	0	0	0	108.9
212	K	29.7	Very low	29.1	Very low	182 Å²	182	163.6 Å²	163.6	79%	0.791	80%	0.804	S	S	*	*			trans	-102.2	133.5	178.4	-66.8	175.4	179.7	174.3	0	109.2
213	Q	31.3	Very low	29.3	Very low	151 Å²	151	164.1 Å²	164.1	71%	0.706	80%	0.802	S	S	*	*			trans	-154.9	135.7	131.8	-72	-151.7	26.1	0	0	111.3
214	R	27	Very low	29.4	Very low	194 Å²	194	160.4 Å²	160.4	73%	0.732	79%	0.786	S	S	*	*			trans	46.8	145.2	132.8	-65.2	172.9	178.3	145.7	-9.3	120.1
215	H	32.5	Very low	29.3	Very low	166 Å²	166	161.9 Å²	161.9	77%	0.769	78%	0.78	S	S	*	*			cis	-145.2	159.5	7.1	-112.2	-64.1	0	0	0	110.2
216	E	26.4	Very low	29.4	Very low	171 Å²	171	158.3 Å²	158.3	80%	0.799	76%	0.762	S	S	*	*			trans	-77.8	151.1	169.5	-56.4	170.1	130.5	0	0	111.5
217	N	32	Very low	29.5	Very low	164 Å²	164	157 Å²	157	88%	0.877	76%	0.757	S	S	*	*			trans	-166	154.2	133.7	-107.4	-44.5	0	0	0	113.2
218	N	26.5	Very low	29.3	Very low	151 Å²	151	159.7 Å²	159.7	81%	0.807	76%	0.761	S	S	*	*			trans	-100.4	135.4	-171	-58.9	-85.4	0	0	0	112.8
219	V	28.7	Very low	29.3	Very low	141 Å²	141	152.2 Å²	152.2	86%	0.855	75%	0.748	S	S	*	*			trans	-144.1	134.7	148.3	-176.1	0	0	0	0	109.8
220	R	26.7	Very low	29.3	Very low	195 Å²	195	145 Å²	145	74%	0.736	74%	0.736	S	S	*	*			trans	-107.9	144.1	164.1	-78.9	-178.3	167.4	-153.5	2.8	109.3
221	L	25.8	Very low	29.4	Very low	151 Å²	151	149.1 Å²	149.1	79%	0.791	75%	0.748	S	S	*	*			trans	-178.4	107.7	148.7	-92.3	142.1	0	0	0	105.7
222	I	27.6	Very low	29	Very low	153 Å²	153	148.1 Å²	148.1	79%	0.785	74%	0.743	S	S	*	*				72.4	128.8	80.5	-63.5	172.9	0	0	0	113
223	Q	37.1	Very low	29.2	Very low	161 Å²	161	144.6 Å²	144.6	75%	0.752	74%	0.741	S	S	*	*			trans	-78.3	172	-175.6	-59.3	177.4	-38.6	0	0	113
224	P	29.9	Very low	29	Very low	78 Å²	78	142.7 Å²	142.7	51%	0.506	75%	0.745	S	S	.	*				-144.6	161.1	107.5	19.2	3.9	0	0	0	116.9	H507	P224-H507 VanDerWaalsContact CB-O 3.28Å; P224-H507 WeakPolarHBondContact CB-O 3.02Å; P224-H507 WeakPolarHBondContact CG-O 3.3Å
225	N	29.6	Very low	29.2	Very low	132 Å²	132	140.7 Å²	140.7	71%	0.706	75%	0.754	S	S	*	*			trans	-89.7	165.5	172	-83.1	-39	0	0	0	113
226	L	29.5	Very low	29.2	Very low	73 Å²	73	137.1 Å²	137.1	38%	0.382	75%	0.747	S	S	.	*			trans	-159.4	170.1	141.1	-142.1	79	0	0	0	110.5	R508	L226-R508 HydrophobicContact CB-CB 3.88Å; L226-R508 VanDerWaalsContact CB-CD 3.45Å; L226-R508 HydrophobicContact CB-CG 3.72Å; L226-R508 VanDerWaalsContact CB-CZ 3.49Å; L226-R508 VanDerWaalsContact CB-NE 3.26Å; L226-R508 HydrophobicContact CD1-CB 4.32Å; L226-R508 HydrophobicContact CG-CB 4.48Å; L226-R508 PolarHBondContact O-NH2 3.3Å
227	I	27.9	Very low	29.2	Very low	149 Å²	149	137.2 Å²	137.2	76%	0.764	75%	0.748	S	S	*	*			trans	-125.4	140.7	-172.1	-64.2	161.7	0	0	0	109.7
228	Q	27.1	Very low	29.3	Very low	180 Å²	180	140.6 Å²	140.6	84%	0.841	75%	0.75	S	S	*	*			trans	-166.3	136.1	159.6	-148.4	94.3	27	0	0	107.3
229	G	27.6	Very low	29.3	Very low	56 Å²	56	140.7 Å²	140.7	58%	0.577	75%	0.751	S	S	*	*			cis	-178.8	151.7	-12.1	0	0	0	0	0	111.2
230	S	28.6	Very low	29.4	Very low	98 Å²	98	139.5 Å²	139.5	69%	0.685	75%	0.748	S	S	*	*			trans	34.7	119.5	156.5	60	0	0	0	0	120.8
231	F	31.8	Very low	29.4	Very low	218 Å²	218	135 Å²	135	96%	0.956	75%	0.753	S	S	*	*				-143.4	113.1	126.8	-108.2	-73.6	0	0	0	109.5
232	D	26.5	Very low	29.7	Very low	146 Å²	146	133 Å²	133	78%	0.781	75%	0.751	S	S	*	*			trans	-95.2	142.1	-179	-70.6	-69.2	0	0	0	112.2
233	S	32.5	Very low	29.6	Very low	109 Å²	109	135.9 Å²	135.9	76%	0.762	75%	0.754	S	S	*	*			trans	-175.3	91.3	148.5	15.2	0	0	0	0	109.3
234	S	27.9	Very low	29.4	Very low	111 Å²	111	135 Å²	135	78%	0.776	76%	0.759	S	S	*	*				75.1	86	77.7	74.9	0	0	0	0	114.9
235	V	31.9	Very low	29.3	Very low	152 Å²	152	140 Å²	140	92%	0.921	77%	0.77	S	S	*	*			trans	-134.7	137.8	144.9	179.6	0	0	0	0	107.4
236	S	30.6	Very low	29.3	Very low	91 Å²	91	141.3 Å²	141.3	64%	0.636	78%	0.777	S	S	*	*			trans	-90.1	156.7	-169.1	53.7	0	0	0	0	114.4
237	E	27.9	Very low	29.3	Very low	173 Å²	173	141.6 Å²	141.6	81%	0.808	79%	0.785	S	S	*	*			trans	21.1	130.1	135.9	-55.5	171.9	137	0	0	119.1
238	Y	32.6	Very low	29.3	Very low	234 Å²	234	139.9 Å²	139.9	92%	0.918	79%	0.786	S	S	*	*				-156.8	133.4	118.8	-111.2	-72.4	0	0	0	111.3
239	D	27.5	Very low	29.6	Very low	154 Å²	154	136 Å²	136	82%	0.824	78%	0.779	S	S	*	*			trans	-65.8	142.3	166.7	-93.6	-50.6	0	0	0	111.3
240	S	30.9	Very low	29.6	Very low	115 Å²	115	143.6 Å²	143.6	80%	0.804	79%	0.791	S	S	*	*			trans	-165.6	97.4	155.2	-84.6	0	0	0	0	111.6
241	A	27.6	Very low	29.7	Very low	100 Å²	100	144.6 Å²	144.6	83%	0.826	80%	0.798	S	S	*	*			trans	-80.4	112.9	164.1	0	0	0	0	0	109.8
242	S	31.1	Very low	29.4	Very low	109 Å²	109	144 Å²	144	76%	0.762	80%	0.795	S	S	*	*			trans	-105	93.9	176	44.4	0	0	0	0	111.8	T244	S242-T244 PolarHBondContact O-N 3.05Å
243	Y	26.3	Very low	29.6	Very low	215 Å²	215	142.3 Å²	142.3	84%	0.843	80%	0.796	S	S	*	*			trans	-64.2	123.2	155.4	-85.1	-103.9	0	0	0	108.7
244	T	32	Very low	29.3	Very low	141 Å²	141	141.5 Å²	141.5	87%	0.865	79%	0.79	S	S	*	*			trans	-96.4	108.6	160	50.7	0	0	0	0	108.6	S242	S242-T244 PolarHBondContact O-N 3.05Å
245	Y	27.1	Very low	29.3	Very low	185 Å²	185	142.7 Å²	142.7	73%	0.725	79%	0.792	S	S	*	*			trans	-109.7	113.9	-174.1	-160.6	-62.9	0	0	0	108.5	S247	Y245-S247 WeakPolarHBondContact CD1-OG 3.28Å
246	D	31.6	Very low	29.3	Very low	159 Å²	159	142 Å²	142	85%	0.85	79%	0.789	S	S	*	*			trans	-118.7	113.9	162.3	-81.2	-37.8	0	0	0	105.7
247	S	28	Very low	29.3	Very low	79 Å²	79	141.9 Å²	141.9	55%	0.552	79%	0.793	S	S	*	*			cis	50.4	108.2	34.3	-70.1	0	0	0	0	111.1	Y245	Y245-S247 WeakPolarHBondContact CD1-OG 3.28Å
248	S	29.2	Very low	29.5	Very low	113 Å²	113	139.7 Å²	139.7	79%	0.79	79%	0.794	S	S	*	*			cis	-166.3	-171.2	16.7	60.8	0	0	0	0	107.9
249	S	32.6	Very low	29.5	Very low	98 Å²	98	135.2 Å²	135.2	69%	0.685	79%	0.792	S	S	*	*			cis	-158.6	160.3	12	46.1	0	0	0	0	111.6
250	Y	26.7	Very low	29.5	Very low	216 Å²	216	135.7 Å²	135.7	85%	0.847	79%	0.794	S	S	*	*			trans	-9.4	145.8	154.8	-59.1	-88	0	0	0	118.1
251	S	30.7	Very low	29.5	Very low	119 Å²	119	135.1 Å²	135.1	83%	0.832	79%	0.79	S	S	*	*				-162.3	151	63	-60.4	0	0	0	0	115.6
252	F	26.3	Very low	29.7	Very low	204 Å²	204	135.4 Å²	135.4	90%	0.895	79%	0.786	S	S	*	*			trans	-91.2	140.8	169.6	-103.8	-106.9	0	0	0	111.6
253	S	29.8	Very low	29.8	Very low	112 Å²	112	138 Å²	138	78%	0.783	79%	0.79	S	S	*	*			trans	-176	108.9	148.3	-77.6	0	0	0	0	107.5
254	S	28.2	Very low	30	Very low	91 Å²	91	135.3 Å²	135.3	64%	0.636	79%	0.79	S	S	*	*			cis	88.9	119.9	49.7	74.8	0	0	0	0	113.9
255	T	27.6	Very low	30	Very low	136 Å²	136	134.8 Å²	134.8	83%	0.834	79%	0.786	S	S	*	*			trans	68.4	151	-179.9	77.3	0	0	0	0	114.5
256	T	31.8	Very low	30.1	Very low	137 Å²	137	130.1 Å²	130.1	84%	0.84	79%	0.786	S	S	*	*			cis	-125.7	-175.8	11.7	46.4	0	0	0	0	113.7
257	A	30.6	Very low	30.1	Very low	89 Å²	89	127.1 Å²	127.1	74%	0.736	78%	0.778	S	S	*	*			trans	-83.3	163.6	-174.2	0	0	0	0	0	114.2
258	P	31.5	Very low	30.2	Very low	128 Å²	128	132.3 Å²	132.3	83%	0.831	79%	0.79	S	S	*	*			trans	-90.5	156.2	-170.8	36	-36.2	0	0	0	114.8
259	T	31.9	Very low	30.2	Very low	140 Å²	140	132.6 Å²	132.6	86%	0.859	79%	0.788	S	S	*	*			trans	-135	152	169.7	48.1	0	0	0	0	111.8
260	N	29.1	Very low	30.3	Very low	163 Å²	163	135 Å²	135	87%	0.872	79%	0.791	S	S	*	*			trans	-91	141.1	-171.1	-43.1	-75.2	0	0	0	113.2
261	S	30.9	Very low	30.2	Very low	103 Å²	103	132.4 Å²	132.4	72%	0.72	79%	0.792	S	S	*	*			trans	-178.7	111.6	132.7	53.5	0	0	0	0	108.5
262	S	31	Very low	30.4	Very low	106 Å²	106	131.9 Å²	131.9	74%	0.741	79%	0.788	S	S	*	*				56.4	108.9	63.8	79.9	0	0	0	0	114.6
263	I	32.3	Very low	30.5	Very low	164 Å²	164	127.1 Å²	127.1	84%	0.841	78%	0.78	S	S	*	*				-166.7	142.2	128.3	-98.3	151.5	0	0	0	108.7
264	N	30.8	Very low	30.6	Very low	159 Å²	159	129.8 Å²	129.8	85%	0.85	78%	0.784	S	S	*	*			trans	-112.9	144.1	178.4	-61.6	-41.2	0	0	0	110.4
265	T	31.6	Very low	30.6	Very low	129 Å²	129	129.6 Å²	129.6	79%	0.791	78%	0.783	S	S	*	*			trans	-158.5	122.4	149.2	23.6	0	0	0	0	105.8
266	A	30.2	Very low	30.6	Very low	87 Å²	87	129.5 Å²	129.5	72%	0.719	78%	0.777	S	S	*	*				63.7	132.8	51.9	0	0	0	0	0	111.3
267	S	30.4	Very low	30.5	Very low	97 Å²	97	128.2 Å²	128.2	68%	0.678	77%	0.769	S	S	*	*			cis	-147.9	160.2	28	-54.7	0	0	0	0	111.8
268	K	32.1	Very low	30.4	Very low	188 Å²	188	132.2 Å²	132.2	82%	0.817	78%	0.777	S	S	*	*				52.3	143.7	100.1	-56.9	-176.7	177.9	-176.4	0	116
269	T	28.7	Very low	30.3	Very low	119 Å²	119	129.5 Å²	129.5	73%	0.73	76%	0.761	S	S	*	*			cis	-171.6	-177.6	-2.4	21.3	0	0	0	0	109.2
270	I	34.1	Very low	30.2	Very low	149 Å²	149	131.3 Å²	131.3	76%	0.764	76%	0.763	S	S	*	*			trans	108	118.1	150.2	-54.8	178.9	0	0	0	115.4
271	D	25.3	Very low	30.2	Very low	160 Å²	160	126.1 Å²	126.1	86%	0.856	75%	0.749	S	S	*	*			trans	-90.5	142.1	166	-50	-90	0	0	0	111.5
272	S	33.6	Very low	30.2	Very low	108 Å²	108	126.3 Å²	126.3	76%	0.755	74%	0.742	S	S	*	*			trans	-166.3	105.3	148.8	61.3	0	0	0	0	114
273	S	29.2	Very low	30.2	Very low	104 Å²	104	127.1 Å²	127.1	73%	0.727	74%	0.738	S	S	*	*			trans	-8	161.7	147.5	61.6	0	0	0	0	122.8
274	I	31	Very low	30.3	Very low	168 Å²	168	127.1 Å²	127.1	86%	0.862	74%	0.74	S	S	*	*			trans	96.1	156.3	162.2	-61.7	165.1	0	0	0	115
275	S	29	Very low	30.2	Very low	88 Å²	88	124.3 Å²	124.3	62%	0.615	73%	0.732	S	S	*	*			trans	-134.2	174.9	-142.1	58.6	0	0	0	0	116
276	D	28.1	Very low	30.2	Very low	133 Å²	133	126.2 Å²	126.2	71%	0.711	74%	0.736	S	S	*	*			trans	79.7	106.9	152.9	-56	-48.7	0	0	0	122.1
277	V	28.3	Very low	30.2	Very low	110 Å²	110	126.9 Å²	126.9	67%	0.667	74%	0.735	S	S	*	*				62.6	121.4	127.7	-177.9	0	0	0	0	120.2
278	L	28.9	Very low	30.5	Very low	174 Å²	174	127.4 Å²	127.4	91%	0.911	74%	0.736	S	S	*	*				-169.7	141.1	123.7	-100.9	169.1	0	0	0	110.8
279	S	28.9	Very low	30.5	Very low	71 Å²	71	125.9 Å²	125.9	50%	0.497	74%	0.736	S	S	.	*			trans	-130.7	136.2	-170	-65.6	0	0	0	0	114.6
280	I	30.3	Very low	30.6	Very low	177 Å²	177	126 Å²	126	91%	0.908	73%	0.732	S	S	*	*			trans	-152.6	142.2	164.6	-50.4	179.4	0	0	0	107.8
281	G	30	Very low	30.7	Very low	55 Å²	55	124.9 Å²	124.9	57%	0.567	73%	0.728	S	S	*	*			cis	158.4	156.6	-9.6	0	0	0	0	0	114.1
282	N	31.4	Very low	31	Very low	106 Å²	106	122.4 Å²	122.4	57%	0.567	72%	0.715	S	S	*	*			trans	66.6	108.3	161.5	-70.4	-10.6	0	0	0	123.3
283	N	30.5	Very low	30.9	Very low	124 Å²	124	125.8 Å²	125.8	66%	0.663	71%	0.712	S	S	*	*				58.8	121.5	115.6	-47.3	-18.4	0	0	0	121.8
284	N	33.3	Very low	31	Very low	164 Å²	164	130 Å²	130	88%	0.877	71%	0.712	S	S	*	*				-174	175.9	92.9	-97.3	-43.8	0	0	0	113.6
285	S	28.4	Very low	30.9	Very low	100 Å²	100	129.2 Å²	129.2	70%	0.699	71%	0.71	S	S	*	*			trans	-111.3	163.5	-168.6	54.9	0	0	0	0	114.4
286	I	31.8	Very low	31	Very low	169 Å²	169	132.5 Å²	132.5	87%	0.867	72%	0.719	S	S	*	*			trans	174.4	155.1	135	-90.4	157	0	0	0	110.5
287	S	31.9	Very low	31.1	Very low	100 Å²	100	129.1 Å²	129.1	70%	0.699	72%	0.715	S	S	*	*			trans	-94.6	178.2	-175.5	60.5	0	0	0	0	113.6
288	P	35	Very low	31	Very low	108 Å²	108	131.3 Å²	131.3	70%	0.701	72%	0.723	S	S	*	*				-153	151.7	96.1	39.3	-21.2	0	0	0	118.3
289	L	32.2	Very low	31.2	Very low	157 Å²	157	130.6 Å²	130.6	82%	0.822	72%	0.72	S	S	*	*				39.6	159	129.3	-54.8	170.4	0	0	0	123.3
290	N	30.9	Very low	31.1	Very low	120 Å²	120	132.5 Å²	132.5	64%	0.642	73%	0.733	S	S	*	*			cis	-177.3	179.2	-30	-165.5	13	0	0	0	109.4
291	N	35.9	Very low	31.1	Very low	126 Å²	126	128.5 Å²	128.5	67%	0.674	72%	0.722	S	S	*	*			trans	83.5	141.8	164.4	-53.8	-29.2	0	0	0	115.4
292	N	32.5	Very low	31	Very low	108 Å²	108	132.3 Å²	132.3	58%	0.578	73%	0.729	S	S	*	*			cis	162.8	166.5	-10.6	-94.2	-32.2	0	0	0	103.7
293	Y	31.9	Very low	30.8	Very low	179 Å²	179	133.3 Å²	133.3	70%	0.702	73%	0.734	S	S	*	*			cis	-145.1	171.5	21.6	-109.4	-66.3	0	0	0	113.4
294	R	30.8	Very low	30.9	Very low	194 Å²	194	134 Å²	134	73%	0.732	74%	0.738	S	S	*	*			trans	-45.8	154.9	178.9	-64.2	159.4	-170.2	172.5	-0.7	116.2
295	N	28.5	Very low	30.5	Very low	151 Å²	151	133.5 Å²	133.5	81%	0.807	74%	0.735	S	S	*	*			cis	85.1	156.3	32.5	-164.3	19.1	0	0	0	114.7
296	I	31.5	Very low	30.5	Very low	156 Å²	156	134 Å²	134	80%	0.8	73%	0.729	S	S	*	*			trans	89.6	133	-173.6	-51.4	157.9	0	0	0	113.6
297	G	29.9	Very low	30.4	Very low	62 Å²	62	132.4 Å²	132.4	64%	0.639	72%	0.722	S	S	*	*			cis	170.5	156.7	-10.1	0	0	0	0	0	115.4
298	N	27.3	Very low	30.2	Very low	156 Å²	156	134.2 Å²	134.2	83%	0.834	72%	0.724	S	S	*	*			trans	46.8	108.6	158.5	-60.2	-3.3	0	0	0	122.3
299	N	32.1	Very low	29.9	Very low	160 Å²	160	135.8 Å²	135.8	86%	0.856	73%	0.727	S	S	*	*				177	112.5	122.2	-88.2	-27.5	0	0	0	107.9
300	S	27.9	Very low	29.7	Very low	110 Å²	110	138.3 Å²	138.3	77%	0.769	73%	0.727	S	S	*	*				89.8	123.7	55.1	-169.4	0	0	0	0	113.6
301	S	28.7	Very low	29.7	Very low	94 Å²	94	138.1 Å²	138.1	66%	0.657	72%	0.724	S	S	*	*			trans	81.6	124.4	165.2	-147	0	0	0	0	119.8
302	N	28	Very low	29.3	Very low	134 Å²	134	138.9 Å²	138.9	72%	0.717	73%	0.729	S	S	*	*			trans	59.3	127.2	151.3	-59.7	-10.7	0	0	0	119.2
303	N	28.8	Very low	29.2	Very low	128 Å²	128	140.8 Å²	140.8	68%	0.684	73%	0.734	S	S	*	*			cis	-163.8	163	16.9	-113.5	-15.6	0	0	0	114.1
304	N	30.7	Very low	29.2	Very low	138 Å²	138	138.2 Å²	138.2	74%	0.738	74%	0.736	S	S	*	*			trans	68.4	90.2	155.6	-60.2	-13.5	0	0	0	120
305	N	26.7	Very low	29.1	Very low	154 Å²	154	137.7 Å²	137.7	82%	0.824	74%	0.74	S	S	*	*			trans	-56.6	148.7	149.5	-69.7	-34.8	0	0	0	111.7
306	I	28.6	Very low	29	Very low	109 Å²	109	138 Å²	138	56%	0.559	74%	0.74	S	S	*	*			trans	-132.8	109.6	148.7	-62.8	-177.4	0	0	0	108
307	N	27.7	Very low	28.8	Very low	136 Å²	136	138 Å²	138	73%	0.727	74%	0.741	S	S	*	*			trans	-76.7	127.7	166	-68.5	-18.9	0	0	0	108.7
308	N	29.1	Very low	28.6	Very low	138 Å²	138	139.7 Å²	139.7	74%	0.738	74%	0.742	S	S	*	*			trans	-112.7	87.1	165.4	-88.9	0.9	0	0	0	109.1	Y310	N308-Y310 PolarHBondContact O-N 3.47Å
309	N	28.3	Very low	29.1	Very low	142 Å²	142	137.8 Å²	137.8	76%	0.759	74%	0.739	S	S	*	*			trans	-70.7	112.5	161	-74.3	-9.5	0	0	0	107.7
310	Y	28.4	Very low	29.2	Very low	210 Å²	210	135.9 Å²	135.9	82%	0.824	73%	0.733	S	S	*	*			trans	-90.6	119	164.1	-125.2	-99.1	0	0	0	108.2	N308	N308-Y310 PolarHBondContact O-N 3.47Å
311	I	30	Very low	29.5	Very low	116 Å²	116	136.3 Å²	136.3	60%	0.595	73%	0.733	S	S	*	*			trans	-107.8	105.4	178	-55.8	174.6	0	0	0	106.8	H313	I311-H313 VanDerWaalsContact C-N 3.31Å; I311-H313 WeakPolarHBondContact CG2-NE2 3.37Å; I311-H313 PolarHBondContact O-N 3.39Å
312	D	28.9	Very low	29.7	Very low	142 Å²	142	140.8 Å²	140.8	76%	0.759	74%	0.741	S	S	*	*			trans	-73.4	85.6	176.3	-77.7	-36.6	0	0	0	110.4	T314	D312-T314 PolarHBondContact O-N 2.88Å; D312-T314 VanDerWaalsContact O-N 3.16Å
313	H	29.8	Very low	29.8	Very low	148 Å²	148	144.4 Å²	144.4	69%	0.685	75%	0.751	S	S	*	*			trans	-76.8	95.6	168.7	-80.6	-60.8	0	0	0	110.5	I311 F315	I311-H313 VanDerWaalsContact C-N 3.31Å; I311-H313 WeakPolarHBondContact CG2-NE2 3.37Å; I311-H313 PolarHBondContact O-N 3.39Å; H313-F315 WeakPolarHBondContact O-CD2 3.44Å; H313-F315 PolarHBondContact O-N 2.84Å
314	T	30.6	Very low	29.9	Very low	124 Å²	124	148.8 Å²	148.8	76%	0.761	76%	0.757	S	S	*	*			trans	-59.3	102.2	174.5	-49.8	0	0	0	0	111.5	D312 I316	D312-T314 PolarHBondContact O-N 2.88Å; D312-T314 VanDerWaalsContact O-N 3.16Å; T314-I316 PolarHBondContact O-N 3.07Å; T314-I316 VanDerWaalsContact O-N 3.07Å
315	F	28.7	Very low	29.8	Very low	184 Å²	184	152 Å²	152	81%	0.807	77%	0.765	S	S	*	*			trans	-70.4	101.9	174.4	-89.1	-90.3	0	0	0	111.2	H313 L317	H313-F315 WeakPolarHBondContact O-CD2 3.44Å; H313-F315 PolarHBondContact O-N 2.84Å; F315-L317 PolarHBondContact O-N 2.61Å
316	I	27.1	Very low	29.9	Very low	157 Å²	157	152.3 Å²	152.3	81%	0.805	77%	0.766	S	S	*	*			trans	-73.9	92.9	171	-57.3	176.8	0	0	0	108.6	T314 S318	T314-I316 PolarHBondContact O-N 3.07Å; T314-I316 VanDerWaalsContact O-N 3.07Å; I316-S318 PolarHBondContact O-N 3.28Å
317	L	28.3	Very low	29.8	Very low	157 Å²	157	154.4 Å²	154.4	82%	0.822	78%	0.778	S	S	*	*			trans	-78.4	112.7	168.9	-74.8	170.8	0	0	0	109.7	F315	F315-L317 PolarHBondContact O-N 2.61Å
318	S	26	Very low	29.9	Very low	96 Å²	96	154.3 Å²	154.3	67%	0.671	78%	0.777	S	S	*	*			trans	-69.8	137.8	174.8	47.2	0	0	0	0	111.4	I316 T320	I316-S318 PolarHBondContact O-N 3.28Å; S318-T320 PolarHBondContact O-N 3.19Å
319	P	36.9	Very low	29.9	Very low	116 Å²	116	155.4 Å²	155.4	75%	0.753	78%	0.783	S	S	*	*			trans	-75.7	111.9	175	29.8	-32.3	0	0	0	110.3
320	T	34.1	Very low	29.9	Very low	120 Å²	120	155.7 Å²	155.7	74%	0.736	78%	0.78	S	S	*	*			trans	-69.3	137.8	170.9	38.3	0	0	0	0	111.1	S318 F322	S318-T320 PolarHBondContact O-N 3.19Å; T320-F322 PolarHBondContact O-N 3.4Å
321	P	34.3	Very low	30.1	Very low	119 Å²	119	154.5 Å²	154.5	77%	0.773	78%	0.782	S	S	*	*			trans	-74.6	123.5	-176.6	28.4	-34	0	0	0	111.8	K323	P321-K323 PolarHBondContact O-N 2.97Å; P321-K323 VanDerWaalsContact O-N 3.08Å
322	F	32.4	Very low	30.1	Very low	188 Å²	188	154.2 Å²	154.2	83%	0.825	79%	0.785	S	S	*	*			trans	-65.4	104.8	171.7	-96.8	-91.4	0	0	0	110.9	T320 R324	T320-F322 PolarHBondContact O-N 3.4Å; F322-R324 PolarHBondContact O-N 3.41Å
323	K	29.8	Very low	30.1	Very low	211 Å²	211	154.2 Å²	154.2	92%	0.917	79%	0.785	S	S	*	*			trans	-66.6	95.5	167.9	-72.4	-174.7	178.1	-179.8	0	110.4	P321	P321-K323 PolarHBondContact O-N 2.97Å; P321-K323 VanDerWaalsContact O-N 3.08Å
324	R	31.3	Very low	30.3	Very low	219 Å²	219	153.4 Å²	153.4	83%	0.826	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-91.4	131.3	163	-66.7	-174.5	-173.8	144.3	3	109.6	F322 L326	F322-R324 PolarHBondContact O-N 3.41Å; R324-L326 PolarHBondContact O-N 2.85Å
325	K	28.7	Very low	30.2	Very low	205 Å²	205	154.5 Å²	154.5	89%	0.891	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-74.2	117.6	170.3	-69.5	-178.4	176.7	-179.1	0	108.8	N327	K325-N327 PolarHBondContact O-N 2.93Å
326	L	29.8	Very low	30.3	Very low	162 Å²	162	155.1 Å²	155.1	85%	0.848	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-70.9	120.2	160.8	-87.7	166.5	0	0	0	108.3	R324 L328	R324-L326 PolarHBondContact O-N 2.85Å; L326-L328 PolarHBondContact O-N 3.32Å
327	N	25.9	Very low	30.5	Very low	152 Å²	152	154.8 Å²	154.8	81%	0.813	78%	0.783	S	S	*	*			trans	-93.5	90.9	177.3	-164.1	13.3	0	0	0	108.9	K325 N329	K325-N327 PolarHBondContact O-N 2.93Å; N327-N329 PolarHBondContact O-N 2.93Å
328	L	29.9	Very low	30.7	Very low	134 Å²	134	152.4 Å²	152.4	70%	0.702	78%	0.777	S	S	*	*			trans	-81.5	96.3	-173	-167.5	75.2	0	0	0	110.7	L326 Q330	L326-L328 PolarHBondContact O-N 3.32Å; L328-Q330 HydrophobicContact CD2-CG 4.25Å; L328-Q330 HydrophobicContact CG-CG 4.39Å; L328-Q330 PolarHBondContact O-N 2.76Å
329	N	28.1	Very low	30.8	Very low	161 Å²	161	152.2 Å²	152.2	86%	0.861	78%	0.776	S	S	*	*			trans	-65.5	102.3	175.9	-116.8	-5.6	0	0	0	110.5	N327	N327-N329 PolarHBondContact O-N 2.93Å
330	Q	28.2	Very low	30.7	Very low	149 Å²	149	154.5 Å²	154.5	70%	0.696	78%	0.781	S	S	*	*			trans	-105.9	118.7	168.9	-67.6	-169.7	8.7	0	0	110.4	L328	L328-Q330 HydrophobicContact CD2-CG 4.25Å; L328-Q330 HydrophobicContact CG-CG 4.39Å; L328-Q330 PolarHBondContact O-N 2.76Å
331	Q	33.1	Very low	30.4	Very low	185 Å²	185	153.4 Å²	153.4	86%	0.864	78%	0.778	S	S	*	*			trans	-104	102.1	150.6	-74.5	179.9	-22.4	0	0	105.3
332	T	29.6	Very low	30.3	Very low	110 Å²	110	155.8 Å²	155.8	68%	0.675	78%	0.784	S	S	*	*				60.3	122.1	92.2	58.7	0	0	0	0	111.9
333	N	30.4	Very low	30.1	Very low	142 Å²	142	152.5 Å²	152.5	76%	0.759	78%	0.78	S	S	*	*			cis	-136.6	-179.5	13.9	-94.4	-22.2	0	0	0	110.4
334	N	32.4	Very low	30.3	Very low	130 Å²	130	150.4 Å²	150.4	70%	0.695	78%	0.777	S	S	*	*			cis	-152.8	-174	26.2	-155.5	7.2	0	0	0	114.4
335	H	30.1	Very low	30.2	Very low	148 Å²	148	145.7 Å²	145.7	69%	0.685	77%	0.768	S	S	*	*			trans	-57.8	146.8	177	-57	-6.3	0	0	0	113.8
336	F	30.6	Very low	30.2	Very low	196 Å²	196	145.4 Å²	145.4	86%	0.86	76%	0.763	S	S	*	*				-151.6	154.7	67.6	-107.7	-90.5	0	0	0	115.2
337	I	30.3	Very low	30.1	Very low	150 Å²	150	143.2 Å²	143.2	77%	0.769	75%	0.752	S	S	*	*			trans	-147.8	170.9	171.5	4.3	175.7	0	0	0	106.2
338	P	32.9	Very low	30.3	Very low	107 Å²	107	141.5 Å²	141.5	70%	0.695	74%	0.743	S	S	*	*			cis	-147.5	169.3	33.6	46.5	-27	0	0	0	119.2
339	S	29	Very low	30.2	Very low	92 Å²	92	141.1 Å²	141.1	64%	0.643	74%	0.742	S	S	*	*			trans	26.7	143.1	138.2	72.8	0	0	0	0	121.5
340	L	34	Very low	30.2	Very low	165 Å²	165	137.9 Å²	137.9	86%	0.864	73%	0.727	S	S	*	*				-161.8	163.9	81.1	-111.7	137.4	0	0	0	114
341	S	27.7	Very low	30.3	Very low	96 Å²	96	135.1 Å²	135.1	67%	0.671	72%	0.721	S	S	*	*			trans	-119.5	159.5	-175.4	53.4	0	0	0	0	112.6
342	N	32	Very low	30.1	Very low	169 Å²	169	130.2 Å²	130.2	90%	0.904	71%	0.707	S	S	*	*			trans	-161.8	157.2	148.9	-105.9	-26.1	0	0	0	111.7
343	T	29	Very low	30	Very low	119 Å²	119	130.5 Å²	130.5	73%	0.73	71%	0.712	S	S	*	*			trans	-137.8	148.4	-171.8	-46.4	0	0	0	0	109.9
344	I	33.3	Very low	30	Very low	168 Å²	168	131.4 Å²	131.4	86%	0.862	72%	0.717	S	S	*	*			trans	-165.5	155	149.9	-103.7	148.9	0	0	0	110.8
345	N	28.7	Very low	29.9	Very low	120 Å²	120	131.8 Å²	131.8	64%	0.642	72%	0.724	S	S	*	*			trans	-74	165.2	-175.8	-56.6	-16.7	0	0	0	112
346	Y	29.4	Very low	30	Very low	198 Å²	198	130.4 Å²	130.4	78%	0.776	73%	0.728	S	S	*	*				-171.2	147	64.6	-109.6	-85.8	0	0	0	114.1
347	N	28.6	Very low	30.1	Very low	116 Å²	116	126.7 Å²	126.7	62%	0.62	72%	0.721	S	S	*	*			trans	46.6	129.7	147.5	-79.3	44.1	0	0	0	125.9
348	D	29.1	Very low	30.1	Very low	117 Å²	117	127 Å²	127	63%	0.626	72%	0.721	S	S	*	*				83.3	112.6	123.3	-61.8	-1.5	0	0	0	125.2
349	N	28.3	Very low	30	Very low	126 Å²	126	128.4 Å²	128.4	67%	0.674	72%	0.723	S	S	*	*				82.6	145.2	125.7	-63	-23.9	0	0	0	124.5
350	T	27.8	Very low	30.1	Very low	92 Å²	92	127.6 Å²	127.6	56%	0.564	73%	0.729	S	S	*	*			trans	88.2	130.2	148.6	39.3	0	0	0	0	124.4	N186	N186-T350 PolarHBondContact OD1-N 3.35Å; N186-T350 VanDerWaalsContact OD1-N 3.16Å
351	T	30.7	Very low	30.1	Very low	92 Å²	92	128.2 Å²	128.2	56%	0.564	73%	0.727	S	S	*	*			trans	56.6	147.2	166.8	48.6	0	0	0	0	122.1	N186	N186-T351 VanDerWaalsContact CB-N 3.34Å; N186-T351 PolarHBondContact ND2-N 3.29Å; N186-T351 VanDerWaalsContact ND2-N 3.18Å
352	S	28.4	Very low	30.3	Very low	82 Å²	82	129.7 Å²	129.7	57%	0.573	74%	0.736	S	S	*	*			cis	-176.2	141.2	-29	50	0	0	0	0	113.3	N186	N186-S352 WeakPolarHBondContact O-CA 3.44Å
353	C	27.6	Very low	30.4	Very low	116 Å²	116	128.8 Å²	128.8	78%	0.784	73%	0.727	S	S	*	*			trans	51.6	136.3	151.1	-66.9	0	0	0	0	124.8
354	N	29.9	Very low	30.5	Very low	160 Å²	160	129.2 Å²	129.2	86%	0.856	72%	0.724	S	S	*	*			trans	-31.1	151.7	165.3	-55.2	-18.4	0	0	0	119.6
355	V	30.5	Very low	30.4	Very low	138 Å²	138	125.3 Å²	125.3	84%	0.836	71%	0.711	S	S	*	*			trans	-121.5	133.4	160	176.4	0	0	0	0	110.4
356	P	33.3	Very low	30.5	Very low	119 Å²	119	127.2 Å²	127.2	77%	0.773	72%	0.716	S	S	*	*			trans	-107.9	147.5	159.2	35.6	-27.5	0	0	0	112.6
357	T	31.4	Very low	30.5	Very low	118 Å²	118	124 Å²	124	72%	0.724	71%	0.712	S	S	*	*			trans	-80.6	145	-169.8	-17.6	0	0	0	0	115
358	M	29.8	Very low	30.5	Very low	156 Å²	156	124.6 Å²	124.6	77%	0.768	71%	0.714	S	S	*	*			trans	-150.5	120.5	141.2	-83	-62.6	101.8	0	0	106.4
359	N	31.1	Very low	30.6	Very low	138 Å²	138	125.1 Å²	125.1	74%	0.738	72%	0.716	S	S	*	*				74.3	125.8	73.2	-80.1	-17.9	0	0	0	114.7
360	G	32.5	Very low	30.7	Very low	74 Å²	74	125.5 Å²	125.5	76%	0.763	72%	0.718	S	S	*	*			trans	133	66.4	-174.8	0	0	0	0	0	111.6
361	H	33	Very low	31	Very low	178 Å²	178	126.7 Å²	126.7	82%	0.824	72%	0.72	S	S	*	*				66.3	100.1	67.3	-142	106.4	0	0	0	113.4
362	C	31.9	Very low	31.2	Very low	127 Å²	127	128.2 Å²	128.2	86%	0.858	73%	0.725	S	S	*	*			trans	-158.8	153.8	139.2	-137.4	0	0	0	0	111.8
363	Q	33.7	Very low	31.6	Very low	150 Å²	150	129.9 Å²	129.9	70%	0.701	73%	0.727	S	S	*	*			trans	-86.7	-175.5	169	-59.7	176.3	-8.5	0	0	107.9
364	N	31.8	Very low	32	Very low	128 Å²	128	130.4 Å²	130.4	68%	0.684	72%	0.723	S	S	*	*			cis	-175.1	178.7	33	-151.2	-14.6	0	0	0	111.6
365	C	30	Very low	32.5	Very low	87 Å²	87	128.2 Å²	128.2	59%	0.588	71%	0.711	S	S	*	*			trans	66	110.5	150.7	-71.6	0	0	0	0	121.8
366	H	31.4	Very low	32.8	Very low	159 Å²	159	127.4 Å²	127.4	74%	0.736	70%	0.702	S	S	*	*				60.7	142.7	117.6	-77.5	92.6	0	0	0	122.2
367	N	29.8	Very low	33.1	Very low	130 Å²	130	127.2 Å²	127.2	70%	0.695	69%	0.694	S	S	*	*			trans	72.8	148.1	143.1	-73	0.7	0	0	0	117.2
368	I	28.1	Very low	33.2	Very low	129 Å²	129	127.8 Å²	127.8	66%	0.662	69%	0.693	S	S	*	*			cis	-165.2	157.3	-15.5	-130.1	168.5	0	0	0	108.6
369	I	30.7	Very low	33.5	Very low	129 Å²	129	127.5 Å²	127.5	66%	0.662	69%	0.694	S	S	*	*			trans	61	119.4	157	-75.4	175	0	0	0	119.5
370	D	31.6	Very low	33.7	Very low	134 Å²	134	129.6 Å²	129.6	72%	0.717	70%	0.697	S	S	*	*			trans	56.3	171.1	140.8	-49.6	-1.1	0	0	0	119.5
371	N	33.7	Very low	33.6	Very low	116 Å²	116	132.1 Å²	132.1	62%	0.62	69%	0.692	S	S	*	*			cis	-155.1	153.6	6.3	-144.9	-28.5	0	0	0	112.2
372	N	35.4	Very low	33.6	Very low	125 Å²	125	130.6 Å²	130.6	67%	0.668	69%	0.69	S	S	*	*			trans	63	157.4	157.6	-67.1	-44	0	0	0	118.2
373	N	36.6	Very low	33.6	Very low	116 Å²	116	130.6 Å²	130.6	62%	0.62	68%	0.681	S	S	*	*			cis	-151.5	155.9	0.6	-135.4	-23.8	0	0	0	111.9
374	N	36.6	Very low	33.6	Very low	127 Å²	127	129 Å²	129	68%	0.679	68%	0.677	S	S	*	*			trans	32.9	138.3	142.7	-71.4	-12.9	0	0	0	121.1
375	N	38.7	Very low	33.9	Very low	115 Å²	115	129.9 Å²	129.9	62%	0.615	68%	0.677	S	S	*	*			cis	-165.4	150.3	30.5	-121.2	-16.3	0	0	0	112.3
376	N	37.8	Very low	34.1	Very low	120 Å²	120	132 Å²	132	64%	0.642	68%	0.682	S	S	*	*			trans	42.6	140.7	134.5	-60.5	-11.4	0	0	0	121.7
377	N	38.6	Very low	34.3	Very low	115 Å²	115	129.5 Å²	129.5	62%	0.615	68%	0.675	S	S	*	*			cis	-162.9	133.2	3.4	-113.5	-18.1	0	0	0	113.2
378	N	35.2	Very low	34.6	Very low	131 Å²	131	131.5 Å²	131.5	70%	0.701	68%	0.677	S	S	*	*			trans	50	148.5	131.6	-61.3	-19.6	0	0	0	125
379	N	36.4	Very low	34.9	Very low	149 Å²	149	131.5 Å²	131.5	80%	0.797	68%	0.679	S	S	*	*			trans	79.6	111.3	162.6	-56.3	-22.9	0	0	0	116.8
380	K	34.1	Very low	35	Very low	182 Å²	182	131.6 Å²	131.6	79%	0.791	68%	0.679	S	S	*	*			cis	72.4	108	44.8	-83.7	-165.6	163.1	-175.1	0	116.3
381	I	30.6	Very low	35	Very low	128 Å²	128	133.5 Å²	133.5	66%	0.656	68%	0.684	S	S	*	*				72.5	143.8	123.2	-67.7	174.9	0	0	0	118.5
382	N	33.4	Very low	34.9	Very low	146 Å²	146	132 Å²	132	78%	0.781	68%	0.682	S	S	*	*			trans	67.1	157.9	177.5	-65.2	-13.5	0	0	0	114.7
383	N	31	Very low	34.7	Very low	126 Å²	126	134.7 Å²	134.7	67%	0.674	69%	0.691	S	S	*	*			cis	178.7	155.7	-40	-133.9	47	0	0	0	103
384	D	34.4	Very low	34.6	Very low	116 Å²	116	134.8 Å²	134.8	62%	0.62	70%	0.696	S	S	*	*			trans	69.9	119.3	156.5	-67.1	-53.9	0	0	0	122.2
385	H	37.6	Very low	34.1	Very low	148 Å²	148	136.5 Å²	136.5	69%	0.685	71%	0.705	S	S	*	*				83.2	102.9	129	-76.6	57.8	0	0	0	121.1
386	N	35.5	Very low	33.7	Very low	130 Å²	130	134.4 Å²	134.4	70%	0.695	71%	0.711	S	S	*	*				95.7	129.8	120.3	-78	-19.1	0	0	0	123.1
387	N	34.1	Very low	33.4	Very low	107 Å²	107	137.3 Å²	137.3	57%	0.572	72%	0.72	S	S	*	*			trans	91.2	102.7	142.1	-75.5	-47.1	0	0	0	121.2
388	K	37.5	Very low	32.7	Very low	173 Å²	173	143.3 Å²	143.3	75%	0.752	74%	0.736	S	S	*	*				73.7	148.6	128	-65.8	162.3	-176.8	153.1	0	116.4
389	N	32.7	Very low	32.5	Very low	129 Å²	129	143.2 Å²	143.2	69%	0.69	73%	0.734	S	S	*	*			cis	-158.4	159.4	22.4	-139.5	2.9	0	0	0	111.7
390	I	32.9	Very low	32	Very low	131 Å²	131	141.5 Å²	141.5	67%	0.672	73%	0.734	S	S	*	*			trans	65.8	135.3	151.8	-69.8	162.7	0	0	0	116.3
391	Q	31.5	Very low	31.8	Very low	174 Å²	174	139.3 Å²	139.3	81%	0.813	73%	0.729	S	S	*	*			cis	-160	165.9	-4.8	-110.4	171.7	-14.9	0	0	106.1
392	S	31.6	Very low	31.7	Very low	84 Å²	84	140.1 Å²	140.1	59%	0.587	73%	0.733	S	S	*	*			cis	-165.5	141.5	0.3	45	0	0	0	0	111.1
393	Q	32.4	Very low	31.3	Very low	182 Å²	182	141.8 Å²	141.8	85%	0.85	73%	0.734	S	S	*	*			trans	60	137.7	148.1	-61	167.3	-5	0	0	119.5
394	T	33	Very low	31.2	Very low	117 Å²	117	140.5 Å²	140.5	72%	0.718	73%	0.734	S	S	*	*			cis	-157.3	125.6	-13.4	19.3	0	0	0	0	106.4
395	N	27.4	Very low	30.8	Very low	164 Å²	164	143.1 Å²	143.1	88%	0.877	74%	0.741	S	S	*	*				50.2	127.6	90.3	-69.6	-7.1	0	0	0	114.7
396	G	30.5	Very low	30.4	Very low	71 Å²	71	140.9 Å²	140.9	73%	0.732	74%	0.737	S	S	*	*			cis	-170.6	-164.8	-0.3	0	0	0	0	0	110.3
397	Q	30.8	Very low	30	Very low	180 Å²	180	140.9 Å²	140.9	84%	0.841	73%	0.733	S	S	*	*			cis	-141.5	143.1	-1	-66.2	170	-77.2	0	0	109.2
398	Y	24.8	Very low	29.7	Very low	241 Å²	241	142.4 Å²	142.4	95%	0.945	74%	0.741	S	S	*	*			trans	-84.2	139.7	159	-99	-103.3	0	0	0	109.1
399	I	30.2	Very low	29.2	Very low	129 Å²	129	140.1 Å²	140.1	66%	0.662	74%	0.737	S	S	*	*			trans	-122.7	108.4	163.5	-68.3	-176.5	0	0	0	108.7	I401	I399-I401 HydrophobicContact CG2-CD1 3.6Å; I399-I401 HydrophobicContact CG2-CG1 3.64Å
400	S	25.2	Very low	29.2	Very low	114 Å²	114	142.2 Å²	142.2	80%	0.797	74%	0.743	S	S	*	*			trans	-88.5	105.3	168.8	52.6	0	0	0	0	109.6
401	I	30	Very low	28.9	Very low	136 Å²	136	143.2 Å²	143.2	70%	0.697	75%	0.75	S	S	*	*			trans	-118.7	98.7	170.9	-72.4	176.8	0	0	0	109.7	I399	I399-I401 HydrophobicContact CG2-CD1 3.6Å; I399-I401 HydrophobicContact CG2-CG1 3.64Å
402	I	29.5	Very low	28.9	Very low	144 Å²	144	140.6 Å²	140.6	74%	0.738	74%	0.741	S	S	*	*				56.8	128.2	126.3	-63.9	167.9	0	0	0	118.6
403	K	25.7	Very low	28.9	Very low	182 Å²	182	143.5 Å²	143.5	79%	0.791	75%	0.746	S	S	*	*			trans	-65	136.9	162.7	-56.8	169.6	179.4	175	0	110.5	F405	K403-F405 HydrophobicContact CB-CB 4.46Å
404	S	28.8	Very low	28.7	Very low	98 Å²	98	142.4 Å²	142.4	69%	0.685	75%	0.745	S	S	*	*			trans	-132.5	121.6	151.4	-60	0	0	0	0	107.3
405	F	25.5	Very low	28.7	Very low	171 Å²	171	141.7 Å²	141.7	75%	0.75	75%	0.745	S	S	*	*			cis	55.2	46.8	2.5	-98.7	-68.3	0	0	0	115.4	K403	K403-F405 HydrophobicContact CB-CB 4.46Å
406	V	28.9	Very low	28.8	Very low	102 Å²	102	141.9 Å²	141.9	62%	0.618	74%	0.739	S	S	*	*			trans	-95.9	120.8	141.3	171.2	0	0	0	0	105.8	D408	V406-D408 HydrophobicContact CG1-CB 4.31Å; V406-D408 WeakPolarHBondContact CG1-OD1 3.41Å; V406-D408 WeakPolarHBondContact CG1-OD2 3.32Å
407	Q	26.7	Very low	28.9	Very low	130 Å²	130	146.2 Å²	146.2	61%	0.607	74%	0.737	S	S	*	*			trans	-124.8	72.9	177	-175	-172.1	-30.1	0	0	107.6	N409	Q407-N409 VanDerWaalsContact C-N 3.27Å; Q407-N409 PolarHBondContact NE2-ND2 2.89Å; Q407-N409 PolarHBondContact O-N 3.41Å
408	D	28.7	Very low	28.8	Very low	139 Å²	139	145.8 Å²	145.8	74%	0.743	73%	0.733	S	S	*	*			trans	-80.2	78.8	-176.9	-67.1	-13.9	0	0	0	110.3	V406 E410	V406-D408 HydrophobicContact CG1-CB 4.31Å; V406-D408 WeakPolarHBondContact CG1-OD1 3.41Å; V406-D408 WeakPolarHBondContact CG1-OD2 3.32Å; D408-E410 PolarHBondContact O-N 3.04Å
409	N	26.7	Very low	29.3	Very low	124 Å²	124	141.1 Å²	141.1	66%	0.663	72%	0.723	S	S	*	*			trans	-74.7	66.6	168.7	-97.4	-14.5	0	0	0	110.7	Q407 N411	Q407-N409 VanDerWaalsContact C-N 3.27Å; Q407-N409 PolarHBondContact NE2-ND2 2.89Å; Q407-N409 PolarHBondContact O-N 3.41Å; N409-N411 VanDerWaalsContact C-N 3.34Å; N409-N411 PolarHBondContact O-N 3.44Å
410	E	31.6	Very low	29.2	Very low	174 Å²	174	140.6 Å²	140.6	81%	0.813	72%	0.721	S	S	*	*			trans	-91.2	68	169	-74.5	-108.6	128.3	0	0	110.8	D408 N412	D408-E410 PolarHBondContact O-N 3.04Å; E410-N412 PolarHBondContact O-N 3.35Å
411	N	27.5	Very low	29.4	Very low	152 Å²	152	142.2 Å²	142.2	81%	0.813	72%	0.721	S	S	*	*			trans	-72	100	160.1	-97.8	-41.9	0	0	0	108.7	N409	N409-N411 VanDerWaalsContact C-N 3.34Å; N409-N411 PolarHBondContact O-N 3.44Å
412	N	31	Very low	29.4	Very low	119 Å²	119	140.7 Å²	140.7	64%	0.636	72%	0.722	S	S	*	*			trans	-150.5	131.6	166.8	-114.5	-40.3	0	0	0	114.5	E410	E410-N412 PolarHBondContact O-N 3.35Å
413	Q	32.9	Very low	29.5	Very low	145 Å²	145	138.9 Å²	138.9	68%	0.678	72%	0.722	S	S	*	*			trans	48.2	96.4	162.6	-46.7	-46.1	-44.7	0	0	117
414	N	28.2	Very low	29.6	Very low	158 Å²	158	134.4 Å²	134.4	85%	0.845	72%	0.72	S	S	*	*				34.5	85.4	74.4	-82	-37.4	0	0	0	114.7
415	S	31.5	Very low	29.9	Very low	103 Å²	103	134.7 Å²	134.7	72%	0.72	72%	0.719	S	S	*	*			trans	-154.7	115.3	144	53.6	0	0	0	0	115.3
416	F	30.3	Very low	29.9	Very low	167 Å²	167	133.1 Å²	133.1	73%	0.732	72%	0.717	S	S	*	*			trans	56.3	112.7	143.6	-74.1	-114.2	0	0	0	118.9
417	K	32.1	Very low	29.8	Very low	163 Å²	163	134.5 Å²	134.5	71%	0.709	72%	0.719	S	S	*	*				68	141.9	80.7	-74.8	-178.8	-157.3	152.9	0	113.3
418	K	29.6	Very low	29.8	Very low	170 Å²	170	133.3 Å²	133.3	74%	0.739	72%	0.721	S	S	*	*			cis	-176.9	-172.5	-2.9	176.9	174.4	178.1	-174	0	106.2
419	I	34.5	Very low	29.8	Very low	144 Å²	144	132.6 Å²	132.6	74%	0.738	72%	0.717	S	S	*	*			trans	82.7	90.4	165.9	-49.4	174.1	0	0	0	111.2
420	N	29.3	Very low	29.8	Very low	117 Å²	117	134 Å²	134	63%	0.626	72%	0.72	S	S	*	*				86.3	133.7	69.3	-71.5	12.5	0	0	0	112.8
421	N	28.5	Very low	29.6	Very low	148 Å²	148	131.1 Å²	131.1	79%	0.791	72%	0.715	S	S	*	*			trans	33.5	135.5	134.3	-45.7	-4.7	0	0	0	117.8
422	S	30.8	Very low	29.7	Very low	104 Å²	104	129.6 Å²	129.6	73%	0.727	71%	0.711	S	S	*	*				-172.2	172.4	54.7	-168.8	0	0	0	0	112.4
423	S	31.6	Very low	29.5	Very low	106 Å²	106	128.2 Å²	128.2	74%	0.741	72%	0.716	S	S	*	*			trans	70.9	107.2	151	-54.2	0	0	0	0	118.2
424	A	28	Very low	29.2	Very low	89 Å²	89	126.2 Å²	126.2	74%	0.736	71%	0.713	S	S	*	*			trans	-29.9	173.1	132.8	0	0	0	0	0	115.9
425	P	33.4	Very low	29.2	Very low	104 Å²	104	126.5 Å²	126.5	68%	0.675	71%	0.712	S	S	*	*			cis	-138.7	-157.5	4.9	25.1	2.5	0	0	0	112.9
426	I	26.4	Very low	29	Very low	137 Å²	137	126.4 Å²	126.4	70%	0.703	71%	0.707	S	S	*	*				91.9	138.6	126.5	-126.9	170.2	0	0	0	120.6
427	I	27.3	Very low	29	Very low	131 Å²	131	126.5 Å²	126.5	67%	0.672	71%	0.707	S	S	*	*			trans	75.3	124.5	144.9	-92	164	0	0	0	121.3
428	T	27.2	Very low	28.8	Very low	106 Å²	106	125.3 Å²	125.3	65%	0.65	71%	0.708	S	S	*	*			trans	66.7	120.5	151.2	54.5	0	0	0	0	118.9
429	N	26.7	Very low	28.7	Very low	123 Å²	123	123.1 Å²	123.1	66%	0.658	71%	0.709	S	S	*	*				82.4	135.3	75.5	-67.5	25.3	0	0	0	112.6
430	E	28.1	Very low	28.5	Very low	154 Å²	154	122.2 Å²	122.2	72%	0.72	71%	0.71	S	S	*	*				57.8	121.1	127.1	-64	178.9	116.9	0	0	119.3
431	T	27.4	Very low	28.3	Very low	114 Å²	114	125.1 Å²	125.1	70%	0.699	72%	0.72	S	S	*	*				108.9	143.1	62.6	-72.8	0	0	0	0	108
432	V	28.1	Very low	28.3	Very low	120 Å²	120	122.7 Å²	122.7	73%	0.727	71%	0.713	S	S	*	*			trans	51.9	83.9	167.9	172.1	0	0	0	0	113.3
433	A	27.2	Very low	28.3	Very low	90 Å²	90	123.6 Å²	123.6	74%	0.744	71%	0.709	S	S	*	*				82.4	173.8	102.7	0	0	0	0	0	110.4
434	T	27.6	Very low	28	Very low	102 Å²	102	127.2 Å²	127.2	63%	0.626	71%	0.714	S	S	*	*			cis	-157.8	176.7	41.8	48.6	0	0	0	0	109.9
435	M	27.2	Very low	28	Very low	164 Å²	164	131 Å²	131	81%	0.808	71%	0.714	S	S	*	*			trans	66.4	129.5	145	-80.1	172.4	-174.5	0	0	118.6
436	T	28.8	Very low	27.9	Very low	101 Å²	101	135.3 Å²	135.3	62%	0.62	72%	0.718	S	S	*	*			cis	-169.7	166.8	-12.2	-1.6	0	0	0	0	109.3
437	K	29.1	Very low	28.1	Very low	169 Å²	169	132 Å²	132	74%	0.735	71%	0.707	S	S	*	*			trans	69.8	151.2	141.9	-78.4	165.1	-177	174.4	0	118.9
438	N	28	Very low	28.5	Very low	138 Å²	138	131.4 Å²	131.4	74%	0.738	71%	0.712	S	S	*	*			trans	71.1	116.6	156.2	-60.3	-3.4	0	0	0	115.8
439	V	27.6	Very low	28.5	Very low	124 Å²	124	133.4 Å²	133.4	75%	0.752	71%	0.714	S	S	*	*				79.3	142.1	58.1	171.9	0	0	0	0	110.7
440	T	31.3	Very low	28.9	Very low	125 Å²	125	135.6 Å²	135.6	77%	0.767	72%	0.724	S	S	*	*			trans	68.3	123.8	-172.5	10.2	0	0	0	0	111.7
441	Q	24.3	Very low	28.9	Very low	179 Å²	179	135 Å²	135	84%	0.836	72%	0.721	S	S	*	*			cis	50.5	140.6	49.7	-73.3	-158.1	1.1	0	0	112.6
442	P	29	Very low	29.2	Very low	97 Å²	97	135.9 Å²	135.9	63%	0.63	73%	0.727	S	S	*	*			cis	-143.3	-159.1	32.7	42	-21.3	0	0	0	114.5
443	N	28.9	Very low	29.2	Very low	123 Å²	123	134.5 Å²	134.5	66%	0.658	72%	0.719	S	S	*	*			trans	63.4	121.1	156.8	-59.9	-7.1	0	0	0	117.5	F445	N443-F445 HydrophobicContact CB-CD2 4.31Å
444	H	26.4	Very low	29.5	Very low	182 Å²	182	137.3 Å²	137.3	84%	0.843	72%	0.72	S	S	*	*			cis	64.9	80.4	21.2	-112.5	-65.8	0	0	0	114.1
445	F	29	Very low	29.5	Very low	167 Å²	167	138.7 Å²	138.7	73%	0.732	72%	0.724	S	S	*	*			trans	-152.2	131.4	154.4	-95	-90.6	0	0	0	108.5	N443	N443-F445 HydrophobicContact CB-CD2 4.31Å
446	Y	31	Very low	29.7	Very low	195 Å²	195	136.9 Å²	136.9	77%	0.765	72%	0.717	S	S	*	*			cis	-154.3	161.8	-10.9	-145.9	-119	0	0	0	110.3
447	S	30.5	Very low	29.9	Very low	68 Å²	68	142 Å²	142	48%	0.476	73%	0.726	S	S	.	*			trans	-89.6	178.7	170.8	-152.7	0	0	0	0	110.5	E449	S447-E449 PolarHBondContact OG-N 3.44Å
448	P	35.2	Very low	29.9	Very low	119 Å²	119	137.5 Å²	137.5	77%	0.773	72%	0.716	S	S	*	*				-136.9	147.7	80.1	34.2	-17.9	0	0	0	113.6
449	E	27.8	Very low	29.9	Very low	148 Å²	148	139.2 Å²	139.2	69%	0.692	72%	0.719	S	S	*	*			cis	75.5	91.6	43	-68.3	178.6	168.3	0	0	115.5	S447	S447-E449 PolarHBondContact OG-N 3.44Å
450	I	34.7	Very low	29.8	Very low	169 Å²	169	137.3 Å²	137.3	87%	0.867	71%	0.711	S	S	*	*			trans	-145.7	88.6	138.5	-57.2	-175.2	0	0	0	104.4
451	E	28.5	Very low	29.5	Very low	141 Å²	141	137.4 Å²	137.4	66%	0.659	71%	0.707	S	S	*	*				52	105.2	75.5	-76.1	-128	117.4	0	0	116
452	T	32.8	Very low	29.6	Very low	133 Å²	133	133.9 Å²	133.9	82%	0.816	69%	0.694	S	S	*	*			trans	-178.8	90.1	133.3	18.7	0	0	0	0	107.1
453	T	28.2	Very low	29.5	Very low	91 Å²	91	137.1 Å²	137.1	56%	0.558	70%	0.699	S	S	*	*				56.6	114.3	71.9	75.4	0	0	0	0	114.3
454	L	33.2	Very low	29.4	Very low	149 Å²	149	139.4 Å²	139.4	78%	0.78	71%	0.705	S	S	*	*			trans	171.1	104.6	135.7	-87.4	176.2	0	0	0	104.3
455	N	28.2	Very low	29.4	Very low	130 Å²	130	135.6 Å²	135.6	70%	0.695	70%	0.699	S	S	*	*				66.3	148.9	74.6	-59.4	-11.7	0	0	0	111.2
456	L	32	Very low	29.3	Very low	126 Å²	126	133.5 Å²	133.5	66%	0.66	70%	0.695	S	S	*	*			cis	-150	149.2	32.9	-71.3	155.5	0	0	0	111.6
457	Y	31.1	Very low	29.1	Very low	210 Å²	210	131 Å²	131	82%	0.824	70%	0.695	S	S	*	*			trans	66.2	153.2	136.3	-75	-142	0	0	0	118
458	S	30	Very low	29	Very low	73 Å²	73	131.9 Å²	131.9	51%	0.51	70%	0.701	S	S	.	*			cis	-152.8	153	-17.1	-103.7	0	0	0	0	107.6
459	Q	27.3	Very low	28.7	Very low	175 Å²	175	132.1 Å²	132.1	82%	0.818	70%	0.696	S	S	*	*				39.3	134.2	87.3	-91.9	-178.6	-6.1	0	0	113.8
460	S	25.4	Very low	28.8	Very low	83 Å²	83	130.8 Å²	130.8	58%	0.58	69%	0.693	S	S	*	*			cis	175.1	-177.3	-15.3	47.1	0	0	0	0	105.1
461	N	25.9	Very low	28.6	Very low	127 Å²	127	128.3 Å²	128.3	68%	0.679	68%	0.682	S	S	*	*			trans	67.8	160.1	162.7	-60.3	38.2	0	0	0	114.5
462	D	26.4	Very low	28.6	Very low	106 Å²	106	128.8 Å²	128.8	57%	0.567	69%	0.689	S	S	*	*			cis	-160.5	-170.9	-25.4	-97.5	-26.3	0	0	0	106.7
463	F	26.8	Very low	28.4	Very low	165 Å²	165	126.7 Å²	126.7	72%	0.724	69%	0.686	S	S	*	*			trans	67.3	105	155	-59	-56	0	0	0	116.9
464	H	26.7	Very low	28.2	Very low	171 Å²	171	133 Å²	133	79%	0.792	70%	0.699	S	S	*	*				64.5	107.1	94.4	-73.9	-6.5	0	0	0	114.4
465	S	26.6	Very low	28	Very low	101 Å²	101	132.8 Å²	132.8	71%	0.706	70%	0.697	S	S	*	*				-163.4	130.6	103.9	-174.8	0	0	0	0	112.5
466	N	26.7	Very low	28	Very low	124 Å²	124	133.1 Å²	133.1	66%	0.663	70%	0.699	S	S	*	*				-5	139.9	129.1	-26.7	-66.9	0	0	0	114.7
467	N	27	Very low	27.7	Very low	142 Å²	142	132.2 Å²	132.2	76%	0.759	70%	0.698	S	S	*	*			cis	-146.1	143.4	37	-91.2	-51.4	0	0	0	110.2
468	S	28.5	Very low	27.6	Very low	86 Å²	86	129.8 Å²	129.8	60%	0.601	69%	0.694	S	S	*	*				80.8	147.1	54.9	-164.9	0	0	0	0	113.2
469	N	28.8	Very low	27.5	Very low	124 Å²	124	136.2 Å²	136.2	66%	0.663	71%	0.707	S	S	*	*			trans	70.6	143.7	170.5	-61.4	-29.8	0	0	0	117.2
470	N	30	Very low	27.5	Very low	120 Å²	120	137.3 Å²	137.3	64%	0.642	71%	0.709	S	S	*	*			cis	-169.4	167.3	-20.6	-120.1	-17.9	0	0	0	111.2
471	N	30.8	Very low	27.7	Very low	118 Å²	118	137.1 Å²	137.1	63%	0.631	72%	0.721	S	S	*	*			trans	62.8	128.7	149.3	-66.9	-28.4	0	0	0	119.3
472	N	27.3	Very low	28	Very low	151 Å²	151	135.3 Å²	135.3	81%	0.807	73%	0.732	S	S	*	*				70.8	80	57.8	-63	-45.1	0	0	0	114.6
473	A	28.9	Very low	28.2	Very low	89 Å²	89	133.5 Å²	133.5	74%	0.736	74%	0.739	S	S	*	*			trans	-175.7	131.8	151.4	0	0	0	0	0	106.7
474	R	25.1	Very low	28.2	Very low	224 Å²	224	137.9 Å²	137.9	85%	0.845	75%	0.75	S	S	*	*			cis	68.1	153.7	25.6	-155.2	172.5	-176.2	167.2	3.1	113.3
475	I	29.1	Very low	28.3	Very low	143 Å²	143	132.7 Å²	132.7	73%	0.733	74%	0.744	S	S	*	*			trans	82	97	-158.4	-52.7	159.7	0	0	0	108	V477	I475-V477 HydrophobicContact CG2-CG2 4.49Å
476	D	26.5	Very low	28.3	Very low	137 Å²	137	134.5 Å²	134.5	73%	0.733	75%	0.75	S	S	*	*				64.5	166.5	50.3	-68.2	-65.5	0	0	0	114.3
477	V	27.7	Very low	28.4	Very low	107 Å²	107	136.8 Å²	136.8	65%	0.648	76%	0.757	S	S	*	*			trans	81.6	83.1	176.5	-165	0	0	0	0	116.1	I475	I475-V477 HydrophobicContact CG2-CG2 4.49Å
478	Q	27.5	Very low	28.5	Very low	159 Å²	159	135.9 Å²	135.9	74%	0.743	76%	0.756	S	S	*	*				35.6	131.5	120.1	-50.8	169.5	7.9	0	0	119.1
479	R	27.6	Very low	28.5	Very low	208 Å²	208	138.8 Å²	138.8	79%	0.785	77%	0.765	S	S	*	*				-174.8	153.9	95.4	-98	163.9	-172.7	-174.4	3.1	114.5
480	K	28.8	Very low	28.4	Very low	198 Å²	198	140.3 Å²	140.3	86%	0.861	77%	0.773	S	S	*	*			trans	6.6	139.1	150.3	-52	176.3	179.2	-175	0	118.3
481	G	29.6	Very low	28.2	Very low	80 Å²	80	142.3 Å²	142.3	83%	0.825	78%	0.779	S	S	*	*			cis	135.2	144	-1.9	0	0	0	0	0	113.8
482	G	31.2	Very low	28.1	Very low	89 Å²	89	144.3 Å²	144.3	92%	0.918	78%	0.784	S	S	*	*			trans	86.2	148.3	-178.1	0	0	0	0	0	113.9
483	G	30	Very low	28.2	Very low	68 Å²	68	142.8 Å²	142.8	70%	0.701	77%	0.772	S	S	*	*			cis	151.5	142.4	-15.3	0	0	0	0	0	115.7
484	R	27.6	Very low	28.2	Very low	256 Å²	256	145.7 Å²	145.7	97%	0.966	77%	0.773	S	S	*	*			trans	79.5	151.6	171.5	-56.5	179	-74.8	-153.3	-0.9	116.7
485	G	28.9	Very low	28.4	Very low	63 Å²	63	139 Å²	139	65%	0.649	76%	0.757	S	S	*	*			trans	93.1	106.5	-168.2	0	0	0	0	0	110.5
486	V	26.9	Very low	28.4	Very low	138 Å²	138	139.5 Å²	139.5	84%	0.836	76%	0.757	S	S	*	*			cis	59.1	114.2	36.1	-164.2	0	0	0	0	108.8
487	Q	27.8	Very low	28.6	Very low	173 Å²	173	142.7 Å²	142.7	81%	0.808	77%	0.765	S	S	*	*				-166.7	168.6	62.7	-162.5	177.7	-26.5	0	0	113
488	V	30.3	Very low	28.6	Very low	123 Å²	123	143.1 Å²	143.1	75%	0.745	76%	0.758	S	S	*	*			trans	80.8	116.6	165.5	-166.6	0	0	0	0	116.8
489	D	27.7	Very low	28.4	Very low	147 Å²	147	142 Å²	142	79%	0.786	76%	0.757	S	S	*	*			trans	-86.2	130.1	177.1	-45.4	-98.7	0	0	0	112.5
490	N	27.2	Very low	28.4	Very low	156 Å²	156	140 Å²	140	83%	0.834	76%	0.762	S	S	*	*			trans	-179	148.9	143	-98.2	-39.7	0	0	0	112
491	Q	26.6	Very low	28.2	Very low	162 Å²	162	136.2 Å²	136.2	76%	0.757	75%	0.751	S	S	*	*			trans	62.7	135.9	171.1	-70.7	179.9	-104	0	0	119.8
492	E	28.5	Very low	28.2	Very low	159 Å²	159	139.5 Å²	139.5	74%	0.743	75%	0.748	S	S	*	*			trans	61	157.1	153	-70.4	150	-124.5	0	0	117.7
493	E	27.8	Very low	27.8	Very low	120 Å²	120	141.3 Å²	141.3	56%	0.561	74%	0.737	S	S	*	*			cis	-122	170.6	2.2	-128.2	-178	152.2	0	0	108.6	K498	E493-K498 IonicContact OE1-NZ 3.71Å; E493-K498 PolarHBondContact OE1-NZ 3.36Å
494	I	30.2	Very low	27.8	Very low	149 Å²	149	145.3 Å²	145.3	76%	0.764	74%	0.741	S	S	*	*				-139.8	123	61.7	-71.7	168.4	0	0	0	110.5	Q496	I494-Q496 HydrophobicContact CG2-CG 4.33Å
495	T	28.4	Very low	27.7	Very low	83 Å²	83	138.8 Å²	138.8	51%	0.509	73%	0.725	S	S	.	*			trans	-122.8	100.6	177.9	-59	0	0	0	0	109.5	K498	T495-K498 VanDerWaalsContact O-CD 3.26Å; T495-K498 WeakPolarHBondContact O-CD 3.37Å; T495-K498 WeakPolarHBondContact O-CE 3.48Å
496	Q	29	Very low	27.6	Very low	154 Å²	154	142.9 Å²	142.9	72%	0.72	73%	0.729	S	S	*	*			trans	-145.1	128.8	176	-61.3	-179	2.3	0	0	108.5	I494	I494-Q496 HydrophobicContact CG2-CG 4.33Å
497	F	31.4	Very low	27.8	Very low	204 Å²	204	143.4 Å²	143.4	90%	0.895	72%	0.722	S	S	*	*			cis	-99.2	133.9	-1.2	-65.3	-111.9	0	0	0	108.2
498	K	26.5	Very low	27.7	Very low	117 Å²	117	140 Å²	140	51%	0.509	70%	0.702	S	S	.	*			cis	61.3	89.8	31	-81.8	-178.9	-177.9	167.6	0	114.6	E493 T495	E493-K498 IonicContact OE1-NZ 3.71Å; E493-K498 PolarHBondContact OE1-NZ 3.36Å; T495-K498 VanDerWaalsContact O-CD 3.26Å; T495-K498 WeakPolarHBondContact O-CD 3.37Å; T495-K498 WeakPolarHBondContact O-CE 3.48Å
499	N	24.8	Very low	27.6	Very low	135 Å²	135	139.4 Å²	139.4	72%	0.722	69%	0.694	S	S	*	*			trans	52.3	109.5	142.2	-56.5	4.8	0	0	0	119.7
500	N	27.4	Very low	27.7	Very low	165 Å²	165	137.5 Å²	137.5	88%	0.882	68%	0.684	S	S	*	*			trans	-113.4	59.6	138.8	-95.3	-18.2	0	0	0	109.3	I502	N500-I502 PolarHBondContact O-N 3.46Å
501	N	25	Very low	27.7	Very low	119 Å²	119	138.9 Å²	138.9	64%	0.636	68%	0.679	S	S	*	*			trans	-67.7	118.6	149.9	-90.1	6	0	0	0	106.1	D503	N501-D503 PolarHBondContact O-N 2.85Å
502	I	28.1	Very low	27.8	Very low	149 Å²	149	139.7 Å²	139.7	76%	0.764	68%	0.68	S	S	*	*			trans	-87.6	93.6	161.4	-64.7	-178.6	0	0	0	106.3	N500 I504	N500-I502 PolarHBondContact O-N 3.46Å; I502-I504 PolarHBondContact O-N 3.4Å
503	D	24.7	Very low	27.8	Very low	128 Å²	128	140 Å²	140	68%	0.684	68%	0.681	S	S	*	*			trans	-65.7	113.9	169.6	-69.9	-61.3	0	0	0	110.1	N501	N501-D503 PolarHBondContact O-N 2.85Å
504	I	28.8	Very low	27.7	Very low	152 Å²	152	142.1 Å²	142.1	78%	0.779	69%	0.691	S	S	*	*			trans	-133.6	78.1	145.6	-51.3	-178.7	0	0	0	107.6	I502	I502-I504 PolarHBondContact O-N 3.4Å
505	N	24.9	Very low	27.6	Very low	119 Å²	119	142.1 Å²	142.1	64%	0.636	69%	0.687	S	S	*	*			trans	-105	107.7	171.2	-167.5	9.6	0	0	0	108
506	M	27.1	Very low	27.6	Very low	149 Å²	149	142.6 Å²	142.6	73%	0.734	70%	0.695	S	S	*	*			trans	-138.6	117.1	-179	-87	-66.8	154.9	0	0	112.5
507	H	30.8	Very low	27.9	Very low	149 Å²	149	141.2 Å²	141.2	69%	0.69	69%	0.692	S	S	*	*			trans	59.8	103.3	164	-72.8	-71.2	0	0	0	120.8	P224	P224-H507 VanDerWaalsContact CB-O 3.28Å; P224-H507 WeakPolarHBondContact CB-O 3.02Å; P224-H507 WeakPolarHBondContact CG-O 3.3Å
508	R	26	Very low	27.9	Very low	102 Å²	102	137.6 Å²	137.6	39%	0.385	68%	0.682	S	S	.	*			trans	-72.6	176.8	146.1	-164.6	-150.3	-140.8	162.5	9.7	110.7	L226	L226-R508 HydrophobicContact CB-CB 3.88Å; L226-R508 VanDerWaalsContact CB-CD 3.45Å; L226-R508 HydrophobicContact CB-CG 3.72Å; L226-R508 VanDerWaalsContact CB-CZ 3.49Å; L226-R508 VanDerWaalsContact CB-NE 3.26Å; L226-R508 HydrophobicContact CD1-CB 4.32Å; L226-R508 HydrophobicContact CG-CB 4.48Å; L226-R508 PolarHBondContact O-NH2 3.3Å
509	N	29.6	Very low	28.1	Very low	109 Å²	109	138 Å²	138	58%	0.583	69%	0.694	S	S	*	*			trans	112.4	141	157.3	-62.6	26.2	0	0	0	114.2
510	D	29.6	Very low	28.3	Very low	108 Å²	108	137.3 Å²	137.3	58%	0.578	69%	0.691	S	S	*	*			cis	-165.1	153.1	-8.3	-108.2	-21.4	0	0	0	115.4
511	Y	26.7	Very low	28.3	Very low	184 Å²	184	135 Å²	135	72%	0.722	68%	0.683	S	S	*	*			trans	66.4	143.7	144.8	-89	-72.4	0	0	0	127.5
512	K	29.2	Very low	28.4	Very low	179 Å²	179	136.3 Å²	136.3	78%	0.778	69%	0.689	S	S	*	*			trans	91.1	106.2	160	-48.4	-150.4	178.4	-174.8	0	116.8
513	H	27.6	Very low	28.2	Very low	167 Å²	167	136.1 Å²	136.1	77%	0.773	69%	0.688	S	S	*	*				69.4	131.4	76.6	-70.5	-67.3	0	0	0	112.2
514	Q	26.3	Very low	28.4	Very low	163 Å²	163	134.9 Å²	134.9	76%	0.762	69%	0.685	S	S	*	*				-157.3	155.9	60.1	-174.3	162.9	-4.6	0	0	114.5
515	E	27.6	Very low	28.1	Very low	149 Å²	149	133.3 Å²	133.3	70%	0.696	69%	0.686	S	S	*	*			trans	12.6	122.9	161.8	-72.1	147.5	169.5	0	0	121.1
516	S	29.7	Very low	28.3	Very low	94 Å²	94	135.1 Å²	135.1	66%	0.657	69%	0.694	S	S	*	*				93	151.9	82.4	84.9	0	0	0	0	111.8
517	D	34.9	Very low	28.2	Very low	124 Å²	124	133.4 Å²	133.4	66%	0.663	70%	0.697	S	S	*	*			cis	-133.3	144.7	19.1	-89.1	-73.2	0	0	0	111.2
518	N	30.5	Very low	28.1	Very low	128 Å²	128	132.6 Å²	132.6	68%	0.684	70%	0.698	S	S	*	*				57.9	139.4	82.3	-63.3	-39.7	0	0	0	114.1
519	T	30.7	Very low	28.2	Very low	126 Å²	126	134.6 Å²	134.6	77%	0.773	72%	0.716	S	S	*	*			cis	-168.1	159.6	0.7	17.4	0	0	0	0	106.7
520	D	29.7	Very low	28.1	Very low	120 Å²	120	135.9 Å²	135.9	64%	0.642	72%	0.723	S	S	*	*			cis	-158.8	-179.9	-2.3	175.2	43.3	0	0	0	108.4	L522	D520-L522 PolarHBondContact OD2-N 3.4Å
521	T	26.6	Very low	27.9	Very low	118 Å²	118	140.1 Å²	140.1	72%	0.724	73%	0.731	S	S	*	*			trans	-118.9	87.8	163.5	-59.5	0	0	0	0	111.8	I523	T521-I523 PolarHBondContact O-N 3.43Å; T521-I523 VanDerWaalsContact O-N 3.14Å
522	L	26.6	Very low	28	Very low	146 Å²	146	138.1 Å²	138.1	76%	0.764	73%	0.733	S	S	*	*			trans	-71.6	102.4	-179.9	-101.2	168.3	0	0	0	112.9	D520 V524	D520-L522 PolarHBondContact OD2-N 3.4Å; L522-V524 HydrophobicContact CB-CG2 4.45Å; L522-V524 HydrophobicContact CD2-CG2 3.98Å
523	I	25.8	Very low	27.8	Very low	145 Å²	145	137.4 Å²	137.4	74%	0.744	74%	0.737	S	S	*	*			trans	-88.4	105.1	168.1	-59.2	177	0	0	0	108.9	T521	T521-I523 PolarHBondContact O-N 3.43Å; T521-I523 VanDerWaalsContact O-N 3.14Å
524	V	27	Very low	27.7	Very low	102 Å²	102	135.6 Å²	135.6	62%	0.618	74%	0.738	S	S	*	*			trans	-111.8	111.1	179.2	-174.1	0	0	0	0	110.9	L522 I526	L522-V524 HydrophobicContact CB-CG2 4.45Å; L522-V524 HydrophobicContact CD2-CG2 3.98Å; V524-I526 HydrophobicContact CG1-CD1 4.23Å; V524-I526 HydrophobicContact CG1-CG1 4.06Å
525	C	24.4	Very low	27.7	Very low	119 Å²	119	133.3 Å²	133.3	80%	0.804	74%	0.74	S	S	*	*			trans	-89.5	121	175.7	-63.7	0	0	0	0	110.9
526	I	27.3	Very low	27.6	Very low	157 Å²	157	131.9 Å²	131.9	81%	0.805	74%	0.741	S	S	*	*			trans	-127.6	133.7	172	-55.1	-177	0	0	0	110.2	V524	V524-I526 HydrophobicContact CG1-CD1 4.23Å; V524-I526 HydrophobicContact CG1-CG1 4.06Å
527	S	25.6	Very low	27.5	Very low	112 Å²	112	134.8 Å²	134.8	78%	0.783	75%	0.748	S	S	*	*			trans	-94.7	111.1	-177.8	171.4	0	0	0	0	112.3
528	N	29.8	Very low	27	Very low	133 Å²	133	136.1 Å²	136.1	71%	0.711	75%	0.752	S	S	*	*			trans	24.4	114.4	146.5	-171.7	23.7	0	0	0	119
529	N	26.3	Very low	26.9	Very low	143 Å²	143	139.2 Å²	139.2	77%	0.765	76%	0.759	S	S	*	*			trans	-161.3	144.7	133.5	-104.4	-32	0	0	0	112.7
530	N	28.5	Very low	26.7	Very low	137 Å²	137	138.6 Å²	138.6	73%	0.733	76%	0.755	S	S	*	*			trans	52.9	105.7	162	-68.3	-26.7	0	0	0	120.4
531	R	25.8	Very low	26.5	Very low	196 Å²	196	139 Å²	139	74%	0.74	76%	0.762	S	S	*	*				41.9	129.3	129.8	-66.6	-179.3	175.2	165.3	-2.1	119.6
532	N	27.4	Very low	26.6	Very low	143 Å²	143	139.4 Å²	139.4	77%	0.765	77%	0.765	S	S	*	*			trans	74.5	105.9	171	-48.9	-6.4	0	0	0	113.9
533	N	26.7	Very low	26.7	Very low	163 Å²	163	137 Å²	137	87%	0.872	76%	0.758	S	S	*	*				-173.3	158.4	113.1	-89.8	-19.1	0	0	0	112.1
534	T	25	Very low	26.8	Very low	130 Å²	130	139.6 Å²	139.6	80%	0.798	76%	0.76	S	S	*	*			trans	-73.6	137.4	178	39.1	0	0	0	0	112
535	S	25.7	Very low	27.1	Very low	114 Å²	114	141.1 Å²	141.1	80%	0.797	76%	0.764	S	S	*	*			trans	-97.9	94.9	171.3	45.6	0	0	0	0	111.2	I537	S535-I537 PolarHBondContact O-N 3.23Å
536	V	26.2	Very low	27.5	Very low	120 Å²	120	142.7 Å²	142.7	73%	0.727	77%	0.765	S	S	*	*			trans	-75.7	113.4	168.2	179.5	0	0	0	0	108.8	M538	V536-M538 HydrophobicContact CG1-CG 3.96Å; V536-M538 PolarHBondContact O-N 3.28Å; V536-M538 VanDerWaalsContact O-N 3.11Å
537	I	27.3	Very low	27.6	Very low	155 Å²	155	142.1 Å²	142.1	80%	0.795	76%	0.763	S	S	*	*			trans	-82.2	86.2	172.4	-55.4	179.5	0	0	0	108.8	S535	S535-I537 PolarHBondContact O-N 3.23Å
538	M	24.4	Very low	28.1	Very low	151 Å²	151	143.8 Å²	143.8	74%	0.744	76%	0.764	S	S	*	*			trans	-74.1	122.2	164.1	-71.8	-156.3	-68.1	0	0	109.7	V536 T540	V536-M538 HydrophobicContact CG1-CG 3.96Å; V536-M538 PolarHBondContact O-N 3.28Å; V536-M538 VanDerWaalsContact O-N 3.11Å; M538-T540 PolarHBondContact O-N 3.29Å
539	K	27.4	Very low	28.1	Very low	194 Å²	194	143.9 Å²	143.9	84%	0.843	76%	0.764	S	S	*	*			trans	-78.2	93.4	164.6	-71.4	-177.1	178.8	179.1	0	108.7	T541	K539-T541 PolarHBondContact O-N 3.22Å; K539-T541 VanDerWaalsContact O-N 3.07Å
540	T	26.7	Very low	28.4	Very low	112 Å²	112	141.8 Å²	141.8	69%	0.687	76%	0.76	S	S	*	*			trans	-72.1	97.1	171.7	49.6	0	0	0	0	110.1	M538 T542	M538-T540 PolarHBondContact O-N 3.29Å; T540-T542 PolarHBondContact O-N 3.25Å
541	T	27.1	Very low	28.6	Very low	129 Å²	129	141.9 Å²	141.9	79%	0.791	76%	0.761	S	S	*	*			trans	-68.3	117.7	159.8	47.3	0	0	0	0	108.6	K539 P543	K539-T541 PolarHBondContact O-N 3.22Å; K539-T541 VanDerWaalsContact O-N 3.07Å; T541-P543 WeakPolarHBondContact O-CD 3.49Å
542	T	27.8	Very low	28.8	Very low	126 Å²	126	138.1 Å²	138.1	77%	0.773	76%	0.755	S	S	*	*			trans	-96.3	102.9	175.1	49.2	0	0	0	0	110.5	T540	T540-T542 PolarHBondContact O-N 3.25Å
543	P	29.3	Very low	28.7	Very low	95 Å²	95	141.4 Å²	141.4	62%	0.617	76%	0.757	S	S	*	*			trans	-75.5	178.4	155.2	33.6	-32.9	0	0	0	110.5	T541	T541-P543 WeakPolarHBondContact O-CD 3.49Å
544	Y	27.7	Very low	28.7	Very low	201 Å²	201	144.4 Å²	144.4	79%	0.788	76%	0.758	S	S	*	*			trans	70.8	153.2	-178.7	-68.4	-91.1	0	0	0	114.8
545	D	32	Very low	28.8	Very low	134 Å²	134	143.4 Å²	143.4	72%	0.717	75%	0.751	S	S	*	*			cis	-114.6	147.4	7.9	-96	-58.7	0	0	0	114.9
546	N	33.4	Very low	28.9	Very low	152 Å²	152	144.3 Å²	144.3	81%	0.813	75%	0.747	S	S	*	*			trans	-146.7	121	146.2	-140.3	-2.2	0	0	0	106.9	D548	N546-D548 PolarHBondContact O-N 3.19Å
547	N	29.5	Very low	28.9	Very low	145 Å²	145	144.2 Å²	144.2	78%	0.775	75%	0.747	S	S	*	*			trans	-65.4	131.9	-171.8	-70.4	-74.8	0	0	0	111.2
548	D	36.2	Very low	28.8	Very low	147 Å²	147	142.6 Å²	142.6	79%	0.786	74%	0.74	S	S	*	*				-152.7	157.4	129.8	-129.2	-34.2	0	0	0	114.8	N546	N546-D548 PolarHBondContact O-N 3.19Å
549	N	30.3	Very low	29	Very low	135 Å²	135	142.4 Å²	142.4	72%	0.722	74%	0.742	S	S	*	*			trans	-64.8	145	-155.7	-78.2	-89.6	0	0	0	118.6
550	S	32.7	Very low	29	Very low	98 Å²	98	140 Å²	140	69%	0.685	74%	0.737	S	S	*	*			trans	101.3	124.5	130.3	78.8	0	0	0	0	121.9
551	N	31.3	Very low	29.1	Very low	140 Å²	140	141.5 Å²	141.5	75%	0.749	74%	0.739	S	S	*	*			trans	74.6	112.2	135	-69.7	-24.9	0	0	0	122.1
552	N	30.8	Very low	28.9	Very low	116 Å²	116	143 Å²	143	62%	0.62	74%	0.739	S	S	*	*			trans	85	98.1	137.1	-72	-51	0	0	0	120.7
553	R	25.7	Very low	28.8	Very low	213 Å²	213	148.4 Å²	148.4	80%	0.804	75%	0.746	S	S	*	*				93.4	125.1	113.9	-73.1	175	-164.3	-158.4	-0.6	120
554	Y	26.8	Very low	28.8	Very low	226 Å²	226	149.4 Å²	149.4	89%	0.886	75%	0.75	S	S	*	*			trans	95.3	139.6	137.6	-111.5	-97.3	0	0	0	118.9
555	V	26.6	Very low	28.7	Very low	109 Å²	109	146.1 Å²	146.1	66%	0.661	75%	0.751	S	S	*	*			trans	-104	140.6	-176.3	175.8	0	0	0	0	107.8	T557	V555-T557 HydrophobicContact CG1-CG2 3.8Å
556	D	27.7	Very low	28.4	Very low	132 Å²	132	146.6 Å²	146.6	71%	0.706	75%	0.753	S	S	*	*			trans	-136.5	135.6	146	-159.9	-21.2	0	0	0	108.5	N558	D556-N558 PolarHBondContact OD1-ND2 3.41Å
557	T	26.4	Very low	28.2	Very low	119 Å²	119	144 Å²	144	73%	0.73	75%	0.747	S	S	*	*			trans	-122.4	80.1	-177.3	50.4	0	0	0	0	109.1	V555	V555-T557 HydrophobicContact CG1-CG2 3.8Å
558	N	25.2	Very low	28.2	Very low	120 Å²	120	144.3 Å²	144.3	64%	0.642	75%	0.749	S	S	*	*			trans	-141.9	149.8	178.6	-82.9	-69.7	0	0	0	110.9	D556	D556-N558 PolarHBondContact OD1-ND2 3.41Å
559	N	29.1	Very low	27.8	Very low	147 Å²	147	145.2 Å²	145.2	79%	0.786	75%	0.748	S	S	*	*			trans	73.2	129.3	-178.3	-50.1	-47.8	0	0	0	114.4
560	I	27.9	Very low	27.9	Very low	145 Å²	145	146.4 Å²	146.4	74%	0.744	76%	0.755	S	S	*	*			cis	-133.2	119.9	6.5	-79	103.4	0	0	0	112
561	I	28.1	Very low	27.6	Very low	142 Å²	142	148.5 Å²	148.5	73%	0.728	76%	0.758	S	S	*	*			trans	43.4	121.3	133	-49.8	173.9	0	0	0	120.3
562	M	23.1	Very low	27.6	Very low	162 Å²	162	150.3 Å²	150.3	80%	0.798	77%	0.766	S	S	*	*			trans	-79.6	155.4	162.9	-56	-163.3	-56.4	0	0	113.4
563	R	25.1	Very low	27.3	Very low	239 Å²	239	150.5 Å²	150.5	90%	0.902	77%	0.767	S	S	*	*			trans	-142.6	118.1	142.7	-76.1	-161.8	175.1	144.3	3.4	112.9
564	T	28.8	Very low	27.5	Very low	116 Å²	116	147.1 Å²	147.1	71%	0.712	77%	0.769	S	S	*	*			trans	-136.2	108.8	164.5	50.5	0	0	0	0	108.8
565	T	26.9	Very low	27.4	Very low	131 Å²	131	140 Å²	140	80%	0.804	75%	0.753	S	S	*	*			trans	-166	130.8	163.7	37.2	0	0	0	0	111.5
566	N	25.2	Very low	27.4	Very low	144 Å²	144	140.2 Å²	140.2	77%	0.77	76%	0.759	S	S	*	*			trans	18.9	147.1	137.8	-55.6	-2.5	0	0	0	122.3
567	S	27.9	Very low	27.4	Very low	98 Å²	98	138.9 Å²	138.9	69%	0.685	76%	0.76	S	S	*	*			trans	43.2	135	140.4	75.1	0	0	0	0	119.8
568	D	30.7	Very low	27.5	Very low	151 Å²	151	139.7 Å²	139.7	81%	0.807	76%	0.759	S	S	*	*				-156.7	174.5	74.4	-81.2	-23.3	0	0	0	114.1
569	H	26.5	Very low	27.6	Very low	167 Å²	167	141 Å²	141	77%	0.773	77%	0.765	S	S	*	*			trans	-78.5	149.5	177	-64.9	-59.1	0	0	0	113.6
570	N	34.3	Very low	27.5	Very low	160 Å²	160	137.8 Å²	137.8	86%	0.856	76%	0.755	S	S	*	*			trans	-173.5	97.3	140.2	-88.6	-39.1	0	0	0	107.1
571	N	25.1	Very low	27.5	Very low	142 Å²	142	137.7 Å²	137.7	76%	0.759	76%	0.756	S	S	*	*				45	92.3	78.5	-78.5	8.7	0	0	0	114.8
572	I	31.9	Very low	27.5	Very low	177 Å²	177	136.3 Å²	136.3	91%	0.908	75%	0.754	S	S	*	*				-132.5	141.1	124.6	-63.4	-170.8	0	0	0	107
573	D	25.2	Very low	27.6	Very low	120 Å²	120	133.1 Å²	133.1	64%	0.642	75%	0.748	S	S	*	*			trans	-126.7	134.4	-169.2	164	32.7	0	0	0	110.4	S575	D573-S575 PolarHBondContact OD1-N 3.36Å
574	V	29.5	Very low	27.5	Very low	142 Å²	142	125.9 Å²	125.9	86%	0.861	73%	0.734	S	S	*	*			trans	-142.3	76.4	151.3	-168.6	0	0	0	0	110.4
575	S	23.5	Very low	27.4	Very low	78 Å²	78	127.8 Å²	127.8	55%	0.545	74%	0.738	S	S	.	*			trans	-15.3	160.3	149	48.2	0	0	0	0	121.4	D573	D573-S575 PolarHBondContact OD1-N 3.36Å
576	S	26.5	Very low	27.4	Very low	112 Å²	112	127 Å²	127	78%	0.783	73%	0.733	S	S	*	*			trans	77.1	145.8	168	80.1	0	0	0	0	117.5
577	S	29.6	Very low	27.3	Very low	105 Å²	105	124.7 Å²	124.7	73%	0.734	73%	0.728	S	S	*	*			cis	-135.6	137	-4.6	47.1	0	0	0	0	108.9
578	I	26.7	Very low	27.2	Very low	135 Å²	135	126.7 Å²	126.7	69%	0.692	73%	0.731	S	S	*	*				65.1	86.5	65.4	-55.3	173.4	0	0	0	113.3
579	N	28.4	Very low	27.2	Very low	147 Å²	147	127.2 Å²	127.2	79%	0.786	73%	0.734	S	S	*	*				-173.2	107.1	121.8	-88.9	-35.1	0	0	0	107
580	S	26.9	Very low	27.1	Very low	80 Å²	80	130.1 Å²	130.1	56%	0.559	74%	0.738	S	S	*	*				52.8	92.5	54.3	80.8	0	0	0	0	114.5
581	N	28.2	Very low	26.8	Very low	144 Å²	144	129 Å²	129	77%	0.77	73%	0.732	S	S	*	*				-160.2	122.9	117.2	-85.8	-27.9	0	0	0	108.1
582	T	26.9	Very low	26.9	Very low	113 Å²	113	130.8 Å²	130.8	69%	0.693	73%	0.729	S	S	*	*				68.1	137.5	60.9	70.1	0	0	0	0	112.7
583	S	25.7	Very low	26.7	Very low	95 Å²	95	133.4 Å²	133.4	66%	0.664	73%	0.729	S	S	*	*			cis	-167.6	173.8	-10.6	47	0	0	0	0	110.4
584	S	24.1	Very low	26.9	Very low	86 Å²	86	133.5 Å²	133.5	60%	0.601	73%	0.729	S	S	*	*			trans	40.9	124.7	145.7	61.3	0	0	0	0	119.2
585	I	26.9	Very low	26.9	Very low	156 Å²	156	134.2 Å²	134.2	80%	0.8	73%	0.728	S	S	*	*				-160.7	121.7	81.2	-84.9	146	0	0	0	106.2
586	V	25.1	Very low	27.2	Very low	115 Å²	115	138 Å²	138	70%	0.697	74%	0.741	S	S	*	*				78.4	121.7	60.3	174.2	0	0	0	0	113.8
587	S	24.5	Very low	27.4	Very low	95 Å²	95	136.6 Å²	136.6	66%	0.664	73%	0.725	S	S	*	*			trans	80.3	136.5	164.1	77.7	0	0	0	0	120
588	N	24.9	Very low	27.5	Very low	141 Å²	141	137.1 Å²	137.1	75%	0.754	71%	0.714	S	S	*	*			trans	58.8	101.9	151.8	-55.3	-22.5	0	0	0	119.6
589	N	30	Very low	27.6	Very low	161 Å²	161	140.2 Å²	140.2	86%	0.861	73%	0.726	S	S	*	*				-155	130.7	95.9	-96.7	-30	0	0	0	112.9
590	R	24.9	Very low	27.6	Very low	229 Å²	229	140.8 Å²	140.8	86%	0.864	73%	0.728	S	S	*	*			trans	-79.7	153.1	155.2	-59.1	169.6	179.7	149.1	-1	107
591	N	28.4	Very low	27.6	Very low	135 Å²	135	143.7 Å²	143.7	72%	0.722	74%	0.737	S	S	*	*			trans	-174.9	113.3	138.3	-91.3	-20.7	0	0	0	112.6
592	Y	26.4	Very low	27.7	Very low	181 Å²	181	143.7 Å²	143.7	71%	0.71	74%	0.737	S	S	*	*			trans	29.4	114	143.1	-51.4	-78.7	0	0	0	121	L594	Y592-L594 HydrophobicContact CD1-CG 4.46Å
593	Y	27.9	Very low	27.8	Very low	232 Å²	232	144.2 Å²	144.2	91%	0.91	74%	0.735	S	S	*	*				-132.8	152.9	102.7	-128.2	-98.3	0	0	0	109.3
594	L	30.6	Very low	28	Very low	122 Å²	122	147.3 Å²	147.3	64%	0.639	74%	0.737	S	S	*	*			trans	-101.7	123.9	-165.6	-75.7	165.5	0	0	0	112.9	Y592 L596	Y592-L594 HydrophobicContact CD1-CG 4.46Å; L594-L596 HydrophobicContact CB-CG 4.32Å; L594-L596 PolarHBondContact O-N 3.12Å
595	D	28.6	Very low	28.2	Very low	157 Å²	157	155.2 Å²	155.2	84%	0.84	75%	0.754	S	S	*	*			trans	-77.4	96.2	168.2	-166.7	9.5	0	0	0	109.3	D597	D595-D597 PolarHBondContact O-N 3.15Å
596	L	31.1	Very low	28.2	Very low	157 Å²	157	153 Å²	153	82%	0.822	74%	0.742	S	S	*	*			trans	-92.2	59.6	-170.2	-91.7	172.3	0	0	0	112.9	L594	L594-L596 HydrophobicContact CB-CG 4.32Å; L594-L596 PolarHBondContact O-N 3.12Å
597	D	29	Very low	28.5	Very low	83 Å²	83	154.4 Å²	154.4	44%	0.444	75%	0.746	S	S	.	*	S	Bend	trans	-150.4	113.2	169.1	-158.8	13.1	0	0	0	114.1	D595 N978	D595-D597 PolarHBondContact O-N 3.15Å; D597-N978 PolarHBondContact OD2-ND2 2.91Å
598	K	32.7	Very low	28.6	Very low	115 Å²	115	155.3 Å²	155.3	50%	0.5	74%	0.744	S	S	.	*			trans	75.6	91.1	170.6	-45.5	168.3	-145.5	72.7	0	118.4	N978	K598-N978 WeakPolarHBondContact CE-ND2 3.18Å
599	Q	29.1	Very low	28.9	Very low	201 Å²	201	155.8 Å²	155.8	94%	0.939	75%	0.746	S	S	*	*			trans	-149.2	96.5	137.9	-80.6	-150.6	41.2	0	0	112.9
600	L	27	Very low	28.8	Very low	159 Å²	159	152.5 Å²	152.5	83%	0.832	74%	0.735	S	S	*	*			trans	-162.7	110.9	140.2	-150.9	74	0	0	0	111.7
601	N	27.7	Very low	29	Very low	140 Å²	140	149.7 Å²	149.7	75%	0.749	73%	0.734	S	S	*	*			trans	156.2	150.7	143.5	-84.7	-32.2	0	0	0	111.9
602	N	29.5	Very low	28.9	Very low	144 Å²	144	149.9 Å²	149.9	77%	0.77	74%	0.735	S	S	*	*			trans	70	148.8	-179.6	-53.7	-38.2	0	0	0	114.5
603	N	29.7	Very low	29.1	Very low	124 Å²	124	149.1 Å²	149.1	66%	0.663	74%	0.743	S	S	*	*			cis	-168.8	154.2	-16.4	-108.6	-35.8	0	0	0	107
604	K	29.9	Very low	28.9	Very low	161 Å²	161	146.5 Å²	146.5	70%	0.7	74%	0.736	S	S	*	*			cis	-166.4	154.4	-9.5	-154.2	173.6	-164.7	177.4	0	107.7	I606	K604-I606 HydrophobicContact CD-CD1 4.2Å
605	R	27.3	Very low	28.7	Very low	251 Å²	251	147.5 Å²	147.5	95%	0.947	74%	0.742	S	S	*	*			trans	-145.6	122.2	157.3	-151.7	172.1	-168.9	-178.7	2.8	112.5
606	I	28.5	Very low	28.7	Very low	109 Å²	109	145.3 Å²	145.3	56%	0.559	74%	0.739	S	S	*	*			trans	-109.2	137.5	179.2	-65.4	169.4	0	0	0	108.7	K604	K604-I606 HydrophobicContact CD-CD1 4.2Å
607	N	30.3	Very low	28.4	Very low	146 Å²	146	147.1 Å²	147.1	78%	0.781	74%	0.736	S	S	*	*			trans	-143.8	111.4	140.1	-96.7	-18	0	0	0	104.5
608	N	26.9	Very low	28.2	Very low	114 Å²	114	152 Å²	152	61%	0.61	76%	0.756	S	S	*	*				65.9	89.6	86.6	-65.9	-0.7	0	0	0	112
609	N	31.1	Very low	28	Very low	151 Å²	151	151.9 Å²	151.9	81%	0.807	77%	0.77	S	S	*	*				-174.4	150	98.2	-88.3	-19.1	0	0	0	114.7
610	S	27.9	Very low	27.9	Very low	91 Å²	91	151 Å²	151	64%	0.636	76%	0.763	S	S	*	*			trans	48.7	119.5	146.9	-60.9	0	0	0	0	122.9
611	M	29.8	Very low	27.9	Very low	171 Å²	171	150.1 Å²	150.1	84%	0.842	76%	0.759	S	S	*	*			trans	69.2	114.9	133.1	-58.4	174.5	-171.9	0	0	117.8
612	N	24.9	Very low	27.8	Very low	139 Å²	139	148 Å²	148	74%	0.743	76%	0.761	S	S	*	*				71.3	96.9	56.8	-169.8	26	0	0	0	113.2
613	L	30.5	Very low	27.8	Very low	165 Å²	165	149.8 Å²	149.8	86%	0.864	76%	0.762	S	S	*	*				-170.9	166.4	123.3	-100.5	160.9	0	0	0	112.3
614	K	25.4	Very low	27.5	Very low	176 Å²	176	151.9 Å²	151.9	77%	0.765	77%	0.768	S	S	*	*			trans	-107.2	157.2	-173.9	-88.3	-178.6	175.6	177.8	0	112.1
615	N	25	Very low	27.3	Very low	144 Å²	144	150.4 Å²	150.4	77%	0.77	77%	0.767	S	S	*	*			trans	56.5	106	148.1	-58.4	4.8	0	0	0	120.6
616	S	28.5	Very low	27.3	Very low	110 Å²	110	144 Å²	144	77%	0.769	76%	0.756	S	S	*	*				-152.9	126.9	124.4	60.1	0	0	0	0	107.7
617	Y	25.1	Very low	27.2	Very low	196 Å²	196	144 Å²	144	77%	0.769	76%	0.761	S	S	*	*				54.4	117.3	74.3	-82.1	-78.4	0	0	0	113.9
618	E	25.8	Very low	27.1	Very low	184 Å²	184	144.4 Å²	144.4	86%	0.86	76%	0.758	S	S	*	*			trans	62.8	146	155.5	-50.1	-176.7	130.6	0	0	116.2
619	S	27.3	Very low	27.3	Very low	113 Å²	113	145.9 Å²	145.9	79%	0.79	77%	0.766	S	S	*	*			cis	-160.4	-173.4	28	58.5	0	0	0	0	113
620	K	26.9	Very low	27.1	Very low	182 Å²	182	148.9 Å²	148.9	79%	0.791	77%	0.766	S	S	*	*			trans	-62	-177.4	179.7	-59.6	153.9	-179.6	168.3	0	113.9
621	N	28.7	Very low	27.6	Very low	141 Å²	141	148.7 Å²	148.7	75%	0.754	76%	0.762	S	S	*	*			trans	86.8	125.8	174.1	-44.6	-23.3	0	0	0	112.7
622	A	24.8	Very low	27.5	Very low	95 Å²	95	146.8 Å²	146.8	79%	0.785	76%	0.756	S	S	*	*			cis	74.5	64.7	18.9	0	0	0	0	0	115.7
623	F	28.6	Very low	27.9	Very low	182 Å²	182	146.5 Å²	146.5	80%	0.798	75%	0.754	S	S	*	*			trans	-151.7	126.1	148.2	-85	-82.8	0	0	0	102.9
624	E	24.4	Very low	27.9	Very low	169 Å²	169	142.1 Å²	142.1	79%	0.79	74%	0.738	S	S	*	*			cis	55.1	94.3	33	-154.7	-169.5	-144.8	0	0	113.2
625	L	26.5	Very low	28.5	Very low	129 Å²	129	139.8 Å²	139.8	68%	0.675	73%	0.734	S	S	*	*				176.7	133.4	126.3	-118.7	83.5	0	0	0	111.9
626	T	26.1	Very low	28.8	Very low	117 Å²	117	139.9 Å²	139.9	72%	0.718	73%	0.734	S	S	*	*			trans	63	158.8	143.8	58.1	0	0	0	0	120.3
627	T	27.2	Very low	29	Very low	108 Å²	108	139.2 Å²	139.2	66%	0.663	73%	0.729	S	S	*	*			cis	-152	167.6	-1.9	-2.6	0	0	0	0	112.8
628	H	27.3	Very low	29.2	Very low	156 Å²	156	135.7 Å²	135.7	72%	0.722	73%	0.728	S	S	*	*			trans	-15.3	142.7	159	-46.9	-46.4	0	0	0	118.5
629	N	31.3	Very low	29.3	Very low	144 Å²	144	134.3 Å²	134.3	77%	0.77	73%	0.725	S	S	*	*				-165.8	144.9	66.1	-83.2	-72.1	0	0	0	110
630	R	27.7	Very low	29.4	Very low	214 Å²	214	134.1 Å²	134.1	81%	0.808	72%	0.72	S	S	*	*				74.7	150.7	65.1	-100.1	-147.4	102.1	155.1	2.2	114.4
631	P	37	Very low	29.5	Very low	87 Å²	87	132.2 Å²	132.2	57%	0.565	72%	0.716	S	S	*	*				-137.7	-141.5	-117.1	40.5	-17.7	0	0	0	113.1
632	N	28.6	Very low	29.5	Very low	131 Å²	131	133.5 Å²	133.5	70%	0.701	72%	0.723	S	S	*	*			trans	78.8	157.9	178	-58.3	-2	0	0	0	113.5
633	N	34	Very low	29.7	Very low	134 Å²	134	134.4 Å²	134.4	72%	0.717	72%	0.718	S	S	*	*			cis	-146.9	141.1	18.4	-132.1	4.3	0	0	0	110
634	S	30.9	Very low	29.9	Very low	73 Å²	73	133.4 Å²	133.4	51%	0.51	72%	0.721	S	S	.	*				61.5	132.2	103.7	84.9	0	0	0	0	115.7
635	N	36	Very low	30.7	Very low	127 Å²	127	130.3 Å²	130.3	68%	0.679	72%	0.716	S	S	*	*			cis	-169.9	155.1	46.8	-93.5	-47.7	0	0	0	112.9
636	N	32.9	Very low	30.9	Very low	146 Å²	146	129.4 Å²	129.4	78%	0.781	72%	0.72	S	S	*	*			trans	60.3	154.1	142.1	-60.1	-6.2	0	0	0	120.5
637	S	32.8	Very low	31.1	Very low	95 Å²	95	130.3 Å²	130.3	66%	0.664	72%	0.721	S	S	*	*			cis	-165.6	117.1	-11.9	40	0	0	0	0	109.5
638	T	28.2	Very low	31.5	Very low	123 Å²	123	130.4 Å²	130.4	76%	0.755	72%	0.721	S	S	*	*				76.3	144.6	97.3	-5.3	0	0	0	0	118.1
639	I	28.5	Very low	31.6	Very low	154 Å²	154	128.2 Å²	128.2	79%	0.79	72%	0.719	S	S	*	*			trans	75.8	139.4	154.6	-71.2	160.1	0	0	0	117.5
640	T	29.5	Very low	31.8	Very low	110 Å²	110	129 Å²	129	68%	0.675	72%	0.723	S	S	*	*			cis	-161.7	150.3	-16.4	-92.4	0	0	0	0	112.7
641	I	27.9	Very low	31.9	Very low	141 Å²	141	128.5 Å²	128.5	72%	0.723	73%	0.73	S	S	*	*			trans	-18.1	140.5	158.7	-49.5	158.9	0	0	0	117.9
642	L	29.7	Very low	31.8	Very low	169 Å²	169	127.4 Å²	127.4	89%	0.885	73%	0.734	S	S	*	*			trans	-162.4	153	134	-108.8	162	0	0	0	112.3
643	T	29.6	Very low	32	Very low	113 Å²	113	126.1 Å²	126.1	69%	0.693	74%	0.736	S	S	*	*			trans	-140.8	145.8	-173.9	49.4	0	0	0	0	110.2
644	D	31.4	Very low	32	Very low	161 Å²	161	126.3 Å²	126.3	86%	0.861	74%	0.737	S	S	*	*			trans	-166.5	157.4	145.1	-105.1	-27	0	0	0	113.9
645	P	42	Very low	32.2	Very low	104 Å²	104	128.9 Å²	128.9	68%	0.675	75%	0.749	S	S	*	*			trans	-125	-161.3	-176.5	44.3	-30.8	0	0	0	115.1
646	S	30.8	Very low	32	Very low	110 Å²	110	127.9 Å²	127.9	77%	0.769	75%	0.752	S	S	*	*			trans	78.2	159.7	-179.8	85	0	0	0	0	115.1
647	N	30.3	Very low	32.1	Very low	136 Å²	136	127.7 Å²	127.7	73%	0.727	75%	0.749	S	S	*	*			cis	-155.6	-178	-3.3	-130.3	-20.4	0	0	0	107.8
648	T	34.3	Very low	32.1	Very low	111 Å²	111	129.7 Å²	129.7	68%	0.681	75%	0.753	S	S	*	*			cis	-157	140.9	4.1	6.7	0	0	0	0	106.3
649	T	30.7	Very low	32.5	Very low	109 Å²	109	131.5 Å²	131.5	67%	0.669	76%	0.758	S	S	*	*				63.8	123.4	87.9	-47.3	0	0	0	0	117.7
650	N	34.9	Very low	32.9	Very low	161 Å²	161	128.4 Å²	128.4	86%	0.861	76%	0.755	S	S	*	*			trans	-172	158.7	132.4	-95.7	-18.1	0	0	0	113.4
651	Q	30.3	Very low	33.1	Very low	204 Å²	204	131.1 Å²	131.1	95%	0.953	76%	0.762	S	S	*	*			trans	-140	166.1	-176.9	-72.5	-169.7	-5.2	0	0	112.9
652	G	34.4	Very low	33.7	Very low	63 Å²	63	129.4 Å²	129.4	65%	0.649	76%	0.76	S	S	*	*			trans	163.7	120.4	170.9	0	0	0	0	0	107.7
653	S	33.7	Very low	33.8	Very low	105 Å²	105	127.9 Å²	127.9	73%	0.734	75%	0.752	S	S	*	*			cis	74.7	136.4	47.5	102.6	0	0	0	0	111.5
654	D	32.5	Very low	33.9	Very low	137 Å²	137	127 Å²	127	73%	0.733	75%	0.751	S	S	*	*			cis	-152.1	-174.6	11.8	-82.3	-63.7	0	0	0	112.3
655	V	35.8	Very low	33.9	Very low	128 Å²	128	124.5 Å²	124.5	78%	0.776	74%	0.741	S	S	*	*			trans	73.8	119.4	162.4	-147.6	0	0	0	0	115.2
656	S	31.6	Very low	33.4	Very low	106 Å²	106	126.3 Å²	126.3	74%	0.741	74%	0.744	S	S	*	*			cis	74.3	147.4	46.8	-143.3	0	0	0	0	112.2
657	I	35.9	Very low	33.5	Very low	141 Å²	141	126 Å²	126	72%	0.723	74%	0.738	S	S	*	*			cis	-141.5	167.4	28	-80.6	174.5	0	0	0	111
658	D	32.9	Very low	33.5	Very low	138 Å²	138	125.1 Å²	125.1	74%	0.738	74%	0.738	S	S	*	*			trans	-30.9	161.9	170.5	-48	-66.6	0	0	0	118.2
659	D	35.5	Very low	33.4	Very low	160 Å²	160	126.9 Å²	126.9	86%	0.856	75%	0.748	S	S	*	*				-166.5	167.2	73.9	-136.7	-29.4	0	0	0	117
660	A	36.4	Very low	33.4	Very low	89 Å²	89	128.4 Å²	128.4	74%	0.736	75%	0.752	S	S	*	*			trans	62.8	94.1	159.2	0	0	0	0	0	122
661	M	35.3	Very low	33.4	Very low	168 Å²	168	129.1 Å²	129.1	83%	0.828	75%	0.748	S	S	*	*			trans	-59.8	-178.5	148.5	-122.1	-149.5	-177.6	0	0	112.3	L663	M661-L663 HydrophobicContact SD-CD1 4.49Å
662	P	38.9	Very low	33.5	Very low	104 Å²	104	125 Å²	125	68%	0.675	74%	0.737	S	S	*	*			cis	-146.8	175.9	25.2	34.6	-9.4	0	0	0	120.2
663	L	33	Very low	33.3	Very low	137 Å²	137	128.8 Å²	128.8	72%	0.717	74%	0.741	S	S	*	*			trans	54.2	110.5	146.2	-93.1	60	0	0	0	120.1	M661	M661-L663 HydrophobicContact SD-CD1 4.49Å
664	S	31.7	Very low	33.3	Very low	96 Å²	96	132.4 Å²	132.4	67%	0.671	74%	0.744	S	S	*	*				105.7	161.3	75.1	71.6	0	0	0	0	111.1
665	T	31	Very low	33.1	Very low	107 Å²	107	136 Å²	136	66%	0.656	75%	0.747	S	S	*	*			cis	-163.6	142.8	33.5	-44.6	0	0	0	0	111.9
666	I	32.3	Very low	32.9	Very low	142 Å²	142	138.3 Å²	138.3	73%	0.728	75%	0.747	S	S	*	*			trans	61.6	102.4	151.5	-76.4	174.9	0	0	0	118.8
667	T	31.3	Very low	32.8	Very low	104 Å²	104	138.8 Å²	138.8	64%	0.638	75%	0.745	S	S	*	*				60.9	110.8	89.1	59.2	0	0	0	0	115.2
668	T	29.9	Very low	32.4	Very low	118 Å²	118	139.3 Å²	139.3	72%	0.724	75%	0.749	S	S	*	*				53.3	132.7	82.3	66.2	0	0	0	0	116
669	T	33.6	Very low	32.4	Very low	148 Å²	148	139.6 Å²	139.6	91%	0.908	76%	0.756	S	S	*	*				-176.4	-179.3	121.4	29.5	0	0	0	0	111.4
670	N	30.7	Very low	32.3	Very low	141 Å²	141	142.3 Å²	142.3	75%	0.754	75%	0.754	S	S	*	*			trans	-132.5	157.7	-155.2	-136.5	-50.4	0	0	0	110.6
671	K	34.7	Very low	32.2	Very low	175 Å²	175	143.6 Å²	143.6	76%	0.761	76%	0.758	S	S	*	*			trans	75.7	141.3	155.7	-63	167.2	-178.3	173.3	0	121.4
672	T	32	Very low	32.3	Very low	119 Å²	119	141.1 Å²	141.1	73%	0.73	75%	0.754	S	S	*	*			trans	76.7	120.3	140.3	42.6	0	0	0	0	123.1
673	L	30.1	Very low	32.1	Very low	142 Å²	142	144.5 Å²	144.5	74%	0.743	77%	0.766	S	S	*	*			trans	83.1	131.6	133.8	-72.2	168.3	0	0	0	121.2
674	K	34.7	Very low	32.2	Very low	181 Å²	181	143.6 Å²	143.6	79%	0.787	77%	0.771	S	S	*	*			trans	69.4	105.2	149.3	-67.1	170.3	-178.8	177.7	0	119.4
675	R	27.8	Very low	32.4	Very low	211 Å²	211	144.2 Å²	144.2	80%	0.796	78%	0.775	S	S	*	*				64.9	132.3	121.3	-121.6	177.4	-169.1	-175.2	3.8	118.6
676	F	30.6	Very low	33.1	Very low	178 Å²	178	144.8 Å²	144.8	78%	0.781	78%	0.781	S	S	*	*			trans	71.2	152.1	171.6	-50.4	-68	0	0	0	115.2
677	V	29.9	Very low	33.5	Very low	116 Å²	116	143.5 Å²	143.5	70%	0.703	78%	0.781	S	S	*	*			cis	-161.9	138.2	-37.5	108.7	0	0	0	0	108.9
678	L	28.5	Very low	33.7	Very low	151 Å²	151	144.3 Å²	144.3	79%	0.791	79%	0.786	S	S	*	*			trans	55.2	158.7	159.1	-63.5	173.8	0	0	0	123.5
679	T	33.1	Very low	34	Very low	145 Å²	145	145.4 Å²	145.4	89%	0.89	79%	0.793	S	S	*	*			trans	91.3	154.4	162.4	73	0	0	0	0	119.2
680	R	32.4	Very low	34	Very low	216 Å²	216	144 Å²	144	82%	0.815	78%	0.784	S	S	*	*			trans	-126.6	154.9	-163.8	-67.4	173.7	162.5	-168.9	-3.2	111
681	S	34.5	Very low	34.6	Very low	116 Å²	116	143.1 Å²	143.1	81%	0.811	79%	0.786	S	S	*	*				169.7	147.1	115.1	-72.9	0	0	0	0	113.3
682	P	37.5	Very low	34.6	Very low	117 Å²	117	141.3 Å²	141.3	76%	0.76	79%	0.79	S	S	*	*			trans	-119.8	166.8	175.9	41.6	-31.9	0	0	0	114.5
683	L	34.7	Very low	34.7	Very low	174 Å²	174	140.7 Å²	140.7	91%	0.911	79%	0.79	S	S	*	*			trans	-171.5	162.9	142.9	-134.1	70.3	0	0	0	115.8
684	S	34.5	Very low	35.1	Very low	118 Å²	118	140.2 Å²	140.2	83%	0.825	79%	0.793	S	S	*	*			trans	94.8	135.5	150.9	-150.9	0	0	0	0	121.2
685	S	36.8	Very low	35.2	Very low	110 Å²	110	137.1 Å²	137.1	77%	0.769	79%	0.794	S	S	*	*			trans	-161.1	149.5	174.1	57.5	0	0	0	0	111
686	P	45	Very low	36.1	Very low	119 Å²	119	133.1 Å²	133.1	77%	0.773	80%	0.796	S	S	*	*			trans	-142.9	-163.4	162.5	46	-28.7	0	0	0	112.9
687	P	41.6	Very low	36.4	Very low	114 Å²	114	129 Å²	129	74%	0.74	80%	0.795	S	S	*	*				-142.7	167.4	-97	41.6	-20.1	0	0	0	120.1
688	V	36.2	Very low	37.2	Very low	121 Å²	121	128.3 Å²	128.3	73%	0.733	79%	0.793	S	S	*	*			trans	11	141.6	143.1	-172.8	0	0	0	0	123.2
689	T	34.3	Very low	37.5	Very low	141 Å²	141	130.2 Å²	130.2	87%	0.865	79%	0.79	S	S	*	*			trans	-147	147.8	146.7	44.2	0	0	0	0	113.7
690	T	34.3	Very low	37.8	Very low	119 Å²	119	129.5 Å²	129.5	73%	0.73	78%	0.777	S	S	*	*			trans	-152.3	172.7	-179.8	53.8	0	0	0	0	113.7
691	P	43.1	Very low	38	Very low	123 Å²	123	126.4 Å²	126.4	80%	0.799	77%	0.772	S	S	*	*			trans	-114	-169.5	163.8	30.8	-13.3	0	0	0	114
692	T	34.4	Very low	38.1	Very low	136 Å²	136	126.2 Å²	126.2	83%	0.834	76%	0.762	S	S	*	*			trans	-160.6	174.3	-169.5	-73.7	0	0	0	0	113.6
693	S	34.9	Very low	38.2	Very low	106 Å²	106	127.1 Å²	127.1	74%	0.741	76%	0.755	S	S	*	*			trans	96.9	160.3	175.1	79.6	0	0	0	0	116.2
694	V	37.8	Very low	38.4	Very low	133 Å²	133	126 Å²	126	81%	0.806	75%	0.745	S	S	*	*			cis	-121.9	-142.7	11.4	-154.9	0	0	0	0	112.6
695	S	37.3	Very low	38.5	Very low	115 Å²	115	126.5 Å²	126.5	80%	0.804	74%	0.737	S	S	*	*			trans	-149.9	-107.3	-165.2	-65.9	0	0	0	0	120.3
696	P	46.1	Very low	38.4	Very low	128 Å²	128	127.2 Å²	127.2	83%	0.831	73%	0.732	S	S	*	*				-136.7	-175.2	-118.4	39.9	-20.7	0	0	0	120.4
697	A	37.9	Very low	37.7	Very low	92 Å²	92	129 Å²	129	76%	0.76	73%	0.73	S	S	*	*			trans	-147.5	162.5	170.2	0	0	0	0	0	111.3
698	P	45.6	Very low	37.5	Very low	101 Å²	101	133.4 Å²	133.4	66%	0.656	73%	0.732	S	S	*	*				-160.7	-149.9	110.9	43.6	-22.2	0	0	0	115.8
699	Y	35.5	Very low	37.7	Very low	190 Å²	190	133.7 Å²	133.7	75%	0.745	73%	0.734	S	S	*	*			trans	94.6	146.3	165.8	-59	-55.3	0	0	0	119
700	H	38.6	Very low	37.9	Very low	130 Å²	130	132.5 Å²	132.5	60%	0.602	73%	0.729	S	S	*	*			cis	-161.4	142	-3.4	-121.8	-51.7	0	0	0	112.6
701	Q	37.7	Very low	38.4	Very low	151 Å²	151	132.2 Å²	132.2	71%	0.706	73%	0.729	S	S	*	*			trans	48.9	160.3	144.4	-73.1	172.3	-17.2	0	0	121.7
702	N	36.7	Very low	38.1	Very low	113 Å²	113	131.2 Å²	131.2	60%	0.604	73%	0.725	S	S	*	*			cis	-171.9	-179.3	-7.7	-101.9	-9.6	0	0	0	107.6
703	H	39	Very low	38.2	Very low	135 Å²	135	130.2 Å²	130.2	63%	0.625	72%	0.724	S	S	*	*			cis	-167.7	147	-9.7	-109.3	-42.2	0	0	0	109.6
704	H	38.4	Very low	38.2	Very low	151 Å²	151	131.1 Å²	131.1	70%	0.699	73%	0.725	S	S	*	*			trans	55.6	158.2	145.7	-66	-46.5	0	0	0	122.3
705	I	37.9	Very low	38.2	Very low	128 Å²	128	132.5 Å²	132.5	66%	0.656	72%	0.724	S	S	*	*			cis	-161.3	149.7	-9.3	-113.6	165	0	0	0	110.7
706	N	33.1	Very low	38	Very low	125 Å²	125	133.3 Å²	133.3	67%	0.668	72%	0.72	S	S	*	*			trans	32.4	160.4	153.1	-53.9	24.7	0	0	0	122
707	E	31.1	Very low	37.3	Very low	156 Å²	156	133.3 Å²	133.3	73%	0.729	71%	0.713	S	S	*	*			cis	-166.7	168.5	0	-131.1	170.6	-119.3	0	0	113.8
708	R	36.7	Very low	37.1	Very low	208 Å²	208	134 Å²	134	79%	0.785	71%	0.707	S	S	*	*			trans	78.6	93	138.7	-160.8	163.3	-161.9	-98.9	2.3	124.2
709	T	40.4	Very low	36.4	Very low	126 Å²	126	135.9 Å²	135.9	77%	0.773	71%	0.712	S	S	*	*			trans	73.6	152	140.6	45.7	0	0	0	0	123.8
710	P	40.3	Very low	36.1	Very low	117 Å²	117	131.4 Å²	131.4	76%	0.76	71%	0.709	S	S	*	*			trans	-112.6	-174	-173.5	48.1	-37.7	0	0	0	113.5
711	P	43.2	Very low	35.6	Very low	113 Å²	113	129.9 Å²	129.9	73%	0.734	71%	0.712	S	S	*	*				-156	177.7	78	43	-22.6	0	0	0	118.9
712	S	38	Very low	35.3	Very low	101 Å²	101	129.9 Å²	129.9	71%	0.706	72%	0.716	S	S	*	*			trans	89.2	122.1	144	73.9	0	0	0	0	123.8
713	S	36.3	Very low	34.9	Very low	116 Å²	116	129.9 Å²	129.9	81%	0.811	72%	0.72	S	S	*	*			trans	65	150.1	158.8	73.9	0	0	0	0	117.6
714	V	34.9	Very low	34.5	Very low	125 Å²	125	133.1 Å²	133.1	76%	0.758	73%	0.732	S	S	*	*			cis	-129.5	176.8	12.5	174	0	0	0	0	110.2
715	M	36.9	Very low	34.1	Very low	162 Å²	162	131 Å²	131	80%	0.798	74%	0.735	S	S	*	*			trans	-31.4	153.5	168.6	-69.1	160.9	169.7	0	0	116.1
716	D	33.4	Very low	34	Very low	132 Å²	132	133.1 Å²	133.1	71%	0.706	74%	0.741	S	S	*	*			cis	-144.7	164.1	33.4	-128.4	-41.6	0	0	0	117.1
717	N	32.6	Very low	34	Very low	128 Å²	128	134.1 Å²	134.1	68%	0.684	74%	0.74	S	S	*	*			trans	-27.2	117.7	-174	-71.6	-60.9	0	0	0	121.8
718	T	33.3	Very low	34.2	Very low	106 Å²	106	132.5 Å²	132.5	65%	0.65	74%	0.736	S	S	*	*			trans	47.8	105.1	130.5	59.8	0	0	0	0	119.6
719	N	30.8	Very low	34	Very low	140 Å²	140	131.7 Å²	131.7	75%	0.749	73%	0.733	S	S	*	*				73.8	111.7	89.1	-64.4	-8.7	0	0	0	113.8
720	S	29	Very low	33.7	Very low	97 Å²	97	132.2 Å²	132.2	68%	0.678	73%	0.73	S	S	*	*				63.5	135.5	58.9	85.2	0	0	0	0	113.5
721	S	28.4	Very low	33.1	Very low	97 Å²	97	131.5 Å²	131.5	68%	0.678	73%	0.727	S	S	*	*			cis	176.1	154.2	-7.6	47.2	0	0	0	0	107.6
722	I	30.4	Very low	32.7	Very low	151 Å²	151	133.9 Å²	133.9	77%	0.774	73%	0.733	S	S	*	*			trans	174	122.6	133.3	-93.3	156.9	0	0	0	112.9
723	T	29.6	Very low	32.2	Very low	113 Å²	113	136 Å²	136	69%	0.693	74%	0.736	S	S	*	*			trans	54.4	118.9	158.5	57.7	0	0	0	0	123.6
724	K	29.9	Very low	32	Very low	204 Å²	204	137.1 Å²	137.1	89%	0.887	73%	0.733	S	S	*	*			trans	74.1	85.5	131.8	-65.1	177.7	179	-179.6	0	119.5
725	S	28.9	Very low	31.9	Very low	107 Å²	107	138.2 Å²	138.2	75%	0.748	73%	0.734	S	S	*	*			trans	-143.3	152.1	136.1	65.2	0	0	0	0	110.7
726	H	37.3	Very low	31.9	Very low	172 Å²	172	134.7 Å²	134.7	80%	0.796	72%	0.723	S	S	*	*			trans	-128.4	122.4	163.2	-94.3	-120.1	0	0	0	105.1
727	F	32.7	Very low	31.7	Very low	146 Å²	146	138.2 Å²	138.2	64%	0.64	73%	0.728	S	S	*	*				68.4	133.1	75.8	-71.4	-45	0	0	0	111.7
728	N	34.9	Very low	31.5	Very low	122 Å²	122	138.6 Å²	138.6	65%	0.652	73%	0.731	S	S	*	*			cis	-151.4	170.9	12.2	-87.9	-33.6	0	0	0	108.3
729	R	32.5	Very low	31.2	Very low	190 Å²	190	140.9 Å²	140.9	72%	0.717	74%	0.738	S	S	*	*			cis	-172.6	172.9	-20.4	-102.3	178.9	-158.3	-136	0.8	105.6
730	I	34.3	Very low	31.2	Very low	138 Å²	138	138.4 Å²	138.4	71%	0.708	73%	0.731	S	S	*	*			cis	-147	170.9	3.8	-146.5	166.5	0	0	0	109.3
731	S	28.6	Very low	31.2	Very low	101 Å²	101	141.6 Å²	141.6	71%	0.706	74%	0.735	S	S	*	*			trans	-156.8	136.1	168.5	53	0	0	0	0	112.7
732	L	33.2	Very low	31.3	Very low	163 Å²	163	145.1 Å²	145.1	85%	0.853	74%	0.741	S	S	*	*			trans	-154.1	121.7	169.9	-65.9	176.5	0	0	0	106.2
733	L	28.8	Very low	31.1	Very low	146 Å²	146	143 Å²	143	76%	0.764	73%	0.731	S	S	*	*			cis	98.2	133.1	18.4	-148.5	85.8	0	0	0	114.7
734	N	32	Very low	31.1	Very low	139 Å²	139	148 Å²	148	74%	0.743	74%	0.739	S	S	*	*			trans	78.7	119.8	175	-54.4	-27.5	0	0	0	116.9
735	N	31.4	Very low	31.1	Very low	148 Å²	148	141.4 Å²	141.4	79%	0.791	73%	0.728	S	S	*	*			cis	85.5	144.3	29.8	-152.3	52.3	0	0	0	113
736	P	38	Very low	31.1	Very low	88 Å²	88	145.4 Å²	145.4	57%	0.571	74%	0.735	S	S	*	*				-141.9	178.5	-56.3	42.9	-27.5	0	0	0	116.6
737	Y	29.7	Very low	30.9	Very low	206 Å²	206	145.3 Å²	145.3	81%	0.808	74%	0.739	S	S	*	*			trans	55.8	131.1	152.1	-78.3	-63.4	0	0	0	124.1
738	N	27.8	Very low	30.7	Very low	137 Å²	137	145.3 Å²	145.3	73%	0.733	75%	0.746	S	S	*	*			trans	65.2	139.4	154.5	-58.8	-26.3	0	0	0	116.8
739	L	27.7	Very low	30.7	Very low	154 Å²	154	144.2 Å²	144.2	81%	0.806	75%	0.745	S	S	*	*			cis	-153.4	177.7	42.4	-129.1	120	0	0	0	113.7
740	S	29.2	Very low	30.4	Very low	87 Å²	87	139.4 Å²	139.4	61%	0.608	74%	0.741	S	S	*	*			trans	58.3	105.2	152.7	59.5	0	0	0	0	120.9
741	H	30.2	Very low	30.1	Very low	165 Å²	165	142 Å²	142	76%	0.764	75%	0.747	S	S	*	*				73.1	126.4	120.9	-74	-54.2	0	0	0	123.1
742	Q	29.6	Very low	30	Very low	171 Å²	171	141.9 Å²	141.9	80%	0.799	75%	0.746	S	S	*	*			trans	73.3	156.5	137.1	-69.5	-174.3	26.3	0	0	118.8
743	N	27.2	Very low	30	Very low	106 Å²	106	139.8 Å²	139.8	57%	0.567	75%	0.746	S	S	*	*			cis	-166.9	149.4	-35.9	-163	6.3	0	0	0	106.7
744	Y	29.4	Very low	30.2	Very low	219 Å²	219	137.8 Å²	137.8	86%	0.859	74%	0.744	S	S	*	*			trans	60.1	159.9	-172.8	-47.2	-84.7	0	0	0	113.1
745	G	30.3	Very low	30.3	Very low	64 Å²	64	137 Å²	137	66%	0.66	74%	0.744	S	S	*	*			cis	-179.8	137	-11.2	0	0	0	0	0	111.5
746	Q	28.7	Very low	30.4	Very low	191 Å²	191	134.9 Å²	134.9	89%	0.893	74%	0.741	S	S	*	*			trans	27.4	105.2	132.8	-175.2	-177.8	6.6	0	0	117.3
747	I	33.3	Very low	30.2	Very low	170 Å²	170	138.8 Å²	138.8	87%	0.872	75%	0.751	S	S	*	*			trans	-153.6	144	130.5	-100.9	147.8	0	0	0	107.9
748	D	27.8	Very low	30.2	Very low	146 Å²	146	135.1 Å²	135.1	78%	0.781	75%	0.745	S	S	*	*			trans	-100.7	-163.7	-167.9	-141.5	-12	0	0	0	110.2
749	P	35.9	Very low	30.3	Very low	99 Å²	99	134 Å²	134	64%	0.643	74%	0.739	S	S	*	*				-116.4	-156.7	-127	41.3	-25.4	0	0	0	113.6
750	S	26.4	Very low	30.5	Very low	89 Å²	89	134.1 Å²	134.1	62%	0.622	73%	0.733	S	S	*	*			trans	95.9	147.2	153.9	77	0	0	0	0	120.5
751	F	27.5	Very low	30.6	Very low	192 Å²	192	135 Å²	135	84%	0.842	73%	0.73	S	S	*	*			trans	65.3	152	168.7	-54.2	-72.4	0	0	0	119.5
752	S	27	Very low	30.4	Very low	99 Å²	99	132 Å²	132	69%	0.692	73%	0.728	S	S	*	*			cis	-169.1	144.8	-35.6	52.1	0	0	0	0	110.7
753	S	32.3	Very low	30.3	Very low	120 Å²	120	128 Å²	128	84%	0.839	72%	0.719	S	S	*	*			trans	166.2	146.5	158.9	33.2	0	0	0	0	108.8
754	S	33.2	Very low	30.3	Very low	103 Å²	103	126.9 Å²	126.9	72%	0.72	72%	0.719	S	S	*	*			cis	-137	143.1	0.1	-48.9	0	0	0	0	111.4
755	T	34.5	Very low	30.1	Very low	124 Å²	124	122.9 Å²	122.9	76%	0.761	71%	0.711	S	S	*	*			trans	2.9	118.1	141.5	53.7	0	0	0	0	117.4
756	S	32.3	Very low	29.9	Very low	102 Å²	102	125.7 Å²	125.7	71%	0.713	72%	0.715	S	S	*	*				90.7	154.4	54	72.1	0	0	0	0	114.3
757	E	34.3	Very low	29.8	Very low	171 Å²	171	126.1 Å²	126.1	80%	0.799	72%	0.715	S	S	*	*			trans	78.6	140.7	-178.3	-52.7	-161.2	160.3	0	0	116.5
758	L	29.7	Very low	29.4	Very low	129 Å²	129	122.4 Å²	122.4	68%	0.675	70%	0.704	S	S	*	*			cis	-158.3	153.8	-16.2	-114.9	172.2	0	0	0	110.7
759	D	31	Very low	29.4	Very low	112 Å²	112	120 Å²	120	60%	0.599	70%	0.698	S	S	*	*			trans	66.9	126	146.1	-93.7	3	0	0	0	125.7
760	K	31.5	Very low	28.9	Very low	158 Å²	158	121.3 Å²	121.3	69%	0.687	70%	0.7	S	S	*	*			trans	100.5	116.4	132	-73.3	171.1	178.7	106.4	0	122.5
761	I	29.8	Very low	29.1	Very low	106 Å²	106	122.8 Å²	122.8	54%	0.544	71%	0.707	S	S	.	*				55.3	101	128.9	-52.8	165.9	0	0	0	116.1
762	S	26.8	Very low	29.3	Very low	102 Å²	102	117.4 Å²	117.4	71%	0.713	69%	0.694	S	S	*	*				86	130.5	58.2	-169.8	0	0	0	0	116
763	S	27.8	Very low	29.3	Very low	87 Å²	87	118.9 Å²	118.9	61%	0.608	69%	0.693	S	S	*	*			trans	84.5	145.7	160.8	81.5	0	0	0	0	121.2
764	S	27.4	Very low	29.2	Very low	81 Å²	81	122.8 Å²	122.8	57%	0.566	69%	0.691	S	S	*	*			trans	86.3	80	151.9	-48.5	0	0	0	0	119.8
765	I	25.8	Very low	28.9	Very low	136 Å²	136	122.7 Å²	122.7	70%	0.697	68%	0.682	S	S	*	*			trans	-123.5	112.7	132.5	-65.5	-176.5	0	0	0	107.9	F767	I765-F767 HydrophobicContact CG2-CD2 3.8Å; I765-F767 HydrophobicContact CG2-CE2 3.7Å
766	T	25.9	Very low	28.6	Very low	122 Å²	122	122.8 Å²	122.8	75%	0.748	68%	0.676	S	S	*	*			trans	-109.8	100.6	-178.4	-35.5	0	0	0	0	109.1	S768	T766-S768 VanDerWaalsContact C-N 3.35Å; T766-S768 PolarHBondContact O-N 2.95Å; T766-S768 VanDerWaalsContact O-N 3.14Å
767	F	26.4	Very low	28.3	Very low	201 Å²	201	125.8 Å²	125.8	88%	0.882	68%	0.677	S	S	*	*			trans	-83.6	86.1	166.2	-84.3	-72.8	0	0	0	110	I765	I765-F767 HydrophobicContact CG2-CD2 3.8Å; I765-F767 HydrophobicContact CG2-CE2 3.7Å
768	S	24.8	Very low	28.1	Very low	92 Å²	92	122.4 Å²	122.4	64%	0.643	67%	0.667	S	S	*	*			trans	-78.4	155.3	166.1	-174.3	0	0	0	0	110.4	T766	T766-S768 VanDerWaalsContact C-N 3.35Å; T766-S768 PolarHBondContact O-N 2.95Å; T766-S768 VanDerWaalsContact O-N 3.14Å
769	S	26.2	Very low	27.9	Very low	96 Å²	96	120.3 Å²	120.3	67%	0.671	66%	0.664	S	S	*	*			trans	63.2	136.8	174.1	68.9	0	0	0	0	116.5
770	N	26.3	Very low	27.8	Very low	126 Å²	126	123.5 Å²	123.5	67%	0.674	67%	0.673	S	S	*	*			cis	-153.2	125.9	-6.7	-97.2	-16.8	0	0	0	109.3	S772	N770-S772 VanDerWaalsContact C-N 3.35Å; N770-S772 PolarHBondContact ND2-OG 3.48Å; N770-S772 PolarHBondContact O-N 3.38Å
771	P	31.2	Very low	27.6	Very low	119 Å²	119	122 Å²	122	77%	0.773	68%	0.677	S	S	*	*			trans	-78.6	92.5	138.6	31.8	-24.3	0	0	0	106.7	D773	P771-D773 VanDerWaalsContact C-N 3.27Å; P771-D773 PolarHBondContact O-N 3.1Å
772	S	30.9	Very low	27.7	Very low	80 Å²	80	126 Å²	126	56%	0.559	69%	0.691	S	S	*	*			trans	-71.6	89.5	173.3	-72.6	0	0	0	0	109	N770 Y774	N770-S772 VanDerWaalsContact C-N 3.35Å; N770-S772 PolarHBondContact ND2-OG 3.48Å; N770-S772 PolarHBondContact O-N 3.38Å; S772-Y774 VanDerWaalsContact C-N 3.29Å; S772-Y774 PolarHBondContact O-N 3.37Å
773	D	27.6	Very low	27.8	Very low	129 Å²	129	129.9 Å²	129.9	69%	0.69	70%	0.697	S	S	*	*			trans	-54.1	88.8	173	-92.3	-31.4	0	0	0	110.5	P771 I775	P771-D773 VanDerWaalsContact C-N 3.27Å; P771-D773 PolarHBondContact O-N 3.1Å; D773-I775 HydrophobicContact CB-CD1 3.96Å; D773-I775 HydrophobicContact CB-CG1 3.99Å; D773-I775 PolarHBondContact O-N 2.83Å
774	Y	29.2	Very low	28.1	Very low	202 Å²	202	131.8 Å²	131.8	79%	0.792	71%	0.708	S	S	*	*			trans	-74.9	55.7	164.2	-107.1	-81.2	0	0	0	110.1	S772 I776	S772-Y774 VanDerWaalsContact C-N 3.29Å; S772-Y774 PolarHBondContact O-N 3.37Å; Y774-I776 HydrophobicContact CD1-CD1 4.15Å; Y774-I776 HydrophobicContact CD1-CG1 3.9Å; Y774-I776 PolarHBondContact O-N 3.1Å
775	I	27.4	Very low	28.3	Very low	102 Å²	102	136.9 Å²	136.9	52%	0.523	72%	0.722	S	S	.	*			trans	-65.8	86.6	161.7	-65	172	0	0	0	105.9	D773 K777	D773-I775 HydrophobicContact CB-CD1 3.96Å; D773-I775 HydrophobicContact CB-CG1 3.99Å; D773-I775 PolarHBondContact O-N 2.83Å; I775-K777 HydrophobicContact CG2-CB 4.06Å; I775-K777 HydrophobicContact CG2-CD 3.67Å; I775-K777 HydrophobicContact CG2-CG 3.56Å; I775-K777 PolarHBondContact O-N 3.15Å
776	I	28.3	Very low	28.5	Very low	126 Å²	126	136.1 Å²	136.1	65%	0.646	73%	0.727	S	S	*	*			trans	-72.3	68	166.5	-56.7	-176.2	0	0	0	107.6	Y774 T778	Y774-I776 HydrophobicContact CD1-CD1 4.15Å; Y774-I776 HydrophobicContact CD1-CG1 3.9Å; Y774-I776 PolarHBondContact O-N 3.1Å; I776-T778 HydrophobicContact CG2-CG2 3.81Å; I776-T778 PolarHBondContact O-N 3.04Å
777	K	26.9	Very low	28.6	Very low	165 Å²	165	139.1 Å²	139.1	72%	0.717	73%	0.732	S	S	*	*			trans	-72.6	85.3	157.5	-87.7	172.2	-177.5	173.4	0	106.8	I775 S779	I775-K777 HydrophobicContact CG2-CB 4.06Å; I775-K777 HydrophobicContact CG2-CD 3.67Å; I775-K777 HydrophobicContact CG2-CG 3.56Å; I775-K777 PolarHBondContact O-N 3.15Å; K777-S779 PolarHBondContact O-N 2.68Å
778	T	28.2	Very low	28.9	Very low	99 Å²	99	139.2 Å²	139.2	61%	0.607	74%	0.735	S	S	*	*			trans	-70.9	55.3	161.6	37.2	0	0	0	0	110.6	I776 F780	I776-T778 HydrophobicContact CG2-CG2 3.81Å; I776-T778 PolarHBondContact O-N 3.04Å; T778-F780 HydrophobicContact CG2-CD2 4.24Å; T778-F780 HydrophobicContact CG2-CE2 3.99Å; T778-F780 PolarHBondContact O-N 2.84Å
779	S	26.8	Very low	29	Very low	86 Å²	86	140 Å²	140	60%	0.601	74%	0.74	S	S	*	*			trans	-72.8	72.5	164.8	53.6	0	0	0	0	108.9	K777 T781	K777-S779 PolarHBondContact O-N 2.68Å; S779-T781 PolarHBondContact O-N 3.47Å
780	F	28.9	Very low	29.2	Very low	179 Å²	179	146.3 Å²	146.3	79%	0.785	75%	0.75	S	S	*	*			trans	-73	66.2	172.8	-88.5	-70.3	0	0	0	110.8	T778 K782	T778-F780 HydrophobicContact CG2-CD2 4.24Å; T778-F780 HydrophobicContact CG2-CE2 3.99Å; T778-F780 PolarHBondContact O-N 2.84Å; F780-K782 PolarHBondContact O-N 3.21Å
781	T	27.6	Very low	29.4	Very low	127 Å²	127	148.2 Å²	148.2	78%	0.779	76%	0.755	S	S	*	*			trans	-71.6	76.3	163.9	49.9	0	0	0	0	109.2	S779 Q783	S779-T781 PolarHBondContact O-N 3.47Å; T781-Q783 PolarHBondContact O-N 2.8Å
782	K	30.2	Very low	29.5	Very low	190 Å²	190	149.5 Å²	149.5	83%	0.826	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-66.4	123.4	167	-91	-166.1	170.5	-170.8	0	109.1	F780	F780-K782 PolarHBondContact O-N 3.21Å
783	Q	29.5	Very low	29.5	Very low	183 Å²	183	153.5 Å²	153.5	86%	0.855	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-65.5	146.4	166.4	-64.5	176.7	-67.9	0	0	109.8	T781	T781-Q783 PolarHBondContact O-N 2.8Å
784	P	33.6	Very low	29.7	Very low	127 Å²	127	156.5 Å²	156.5	83%	0.825	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-80	123.1	167.8	31.4	-31.1	0	0	0	110.4
785	E	32.5	Very low	29.8	Very low	187 Å²	187	155.5 Å²	155.5	87%	0.874	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-74.9	154.2	164.5	-87.9	-167.2	119.6	0	0	111.5
786	P	30.5	Very low	29.9	Very low	121 Å²	121	157 Å²	157	79%	0.786	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-79.5	159.6	-171.1	32.2	-36.4	0	0	0	114.5
787	Q	27.6	Very low	30.1	Very low	184 Å²	184	156.3 Å²	156.3	86%	0.86	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-71.7	151.1	-178.5	-59	173.4	-8.8	0	0	113.6
788	Q	33.2	Very low	30.2	Very low	203 Å²	203	153 Å²	153	95%	0.949	79%	0.787	S	S	*	*			trans	-129.8	159.4	145.6	-72.1	-160.2	4.4	0	0	110.6
789	S	26.8	Very low	30.2	Very low	108 Å²	108	155.9 Å²	155.9	76%	0.755	80%	0.798	S	S	*	*			trans	-139.8	145.7	-151.4	57.9	0	0	0	0	115.8
790	R	30.4	Very low	30.5	Very low	229 Å²	229	159.3 Å²	159.3	86%	0.864	81%	0.808	S	S	*	*			trans	-172.4	117.2	151.3	-106.3	165	170	175.2	-3.6	107.3
791	Q	30.5	Very low	30.4	Very low	167 Å²	167	158.3 Å²	158.3	78%	0.78	81%	0.811	S	S	*	*				52.8	115.3	77.4	-60.5	-172.4	-0.4	0	0	111.1
792	E	33	Very low	30.6	Very low	146 Å²	146	159.5 Å²	159.5	68%	0.682	81%	0.807	S	S	*	*				-154.4	142.6	60.1	-72.5	-159.5	109.4	0	0	116.7
793	K	30	Very low	30.5	Very low	164 Å²	164	156.9 Å²	156.9	71%	0.713	80%	0.798	S	S	*	*				37.9	117.9	125.3	-49.7	171.2	-174.2	154.9	0	121.8
794	K	32.8	Very low	30.6	Very low	192 Å²	192	156.1 Å²	156.1	84%	0.835	79%	0.794	S	S	*	*				-178.1	127.9	95.6	-98.7	174.4	-179.2	176.9	0	115.1
795	Q	31.7	Very low	30.5	Very low	181 Å²	181	155.6 Å²	155.6	85%	0.846	79%	0.794	S	S	*	*			trans	28.8	130.3	148	-68.4	179	-30.8	0	0	123.1
796	P	29.5	Very low	30.4	Very low	133 Å²	133	155.4 Å²	155.4	86%	0.864	79%	0.793	S	S	*	*			trans	-108.9	154.1	148.6	37.9	-29.2	0	0	0	113.2
797	S	32.1	Very low	30.6	Very low	111 Å²	111	159.2 Å²	159.2	78%	0.776	80%	0.8	S	S	*	*			trans	-164.9	140.9	169.8	55.2	0	0	0	0	109.3
798	S	29.6	Very low	30.5	Very low	96 Å²	96	161 Å²	161	67%	0.671	80%	0.799	S	S	*	*			cis	158.6	137.1	-17.4	46.7	0	0	0	0	105.9
799	L	28	Very low	30.4	Very low	159 Å²	159	159 Å²	159	83%	0.832	79%	0.793	S	S	*	*			trans	58	118.4	155.7	-90.4	79.5	0	0	0	120.1
800	I	32.5	Very low	30.4	Very low	158 Å²	158	159.2 Å²	159.2	81%	0.81	79%	0.79	S	S	*	*				178.7	140.3	104.6	-94.2	150	0	0	0	111.2
801	N	26	Very low	30.5	Very low	159 Å²	159	155.8 Å²	155.8	85%	0.85	79%	0.788	S	S	*	*			trans	-124.4	105.4	174.6	-96.8	-19.1	0	0	0	110.9
802	H	32.6	Very low	30.4	Very low	152 Å²	152	153.6 Å²	153.6	70%	0.704	78%	0.782	S	S	*	*			trans	-160.8	120.2	146.4	-114.4	55.7	0	0	0	107.9
803	Q	29.2	Very low	30.4	Very low	135 Å²	135	152.4 Å²	152.4	63%	0.631	78%	0.78	S	S	*	*				86.7	136.8	56.1	-161.6	-153.8	95.7	0	0	111.7
804	Q	29.8	Very low	30.3	Very low	166 Å²	166	150.5 Å²	150.5	78%	0.776	78%	0.778	S	S	*	*			trans	75	145.5	179	-43.2	-175	18	0	0	113.9
805	S	32.7	Very low	30.4	Very low	116 Å²	116	149 Å²	149	81%	0.811	78%	0.779	S	S	*	*			cis	-139.8	173.1	2.9	56.2	0	0	0	0	111.9
806	Q	30.4	Very low	30.3	Very low	183 Å²	183	146.9 Å²	146.9	86%	0.855	77%	0.773	S	S	*	*			trans	-80.8	149.2	-176.2	-55.2	173.3	12.5	0	0	112.7
807	Q	34.2	Very low	30.3	Very low	201 Å²	201	147.3 Å²	147.3	94%	0.939	77%	0.768	S	S	*	*			trans	-150.7	137.5	145.6	-117	169.4	52.8	0	0	111.9
808	R	24.9	Very low	30.4	Very low	223 Å²	223	149.2 Å²	149.2	84%	0.842	77%	0.77	S	S	*	*			trans	-83.1	146.5	175.8	-65.8	177.2	175	-177.2	-2.5	110.7
809	I	32.3	Very low	30.3	Very low	161 Å²	161	151.2 Å²	151.2	83%	0.826	77%	0.772	S	S	*	*			trans	-131.5	142.3	134.4	-61.3	-175.6	0	0	0	107.6
810	T	26.4	Very low	30.2	Very low	111 Å²	111	148.4 Å²	148.4	68%	0.681	77%	0.766	S	S	*	*			trans	-141.3	121.4	177.5	-51.3	0	0	0	0	110.1
811	L	32.9	Very low	30.1	Very low	158 Å²	158	146 Å²	146	83%	0.827	76%	0.763	S	S	*	*			trans	-136.3	111	169.1	-69.5	167	0	0	0	104.7
812	N	28.1	Very low	30.3	Very low	121 Å²	121	145 Å²	145	65%	0.647	76%	0.757	S	S	*	*			cis	80.2	144.2	30.1	-159.9	32	0	0	0	115
813	N	32.6	Very low	30.3	Very low	121 Å²	121	144.4 Å²	144.4	65%	0.647	75%	0.754	S	S	*	*			trans	71.5	119	-170.5	-63	-35.3	0	0	0	114.8
814	N	28.7	Very low	30.5	Very low	123 Å²	123	144.2 Å²	144.2	66%	0.658	75%	0.754	S	S	*	*				70.8	115.3	53.8	-62	-43.8	0	0	0	112.4
815	N	34.6	Very low	30.6	Very low	161 Å²	161	143.6 Å²	143.6	86%	0.861	75%	0.75	S	S	*	*				-169.8	161.9	107.1	-94.9	-34.7	0	0	0	112.7
816	N	28.6	Very low	30.6	Very low	137 Å²	137	142.2 Å²	142.2	73%	0.733	74%	0.741	S	S	*	*			trans	-98	168.1	-176.5	-59.2	-55.7	0	0	0	112.6
817	N	29.9	Very low	30.6	Very low	141 Å²	141	139.6 Å²	139.6	75%	0.754	73%	0.733	S	S	*	*			trans	77.2	155.2	153.2	-56.6	-27.6	0	0	0	119.2
818	N	33.7	Very low	30.5	Very low	152 Å²	152	139.6 Å²	139.6	81%	0.813	73%	0.725	S	S	*	*			trans	76.3	154.7	161.8	-59.2	-22.1	0	0	0	118.8
819	L	28.8	Very low	30.9	Very low	138 Å²	138	133.6 Å²	133.6	72%	0.723	71%	0.714	S	S	*	*			cis	-171.3	114.3	-32.3	177.1	62.7	0	0	0	109
820	S	25.8	Very low	30.9	Very low	99 Å²	99	132 Å²	132	69%	0.692	71%	0.707	S	S	*	*			trans	59.7	169.4	159.1	-59.8	0	0	0	0	119.3
821	S	29.8	Very low	31.2	Very low	109 Å²	109	133.3 Å²	133.3	76%	0.762	71%	0.71	S	S	*	*			trans	68.8	144.8	164.7	75.3	0	0	0	0	116.8
822	L	30.2	Very low	31.1	Very low	136 Å²	136	130.5 Å²	130.5	71%	0.712	70%	0.703	S	S	*	*			cis	-154.3	150.6	-4.4	-146.6	62.9	0	0	0	109.8
823	Q	32.7	Very low	31.4	Very low	140 Å²	140	132.5 Å²	132.5	65%	0.654	71%	0.708	S	S	*	*			trans	28	154.3	143.8	-66.6	169.7	-27.5	0	0	122
824	Q	33.9	Very low	31.2	Very low	132 Å²	132	131.8 Å²	131.8	62%	0.617	71%	0.708	S	S	*	*			cis	-167.6	161	-11.3	-96	154.1	-29.9	0	0	104.4
825	H	32.4	Very low	31.4	Very low	152 Å²	152	133.8 Å²	133.8	70%	0.704	72%	0.718	S	S	*	*				178.8	132	67.4	-109.6	-67.7	0	0	0	111.1
826	S	31.5	Very low	31	Very low	87 Å²	87	133.2 Å²	133.2	61%	0.608	72%	0.715	S	S	*	*			trans	40.2	136.3	131.5	61.3	0	0	0	0	122
827	N	31.2	Very low	31.2	Very low	129 Å²	129	132.3 Å²	132.3	69%	0.69	72%	0.717	S	S	*	*			cis	-146.7	-178.5	4.7	-67.3	-53.5	0	0	0	108.1
828	Y	32.1	Very low	31	Very low	200 Å²	200	131 Å²	131	78%	0.784	71%	0.714	S	S	*	*			cis	-126.3	154.6	5	-77.6	-106.9	0	0	0	107.5
829	T	32.1	Very low	30.6	Very low	97 Å²	97	132.9 Å²	132.9	60%	0.595	72%	0.716	S	S	*	*				51.5	128.9	68.8	85.3	0	0	0	0	115.2
830	D	33.7	Very low	30.7	Very low	128 Å²	128	132.2 Å²	132.2	68%	0.684	72%	0.722	S	S	*	*			cis	-130.2	134.8	15.9	-86.6	-71.1	0	0	0	112
831	N	32.2	Very low	30.7	Very low	139 Å²	139	133.6 Å²	133.6	74%	0.743	73%	0.727	S	S	*	*				60.3	131.3	88.8	-68.1	-46.2	0	0	0	114.5
832	S	31	Very low	30.7	Very low	98 Å²	98	134.8 Å²	134.8	69%	0.685	73%	0.729	S	S	*	*			cis	-160.6	-172.8	-0.3	59.9	0	0	0	0	108.5
833	H	34.4	Very low	30.7	Very low	163 Å²	163	136.2 Å²	136.2	76%	0.755	74%	0.738	S	S	*	*			cis	-149.1	-123.7	10.6	-148.5	-58.8	0	0	0	111.9
834	T	28.5	Very low	30.8	Very low	106 Å²	106	134.5 Å²	134.5	65%	0.65	74%	0.741	S	S	*	*			trans	-156	151.9	-165.8	52.7	0	0	0	0	113.9
835	L	32.8	Very low	30.8	Very low	165 Å²	165	133.8 Å²	133.8	86%	0.864	75%	0.748	S	S	*	*				176.8	135.1	123.6	-96.2	167.9	0	0	0	112.9
836	N	25.5	Very low	30.9	Very low	150 Å²	150	131.4 Å²	131.4	80%	0.802	75%	0.746	S	S	*	*			trans	-102.6	150.7	162	-90.8	-25.7	0	0	0	108.2
837	P	32.4	Very low	31.1	Very low	117 Å²	117	132.8 Å²	132.8	76%	0.76	76%	0.756	S	S	*	*				-149.4	146.8	97.9	36.7	-18.6	0	0	0	118
838	T	26.3	Very low	31.3	Very low	114 Å²	114	132.8 Å²	132.8	70%	0.699	75%	0.754	S	S	*	*			trans	10.8	145.8	143.4	-3.5	0	0	0	0	124.3
839	F	26.3	Very low	31.5	Very low	192 Å²	192	130.6 Å²	130.6	84%	0.842	75%	0.749	S	S	*	*			trans	65.1	111.3	154.4	-66.9	-59.6	0	0	0	120.9
840	S	29.1	Very low	31.7	Very low	124 Å²	124	131 Å²	131	87%	0.867	75%	0.754	S	S	*	*				-172.3	156.9	101.5	41.8	0	0	0	0	112.1
841	T	27.1	Very low	31.6	Very low	127 Å²	127	132.5 Å²	132.5	78%	0.779	75%	0.75	S	S	*	*			trans	-104.4	123.3	-171.9	50.2	0	0	0	0	113.3
842	T	30.3	Very low	31.7	Very low	134 Å²	134	131.9 Å²	131.9	82%	0.822	75%	0.753	S	S	*	*			trans	-137	123.1	153.4	51.4	0	0	0	0	110	S844	T842-S844 PolarHBondContact O-N 3.38Å
843	N	30.2	Very low	31.9	Very low	167 Å²	167	131.6 Å²	131.6	89%	0.893	76%	0.757	S	S	*	*			trans	-77.6	121.1	-174.6	-68.7	-30.1	0	0	0	111.1
844	S	33	Very low	31.9	Very low	103 Å²	103	131.9 Å²	131.9	72%	0.72	76%	0.756	S	S	*	*			trans	-112.9	140.7	164.2	-69.5	0	0	0	0	109.2	T842	T842-S844 PolarHBondContact O-N 3.38Å
845	P	34.4	Very low	32.2	Very low	118 Å²	118	137.7 Å²	137.7	77%	0.766	77%	0.766	S	S	*	*			trans	-64.2	146.3	178.6	27.6	-34.6	0	0	0	111
846	P	34.5	Very low	32.3	Very low	102 Å²	102	133.6 Å²	133.6	66%	0.662	75%	0.748	S	S	*	*			trans	-62.9	148.2	-179.5	25.9	-34.1	0	0	0	111.7	I848	P846-I848 VanDerWaalsContact C-N 3.26Å; P846-I848 HydrophobicContact CB-CG1 4.45Å; P846-I848 HydrophobicContact CG-CD1 4.29Å; P846-I848 HydrophobicContact CG-CG1 4.15Å; P846-I848 PolarHBondContact O-N 3.09Å
847	S	35.2	Very low	32.7	Very low	116 Å²	116	131.5 Å²	131.5	81%	0.811	74%	0.743	S	S	*	*			trans	-75.6	72.5	179.8	-178	0	0	0	0	111.5	F849	S847-F849 PolarHBondContact O-N 2.83Å
848	I	35.4	Very low	32.7	Very low	128 Å²	128	132.4 Å²	132.4	66%	0.656	74%	0.741	S	S	*	*			trans	-74.5	65.7	177.5	-48.3	175	0	0	0	110.4	P846	P846-I848 VanDerWaalsContact C-N 3.26Å; P846-I848 HydrophobicContact CB-CG1 4.45Å; P846-I848 HydrophobicContact CG-CD1 4.29Å; P846-I848 HydrophobicContact CG-CG1 4.15Å; P846-I848 PolarHBondContact O-N 3.09Å
849	F	37.5	Very low	33.3	Very low	154 Å²	154	133.2 Å²	133.2	68%	0.675	75%	0.746	S	S	*	*			trans	-167	108.2	154.9	-87	-59.1	0	0	0	108.7	S847	S847-F849 PolarHBondContact O-N 2.83Å
850	P	35.6	Very low	33.7	Very low	106 Å²	106	134.8 Å²	134.8	69%	0.688	75%	0.746	S	S	*	*			trans	-62.3	139.9	154.1	29.1	-32.5	0	0	0	108.1
851	R	32.5	Very low	34.1	Very low	160 Å²	160	134.9 Å²	134.9	60%	0.604	74%	0.742	S	S	*	*			trans	-60.3	135.8	171.6	-79.2	-170.9	-179	170	3.1	108.9	S117 A853	S117-R851 PolarHBondContact O-NH1 3.28Å; S117-R851 PolarHBondContact O-NH2 2.93Å; R851-A853 VanDerWaalsContact C-N 3.33Å; R851-A853 PolarHBondContact O-N 3.07Å
852	P	33.2	Very low	34.6	Very low	125 Å²	125	134.2 Å²	134.2	81%	0.812	74%	0.742	S	S	*	*			trans	-65	89.3	170.8	-21.8	34.2	0	0	0	111.4	F854	P852-F854 PolarHBondContact O-N 3.43Å
853	A	35.5	Very low	34.7	Very low	92 Å²	92	140 Å²	140	76%	0.76	75%	0.749	S	S	*	*			trans	-80.5	40.6	173.5	0	0	0	0	0	111.4	R851	R851-A853 VanDerWaalsContact C-N 3.33Å; R851-A853 PolarHBondContact O-N 3.07Å
854	F	35.5	Very low	35.3	Very low	170 Å²	170	141.8 Å²	141.8	75%	0.746	75%	0.749	S	S	*	*			trans	-139.9	53.9	-160.4	-159.2	-94.6	0	0	0	113	P852	P852-F854 PolarHBondContact O-N 3.43Å
855	W	34.1	Very low	35.4	Very low	228 Å²	228	144 Å²	144	86%	0.864	75%	0.751	S	S	*	*	S	Bend	trans	-148.1	15.8	159.6	-86.5	116.4	0	0	0	113.1
856	T	35.4	Very low	35.7	Very low	79 Å²	79	145.3 Å²	145.3	49%	0.485	75%	0.752	S	S	.	*			trans	-128.3	93.7	-176.6	54.6	0	0	0	0	109.3	I121 D858	I121-T856 HydrophobicContact CB-CG2 4.28Å; I121-T856 HydrophobicContact CD1-CG2 3.51Å; I121-T856 HydrophobicContact CG1-CG2 3.85Å; T856-D858 PolarHBondContact O-N 3.31Å
857	P	34.1	Very low	35.6	Very low	106 Å²	106	147.7 Å²	147.7	69%	0.688	76%	0.759	S	S	*	*			trans	-65.3	118.6	168.3	28.1	-31.9	0	0	0	108.2	V859	P857-V859 VanDerWaalsContact C-N 3.3Å; P857-V859 HydrophobicContact CB-CG2 4.09Å; P857-V859 HydrophobicContact CG-CG2 4.18Å; P857-V859 WeakPolarHBondContact O-CG2 3.29Å; P857-V859 PolarHBondContact O-N 2.84Å
858	D	31.8	Very low	36.2	Very low	136 Å²	136	149.2 Å²	149.2	73%	0.727	76%	0.756	S	S	*	*			trans	-76.1	86.9	172.3	-170.4	-5.9	0	0	0	108.7	T856 R860	T856-D858 PolarHBondContact O-N 3.31Å; D858-R860 PolarHBondContact O-N 3.48Å
859	V	38.5	Very low	37	Very low	131 Å²	131	150.4 Å²	150.4	79%	0.794	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	54.8	-175.3	-165	0	0	0	0	111.1	P857	P857-V859 VanDerWaalsContact C-N 3.3Å; P857-V859 HydrophobicContact CB-CG2 4.09Å; P857-V859 HydrophobicContact CG-CG2 4.18Å; P857-V859 WeakPolarHBondContact O-CG2 3.29Å; P857-V859 PolarHBondContact O-N 2.84Å
860	R	35.7	Very low	38	Very low	224 Å²	224	151.6 Å²	151.6	85%	0.845	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.8	7.8	-179.5	-109.7	173.1	-169.2	-173.6	3.2	117.7	D858	D858-R860 PolarHBondContact O-N 3.48Å
861	T	37.6	Very low	39.6	Very low	126 Å²	126	151.4 Å²	151.4	77%	0.773	76%	0.76	S	S	*	*	S	Bend	trans	-140.2	154	165.4	-22.6	0	0	0	0	114
862	S	36.9	Very low	42.1	Very low	113 Å²	113	147.6 Å²	147.6	79%	0.79	75%	0.752	S	S	*	*			trans	62.9	70.9	162	-60.9	0	0	0	0	118.6	K864	S862-K864 PolarHBondContact O-N 2.99Å; S862-K864 VanDerWaalsContact O-N 3.11Å
863	R	32.4	Very low	44.6	Very low	255 Å²	255	144.6 Å²	144.6	96%	0.962	73%	0.732	S	S	*	*			trans	-59.3	107.7	156.2	-81.1	177.5	-80.7	-170.2	-9.4	111.1
864	K	43.3	Very low	47	Very low	206 Å²	206	144 Å²	144	90%	0.896	71%	0.712	S	S	*	*			trans	-139.8	144.2	152.7	-99	-177.1	178.2	177.9	0	109.2	S862	S862-K864 PolarHBondContact O-N 2.99Å; S862-K864 VanDerWaalsContact O-N 3.11Å
865	I	35.1	Very low	49.5	Very low	148 Å²	148	138 Å²	138	76%	0.759	69%	0.69	S	S	*	*			trans	-90.1	121.1	-164.2	-60.7	162.5	0	0	0	110
866	N	40.1	Very low	52	Low	147 Å²	147	132.6 Å²	132.6	79%	0.786	67%	0.672	S	S	*	*			trans	-138.5	114.8	158.3	-94.1	-14.9	0	0	0	107	I868	N866-I868 PolarHBondContact O-N 3.32Å
867	N	33.3	Very low	54.5	Low	151 Å²	151	128.9 Å²	128.9	81%	0.807	65%	0.65	S	S	*	*			trans	-80.1	68.3	-178.7	-72.8	6.4	0	0	0	111.2	I869	N867-I869 PolarHBondContact O-N 3.23Å
868	I	46.7	Very low	57.2	Low	149 Å²	149	125 Å²	125	76%	0.764	62%	0.622	S	S	*	*			trans	-80	111.4	158.3	-59.7	176.8	0	0	0	105.8	N866 Q870	N866-I868 PolarHBondContact O-N 3.32Å; I868-Q870 PolarHBondContact O-N 3.41Å
869	I	52.2	Low	59.8	Low	153 Å²	153	122.3 Å²	122.3	79%	0.785	60%	0.603	S	S	*	*			trans	-69.9	101.5	175	-58.7	175.5	0	0	0	107.1	N867 E871	N867-I869 PolarHBondContact O-N 3.23Å; I869-E871 PolarHBondContact O-N 2.81Å; I869-E871 VanDerWaalsContact O-N 3.14Å
870	Q	59.5	Low	62.2	Low	178 Å²	178	117.8 Å²	117.8	83%	0.832	57%	0.572	S	S	*	*			trans	-65.6	109.8	168.5	178.1	174.8	-29	0	0	107.5	I868 D872	I868-Q870 PolarHBondContact O-N 3.41Å; Q870-D872 PolarHBondContact O-N 3.35Å
871	E	69.1	Low	64.8	Low	102 Å²	102	107.1 Å²	107.1	48%	0.477	53%	0.532	S	S	.	.			trans	-59.3	135.5	178.8	-59.8	-163.5	174.8	0	0	110.6	I869 K879	I869-E871 PolarHBondContact O-N 2.81Å; I869-E871 VanDerWaalsContact O-N 3.14Å; E871-K879 IonicContact OE1-NZ 3.95Å; E871-K879 PolarHBondContact OE1-NZ 3.49Å; E871-K879 IonicContact OE2-NZ 2.72Å; E871-K879 PolarHBondContact OE2-NZ 3.24Å
872	D	84.4	Confident	67.1	Low	81 Å²	81	105.3 Å²	105.3	43%	0.433	52%	0.515	S	S	.	.			trans	-54.5	130.5	172.2	164.7	15.1	0	0	0	109.4	Q870 K874 T875 K876	Q870-D872 PolarHBondContact O-N 3.35Å; D872-K874 PolarHBondContact O-N 3.07Å; D872-K874 VanDerWaalsContact O-N 3.12Å; D872-K874 WeakPolarHBondContact OD1-CB 3.47Å; D872-K874 PolarHBondContact OD1-N 2.97Å; D872-K874 WeakPolarHBondContact OD2-CB 3.31Å; D872-T875 WeakPolarHBondContact O-CB 3.5Å; D872-T875 PolarHBondContact O-N 2.75Å; D872-K876 PolarHBondContact O-N 2.79Å
873	P	84.8	Confident	69.3	Low	62 Å²	62	104 Å²	104	40%	0.403	51%	0.505	S	S	.	.	H	α-helix	trans	-49.2	-36	174.7	20.1	-33.4	0	0	0	112.8	K876 V877 E944	P873-K876 WeakPolarHBondContact O-CB 3.48Å; P873-K876 PolarHBondContact O-N 2.92Å; P873-V877 WeakPolarHBondContact O-CG2 3.33Å; P873-V877 PolarHBondContact O-N 2.58Å; P873-E944 CarbonylContact C-O 3.05Å
874	K	86.4	Confident	71.7	Confident	78 Å²	78	99 Å²	99	34%	0.339	49%	0.487	S	S	.	.	H	α-helix	trans	-66.3	-44.2	177.7	-169.6	176	-177.1	163.3	0	112.1	D872 K876 V877 Y878 F919 E944	D872-K874 PolarHBondContact O-N 3.07Å; D872-K874 VanDerWaalsContact O-N 3.12Å; D872-K874 WeakPolarHBondContact OD1-CB 3.47Å; D872-K874 PolarHBondContact OD1-N 2.97Å; D872-K874 WeakPolarHBondContact OD2-CB 3.31Å; K874-K876 VanDerWaalsContact C-N 3.26Å; K874-K876 PolarHBondContact O-N 2.66Å; K874-V877 PolarHBondContact O-N 3.21Å; K874-Y878 PolarHBondContact O-N 3.28Å; K874-F919 HydrophobicContact CG-CE1 4.49Å; K874-F919 HydrophobicContact CG-CZ 4.42Å; K874-E944 WeakPolarHBondContact CA-O 3.22Å; K874-E944 HydrophobicContact CB-CB 4.18Å; K874-E944 HydrophobicContact CD-CB 4.46Å; K874-E944 HydrophobicContact CD-CG 4.05Å; K874-E944 WeakPolarHBondContact CD-OE1 3.25Å; K874-E944 WeakPolarHBondContact CE-OE1 3.43Å; K874-E944 HydrophobicContact CG-CB 4.19Å; K874-E944 HydrophobicContact CG-CG 4.16Å; K874-E944 PolarHBondContact N-O 2.76Å; K874-E944 VanDerWaalsContact N-O 3.13Å; K874-E944 IonicContact NZ-OE1 2.65Å; K874-E944 PolarHBondContact NZ-OE1 3.03Å
875	T	87.3	Confident	73.8	Confident	46 Å²	46	89.1 Å²	89.1	28%	0.282	45%	0.445	S	S	.	.	H	α-helix	trans	-58	-39.9	172	-52.7	0	0	0	0	111.6	D872 Y878 K879	D872-T875 WeakPolarHBondContact O-CB 3.5Å; D872-T875 PolarHBondContact O-N 2.75Å; T875-Y878 PolarHBondContact O-N 2.91Å; T875-K879 HydrophobicContact CG2-CD 4.29Å; T875-K879 WeakPolarHBondContact O-CG 3.37Å; T875-K879 PolarHBondContact O-N 3.23Å
876	K	87.7	Confident	76.3	Confident	113 Å²	113	82.6 Å²	82.6	49%	0.491	41%	0.413	S	S	.	.	H	α-helix	trans	-66.5	-38.9	177.9	-177	-171.4	174.8	-172.5	0	112.5	D872 P873 K874 W880 L947	D872-K876 PolarHBondContact O-N 2.79Å; P873-K876 WeakPolarHBondContact O-CB 3.48Å; P873-K876 PolarHBondContact O-N 2.92Å; K874-K876 VanDerWaalsContact C-N 3.26Å; K874-K876 PolarHBondContact O-N 2.66Å; K876-W880 WeakPolarHBondContact O-CB 3.46Å; K876-W880 PolarHBondContact O-N 2.93Å; K876-L947 HydrophobicContact CG-CD2 4.46Å
877	V	88.6	Confident	78.4	Confident	2 Å²	2	79 Å²	79	1%	0.012	40%	0.404	C	S	.	.	H	α-helix	trans	-69.2	-41.1	172.8	-178	0	0	0	0	110.9	P873 K874 W880 F881 F919 L947	P873-V877 WeakPolarHBondContact O-CG2 3.33Å; P873-V877 PolarHBondContact O-N 2.58Å; K874-V877 PolarHBondContact O-N 3.21Å; V877-W880 HydrophobicContact CG1-CE3 4.06Å; V877-W880 HydrophobicContact CG1-CZ3 4.43Å; V877-W880 PolarHBondContact O-N 3.02Å; V877-F881 PolarHBondContact O-N 3.02Å; V877-F919 HydrophobicContact CB-CE1 4.06Å; V877-F919 HydrophobicContact CB-CZ 3.92Å; V877-F919 HydrophobicContact CG1-CE1 3.71Å; V877-F919 HydrophobicContact CG1-CZ 3.73Å; V877-L947 HydrophobicContact CB-CD2 4.45Å; V877-L947 HydrophobicContact CG2-CD2 4.01Å
878	Y	88.9	Confident	80.8	Confident	24 Å²	24	74.8 Å²	74.8	9%	0.094	38%	0.377	C	S	.	.	H	α-helix	trans	-57	-53.4	175.7	178.6	-77.6	0	0	0	111.1	K874 T875 W880 F881 E882 F919 S1039 P1041	K874-Y878 PolarHBondContact O-N 3.28Å; T875-Y878 PolarHBondContact O-N 2.91Å; Y878-W880 VanDerWaalsContact C-N 3.26Å; Y878-W880 PolarHBondContact O-N 3.39Å; Y878-F881 PolarHBondContact O-N 2.75Å; Y878-E882 HydrophobicContact CE1-CB 4.07Å; Y878-E882 HydrophobicContact CE1-CG 4.4Å; Y878-E882 WeakPolarHBondContact CE1-OE2 3.47Å; Y878-E882 WeakPolarHBondContact O-CB 3.35Å; Y878-E882 PolarHBondContact O-N 3.13Å; Y878-F919 HydrophobicContact CD2-CE2 4.23Å; Y878-S1039 WeakPolarHBondContact CE2-O 3.19Å; Y878-S1039 PolarHBondContact OH-O 3.04Å; Y878-P1041 HydrophobicContact CD1-CB 4.12Å; Y878-P1041 HydrophobicContact CD1-CG 4Å; Y878-P1041 HydrophobicContact CE1-CB 4.19Å; Y878-P1041 HydrophobicContact CE1-CG 3.73Å
879	K	87.2	Confident	82.8	Confident	80 Å²	80	67.7 Å²	67.7	35%	0.348	34%	0.34	S	S	.	.	H	α-helix	trans	-57.9	-38.1	179.3	-74.5	174.5	178.7	173.4	0	112.5	E871 T875 S883	E871-K879 IonicContact OE1-NZ 3.95Å; E871-K879 PolarHBondContact OE1-NZ 3.49Å; E871-K879 IonicContact OE2-NZ 2.72Å; E871-K879 PolarHBondContact OE2-NZ 3.24Å; T875-K879 HydrophobicContact CG2-CD 4.29Å; T875-K879 WeakPolarHBondContact O-CG 3.37Å; T875-K879 PolarHBondContact O-N 3.23Å; K879-S883 VanDerWaalsContact O-CB 3.22Å; K879-S883 WeakPolarHBondContact O-CB 3.22Å; K879-S883 PolarHBondContact O-N 2.87Å; K879-S883 PolarHBondContact O-OG 3.22Å
880	W	89.4	Confident	84.4	Confident	35 Å²	35	61.3 Å²	61.3	13%	0.133	31%	0.307	C	S	.	.	H	α-helix	trans	-66.3	-45.8	174.5	163.4	80.9	0	0	0	111.8	K876 V877 Y878 S883 Y884 E885 L942 L947 Y949 V966	K876-W880 WeakPolarHBondContact O-CB 3.46Å; K876-W880 PolarHBondContact O-N 2.93Å; V877-W880 HydrophobicContact CG1-CE3 4.06Å; V877-W880 HydrophobicContact CG1-CZ3 4.43Å; V877-W880 PolarHBondContact O-N 3.02Å; Y878-W880 VanDerWaalsContact C-N 3.26Å; Y878-W880 PolarHBondContact O-N 3.39Å; W880-S883 PolarHBondContact O-N 2.73Å; W880-Y884 AromaticContact CD1-CD2 3.47Å; W880-Y884 VanDerWaalsContact CD1-CD2 3.47Å; W880-Y884 HydrophobicContact CG-CD2 4.25Å; W880-Y884 AromaticContact NE1-CD2 3.94Å; W880-Y884 WeakPolarHBondContact O-CB 3.43Å; W880-Y884 WeakPolarHBondContact O-CD2 3.28Å; W880-Y884 PolarHBondContact O-N 3.25Å; W880-E885 HydrophobicContact CH2-CG 3.98Å; W880-E885 HydrophobicContact CZ2-CG 3.92Å; W880-L942 HydrophobicContact CZ3-CD2 3.87Å; W880-L947 HydrophobicContact CB-CD2 3.73Å; W880-L947 HydrophobicContact CD2-CB 4.17Å; W880-L947 HydrophobicContact CD2-CD2 4.27Å; W880-L947 HydrophobicContact CG-CB 4.31Å; W880-L947 HydrophobicContact CG-CD2 3.88Å; W880-Y949 HydrophobicContact CH2-CE2 4.34Å; W880-V966 HydrophobicContact CH2-CG2 3.8Å; W880-V966 HydrophobicContact CZ2-CB 3.87Å; W880-V966 HydrophobicContact CZ2-CG1 4.36Å; W880-V966 HydrophobicContact CZ2-CG2 3.64Å
881	F	89.5	Confident	85.6	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61	-50.1	178.5	-179.9	-96.7	0	0	0	111.2	V877 Y878 S883 Y884 E885 A886 L889 L942 Y949 I1036 F1037	V877-F881 PolarHBondContact O-N 3.02Å; Y878-F881 PolarHBondContact O-N 2.75Å; F881-S883 VanDerWaalsContact C-N 3.34Å; F881-S883 PolarHBondContact O-N 3.05Å; F881-Y884 PolarHBondContact O-N 2.92Å; F881-E885 HydrophobicContact CD2-CB 3.76Å; F881-E885 HydrophobicContact CE2-CB 3.87Å; F881-E885 PolarHBondContact O-N 2.81Å; F881-A886 HydrophobicContact CD1-CB 3.93Å; F881-A886 HydrophobicContact CE1-CB 3.63Å; F881-A886 HydrophobicContact CZ-CB 4.29Å; F881-A886 PolarHBondContact O-N 3.17Å; F881-L889 HydrophobicContact CE2-CD1 3.83Å; F881-L889 HydrophobicContact CZ-CD1 4Å; F881-L942 HydrophobicContact CB-CD1 4.48Å; F881-L942 HydrophobicContact CD2-CD1 3.78Å; F881-L942 HydrophobicContact CD2-CD2 4.02Å; F881-L942 HydrophobicContact CD2-CG 4.48Å; F881-L942 HydrophobicContact CE2-CD1 4.16Å; F881-L942 HydrophobicContact CG-CD1 4.01Å; F881-Y949 HydrophobicContact CE2-CE1 4.2Å; F881-Y949 WeakPolarHBondContact CE2-OH 3.45Å; F881-I1036 HydrophobicContact CD1-CB 4.11Å; F881-I1036 WeakPolarHBondContact CD1-O 3.37Å; F881-I1036 HydrophobicContact CE1-CB 3.91Å; F881-I1036 HydrophobicContact CE1-CD1 3.77Å; F881-I1036 HydrophobicContact CE1-CG1 4.14Å; F881-I1036 VanDerWaalsContact CE1-O 3.3Å; F881-I1036 WeakPolarHBondContact CE1-O 3.21Å; F881-I1036 HydrophobicContact CE2-CD1 4.27Å; F881-I1036 HydrophobicContact CZ-CD1 3.63Å; F881-I1036 HydrophobicContact CZ-CG1 4.47Å; F881-F1037 HydrophobicContact CE1-CD1 4.18Å; F881-F1037 HydrophobicContact CE1-CE1 4.04Å; F881-F1037 HydrophobicContact CZ-CD1 4.4Å; F881-F1037 AromaticContact CZ-CE1 3.8Å; F881-F1037 HydrophobicContact CZ-CE1 3.8Å; F881-F1037 HydrophobicContact CZ-CZ 4.11Å
882	E	87.2	Confident	86.3	Confident	89 Å²	89	53.3 Å²	53.3	42%	0.416	28%	0.276	S	S	.	.	I	π-helix	trans	-54.6	-46.7	175.5	-176.7	177.2	-134	0	0	111.9	Y878	Y878-E882 HydrophobicContact CE1-CB 4.07Å; Y878-E882 HydrophobicContact CE1-CG 4.4Å; Y878-E882 WeakPolarHBondContact CE1-OE2 3.47Å; Y878-E882 WeakPolarHBondContact O-CB 3.35Å; Y878-E882 PolarHBondContact O-N 3.13Å
883	S	81.4	Confident	86.5	Confident	85 Å²	85	49.4 Å²	49.4	59%	0.594	26%	0.256	S	S	*	.	I	π-helix	trans	-74.7	-27.7	-175	-59.7	0	0	0	0	115.1	K879 W880 F881	K879-S883 VanDerWaalsContact O-CB 3.22Å; K879-S883 WeakPolarHBondContact O-CB 3.22Å; K879-S883 PolarHBondContact O-N 2.87Å; K879-S883 PolarHBondContact O-OG 3.22Å; W880-S883 PolarHBondContact O-N 2.73Å; F881-S883 VanDerWaalsContact C-N 3.34Å; F881-S883 PolarHBondContact O-N 3.05Å
884	Y	82.8	Confident	86.4	Confident	149 Å²	149	48.2 Å²	48.2	58%	0.584	26%	0.255	S	S	*	.	I	π-helix	trans	-125	-26.3	-167.7	-66.2	-69.6	0	0	0	115.4	W880 F881	W880-Y884 AromaticContact CD1-CD2 3.47Å; W880-Y884 VanDerWaalsContact CD1-CD2 3.47Å; W880-Y884 HydrophobicContact CG-CD2 4.25Å; W880-Y884 AromaticContact NE1-CD2 3.94Å; W880-Y884 WeakPolarHBondContact O-CB 3.43Å; W880-Y884 WeakPolarHBondContact O-CD2 3.28Å; W880-Y884 PolarHBondContact O-N 3.25Å; F881-Y884 PolarHBondContact O-N 2.92Å
885	E	87.8	Confident	86.3	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.24	C	C	.	.	I	π-helix	trans	-124.6	-36.1	-168.1	-72.9	-76	111.1	0	0	113.4	W880 F881 A887 R888 L889 Y949 V966 S982 Y984	W880-E885 HydrophobicContact CH2-CG 3.98Å; W880-E885 HydrophobicContact CZ2-CG 3.92Å; F881-E885 HydrophobicContact CD2-CB 3.76Å; F881-E885 HydrophobicContact CE2-CB 3.87Å; F881-E885 PolarHBondContact O-N 2.81Å; E885-A887 PolarHBondContact O-N 3.39Å; E885-R888 WeakPolarHBondContact O-CA 3.48Å; E885-R888 WeakPolarHBondContact O-CB 3.38Å; E885-R888 PolarHBondContact O-N 3.26Å; E885-L889 PolarHBondContact O-N 2.98Å; E885-Y949 WeakPolarHBondContact OE2-CE2 3.33Å; E885-Y949 PolarHBondContact OE2-OH 2.77Å; E885-V966 HydrophobicContact CG-CG1 4.45Å; E885-V966 WeakPolarHBondContact OE1-CG1 3.5Å; E885-S982 PolarHBondContact OE1-OG 3.48Å; E885-Y984 VanDerWaalsContact CD-OH 3.3Å; E885-Y984 PolarHBondContact OE1-OH 3.07Å; E885-Y984 WeakPolarHBondContact OE2-CE1 3.14Å; E885-Y984 PolarHBondContact OE2-OH 3.45Å
886	A	88	Confident	85.9	Confident	10 Å²	10	44 Å²	44	8%	0.083	24%	0.236	C	C	.	.	I	π-helix	trans	-55.2	-52.5	-174.4	0	0	0	0	0	112.5	F881 R888 L889 L890 F1037	F881-A886 HydrophobicContact CD1-CB 3.93Å; F881-A886 HydrophobicContact CE1-CB 3.63Å; F881-A886 HydrophobicContact CZ-CB 4.29Å; F881-A886 PolarHBondContact O-N 3.17Å; A886-R888 PolarHBondContact O-N 3.21Å; A886-L889 PolarHBondContact O-N 3.28Å; A886-L890 WeakPolarHBondContact O-CB 3.42Å; A886-L890 VanDerWaalsContact O-CG 3.3Å; A886-L890 WeakPolarHBondContact O-CG 3.41Å; A886-L890 PolarHBondContact O-N 2.9Å; A886-F1037 HydrophobicContact CB-CD1 4.45Å
887	A	84.1	Confident	85.3	Confident	73 Å²	73	44.8 Å²	44.8	60%	0.603	24%	0.244	S	C	*	.	H	α-helix	trans	-59.9	-32.3	177.7	0	0	0	0	0	113.2	E885 V891	E885-A887 PolarHBondContact O-N 3.39Å; A887-V891 WeakPolarHBondContact O-CG2 3.43Å
888	R	83.2	Confident	84.4	Confident	62 Å²	62	51.3 Å²	51.3	23%	0.234	28%	0.284	C	S	.	.	H	α-helix	trans	-72.6	-45	178	-156.9	-163.2	79.7	69.5	6.2	111.1	E885 A886 V891 D892 Y984 D997	E885-R888 WeakPolarHBondContact O-CA 3.48Å; E885-R888 WeakPolarHBondContact O-CB 3.38Å; E885-R888 PolarHBondContact O-N 3.26Å; A886-R888 PolarHBondContact O-N 3.21Å; R888-V891 PolarHBondContact O-N 3.1Å; R888-D892 IonicContact NH2-OD2 3.32Å; R888-D892 PolarHBondContact O-N 3.18Å; R888-Y984 VanDerWaalsContact CZ-OH 3.3Å; R888-Y984 PolarHBondContact NE-OH 2.72Å; R888-Y984 PolarHBondContact NH2-OH 2.96Å; R888-D997 IonicContact CZ-OD1 2.76Å; R888-D997 IonicContact NH1-OD1 2.72Å; R888-D997 PolarHBondContact NH1-OD1 3.44Å; R888-D997 IonicContact NH2-OD1 3Å
889	L	88.4	Confident	83.5	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-74.3	-32.7	-179.1	-69	-174	0	0	0	113.2	F881 E885 A886 V891 D892 F893 F916 Y949 L998 F1037	F881-L889 HydrophobicContact CE2-CD1 3.83Å; F881-L889 HydrophobicContact CZ-CD1 4Å; E885-L889 PolarHBondContact O-N 2.98Å; A886-L889 PolarHBondContact O-N 3.28Å; L889-V891 PolarHBondContact O-N 3.28Å; L889-D892 PolarHBondContact O-N 2.99Å; L889-F893 HydrophobicContact CB-CD2 4.3Å; L889-F893 HydrophobicContact CB-CE2 4.16Å; L889-F893 HydrophobicContact CD1-CE2 4.23Å; L889-F893 HydrophobicContact CD1-CZ 4.34Å; L889-F893 HydrophobicContact CD2-CE1 4.13Å; L889-F893 HydrophobicContact CD2-CE2 4.35Å; L889-F893 HydrophobicContact CD2-CZ 3.88Å; L889-F893 HydrophobicContact CG-CE2 4.5Å; L889-F893 HydrophobicContact CG-CZ 4.49Å; L889-F893 VanDerWaalsContact O-CB 3.24Å; L889-F893 WeakPolarHBondContact O-CB 3.43Å; L889-F893 WeakPolarHBondContact O-CG 3.3Å; L889-F893 PolarHBondContact O-N 3.34Å; L889-F916 HydrophobicContact CD1-CE2 3.96Å; L889-F916 HydrophobicContact CD1-CZ 3.88Å; L889-Y949 WeakPolarHBondContact CD1-OH 3.45Å; L889-L998 HydrophobicContact CD1-CD1 4.31Å; L889-L998 HydrophobicContact CD2-CD1 4.07Å; L889-F1037 HydrophobicContact CB-CE1 3.89Å; L889-F1037 HydrophobicContact CB-CZ 3.95Å
890	L	86	Confident	82.7	Confident	18 Å²	18	51.4 Å²	51.4	9%	0.094	29%	0.292	C	S	.	.	H	α-helix	trans	-54.3	-42.8	169.7	-74.8	171.7	0	0	0	110.8	A886 G894 L895 F1037 Y1038	A886-L890 WeakPolarHBondContact O-CB 3.42Å; A886-L890 VanDerWaalsContact O-CG 3.3Å; A886-L890 WeakPolarHBondContact O-CG 3.41Å; A886-L890 PolarHBondContact O-N 2.9Å; L890-G894 CarbonylContact O-C 3.52Å; L890-G894 WeakPolarHBondContact O-CA 3.48Å; L890-G894 PolarHBondContact O-N 3Å; L890-L895 HydrophobicContact CD2-CB 3.56Å; L890-L895 HydrophobicContact CD2-CD1 4.1Å; L890-L895 HydrophobicContact CD2-CG 4.5Å; L890-L895 PolarHBondContact O-N 2.8Å; L890-F1037 HydrophobicContact CD2-CB 4.16Å; L890-F1037 HydrophobicContact CD2-CD1 3.62Å; L890-F1037 HydrophobicContact CD2-CE1 4.21Å; L890-F1037 HydrophobicContact CD2-CG 3.98Å; L890-F1037 HydrophobicContact CG-CD1 3.76Å; L890-F1037 HydrophobicContact CG-CE1 4.12Å; L890-Y1038 HydrophobicContact CD2-CE1 4.4Å
891	V	84.9	Confident	81.4	Confident	89 Å²	89	52 Å²	52	54%	0.539	30%	0.302	S	S	.	.	H	α-helix	trans	-74.6	-43.9	179	176	0	0	0	0	113	A887 R888 L889 G894 I897 R911	A887-V891 WeakPolarHBondContact O-CG2 3.43Å; R888-V891 PolarHBondContact O-N 3.1Å; L889-V891 PolarHBondContact O-N 3.28Å; V891-G894 PolarHBondContact O-N 3.43Å; V891-I897 HydrophobicContact CG2-CD1 4.11Å; V891-R911 PolarHBondContact O-NH2 3.18Å
892	D	84.9	Confident	80.4	Confident	23 Å²	23	57.2 Å²	57.2	12%	0.123	34%	0.335	C	S	.	.	H	α-helix	trans	-58.7	-52.7	175.5	176.4	-1.7	0	0	0	110.6	R888 L889 G894 R911 R999	R888-D892 IonicContact NH2-OD2 3.32Å; R888-D892 PolarHBondContact O-N 3.18Å; L889-D892 PolarHBondContact O-N 2.99Å; D892-G894 VanDerWaalsContact C-N 3.26Å; D892-G894 PolarHBondContact O-N 2.94Å; D892-R911 PolarHBondContact O-NE 2.68Å; D892-R911 PolarHBondContact O-NH2 3.12Å; D892-R999 PolarHBondContact O-NH2 3.48Å; D892-R999 VanDerWaalsContact O-NH2 3.09Å; D892-R999 IonicContact OD1-CZ 2.65Å; D892-R999 VanDerWaalsContact OD1-CZ 3.27Å; D892-R999 IonicContact OD1-NE 3.32Å; D892-R999 PolarHBondContact OD1-NE 2.91Å; D892-R999 IonicContact OD1-NH2 2.96Å; D892-R999 PolarHBondContact OD1-NH2 2.83Å; D892-R999 IonicContact OD2-NE 3.48Å
893	F	87.2	Confident	79.3	Confident	0 Å²	0	60 Å²	60	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-77.1	-10	-178.4	-57.4	-13.3	0	0	0	113.3	L889 L895 R911 V912 P913 F916 F1037	L889-F893 HydrophobicContact CB-CD2 4.3Å; L889-F893 HydrophobicContact CB-CE2 4.16Å; L889-F893 HydrophobicContact CD1-CE2 4.23Å; L889-F893 HydrophobicContact CD1-CZ 4.34Å; L889-F893 HydrophobicContact CD2-CE1 4.13Å; L889-F893 HydrophobicContact CD2-CE2 4.35Å; L889-F893 HydrophobicContact CD2-CZ 3.88Å; L889-F893 HydrophobicContact CG-CE2 4.5Å; L889-F893 HydrophobicContact CG-CZ 4.49Å; L889-F893 VanDerWaalsContact O-CB 3.24Å; L889-F893 WeakPolarHBondContact O-CB 3.43Å; L889-F893 WeakPolarHBondContact O-CG 3.3Å; L889-F893 PolarHBondContact O-N 3.34Å; F893-L895 VanDerWaalsContact C-N 3.3Å; F893-L895 HydrophobicContact CB-CD1 4.28Å; F893-L895 HydrophobicContact CB-CG 4.14Å; F893-L895 HydrophobicContact CD2-CD1 4.44Å; F893-L895 PolarHBondContact O-N 3.23Å; F893-R911 VanDerWaalsContact O-CB 3.23Å; F893-R911 WeakPolarHBondContact O-CB 3.48Å; F893-R911 WeakPolarHBondContact O-CD 3.3Å; F893-R911 WeakPolarHBondContact O-CG 3.36Å; F893-V912 HydrophobicContact CB-CB 4.49Å; F893-V912 HydrophobicContact CB-CG2 3.87Å; F893-V912 HydrophobicContact CD2-CB 4.46Å; F893-V912 HydrophobicContact CD2-CG1 3.91Å; F893-V912 HydrophobicContact CD2-CG2 4.19Å; F893-V912 HydrophobicContact CE2-CG1 4.17Å; F893-V912 HydrophobicContact CG-CG1 4.37Å; F893-V912 HydrophobicContact CG-CG2 4.29Å; F893-P913 HydrophobicContact CD1-CG 4.32Å; F893-P913 VanDerWaalsContact CE1-CD 3.46Å; F893-P913 HydrophobicContact CE1-CG 3.85Å; F893-P913 HydrophobicContact CZ-CG 4.34Å; F893-F916 AromaticContact CE2-CD1 3.66Å; F893-F916 HydrophobicContact CE2-CD1 3.66Å; F893-F916 HydrophobicContact CE2-CD2 4.04Å; F893-F916 AromaticContact CE2-CE1 3.74Å; F893-F916 HydrophobicContact CE2-CE1 3.74Å; F893-F916 HydrophobicContact CE2-CE2 4.12Å; F893-F916 AromaticContact CE2-CG 3.82Å; F893-F916 HydrophobicContact CE2-CG 3.82Å; F893-F916 AromaticContact CE2-CZ 3.97Å; F893-F916 HydrophobicContact CE2-CZ 3.97Å; F893-F916 HydrophobicContact CZ-CB 4.49Å; F893-F916 HydrophobicContact CZ-CD1 4.3Å; F893-F916 AromaticContact CZ-CD2 3.91Å; F893-F916 HydrophobicContact CZ-CD2 3.91Å; F893-F916 HydrophobicContact CZ-CE2 4.19Å; F893-F916 AromaticContact CZ-CG 3.97Å; F893-F916 HydrophobicContact CZ-CG 3.97Å; F893-F1037 HydrophobicContact CD2-CZ 4.13Å; F893-F1037 HydrophobicContact CE2-CZ 4.25Å
894	G	82.8	Confident	78.6	Confident	37 Å²	37	57.8 Å²	57.8	38%	0.381	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.6	26.7	178.2	0	0	0	0	0	114.2	L890 V891 D892	L890-G894 CarbonylContact O-C 3.52Å; L890-G894 WeakPolarHBondContact O-CA 3.48Å; L890-G894 PolarHBondContact O-N 3Å; V891-G894 PolarHBondContact O-N 3.43Å; D892-G894 VanDerWaalsContact C-N 3.26Å; D892-G894 PolarHBondContact O-N 2.94Å
895	L	84.2	Confident	77.5	Confident	7 Å²	7	53.6 Å²	53.6	4%	0.037	33%	0.327	C	S	.	.			trans	-76.1	151.7	176.2	-69	173.6	0	0	0	110.8	L890 F893 I897 F909 V912 Y1033 F1037	L890-L895 HydrophobicContact CD2-CB 3.56Å; L890-L895 HydrophobicContact CD2-CD1 4.1Å; L890-L895 HydrophobicContact CD2-CG 4.5Å; L890-L895 PolarHBondContact O-N 2.8Å; F893-L895 VanDerWaalsContact C-N 3.3Å; F893-L895 HydrophobicContact CB-CD1 4.28Å; F893-L895 HydrophobicContact CB-CG 4.14Å; F893-L895 HydrophobicContact CD2-CD1 4.44Å; F893-L895 PolarHBondContact O-N 3.23Å; L895-I897 PolarHBondContact O-N 3.31Å; L895-F909 HydrophobicContact CD2-CD1 3.74Å; L895-F909 HydrophobicContact CD2-CE1 4Å; L895-V912 HydrophobicContact CD1-CG2 3.99Å; L895-V912 HydrophobicContact CD2-CG2 3.76Å; L895-V912 HydrophobicContact CG-CG2 3.96Å; L895-Y1033 HydrophobicContact CD1-CE2 4.49Å; L895-F1037 HydrophobicContact CD1-CD2 3.83Å; L895-F1037 HydrophobicContact CD1-CE2 3.72Å; L895-F1037 HydrophobicContact CD1-CG 4.35Å; L895-F1037 HydrophobicContact CD1-CZ 4.15Å
896	P	78.8	Confident	76.5	Confident	28 Å²	28	58.6 Å²	58.6	18%	0.182	36%	0.362	C	S	.	.			trans	-67.5	122.5	-179.2	26.6	-33.5	0	0	0	111.6	T898 L904 T908 Y1038	P896-T898 PolarHBondContact O-N 2.96Å; P896-L904 HydrophobicContact CG-CD1 4.24Å; P896-L904 HydrophobicContact CG-CD2 3.91Å; P896-T908 HydrophobicContact CG-CG2 4.48Å; P896-Y1038 WeakPolarHBondContact CD-OH 3.28Å; P896-Y1038 WeakPolarHBondContact CG-OH 3.08Å; P896-Y1038 WeakPolarHBondContact O-CE1 3.5Å; P896-Y1038 PolarHBondContact O-OH 3.19Å
897	I	76.5	Confident	75.4	Confident	129 Å²	129	64.7 Å²	64.7	66%	0.662	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-21.6	174.5	-54.2	172.4	0	0	0	110.9	V891 L895 G899	V891-I897 HydrophobicContact CG2-CD1 4.11Å; L895-I897 PolarHBondContact O-N 3.31Å; I897-G899 PolarHBondContact O-N 3.23Å
898	T	68.8	Low	74.7	Confident	140 Å²	140	63.2 Å²	63.2	86%	0.859	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	2.2	179.8	52.8	0	0	0	0	114.8	P896	P896-T898 PolarHBondContact O-N 2.96Å
899	G	69.7	Low	74.3	Confident	25 Å²	25	61.7 Å²	61.7	26%	0.258	37%	0.371	S	S	.	.			trans	98	168.7	-175	0	0	0	0	0	113.8	I897 Y1038	I897-G899 PolarHBondContact O-N 3.23Å; G899-Y1038 VanDerWaalsContact C-CE1 3.47Å
900	F	70.2	Confident	73.6	Confident	80 Å²	80	65.9 Å²	65.9	35%	0.351	40%	0.401	S	S	.	.			trans	-71.8	145.2	173.6	177.7	-115.2	0	0	0	111.5	P902 L904 F909 L1030 L1034 Y1038	F900-P902 HydrophobicContact CE1-CB 4.43Å; F900-L904 HydrophobicContact CD2-CD2 4.35Å; F900-F909 HydrophobicContact CD2-CZ 4.31Å; F900-F909 HydrophobicContact CE2-CZ 4.03Å; F900-L1030 HydrophobicContact CZ-CD1 4.45Å; F900-L1034 HydrophobicContact CD1-CD2 4.22Å; F900-L1034 HydrophobicContact CD2-CD1 3.72Å; F900-L1034 HydrophobicContact CD2-CD2 4.05Å; F900-L1034 HydrophobicContact CD2-CG 4.4Å; F900-L1034 HydrophobicContact CE1-CD2 4.05Å; F900-L1034 HydrophobicContact CE2-CD1 4.05Å; F900-L1034 HydrophobicContact CE2-CD2 3.88Å; F900-L1034 HydrophobicContact CG-CD1 4.27Å; F900-L1034 HydrophobicContact CG-CD2 4.21Å; F900-L1034 HydrophobicContact CZ-CD2 3.88Å; F900-Y1038 HydrophobicContact CB-CD1 4.12Å; F900-Y1038 HydrophobicContact CB-CD2 3.72Å; F900-Y1038 HydrophobicContact CB-CE2 4.18Å; F900-Y1038 HydrophobicContact CB-CG 3.67Å; F900-Y1038 VanDerWaalsContact N-CD1 3.32Å
901	S	63.9	Low	73.4	Confident	49 Å²	49	71.7 Å²	71.7	34%	0.343	42%	0.421	S	S	.	.			trans	-130.4	134.9	165.9	173.3	0	0	0	0	107.8	N903 L904	S901-N903 PolarHBondContact O-N 3.48Å; S901-N903 PolarHBondContact OG-N 3.31Å; S901-L904 WeakPolarHBondContact O-CB 3.34Å; S901-L904 PolarHBondContact O-N 3.37Å
902	P	66.8	Low	73.4	Confident	108 Å²	108	68.1 Å²	68.1	70%	0.701	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-15.2	178.4	27.5	-35.7	0	0	0	113.1	F900 L904	F900-P902 HydrophobicContact CE1-CB 4.43Å; P902-L904 VanDerWaalsContact C-N 3.3Å
903	N	63.9	Low	73.7	Confident	148 Å²	148	67.7 Å²	67.7	79%	0.791	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	11.5	174.9	-63	-11.9	0	0	0	113	S901 S905	S901-N903 PolarHBondContact O-N 3.48Å; S901-N903 PolarHBondContact OG-N 3.31Å; N903-S905 PolarHBondContact O-N 3.05Å
904	L	67.2	Low	73.8	Confident	39 Å²	39	73.1 Å²	73.1	20%	0.204	42%	0.423	C	S	.	.			trans	-60.6	127.8	172.9	-115.6	67	0	0	0	110.5	P896 F900 S901 P902 T908 F909	P896-L904 HydrophobicContact CG-CD1 4.24Å; P896-L904 HydrophobicContact CG-CD2 3.91Å; F900-L904 HydrophobicContact CD2-CD2 4.35Å; S901-L904 WeakPolarHBondContact O-CB 3.34Å; S901-L904 PolarHBondContact O-N 3.37Å; P902-L904 VanDerWaalsContact C-N 3.3Å; L904-T908 HydrophobicContact CD2-CG2 3.58Å; L904-T908 HydrophobicContact CG-CG2 3.85Å; L904-F909 HydrophobicContact CB-CE2 4.09Å; L904-F909 HydrophobicContact CB-CZ 4.43Å; L904-F909 HydrophobicContact CD2-CE1 4.14Å; L904-F909 HydrophobicContact CD2-CE2 3.89Å; L904-F909 HydrophobicContact CD2-CZ 3.54Å
905	S	61.2	Low	74.3	Confident	61 Å²	61	72.5 Å²	72.5	43%	0.427	41%	0.41	S	S	.	.			trans	-61.9	144.9	169.8	71.6	0	0	0	0	110.4	N903 L907 T908	N903-S905 PolarHBondContact O-N 3.05Å; S905-L907 PolarHBondContact O-N 2.87Å; S905-L907 VanDerWaalsContact O-N 3.08Å; S905-T908 VanDerWaalsContact O-CB 3.28Å; S905-T908 WeakPolarHBondContact O-CB 3.3Å; S905-T908 PolarHBondContact O-N 3.17Å; S905-T908 PolarHBondContact O-OG1 2.83Å; S905-T908 PolarHBondContact OG-N 3.43Å; S905-T908 PolarHBondContact OG-OG1 2.94Å
906	S	64.9	Low	74.7	Confident	104 Å²	104	72.2 Å²	72.2	73%	0.727	41%	0.408	S	S	*	.	H	α-helix	trans	-53.7	-29.7	170.2	175.8	0	0	0	0	112.1	T908 F909 S910	S906-T908 PolarHBondContact O-N 2.85Å; S906-F909 PolarHBondContact O-N 2.81Å; S906-S910 PolarHBondContact O-N 3.01Å
907	L	66.1	Low	75.4	Confident	138 Å²	138	70.9 Å²	70.9	72%	0.723	40%	0.399	S	S	*	.	H	α-helix	trans	-60.5	-25.6	174	-151.7	75.2	0	0	0	113.7	S905 F909 S910	S905-L907 PolarHBondContact O-N 2.87Å; S905-L907 VanDerWaalsContact O-N 3.08Å; L907-F909 PolarHBondContact O-N 2.87Å; L907-S910 PolarHBondContact O-N 3.38Å; L907-S910 PolarHBondContact O-OG 2.95Å
908	T	69.1	Low	76	Confident	42 Å²	42	64.7 Å²	64.7	26%	0.258	37%	0.368	S	S	.	.	H	α-helix	trans	-68.5	-26.1	175.2	-50.2	0	0	0	0	112	P896 L904 S905 S906	P896-T908 HydrophobicContact CG-CG2 4.48Å; L904-T908 HydrophobicContact CD2-CG2 3.58Å; L904-T908 HydrophobicContact CG-CG2 3.85Å; S905-T908 VanDerWaalsContact O-CB 3.28Å; S905-T908 WeakPolarHBondContact O-CB 3.3Å; S905-T908 PolarHBondContact O-N 3.17Å; S905-T908 PolarHBondContact O-OG1 2.83Å; S905-T908 PolarHBondContact OG-N 3.43Å; S905-T908 PolarHBondContact OG-OG1 2.94Å; S906-T908 PolarHBondContact O-N 2.85Å
909	F	75	Confident	77	Confident	30 Å²	30	59.7 Å²	59.7	13%	0.132	33%	0.334	C	S	.	.	H	α-helix	trans	-90.1	-12.6	176.7	-63	-67.9	0	0	0	113.3	L895 F900 L904 S906 L907 R911 V912 P1031 Y1033 L1034	L895-F909 HydrophobicContact CD2-CD1 3.74Å; L895-F909 HydrophobicContact CD2-CE1 4Å; F900-F909 HydrophobicContact CD2-CZ 4.31Å; F900-F909 HydrophobicContact CE2-CZ 4.03Å; L904-F909 HydrophobicContact CB-CE2 4.09Å; L904-F909 HydrophobicContact CB-CZ 4.43Å; L904-F909 HydrophobicContact CD2-CE1 4.14Å; L904-F909 HydrophobicContact CD2-CE2 3.89Å; L904-F909 HydrophobicContact CD2-CZ 3.54Å; S906-F909 PolarHBondContact O-N 2.81Å; L907-F909 PolarHBondContact O-N 2.87Å; F909-R911 PolarHBondContact O-N 2.86Å; F909-V912 WeakPolarHBondContact O-CB 3.49Å; F909-V912 PolarHBondContact O-N 2.79Å; F909-P1031 HydrophobicContact CD1-CG 4.29Å; F909-P1031 HydrophobicContact CG-CG 4.34Å; F909-Y1033 AromaticContact CD1-CE2 3.96Å; F909-Y1033 HydrophobicContact CD1-CE2 3.96Å; F909-Y1033 WeakPolarHBondContact CD1-OH 3.32Å; F909-Y1033 HydrophobicContact CE1-CE2 4.29Å; F909-L1034 HydrophobicContact CE1-CD1 3.87Å; F909-L1034 HydrophobicContact CZ-CD1 3.94Å
910	S	73.9	Confident	78	Confident	89 Å²	89	58.6 Å²	58.6	62%	0.622	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-5.6	-172	77.7	0	0	0	0	115.5	S906 L907	S906-S910 PolarHBondContact O-N 3.01Å; L907-S910 PolarHBondContact O-N 3.38Å; L907-S910 PolarHBondContact O-OG 2.95Å
911	R	81.1	Confident	79	Confident	140 Å²	140	55.9 Å²	55.9	53%	0.528	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-11.7	177	-179.7	178.3	161.6	163.3	-5	113.1	V891 D892 F893 F909 R999	V891-R911 PolarHBondContact O-NH2 3.18Å; D892-R911 PolarHBondContact O-NE 2.68Å; D892-R911 PolarHBondContact O-NH2 3.12Å; F893-R911 VanDerWaalsContact O-CB 3.23Å; F893-R911 WeakPolarHBondContact O-CB 3.48Å; F893-R911 WeakPolarHBondContact O-CD 3.3Å; F893-R911 WeakPolarHBondContact O-CG 3.36Å; F909-R911 PolarHBondContact O-N 2.86Å; R911-R999 PolarHBondContact O-NH1 3.31Å; R911-R999 PolarHBondContact O-NH2 3.34Å
912	V	86.2	Confident	80.3	Confident	14 Å²	14	60 Å²	60	9%	0.085	32%	0.321	C	S	.	.	S	Bend	trans	-69.4	132.8	166.8	-175	0	0	0	0	108.3	F893 L895 F909 E914 F916 Y1033	F893-V912 HydrophobicContact CB-CB 4.49Å; F893-V912 HydrophobicContact CB-CG2 3.87Å; F893-V912 HydrophobicContact CD2-CB 4.46Å; F893-V912 HydrophobicContact CD2-CG1 3.91Å; F893-V912 HydrophobicContact CD2-CG2 4.19Å; F893-V912 HydrophobicContact CE2-CG1 4.17Å; F893-V912 HydrophobicContact CG-CG1 4.37Å; F893-V912 HydrophobicContact CG-CG2 4.29Å; L895-V912 HydrophobicContact CD1-CG2 3.99Å; L895-V912 HydrophobicContact CD2-CG2 3.76Å; L895-V912 HydrophobicContact CG-CG2 3.96Å; F909-V912 WeakPolarHBondContact O-CB 3.49Å; F909-V912 PolarHBondContact O-N 2.79Å; V912-E914 PolarHBondContact O-N 3.42Å; V912-F916 HydrophobicContact CG1-CB 4.32Å; V912-F916 HydrophobicContact CG1-CD1 4.22Å; V912-Y1033 HydrophobicContact CB-CE1 4.23Å; V912-Y1033 HydrophobicContact CG1-CD1 4.12Å; V912-Y1033 HydrophobicContact CG1-CE1 3.59Å; V912-Y1033 HydrophobicContact CG1-CE2 4.26Å; V912-Y1033 HydrophobicContact CG2-CE2 3.96Å; V912-Y1033 WeakPolarHBondContact CG2-OH 3.06Å
913	P	89.4	Confident	81.6	Confident	13 Å²	13	60.3 Å²	60.3	8%	0.084	31%	0.313	C	S	.	.			trans	-64.5	134.5	175.6	-18.6	30.8	0	0	0	111.9	F893 W915 F916	F893-P913 HydrophobicContact CD1-CG 4.32Å; F893-P913 VanDerWaalsContact CE1-CD 3.46Å; F893-P913 HydrophobicContact CE1-CG 3.85Å; F893-P913 HydrophobicContact CZ-CG 4.34Å; P913-W915 HydrophobicContact CB-CD2 3.65Å; P913-W915 HydrophobicContact CB-CE3 4.12Å; P913-W915 HydrophobicContact CB-CG 4.14Å; P913-W915 HydrophobicContact CB-CH2 3.99Å; P913-W915 HydrophobicContact CB-CZ2 3.48Å; P913-W915 VanDerWaalsContact CB-CZ2 3.48Å; P913-W915 HydrophobicContact CB-CZ3 4.28Å; P913-W915 HydrophobicContact CG-CH2 3.85Å; P913-W915 HydrophobicContact CG-CZ2 3.63Å; P913-W915 HydrophobicContact CG-CZ3 4.39Å; P913-W915 PolarHBondContact O-N 3.03Å; P913-W915 VanDerWaalsContact O-N 3.07Å; P913-F916 WeakPolarHBondContact O-CB 3.45Å; P913-F916 PolarHBondContact O-N 2.97Å
914	E	89.8	Confident	82.9	Confident	115 Å²	115	56.3 Å²	56.3	54%	0.537	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	-37.4	179	177.9	176.6	-167.8	0	0	113.3	V912 F916 G1024 Q1025	V912-E914 PolarHBondContact O-N 3.42Å; E914-F916 VanDerWaalsContact C-N 3.27Å; E914-F916 PolarHBondContact O-N 2.95Å; E914-G1024 VanDerWaalsContact CG-CA 3.42Å; E914-G1024 PolarHBondContact OE1-N 3.29Å; E914-Q1025 PolarHBondContact O-NE2 3Å
915	W	93.2	Very high	84.2	Confident	24 Å²	24	54.4 Å²	54.4	9%	0.091	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-2.1	-179.3	50.2	-106.8	0	0	0	115.3	P913 H917 F938 L940 L998 R999 V1002 P1022	P913-W915 HydrophobicContact CB-CD2 3.65Å; P913-W915 HydrophobicContact CB-CE3 4.12Å; P913-W915 HydrophobicContact CB-CG 4.14Å; P913-W915 HydrophobicContact CB-CH2 3.99Å; P913-W915 HydrophobicContact CB-CZ2 3.48Å; P913-W915 VanDerWaalsContact CB-CZ2 3.48Å; P913-W915 HydrophobicContact CB-CZ3 4.28Å; P913-W915 HydrophobicContact CG-CH2 3.85Å; P913-W915 HydrophobicContact CG-CZ2 3.63Å; P913-W915 HydrophobicContact CG-CZ3 4.39Å; P913-W915 PolarHBondContact O-N 3.03Å; P913-W915 VanDerWaalsContact O-N 3.07Å; W915-H917 PolarHBondContact O-CD2 2.88Å; W915-F938 HydrophobicContact CB-CD2 4.21Å; W915-F938 HydrophobicContact CB-CE2 3.66Å; W915-F938 HydrophobicContact CB-CZ 4.27Å; W915-F938 AromaticContact CD1-CE2 3.82Å; W915-F938 AromaticContact CD1-CZ 3.84Å; W915-F938 HydrophobicContact CD2-CE2 4.34Å; W915-F938 AromaticContact CG-CE2 3.67Å; W915-F938 HydrophobicContact CG-CE2 3.67Å; W915-F938 HydrophobicContact CG-CZ 4.15Å; W915-L940 HydrophobicContact CE3-CB 3.81Å; W915-L940 HydrophobicContact CE3-CD1 4.45Å; W915-L940 HydrophobicContact CZ3-CB 4.16Å; W915-L940 HydrophobicContact CZ3-CD1 4.03Å; W915-L940 HydrophobicContact CZ3-CG 4.48Å; W915-L940 PolarHBondContact O-N 3.01Å; W915-L998 HydrophobicContact CH2-CB 3.89Å; W915-L998 HydrophobicContact CZ3-CB 4.35Å; W915-R999 HydrophobicContact CZ2-CG 4.5Å; W915-V1002 HydrophobicContact CD2-CG2 4.26Å; W915-V1002 HydrophobicContact CE3-CG2 4.35Å; W915-V1002 HydrophobicContact CH2-CG2 3.95Å; W915-V1002 HydrophobicContact CZ2-CB 4.07Å; W915-V1002 HydrophobicContact CZ2-CG1 4.36Å; W915-V1002 HydrophobicContact CZ2-CG2 3.83Å; W915-V1002 HydrophobicContact CZ3-CG2 4.21Å; W915-P1022 HydrophobicContact CB-CB 3.87Å; W915-P1022 HydrophobicContact CG-CB 4.31Å
916	F	93.8	Very high	85.7	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	117.8	-177.5	-176.9	-93.7	0	0	0	111.7	L889 F893 V912 P913 E914 L940 Y949 L998 Q1025 Y1033 I1036 F1037	L889-F916 HydrophobicContact CD1-CE2 3.96Å; L889-F916 HydrophobicContact CD1-CZ 3.88Å; F893-F916 AromaticContact CE2-CD1 3.66Å; F893-F916 HydrophobicContact CE2-CD1 3.66Å; F893-F916 HydrophobicContact CE2-CD2 4.04Å; F893-F916 AromaticContact CE2-CE1 3.74Å; F893-F916 HydrophobicContact CE2-CE1 3.74Å; F893-F916 HydrophobicContact CE2-CE2 4.12Å; F893-F916 AromaticContact CE2-CG 3.82Å; F893-F916 HydrophobicContact CE2-CG 3.82Å; F893-F916 AromaticContact CE2-CZ 3.97Å; F893-F916 HydrophobicContact CE2-CZ 3.97Å; F893-F916 HydrophobicContact CZ-CB 4.49Å; F893-F916 HydrophobicContact CZ-CD1 4.3Å; F893-F916 AromaticContact CZ-CD2 3.91Å; F893-F916 HydrophobicContact CZ-CD2 3.91Å; F893-F916 HydrophobicContact CZ-CE2 4.19Å; F893-F916 AromaticContact CZ-CG 3.97Å; F893-F916 HydrophobicContact CZ-CG 3.97Å; V912-F916 HydrophobicContact CG1-CB 4.32Å; V912-F916 HydrophobicContact CG1-CD1 4.22Å; P913-F916 WeakPolarHBondContact O-CB 3.45Å; P913-F916 PolarHBondContact O-N 2.97Å; E914-F916 VanDerWaalsContact C-N 3.27Å; E914-F916 PolarHBondContact O-N 2.95Å; F916-L940 HydrophobicContact CD2-CD2 4.01Å; F916-L940 HydrophobicContact CE2-CD2 4.24Å; F916-Y949 HydrophobicContact CE2-CE1 4.09Å; F916-L998 HydrophobicContact CE2-CD1 4.32Å; F916-Q1025 PolarHBondContact O-NE2 3.4Å; F916-Y1033 HydrophobicContact CD1-CD1 4.09Å; F916-Y1033 HydrophobicContact CD1-CG 4.07Å; F916-Y1033 HydrophobicContact CE1-CG 4.25Å; F916-Y1033 WeakPolarHBondContact O-CD1 3.33Å; F916-I1036 HydrophobicContact CE1-CD1 3.85Å; F916-I1036 HydrophobicContact CZ-CD1 3.84Å; F916-F1037 AromaticContact CE1-CE2 3.94Å; F916-F1037 HydrophobicContact CE1-CE2 3.94Å; F916-F1037 HydrophobicContact CE1-CZ 4.11Å; F916-F1037 HydrophobicContact CZ-CZ 4.39Å
917	H	91.9	Very high	87.1	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	-2.7	-169	-75.7	-127.5	0	0	0	115.4	W915 L920 L940 H941 V1023 G1024 D1032	W915-H917 PolarHBondContact O-CD2 2.88Å; H917-L920 HydrophobicContact CB-CB 4.31Å; H917-L920 HydrophobicContact CB-CD2 3.94Å; H917-L940 PolarHBondContact N-O 3.31Å; H917-H941 HydrophobicContact CB-CB 4.27Å; H917-V1023 PolarHBondContact NE2-O 3.01Å; H917-G1024 PolarHBondContact CE1-O 2.99Å; H917-G1024 PolarHBondContact NE2-O 2.8Å; H917-D1032 CarbonylContact O-C 3.53Å
918	G	90.5	Very high	88.4	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	64	-137.7	-173.5	0	0	0	0	0	112.7	L920 H941 L942 I1036	G918-L920 PolarHBondContact O-N 2.91Å; G918-H941 CarbonylContact O-C 3.5Å; G918-H941 WeakPolarHBondContact O-CA 3.39Å; G918-H941 WeakPolarHBondContact O-CB 3.2Å; G918-L942 PolarHBondContact O-N 3.38Å; G918-I1036 VanDerWaalsContact CA-CD1 3.44Å
919	F	90	Very high	89.5	Confident	34 Å²	34	47.1 Å²	47.1	15%	0.149	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	117.6	174.9	-85.8	-58	0	0	0	110.9	K874 V877 Y878 L942 E944 I1036	K874-F919 HydrophobicContact CG-CE1 4.49Å; K874-F919 HydrophobicContact CG-CZ 4.42Å; V877-F919 HydrophobicContact CB-CE1 4.06Å; V877-F919 HydrophobicContact CB-CZ 3.92Å; V877-F919 HydrophobicContact CG1-CE1 3.71Å; V877-F919 HydrophobicContact CG1-CZ 3.73Å; Y878-F919 HydrophobicContact CD2-CE2 4.23Å; F919-L942 HydrophobicContact CD1-CB 3.59Å; F919-L942 HydrophobicContact CD1-CD1 4.43Å; F919-L942 HydrophobicContact CE1-CB 3.76Å; F919-L942 HydrophobicContact CE1-CD1 4.37Å; F919-L942 HydrophobicContact CE2-CD1 4.47Å; F919-L942 HydrophobicContact CG-CB 4.26Å; F919-L942 HydrophobicContact CZ-CD1 4.38Å; F919-E944 HydrophobicContact CD1-CG 4.37Å; F919-I1036 HydrophobicContact CB-CG2 4.32Å; F919-I1036 HydrophobicContact CD2-CG2 3.25Å; F919-I1036 HydrophobicContact CE2-CG2 3.77Å; F919-I1036 HydrophobicContact CG-CG2 4.01Å
920	L	90.8	Very high	90.3	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.01	23%	0.232	C	C	.	.			trans	-138.2	130.7	179.7	-165.8	72.9	0	0	0	108.7	H917 G918 Q924 A925 L928 L939 H941	H917-L920 HydrophobicContact CB-CB 4.31Å; H917-L920 HydrophobicContact CB-CD2 3.94Å; G918-L920 PolarHBondContact O-N 2.91Å; L920-Q924 HydrophobicContact CD1-CB 3.58Å; L920-Q924 HydrophobicContact CD1-CG 4.36Å; L920-Q924 HydrophobicContact CG-CB 3.74Å; L920-A925 HydrophobicContact CD2-CB 3.87Å; L920-L928 HydrophobicContact CD1-CD1 4.26Å; L920-L928 HydrophobicContact CD2-CD1 4.18Å; L920-L939 HydrophobicContact CD2-CD1 3.73Å; L920-L939 HydrophobicContact CD2-CD2 4.15Å; L920-H941 HydrophobicContact CB-CB 3.59Å; L920-H941 HydrophobicContact CD2-CB 4.29Å; L920-H941 PolarHBondContact O-CE1 3.18Å; L920-H941 PolarHBondContact O-ND1 3.1Å
921	S	90.5	Very high	91	Very high	24 Å²	24	53.2 Å²	53.2	17%	0.168	24%	0.238	C	C	.	.			trans	-65.5	159.3	173.8	107	0	0	0	0	110.6	E923 Q924 A925	S921-E923 VanDerWaalsContact C-N 3.26Å; S921-E923 WeakPolarHBondContact CB-OE2 3.47Å; S921-E923 PolarHBondContact O-N 3.44Å; S921-E923 PolarHBondContact OG-N 3.11Å; S921-E923 PolarHBondContact OG-OE2 2.98Å; S921-Q924 PolarHBondContact O-N 2.76Å; S921-Q924 PolarHBondContact OG-N 2.97Å; S921-A925 PolarHBondContact O-N 3.24Å
922	R	92.1	Very high	91.2	Very high	135 Å²	135	48.3 Å²	48.3	51%	0.509	23%	0.225	S	C	.	.	H	α-helix	trans	-61.7	-40.4	176.4	-179.4	-179	166	-153.1	-13.5	110.9	Q924 A925 E926 H961	R922-Q924 VanDerWaalsContact C-N 3.34Å; R922-A925 WeakPolarHBondContact O-CB 3.43Å; R922-A925 PolarHBondContact O-N 3.16Å; R922-E926 HydrophobicContact CG-CG 4.37Å; R922-E926 IonicContact CZ-OE1 2.69Å; R922-E926 IonicContact NE-OE1 3.9Å; R922-E926 PolarHBondContact NE-OE1 3.34Å; R922-E926 IonicContact NH2-OE1 2.65Å; R922-E926 PolarHBondContact NH2-OE1 2.79Å; R922-E926 WeakPolarHBondContact O-CG 3.38Å; R922-E926 PolarHBondContact O-N 3.04Å; R922-H961 PolarHBondContact NE-CD2 3.27Å; R922-H961 PolarHBondContact NE-NE2 3.15Å
923	E	92.5	Very high	91.1	Very high	114 Å²	114	53.8 Å²	53.8	53%	0.533	25%	0.253	S	S	.	.	H	α-helix	trans	-67.4	-36.5	179.7	-53.4	65.3	-139.9	0	0	110.6	S921 R927	S921-E923 VanDerWaalsContact C-N 3.26Å; S921-E923 WeakPolarHBondContact CB-OE2 3.47Å; S921-E923 PolarHBondContact O-N 3.44Å; S921-E923 PolarHBondContact OG-N 3.11Å; S921-E923 PolarHBondContact OG-OE2 2.98Å; E923-R927 WeakPolarHBondContact O-CB 3.3Å; E923-R927 WeakPolarHBondContact O-CG 3.29Å; E923-R927 PolarHBondContact O-N 3.31Å; E923-R927 PolarHBondContact O-NE 3.46Å
924	Q	92.1	Very high	91.1	Very high	64 Å²	64	58.8 Å²	58.8	30%	0.299	27%	0.274	S	S	.	.	H	α-helix	trans	-64	-47.7	170.2	-66.6	-179.5	-85.4	0	0	111.5	L920 S921 R922 E926 R927 L928 E1026	L920-Q924 HydrophobicContact CD1-CB 3.58Å; L920-Q924 HydrophobicContact CD1-CG 4.36Å; L920-Q924 HydrophobicContact CG-CB 3.74Å; S921-Q924 PolarHBondContact O-N 2.76Å; S921-Q924 PolarHBondContact OG-N 2.97Å; R922-Q924 VanDerWaalsContact C-N 3.34Å; Q924-E926 PolarHBondContact O-N 3.06Å; Q924-R927 PolarHBondContact O-N 2.97Å; Q924-L928 WeakPolarHBondContact O-CG 3.47Å; Q924-L928 PolarHBondContact O-N 3.36Å; Q924-E1026 PolarHBondContact NE2-OE2 2.93Å
925	A	93.7	Very high	91.1	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-57.9	-48.3	176.2	0	0	0	0	0	112.1	L920 S921 R922 R927 L928 L929 L939	L920-A925 HydrophobicContact CD2-CB 3.87Å; S921-A925 PolarHBondContact O-N 3.24Å; R922-A925 WeakPolarHBondContact O-CB 3.43Å; R922-A925 PolarHBondContact O-N 3.16Å; A925-R927 PolarHBondContact O-N 3.06Å; A925-L928 PolarHBondContact O-N 3Å; A925-L929 WeakPolarHBondContact O-CB 3.37Å; A925-L929 VanDerWaalsContact O-CG 3.22Å; A925-L929 WeakPolarHBondContact O-CG 3.47Å; A925-L929 PolarHBondContact O-N 2.85Å; A925-L939 HydrophobicContact CB-CD1 3.94Å
926	E	94.3	Very high	90.9	Very high	56 Å²	56	56.6 Å²	56.6	26%	0.262	27%	0.268	S	S	.	.	H	α-helix	trans	-62.1	-39.2	179	-70.8	-173.1	176	0	0	112.5	R922 Q924 T930 C959 H961	R922-E926 HydrophobicContact CG-CG 4.37Å; R922-E926 IonicContact CZ-OE1 2.69Å; R922-E926 IonicContact NE-OE1 3.9Å; R922-E926 PolarHBondContact NE-OE1 3.34Å; R922-E926 IonicContact NH2-OE1 2.65Å; R922-E926 PolarHBondContact NH2-OE1 2.79Å; R922-E926 WeakPolarHBondContact O-CG 3.38Å; R922-E926 PolarHBondContact O-N 3.04Å; Q924-E926 PolarHBondContact O-N 3.06Å; E926-T930 VanDerWaalsContact O-CB 3.27Å; E926-T930 WeakPolarHBondContact O-CB 3.47Å; E926-T930 PolarHBondContact O-N 3.38Å; E926-T930 PolarHBondContact O-OG1 3.04Å; E926-C959 HydrophobicContact CG-CB 3.72Å; E926-H961 IonicContact OE1-CE1 3.27Å; E926-H961 IonicContact OE1-NE2 2.7Å; E926-H961 PolarHBondContact OE1-NE2 2.81Å
927	R	93.3	Very high	91	Very high	129 Å²	129	56.7 Å²	56.7	49%	0.487	27%	0.268	S	S	.	.	H	α-helix	trans	-63.4	-46.8	174.6	-72.3	177.1	-45.4	127.6	25.4	112.3	E923 Q924 A925 T930 K931 E1026	E923-R927 WeakPolarHBondContact O-CB 3.3Å; E923-R927 WeakPolarHBondContact O-CG 3.29Å; E923-R927 PolarHBondContact O-N 3.31Å; E923-R927 PolarHBondContact O-NE 3.46Å; Q924-R927 PolarHBondContact O-N 2.97Å; A925-R927 PolarHBondContact O-N 3.06Å; R927-T930 PolarHBondContact O-N 3.32Å; R927-K931 WeakPolarHBondContact O-CB 3.22Å; R927-K931 PolarHBondContact O-N 3.32Å; R927-E1026 IonicContact CZ-OE1 2.67Å; R927-E1026 IonicContact NH1-OE1 3.68Å; R927-E1026 PolarHBondContact NH1-OE1 3.38Å; R927-E1026 IonicContact NH2-OE1 2.75Å; R927-E1026 PolarHBondContact NH2-OE1 3.4Å; R927-E1026 IonicContact NH2-OE2 2.74Å; R927-E1026 PolarHBondContact NH2-OE2 2.93Å
928	L	92.9	Very high	91.1	Very high	7 Å²	7	57 Å²	57	4%	0.037	27%	0.27	C	S	.	.	H	α-helix	trans	-67.3	-38.8	-178.1	-67.5	170.4	0	0	0	112.2	L920 Q924 A925 S932 L939 V1023 E1026	L920-L928 HydrophobicContact CD1-CD1 4.26Å; L920-L928 HydrophobicContact CD2-CD1 4.18Å; Q924-L928 WeakPolarHBondContact O-CG 3.47Å; Q924-L928 PolarHBondContact O-N 3.36Å; A925-L928 PolarHBondContact O-N 3Å; L928-S932 PolarHBondContact O-OG 3.35Å; L928-L939 HydrophobicContact CB-CD2 4.04Å; L928-L939 HydrophobicContact CD1-CD2 4.38Å; L928-V1023 HydrophobicContact CB-CG1 4.21Å; L928-E1026 HydrophobicContact CD1-CB 4.14Å; L928-E1026 HydrophobicContact CD2-CB 3.95Å; L928-E1026 HydrophobicContact CD2-CG 4.09Å
929	L	93.5	Very high	91.4	Very high	0 Å²	0	57 Å²	57	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-64.4	-49	172.9	-71.6	176.6	0	0	0	111.9	A925 K931 S932 S937 L939 F954 V1023	A925-L929 WeakPolarHBondContact O-CB 3.37Å; A925-L929 VanDerWaalsContact O-CG 3.22Å; A925-L929 WeakPolarHBondContact O-CG 3.47Å; A925-L929 PolarHBondContact O-N 2.85Å; L929-K931 VanDerWaalsContact C-N 3.31Å; L929-K931 PolarHBondContact O-N 3Å; L929-S932 WeakPolarHBondContact O-CB 3.48Å; L929-S932 PolarHBondContact O-N 2.85Å; L929-S937 WeakPolarHBondContact CD2-O 3.24Å; L929-L939 HydrophobicContact CD2-CD2 4.26Å; L929-L939 HydrophobicContact CD2-CG 4.24Å; L929-L939 HydrophobicContact CG-CD2 4.16Å; L929-L939 HydrophobicContact CG-CG 4.37Å; L929-F954 HydrophobicContact CB-CB 4.26Å; L929-V1023 HydrophobicContact CD2-CG2 4.05Å
930	T	90.5	Very high	91.6	Very high	77 Å²	77	55.4 Å²	55.4	47%	0.472	26%	0.263	S	S	.	.	H	α-helix	trans	-63	-37	180	-54.7	0	0	0	0	111.8	E926 R927 S932 D933	E926-T930 VanDerWaalsContact O-CB 3.27Å; E926-T930 WeakPolarHBondContact O-CB 3.47Å; E926-T930 PolarHBondContact O-N 3.38Å; E926-T930 PolarHBondContact O-OG1 3.04Å; R927-T930 PolarHBondContact O-N 3.32Å; T930-S932 PolarHBondContact O-N 2.9Å; T930-S932 VanDerWaalsContact O-N 3.12Å; T930-D933 PolarHBondContact O-N 3.41Å
931	K	89	Confident	91.8	Very high	170 Å²	170	55.5 Å²	55.5	74%	0.739	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-22.5	173.9	-178.5	-176.7	175.3	-170.6	0	113.4	R927 L929	R927-K931 WeakPolarHBondContact O-CB 3.22Å; R927-K931 PolarHBondContact O-N 3.32Å; L929-K931 VanDerWaalsContact C-N 3.31Å; L929-K931 PolarHBondContact O-N 3Å
932	S	85.3	Confident	91.8	Very high	37 Å²	37	54.4 Å²	54.4	26%	0.259	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-22.6	-179	-58.4	0	0	0	0	114	L928 L929 T930 K934 S937 V1023	L928-S932 PolarHBondContact O-OG 3.35Å; L929-S932 WeakPolarHBondContact O-CB 3.48Å; L929-S932 PolarHBondContact O-N 2.85Å; T930-S932 PolarHBondContact O-N 2.9Å; T930-S932 VanDerWaalsContact O-N 3.12Å; S932-K934 WeakPolarHBondContact O-CG 3.47Å; S932-K934 PolarHBondContact O-N 2.87Å; S932-S937 WeakPolarHBondContact CB-OG 3.27Å; S932-V1023 WeakPolarHBondContact OG-CG2 3.34Å
933	D	84	Confident	91.5	Very high	128 Å²	128	50.4 Å²	50.4	68%	0.684	24%	0.244	S	C	*	.			trans	39.2	39.3	-178.6	-158.2	26	0	0	0	116.2	T930	T930-D933 PolarHBondContact O-N 3.41Å
934	K	88.7	Confident	91.1	Very high	118 Å²	118	48.3 Å²	48.3	51%	0.513	23%	0.234	S	C	.	.			trans	-122	121.3	-180	-74	161.1	-172	172.4	0	110.4	S932 G936 S937 F954 Y1021	S932-K934 WeakPolarHBondContact O-CG 3.47Å; S932-K934 PolarHBondContact O-N 2.87Å; K934-G936 PolarHBondContact O-N 3.08Å; K934-S937 VanDerWaalsContact O-CB 3.23Å; K934-S937 WeakPolarHBondContact O-CB 3.39Å; K934-S937 PolarHBondContact O-N 3.24Å; K934-F954 WeakPolarHBondContact O-CD1 3.24Å; K934-Y1021 HydrophobicContact CB-CD2 3.74Å; K934-Y1021 HydrophobicContact CB-CE2 4.13Å; K934-Y1021 HydrophobicContact CB-CG 4.46Å; K934-Y1021 HydrophobicContact CD-CD2 4.4Å; K934-Y1021 HydrophobicContact CD-CG 4.42Å
935	N	90	Very high	90.7	Very high	93 Å²	93	49.7 Å²	49.7	50%	0.497	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	125.3	171.5	-67.8	-47.6	0	0	0	109.8	S956 Y1021	N935-S956 WeakPolarHBondContact OD1-CA 3.37Å; N935-S956 PolarHBondContact OD1-N 3.41Å; N935-Y1021 VanDerWaalsContact O-CE2 3.32Å; N935-Y1021 WeakPolarHBondContact O-CE2 3.45Å
936	G	90.5	Very high	90.3	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.2	1.7	-171	0	0	0	0	0	114.5	K934 F954 L1018 L1020 Y1021	K934-G936 PolarHBondContact O-N 3.08Å; G936-F954 PolarHBondContact N-O 3.48Å; G936-L1018 WeakPolarHBondContact CA-O 3.48Å; G936-L1020 PolarHBondContact O-N 3.44Å; G936-Y1021 PolarHBondContact O-N 3.04Å
937	S	94	Very high	90	Very high	2 Å²	2	53 Å²	53	1%	0.014	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	131.9	169.5	-92.5	0	0	0	0	111.4	L929 S932 K934 L953 F954 Y1021	L929-S937 WeakPolarHBondContact CD2-O 3.24Å; S932-S937 WeakPolarHBondContact CB-OG 3.27Å; K934-S937 VanDerWaalsContact O-CB 3.23Å; K934-S937 WeakPolarHBondContact O-CB 3.39Å; K934-S937 PolarHBondContact O-N 3.24Å; S937-L953 WeakPolarHBondContact O-CA 3.5Å; S937-L953 WeakPolarHBondContact O-CD1 3.46Å; S937-F954 PolarHBondContact O-N 3.36Å; S937-Y1021 CarbonylContact C-O 3.53Å; S937-Y1021 WeakPolarHBondContact CA-O 3.27Å
938	F	95.7	Very high	89.9	Confident	8 Å²	8	46.8 Å²	46.8	4%	0.035	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	157.2	-175.8	77	-83.6	0	0	0	114.3	W915 S952 L953 V1002 L1019 Y1021 P1022 V1023	W915-F938 HydrophobicContact CB-CD2 4.21Å; W915-F938 HydrophobicContact CB-CE2 3.66Å; W915-F938 HydrophobicContact CB-CZ 4.27Å; W915-F938 AromaticContact CD1-CE2 3.82Å; W915-F938 AromaticContact CD1-CZ 3.84Å; W915-F938 HydrophobicContact CD2-CE2 4.34Å; W915-F938 AromaticContact CG-CE2 3.67Å; W915-F938 HydrophobicContact CG-CE2 3.67Å; W915-F938 HydrophobicContact CG-CZ 4.15Å; F938-S952 CarbonylContact C-O 3.47Å; F938-S952 WeakPolarHBondContact CA-O 3.35Å; F938-L953 HydrophobicContact CB-CD1 4.26Å; F938-V1002 HydrophobicContact CE2-CG1 3.53Å; F938-V1002 HydrophobicContact CE2-CG2 4.39Å; F938-V1002 HydrophobicContact CZ-CG1 3.56Å; F938-L1019 HydrophobicContact CB-CD2 3.59Å; F938-L1019 HydrophobicContact CD1-CB 3.68Å; F938-L1019 HydrophobicContact CD1-CD2 4.21Å; F938-L1019 HydrophobicContact CD1-CG 4.5Å; F938-L1019 HydrophobicContact CD2-CB 4.21Å; F938-L1019 HydrophobicContact CD2-CD1 4.3Å; F938-L1019 HydrophobicContact CD2-CD2 3.95Å; F938-L1019 HydrophobicContact CD2-CG 4.38Å; F938-L1019 HydrophobicContact CE1-CB 3.73Å; F938-L1019 HydrophobicContact CE2-CB 4.26Å; F938-L1019 HydrophobicContact CE2-CD1 4.4Å; F938-L1019 HydrophobicContact CG-CB 3.92Å; F938-L1019 HydrophobicContact CG-CD2 3.65Å; F938-L1019 HydrophobicContact CG-CG 4.27Å; F938-L1019 HydrophobicContact CZ-CB 4.03Å; F938-Y1021 WeakPolarHBondContact CD1-O 3.38Å; F938-Y1021 PolarHBondContact N-O 3.35Å; F938-P1022 HydrophobicContact CE1-CB 4.15Å; F938-P1022 HydrophobicContact CZ-CB 4.02Å; F938-V1023 PolarHBondContact O-N 3.07Å
939	L	95.4	Very high	89.9	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	163.4	168.1	60.1	82.4	0	0	0	110.7	L920 A925 L928 L929 H941 S952 V1023	L920-L939 HydrophobicContact CD2-CD1 3.73Å; L920-L939 HydrophobicContact CD2-CD2 4.15Å; A925-L939 HydrophobicContact CB-CD1 3.94Å; L928-L939 HydrophobicContact CB-CD2 4.04Å; L928-L939 HydrophobicContact CD1-CD2 4.38Å; L929-L939 HydrophobicContact CD2-CD2 4.26Å; L929-L939 HydrophobicContact CD2-CG 4.24Å; L929-L939 HydrophobicContact CG-CD2 4.16Å; L929-L939 HydrophobicContact CG-CG 4.37Å; L939-H941 HydrophobicContact CD1-CB 4.46Å; L939-S952 PolarHBondContact N-O 3.46Å; L939-S952 PolarHBondContact O-N 3.42Å; L939-V1023 HydrophobicContact CD2-CB 4.5Å; L939-V1023 HydrophobicContact CD2-CG1 4.45Å
940	L	95.4	Very high	90	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	126.8	179.2	-171.5	157.3	0	0	0	109.8	W915 F916 H917 Y949 V950 I951 L998 V1002	W915-L940 HydrophobicContact CE3-CB 3.81Å; W915-L940 HydrophobicContact CE3-CD1 4.45Å; W915-L940 HydrophobicContact CZ3-CB 4.16Å; W915-L940 HydrophobicContact CZ3-CD1 4.03Å; W915-L940 HydrophobicContact CZ3-CG 4.48Å; W915-L940 PolarHBondContact O-N 3.01Å; F916-L940 HydrophobicContact CD2-CD2 4.01Å; F916-L940 HydrophobicContact CE2-CD2 4.24Å; H917-L940 PolarHBondContact N-O 3.31Å; L940-Y949 HydrophobicContact CD2-CD1 3.59Å; L940-Y949 HydrophobicContact CD2-CE1 4.44Å; L940-Y949 HydrophobicContact CD2-CG 3.84Å; L940-V950 WeakPolarHBondContact CA-O 3.34Å; L940-I951 HydrophobicContact CB-CG1 4.45Å; L940-I951 HydrophobicContact CD1-CD1 4.26Å; L940-I951 HydrophobicContact CD1-CG1 3.83Å; L940-I951 HydrophobicContact CG-CG1 4.1Å; L940-L998 HydrophobicContact CD1-CD2 4.3Å; L940-L998 HydrophobicContact CD2-CD1 4.33Å; L940-V1002 HydrophobicContact CD1-CG2 4.4Å
941	H	94	Very high	90.2	Very high	4 Å²	4	43 Å²	43	2%	0.019	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	166.1	-176.4	64.1	119.2	0	0	0	112.4	H917 G918 L920 L939 Y949 V950 S952	H917-H941 HydrophobicContact CB-CB 4.27Å; G918-H941 CarbonylContact O-C 3.5Å; G918-H941 WeakPolarHBondContact O-CA 3.39Å; G918-H941 WeakPolarHBondContact O-CB 3.2Å; L920-H941 HydrophobicContact CB-CB 3.59Å; L920-H941 HydrophobicContact CD2-CB 4.29Å; L920-H941 PolarHBondContact O-CE1 3.18Å; L920-H941 PolarHBondContact O-ND1 3.1Å; L939-H941 HydrophobicContact CD1-CB 4.46Å; H941-Y949 CarbonylContact O-C 3.46Å; H941-Y949 VanDerWaalsContact O-CA 3.28Å; H941-Y949 WeakPolarHBondContact O-CA 3.32Å; H941-V950 PolarHBondContact CD2-O 3.36Å; H941-V950 PolarHBondContact N-O 2.93Å; H941-V950 PolarHBondContact O-N 2.91Å; H941-S952 PolarHBondContact CD2-OG 3.31Å; H941-S952 PolarHBondContact NE2-OG 3.31Å
942	L	91.4	Very high	90.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	146.6	166	-68.4	166.4	0	0	0	109.7	W880 F881 G918 F919 Y949 I1036	W880-L942 HydrophobicContact CZ3-CD2 3.87Å; F881-L942 HydrophobicContact CB-CD1 4.48Å; F881-L942 HydrophobicContact CD2-CD1 3.78Å; F881-L942 HydrophobicContact CD2-CD2 4.02Å; F881-L942 HydrophobicContact CD2-CG 4.48Å; F881-L942 HydrophobicContact CE2-CD1 4.16Å; F881-L942 HydrophobicContact CG-CD1 4.01Å; G918-L942 PolarHBondContact O-N 3.38Å; F919-L942 HydrophobicContact CD1-CB 3.59Å; F919-L942 HydrophobicContact CD1-CD1 4.43Å; F919-L942 HydrophobicContact CE1-CB 3.76Å; F919-L942 HydrophobicContact CE1-CD1 4.37Å; F919-L942 HydrophobicContact CE2-CD1 4.47Å; F919-L942 HydrophobicContact CG-CB 4.26Å; F919-L942 HydrophobicContact CZ-CD1 4.38Å; L942-Y949 HydrophobicContact CD2-CD1 3.56Å; L942-Y949 HydrophobicContact CD2-CE1 3.5Å; L942-Y949 HydrophobicContact CD2-CG 4.36Å; L942-Y949 HydrophobicContact CG-CD1 4.05Å; L942-Y949 HydrophobicContact CG-CE1 4.07Å; L942-I1036 HydrophobicContact CD1-CD1 3.96Å; L942-I1036 HydrophobicContact CD1-CG2 4.02Å
943	N	84.6	Confident	90.9	Very high	52 Å²	52	33.1 Å²	33.1	28%	0.278	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	139.1	173.8	-174.5	-52.1	0	0	0	109.5	S945 F946 V950	N943-S945 PolarHBondContact O-N 2.81Å; N943-S945 PolarHBondContact OD1-N 2.92Å; N943-F946 HydrophobicContact CB-CB 4.06Å; N943-V950 HydrophobicContact CB-CG2 3.69Å
944	E	84.2	Confident	91.3	Very high	70 Å²	70	27.6 Å²	27.6	33%	0.327	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-17.6	-178.6	-56.1	-174.5	143.1	0	0	113.7	P873 K874 F919	P873-E944 CarbonylContact C-O 3.05Å; K874-E944 WeakPolarHBondContact CA-O 3.22Å; K874-E944 HydrophobicContact CB-CB 4.18Å; K874-E944 HydrophobicContact CD-CB 4.46Å; K874-E944 HydrophobicContact CD-CG 4.05Å; K874-E944 WeakPolarHBondContact CD-OE1 3.25Å; K874-E944 WeakPolarHBondContact CE-OE1 3.43Å; K874-E944 HydrophobicContact CG-CB 4.19Å; K874-E944 HydrophobicContact CG-CG 4.16Å; K874-E944 PolarHBondContact N-O 2.76Å; K874-E944 VanDerWaalsContact N-O 3.13Å; K874-E944 IonicContact NZ-OE1 2.65Å; K874-E944 PolarHBondContact NZ-OE1 3.03Å; F919-E944 HydrophobicContact CD1-CG 4.37Å
945	S	83.5	Confident	91.3	Very high	93 Å²	93	22.1 Å²	22.1	65%	0.65	12%	0.12	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.5	-0.8	-177.4	-67.9	0	0	0	0	115.5	N943	N943-S945 PolarHBondContact O-N 2.81Å; N943-S945 PolarHBondContact OD1-N 2.92Å
946	F	85.9	Confident	90.9	Very high	50 Å²	50	20.2 Å²	20.2	22%	0.219	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	133.5	-174.5	171.3	-100.5	0	0	0	112.2	N943 G948 L963	N943-F946 HydrophobicContact CB-CB 4.06Å; F946-G948 PolarHBondContact O-N 3.37Å; F946-L963 HydrophobicContact CD1-CD2 4.06Å; F946-L963 HydrophobicContact CD2-CD1 4.33Å; F946-L963 HydrophobicContact CE1-CB 4.03Å; F946-L963 HydrophobicContact CE1-CD2 4.25Å; F946-L963 HydrophobicContact CE2-CD1 4.19Å; F946-L963 HydrophobicContact CG-CD2 4.34Å; F946-L963 HydrophobicContact CZ-CB 4.01Å; F946-L963 HydrophobicContact CZ-CD1 4.38Å
947	L	88.4	Confident	90.4	Very high	74 Å²	74	25.3 Å²	25.3	39%	0.387	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	69.9	-178.6	-57.3	177	0	0	0	110.7	K876 V877 W880	K876-L947 HydrophobicContact CG-CD2 4.46Å; V877-L947 HydrophobicContact CB-CD2 4.45Å; V877-L947 HydrophobicContact CG2-CD2 4.01Å; W880-L947 HydrophobicContact CB-CD2 3.73Å; W880-L947 HydrophobicContact CD2-CB 4.17Å; W880-L947 HydrophobicContact CD2-CD2 4.27Å; W880-L947 HydrophobicContact CG-CB 4.31Å; W880-L947 HydrophobicContact CG-CD2 3.88Å
948	G	91.3	Very high	90.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168	-168.1	-176.7	0	0	0	0	0	111.4	F946	F946-G948 PolarHBondContact O-N 3.37Å
949	Y	93.6	Very high	89.8	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	168.2	-176.9	-51.2	-89.5	0	0	0	111.8	W880 F881 E885 L889 F916 L940 H941 L942 V964 V966 Y984 L998	W880-Y949 HydrophobicContact CH2-CE2 4.34Å; F881-Y949 HydrophobicContact CE2-CE1 4.2Å; F881-Y949 WeakPolarHBondContact CE2-OH 3.45Å; E885-Y949 WeakPolarHBondContact OE2-CE2 3.33Å; E885-Y949 PolarHBondContact OE2-OH 2.77Å; L889-Y949 WeakPolarHBondContact CD1-OH 3.45Å; F916-Y949 HydrophobicContact CE2-CE1 4.09Å; L940-Y949 HydrophobicContact CD2-CD1 3.59Å; L940-Y949 HydrophobicContact CD2-CE1 4.44Å; L940-Y949 HydrophobicContact CD2-CG 3.84Å; H941-Y949 CarbonylContact O-C 3.46Å; H941-Y949 VanDerWaalsContact O-CA 3.28Å; H941-Y949 WeakPolarHBondContact O-CA 3.32Å; L942-Y949 HydrophobicContact CD2-CD1 3.56Å; L942-Y949 HydrophobicContact CD2-CE1 3.5Å; L942-Y949 HydrophobicContact CD2-CG 4.36Å; L942-Y949 HydrophobicContact CG-CD1 4.05Å; L942-Y949 HydrophobicContact CG-CE1 4.07Å; Y949-V964 PolarHBondContact N-O 3.31Å; Y949-V964 VanDerWaalsContact N-O 3.09Å; Y949-V964 PolarHBondContact O-N 2.96Å; Y949-V966 HydrophobicContact CD2-CG2 3.98Å; Y949-V966 HydrophobicContact CE2-CG2 3.72Å; Y949-Y984 HydrophobicContact CD2-CE1 4.42Å; Y949-Y984 HydrophobicContact CE2-CD1 4.35Å; Y949-Y984 AromaticContact CE2-CE1 3.8Å; Y949-Y984 HydrophobicContact CE2-CE1 3.8Å; Y949-L998 HydrophobicContact CD2-CD2 4.19Å; Y949-L998 HydrophobicContact CE1-CD1 4.32Å; Y949-L998 HydrophobicContact CE2-CD1 4.29Å; Y949-L998 HydrophobicContact CE2-CD2 4.29Å
950	V	94.6	Very high	89.6	Confident	4 Å²	4	32.1 Å²	32.1	2%	0.024	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	127.6	173.1	-172.9	0	0	0	0	108	L940 H941 N943 H961 F962 L963	L940-V950 WeakPolarHBondContact CA-O 3.34Å; H941-V950 PolarHBondContact CD2-O 3.36Å; H941-V950 PolarHBondContact N-O 2.93Å; H941-V950 PolarHBondContact O-N 2.91Å; N943-V950 HydrophobicContact CB-CG2 3.69Å; V950-H961 HydrophobicContact CG1-CB 3.85Å; V950-F962 WeakPolarHBondContact CA-O 3.28Å; V950-L963 HydrophobicContact CG2-CD2 3.95Å
951	I	94.6	Very high	89.4	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	116.3	166.2	-67.7	171.1	0	0	0	107.3	L940 H961 F962 V964 L1001 L1019	L940-I951 HydrophobicContact CB-CG1 4.45Å; L940-I951 HydrophobicContact CD1-CD1 4.26Å; L940-I951 HydrophobicContact CD1-CG1 3.83Å; L940-I951 HydrophobicContact CG-CG1 4.1Å; I951-H961 WeakPolarHBondContact O-CA 3.34Å; I951-F962 PolarHBondContact N-O 3.4Å; I951-F962 PolarHBondContact O-N 3.47Å; I951-V964 HydrophobicContact CD1-CG2 3.66Å; I951-V964 HydrophobicContact CG1-CG2 3.87Å; I951-L1001 HydrophobicContact CD1-CD2 3.39Å; I951-L1019 HydrophobicContact CG2-CD1 4.36Å; I951-L1019 HydrophobicContact CG2-CD2 3.73Å
952	S	94.5	Very high	89.3	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	121.9	179.5	-66.8	0	0	0	0	108.6	F938 L939 H941 N960 H961	F938-S952 CarbonylContact C-O 3.47Å; F938-S952 WeakPolarHBondContact CA-O 3.35Å; L939-S952 PolarHBondContact N-O 3.46Å; L939-S952 PolarHBondContact O-N 3.42Å; H941-S952 PolarHBondContact CD2-OG 3.31Å; H941-S952 PolarHBondContact NE2-OG 3.31Å; S952-N960 CarbonylContact C-O 3.55Å; S952-N960 VanDerWaalsContact CA-O 3.27Å; S952-N960 WeakPolarHBondContact CA-O 3.47Å; S952-H961 PolarHBondContact OG-CE1 3.33Å; S952-H961 PolarHBondContact OG-ND1 2.75Å
953	L	94.1	Very high	89.3	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	124.1	-170	167	65.3	0	0	0	111.8	S937 F938 N960 F962 L1010 Q1017 L1019	S937-L953 WeakPolarHBondContact O-CA 3.5Å; S937-L953 WeakPolarHBondContact O-CD1 3.46Å; F938-L953 HydrophobicContact CB-CD1 4.26Å; L953-N960 HydrophobicContact CB-CB 4.43Å; L953-N960 PolarHBondContact N-O 2.69Å; L953-N960 PolarHBondContact O-N 3.25Å; L953-N960 PolarHBondContact O-ND2 2.86Å; L953-N960 VanDerWaalsContact O-ND2 3.15Å; L953-F962 HydrophobicContact CB-CE2 4.28Å; L953-F962 HydrophobicContact CD2-CE2 4.13Å; L953-L1010 HydrophobicContact CD2-CD1 3.44Å; L953-L1010 VanDerWaalsContact CD2-CD1 3.44Å; L953-Q1017 HydrophobicContact CD2-CB 3.86Å; L953-Q1017 HydrophobicContact CD2-CG 4.04Å; L953-L1019 HydrophobicContact CD1-CD2 4.39Å
954	F	93.1	Very high	89.7	Confident	11 Å²	11	36.6 Å²	36.6	5%	0.048	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	126.6	169.6	-165.3	-115	0	0	0	111	L929 K934 G936 S937	L929-F954 HydrophobicContact CB-CB 4.26Å; K934-F954 WeakPolarHBondContact O-CD1 3.24Å; G936-F954 PolarHBondContact N-O 3.48Å; S937-F954 PolarHBondContact O-N 3.36Å
955	T	88	Confident	89.8	Confident	4 Å²	4	35 Å²	35	3%	0.025	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	129.1	174.7	-57.9	0	0	0	0	109.5	S957 Y958 Q1017	T955-S957 VanDerWaalsContact C-N 3.32Å; T955-S957 PolarHBondContact O-N 3.33Å; T955-Y958 PolarHBondContact N-O 3.11Å; T955-Y958 WeakPolarHBondContact O-CD1 3.13Å; T955-Y958 WeakPolarHBondContact O-CE1 3.38Å; T955-Y958 PolarHBondContact O-N 2.99Å; T955-Y958 VanDerWaalsContact O-O 3.13Å; T955-Q1017 HydrophobicContact CG2-CG 4.09Å
956	S	81.3	Confident	90.1	Very high	53 Å²	53	31.8 Å²	31.8	37%	0.371	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.3	49.2	173.9	-53.3	0	0	0	0	113.5	N935 Y958	N935-S956 WeakPolarHBondContact OD1-CA 3.37Å; N935-S956 PolarHBondContact OD1-N 3.41Å; S956-Y958 VanDerWaalsContact C-N 3.32Å; S956-Y958 WeakPolarHBondContact O-CD1 3.28Å; S956-Y958 PolarHBondContact O-N 2.65Å
957	S	81.6	Confident	89.9	Confident	107 Å²	107	31.9 Å²	31.9	75%	0.748	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.7	27.9	-177.2	79.7	0	0	0	0	116.4	T955	T955-S957 VanDerWaalsContact C-N 3.32Å; T955-S957 PolarHBondContact O-N 3.33Å
958	Y	86.8	Confident	89.3	Confident	96 Å²	96	31 Å²	31	38%	0.376	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	148.7	164.6	55	-87.2	0	0	0	112.3	T955 S956 N960	T955-Y958 PolarHBondContact N-O 3.11Å; T955-Y958 WeakPolarHBondContact O-CD1 3.13Å; T955-Y958 WeakPolarHBondContact O-CE1 3.38Å; T955-Y958 PolarHBondContact O-N 2.99Å; T955-Y958 VanDerWaalsContact O-O 3.13Å; S956-Y958 VanDerWaalsContact C-N 3.32Å; S956-Y958 WeakPolarHBondContact O-CD1 3.28Å; S956-Y958 PolarHBondContact O-N 2.65Å; Y958-N960 WeakPolarHBondContact CD2-ND2 3.15Å; Y958-N960 WeakPolarHBondContact CD2-OD1 3.39Å; Y958-N960 WeakPolarHBondContact CE2-ND2 3.37Å; Y958-N960 VanDerWaalsContact CE2-OD1 3.22Å; Y958-N960 WeakPolarHBondContact CE2-OD1 3.5Å; Y958-N960 PolarHBondContact O-ND2 3.47Å
959	C	90.5	Very high	88	Confident	27 Å²	27	33.9 Å²	33.9	18%	0.182	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	136.2	170.5	-66.5	0	0	0	0	110.2	E926	E926-C959 HydrophobicContact CG-CB 3.72Å
960	N	90.5	Very high	86.3	Confident	30 Å²	30	42.4 Å²	42.4	16%	0.16	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	141.3	176.7	-60.4	-94.5	0	0	0	108.2	S952 L953 Y958 F962 Q1017	S952-N960 CarbonylContact C-O 3.55Å; S952-N960 VanDerWaalsContact CA-O 3.27Å; S952-N960 WeakPolarHBondContact CA-O 3.47Å; L953-N960 HydrophobicContact CB-CB 4.43Å; L953-N960 PolarHBondContact N-O 2.69Å; L953-N960 PolarHBondContact O-N 3.25Å; L953-N960 PolarHBondContact O-ND2 2.86Å; L953-N960 VanDerWaalsContact O-ND2 3.15Å; Y958-N960 WeakPolarHBondContact CD2-ND2 3.15Å; Y958-N960 WeakPolarHBondContact CD2-OD1 3.39Å; Y958-N960 WeakPolarHBondContact CE2-ND2 3.37Å; Y958-N960 VanDerWaalsContact CE2-OD1 3.22Å; Y958-N960 WeakPolarHBondContact CE2-OD1 3.5Å; Y958-N960 PolarHBondContact O-ND2 3.47Å; N960-F962 HydrophobicContact CB-CD2 4.34Å; N960-F962 HydrophobicContact CB-CE2 3.54Å; N960-F962 HydrophobicContact CB-CZ 3.89Å; N960-Q1017 PolarHBondContact ND2-NE2 3.41Å; N960-Q1017 PolarHBondContact OD1-NE2 3.1Å
961	H	91.5	Very high	84.4	Confident	57 Å²	57	47 Å²	47	26%	0.264	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	112.7	179.6	-56.7	-78.4	0	0	0	109.1	R922 E926 V950 I951 S952	R922-H961 PolarHBondContact NE-CD2 3.27Å; R922-H961 PolarHBondContact NE-NE2 3.15Å; E926-H961 IonicContact OE1-CE1 3.27Å; E926-H961 IonicContact OE1-NE2 2.7Å; E926-H961 PolarHBondContact OE1-NE2 2.81Å; V950-H961 HydrophobicContact CG1-CB 3.85Å; I951-H961 WeakPolarHBondContact O-CA 3.34Å; S952-H961 PolarHBondContact OG-CE1 3.33Å; S952-H961 PolarHBondContact OG-ND1 2.75Å
962	F	91.1	Very high	82	Confident	36 Å²	36	52.5 Å²	52.5	16%	0.158	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	122.2	-179.8	-54.3	-90	0	0	0	109.9	V950 I951 L953 N960 L986 L1010	V950-F962 WeakPolarHBondContact CA-O 3.28Å; I951-F962 PolarHBondContact N-O 3.4Å; I951-F962 PolarHBondContact O-N 3.47Å; L953-F962 HydrophobicContact CB-CE2 4.28Å; L953-F962 HydrophobicContact CD2-CE2 4.13Å; N960-F962 HydrophobicContact CB-CD2 4.34Å; N960-F962 HydrophobicContact CB-CE2 3.54Å; N960-F962 HydrophobicContact CB-CZ 3.89Å; F962-L986 HydrophobicContact CB-CD1 3.69Å; F962-L986 HydrophobicContact CB-CG 4.47Å; F962-L1010 HydrophobicContact CD1-CB 4.43Å; F962-L1010 HydrophobicContact CD2-CD1 4.34Å; F962-L1010 HydrophobicContact CD2-CD2 4.44Å; F962-L1010 HydrophobicContact CE1-CB 3.97Å; F962-L1010 HydrophobicContact CE2-CB 4.08Å; F962-L1010 HydrophobicContact CE2-CD1 3.97Å; F962-L1010 HydrophobicContact CE2-CG 4.48Å; F962-L1010 HydrophobicContact CZ-CB 3.78Å; F962-L1010 HydrophobicContact CZ-CD1 4.46Å
963	L	92.6	Very high	79.7	Confident	57 Å²	57	60.4 Å²	60.4	30%	0.298	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	134	177.2	-58.3	178.7	0	0	0	110.4	F946 V950 Y987	F946-L963 HydrophobicContact CD1-CD2 4.06Å; F946-L963 HydrophobicContact CD2-CD1 4.33Å; F946-L963 HydrophobicContact CE1-CB 4.03Å; F946-L963 HydrophobicContact CE1-CD2 4.25Å; F946-L963 HydrophobicContact CE2-CD1 4.19Å; F946-L963 HydrophobicContact CG-CD2 4.34Å; F946-L963 HydrophobicContact CZ-CB 4.01Å; F946-L963 HydrophobicContact CZ-CD1 4.38Å; V950-L963 HydrophobicContact CG2-CD2 3.95Å; L963-Y987 WeakPolarHBondContact O-CB 3.45Å; L963-Y987 PolarHBondContact O-N 2.98Å
964	V	91.9	Very high	77.3	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	111.8	173.6	-179.5	0	0	0	0	108.4	Y949 I951 Y984 L986 L1001	Y949-V964 PolarHBondContact N-O 3.31Å; Y949-V964 VanDerWaalsContact N-O 3.09Å; Y949-V964 PolarHBondContact O-N 2.96Å; I951-V964 HydrophobicContact CD1-CG2 3.66Å; I951-V964 HydrophobicContact CG1-CG2 3.87Å; V964-Y984 HydrophobicContact CG1-CD1 4.43Å; V964-L986 HydrophobicContact CG2-CD1 3.94Å; V964-L1001 HydrophobicContact CG1-CD1 3.8Å
965	S	87.6	Confident	75.4	Confident	36 Å²	36	68.2 Å²	68.2	25%	0.252	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	137.7	176.5	-170.6	0	0	0	0	110.3	Q985	S965-Q985 PolarHBondContact N-O 2.92Å; S965-Q985 PolarHBondContact O-N 3.05Å
966	V	88	Confident	73.5	Confident	25 Å²	25	71.8 Å²	71.8	15%	0.152	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	120.5	173.1	-172	0	0	0	0	109	W880 E885 Y949 Y984	W880-V966 HydrophobicContact CH2-CG2 3.8Å; W880-V966 HydrophobicContact CZ2-CB 3.87Å; W880-V966 HydrophobicContact CZ2-CG1 4.36Å; W880-V966 HydrophobicContact CZ2-CG2 3.64Å; E885-V966 HydrophobicContact CG-CG1 4.45Å; E885-V966 WeakPolarHBondContact OE1-CG1 3.5Å; Y949-V966 HydrophobicContact CD2-CG2 3.98Å; Y949-V966 HydrophobicContact CE2-CG2 3.72Å; V966-Y984 HydrophobicContact CB-CE1 4.48Å; V966-Y984 HydrophobicContact CG1-CD1 4.41Å; V966-Y984 HydrophobicContact CG1-CE1 4.01Å; V966-Y984 HydrophobicContact CG2-CD1 3.96Å; V966-Y984 HydrophobicContact CG2-CE1 3.84Å
967	I	83.7	Confident	72	Confident	53 Å²	53	79.1 Å²	79.1	27%	0.272	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	97.6	-175.6	-57.1	175.4	0	0	0	108.1	V969 S982 T983 Q985	I967-V969 PolarHBondContact O-N 2.97Å; I967-V969 VanDerWaalsContact O-N 3.1Å; I967-S982 WeakPolarHBondContact O-CA 3.48Å; I967-T983 PolarHBondContact N-O 2.83Å; I967-T983 PolarHBondContact O-N 3.07Å; I967-Q985 HydrophobicContact CD1-CB 3.97Å
968	A	73.9	Confident	70.2	Confident	55 Å²	55	78.8 Å²	78.8	46%	0.455	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	101.5	176	0	0	0	0	0	110.6	K970	A968-K970 PolarHBondContact O-N 2.91Å
969	V	63.9	Low	68.4	Low	61 Å²	61	78.3 Å²	78.3	37%	0.37	44%	0.444	S	S	.	.			trans	-71.6	97.3	179.8	-175.9	0	0	0	0	110.1	I967 Q971 T983	I967-V969 PolarHBondContact O-N 2.97Å; I967-V969 VanDerWaalsContact O-N 3.1Å; V969-Q971 PolarHBondContact O-N 2.89Å; V969-T983 HydrophobicContact CG2-CG2 4.27Å
970	K	59	Low	66.8	Low	178 Å²	178	81.8 Å²	81.8	77%	0.774	46%	0.464	S	S	*	.			trans	-69.3	105.9	165.7	-67.9	-172.3	177.8	-173.7	0	108.6	A968 T972	A968-K970 PolarHBondContact O-N 2.91Å; K970-T972 PolarHBondContact O-N 3.05Å
971	Q	53.6	Low	65.6	Low	102 Å²	102	86.1 Å²	86.1	48%	0.477	48%	0.482	S	S	.	.			trans	-68.1	92.7	175.9	-65.5	-166.3	44.3	0	0	110.5	V969 T979	V969-Q971 PolarHBondContact O-N 2.89Å; Q971-T979 PolarHBondContact NE2-O 3.5Å
972	T	44.2	Very low	64.9	Low	114 Å²	114	83.9 Å²	83.9	70%	0.699	47%	0.473	S	S	*	.			trans	-80.6	135.4	166.4	52.9	0	0	0	0	109.8	K970	K970-T972 PolarHBondContact O-N 3.05Å
973	N	46.3	Very low	64.7	Low	166 Å²	166	82.9 Å²	82.9	89%	0.888	47%	0.469	S	S	*	.	S	Bend	trans	72.5	48.8	167.4	-48.2	-14.9	0	0	0	116.5
974	S	45	Very low	64.6	Low	84 Å²	84	80.1 Å²	80.1	59%	0.587	46%	0.455	S	S	*	.			trans	-151.2	139.9	154.4	-177.1	0	0	0	0	110.7	S976	S974-S976 PolarHBondContact O-N 2.88Å
975	G	52.8	Low	64.4	Low	92 Å²	92	82.3 Å²	82.3	95%	0.948	47%	0.465	S	S	*	.			trans	-75.1	18.3	177.6	0	0	0	0	0	114.8
976	S	48.2	Very low	64.5	Low	78 Å²	78	80.8 Å²	80.8	55%	0.545	45%	0.454	S	S	.	.	S	Bend	trans	-80.3	141.7	-178.9	-166.6	0	0	0	0	111.5	S974 N978	S974-S976 PolarHBondContact O-N 2.88Å; S976-N978 PolarHBondContact O-N 3Å
977	R	50.4	Low	64.3	Low	208 Å²	208	87.1 Å²	87.1	79%	0.785	48%	0.476	S	S	*	.			trans	-70.8	103	-172.2	-74.4	175.8	170.3	161.3	-5.9	112.3	T979	R977-T979 PolarHBondContact O-N 3.24Å
978	N	43.1	Very low	63.8	Low	99 Å²	99	88.2 Å²	88.2	53%	0.529	50%	0.501	S	S	.	.			trans	30.4	81.3	148.6	-57.5	10.3	0	0	0	116.6	D597 K598 S976	D597-N978 PolarHBondContact OD2-ND2 2.91Å; K598-N978 WeakPolarHBondContact CE-ND2 3.18Å; S976-N978 PolarHBondContact O-N 3Å
979	T	49.4	Very low	63.5	Low	86 Å²	86	87.8 Å²	87.8	53%	0.528	49%	0.493	S	S	.	.			trans	-134.3	97	150.7	44.6	0	0	0	0	110	Q971 R977 K981	Q971-T979 PolarHBondContact NE2-O 3.5Å; R977-T979 PolarHBondContact O-N 3.24Å; T979-K981 VanDerWaalsContact C-N 3.3Å; T979-K981 PolarHBondContact O-N 3.13Å
980	T	55.3	Low	63.1	Low	100 Å²	100	89.2 Å²	89.2	61%	0.613	51%	0.511	S	S	*	.			trans	-76.9	81.4	172	47.7	0	0	0	0	109.3	S982	T980-S982 PolarHBondContact O-N 2.7Å; T980-S982 VanDerWaalsContact O-N 3.16Å
981	K	66.9	Low	63.2	Low	122 Å²	122	83.8 Å²	83.8	53%	0.53	49%	0.49	S	S	.	.			trans	-67.3	112.3	173.5	-68.5	-164.1	174.8	-165.6	0	109.4	T979	T979-K981 VanDerWaalsContact C-N 3.3Å; T979-K981 PolarHBondContact O-N 3.13Å
982	S	76.5	Confident	63.7	Low	9 Å²	9	83.5 Å²	83.5	6%	0.063	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55	144.2	160.4	-60.1	0	0	0	0	109.7	E885 I967 T980	E885-S982 PolarHBondContact OE1-OG 3.48Å; I967-S982 WeakPolarHBondContact O-CA 3.48Å; T980-S982 PolarHBondContact O-N 2.7Å; T980-S982 VanDerWaalsContact O-N 3.16Å
983	T	86.7	Confident	65.3	Low	15 Å²	15	81 Å²	81	9%	0.092	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	152	164.9	61.7	0	0	0	0	110.9	I967 V969 Q994 F995	I967-T983 PolarHBondContact N-O 2.83Å; I967-T983 PolarHBondContact O-N 3.07Å; V969-T983 HydrophobicContact CG2-CG2 4.27Å; T983-Q994 HydrophobicContact CG2-CB 4.44Å; T983-Q994 PolarHBondContact OG1-OE1 2.97Å; T983-F995 CarbonylContact C-O 3.45Å; T983-F995 VanDerWaalsContact CA-O 3.25Å; T983-F995 WeakPolarHBondContact CA-O 3.24Å
984	Y	89.8	Confident	67.1	Low	0 Å²	0	77.7 Å²	77.7	0%	0	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	128.9	-177.6	-57	-70.4	0	0	0	109.9	E885 R888 Y949 V964 V966 Q994 F995 T996 L998	E885-Y984 VanDerWaalsContact CD-OH 3.3Å; E885-Y984 PolarHBondContact OE1-OH 3.07Å; E885-Y984 WeakPolarHBondContact OE2-CE1 3.14Å; E885-Y984 PolarHBondContact OE2-OH 3.45Å; R888-Y984 VanDerWaalsContact CZ-OH 3.3Å; R888-Y984 PolarHBondContact NE-OH 2.72Å; R888-Y984 PolarHBondContact NH2-OH 2.96Å; Y949-Y984 HydrophobicContact CD2-CE1 4.42Å; Y949-Y984 HydrophobicContact CE2-CD1 4.35Å; Y949-Y984 AromaticContact CE2-CE1 3.8Å; Y949-Y984 HydrophobicContact CE2-CE1 3.8Å; V964-Y984 HydrophobicContact CG1-CD1 4.43Å; V966-Y984 HydrophobicContact CB-CE1 4.48Å; V966-Y984 HydrophobicContact CG1-CD1 4.41Å; V966-Y984 HydrophobicContact CG1-CE1 4.01Å; V966-Y984 HydrophobicContact CG2-CD1 3.96Å; V966-Y984 HydrophobicContact CG2-CE1 3.84Å; Y984-Q994 WeakPolarHBondContact O-CA 3.19Å; Y984-F995 PolarHBondContact N-O 3.49Å; Y984-F995 PolarHBondContact O-N 3.24Å; Y984-T996 WeakPolarHBondContact CE2-O 3.5Å; Y984-L998 HydrophobicContact CD1-CD2 3.59Å; Y984-L998 HydrophobicContact CD1-CG 4.48Å; Y984-L998 HydrophobicContact CD2-CD2 3.94Å; Y984-L998 HydrophobicContact CD2-CG 4.31Å; Y984-L998 HydrophobicContact CE1-CD2 3.74Å; Y984-L998 HydrophobicContact CE1-CG 4.22Å; Y984-L998 HydrophobicContact CE2-CD2 4.06Å; Y984-L998 HydrophobicContact CE2-CG 4.02Å; Y984-L998 HydrophobicContact CG-CD2 3.69Å
985	Q	89.2	Confident	69.2	Low	46 Å²	46	74.7 Å²	74.7	22%	0.215	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	138.3	177.2	-170.5	176.9	-5.9	0	0	110.9	S965 I967 Y987 Q994	S965-Q985 PolarHBondContact N-O 2.92Å; S965-Q985 PolarHBondContact O-N 3.05Å; I967-Q985 HydrophobicContact CD1-CB 3.97Å; Q985-Y987 PolarHBondContact O-N 3Å; Q985-Q994 HydrophobicContact CB-CG 4.31Å
986	L	88.4	Confident	70.7	Confident	3 Å²	3	73 Å²	73	2%	0.016	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	121.2	175.1	-159.1	64.6	0	0	0	110	F962 V964 V989 Y1005 L1010	F962-L986 HydrophobicContact CB-CD1 3.69Å; F962-L986 HydrophobicContact CB-CG 4.47Å; V964-L986 HydrophobicContact CG2-CD1 3.94Å; L986-V989 HydrophobicContact CB-CB 4.42Å; L986-V989 HydrophobicContact CB-CG2 4.45Å; L986-V989 HydrophobicContact CD2-CB 4.3Å; L986-V989 HydrophobicContact CD2-CG2 3.72Å; L986-V989 HydrophobicContact CG-CB 4.48Å; L986-V989 HydrophobicContact CG-CG2 3.99Å; L986-Y1005 HydrophobicContact CB-CE2 4.39Å; L986-Y1005 HydrophobicContact CD2-CE1 3.85Å; L986-Y1005 HydrophobicContact CD2-CE2 4.04Å; L986-L1010 HydrophobicContact CD1-CD2 4.39Å; L986-L1010 HydrophobicContact CD2-CD2 3.61Å
987	Y	84.1	Confident	72.6	Confident	158 Å²	158	71.4 Å²	71.4	62%	0.62	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	135.2	-172.2	-173	-92.9	0	0	0	111.8	L963 Q985 V989	L963-Y987 WeakPolarHBondContact O-CB 3.45Å; L963-Y987 PolarHBondContact O-N 2.98Å; Q985-Y987 PolarHBondContact O-N 3Å; Y987-V989 PolarHBondContact O-N 3.09Å; Y987-V989 VanDerWaalsContact O-N 3.17Å
988	G	72.4	Confident	74.6	Confident	76 Å²	76	61.5 Å²	61.5	78%	0.784	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	-5.5	176.3	0	0	0	0	0	115.8
989	V	69.1	Low	76.9	Confident	47 Å²	47	60.9 Å²	60.9	29%	0.285	34%	0.343	S	S	.	.			trans	-84.1	132.4	175.4	176.5	0	0	0	0	109.9	L986 Y987 N991	L986-V989 HydrophobicContact CB-CB 4.42Å; L986-V989 HydrophobicContact CB-CG2 4.45Å; L986-V989 HydrophobicContact CD2-CB 4.3Å; L986-V989 HydrophobicContact CD2-CG2 3.72Å; L986-V989 HydrophobicContact CG-CB 4.48Å; L986-V989 HydrophobicContact CG-CG2 3.99Å; Y987-V989 PolarHBondContact O-N 3.09Å; Y987-V989 VanDerWaalsContact O-N 3.17Å; V989-N991 HydrophobicContact CG1-CB 4.35Å; V989-N991 PolarHBondContact O-N 3.48Å; V989-N991 VanDerWaalsContact O-N 3.1Å
990	A	55	Low	78.9	Confident	91 Å²	91	60.3 Å²	60.3	75%	0.752	34%	0.337	S	S	*	.	S	Bend	trans	-73.3	1.6	-171.8	0	0	0	0	0	115
991	N	60.2	Low	80.6	Confident	63 Å²	63	55.5 Å²	55.5	34%	0.337	31%	0.307	S	S	.	.			trans	-93.1	116	174.5	-165.1	21.5	0	0	0	108.9	V989 E993	V989-N991 HydrophobicContact CG1-CB 4.35Å; V989-N991 PolarHBondContact O-N 3.48Å; V989-N991 VanDerWaalsContact O-N 3.1Å; N991-E993 PolarHBondContact ND2-OE1 2.95Å; N991-E993 PolarHBondContact O-N 2.96Å
992	P	65.4	Low	81.8	Confident	97 Å²	97	50.2 Å²	50.2	63%	0.63	29%	0.285	S	S	*	.			trans	-79.7	28.3	-172	34.9	-38.3	0	0	0	113.4	Q994	P992-Q994 PolarHBondContact O-N 3.35Å
993	E	77	Confident	82.6	Confident	60 Å²	60	56.7 Å²	56.7	28%	0.28	31%	0.312	S	S	.	.			trans	-74.5	119.2	-175.9	-71.3	-166.9	-121.3	0	0	111.4	N991 F995 F1004	N991-E993 PolarHBondContact ND2-OE1 2.95Å; N991-E993 PolarHBondContact O-N 2.96Å; E993-F995 HydrophobicContact CB-CE2 3.96Å; E993-F995 HydrophobicContact CB-CZ 3.79Å; E993-F995 WeakPolarHBondContact O-CE2 3.49Å; E993-F1004 VanDerWaalsContact CD-CE2 3.49Å; E993-F1004 WeakPolarHBondContact OE1-CE2 3.47Å; E993-F1004 WeakPolarHBondContact OE1-CZ 3.32Å; E993-F1004 WeakPolarHBondContact OE2-CE2 3.44Å
994	Q	85	Confident	82.7	Confident	97 Å²	97	57.4 Å²	57.4	45%	0.453	31%	0.314	S	S	.	.			trans	-109.3	117.3	179.5	-72.9	-172.8	12.6	0	0	109.1	T983 Y984 Q985 P992	T983-Q994 HydrophobicContact CG2-CB 4.44Å; T983-Q994 PolarHBondContact OG1-OE1 2.97Å; Y984-Q994 WeakPolarHBondContact O-CA 3.19Å; Q985-Q994 HydrophobicContact CB-CG 4.31Å; P992-Q994 PolarHBondContact O-N 3.35Å
995	F	88.1	Confident	82.7	Confident	21 Å²	21	57.6 Å²	57.6	9%	0.092	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-95.4	142.4	-179.4	-55.5	-85.2	0	0	0	109.6	T983 Y984 E993 D997 D1000 L1001 F1004 Y1005	T983-F995 CarbonylContact C-O 3.45Å; T983-F995 VanDerWaalsContact CA-O 3.25Å; T983-F995 WeakPolarHBondContact CA-O 3.24Å; Y984-F995 PolarHBondContact N-O 3.49Å; Y984-F995 PolarHBondContact O-N 3.24Å; E993-F995 HydrophobicContact CB-CE2 3.96Å; E993-F995 HydrophobicContact CB-CZ 3.79Å; E993-F995 WeakPolarHBondContact O-CE2 3.49Å; F995-D997 VanDerWaalsContact C-N 3.3Å; F995-D1000 HydrophobicContact CD1-CB 4.34Å; F995-L1001 HydrophobicContact CB-CB 3.88Å; F995-L1001 HydrophobicContact CD1-CB 4.39Å; F995-L1001 HydrophobicContact CD2-CB 3.73Å; F995-L1001 HydrophobicContact CD2-CD1 3.81Å; F995-L1001 HydrophobicContact CD2-CG 3.66Å; F995-L1001 HydrophobicContact CE2-CB 4.46Å; F995-L1001 HydrophobicContact CE2-CG 4.12Å; F995-L1001 HydrophobicContact CG-CB 3.71Å; F995-L1001 HydrophobicContact CG-CG 4.18Å; F995-F1004 HydrophobicContact CD1-CB 4.39Å; F995-F1004 HydrophobicContact CE1-CB 3.45Å; F995-F1004 VanDerWaalsContact CE1-CB 3.45Å; F995-F1004 HydrophobicContact CE1-CD1 4.29Å; F995-F1004 AromaticContact CE1-CD2 3.8Å; F995-F1004 HydrophobicContact CE1-CD2 3.8Å; F995-F1004 AromaticContact CE1-CG 3.59Å; F995-F1004 HydrophobicContact CE1-CG 3.59Å; F995-F1004 HydrophobicContact CZ-CB 3.65Å; F995-F1004 AromaticContact CZ-CD1 3.65Å; F995-F1004 HydrophobicContact CZ-CD1 3.65Å; F995-F1004 AromaticContact CZ-CD2 3.84Å; F995-F1004 HydrophobicContact CZ-CD2 3.84Å; F995-F1004 HydrophobicContact CZ-CE1 4.24Å; F995-F1004 HydrophobicContact CZ-CE2 4.4Å; F995-F1004 AromaticContact CZ-CG 3.43Å; F995-F1004 HydrophobicContact CZ-CG 3.43Å; F995-F1004 VanDerWaalsContact CZ-CG 3.43Å; F995-Y1005 HydrophobicContact CE2-CE2 4.03Å; F995-Y1005 HydrophobicContact CZ-CE2 4.42Å
996	T	85.4	Confident	82.8	Confident	58 Å²	58	57.1 Å²	57.1	36%	0.356	32%	0.316	S	S	.	.	S	Bend	trans	-76.4	-21.9	175.6	51.3	0	0	0	0	112.8	Y984	Y984-T996 WeakPolarHBondContact CE2-O 3.5Å
997	D	87.8	Confident	82.7	Confident	43 Å²	43	61.8 Å²	61.8	23%	0.23	35%	0.345	C	S	.	.	S	Bend	trans	-143.6	141.6	-168.2	-64.3	-80.6	0	0	0	110.7	R888 F995 R999 D1000 L1001	R888-D997 IonicContact CZ-OD1 2.76Å; R888-D997 IonicContact NH1-OD1 2.72Å; R888-D997 PolarHBondContact NH1-OD1 3.44Å; R888-D997 IonicContact NH2-OD1 3Å; F995-D997 VanDerWaalsContact C-N 3.3Å; D997-R999 PolarHBondContact O-N 3.16Å; D997-D1000 PolarHBondContact O-N 3.32Å; D997-D1000 VanDerWaalsContact O-N 3.13Å; D997-L1001 PolarHBondContact O-N 3.22Å
998	L	91.2	Very high	82.7	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-60.7	-31.3	-179.6	-65.1	177.4	0	0	0	112.1	L889 W915 F916 L940 Y949 Y984 D1000 L1001 V1002	L889-L998 HydrophobicContact CD1-CD1 4.31Å; L889-L998 HydrophobicContact CD2-CD1 4.07Å; W915-L998 HydrophobicContact CH2-CB 3.89Å; W915-L998 HydrophobicContact CZ3-CB 4.35Å; F916-L998 HydrophobicContact CE2-CD1 4.32Å; L940-L998 HydrophobicContact CD1-CD2 4.3Å; L940-L998 HydrophobicContact CD2-CD1 4.33Å; Y949-L998 HydrophobicContact CD2-CD2 4.19Å; Y949-L998 HydrophobicContact CE1-CD1 4.32Å; Y949-L998 HydrophobicContact CE2-CD1 4.29Å; Y949-L998 HydrophobicContact CE2-CD2 4.29Å; Y984-L998 HydrophobicContact CD1-CD2 3.59Å; Y984-L998 HydrophobicContact CD1-CG 4.48Å; Y984-L998 HydrophobicContact CD2-CD2 3.94Å; Y984-L998 HydrophobicContact CD2-CG 4.31Å; Y984-L998 HydrophobicContact CE1-CD2 3.74Å; Y984-L998 HydrophobicContact CE1-CG 4.22Å; Y984-L998 HydrophobicContact CE2-CD2 4.06Å; Y984-L998 HydrophobicContact CE2-CG 4.02Å; Y984-L998 HydrophobicContact CG-CD2 3.69Å; L998-D1000 PolarHBondContact O-N 3.24Å; L998-L1001 PolarHBondContact O-N 2.96Å; L998-V1002 WeakPolarHBondContact O-CG2 3.44Å; L998-V1002 PolarHBondContact O-N 3.48Å
999	R	92.1	Very high	83.2	Confident	86 Å²	86	56.7 Å²	56.7	33%	0.325	31%	0.311	S	S	.	.	H	α-helix	trans	-60.7	-43.2	175.8	-58	-171.3	-165.5	-106.1	4	112.1	D892 R911 W915 D997 K1003	D892-R999 PolarHBondContact O-NH2 3.48Å; D892-R999 VanDerWaalsContact O-NH2 3.09Å; D892-R999 IonicContact OD1-CZ 2.65Å; D892-R999 VanDerWaalsContact OD1-CZ 3.27Å; D892-R999 IonicContact OD1-NE 3.32Å; D892-R999 PolarHBondContact OD1-NE 2.91Å; D892-R999 IonicContact OD1-NH2 2.96Å; D892-R999 PolarHBondContact OD1-NH2 2.83Å; D892-R999 IonicContact OD2-NE 3.48Å; R911-R999 PolarHBondContact O-NH1 3.31Å; R911-R999 PolarHBondContact O-NH2 3.34Å; W915-R999 HydrophobicContact CZ2-CG 4.5Å; D997-R999 PolarHBondContact O-N 3.16Å; R999-K1003 WeakPolarHBondContact O-CB 3.44Å; R999-K1003 PolarHBondContact O-N 3.22Å
1000	D	91.1	Very high	83.6	Confident	74 Å²	74	54.5 Å²	54.5	40%	0.396	30%	0.297	S	S	.	.	H	α-helix	trans	-74.2	-34.5	-179.8	-80.2	-22.6	0	0	0	111.9	F995 D997 L998 K1003 F1004	F995-D1000 HydrophobicContact CD1-CB 4.34Å; D997-D1000 PolarHBondContact O-N 3.32Å; D997-D1000 VanDerWaalsContact O-N 3.13Å; L998-D1000 PolarHBondContact O-N 3.24Å; D1000-K1003 PolarHBondContact O-N 3.13Å; D1000-F1004 WeakPolarHBondContact O-CB 3.23Å; D1000-F1004 PolarHBondContact O-N 2.74Å
1001	L	91.8	Very high	84.1	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.1	-50	171.3	-172.2	156.7	0	0	0	111	I951 V964 F995 D997 L998 K1003 F1004 Y1005	I951-L1001 HydrophobicContact CD1-CD2 3.39Å; V964-L1001 HydrophobicContact CG1-CD1 3.8Å; F995-L1001 HydrophobicContact CB-CB 3.88Å; F995-L1001 HydrophobicContact CD1-CB 4.39Å; F995-L1001 HydrophobicContact CD2-CB 3.73Å; F995-L1001 HydrophobicContact CD2-CD1 3.81Å; F995-L1001 HydrophobicContact CD2-CG 3.66Å; F995-L1001 HydrophobicContact CE2-CB 4.46Å; F995-L1001 HydrophobicContact CE2-CG 4.12Å; F995-L1001 HydrophobicContact CG-CB 3.71Å; F995-L1001 HydrophobicContact CG-CG 4.18Å; D997-L1001 PolarHBondContact O-N 3.22Å; L998-L1001 PolarHBondContact O-N 2.96Å; L1001-K1003 VanDerWaalsContact C-N 3.35Å; L1001-K1003 PolarHBondContact O-N 3.19Å; L1001-F1004 PolarHBondContact O-N 3.01Å; L1001-Y1005 HydrophobicContact CD2-CD2 3.83Å; L1001-Y1005 HydrophobicContact CD2-CE2 4.2Å; L1001-Y1005 HydrophobicContact CG-CD2 4.15Å; L1001-Y1005 HydrophobicContact CG-CE2 4.17Å; L1001-Y1005 VanDerWaalsContact O-CD2 3.32Å; L1001-Y1005 WeakPolarHBondContact O-CD2 3.36Å; L1001-Y1005 PolarHBondContact O-N 2.99Å; L1001-Y1005 VanDerWaalsContact O-N 3.11Å
1002	V	92.5	Very high	83.9	Confident	10 Å²	10	59.2 Å²	59.2	6%	0.061	30%	0.296	C	S	.	.	H	α-helix	trans	-63.2	-41.8	178.3	169.7	0	0	0	0	111.4	W915 F938 L940 L998 F1004 Y1005 S1006 L1019	W915-V1002 HydrophobicContact CD2-CG2 4.26Å; W915-V1002 HydrophobicContact CE3-CG2 4.35Å; W915-V1002 HydrophobicContact CH2-CG2 3.95Å; W915-V1002 HydrophobicContact CZ2-CB 4.07Å; W915-V1002 HydrophobicContact CZ2-CG1 4.36Å; W915-V1002 HydrophobicContact CZ2-CG2 3.83Å; W915-V1002 HydrophobicContact CZ3-CG2 4.21Å; F938-V1002 HydrophobicContact CE2-CG1 3.53Å; F938-V1002 HydrophobicContact CE2-CG2 4.39Å; F938-V1002 HydrophobicContact CZ-CG1 3.56Å; L940-V1002 HydrophobicContact CD1-CG2 4.4Å; L998-V1002 WeakPolarHBondContact O-CG2 3.44Å; L998-V1002 PolarHBondContact O-N 3.48Å; V1002-F1004 VanDerWaalsContact C-N 3.29Å; V1002-F1004 PolarHBondContact O-N 2.75Å; V1002-Y1005 PolarHBondContact O-N 2.95Å; V1002-S1006 PolarHBondContact O-N 3.37Å; V1002-L1019 HydrophobicContact CB-CD1 4.35Å; V1002-L1019 HydrophobicContact CG1-CD1 4.14Å; V1002-L1019 HydrophobicContact CG2-CD1 4.31Å
1003	K	91.7	Very high	83.5	Confident	146 Å²	146	60 Å²	60	64%	0.635	30%	0.296	S	S	*	.	H	α-helix	trans	-66.3	-26.5	176.5	-178	-178.5	174.6	-172.1	0	113.5	R999 D1000 L1001 S1006	R999-K1003 WeakPolarHBondContact O-CB 3.44Å; R999-K1003 PolarHBondContact O-N 3.22Å; D1000-K1003 PolarHBondContact O-N 3.13Å; L1001-K1003 VanDerWaalsContact C-N 3.35Å; L1001-K1003 PolarHBondContact O-N 3.19Å; K1003-S1006 PolarHBondContact O-OG 2.94Å
1004	F	89.5	Confident	82.7	Confident	29 Å²	29	59.4 Å²	59.4	13%	0.127	29%	0.294	C	S	.	.	H	α-helix	trans	-73.7	-47.7	172.5	178.8	-86.9	0	0	0	111.1	E993 F995 D1000 L1001 V1002 S1006 V1007 H1008	E993-F1004 VanDerWaalsContact CD-CE2 3.49Å; E993-F1004 WeakPolarHBondContact OE1-CE2 3.47Å; E993-F1004 WeakPolarHBondContact OE1-CZ 3.32Å; E993-F1004 WeakPolarHBondContact OE2-CE2 3.44Å; F995-F1004 HydrophobicContact CD1-CB 4.39Å; F995-F1004 HydrophobicContact CE1-CB 3.45Å; F995-F1004 VanDerWaalsContact CE1-CB 3.45Å; F995-F1004 HydrophobicContact CE1-CD1 4.29Å; F995-F1004 AromaticContact CE1-CD2 3.8Å; F995-F1004 HydrophobicContact CE1-CD2 3.8Å; F995-F1004 AromaticContact CE1-CG 3.59Å; F995-F1004 HydrophobicContact CE1-CG 3.59Å; F995-F1004 HydrophobicContact CZ-CB 3.65Å; F995-F1004 AromaticContact CZ-CD1 3.65Å; F995-F1004 HydrophobicContact CZ-CD1 3.65Å; F995-F1004 AromaticContact CZ-CD2 3.84Å; F995-F1004 HydrophobicContact CZ-CD2 3.84Å; F995-F1004 HydrophobicContact CZ-CE1 4.24Å; F995-F1004 HydrophobicContact CZ-CE2 4.4Å; F995-F1004 AromaticContact CZ-CG 3.43Å; F995-F1004 HydrophobicContact CZ-CG 3.43Å; F995-F1004 VanDerWaalsContact CZ-CG 3.43Å; D1000-F1004 WeakPolarHBondContact O-CB 3.23Å; D1000-F1004 PolarHBondContact O-N 2.74Å; L1001-F1004 PolarHBondContact O-N 3.01Å; V1002-F1004 VanDerWaalsContact C-N 3.29Å; V1002-F1004 PolarHBondContact O-N 2.75Å; F1004-S1006 VanDerWaalsContact C-N 3.28Å; F1004-S1006 PolarHBondContact O-N 3.26Å; F1004-V1007 WeakPolarHBondContact O-CG2 3.22Å; F1004-V1007 PolarHBondContact O-N 3.13Å; F1004-H1008 HydrophobicContact CD1-CB 4.01Å; F1004-H1008 AromaticContact CD1-ND1 3.69Å; F1004-H1008 AromaticContact CD2-CE1 3.63Å; F1004-H1008 AromaticContact CD2-ND1 3.36Å; F1004-H1008 WeakPolarHBondContact CD2-ND1 3.36Å; F1004-H1008 HydrophobicContact CE1-CB 3.55Å; F1004-H1008 AromaticContact CE1-CG 3.65Å; F1004-H1008 AromaticContact CE1-ND1 3.57Å; F1004-H1008 AromaticContact CE2-CE1 3.34Å; F1004-H1008 WeakPolarHBondContact CE2-CE1 3.15Å; F1004-H1008 AromaticContact CE2-CG 3.9Å; F1004-H1008 AromaticContact CE2-ND1 3.23Å; F1004-H1008 WeakPolarHBondContact CE2-ND1 3.46Å; F1004-H1008 AromaticContact CG-ND1 3.59Å; F1004-H1008 HydrophobicContact CZ-CB 3.92Å; F1004-H1008 AromaticContact CZ-CE1 3.78Å; F1004-H1008 AromaticContact CZ-CG 3.52Å; F1004-H1008 AromaticContact CZ-ND1 3.34Å; F1004-H1008 VanDerWaalsContact CZ-ND1 3.34Å; F1004-H1008 WeakPolarHBondContact CZ-ND1 3.23Å; F1004-H1008 PolarHBondContact O-N 3Å; F1004-H1008 PolarHBondContact O-ND1 2.89Å
1005	Y	90.3	Very high	81.6	Confident	4 Å²	4	61.6 Å²	61.6	2%	0.016	31%	0.309	C	S	.	.	H	α-helix	trans	-80.7	0.4	-177.9	-70.5	-70	0	0	0	114.6	L986 F995 L1001 V1002 V1007 H1008 L1010 L1018 L1019	L986-Y1005 HydrophobicContact CB-CE2 4.39Å; L986-Y1005 HydrophobicContact CD2-CE1 3.85Å; L986-Y1005 HydrophobicContact CD2-CE2 4.04Å; F995-Y1005 HydrophobicContact CE2-CE2 4.03Å; F995-Y1005 HydrophobicContact CZ-CE2 4.42Å; L1001-Y1005 HydrophobicContact CD2-CD2 3.83Å; L1001-Y1005 HydrophobicContact CD2-CE2 4.2Å; L1001-Y1005 HydrophobicContact CG-CD2 4.15Å; L1001-Y1005 HydrophobicContact CG-CE2 4.17Å; L1001-Y1005 VanDerWaalsContact O-CD2 3.32Å; L1001-Y1005 WeakPolarHBondContact O-CD2 3.36Å; L1001-Y1005 PolarHBondContact O-N 2.99Å; L1001-Y1005 VanDerWaalsContact O-N 3.11Å; V1002-Y1005 PolarHBondContact O-N 2.95Å; Y1005-V1007 VanDerWaalsContact C-N 3.35Å; Y1005-H1008 CarbonylContact C-O 3.58Å; Y1005-H1008 WeakPolarHBondContact CA-O 3.36Å; Y1005-L1010 HydrophobicContact CD1-CB 4.42Å; Y1005-L1010 HydrophobicContact CD1-CD2 3.53Å; Y1005-L1010 HydrophobicContact CD1-CG 3.72Å; Y1005-L1010 HydrophobicContact CD2-CD2 4.06Å; Y1005-L1010 HydrophobicContact CE1-CD2 4.08Å; Y1005-L1010 HydrophobicContact CE1-CG 4.44Å; Y1005-L1010 HydrophobicContact CG-CD2 3.53Å; Y1005-L1010 HydrophobicContact CG-CG 4.03Å; Y1005-L1018 WeakPolarHBondContact O-CA 3.38Å; Y1005-L1019 PolarHBondContact O-N 3.26Å
1006	S	90.2	Very high	80.7	Confident	36 Å²	36	67.3 Å²	67.3	25%	0.252	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-20	164.6	66.9	0	0	0	0	113.1	V1002 K1003 F1004 L1019	V1002-S1006 PolarHBondContact O-N 3.37Å; K1003-S1006 PolarHBondContact O-OG 2.94Å; F1004-S1006 VanDerWaalsContact C-N 3.28Å; F1004-S1006 PolarHBondContact O-N 3.26Å; S1006-L1019 WeakPolarHBondContact CA-O 3.48Å; S1006-L1019 WeakPolarHBondContact CB-O 3.35Å
1007	V	87.3	Confident	80.5	Confident	102 Å²	102	64.9 Å²	64.9	62%	0.618	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.7	-20.8	177.4	-58	0	0	0	0	114	F1004 Y1005	F1004-V1007 WeakPolarHBondContact O-CG2 3.22Å; F1004-V1007 PolarHBondContact O-N 3.13Å; Y1005-V1007 VanDerWaalsContact C-N 3.35Å
1008	H	84.1	Confident	80.5	Confident	88 Å²	88	64.4 Å²	64.4	41%	0.407	32%	0.318	S	S	.	.	S	Bend	trans	-108.3	136	172.5	-55.5	97.9	0	0	0	111.1	F1004 Y1005 L1018	F1004-H1008 HydrophobicContact CD1-CB 4.01Å; F1004-H1008 AromaticContact CD1-ND1 3.69Å; F1004-H1008 AromaticContact CD2-CE1 3.63Å; F1004-H1008 AromaticContact CD2-ND1 3.36Å; F1004-H1008 WeakPolarHBondContact CD2-ND1 3.36Å; F1004-H1008 HydrophobicContact CE1-CB 3.55Å; F1004-H1008 AromaticContact CE1-CG 3.65Å; F1004-H1008 AromaticContact CE1-ND1 3.57Å; F1004-H1008 AromaticContact CE2-CE1 3.34Å; F1004-H1008 WeakPolarHBondContact CE2-CE1 3.15Å; F1004-H1008 AromaticContact CE2-CG 3.9Å; F1004-H1008 AromaticContact CE2-ND1 3.23Å; F1004-H1008 WeakPolarHBondContact CE2-ND1 3.46Å; F1004-H1008 AromaticContact CG-ND1 3.59Å; F1004-H1008 HydrophobicContact CZ-CB 3.92Å; F1004-H1008 AromaticContact CZ-CE1 3.78Å; F1004-H1008 AromaticContact CZ-CG 3.52Å; F1004-H1008 AromaticContact CZ-ND1 3.34Å; F1004-H1008 VanDerWaalsContact CZ-ND1 3.34Å; F1004-H1008 WeakPolarHBondContact CZ-ND1 3.23Å; F1004-H1008 PolarHBondContact O-N 3Å; F1004-H1008 PolarHBondContact O-ND1 2.89Å; Y1005-H1008 CarbonylContact C-O 3.58Å; Y1005-H1008 WeakPolarHBondContact CA-O 3.36Å; H1008-L1018 VanDerWaalsContact C-CD2 3.4Å; H1008-L1018 WeakPolarHBondContact O-CD2 3.21Å
1009	S	83.2	Confident	80.6	Confident	39 Å²	39	64.6 Å²	64.6	27%	0.273	32%	0.319	S	S	.	.			trans	-72.5	136.2	-178.2	-54.5	0	0	0	0	112.8	G1011 N1015 Q1017	S1009-G1011 VanDerWaalsContact C-N 3.27Å; S1009-G1011 PolarHBondContact O-N 3.02Å; S1009-N1015 WeakPolarHBondContact OG-CA 3.3Å; S1009-Q1017 VanDerWaalsContact CA-O 3.3Å; S1009-Q1017 WeakPolarHBondContact CA-O 3.35Å
1010	L	76.5	Confident	80.5	Confident	1 Å²	1	64.4 Å²	64.4	1%	0.005	32%	0.324	C	S	.	.	S	Bend	trans	-67.2	-28.2	179.9	-66.5	141.1	0	0	0	112.8	L953 F962 L986 Y1005 Q1017 L1019	L953-L1010 HydrophobicContact CD2-CD1 3.44Å; L953-L1010 VanDerWaalsContact CD2-CD1 3.44Å; F962-L1010 HydrophobicContact CD1-CB 4.43Å; F962-L1010 HydrophobicContact CD2-CD1 4.34Å; F962-L1010 HydrophobicContact CD2-CD2 4.44Å; F962-L1010 HydrophobicContact CE1-CB 3.97Å; F962-L1010 HydrophobicContact CE2-CB 4.08Å; F962-L1010 HydrophobicContact CE2-CD1 3.97Å; F962-L1010 HydrophobicContact CE2-CG 4.48Å; F962-L1010 HydrophobicContact CZ-CB 3.78Å; F962-L1010 HydrophobicContact CZ-CD1 4.46Å; L986-L1010 HydrophobicContact CD1-CD2 4.39Å; L986-L1010 HydrophobicContact CD2-CD2 3.61Å; Y1005-L1010 HydrophobicContact CD1-CB 4.42Å; Y1005-L1010 HydrophobicContact CD1-CD2 3.53Å; Y1005-L1010 HydrophobicContact CD1-CG 3.72Å; Y1005-L1010 HydrophobicContact CD2-CD2 4.06Å; Y1005-L1010 HydrophobicContact CE1-CD2 4.08Å; Y1005-L1010 HydrophobicContact CE1-CG 4.44Å; Y1005-L1010 HydrophobicContact CG-CD2 3.53Å; Y1005-L1010 HydrophobicContact CG-CG 4.03Å; L1010-Q1017 HydrophobicContact CB-CB 4.44Å; L1010-Q1017 PolarHBondContact N-O 2.97Å; L1010-L1019 HydrophobicContact CD1-CD2 3.72Å; L1010-L1019 HydrophobicContact CD1-CG 4.11Å
1011	G	65	Low	80.6	Confident	18 Å²	18	66.3 Å²	66.3	19%	0.186	33%	0.326	C	S	.	.	S	Bend	trans	-106.1	142.5	177.5	0	0	0	0	0	112.9	S1009 N1013 N1014	S1009-G1011 VanDerWaalsContact C-N 3.27Å; S1009-G1011 PolarHBondContact O-N 3.02Å; G1011-N1013 PolarHBondContact O-N 3.33Å; G1011-N1013 VanDerWaalsContact O-N 3.13Å; G1011-N1014 VanDerWaalsContact C-OD1 3.29Å; G1011-N1014 WeakPolarHBondContact CA-OD1 3.35Å; G1011-N1014 PolarHBondContact O-OD1 3.23Å
1012	R	57	Low	80.7	Confident	234 Å²	234	68.8 Å²	68.8	88%	0.883	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-14.1	-179.8	-179.9	174.4	177.2	163.7	2.2	114.4
1013	N	56.9	Low	80.7	Confident	115 Å²	115	68.9 Å²	68.9	62%	0.615	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123	0	-162.5	-59.2	7.3	0	0	0	113.6	G1011	G1011-N1013 PolarHBondContact O-N 3.33Å; G1011-N1013 VanDerWaalsContact O-N 3.13Å
1014	N	60.3	Low	80.5	Confident	46 Å²	46	63 Å²	63	25%	0.246	32%	0.323	C	S	.	.			trans	-152.7	92.1	-162.3	49.8	-11	0	0	0	112.5	G1011 Q1016 Q1017	G1011-N1014 VanDerWaalsContact C-OD1 3.29Å; G1011-N1014 WeakPolarHBondContact CA-OD1 3.35Å; G1011-N1014 PolarHBondContact O-OD1 3.23Å; N1014-Q1016 PolarHBondContact O-N 3.47Å; N1014-Q1017 WeakPolarHBondContact ND2-CG 3.15Å; N1014-Q1017 PolarHBondContact ND2-NE2 3.11Å; N1014-Q1017 PolarHBondContact ND2-OE1 3.4Å; N1014-Q1017 PolarHBondContact O-N 2.96Å; N1014-Q1017 PolarHBondContact OD1-OE1 2.86Å
1015	N	61.7	Low	80.4	Confident	143 Å²	143	63.7 Å²	63.7	77%	0.765	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	13.9	-177.5	-51.6	9.8	0	0	0	115.8	S1009	S1009-N1015 WeakPolarHBondContact OG-CA 3.3Å
1016	Q	68.8	Low	79.9	Confident	141 Å²	141	67.1 Å²	67.1	66%	0.659	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.4	-7.6	-174.9	-66.5	179.4	-15.3	0	0	112.9	N1014 L1018	N1014-Q1016 PolarHBondContact O-N 3.47Å; Q1016-L1018 PolarHBondContact O-N 3.2Å
1017	Q	81.9	Confident	79.1	Confident	7 Å²	7	68.1 Å²	68.1	3%	0.033	35%	0.346	C	S	.	.			trans	-81.6	73.2	172.3	-77.1	-171	-29.7	0	0	110.8	L953 T955 N960 S1009 L1010 N1014	L953-Q1017 HydrophobicContact CD2-CB 3.86Å; L953-Q1017 HydrophobicContact CD2-CG 4.04Å; T955-Q1017 HydrophobicContact CG2-CG 4.09Å; N960-Q1017 PolarHBondContact ND2-NE2 3.41Å; N960-Q1017 PolarHBondContact OD1-NE2 3.1Å; S1009-Q1017 VanDerWaalsContact CA-O 3.3Å; S1009-Q1017 WeakPolarHBondContact CA-O 3.35Å; L1010-Q1017 HydrophobicContact CB-CB 4.44Å; L1010-Q1017 PolarHBondContact N-O 2.97Å; N1014-Q1017 WeakPolarHBondContact ND2-CG 3.15Å; N1014-Q1017 PolarHBondContact ND2-NE2 3.11Å; N1014-Q1017 PolarHBondContact ND2-OE1 3.4Å; N1014-Q1017 PolarHBondContact O-N 2.96Å; N1014-Q1017 PolarHBondContact OD1-OE1 2.86Å
1018	L	87.9	Confident	78.2	Confident	34 Å²	34	69.2 Å²	69.2	18%	0.178	36%	0.355	C	S	.	.			trans	-112.6	145.5	177	-62.7	176.2	0	0	0	110.4	G936 Y1005 H1008 Q1016 L1020	G936-L1018 WeakPolarHBondContact CA-O 3.48Å; Y1005-L1018 WeakPolarHBondContact O-CA 3.38Å; H1008-L1018 VanDerWaalsContact C-CD2 3.4Å; H1008-L1018 WeakPolarHBondContact O-CD2 3.21Å; Q1016-L1018 PolarHBondContact O-N 3.2Å; L1018-L1020 HydrophobicContact CB-CD2 3.7Å; L1018-L1020 HydrophobicContact CB-CG 3.87Å; L1018-L1020 HydrophobicContact CD1-CD2 4.24Å; L1018-L1020 PolarHBondContact O-N 3.41Å; L1018-L1020 VanDerWaalsContact O-N 3.13Å
1019	L	91.9	Very high	77.4	Confident	4 Å²	4	70.8 Å²	70.8	2%	0.021	37%	0.371	C	S	.	.			trans	-81	83.7	174.4	-57	-176.5	0	0	0	110.1	F938 I951 L953 V1002 Y1005 S1006 L1010	F938-L1019 HydrophobicContact CB-CD2 3.59Å; F938-L1019 HydrophobicContact CD1-CB 3.68Å; F938-L1019 HydrophobicContact CD1-CD2 4.21Å; F938-L1019 HydrophobicContact CD1-CG 4.5Å; F938-L1019 HydrophobicContact CD2-CB 4.21Å; F938-L1019 HydrophobicContact CD2-CD1 4.3Å; F938-L1019 HydrophobicContact CD2-CD2 3.95Å; F938-L1019 HydrophobicContact CD2-CG 4.38Å; F938-L1019 HydrophobicContact CE1-CB 3.73Å; F938-L1019 HydrophobicContact CE2-CB 4.26Å; F938-L1019 HydrophobicContact CE2-CD1 4.4Å; F938-L1019 HydrophobicContact CG-CB 3.92Å; F938-L1019 HydrophobicContact CG-CD2 3.65Å; F938-L1019 HydrophobicContact CG-CG 4.27Å; F938-L1019 HydrophobicContact CZ-CB 4.03Å; I951-L1019 HydrophobicContact CG2-CD1 4.36Å; I951-L1019 HydrophobicContact CG2-CD2 3.73Å; L953-L1019 HydrophobicContact CD1-CD2 4.39Å; V1002-L1019 HydrophobicContact CB-CD1 4.35Å; V1002-L1019 HydrophobicContact CG1-CD1 4.14Å; V1002-L1019 HydrophobicContact CG2-CD1 4.31Å; Y1005-L1019 PolarHBondContact O-N 3.26Å; S1006-L1019 WeakPolarHBondContact CA-O 3.48Å; S1006-L1019 WeakPolarHBondContact CB-O 3.35Å; L1010-L1019 HydrophobicContact CD1-CD2 3.72Å; L1010-L1019 HydrophobicContact CD1-CG 4.11Å
1020	L	90.7	Very high	76.8	Confident	82 Å²	82	73.1 Å²	73.1	43%	0.429	38%	0.38	S	S	.	.			trans	-95.5	-44.4	-171.2	-59.4	-179.4	0	0	0	113.9	G936 L1018	G936-L1020 PolarHBondContact O-N 3.44Å; L1018-L1020 HydrophobicContact CB-CD2 3.7Å; L1018-L1020 HydrophobicContact CB-CG 3.87Å; L1018-L1020 HydrophobicContact CD1-CD2 4.24Å; L1018-L1020 PolarHBondContact O-N 3.41Å; L1018-L1020 VanDerWaalsContact O-N 3.13Å
1021	Y	92.8	Very high	77	Confident	114 Å²	114	74 Å²	74	45%	0.447	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	104.7	-171.7	-52.9	-65.8	0	0	0	110.3	K934 N935 G936 S937 F938	K934-Y1021 HydrophobicContact CB-CD2 3.74Å; K934-Y1021 HydrophobicContact CB-CE2 4.13Å; K934-Y1021 HydrophobicContact CB-CG 4.46Å; K934-Y1021 HydrophobicContact CD-CD2 4.4Å; K934-Y1021 HydrophobicContact CD-CG 4.42Å; N935-Y1021 VanDerWaalsContact O-CE2 3.32Å; N935-Y1021 WeakPolarHBondContact O-CE2 3.45Å; G936-Y1021 PolarHBondContact O-N 3.04Å; S937-Y1021 CarbonylContact C-O 3.53Å; S937-Y1021 WeakPolarHBondContact CA-O 3.27Å; F938-Y1021 WeakPolarHBondContact CD1-O 3.38Å; F938-Y1021 PolarHBondContact N-O 3.35Å
1022	P	93.9	Very high	77.8	Confident	52 Å²	52	75 Å²	75	34%	0.338	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	144.5	174.3	29.7	-35.5	0	0	0	110	W915 F938	W915-P1022 HydrophobicContact CB-CB 3.87Å; W915-P1022 HydrophobicContact CG-CB 4.31Å; F938-P1022 HydrophobicContact CE1-CB 4.15Å; F938-P1022 HydrophobicContact CZ-CB 4.02Å
1023	V	92.6	Very high	79.2	Confident	11 Å²	11	64.4 Å²	64.4	7%	0.067	35%	0.347	C	S	.	.			trans	-111.7	120.6	176	177.5	0	0	0	0	108.8	H917 L928 L929 S932 F938 L939	H917-V1023 PolarHBondContact NE2-O 3.01Å; L928-V1023 HydrophobicContact CB-CG1 4.21Å; L929-V1023 HydrophobicContact CD2-CG2 4.05Å; S932-V1023 WeakPolarHBondContact OG-CG2 3.34Å; F938-V1023 PolarHBondContact O-N 3.07Å; L939-V1023 HydrophobicContact CD2-CB 4.5Å; L939-V1023 HydrophobicContact CD2-CG1 4.45Å
1024	G	88.4	Confident	80.4	Confident	22 Å²	22	59.5 Å²	59.5	23%	0.227	32%	0.321	C	S	.	.			trans	-70.2	175.2	177.4	0	0	0	0	0	115.1	E914 H917	E914-G1024 VanDerWaalsContact CG-CA 3.42Å; E914-G1024 PolarHBondContact OE1-N 3.29Å; H917-G1024 PolarHBondContact CE1-O 2.99Å; H917-G1024 PolarHBondContact NE2-O 2.8Å
1025	Q	86.3	Confident	81.4	Confident	44 Å²	44	61.6 Å²	61.6	21%	0.206	33%	0.332	C	S	.	.			trans	-56.4	156.5	-174.4	-50.5	-60.9	-85.4	0	0	113.8	E914 F916 P1031 D1032	E914-Q1025 PolarHBondContact O-NE2 3Å; F916-Q1025 PolarHBondContact O-NE2 3.4Å; Q1025-P1031 HydrophobicContact CG-CB 4.44Å; Q1025-D1032 VanDerWaalsContact CA-OD2 3.3Å; Q1025-D1032 WeakPolarHBondContact CA-OD2 3.34Å; Q1025-D1032 VanDerWaalsContact CB-OD2 3.3Å; Q1025-D1032 WeakPolarHBondContact CB-OD2 3.23Å
1026	E	79.4	Confident	82.6	Confident	77 Å²	77	54.9 Å²	54.9	36%	0.36	30%	0.296	S	S	.	.	S	Bend	trans	-68	-38	170.1	-168.9	160.3	-164.8	0	0	110.8	Q924 R927 L928 D1032	Q924-E1026 PolarHBondContact NE2-OE2 2.93Å; R927-E1026 IonicContact CZ-OE1 2.67Å; R927-E1026 IonicContact NH1-OE1 3.68Å; R927-E1026 PolarHBondContact NH1-OE1 3.38Å; R927-E1026 IonicContact NH2-OE1 2.75Å; R927-E1026 PolarHBondContact NH2-OE1 3.4Å; R927-E1026 IonicContact NH2-OE2 2.74Å; R927-E1026 PolarHBondContact NH2-OE2 2.93Å; L928-E1026 HydrophobicContact CD1-CB 4.14Å; L928-E1026 HydrophobicContact CD2-CB 3.95Å; L928-E1026 HydrophobicContact CD2-CG 4.09Å; E1026-D1032 PolarHBondContact N-OD2 3.14Å
1027	N	74.6	Confident	83.3	Confident	56 Å²	56	49.1 Å²	49.1	30%	0.299	27%	0.269	S	S	.	.			trans	-113.8	123.3	176.7	-177.2	17.6	0	0	0	113.5	T1029 L1030	N1027-T1029 PolarHBondContact ND2-OG1 3.28Å; N1027-T1029 PolarHBondContact OD1-N 3.17Å; N1027-T1029 PolarHBondContact OD1-OG1 3.48Å; N1027-L1030 WeakPolarHBondContact ND2-CB 3.14Å; N1027-L1030 PolarHBondContact ND2-N 2.78Å; N1027-L1030 PolarHBondContact ND2-O 3.02Å
1028	P	68.6	Low	83.2	Confident	125 Å²	125	51.2 Å²	51.2	81%	0.812	28%	0.277	S	S	*	.	S	Bend	trans	-80.1	-12.4	176.1	32.6	-36.8	0	0	0	115.2
1029	T	66.4	Low	82.2	Confident	121 Å²	121	51.6 Å²	51.6	74%	0.742	28%	0.283	S	S	*	.	S	Bend	trans	-93.4	-35.7	-178.2	63.8	0	0	0	0	113.6	N1027	N1027-T1029 PolarHBondContact ND2-OG1 3.28Å; N1027-T1029 PolarHBondContact OD1-N 3.17Å; N1027-T1029 PolarHBondContact OD1-OG1 3.48Å
1030	L	71.8	Confident	80.4	Confident	88 Å²	88	59.9 Å²	59.9	46%	0.461	31%	0.313	S	S	.	.	S	Bend	trans	-131.7	107	178.5	-161.9	80.9	0	0	0	107	F900 N1027 L1034	F900-L1030 HydrophobicContact CZ-CD1 4.45Å; N1027-L1030 WeakPolarHBondContact ND2-CB 3.14Å; N1027-L1030 PolarHBondContact ND2-N 2.78Å; N1027-L1030 PolarHBondContact ND2-O 3.02Å; L1030-L1034 HydrophobicContact CD1-CD2 3.5Å; L1030-L1034 VanDerWaalsContact CD1-CD2 3.5Å; L1030-L1034 HydrophobicContact CD2-CD2 4.48Å; L1030-L1034 HydrophobicContact CG-CD2 3.9Å
1031	P	79.7	Confident	78.6	Confident	20 Å²	20	58.4 Å²	58.4	13%	0.13	31%	0.309	C	S	.	.			trans	-63.3	142.8	-175	-22	32.5	0	0	0	112.4	F909 Q1025 Y1033 L1034	F909-P1031 HydrophobicContact CD1-CG 4.29Å; F909-P1031 HydrophobicContact CG-CG 4.34Å; Q1025-P1031 HydrophobicContact CG-CB 4.44Å; P1031-Y1033 HydrophobicContact CB-CD1 3.85Å; P1031-Y1033 HydrophobicContact CB-CD2 4.23Å; P1031-Y1033 HydrophobicContact CB-CE1 3.37Å; P1031-Y1033 HydrophobicContact CB-CE2 3.78Å; P1031-Y1033 HydrophobicContact CB-CG 4.25Å; P1031-Y1033 HydrophobicContact CG-CE1 4.28Å; P1031-Y1033 HydrophobicContact CG-CE2 4.28Å; P1031-Y1033 PolarHBondContact O-N 3.43Å; P1031-Y1033 VanDerWaalsContact O-N 3.13Å; P1031-L1034 VanDerWaalsContact O-CB 3.29Å; P1031-L1034 WeakPolarHBondContact O-CB 3.41Å; P1031-L1034 PolarHBondContact O-N 3.43Å
1032	D	82.8	Confident	76.4	Confident	39 Å²	39	58.7 Å²	58.7	21%	0.209	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-24.6	-172.8	-52.8	-49.2	0	0	0	112.1	H917 Q1025 E1026 L1034	H917-D1032 CarbonylContact O-C 3.53Å; Q1025-D1032 VanDerWaalsContact CA-OD2 3.3Å; Q1025-D1032 WeakPolarHBondContact CA-OD2 3.34Å; Q1025-D1032 VanDerWaalsContact CB-OD2 3.3Å; Q1025-D1032 WeakPolarHBondContact CB-OD2 3.23Å; E1026-D1032 PolarHBondContact N-OD2 3.14Å; D1032-L1034 VanDerWaalsContact C-N 3.32Å; D1032-L1034 PolarHBondContact O-N 3.07Å
1033	Y	85.7	Confident	73.8	Confident	11 Å²	11	60.9 Å²	60.9	4%	0.043	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-2.1	173	60.8	-102.5	0	0	0	115.5	L895 F909 V912 F916 P1031 D1035 I1036 F1037	L895-Y1033 HydrophobicContact CD1-CE2 4.49Å; F909-Y1033 AromaticContact CD1-CE2 3.96Å; F909-Y1033 HydrophobicContact CD1-CE2 3.96Å; F909-Y1033 WeakPolarHBondContact CD1-OH 3.32Å; F909-Y1033 HydrophobicContact CE1-CE2 4.29Å; V912-Y1033 HydrophobicContact CB-CE1 4.23Å; V912-Y1033 HydrophobicContact CG1-CD1 4.12Å; V912-Y1033 HydrophobicContact CG1-CE1 3.59Å; V912-Y1033 HydrophobicContact CG1-CE2 4.26Å; V912-Y1033 HydrophobicContact CG2-CE2 3.96Å; V912-Y1033 WeakPolarHBondContact CG2-OH 3.06Å; F916-Y1033 HydrophobicContact CD1-CD1 4.09Å; F916-Y1033 HydrophobicContact CD1-CG 4.07Å; F916-Y1033 HydrophobicContact CE1-CG 4.25Å; F916-Y1033 WeakPolarHBondContact O-CD1 3.33Å; P1031-Y1033 HydrophobicContact CB-CD1 3.85Å; P1031-Y1033 HydrophobicContact CB-CD2 4.23Å; P1031-Y1033 HydrophobicContact CB-CE1 3.37Å; P1031-Y1033 HydrophobicContact CB-CE2 3.78Å; P1031-Y1033 HydrophobicContact CB-CG 4.25Å; P1031-Y1033 HydrophobicContact CG-CE1 4.28Å; P1031-Y1033 HydrophobicContact CG-CE2 4.28Å; P1031-Y1033 PolarHBondContact O-N 3.43Å; P1031-Y1033 VanDerWaalsContact O-N 3.13Å; Y1033-D1035 VanDerWaalsContact C-N 3.33Å; Y1033-D1035 PolarHBondContact O-N 3.42Å; Y1033-I1036 WeakPolarHBondContact O-CG1 3.45Å; Y1033-I1036 PolarHBondContact O-N 2.97Å; Y1033-F1037 AromaticContact CD2-CD2 3.98Å; Y1033-F1037 HydrophobicContact CD2-CD2 3.98Å; Y1033-F1037 AromaticContact CD2-CE2 3.92Å; Y1033-F1037 HydrophobicContact CD2-CE2 3.92Å; Y1033-F1037 HydrophobicContact CG-CE2 4.42Å; Y1033-F1037 VanDerWaalsContact O-CD2 3.3Å; Y1033-F1037 WeakPolarHBondContact O-CD2 3.36Å
1034	L	82.9	Confident	71.1	Confident	12 Å²	12	66.7 Å²	66.7	6%	0.063	37%	0.366	C	S	.	.	H	α-helix	trans	-64.9	-39	-174.3	-164.3	74.1	0	0	0	112.1	F900 F909 L1030 P1031 D1032 I1036 F1037 Y1038	F900-L1034 HydrophobicContact CD1-CD2 4.22Å; F900-L1034 HydrophobicContact CD2-CD1 3.72Å; F900-L1034 HydrophobicContact CD2-CD2 4.05Å; F900-L1034 HydrophobicContact CD2-CG 4.4Å; F900-L1034 HydrophobicContact CE1-CD2 4.05Å; F900-L1034 HydrophobicContact CE2-CD1 4.05Å; F900-L1034 HydrophobicContact CE2-CD2 3.88Å; F900-L1034 HydrophobicContact CG-CD1 4.27Å; F900-L1034 HydrophobicContact CG-CD2 4.21Å; F900-L1034 HydrophobicContact CZ-CD2 3.88Å; F909-L1034 HydrophobicContact CE1-CD1 3.87Å; F909-L1034 HydrophobicContact CZ-CD1 3.94Å; L1030-L1034 HydrophobicContact CD1-CD2 3.5Å; L1030-L1034 VanDerWaalsContact CD1-CD2 3.5Å; L1030-L1034 HydrophobicContact CD2-CD2 4.48Å; L1030-L1034 HydrophobicContact CG-CD2 3.9Å; P1031-L1034 VanDerWaalsContact O-CB 3.29Å; P1031-L1034 WeakPolarHBondContact O-CB 3.41Å; P1031-L1034 PolarHBondContact O-N 3.43Å; D1032-L1034 VanDerWaalsContact C-N 3.32Å; D1032-L1034 PolarHBondContact O-N 3.07Å; L1034-I1036 VanDerWaalsContact C-N 3.34Å; L1034-I1036 PolarHBondContact O-N 3.08Å; L1034-F1037 PolarHBondContact O-N 3.43Å; L1034-Y1038 HydrophobicContact CD1-CD2 3.61Å; L1034-Y1038 HydrophobicContact CD1-CE2 3.86Å; L1034-Y1038 HydrophobicContact CG-CD2 4.07Å; L1034-Y1038 PolarHBondContact O-N 3.35Å
1035	D	81.5	Confident	68.3	Low	90 Å²	90	70.6 Å²	70.6	48%	0.481	39%	0.389	S	S	.	.	H	α-helix	trans	-60.6	-39.3	-178.6	-80.8	-30.4	0	0	0	112.8	Y1033 F1037 Y1038 S1039	Y1033-D1035 VanDerWaalsContact C-N 3.33Å; Y1033-D1035 PolarHBondContact O-N 3.42Å; D1035-F1037 VanDerWaalsContact C-N 3.25Å; D1035-F1037 PolarHBondContact O-N 3.37Å; D1035-Y1038 PolarHBondContact O-N 3.5Å; D1035-S1039 WeakPolarHBondContact O-CB 3.11Å; D1035-S1039 PolarHBondContact O-N 3.11Å; D1035-S1039 VanDerWaalsContact OD1-CB 3.28Å; D1035-S1039 WeakPolarHBondContact OD1-CB 3.45Å; D1035-S1039 PolarHBondContact OD1-OG 2.98Å
1036	I	85.6	Confident	65.6	Low	3 Å²	3	74.2 Å²	74.2	2%	0.015	42%	0.419	C	S	.	.	H	α-helix	trans	-72.9	-15.3	-176.3	56	157.1	0	0	0	114.4	F881 F916 G918 F919 L942 Y1033 L1034	F881-I1036 HydrophobicContact CD1-CB 4.11Å; F881-I1036 WeakPolarHBondContact CD1-O 3.37Å; F881-I1036 HydrophobicContact CE1-CB 3.91Å; F881-I1036 HydrophobicContact CE1-CD1 3.77Å; F881-I1036 HydrophobicContact CE1-CG1 4.14Å; F881-I1036 VanDerWaalsContact CE1-O 3.3Å; F881-I1036 WeakPolarHBondContact CE1-O 3.21Å; F881-I1036 HydrophobicContact CE2-CD1 4.27Å; F881-I1036 HydrophobicContact CZ-CD1 3.63Å; F881-I1036 HydrophobicContact CZ-CG1 4.47Å; F916-I1036 HydrophobicContact CE1-CD1 3.85Å; F916-I1036 HydrophobicContact CZ-CD1 3.84Å; G918-I1036 VanDerWaalsContact CA-CD1 3.44Å; F919-I1036 HydrophobicContact CB-CG2 4.32Å; F919-I1036 HydrophobicContact CD2-CG2 3.25Å; F919-I1036 HydrophobicContact CE2-CG2 3.77Å; F919-I1036 HydrophobicContact CG-CG2 4.01Å; L942-I1036 HydrophobicContact CD1-CD1 3.96Å; L942-I1036 HydrophobicContact CD1-CG2 4.02Å; Y1033-I1036 WeakPolarHBondContact O-CG1 3.45Å; Y1033-I1036 PolarHBondContact O-N 2.97Å; L1034-I1036 VanDerWaalsContact C-N 3.34Å; L1034-I1036 PolarHBondContact O-N 3.08Å
1037	F	83.8	Confident	63.2	Low	20 Å²	20	76.7 Å²	76.7	9%	0.088	44%	0.44	C	S	.	.	H	α-helix	trans	-100.9	-23.5	176.7	-69.4	-63.8	0	0	0	113.1	F881 A886 L889 L890 F893 L895 F916 Y1033 L1034 D1035	F881-F1037 HydrophobicContact CE1-CD1 4.18Å; F881-F1037 HydrophobicContact CE1-CE1 4.04Å; F881-F1037 HydrophobicContact CZ-CD1 4.4Å; F881-F1037 AromaticContact CZ-CE1 3.8Å; F881-F1037 HydrophobicContact CZ-CE1 3.8Å; F881-F1037 HydrophobicContact CZ-CZ 4.11Å; A886-F1037 HydrophobicContact CB-CD1 4.45Å; L889-F1037 HydrophobicContact CB-CE1 3.89Å; L889-F1037 HydrophobicContact CB-CZ 3.95Å; L890-F1037 HydrophobicContact CD2-CB 4.16Å; L890-F1037 HydrophobicContact CD2-CD1 3.62Å; L890-F1037 HydrophobicContact CD2-CE1 4.21Å; L890-F1037 HydrophobicContact CD2-CG 3.98Å; L890-F1037 HydrophobicContact CG-CD1 3.76Å; L890-F1037 HydrophobicContact CG-CE1 4.12Å; F893-F1037 HydrophobicContact CD2-CZ 4.13Å; F893-F1037 HydrophobicContact CE2-CZ 4.25Å; L895-F1037 HydrophobicContact CD1-CD2 3.83Å; L895-F1037 HydrophobicContact CD1-CE2 3.72Å; L895-F1037 HydrophobicContact CD1-CG 4.35Å; L895-F1037 HydrophobicContact CD1-CZ 4.15Å; F916-F1037 AromaticContact CE1-CE2 3.94Å; F916-F1037 HydrophobicContact CE1-CE2 3.94Å; F916-F1037 HydrophobicContact CE1-CZ 4.11Å; F916-F1037 HydrophobicContact CZ-CZ 4.39Å; Y1033-F1037 AromaticContact CD2-CD2 3.98Å; Y1033-F1037 HydrophobicContact CD2-CD2 3.98Å; Y1033-F1037 AromaticContact CD2-CE2 3.92Å; Y1033-F1037 HydrophobicContact CD2-CE2 3.92Å; Y1033-F1037 HydrophobicContact CG-CE2 4.42Å; Y1033-F1037 VanDerWaalsContact O-CD2 3.3Å; Y1033-F1037 WeakPolarHBondContact O-CD2 3.36Å; L1034-F1037 PolarHBondContact O-N 3.43Å; D1035-F1037 VanDerWaalsContact C-N 3.25Å; D1035-F1037 PolarHBondContact O-N 3.37Å
1038	Y	79	Confident	61	Low	50 Å²	50	85.6 Å²	85.6	20%	0.196	47%	0.469	C	S	.	.	H	α-helix	trans	-139.2	-17.4	-165.5	-56.6	-60.9	0	0	0	116	L890 P896 G899 F900 L1034 D1035 R1040	L890-Y1038 HydrophobicContact CD2-CE1 4.4Å; P896-Y1038 WeakPolarHBondContact CD-OH 3.28Å; P896-Y1038 WeakPolarHBondContact CG-OH 3.08Å; P896-Y1038 WeakPolarHBondContact O-CE1 3.5Å; P896-Y1038 PolarHBondContact O-OH 3.19Å; G899-Y1038 VanDerWaalsContact C-CE1 3.47Å; F900-Y1038 HydrophobicContact CB-CD1 4.12Å; F900-Y1038 HydrophobicContact CB-CD2 3.72Å; F900-Y1038 HydrophobicContact CB-CE2 4.18Å; F900-Y1038 HydrophobicContact CB-CG 3.67Å; F900-Y1038 VanDerWaalsContact N-CD1 3.32Å; L1034-Y1038 HydrophobicContact CD1-CD2 3.61Å; L1034-Y1038 HydrophobicContact CD1-CE2 3.86Å; L1034-Y1038 HydrophobicContact CG-CD2 4.07Å; L1034-Y1038 PolarHBondContact O-N 3.35Å; D1035-Y1038 PolarHBondContact O-N 3.5Å; Y1038-R1040 PolarHBondContact O-N 3.13Å
1039	S	67.4	Low	59.1	Low	43 Å²	43	91 Å²	91	30%	0.301	49%	0.49	S	S	.	.			trans	-92.4	102.2	-177.6	-67.5	0	0	0	0	111.4	Y878 D1035	Y878-S1039 WeakPolarHBondContact CE2-O 3.19Å; Y878-S1039 PolarHBondContact OH-O 3.04Å; D1035-S1039 WeakPolarHBondContact O-CB 3.11Å; D1035-S1039 PolarHBondContact O-N 3.11Å; D1035-S1039 VanDerWaalsContact OD1-CB 3.28Å; D1035-S1039 WeakPolarHBondContact OD1-CB 3.45Å; D1035-S1039 PolarHBondContact OD1-OG 2.98Å
1040	R	55.7	Low	58.7	Low	177 Å²	177	89.5 Å²	89.5	67%	0.668	48%	0.477	S	S	*	.			trans	-60.9	134.6	-177.2	-150	177.4	-146.4	169.9	5.6	111.3	Y1038 D1042 S1043	Y1038-R1040 PolarHBondContact O-N 3.13Å; R1040-D1042 PolarHBondContact O-N 3.4Å; R1040-S1043 PolarHBondContact O-N 3.07Å; R1040-S1043 PolarHBondContact O-OG 3.16Å
1041	P	52	Low	58.1	Low	52 Å²	52	89.5 Å²	89.5	34%	0.338	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-6.1	-170.7	26.6	-35.7	0	0	0	115.1	Y878 S1043	Y878-P1041 HydrophobicContact CD1-CB 4.12Å; Y878-P1041 HydrophobicContact CD1-CG 4Å; Y878-P1041 HydrophobicContact CE1-CB 4.19Å; Y878-P1041 HydrophobicContact CE1-CG 3.73Å; P1041-S1043 VanDerWaalsContact C-N 3.32Å
1042	D	47.1	Very low	56.9	Low	120 Å²	120	93.4 Å²	93.4	64%	0.642	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-9	177.7	-53.1	-58.4	0	0	0	113.7	R1040 N1044	R1040-D1042 PolarHBondContact O-N 3.4Å; D1042-N1044 PolarHBondContact O-N 3.46Å; D1042-N1044 PolarHBondContact O-ND2 3.18Å; D1042-N1044 VanDerWaalsContact O-ND2 3.09Å
1043	S	38.3	Very low	55.3	Low	98 Å²	98	96.6 Å²	96.6	69%	0.685	51%	0.514	S	S	*	.			trans	-74.5	62.8	179.6	65	0	0	0	0	112.5	R1040 P1041 S1045	R1040-S1043 PolarHBondContact O-N 3.07Å; R1040-S1043 PolarHBondContact O-OG 3.16Å; P1041-S1043 VanDerWaalsContact C-N 3.32Å; S1043-S1045 PolarHBondContact O-N 2.77Å
1044	N	35.5	Very low	53.4	Low	133 Å²	133	101.9 Å²	101.9	71%	0.711	54%	0.544	S	S	*	.			trans	-57.4	122.5	177.9	-75.1	-83	0	0	0	111.4	D1042	D1042-N1044 PolarHBondContact O-N 3.46Å; D1042-N1044 PolarHBondContact O-ND2 3.18Å; D1042-N1044 VanDerWaalsContact O-ND2 3.09Å
1045	S	30.5	Very low	51.5	Low	104 Å²	104	107.9 Å²	107.9	73%	0.727	58%	0.576	S	S	*	*	S	Bend	trans	33	113.1	153.6	60.5	0	0	0	0	118.2	S1043	S1043-S1045 PolarHBondContact O-N 2.77Å
1046	S	29.6	Very low	49.3	Very low	119 Å²	119	109.2 Å²	109.2	83%	0.832	58%	0.583	S	S	*	*			trans	97	64.2	170.3	-38.7	0	0	0	0	116.6
1047	T	29.7	Very low	46.5	Very low	129 Å²	129	117.4 Å²	117.4	79%	0.791	63%	0.626	S	S	*	*				-154.7	102.4	125.8	-67.5	0	0	0	0	108.4	L1049	T1047-L1049 HydrophobicContact CG2-CD1 4.45Å; T1047-L1049 HydrophobicContact CG2-CG 4.42Å
1048	R	27.4	Very low	43.4	Very low	244 Å²	244	125.5 Å²	125.5	92%	0.921	67%	0.671	S	S	*	*			trans	-108.8	125.2	158.5	-99	-172	171.3	-170.4	-4.2	106.7
1049	L	29	Very low	40.2	Very low	237 Å²	237	132.4 Å²	132.4	100%	1.241	71%	0.714	S	S	*	*			trans	-126.6	0	166.1	-76.7	172	0	0	0	107.1	T1047	T1047-L1049 HydrophobicContact CG2-CD1 4.45Å; T1047-L1049 HydrophobicContact CG2-CG 4.42Å

Retrieved 1,049 of 1,049 residues in 176.5 ms (Link to these results)

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