A0A5K4FCM9_SCHMA Loading...

Uncharacterized protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4FCM9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,117 aa.

						>A0A5K4FCM9_SCHMA|A0A5K4FCM9
MTTMTNLSMEQDENNQDVLEFEDNLEKMSRDLVTDILNRARSAITHESLDTKQIMLPSQDFASSLPQLSITTPSPPKYVGENDKNVEECTDAFVTTPVSQKSAINEEIQPSNVHEDLTIQQAPSEEKLPNHYQTKFDFKSNILNDFRGIGVGSATPDTPRQRDYQWKSSIDLPPTNNTTFTHSYDYPQKPVYLREMSLSPPSLSCDLIKDDLITSSRPTNSNCIDEFTTSCRMLTYRQDSPTVINTDDIEQKLKPFSTPLPIYIPSTACTRILKQSEVYKFTGDYNSQPSRLRYNDSEIGKLSHSDSISSELEKLSIDHKNDSYVTNKKQSKKPNIPRLQLPSSPKLSHSPKTNPIRIRQSSLPRHSIPTSKSNNLKIPKSTSSSLCWWEPLHHHNTPIIESYNDKSNLPEPNPEVLKHYYYLCSQQPIKEANLMKAINEAEIQAKYNKIAHYEYLRQKSLQQQHQQHKRIRFLNSHQSRKFDMELKHLNKINHHHNTSTTTTNNNNSSINSTHRLSLCRPEQFTHLLQKENKPNKSFQYPNKDDPYPIMMKKSKKQRSILSSTVHNSQPRKVSSRSNSQVRSSLKVRNNSLDKNEYHQNDNINHHNHLDHHERRLHSSNNRRTQGSQSPIDNKRNIIKDSDYNRSIHSPISYFLDFNDKPDYNQHCTNLHSEYCHINKQNADSPTYIHSEYEDNLPKQFHSTNLQTENNSCENESYNKSIHSRRNNLRPIHHPNSSFHRNSDLSSGSLDRLRRRCHSIERELGTIERDKYEQTLSNPIPSDPRVDALTSANRILRQRLYDIQKTQENREHALNKAHEMVDGLLNKQQKQASIIRESTRNYAQTPSTLLTTNHDINDDDDDHNRKSYPTNLYKPMIKEDSLNLPTYTPTKYGHYHNQHHLQCHHDPNHITDYYGRHSNQHSPYNYCPNQRKPFDFTNHHSTNVLLEKLRSDYADLANSVYRIEEKARDAASSVQSLLKQFQMGLIMEPVNFNSMNQLPNSDSYESFNKESQSNELYDKSVMFRLQKARDTLDQLKSDSFRPSINCHRQVDYTVPLTISVTTTTNSLLSSSSIPLMTTTSGTVSSKINHYNLHEPYFKHPNMYNHPYSNPLRSTWNIS
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.8	Very low	37.1	Very low	241 Å²	241	157.6 Å²	157.6	100%	1.187	84%	0.841	S	S	*	*				0	103.2	0	-78.3	178.5	164.4	0	0	109.4
2	T	36.6	Very low	37.7	Very low	146 Å²	146	153 Å²	153	90%	0.896	82%	0.816	S	S	*	*			trans	-166	153	159.3	-7.2	0	0	0	0	109.1
3	T	34.9	Very low	38.3	Very low	127 Å²	127	153.8 Å²	153.8	78%	0.779	81%	0.812	S	S	*	*			trans	-77.6	133.9	-162.3	37.8	0	0	0	0	114.6	T5	T3-T5 PolarHBondContact O-N 3.32Å
4	M	31.1	Very low	39	Very low	169 Å²	169	151.9 Å²	151.9	83%	0.833	80%	0.803	S	S	*	*			trans	-78.8	100.1	163.5	-80.2	-103.3	-156.7	0	0	109.7	N6	M4-N6 PolarHBondContact O-N 3.37Å
5	T	40.1	Very low	39.8	Very low	130 Å²	130	147.5 Å²	147.5	80%	0.798	78%	0.78	S	S	*	*			trans	-84	96.7	163.5	49.6	0	0	0	0	109	T3	T3-T5 PolarHBondContact O-N 3.32Å
6	N	39.1	Very low	40.8	Very low	133 Å²	133	145.2 Å²	145.2	71%	0.711	76%	0.763	S	S	*	*			trans	-80.6	144.1	178.9	-88.6	-29.8	0	0	0	112.5	M4	M4-N6 PolarHBondContact O-N 3.37Å
7	L	32	Very low	42.1	Very low	174 Å²	174	143.1 Å²	143.1	91%	0.911	75%	0.753	S	S	*	*			trans	-57.4	129.3	178.6	-61.3	107.8	0	0	0	113.1
8	S	35	Very low	43.5	Very low	98 Å²	98	139.3 Å²	139.3	69%	0.685	74%	0.736	S	S	*	*			trans	-161.5	93.1	156.1	-178.4	0	0	0	0	109
9	M	41.3	Very low	44.8	Very low	154 Å²	154	136.7 Å²	136.7	76%	0.759	72%	0.723	S	S	*	*			trans	-138.4	11	176.4	-72.9	-146.3	-47.7	0	0	114.5
10	E	40.7	Very low	46.3	Very low	199 Å²	199	132.1 Å²	132.1	93%	0.93	70%	0.696	S	S	*	*	S	Bend	trans	-102.4	19.2	-179.9	-72.5	-172.8	144	0	0	113.9
11	Q	40.8	Very low	47.7	Very low	163 Å²	163	132.3 Å²	132.3	76%	0.762	69%	0.692	S	S	*	*	S	Bend	trans	-122	-4.9	175.1	-84.3	-171.4	-31	0	0	115.4
12	D	45.4	Very low	49.7	Very low	102 Å²	102	126.3 Å²	126.3	55%	0.545	66%	0.661	S	S	.	*	S	Bend	trans	-90	-18.4	-174.6	-80.6	-36.3	0	0	0	115.5	N14 N15 Q16	D12-N14 PolarHBondContact O-N 3.36Å; D12-N15 PolarHBondContact O-N 3.44Å; D12-Q16 PolarHBondContact O-N 3.03Å
13	E	44.9	Very low	51.7	Low	163 Å²	163	124.5 Å²	124.5	76%	0.762	65%	0.646	S	S	*	*	H	α-helix	trans	-59.5	-35.5	-178.5	-65.4	-166.1	151.1	0	0	112.1	N15 Q16 D17	E13-N15 VanDerWaalsContact C-N 3.34Å; E13-N15 PolarHBondContact O-N 3.32Å; E13-Q16 PolarHBondContact O-N 3.11Å; E13-D17 PolarHBondContact O-N 3.23Å
14	N	47.6	Very low	53.9	Low	127 Å²	127	122.5 Å²	122.5	68%	0.679	63%	0.631	S	S	*	*	H	α-helix	trans	-79.7	-12.4	178.9	-159.1	75.1	0	0	0	113.8	D12 V18	D12-N14 PolarHBondContact O-N 3.36Å; N14-V18 WeakPolarHBondContact O-CG2 3.49Å
15	N	51.1	Low	56.2	Low	86 Å²	86	118.4 Å²	118.4	46%	0.46	61%	0.612	S	S	.	*	H	α-helix	trans	-90.1	-32.1	170.4	-67.3	-27.5	0	0	0	111	D12 E13 D17 V18 L19	D12-N15 PolarHBondContact O-N 3.44Å; E13-N15 VanDerWaalsContact C-N 3.34Å; E13-N15 PolarHBondContact O-N 3.32Å; N15-D17 VanDerWaalsContact C-N 3.34Å; N15-D17 PolarHBondContact O-N 3Å; N15-V18 PolarHBondContact O-N 3.04Å; N15-L19 PolarHBondContact O-N 3Å
16	Q	56.2	Low	58.2	Low	111 Å²	111	116.6 Å²	116.6	52%	0.519	59%	0.594	S	S	.	*	H	α-helix	trans	-64.8	-37.7	179.7	-167.7	63	66.2	0	0	112.2	D12 E13 V18 E20	D12-Q16 PolarHBondContact O-N 3.03Å; E13-Q16 PolarHBondContact O-N 3.11Å; Q16-V18 VanDerWaalsContact C-N 3.35Å; Q16-E20 WeakPolarHBondContact O-CB 3.46Å; Q16-E20 PolarHBondContact O-N 3.25Å
17	D	63.6	Low	60.4	Low	110 Å²	110	116.2 Å²	116.2	59%	0.588	59%	0.586	S	S	*	*	H	α-helix	trans	-67.2	-32.7	174.1	-78.1	-7.2	0	0	0	112.6	E13 N15 F21	E13-D17 PolarHBondContact O-N 3.23Å; N15-D17 VanDerWaalsContact C-N 3.34Å; N15-D17 PolarHBondContact O-N 3Å; D17-F21 WeakPolarHBondContact O-CB 3.41Å; D17-F21 PolarHBondContact O-N 3.29Å
18	V	66.3	Low	62.8	Low	74 Å²	74	113.7 Å²	113.7	45%	0.448	57%	0.571	S	S	.	*	H	α-helix	trans	-72.4	-46	176.2	176.8	0	0	0	0	110.5	N14 N15 Q16 E20 F21 E22	N14-V18 WeakPolarHBondContact O-CG2 3.49Å; N15-V18 PolarHBondContact O-N 3.04Å; Q16-V18 VanDerWaalsContact C-N 3.35Å; V18-E20 PolarHBondContact O-N 2.68Å; V18-F21 WeakPolarHBondContact O-CB 3.26Å; V18-F21 PolarHBondContact O-N 3.47Å; V18-F21 VanDerWaalsContact O-N 3.17Å; V18-E22 WeakPolarHBondContact O-CG 3.39Å; V18-E22 PolarHBondContact O-N 3.14Å
19	L	68.2	Low	64.8	Low	91 Å²	91	111.8 Å²	111.8	48%	0.476	56%	0.558	S	S	.	*	H	α-helix	trans	-61.8	-41.3	174.8	-73.1	166.4	0	0	0	111.9	N15 F21 E22 D23	N15-L19 PolarHBondContact O-N 3Å; L19-F21 VanDerWaalsContact C-N 3.32Å; L19-F21 PolarHBondContact O-N 2.97Å; L19-E22 PolarHBondContact O-N 2.71Å; L19-D23 WeakPolarHBondContact O-CB 3.38Å; L19-D23 PolarHBondContact O-N 3.42Å
20	E	75.2	Confident	66.8	Low	43 Å²	43	112 Å²	112	20%	0.201	55%	0.55	C	S	.	.	H	α-helix	trans	-68	-31.2	175.1	-178.5	160.3	-158.4	0	0	112.3	Q16 V18 N24 K459	Q16-E20 WeakPolarHBondContact O-CB 3.46Å; Q16-E20 PolarHBondContact O-N 3.25Å; V18-E20 PolarHBondContact O-N 2.68Å; E20-N24 WeakPolarHBondContact O-CB 3.43Å; E20-N24 PolarHBondContact O-N 3.38Å; E20-N24 PolarHBondContact O-ND2 3.3Å; E20-K459 IonicContact OE1-NZ 3.71Å; E20-K459 PolarHBondContact OE1-NZ 3.31Å; E20-K459 IonicContact OE2-NZ 3.38Å; E20-K459 PolarHBondContact OE2-NZ 2.78Å
21	F	75.3	Confident	68.8	Low	137 Å²	137	107 Å²	107	60%	0.601	53%	0.53	S	S	*	.	H	α-helix	trans	-68.2	-45	171.6	179.9	-105.7	0	0	0	111.9	D17 V18 L19 N24 L25	D17-F21 WeakPolarHBondContact O-CB 3.41Å; D17-F21 PolarHBondContact O-N 3.29Å; V18-F21 WeakPolarHBondContact O-CB 3.26Å; V18-F21 PolarHBondContact O-N 3.47Å; V18-F21 VanDerWaalsContact O-N 3.17Å; L19-F21 VanDerWaalsContact C-N 3.32Å; L19-F21 PolarHBondContact O-N 2.97Å; F21-N24 PolarHBondContact O-N 3.05Å; F21-L25 HydrophobicContact CD1-CD1 4.08Å; F21-L25 HydrophobicContact CE1-CD1 3.41Å; F21-L25 VanDerWaalsContact CE1-CD1 3.41Å; F21-L25 HydrophobicContact CE2-CD1 4.22Å; F21-L25 HydrophobicContact CZ-CD1 3.49Å; F21-L25 VanDerWaalsContact CZ-CD1 3.49Å; F21-L25 WeakPolarHBondContact O-CB 3.49Å; F21-L25 PolarHBondContact O-N 2.97Å
22	E	77.3	Confident	71	Confident	115 Å²	115	104.3 Å²	104.3	54%	0.537	52%	0.52	S	S	.	.	H	α-helix	trans	-65.1	-45.2	177.8	-71.9	-174.8	164.5	0	0	112.3	V18 L19 N24 L25 E26	V18-E22 WeakPolarHBondContact O-CG 3.39Å; V18-E22 PolarHBondContact O-N 3.14Å; L19-E22 PolarHBondContact O-N 2.71Å; E22-N24 VanDerWaalsContact C-N 3.3Å; E22-N24 PolarHBondContact O-N 3.21Å; E22-L25 PolarHBondContact O-N 2.85Å; E22-L25 VanDerWaalsContact O-N 3.11Å; E22-E26 PolarHBondContact O-N 3.42Å
23	D	79.5	Confident	72.8	Confident	109 Å²	109	103.2 Å²	103.2	58%	0.583	52%	0.517	S	S	*	.	H	α-helix	trans	-56.6	-42.7	174	-84.7	-13.4	0	0	0	111.8	L19 K27	L19-D23 WeakPolarHBondContact O-CB 3.38Å; L19-D23 PolarHBondContact O-N 3.42Å; D23-K27 VanDerWaalsContact O-CB 3.26Å; D23-K27 WeakPolarHBondContact O-CB 3.45Å; D23-K27 PolarHBondContact O-N 3.34Å
24	N	80.4	Confident	74.7	Confident	85 Å²	85	98.9 Å²	98.9	46%	0.455	50%	0.502	S	S	.	.	H	α-helix	trans	-69.5	-34.7	177.5	-81.7	-59	0	0	0	112.3	E20 F21 E22 M28	E20-N24 WeakPolarHBondContact O-CB 3.43Å; E20-N24 PolarHBondContact O-N 3.38Å; E20-N24 PolarHBondContact O-ND2 3.3Å; F21-N24 PolarHBondContact O-N 3.05Å; E22-N24 VanDerWaalsContact C-N 3.3Å; E22-N24 PolarHBondContact O-N 3.21Å; N24-M28 VanDerWaalsContact O-CB 3.27Å; N24-M28 WeakPolarHBondContact O-CB 3.44Å; N24-M28 PolarHBondContact O-N 2.91Å
25	L	80.8	Confident	76.3	Confident	83 Å²	83	97.7 Å²	97.7	44%	0.435	50%	0.495	S	S	.	.	H	α-helix	trans	-70.3	-42.3	175.8	-123.8	153.4	0	0	0	111.5	F21 E22 M28 S29	F21-L25 HydrophobicContact CD1-CD1 4.08Å; F21-L25 HydrophobicContact CE1-CD1 3.41Å; F21-L25 VanDerWaalsContact CE1-CD1 3.41Å; F21-L25 HydrophobicContact CE2-CD1 4.22Å; F21-L25 HydrophobicContact CZ-CD1 3.49Å; F21-L25 VanDerWaalsContact CZ-CD1 3.49Å; F21-L25 WeakPolarHBondContact O-CB 3.49Å; F21-L25 PolarHBondContact O-N 2.97Å; E22-L25 PolarHBondContact O-N 2.85Å; E22-L25 VanDerWaalsContact O-N 3.11Å; L25-M28 HydrophobicContact CG-CE 4.46Å; L25-S29 WeakPolarHBondContact O-CB 3.3Å; L25-S29 PolarHBondContact O-N 2.84Å
26	E	81.7	Confident	77.7	Confident	92 Å²	92	98.3 Å²	98.3	43%	0.43	50%	0.497	S	S	.	.	H	α-helix	trans	-62.7	-48.6	174.3	-167.9	-175.9	161.7	0	0	110.2	E22 M28 S29 R30	E22-E26 PolarHBondContact O-N 3.42Å; E26-M28 PolarHBondContact O-N 3.4Å; E26-S29 WeakPolarHBondContact O-CB 3.3Å; E26-S29 PolarHBondContact O-N 3.48Å; E26-S29 VanDerWaalsContact O-N 3.08Å; E26-S29 PolarHBondContact O-OG 3.45Å; E26-R30 HydrophobicContact CG-CG 4.48Å; E26-R30 WeakPolarHBondContact O-CG 3.21Å; E26-R30 PolarHBondContact O-N 2.97Å; E26-R30 IonicContact OE1-CZ 2.61Å; E26-R30 IonicContact OE1-NE 3.17Å; E26-R30 PolarHBondContact OE1-NE 3.2Å; E26-R30 IonicContact OE1-NH2 2.74Å; E26-R30 PolarHBondContact OE1-NH2 2.98Å
27	K	84.1	Confident	78.9	Confident	124 Å²	124	97.2 Å²	97.2	54%	0.539	50%	0.495	S	S	.	.	H	α-helix	trans	-56	-50.3	176.8	-175.4	-179	176.4	-173.2	0	112.1	D23 S29 R30 D31	D23-K27 VanDerWaalsContact O-CB 3.26Å; D23-K27 WeakPolarHBondContact O-CB 3.45Å; D23-K27 PolarHBondContact O-N 3.34Å; K27-S29 VanDerWaalsContact C-N 3.26Å; K27-S29 PolarHBondContact O-N 3.23Å; K27-R30 PolarHBondContact O-N 2.84Å; K27-R30 VanDerWaalsContact O-N 3.13Å; K27-D31 PolarHBondContact O-N 2.99Å
28	M	83.2	Confident	79.5	Confident	121 Å²	121	95.6 Å²	95.6	60%	0.596	49%	0.486	S	S	*	.	H	α-helix	trans	-60.5	-34.7	176.8	176.4	166.3	42.4	0	0	112.4	N24 L25 E26 L32	N24-M28 VanDerWaalsContact O-CB 3.27Å; N24-M28 WeakPolarHBondContact O-CB 3.44Å; N24-M28 PolarHBondContact O-N 2.91Å; L25-M28 HydrophobicContact CG-CE 4.46Å; E26-M28 PolarHBondContact O-N 3.4Å; M28-L32 WeakPolarHBondContact O-CB 3.48Å; M28-L32 PolarHBondContact O-N 3.36Å
29	S	78.1	Confident	80	Confident	58 Å²	58	101.4 Å²	101.4	41%	0.406	50%	0.5	S	S	.	.	H	α-helix	trans	-70	-38.8	174.6	81.2	0	0	0	0	112.8	L25 E26 K27 L32 V33	L25-S29 WeakPolarHBondContact O-CB 3.3Å; L25-S29 PolarHBondContact O-N 2.84Å; E26-S29 WeakPolarHBondContact O-CB 3.3Å; E26-S29 PolarHBondContact O-N 3.48Å; E26-S29 VanDerWaalsContact O-N 3.08Å; E26-S29 PolarHBondContact O-OG 3.45Å; K27-S29 VanDerWaalsContact C-N 3.26Å; K27-S29 PolarHBondContact O-N 3.23Å; S29-L32 PolarHBondContact O-N 3.44Å; S29-V33 WeakPolarHBondContact O-CB 3.36Å; S29-V33 VanDerWaalsContact O-CG2 3.31Å; S29-V33 WeakPolarHBondContact O-CG2 3.33Å; S29-V33 PolarHBondContact O-N 2.92Å
30	R	82.5	Confident	80.1	Confident	158 Å²	158	99.2 Å²	99.2	60%	0.596	50%	0.495	S	S	*	.	H	α-helix	trans	-66.9	-41.1	174.9	-70.8	178.3	178.8	-143.5	7.2	111.5	E26 K27 V33 T34	E26-R30 HydrophobicContact CG-CG 4.48Å; E26-R30 WeakPolarHBondContact O-CG 3.21Å; E26-R30 PolarHBondContact O-N 2.97Å; E26-R30 IonicContact OE1-CZ 2.61Å; E26-R30 IonicContact OE1-NE 3.17Å; E26-R30 PolarHBondContact OE1-NE 3.2Å; E26-R30 IonicContact OE1-NH2 2.74Å; E26-R30 PolarHBondContact OE1-NH2 2.98Å; K27-R30 PolarHBondContact O-N 2.84Å; K27-R30 VanDerWaalsContact O-N 3.13Å; R30-V33 PolarHBondContact O-N 2.8Å; R30-T34 VanDerWaalsContact O-CB 3.32Å; R30-T34 WeakPolarHBondContact O-CB 3.35Å; R30-T34 PolarHBondContact O-N 2.92Å; R30-T34 PolarHBondContact O-OG1 2.94Å
31	D	83.6	Confident	79.8	Confident	95 Å²	95	105.4 Å²	105.4	51%	0.508	52%	0.517	S	S	.	.	H	α-helix	trans	-63.6	-45.2	176.1	-69.9	-19.6	0	0	0	110.4	K27 T34 D35	K27-D31 PolarHBondContact O-N 2.99Å; D31-T34 PolarHBondContact O-N 3.49Å; D31-D35 WeakPolarHBondContact O-CB 3.43Å; D31-D35 PolarHBondContact O-N 3.19Å
32	L	85.2	Confident	79.3	Confident	106 Å²	106	102.1 Å²	102.1	56%	0.555	51%	0.511	S	S	*	.	H	α-helix	trans	-63.1	-43.5	176.1	-178.9	64.1	0	0	0	113	M28 S29 T34 D35 I36	M28-L32 WeakPolarHBondContact O-CB 3.48Å; M28-L32 PolarHBondContact O-N 3.36Å; S29-L32 PolarHBondContact O-N 3.44Å; L32-T34 VanDerWaalsContact C-N 3.34Å; L32-D35 PolarHBondContact O-N 2.93Å; L32-I36 HydrophobicContact CD1-CD1 4.2Å; L32-I36 HydrophobicContact CG-CD1 4.02Å; L32-I36 VanDerWaalsContact O-CG1 3.27Å; L32-I36 WeakPolarHBondContact O-CG1 3.41Å; L32-I36 PolarHBondContact O-N 2.66Å
33	V	84.5	Confident	78.2	Confident	80 Å²	80	99.3 Å²	99.3	49%	0.485	51%	0.507	S	S	.	.	H	α-helix	trans	-64.6	-40.8	176.1	168.4	0	0	0	0	110.9	S29 R30 I36 L37	S29-V33 WeakPolarHBondContact O-CB 3.36Å; S29-V33 VanDerWaalsContact O-CG2 3.31Å; S29-V33 WeakPolarHBondContact O-CG2 3.33Å; S29-V33 PolarHBondContact O-N 2.92Å; R30-V33 PolarHBondContact O-N 2.8Å; V33-I36 PolarHBondContact O-N 2.96Å; V33-L37 HydrophobicContact CG1-CD1 3.9Å; V33-L37 HydrophobicContact CG1-CG 4.42Å; V33-L37 WeakPolarHBondContact O-CB 3.41Å; V33-L37 VanDerWaalsContact O-CG 3.32Å; V33-L37 WeakPolarHBondContact O-CG 3.33Å; V33-L37 PolarHBondContact O-N 3.17Å
34	T	83.7	Confident	77	Confident	71 Å²	71	99.3 Å²	99.3	44%	0.436	51%	0.506	S	S	.	.	H	α-helix	trans	-61.3	-43.5	175.1	-57.2	0	0	0	0	111.5	R30 D31 L32 L37 N38	R30-T34 VanDerWaalsContact O-CB 3.32Å; R30-T34 WeakPolarHBondContact O-CB 3.35Å; R30-T34 PolarHBondContact O-N 2.92Å; R30-T34 PolarHBondContact O-OG1 2.94Å; D31-T34 PolarHBondContact O-N 3.49Å; L32-T34 VanDerWaalsContact C-N 3.34Å; T34-L37 PolarHBondContact O-N 3.25Å; T34-N38 WeakPolarHBondContact O-CB 3.25Å; T34-N38 VanDerWaalsContact O-CG 3.22Å; T34-N38 PolarHBondContact O-N 3.3Å; T34-N38 PolarHBondContact O-ND2 3.04Å
35	D	82.3	Confident	75.6	Confident	102 Å²	102	99.3 Å²	99.3	55%	0.545	51%	0.509	S	S	.	.	H	α-helix	trans	-68.4	-39.7	179.5	-161.6	48.5	0	0	0	112.2	D31 L32 N38 R39	D31-D35 WeakPolarHBondContact O-CB 3.43Å; D31-D35 PolarHBondContact O-N 3.19Å; L32-D35 PolarHBondContact O-N 2.93Å; D35-N38 PolarHBondContact O-N 2.91Å; D35-R39 VanDerWaalsContact O-CB 3.3Å; D35-R39 WeakPolarHBondContact O-CB 3.35Å; D35-R39 PolarHBondContact O-N 3.48Å
36	I	80.7	Confident	73.8	Confident	99 Å²	99	99 Å²	99	51%	0.508	51%	0.505	S	S	.	.	H	α-helix	trans	-61.5	-45.8	171.9	-69.1	166.4	0	0	0	111.1	L32 V33 R39 A40	L32-I36 HydrophobicContact CD1-CD1 4.2Å; L32-I36 HydrophobicContact CG-CD1 4.02Å; L32-I36 VanDerWaalsContact O-CG1 3.27Å; L32-I36 WeakPolarHBondContact O-CG1 3.41Å; L32-I36 PolarHBondContact O-N 2.66Å; V33-I36 PolarHBondContact O-N 2.96Å; I36-R39 PolarHBondContact O-N 3.17Å; I36-A40 WeakPolarHBondContact O-CB 3.29Å; I36-A40 PolarHBondContact O-N 2.86Å
37	L	79.9	Confident	71.9	Confident	89 Å²	89	101.3 Å²	101.3	47%	0.466	52%	0.516	S	S	.	.	H	α-helix	trans	-66	-38.7	178.2	-75.5	171.6	0	0	0	112.3	V33 T34 A40 R41	V33-L37 HydrophobicContact CG1-CD1 3.9Å; V33-L37 HydrophobicContact CG1-CG 4.42Å; V33-L37 WeakPolarHBondContact O-CB 3.41Å; V33-L37 VanDerWaalsContact O-CG 3.32Å; V33-L37 WeakPolarHBondContact O-CG 3.33Å; V33-L37 PolarHBondContact O-N 3.17Å; T34-L37 PolarHBondContact O-N 3.25Å; L37-A40 PolarHBondContact O-N 3.34Å; L37-R41 WeakPolarHBondContact O-CB 3.45Å; L37-R41 VanDerWaalsContact O-CG 3.31Å; L37-R41 WeakPolarHBondContact O-CG 3.29Å; L37-R41 PolarHBondContact O-N 2.96Å
38	N	77.4	Confident	70	Confident	76 Å²	76	97.9 Å²	97.9	41%	0.406	51%	0.508	S	S	.	.	H	α-helix	trans	-66.5	-44.6	175.1	-74.9	-23.6	0	0	0	111.2	T34 D35 A40 R41 S42	T34-N38 WeakPolarHBondContact O-CB 3.25Å; T34-N38 VanDerWaalsContact O-CG 3.22Å; T34-N38 PolarHBondContact O-N 3.3Å; T34-N38 PolarHBondContact O-ND2 3.04Å; D35-N38 PolarHBondContact O-N 2.91Å; N38-A40 VanDerWaalsContact C-N 3.34Å; N38-A40 PolarHBondContact O-N 3.12Å; N38-R41 PolarHBondContact O-N 2.8Å; N38-S42 WeakPolarHBondContact O-CB 3.27Å; N38-S42 PolarHBondContact O-N 2.81Å; N38-S42 PolarHBondContact O-OG 2.88Å; N38-S42 VanDerWaalsContact O-OG 3.14Å
39	R	76.3	Confident	68	Low	196 Å²	196	96.9 Å²	96.9	74%	0.74	50%	0.504	S	S	*	.	H	α-helix	trans	-60	-42.4	173.8	179.5	177.7	-90.5	-154.1	-5.5	111.7	D35 I36 S42 A43	D35-R39 VanDerWaalsContact O-CB 3.3Å; D35-R39 WeakPolarHBondContact O-CB 3.35Å; D35-R39 PolarHBondContact O-N 3.48Å; I36-R39 PolarHBondContact O-N 3.17Å; R39-S42 PolarHBondContact O-N 2.82Å; R39-A43 PolarHBondContact O-N 2.92Å
40	A	69.4	Low	66.2	Low	45 Å²	45	98.8 Å²	98.8	37%	0.372	51%	0.51	S	S	.	.	H	α-helix	trans	-64.7	-45	175.6	0	0	0	0	0	112.3	I36 L37 N38 S42 A43 I44	I36-A40 WeakPolarHBondContact O-CB 3.29Å; I36-A40 PolarHBondContact O-N 2.86Å; L37-A40 PolarHBondContact O-N 3.34Å; N38-A40 VanDerWaalsContact C-N 3.34Å; N38-A40 PolarHBondContact O-N 3.12Å; A40-S42 VanDerWaalsContact C-N 3.33Å; A40-S42 PolarHBondContact O-N 3.38Å; A40-A43 PolarHBondContact O-N 3.39Å; A40-I44 WeakPolarHBondContact O-CG1 3.22Å; A40-I44 PolarHBondContact O-N 3.45Å
41	R	69.9	Low	64	Low	172 Å²	172	96.2 Å²	96.2	65%	0.649	51%	0.512	S	S	*	.	H	α-helix	trans	-60.9	-40	174.8	-76.8	174	174.6	178.5	-1.7	112.2	L37 N38 T45	L37-R41 WeakPolarHBondContact O-CB 3.45Å; L37-R41 VanDerWaalsContact O-CG 3.31Å; L37-R41 WeakPolarHBondContact O-CG 3.29Å; L37-R41 PolarHBondContact O-N 2.96Å; N38-R41 PolarHBondContact O-N 2.8Å; R41-T45 PolarHBondContact O-N 3.26Å; R41-T45 PolarHBondContact O-OG1 3.23Å
42	S	64.8	Low	62	Low	68 Å²	68	99.6 Å²	99.6	48%	0.476	52%	0.522	S	S	.	.	H	α-helix	trans	-67.4	-34.8	175.3	-66.1	0	0	0	0	113	N38 R39 A40 T45 H46	N38-S42 WeakPolarHBondContact O-CB 3.27Å; N38-S42 PolarHBondContact O-N 2.81Å; N38-S42 PolarHBondContact O-OG 2.88Å; N38-S42 VanDerWaalsContact O-OG 3.14Å; R39-S42 PolarHBondContact O-N 2.82Å; A40-S42 VanDerWaalsContact C-N 3.33Å; A40-S42 PolarHBondContact O-N 3.38Å; S42-T45 WeakPolarHBondContact CA-OG1 3.32Å; S42-T45 PolarHBondContact O-OG1 3.25Å; S42-H46 PolarHBondContact O-CD2 2.86Å; S42-H46 PolarHBondContact O-N 3.42Å; S42-H46 VanDerWaalsContact O-N 3.17Å
43	A	54.9	Low	59.7	Low	56 Å²	56	102.1 Å²	102.1	46%	0.463	53%	0.531	S	S	.	.	H	α-helix	trans	-65.3	-51.2	173.2	0	0	0	0	0	111.2	R39 A40 T45 H46 E47	R39-A43 PolarHBondContact O-N 2.92Å; A40-A43 PolarHBondContact O-N 3.39Å; A43-T45 VanDerWaalsContact C-N 3.33Å; A43-T45 PolarHBondContact O-N 3.38Å; A43-H46 PolarHBondContact O-N 3.38Å; A43-H46 VanDerWaalsContact O-N 3.17Å; A43-E47 PolarHBondContact O-N 3.49Å
44	I	54.3	Low	57.3	Low	110 Å²	110	104.9 Å²	104.9	56%	0.564	54%	0.542	S	S	*	.	H	α-helix	trans	-60.4	-40.7	179.2	-64.7	163.3	0	0	0	111.5	A40 E47 S48	A40-I44 WeakPolarHBondContact O-CG1 3.22Å; A40-I44 PolarHBondContact O-N 3.45Å; I44-E47 PolarHBondContact O-N 3.42Å; I44-S48 WeakPolarHBondContact O-CB 3.22Å; I44-S48 PolarHBondContact O-N 3.02Å; I44-S48 PolarHBondContact O-OG 3.24Å
45	T	49.8	Very low	54.6	Low	84 Å²	84	109.6 Å²	109.6	52%	0.515	56%	0.561	S	S	.	*	H	α-helix	trans	-66.8	-37	177.3	33.5	0	0	0	0	112.6	R41 S42 A43 S48 L49	R41-T45 PolarHBondContact O-N 3.26Å; R41-T45 PolarHBondContact O-OG1 3.23Å; S42-T45 WeakPolarHBondContact CA-OG1 3.32Å; S42-T45 PolarHBondContact O-OG1 3.25Å; A43-T45 VanDerWaalsContact C-N 3.33Å; A43-T45 PolarHBondContact O-N 3.38Å; T45-S48 WeakPolarHBondContact CA-OG 3.34Å; T45-S48 PolarHBondContact O-OG 3.07Å; T45-L49 PolarHBondContact O-N 2.83Å
46	H	43	Very low	52.2	Low	77 Å²	77	112 Å²	112	36%	0.356	57%	0.573	S	S	.	*	H	α-helix	trans	-67.3	-43.3	173.3	-90.4	-64.4	0	0	0	113.1	S42 A43 S48 L49 D50 K139	S42-H46 PolarHBondContact O-CD2 2.86Å; S42-H46 PolarHBondContact O-N 3.42Å; S42-H46 VanDerWaalsContact O-N 3.17Å; A43-H46 PolarHBondContact O-N 3.38Å; A43-H46 VanDerWaalsContact O-N 3.17Å; H46-S48 VanDerWaalsContact C-N 3.27Å; H46-S48 PolarHBondContact O-N 2.86Å; H46-L49 PolarHBondContact O-N 2.96Å; H46-D50 PolarHBondContact O-N 3.46Å; H46-K139 PolarHBondContact CE1-NZ 2.97Å; H46-K139 PolarHBondContact ND1-NZ 3.18Å; H46-K139 VanDerWaalsContact ND1-NZ 3.11Å
47	E	42.9	Very low	49.8	Very low	140 Å²	140	112.4 Å²	112.4	65%	0.654	58%	0.582	S	S	*	*	H	α-helix	trans	-63.3	-34.2	177.7	-163.6	167.5	-147.4	0	0	111.9	A43 I44 L49 T51	A43-E47 PolarHBondContact O-N 3.49Å; I44-E47 PolarHBondContact O-N 3.42Å; E47-L49 VanDerWaalsContact C-N 3.3Å; E47-L49 PolarHBondContact O-N 3.01Å; E47-T51 WeakPolarHBondContact O-CG2 3.45Å; E47-T51 PolarHBondContact O-N 3.3Å; E47-T51 PolarHBondContact O-OG1 2.91Å
48	S	42.8	Very low	47.4	Very low	52 Å²	52	114.2 Å²	114.2	36%	0.364	60%	0.602	S	S	.	*	H	α-helix	trans	-74.9	-11.4	172.9	77.9	0	0	0	0	115.4	I44 T45 H46	I44-S48 WeakPolarHBondContact O-CB 3.22Å; I44-S48 PolarHBondContact O-N 3.02Å; I44-S48 PolarHBondContact O-OG 3.24Å; T45-S48 WeakPolarHBondContact CA-OG 3.34Å; T45-S48 PolarHBondContact O-OG 3.07Å; H46-S48 VanDerWaalsContact C-N 3.27Å; H46-S48 PolarHBondContact O-N 2.86Å
49	L	42.7	Very low	45.4	Very low	101 Å²	101	118.9 Å²	118.9	53%	0.529	62%	0.621	S	S	.	*	H	α-helix	trans	-98.4	-42.7	-179.6	-141	77	0	0	0	111.6	T45 H46 E47 T51 K52	T45-L49 PolarHBondContact O-N 2.83Å; H46-L49 PolarHBondContact O-N 2.96Å; E47-L49 VanDerWaalsContact C-N 3.3Å; E47-L49 PolarHBondContact O-N 3.01Å; L49-T51 VanDerWaalsContact C-N 3.33Å; L49-T51 PolarHBondContact O-N 3.31Å; L49-K52 PolarHBondContact O-N 3.03Å; L49-K52 VanDerWaalsContact O-N 3.16Å
50	D	38.8	Very low	43.2	Very low	98 Å²	98	117.2 Å²	117.2	52%	0.524	63%	0.627	S	S	.	*	H	α-helix	trans	-64.7	-37.5	175.9	-79.9	-33.9	0	0	0	111.4	H46 K52 Q53	H46-D50 PolarHBondContact O-N 3.46Å; D50-K52 PolarHBondContact O-N 3Å; D50-K52 VanDerWaalsContact O-N 3.07Å; D50-Q53 PolarHBondContact O-N 3Å; D50-Q53 VanDerWaalsContact O-N 3.16Å
51	T	38.2	Very low	41.2	Very low	104 Å²	104	125.2 Å²	125.2	64%	0.638	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	-12.2	174.8	42.4	0	0	0	0	114.6	E47 L49	E47-T51 WeakPolarHBondContact O-CG2 3.45Å; E47-T51 PolarHBondContact O-N 3.3Å; E47-T51 PolarHBondContact O-OG1 2.91Å; L49-T51 VanDerWaalsContact C-N 3.33Å; L49-T51 PolarHBondContact O-N 3.31Å
52	K	39.7	Very low	39.4	Very low	166 Å²	166	121.9 Å²	121.9	72%	0.722	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	-7.3	176.5	-69.3	-177.5	178.8	177.9	0	114.5	L49 D50	L49-K52 PolarHBondContact O-N 3.03Å; L49-K52 VanDerWaalsContact O-N 3.16Å; D50-K52 PolarHBondContact O-N 3Å; D50-K52 VanDerWaalsContact O-N 3.07Å
53	Q	38.3	Very low	37.6	Very low	158 Å²	158	124.2 Å²	124.2	74%	0.738	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	-9.9	175	-70.7	-167.3	13.9	0	0	113.9	D50 M55	D50-Q53 PolarHBondContact O-N 3Å; D50-Q53 VanDerWaalsContact O-N 3.16Å; Q53-M55 VanDerWaalsContact C-N 3.34Å; Q53-M55 PolarHBondContact O-N 3.29Å
54	I	32.8	Very low	36.6	Very low	139 Å²	139	127.3 Å²	127.3	71%	0.713	70%	0.698	S	S	*	*			trans	-98.5	37.7	177.3	-41.4	175.5	0	0	0	111.3
55	M	28.4	Very low	35.5	Very low	169 Å²	169	129.9 Å²	129.9	83%	0.833	71%	0.712	S	S	*	*			trans	-92.3	86.1	161.6	-92.5	179.2	62.7	0	0	108.8	Q53	Q53-M55 VanDerWaalsContact C-N 3.34Å; Q53-M55 PolarHBondContact O-N 3.29Å
56	L	32.3	Very low	34.7	Very low	152 Å²	152	131.7 Å²	131.7	80%	0.796	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-68.8	139.6	167.7	-82.6	163.7	0	0	0	109.8
57	P	30.1	Very low	34.1	Very low	108 Å²	108	137 Å²	137	70%	0.701	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-71.5	139.4	-177.5	29.6	-34.4	0	0	0	111.3	Q59	P57-Q59 PolarHBondContact O-N 3.32Å
58	S	29.6	Very low	33.2	Very low	128 Å²	128	137.6 Å²	137.6	90%	0.895	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-59.1	124.7	174.3	-45.7	0	0	0	0	110.9
59	Q	34.5	Very low	32.6	Very low	173 Å²	173	141.1 Å²	141.1	81%	0.808	78%	0.781	S	S	*	*			trans	-140.7	127.3	173.6	-153.9	167.5	18	0	0	110.3	P57	P57-Q59 PolarHBondContact O-N 3.32Å
60	D	30.5	Very low	31.8	Very low	161 Å²	161	143.3 Å²	143.3	86%	0.861	79%	0.792	S	S	*	*			trans	-74.8	140.2	-163.7	-57.3	-66.8	0	0	0	113.9
61	F	26.2	Very low	31.4	Very low	213 Å²	213	145.2 Å²	145.2	93%	0.934	81%	0.808	S	S	*	*			trans	-86.2	123.6	171.8	-81.8	-85.5	0	0	0	111.5
62	A	32.1	Very low	31	Very low	102 Å²	102	146 Å²	146	84%	0.843	81%	0.813	S	S	*	*			trans	-109.1	127.8	160.8	0	0	0	0	0	109.7
63	S	28.9	Very low	30.6	Very low	118 Å²	118	144.1 Å²	144.1	83%	0.825	82%	0.817	S	S	*	*			trans	-91.3	137.5	-168.8	49.9	0	0	0	0	113.9
64	S	33.7	Very low	30.3	Very low	121 Å²	121	142 Å²	142	85%	0.846	82%	0.82	S	S	*	*			trans	-171.9	130	140.4	38.1	0	0	0	0	112.3
65	L	31.1	Very low	30.3	Very low	164 Å²	164	141.2 Å²	141.2	86%	0.859	82%	0.824	S	S	*	*			trans	-94.8	154.2	162.5	-126	83.5	0	0	0	108.2
66	P	31.4	Very low	30.4	Very low	121 Å²	121	139 Å²	139	79%	0.786	82%	0.822	S	S	*	*				-149.4	131.8	113.4	32.9	-14.6	0	0	0	117.2
67	Q	30.8	Very low	30.5	Very low	188 Å²	188	141.8 Å²	141.8	88%	0.879	83%	0.828	S	S	*	*			trans	43.2	140.3	137.3	-59.7	-164.3	-5.5	0	0	124.5
68	L	24.6	Very low	30.5	Very low	154 Å²	154	147.5 Å²	147.5	81%	0.806	84%	0.837	S	S	*	*			trans	-75.6	158.5	175.6	-77.7	141.9	0	0	0	114.7
69	S	30.8	Very low	30.7	Very low	125 Å²	125	148.3 Å²	148.3	87%	0.874	84%	0.836	S	S	*	*			trans	-145.9	136.3	152.2	-75.6	0	0	0	0	110.1
70	I	25.8	Very low	30.6	Very low	147 Å²	147	142.8 Å²	142.8	75%	0.754	83%	0.826	S	S	*	*			trans	-108.2	140.2	-172.8	-60.5	165.4	0	0	0	109.1
71	T	29.4	Very low	30.8	Very low	139 Å²	139	143.6 Å²	143.6	85%	0.853	82%	0.824	S	S	*	*			trans	-145.5	143.1	159.7	-51.2	0	0	0	0	110.6
72	T	30.6	Very low	31.1	Very low	121 Å²	121	139.2 Å²	139.2	74%	0.742	81%	0.811	S	S	*	*			trans	-90.9	161.9	-161.5	26.2	0	0	0	0	115.3
73	P	30.5	Very low	31.3	Very low	126 Å²	126	140.3 Å²	140.3	82%	0.818	80%	0.802	S	S	*	*			trans	-90.5	170.1	-172.7	37.4	-37	0	0	0	114.1
74	S	31.3	Very low	31.6	Very low	114 Å²	114	142.5 Å²	142.5	80%	0.797	80%	0.797	S	S	*	*			trans	-135.9	152.4	169.5	58.4	0	0	0	0	112.9
75	P	32.7	Very low	31.7	Very low	121 Å²	121	143.6 Å²	143.6	79%	0.786	79%	0.793	S	S	*	*			trans	-99.3	171.5	-161.9	-1	24.6	0	0	0	114.9
76	P	32	Very low	31.8	Very low	122 Å²	122	141.7 Å²	141.7	79%	0.792	79%	0.788	S	S	*	*			trans	-85.5	164.8	-163	35	-37.5	0	0	0	115.4
77	K	34.9	Very low	31.9	Very low	212 Å²	212	143.3 Å²	143.3	92%	0.922	79%	0.785	S	S	*	*			trans	-120	140.5	169.3	-76.1	-174.8	175.5	-179.1	0	111.6
78	Y	28.4	Very low	31.9	Very low	227 Å²	227	142.3 Å²	142.3	89%	0.89	78%	0.781	S	S	*	*			trans	-117.4	127.6	179.3	-118.9	-87.1	0	0	0	109.8
79	V	34.1	Very low	32.1	Very low	146 Å²	146	139.2 Å²	139.2	89%	0.885	77%	0.771	S	S	*	*			trans	-161.7	140.1	158.8	-172.5	0	0	0	0	105.2
80	G	32.7	Very low	32.1	Very low	57 Å²	57	138.6 Å²	138.6	59%	0.588	76%	0.762	S	S	*	*			cis	148.6	143.2	-2	0	0	0	0	0	110.2
81	E	35.2	Very low	32.4	Very low	177 Å²	177	138.2 Å²	138.2	83%	0.827	76%	0.761	S	S	*	*			trans	69.6	153.3	165.4	-53.9	-163.3	121.9	0	0	118.5
82	N	31.9	Very low	32.5	Very low	122 Å²	122	135 Å²	135	65%	0.652	75%	0.749	S	S	*	*			cis	-165.5	179.6	-21.6	-100.8	-20.9	0	0	0	109.8
83	D	37.5	Very low	32.3	Very low	125 Å²	125	138.1 Å²	138.1	67%	0.668	75%	0.753	S	S	*	*			trans	74.9	146.2	162.3	-64.1	-33.8	0	0	0	118.6
84	K	33.9	Very low	32.3	Very low	164 Å²	164	137.8 Å²	137.8	71%	0.713	75%	0.748	S	S	*	*			cis	172.5	167.1	-25.9	-110.8	-179.2	-160.3	121.9	0	106.3
85	N	37	Very low	32	Very low	144 Å²	144	137.6 Å²	137.6	77%	0.77	74%	0.742	S	S	*	*			trans	84.3	123.1	175.6	-47.2	-27	0	0	0	113.8
86	V	32.4	Very low	31.8	Very low	124 Å²	124	136.7 Å²	136.7	75%	0.752	73%	0.734	S	S	*	*				67.5	128.1	56.2	-177.8	0	0	0	0	109.1
87	E	33.7	Very low	31.4	Very low	155 Å²	155	137.1 Å²	137.1	72%	0.724	74%	0.738	S	S	*	*			cis	-126.6	162	28.4	-108.1	122.8	144.6	0	0	111.6
88	E	29.9	Very low	31.1	Very low	167 Å²	167	132.4 Å²	132.4	78%	0.78	73%	0.726	S	S	*	*				53.2	137.8	81.4	-111.1	-179.1	158.1	0	0	113.4
89	C	28.4	Very low	31	Very low	88 Å²	88	126.9 Å²	126.9	60%	0.595	72%	0.721	S	S	*	*			cis	-166.1	166.9	31.2	-149.6	0	0	0	0	110.7
90	T	31.1	Very low	30.8	Very low	113 Å²	113	128.1 Å²	128.1	69%	0.693	72%	0.717	S	S	*	*			trans	44.2	144.2	148.7	51.6	0	0	0	0	120.6
91	D	32.4	Very low	30.5	Very low	139 Å²	139	133.8 Å²	133.8	74%	0.743	73%	0.725	S	S	*	*			cis	-167.5	166.9	18.2	-112.3	-26.8	0	0	0	104.4
92	A	31.7	Very low	30.2	Very low	72 Å²	72	130 Å²	130	60%	0.595	72%	0.718	S	S	*	*			cis	-165	157.6	13.3	0	0	0	0	0	108.6
93	F	26.9	Very low	30	Very low	185 Å²	185	128.4 Å²	128.4	81%	0.811	72%	0.722	S	S	*	*			trans	19.8	137.8	140.5	-52.9	-77.4	0	0	0	119.5
94	V	30.1	Very low	30	Very low	119 Å²	119	130.5 Å²	130.5	72%	0.721	73%	0.732	S	S	*	*			cis	-166.6	164.5	26.5	97.9	0	0	0	0	112.7
95	T	26.2	Very low	29.7	Very low	110 Å²	110	129.8 Å²	129.8	68%	0.675	74%	0.735	S	S	*	*			trans	-38.7	153.1	165.9	49.3	0	0	0	0	114.4
96	T	27	Very low	29.5	Very low	102 Å²	102	132.3 Å²	132.3	63%	0.626	74%	0.743	S	S	*	*				-179.8	144	60	-40.9	0	0	0	0	109.6	V98	T96-V98 HydrophobicContact CG2-CG2 3.86Å
97	P	24.6	Very low	29.3	Very low	132 Å²	132	134.2 Å²	134.2	86%	0.857	74%	0.743	S	S	*	*			trans	-81.1	116.8	166.1	31.8	-31.2	0	0	0	110.6
98	V	29	Very low	29.2	Very low	112 Å²	112	135 Å²	135	68%	0.679	75%	0.751	S	S	*	*			trans	-129.5	127.2	-178.2	177.6	0	0	0	0	111.3	T96	T96-V98 HydrophobicContact CG2-CG2 3.86Å
99	S	24.4	Very low	29.2	Very low	111 Å²	111	134.3 Å²	134.3	78%	0.776	75%	0.747	S	S	*	*			trans	-81.3	138.9	172.3	64	0	0	0	0	111.6
100	Q	30.4	Very low	29	Very low	173 Å²	173	136.2 Å²	136.2	81%	0.808	76%	0.759	S	S	*	*			trans	-136.6	106.3	159.7	-73.4	-167.8	-18.2	0	0	111.8
101	K	26.3	Very low	29	Very low	176 Å²	176	135.7 Å²	135.7	77%	0.765	76%	0.76	S	S	*	*			trans	-86.6	118	153.9	-87.1	-174.6	170.7	-175.6	0	108
102	S	29.9	Very low	28.7	Very low	97 Å²	97	136.5 Å²	136.5	68%	0.678	76%	0.764	S	S	*	*			trans	-175.4	103.6	157.3	46.3	0	0	0	0	108.1
103	A	28	Very low	28.7	Very low	89 Å²	89	139.7 Å²	139.7	74%	0.736	78%	0.776	S	S	*	*				77	96.7	82.1	0	0	0	0	0	113
104	I	35.7	Very low	28.8	Very low	169 Å²	169	138.6 Å²	138.6	87%	0.867	77%	0.773	S	S	*	*			trans	-127	107.7	148.3	-55.9	179.9	0	0	0	105.7
105	N	28.1	Very low	28.7	Very low	148 Å²	148	140.4 Å²	140.4	79%	0.791	77%	0.773	S	S	*	*			trans	-77.9	133.1	171	-63.4	-38.2	0	0	0	108.1
106	E	33.9	Very low	28.9	Very low	198 Å²	198	142.2 Å²	142.2	93%	0.925	78%	0.779	S	S	*	*			trans	-141.2	118.1	146.5	-127.3	172.5	-149.7	0	0	111.5
107	E	27.2	Very low	28.8	Very low	164 Å²	164	146.3 Å²	146.3	77%	0.766	80%	0.796	S	S	*	*			trans	-82.3	114.3	-167.8	172.2	-170.1	170.7	0	0	111.3
108	I	32.9	Very low	29	Very low	170 Å²	170	144.7 Å²	144.7	87%	0.872	78%	0.784	S	S	*	*			trans	-134.4	126.8	159	-57.4	-176.1	0	0	0	109.7
109	Q	28.7	Very low	29.1	Very low	153 Å²	153	146 Å²	146	72%	0.715	79%	0.786	S	S	*	*			trans	-74.9	151.7	-161.8	-63.5	-178.9	-3.6	0	0	115.5
110	P	24.9	Very low	29.2	Very low	128 Å²	128	148.8 Å²	148.8	83%	0.831	79%	0.787	S	S	*	*			trans	-81	132.6	166.5	33.3	-32.1	0	0	0	111.3
111	S	30.6	Very low	29.1	Very low	102 Å²	102	148.7 Å²	148.7	71%	0.713	79%	0.786	S	S	*	*			trans	-148	121.6	170.9	70.5	0	0	0	0	114.8
112	N	26.6	Very low	29.1	Very low	157 Å²	157	144.3 Å²	144.3	84%	0.84	78%	0.782	S	S	*	*			trans	46.7	97.7	148.1	-62.7	-13.1	0	0	0	121.2
113	V	32.4	Very low	29.1	Very low	139 Å²	139	145.8 Å²	145.8	84%	0.842	79%	0.79	S	S	*	*				-155.3	113.2	124.3	-147.2	0	0	0	0	105.6
114	H	28.6	Very low	29.3	Very low	161 Å²	161	146.3 Å²	146.3	75%	0.745	79%	0.788	S	S	*	*				52.4	136.7	75.6	-128.3	-56.1	0	0	0	116.1
115	E	27.7	Very low	29	Very low	157 Å²	157	144.7 Å²	144.7	73%	0.734	78%	0.777	S	S	*	*			trans	-47.8	139.2	176	-58.3	153.9	123.9	0	0	113.7
116	D	29	Very low	29.2	Very low	149 Å²	149	146 Å²	146	80%	0.797	78%	0.778	S	S	*	*			trans	-164.1	117.1	142.3	-106.8	-28.8	0	0	0	111.2	T118	D116-T118 PolarHBondContact O-N 3.41Å; D116-T118 PolarHBondContact O-OG1 3.4Å
117	L	25.2	Very low	29	Very low	187 Å²	187	143.4 Å²	143.4	98%	0.979	76%	0.764	S	S	*	*			trans	-67.9	90.2	170.4	-82.8	160.2	0	0	0	109.6
118	T	30.1	Very low	29.1	Very low	99 Å²	99	142.8 Å²	142.8	61%	0.607	77%	0.765	S	S	*	*			trans	-113.2	111.2	-177.9	-47.1	0	0	0	0	112.4	D116 Q120	D116-T118 PolarHBondContact O-N 3.41Å; D116-T118 PolarHBondContact O-OG1 3.4Å; T118-Q120 PolarHBondContact O-N 3.49Å
119	I	29.7	Very low	28.8	Very low	140 Å²	140	139.9 Å²	139.9	72%	0.718	76%	0.757	S	S	*	*			trans	-69.8	110.5	165.7	-62.2	165.9	0	0	0	108.8
120	Q	27.5	Very low	28.6	Very low	169 Å²	169	140.2 Å²	140.2	79%	0.79	76%	0.764	S	S	*	*			trans	175.8	138.7	158.9	-97.4	147.5	75.3	0	0	106.5	T118	T118-Q120 PolarHBondContact O-N 3.49Å
121	Q	27.5	Very low	28.7	Very low	171 Å²	171	141.8 Å²	141.8	80%	0.799	76%	0.76	S	S	*	*			cis	-151.3	136.7	32.4	-159.1	163.8	15.9	0	0	109.3
122	A	27.4	Very low	28.5	Very low	83 Å²	83	146.4 Å²	146.4	69%	0.686	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-66.8	152.5	177.3	0	0	0	0	0	111.7	S124	A122-S124 PolarHBondContact O-N 2.86Å
123	P	29.7	Very low	28.5	Very low	128 Å²	128	147.1 Å²	147.1	83%	0.831	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-60.8	122.7	162.8	-13.8	28.5	0	0	0	108.5
124	S	31.5	Very low	28.3	Very low	100 Å²	100	146.3 Å²	146.3	70%	0.699	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-69.7	137.3	178.4	48.7	0	0	0	0	111.2	A122 E126	A122-S124 PolarHBondContact O-N 2.86Å; S124-E126 PolarHBondContact O-N 3.15Å
125	E	30.1	Very low	28.3	Very low	136 Å²	136	145.8 Å²	145.8	64%	0.636	75%	0.752	S	S	*	*			trans	-60	115.6	177.2	-57.5	176.5	145.4	0	0	111.5	Y547	E125-Y547 HydrophobicContact CB-CE2 4.45Å; E125-Y547 VanDerWaalsContact CB-OH 3.25Å; E125-Y547 WeakPolarHBondContact CB-OH 3.5Å; E125-Y547 PolarHBondContact O-OH 2.91Å; E125-Y547 WeakPolarHBondContact OE2-CE2 3.48Å
126	E	32.4	Very low	28.3	Very low	175 Å²	175	147.4 Å²	147.4	82%	0.818	76%	0.757	S	S	*	*			trans	-98.1	115.1	164.4	-169.8	164.2	-151.3	0	0	109.1	S124 L128	S124-E126 PolarHBondContact O-N 3.15Å; E126-L128 PolarHBondContact O-N 3.22Å; E126-L128 VanDerWaalsContact O-N 3.11Å
127	K	29.3	Very low	28.5	Very low	143 Å²	143	144.5 Å²	144.5	62%	0.622	74%	0.742	S	S	*	*			trans	-62.2	104.4	177.5	-103.4	155.5	177.8	161.2	0	110.6	Y547	K127-Y547 HydrophobicContact CD-CD1 4.38Å; K127-Y547 HydrophobicContact CD-CD2 4.42Å; K127-Y547 HydrophobicContact CD-CE1 3.8Å; K127-Y547 HydrophobicContact CD-CE2 3.86Å; K127-Y547 HydrophobicContact CG-CE1 4.37Å; K127-Y547 HydrophobicContact CG-CE2 4.22Å; K127-Y547 WeakPolarHBondContact CG-OH 3.34Å; K127-Y547 PolarHBondContact N-OH 2.99Å; K127-Y547 VanDerWaalsContact NZ-CG 3.34Å
128	L	29.6	Very low	28.8	Very low	151 Å²	151	144.8 Å²	144.8	79%	0.791	74%	0.736	S	S	*	*			trans	-127.4	143.2	162	-87.2	165.7	0	0	0	110.8	E126	E126-L128 PolarHBondContact O-N 3.22Å; E126-L128 VanDerWaalsContact O-N 3.11Å
129	P	26.4	Very low	28.7	Very low	109 Å²	109	146 Å²	146	71%	0.708	73%	0.733	S	S	*	*			trans	-89.5	147.7	-155.2	34.1	-37.2	0	0	0	115.1	H131	P129-H131 PolarHBondContact O-N 3.47Å
130	N	25	Very low	28.8	Very low	160 Å²	160	142.9 Å²	142.9	86%	0.856	72%	0.723	S	S	*	*	S	Bend	trans	4.3	79	152.7	-65.8	-15.3	0	0	0	118.5
131	H	26.9	Very low	28.9	Very low	161 Å²	161	140.9 Å²	140.9	75%	0.745	72%	0.718	S	S	*	*			trans	-165.2	153.9	141.4	-108.9	7	0	0	0	111.3	P129	P129-H131 PolarHBondContact O-N 3.47Å
132	Y	26.9	Very low	29.3	Very low	199 Å²	199	137.9 Å²	137.9	78%	0.78	71%	0.706	S	S	*	*			trans	68.7	76	178.9	-51.4	-70.2	0	0	0	117.2	T134	Y132-T134 PolarHBondContact O-N 3.36Å
133	Q	26	Very low	29.5	Very low	173 Å²	173	141.8 Å²	141.8	81%	0.808	71%	0.714	S	S	*	*			trans	-63.6	84.3	155.5	-177.9	110.9	36.7	0	0	110.2	K135	Q133-K135 HydrophobicContact CG-CG 3.9Å; Q133-K135 PolarHBondContact O-N 2.93Å
134	T	27.3	Very low	29.6	Very low	121 Å²	121	140.7 Å²	140.7	74%	0.742	70%	0.701	S	S	*	*			trans	-77	79.4	171.5	-50.8	0	0	0	0	108.9	Y132 F136	Y132-T134 PolarHBondContact O-N 3.36Å; T134-F136 PolarHBondContact O-N 3.2Å
135	K	29.4	Very low	29.7	Very low	151 Å²	151	140.8 Å²	140.8	66%	0.657	69%	0.694	S	S	*	*			trans	-60.6	121.5	165.7	-72.6	-174.9	178.1	-178.8	0	107.8	Q133 D137	Q133-K135 HydrophobicContact CG-CG 3.9Å; Q133-K135 PolarHBondContact O-N 2.93Å; K135-D137 PolarHBondContact O-N 3.03Å
136	F	28.1	Very low	29.9	Very low	190 Å²	190	143.8 Å²	143.8	83%	0.833	71%	0.706	S	S	*	*			trans	-77.7	83.1	171.7	-142.5	-86.7	0	0	0	108	T134 F138	T134-F136 PolarHBondContact O-N 3.2Å; F136-F138 PolarHBondContact O-N 3.2Å
137	D	32.2	Very low	29.9	Very low	88 Å²	88	143.5 Å²	143.5	47%	0.471	70%	0.697	S	S	.	*			trans	-60.2	117.1	179.3	-94.2	7.1	0	0	0	109.8	K135 K139	K135-D137 PolarHBondContact O-N 3.03Å; D137-K139 HydrophobicContact CB-CB 4.34Å; D137-K139 HydrophobicContact CB-CG 4.24Å; D137-K139 PolarHBondContact O-N 2.82Å
138	F	31	Very low	29.9	Very low	194 Å²	194	139.7 Å²	139.7	85%	0.851	70%	0.698	S	S	*	*			trans	-71	31	169.4	-104	-85	0	0	0	112.7	F136 S140	F136-F138 PolarHBondContact O-N 3.2Å; F138-S140 VanDerWaalsContact C-N 3.28Å; F138-S140 PolarHBondContact O-N 3.4Å
139	K	29.6	Very low	30	Very low	125 Å²	125	140.5 Å²	140.5	54%	0.543	70%	0.701	S	S	.	*			trans	-80.1	72.5	172.8	-70.5	-173.8	180	-179.5	0	110.2	H46 D137	H46-K139 PolarHBondContact CE1-NZ 2.97Å; H46-K139 PolarHBondContact ND1-NZ 3.18Å; H46-K139 VanDerWaalsContact ND1-NZ 3.11Å; D137-K139 HydrophobicContact CB-CB 4.34Å; D137-K139 HydrophobicContact CB-CG 4.24Å; D137-K139 PolarHBondContact O-N 2.82Å
140	S	30.1	Very low	30	Very low	73 Å²	73	139.2 Å²	139.2	51%	0.51	71%	0.708	S	S	.	*			trans	-132.6	130.4	159.9	61.4	0	0	0	0	110	F138 I142	F138-S140 VanDerWaalsContact C-N 3.28Å; F138-S140 PolarHBondContact O-N 3.4Å; S140-I142 PolarHBondContact O-N 2.94Å
141	N	31.2	Very low	30.4	Very low	128 Å²	128	138 Å²	138	68%	0.684	71%	0.706	S	S	*	*			trans	-76.9	44.9	-161.4	-72	-33.9	0	0	0	115	L143 N144	N141-L143 PolarHBondContact O-N 3.37Å; N141-L143 VanDerWaalsContact O-N 3.09Å; N141-N144 PolarHBondContact O-N 3.36Å
142	I	34.7	Very low	30.5	Very low	107 Å²	107	134.1 Å²	134.1	55%	0.549	71%	0.71	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.6	-12.5	-172.7	-58.4	177.4	0	0	0	112.8	S140	S140-I142 PolarHBondContact O-N 2.94Å
143	L	31.7	Very low	30.6	Very low	166 Å²	166	130.6 Å²	130.6	87%	0.869	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	-2	177.9	-131.1	79.6	0	0	0	115.7	N141	N141-L143 PolarHBondContact O-N 3.37Å; N141-L143 VanDerWaalsContact O-N 3.09Å
144	N	33.2	Very low	30.9	Very low	104 Å²	104	126.9 Å²	126.9	56%	0.556	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	-9.8	179.4	-83.2	-24	0	0	0	114.5	N141 F146 R147	N141-N144 PolarHBondContact O-N 3.36Å; N144-F146 PolarHBondContact O-N 2.91Å; N144-R147 PolarHBondContact O-N 3.34Å; N144-R147 VanDerWaalsContact O-N 3.15Å
145	D	33.4	Very low	31.2	Very low	103 Å²	103	126.3 Å²	126.3	55%	0.551	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	0.8	178.8	-76	-4.5	0	0	0	114.5	K430	D145-K430 IonicContact OD2-NZ 2.65Å; D145-K430 PolarHBondContact OD2-NZ 3.07Å
146	F	33.3	Very low	31.1	Very low	199 Å²	199	125.2 Å²	125.2	87%	0.873	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.4	12	174.7	-72.5	-74.6	0	0	0	114.4	N144	N144-F146 PolarHBondContact O-N 2.91Å
147	R	33.2	Very low	31.3	Very low	169 Å²	169	123 Å²	123	64%	0.638	71%	0.714	S	S	*	*	S	Bend	trans	-117.4	69.7	170.8	-72.5	-171.8	178.5	-151.4	2.8	111.3	N144 F980	N144-R147 PolarHBondContact O-N 3.34Å; N144-R147 VanDerWaalsContact O-N 3.15Å; R147-F980 VanDerWaalsContact CZ-CZ 3.42Å; R147-F980 VanDerWaalsContact NH1-CZ 3.26Å; R147-F980 VanDerWaalsContact NH2-CZ 3.3Å
148	G	27.8	Very low	31.4	Very low	62 Å²	62	124.1 Å²	124.1	64%	0.639	73%	0.725	S	S	*	*			trans	-166.3	162.9	174.7	0	0	0	0	0	111.6
149	I	31.7	Very low	31.3	Very low	168 Å²	168	121.1 Å²	121.1	86%	0.862	73%	0.725	S	S	*	*			trans	67.5	50.9	179.6	-35.8	178	0	0	0	113.6
150	G	27.8	Very low	31.4	Very low	82 Å²	82	125.3 Å²	125.3	85%	0.845	74%	0.737	S	S	*	*			trans	-127.8	27.2	165.9	0	0	0	0	0	112.6
151	V	33.4	Very low	31.4	Very low	135 Å²	135	129.2 Å²	129.2	82%	0.818	75%	0.747	S	S	*	*	S	Bend	trans	-120.1	126.5	-179.3	-79.9	0	0	0	0	109.8	S153	V151-S153 PolarHBondContact O-N 3.48Å
152	G	29.2	Very low	31.2	Very low	80 Å²	80	132.5 Å²	132.5	83%	0.825	75%	0.75	S	S	*	*			trans	-71	125.2	-178.5	0	0	0	0	0	111.4	A154	G152-A154 VanDerWaalsContact C-N 3.32Å; G152-A154 PolarHBondContact O-N 3.44Å
153	S	28.4	Very low	31.2	Very low	125 Å²	125	134 Å²	134	87%	0.874	76%	0.76	S	S	*	*			trans	-68.2	87.6	166.4	35.6	0	0	0	0	110.3	V151	V151-S153 PolarHBondContact O-N 3.48Å
154	A	32.4	Very low	30.9	Very low	94 Å²	94	134 Å²	134	78%	0.777	75%	0.749	S	S	*	*			trans	-64.1	143.5	155.9	0	0	0	0	0	109	G152	G152-A154 VanDerWaalsContact C-N 3.32Å; G152-A154 PolarHBondContact O-N 3.44Å
155	T	33.9	Very low	31	Very low	110 Å²	110	138.7 Å²	138.7	68%	0.675	77%	0.768	S	S	*	*			trans	-62.4	142.9	-168.3	29	0	0	0	0	114.4	D157	T155-D157 PolarHBondContact O-N 2.83Å; T155-D157 VanDerWaalsContact O-N 3.14Å
156	P	27.4	Very low	30.8	Very low	127 Å²	127	142.5 Å²	142.5	83%	0.825	77%	0.774	S	S	*	*			trans	-80.8	85.8	167	33.5	-31.7	0	0	0	109.6
157	D	32.7	Very low	30.8	Very low	143 Å²	143	140.7 Å²	140.7	77%	0.765	77%	0.766	S	S	*	*			trans	-76.2	130	175.3	-90.9	-45.9	0	0	0	112.2	T155	T155-D157 PolarHBondContact O-N 2.83Å; T155-D157 VanDerWaalsContact O-N 3.14Å
158	T	32.8	Very low	30.6	Very low	113 Å²	113	137 Å²	137	69%	0.693	77%	0.766	S	S	*	*			trans	-75.9	156.5	-169.7	37.1	0	0	0	0	113.6	R160	T158-R160 PolarHBondContact O-N 2.92Å
159	P	29.5	Very low	30.7	Very low	131 Å²	131	139 Å²	139	85%	0.851	77%	0.77	S	S	*	*			trans	-81.1	108.9	-176.4	31.8	-34.2	0	0	0	112.5
160	R	30.7	Very low	30.9	Very low	213 Å²	213	138 Å²	138	80%	0.804	77%	0.765	S	S	*	*			trans	-139.1	106.1	162.7	-62.4	-174.4	80.3	173.6	3	108.5	T158	T158-R160 PolarHBondContact O-N 2.92Å
161	Q	31.7	Very low	31.3	Very low	155 Å²	155	141.1 Å²	141.1	72%	0.724	76%	0.762	S	S	*	*				75.9	103.6	85.5	-173.6	176.9	1.7	0	0	112.8
162	R	27.4	Very low	31.3	Very low	197 Å²	197	142.2 Å²	142.2	74%	0.743	76%	0.763	S	S	*	*			trans	18.9	126.2	152.8	-65.3	-172.9	-93.7	174.8	-7.4	118.1
163	D	33.4	Very low	31.5	Very low	139 Å²	139	143.6 Å²	143.6	74%	0.743	76%	0.757	S	S	*	*				-165.9	157.2	97	-94	-30.5	0	0	0	114.6
164	Y	26.8	Very low	32	Very low	166 Å²	166	142.3 Å²	142.3	65%	0.651	75%	0.746	S	S	*	*			trans	-50.8	148.9	-172	-56.1	-98.6	0	0	0	117.9	W166	Y164-W166 AromaticContact CD1-NE1 3.9Å
165	Q	33.9	Very low	31.8	Very low	202 Å²	202	143.2 Å²	143.2	94%	0.944	74%	0.742	S	S	*	*				-159.3	152.2	114.1	-106.4	168.8	21.7	0	0	112.7
166	W	29	Very low	31.9	Very low	183 Å²	183	144.3 Å²	144.3	69%	0.693	74%	0.744	S	S	*	*			trans	-113.7	156.3	-160.6	-78.3	89.5	0	0	0	114	Y164	Y164-W166 AromaticContact CD1-NE1 3.9Å
167	K	32.9	Very low	31.8	Very low	161 Å²	161	144.8 Å²	144.8	70%	0.7	74%	0.739	S	S	*	*			trans	64.6	157.7	140.5	-84	163.7	172.9	161.4	0	118.4
168	S	29.8	Very low	31.5	Very low	92 Å²	92	144 Å²	144	64%	0.643	74%	0.74	S	S	*	*			cis	-163.2	127	-4.4	35.7	0	0	0	0	107.4
169	S	31	Very low	31.2	Very low	103 Å²	103	143.5 Å²	143.5	72%	0.72	74%	0.737	S	S	*	*				91.9	167.2	88.8	-56.3	0	0	0	0	113.5
170	I	35.5	Very low	31	Very low	147 Å²	147	146.4 Å²	146.4	75%	0.754	74%	0.736	S	S	*	*			trans	80.5	125.3	162.7	-64.7	153	0	0	0	115.3
171	D	35.1	Very low	30.9	Very low	147 Å²	147	141 Å²	141	79%	0.786	73%	0.727	S	S	*	*			cis	-154.7	166.2	-9.8	-106.1	-18.9	0	0	0	113
172	L	34	Very low	30.9	Very low	159 Å²	159	141.5 Å²	141.5	83%	0.832	73%	0.729	S	S	*	*			trans	-88.7	-161.8	175	-113.5	92.8	0	0	0	110.6
173	P	34.1	Very low	30.9	Very low	109 Å²	109	136 Å²	136	71%	0.708	72%	0.721	S	S	*	*			cis	-131.6	-127	-9.9	27.5	1.1	0	0	0	113.2
174	P	37.7	Very low	30.9	Very low	97 Å²	97	138.5 Å²	138.5	63%	0.63	72%	0.721	S	S	*	*				-140.4	-161.8	-111.7	47.2	-26.2	0	0	0	117.5
175	T	28.7	Very low	31.1	Very low	114 Å²	114	136.5 Å²	136.5	70%	0.699	72%	0.722	S	S	*	*			trans	81.4	145.6	148.6	50.5	0	0	0	0	123.5
176	N	35.4	Very low	30.9	Very low	132 Å²	132	136.8 Å²	136.8	71%	0.706	72%	0.716	S	S	*	*			trans	106.8	82.5	151.7	-54.9	-39.4	0	0	0	121
177	N	25.5	Very low	31	Very low	138 Å²	138	132.9 Å²	132.9	74%	0.738	71%	0.714	S	S	*	*				45.4	135.3	117.3	-52.3	-0.7	0	0	0	123.5
178	T	27	Very low	31.1	Very low	125 Å²	125	134.8 Å²	134.8	77%	0.767	73%	0.725	S	S	*	*			trans	72.2	114.4	141.8	41.3	0	0	0	0	122.5
179	T	25.4	Very low	31.1	Very low	103 Å²	103	139.3 Å²	139.3	63%	0.632	73%	0.734	S	S	*	*				61.9	115.9	127.4	-37.8	0	0	0	0	119.7
180	F	27	Very low	31	Very low	193 Å²	193	140.1 Å²	140.1	85%	0.846	74%	0.736	S	S	*	*				-176.8	152.8	107	-105.2	-79.2	0	0	0	113.6
181	T	27.2	Very low	30.7	Very low	100 Å²	100	139.2 Å²	139.2	61%	0.613	74%	0.738	S	S	*	*			trans	-59.8	154.8	-172.9	52.3	0	0	0	0	118.7
182	H	31.4	Very low	30.2	Very low	165 Å²	165	142.4 Å²	142.4	76%	0.764	74%	0.74	S	S	*	*				-177	109.7	121.4	-96.1	-72.3	0	0	0	107.6
183	S	27.8	Very low	30.1	Very low	82 Å²	82	143.1 Å²	143.1	57%	0.573	74%	0.744	S	S	*	*				68.3	110.5	71.3	-169.2	0	0	0	0	114.1
184	Y	33.6	Very low	29.9	Very low	190 Å²	190	148 Å²	148	75%	0.745	75%	0.748	S	S	*	*				170.9	121.1	115.3	-92	-67.7	0	0	0	112.1
185	D	30.2	Very low	29.6	Very low	124 Å²	124	152.5 Å²	152.5	66%	0.663	76%	0.761	S	S	*	*				47.3	139.8	129.2	-65	1.3	0	0	0	121.6
186	Y	29.7	Very low	29.7	Very low	208 Å²	208	154.4 Å²	154.4	82%	0.816	76%	0.763	S	S	*	*			cis	-157.8	167.9	15.8	-138.2	-128.7	0	0	0	111.3
187	P	32.2	Very low	29.3	Very low	102 Å²	102	153.2 Å²	153.2	66%	0.662	77%	0.766	S	S	*	*			trans	-111.3	153.4	-170.7	38.8	-30.5	0	0	0	116
188	Q	35.6	Very low	29.7	Very low	200 Å²	200	154.8 Å²	154.8	94%	0.935	77%	0.773	S	S	*	*			trans	-153.6	138.5	155.7	-111.1	169.3	29.6	0	0	112.3
189	K	29.6	Very low	29.8	Very low	188 Å²	188	153.3 Å²	153.3	82%	0.817	77%	0.768	S	S	*	*			trans	-85.7	164.1	-173.5	-66.9	176.3	176.3	174.8	0	112.5
190	P	28.3	Very low	30.2	Very low	119 Å²	119	154 Å²	154	77%	0.773	77%	0.774	S	S	*	*				-133.8	137.3	113.4	35.5	-26.5	0	0	0	115.8
191	V	28.7	Very low	30.6	Very low	129 Å²	129	150.2 Å²	150.2	78%	0.782	77%	0.769	S	S	*	*			trans	43.9	112.1	143.4	-168.1	0	0	0	0	119.6
192	Y	25.8	Very low	30.5	Very low	214 Å²	214	151.1 Å²	151.1	84%	0.839	78%	0.779	S	S	*	*			trans	-78.2	137.3	164.4	-72.8	-99.5	0	0	0	111.8
193	L	32	Very low	30.4	Very low	173 Å²	173	150.3 Å²	150.3	91%	0.906	78%	0.78	S	S	*	*			trans	-100.4	139.6	150.2	-80.5	173.1	0	0	0	109.5
194	R	28.2	Very low	30.2	Very low	212 Å²	212	151.4 Å²	151.4	80%	0.8	79%	0.787	S	S	*	*			trans	-98	102.2	-168.5	176.2	-167.8	-67.9	-159.1	-3	109.8
195	E	31.9	Very low	30.1	Very low	192 Å²	192	148.4 Å²	148.4	90%	0.897	79%	0.792	S	S	*	*			trans	-80.6	128	163.8	-69.8	-165.9	153	0	0	110.1	S197	E195-S197 PolarHBondContact O-N 3.19Å
196	M	30.7	Very low	30.1	Very low	154 Å²	154	149.3 Å²	149.3	76%	0.759	80%	0.797	S	S	*	*			trans	-90.2	98.6	-176.3	-70.4	174.2	171.8	0	0	110.6	L198	M196-L198 PolarHBondContact O-N 2.73Å
197	S	28.4	Very low	30	Very low	107 Å²	107	147.8 Å²	147.8	75%	0.748	80%	0.802	S	S	*	*			trans	-79	108.8	163.2	56.6	0	0	0	0	110	E195 S199	E195-S197 PolarHBondContact O-N 3.19Å; S197-S199 PolarHBondContact O-N 3.43Å
198	L	32.1	Very low	30.1	Very low	171 Å²	171	151 Å²	151	90%	0.895	81%	0.812	S	S	*	*			trans	-83.6	82.3	171.6	-85.7	160.1	0	0	0	110.5	M196	M196-L198 PolarHBondContact O-N 2.73Å
199	S	30.6	Very low	30	Very low	94 Å²	94	149.2 Å²	149.2	66%	0.657	80%	0.801	S	S	*	*			trans	-68.8	136.9	157.4	-61.1	0	0	0	0	109	S197	S197-S199 PolarHBondContact O-N 3.43Å
200	P	33.7	Very low	30.1	Very low	118 Å²	118	146.2 Å²	146.2	77%	0.766	79%	0.794	S	S	*	*			trans	-65	135.1	173.8	27.3	-33.2	0	0	0	109.9	S202	P200-S202 PolarHBondContact O-N 3.05Å; P200-S202 VanDerWaalsContact O-N 3.16Å
201	P	34.7	Very low	30.4	Very low	113 Å²	113	146.9 Å²	146.9	73%	0.734	79%	0.792	S	S	*	*			trans	-74	110.3	-175	28.4	-33.7	0	0	0	111.3	L203	P201-L203 HydrophobicContact CB-CG 4.48Å; P201-L203 PolarHBondContact O-N 2.82Å
202	S	25.7	Very low	30.6	Very low	118 Å²	118	146.6 Å²	146.6	83%	0.825	79%	0.785	S	S	*	*			trans	-70	108.3	157.9	53.5	0	0	0	0	108.9	P200	P200-S202 PolarHBondContact O-N 3.05Å; P200-S202 VanDerWaalsContact O-N 3.16Å
203	L	29.1	Very low	31	Very low	149 Å²	149	143 Å²	143	78%	0.78	78%	0.778	S	S	*	*			trans	-129.2	111.8	170.5	-72.2	176	0	0	0	110	P201	P201-L203 HydrophobicContact CB-CG 4.48Å; P201-L203 PolarHBondContact O-N 2.82Å
204	S	24.3	Very low	31.1	Very low	105 Å²	105	140.5 Å²	140.5	73%	0.734	77%	0.771	S	S	*	*			trans	-65.3	144.7	157.7	50.2	0	0	0	0	109.3
205	C	29.9	Very low	31.3	Very low	126 Å²	126	135.5 Å²	135.5	85%	0.851	77%	0.769	S	S	*	*			trans	-136	125.7	158.1	-83.7	0	0	0	0	108.3
206	D	31.7	Very low	31.4	Very low	144 Å²	144	131.7 Å²	131.7	77%	0.77	76%	0.763	S	S	*	*			trans	-73.2	163.6	-172.5	-64.8	-74.4	0	0	0	113.6	I208	D206-I208 PolarHBondContact O-N 3.19Å
207	L	27.8	Very low	31.5	Very low	175 Å²	175	134.5 Å²	134.5	92%	0.916	77%	0.765	S	S	*	*			trans	-53.4	115	168.2	-68.4	146.4	0	0	0	110.8
208	I	34.1	Very low	31.7	Very low	171 Å²	171	135 Å²	135	88%	0.877	77%	0.766	S	S	*	*			trans	-122	131.6	151.8	-59.3	-176	0	0	0	108.7	D206	D206-I208 PolarHBondContact O-N 3.19Å
209	K	32.6	Very low	31.7	Very low	161 Å²	161	131.1 Å²	131.1	70%	0.7	75%	0.749	S	S	*	*			trans	-95.2	160	-166.2	-109.4	-178.4	171.3	-162.6	0	111.4
210	D	32.3	Very low	32	Very low	125 Å²	125	133.8 Å²	133.8	67%	0.668	76%	0.756	S	S	*	*			trans	65.9	147.3	150	-50.4	-16.3	0	0	0	115.6
211	D	33.3	Very low	31.8	Very low	134 Å²	134	132.7 Å²	132.7	72%	0.717	75%	0.751	S	S	*	*			cis	-160.3	169	6.9	-135.2	-21.9	0	0	0	114.5
212	L	33.5	Very low	31.8	Very low	122 Å²	122	135.3 Å²	135.3	64%	0.639	76%	0.759	S	S	*	*			trans	68.6	111.2	155	-93.5	89.4	0	0	0	124
213	I	35.1	Very low	31.8	Very low	138 Å²	138	134.3 Å²	134.3	71%	0.708	75%	0.751	S	S	*	*				59.2	125.4	113.7	-63	179.6	0	0	0	118.1
214	T	34.3	Very low	32	Very low	122 Å²	122	135.2 Å²	135.2	75%	0.748	76%	0.755	S	S	*	*				-162.9	149.6	54.1	-19.9	0	0	0	0	113.7
215	S	31.7	Very low	32.1	Very low	107 Å²	107	136.4 Å²	136.4	75%	0.748	75%	0.753	S	S	*	*			trans	59.8	132.9	141.6	-163.5	0	0	0	0	120.3
216	S	34.6	Very low	32.3	Very low	111 Å²	111	139.2 Å²	139.2	78%	0.776	75%	0.754	S	S	*	*			cis	-161.1	165.4	-5.2	39.5	0	0	0	0	110.5
217	R	31.6	Very low	32.3	Very low	214 Å²	214	141.2 Å²	141.2	81%	0.808	76%	0.756	S	S	*	*			trans	-125	146.6	-174.5	178.2	-175.6	-176.4	-174.6	4.5	111	T219	R217-T219 HydrophobicContact CG-CG2 4.32Å
218	P	33.9	Very low	32.3	Very low	117 Å²	117	139.6 Å²	139.6	76%	0.76	75%	0.753	S	S	*	*			trans	-132.2	114.6	133.1	33.1	-20.8	0	0	0	110.5
219	T	32.5	Very low	32.1	Very low	89 Å²	89	137.4 Å²	137.4	55%	0.546	75%	0.748	S	S	.	*				76.9	132.9	72.8	56.4	0	0	0	0	114.3	R217	R217-T219 HydrophobicContact CG-CG2 4.32Å
220	N	35.2	Very low	31.8	Very low	151 Å²	151	134.4 Å²	134.4	81%	0.807	75%	0.747	S	S	*	*			trans	74.3	136.4	180	-52.4	-8.9	0	0	0	116.5
221	S	30.7	Very low	31.4	Very low	95 Å²	95	134.7 Å²	134.7	66%	0.664	76%	0.758	S	S	*	*			cis	179.6	112.6	-35.6	40	0	0	0	0	108.1
222	N	34.3	Very low	31.2	Very low	168 Å²	168	138.9 Å²	138.9	90%	0.898	76%	0.763	S	S	*	*			trans	173.9	121.2	136.4	-88.5	-11.1	0	0	0	108.6
223	C	26.6	Very low	30.8	Very low	97 Å²	97	141.2 Å²	141.2	66%	0.655	77%	0.773	S	S	*	*			trans	-99.4	132.7	-174.2	-175.9	0	0	0	0	110.8
224	I	32.7	Very low	30.5	Very low	168 Å²	168	142.7 Å²	142.7	86%	0.862	78%	0.782	S	S	*	*			trans	-135.3	123.4	139.8	-61.4	-174.9	0	0	0	105.8	E226	I224-E226 PolarHBondContact O-N 3.19Å
225	D	27	Very low	30.4	Very low	130 Å²	130	142.5 Å²	142.5	70%	0.695	78%	0.78	S	S	*	*			trans	-71.5	115.7	-175.2	-69	-63.3	0	0	0	112.5
226	E	32.3	Very low	30.2	Very low	185 Å²	185	148.3 Å²	148.3	86%	0.864	79%	0.788	S	S	*	*			trans	-106.1	114.4	152.9	-78.6	-168.9	150.6	0	0	109.1	I224 T228	I224-E226 PolarHBondContact O-N 3.19Å; E226-T228 PolarHBondContact O-N 3.32Å
227	F	31.7	Very low	30	Very low	186 Å²	186	153.3 Å²	153.3	82%	0.816	79%	0.789	S	S	*	*			trans	-64.2	106.3	-176.7	-90.1	-94.8	0	0	0	112.1	T229	F227-T229 PolarHBondContact O-N 3.24Å
228	T	28.5	Very low	30	Very low	141 Å²	141	152 Å²	152	87%	0.865	79%	0.792	S	S	*	*			trans	-75.5	97.2	166.1	26.2	0	0	0	0	110.2	E226	E226-T228 PolarHBondContact O-N 3.32Å
229	T	29	Very low	29.9	Very low	125 Å²	125	153 Å²	153	77%	0.767	79%	0.791	S	S	*	*			trans	-105.5	84.8	169	27.7	0	0	0	0	111.5	F227 C231	F227-T229 PolarHBondContact O-N 3.24Å; T229-C231 PolarHBondContact O-N 3.26Å
230	S	26.6	Very low	29.9	Very low	97 Å²	97	153.7 Å²	153.7	68%	0.678	80%	0.8	S	S	*	*			trans	5.8	103.6	158.4	-167.3	0	0	0	0	117.3	R232	S230-R232 VanDerWaalsContact C-N 3.31Å; S230-R232 PolarHBondContact O-N 3.12Å
231	C	24.5	Very low	29.9	Very low	132 Å²	132	152.5 Å²	152.5	89%	0.892	80%	0.801	S	S	*	*			trans	-65.2	90	157.6	-69.8	0	0	0	0	109.6	T229 M233	T229-C231 PolarHBondContact O-N 3.26Å; C231-M233 PolarHBondContact O-N 3.15Å
232	R	29.5	Very low	30.3	Very low	221 Å²	221	154.1 Å²	154.1	83%	0.834	81%	0.806	S	S	*	*			trans	-71.8	108.7	168	-76.4	-173.7	174.4	-178.8	-1.2	108.9	S230 L234	S230-R232 VanDerWaalsContact C-N 3.31Å; S230-R232 PolarHBondContact O-N 3.12Å; R232-L234 PolarHBondContact O-N 2.99Å; R232-L234 VanDerWaalsContact O-N 3.11Å
233	M	24.6	Very low	30.4	Very low	171 Å²	171	152.4 Å²	152.4	84%	0.842	80%	0.802	S	S	*	*			trans	-57.3	115.4	167.7	-61.9	-164	-45.6	0	0	109.4	C231	C231-M233 PolarHBondContact O-N 3.15Å
234	L	29.6	Very low	31.1	Very low	170 Å²	170	154 Å²	154	89%	0.89	80%	0.802	S	S	*	*			trans	-84.9	110.3	160.9	-76.9	172.2	0	0	0	108	R232 Y236	R232-L234 PolarHBondContact O-N 2.99Å; R232-L234 VanDerWaalsContact O-N 3.11Å; L234-Y236 PolarHBondContact O-N 3.21Å
235	T	30.9	Very low	31.5	Very low	117 Å²	117	150.3 Å²	150.3	72%	0.718	78%	0.784	S	S	*	*			trans	-68.4	120.7	177.1	36.4	0	0	0	0	110.4	R237	T235-R237 PolarHBondContact O-N 3.07Å; T235-R237 VanDerWaalsContact O-N 3.14Å
236	Y	27.4	Very low	32.7	Very low	230 Å²	230	148.7 Å²	148.7	90%	0.902	78%	0.78	S	S	*	*			trans	-63.5	112.9	173	-122	-94.5	0	0	0	109.5	L234	L234-Y236 PolarHBondContact O-N 3.21Å
237	R	31.2	Very low	34	Very low	215 Å²	215	144.1 Å²	144.1	81%	0.811	76%	0.761	S	S	*	*			trans	-77.7	123.9	166.1	-85	-84.2	176.9	157.2	-3.8	108.3	T235 D239	T235-R237 PolarHBondContact O-N 3.07Å; T235-R237 VanDerWaalsContact O-N 3.14Å; R237-D239 PolarHBondContact O-N 2.93Å
238	Q	31.2	Very low	35.3	Very low	187 Å²	187	138.6 Å²	138.6	87%	0.874	74%	0.74	S	S	*	*			trans	-75.4	103.6	174.9	-66.2	169.3	-56.5	0	0	109.5
239	D	32.9	Very low	37	Very low	137 Å²	137	135.8 Å²	135.8	73%	0.733	72%	0.719	S	S	*	*			trans	-139.7	99.7	167.4	-82.1	-58.4	0	0	0	110.6	R237	R237-D239 PolarHBondContact O-N 2.93Å
240	S	32.2	Very low	38.7	Very low	104 Å²	104	136.4 Å²	136.4	73%	0.727	71%	0.713	S	S	*	*			trans	44.8	124.3	157.7	-55.1	0	0	0	0	120.6	T242	S240-T242 PolarHBondContact O-N 3.01Å
241	P	34.7	Very low	40.6	Very low	127 Å²	127	138 Å²	138	83%	0.825	71%	0.71	S	S	*	*			trans	-70.7	107.5	171.5	30.5	-32.7	0	0	0	110.5	V243	P241-V243 PolarHBondContact O-N 3.48Å
242	T	38.4	Very low	42.7	Very low	128 Å²	128	138 Å²	138	79%	0.785	69%	0.694	S	S	*	*			trans	-60.4	121	170.7	-56.3	0	0	0	0	109.3	S240 I244	S240-T242 PolarHBondContact O-N 3.01Å; T242-I244 PolarHBondContact O-N 2.85Å
243	V	37.2	Very low	44.3	Very low	133 Å²	133	132.2 Å²	132.2	81%	0.806	68%	0.68	S	S	*	*			trans	-58.2	108.5	177.7	177.8	0	0	0	0	108.9	P241 N245	P241-V243 PolarHBondContact O-N 3.48Å; V243-N245 PolarHBondContact O-N 3.08Å; V243-N245 VanDerWaalsContact O-N 3.15Å
244	I	41.2	Very low	46.2	Very low	129 Å²	129	131 Å²	131	66%	0.662	67%	0.67	S	S	*	*			trans	-71.5	111.3	178.2	-55.3	177	0	0	0	107.4	T242 T246 I249	T242-I244 PolarHBondContact O-N 2.85Å; I244-T246 PolarHBondContact O-N 2.89Å; I244-I249 HydrophobicContact CG2-CD1 3.9Å; I244-I249 HydrophobicContact CG2-CG1 4.17Å
245	N	41.1	Very low	47.4	Very low	91 Å²	91	127.1 Å²	127.1	49%	0.487	66%	0.655	S	S	.	*			trans	-63.6	120.7	178.3	-173.9	0.3	0	0	0	109.8	V243 D247 D248	V243-N245 PolarHBondContact O-N 3.08Å; V243-N245 VanDerWaalsContact O-N 3.15Å; N245-D247 PolarHBondContact O-N 3.33Å; N245-D247 PolarHBondContact OD1-N 3.32Å; N245-D248 PolarHBondContact O-N 2.89Å; N245-D248 VanDerWaalsContact O-N 3.12Å
246	T	51.5	Low	48.3	Very low	97 Å²	97	129.9 Å²	129.9	60%	0.595	66%	0.657	S	S	*	*	H	α-helix	trans	-57.5	-31.2	-179.4	42.4	0	0	0	0	112.6	I244 D248 I249 E250	I244-T246 PolarHBondContact O-N 2.89Å; T246-D248 VanDerWaalsContact C-N 3.26Å; T246-D248 PolarHBondContact O-N 3.34Å; T246-I249 PolarHBondContact O-N 2.9Å; T246-E250 PolarHBondContact O-N 3.47Å
247	D	59.7	Low	49.3	Very low	88 Å²	88	123 Å²	123	47%	0.471	64%	0.643	S	S	.	*	H	α-helix	trans	-64.3	-30.9	-179.4	-58.3	-10.5	0	0	0	112.5	N245 Q251	N245-D247 PolarHBondContact O-N 3.33Å; N245-D247 PolarHBondContact OD1-N 3.32Å; D247-Q251 WeakPolarHBondContact O-CB 3.23Å; D247-Q251 WeakPolarHBondContact O-CG 3.38Å; D247-Q251 PolarHBondContact O-N 3.34Å
248	D	59.7	Low	50.1	Low	70 Å²	70	117.6 Å²	117.6	37%	0.374	63%	0.634	S	S	.	*	H	α-helix	trans	-75.9	-30.8	179.2	-172.1	48.2	0	0	0	111.4	N245 T246 K252	N245-D248 PolarHBondContact O-N 2.89Å; N245-D248 VanDerWaalsContact O-N 3.12Å; T246-D248 VanDerWaalsContact C-N 3.26Å; T246-D248 PolarHBondContact O-N 3.34Å; D248-K252 WeakPolarHBondContact O-CB 3.46Å; D248-K252 WeakPolarHBondContact O-CD 3.27Å; D248-K252 VanDerWaalsContact O-CG 3.26Å; D248-K252 WeakPolarHBondContact O-CG 3.44Å; D248-K252 PolarHBondContact O-N 3.35Å; D248-K252 VanDerWaalsContact O-N 3.13Å; D248-K252 WeakPolarHBondContact OD1-CE 3.42Å; D248-K252 IonicContact OD1-NZ 2.99Å; D248-K252 PolarHBondContact OD1-NZ 3.14Å; D248-K252 WeakPolarHBondContact OD2-CE 3.38Å; D248-K252 IonicContact OD2-NZ 3.77Å; D248-K252 PolarHBondContact OD2-NZ 2.98Å
249	I	64.2	Low	50.7	Low	82 Å²	82	114.5 Å²	114.5	42%	0.421	63%	0.63	S	S	.	*	H	α-helix	trans	-69.8	-45.9	171.1	-58	177.7	0	0	0	110	I244 T246 Q251 K252 L253	I244-I249 HydrophobicContact CG2-CD1 3.9Å; I244-I249 HydrophobicContact CG2-CG1 4.17Å; T246-I249 PolarHBondContact O-N 2.9Å; I249-Q251 VanDerWaalsContact C-N 3.34Å; I249-Q251 PolarHBondContact O-N 3.06Å; I249-K252 PolarHBondContact O-N 3.48Å; I249-L253 HydrophobicContact CG2-CD1 3.82Å; I249-L253 HydrophobicContact CG2-CG 4.33Å; I249-L253 WeakPolarHBondContact O-CG 3.36Å; I249-L253 PolarHBondContact O-N 2.84Å
250	E	64.5	Low	51.3	Low	138 Å²	138	115.5 Å²	115.5	65%	0.645	63%	0.634	S	S	*	*	H	α-helix	trans	-62.5	-38.6	176.7	-73.7	-158.5	162.1	0	0	112.7	T246 K252 L253 K254	T246-E250 PolarHBondContact O-N 3.47Å; E250-K252 VanDerWaalsContact C-N 3.35Å; E250-L253 PolarHBondContact O-N 3.46Å; E250-K254 PolarHBondContact O-N 3.28Å
251	Q	66.4	Low	51.8	Low	131 Å²	131	116.3 Å²	116.3	61%	0.612	64%	0.637	S	S	*	*	H	α-helix	trans	-64.3	-38	174.1	-76.2	-171.5	52.4	0	0	112.6	D247 I249 K254	D247-Q251 WeakPolarHBondContact O-CB 3.23Å; D247-Q251 WeakPolarHBondContact O-CG 3.38Å; D247-Q251 PolarHBondContact O-N 3.34Å; I249-Q251 VanDerWaalsContact C-N 3.34Å; I249-Q251 PolarHBondContact O-N 3.06Å; Q251-K254 WeakPolarHBondContact O-CB 3.31Å
252	K	68.2	Low	52.2	Low	131 Å²	131	117.4 Å²	117.4	57%	0.57	64%	0.635	S	S	*	*	H	α-helix	trans	-73	-26.4	176.8	-72.9	166.2	-176.4	167.4	0	113.6	D248 I249 E250 P255	D248-K252 WeakPolarHBondContact O-CB 3.46Å; D248-K252 WeakPolarHBondContact O-CD 3.27Å; D248-K252 VanDerWaalsContact O-CG 3.26Å; D248-K252 WeakPolarHBondContact O-CG 3.44Å; D248-K252 PolarHBondContact O-N 3.35Å; D248-K252 VanDerWaalsContact O-N 3.13Å; D248-K252 WeakPolarHBondContact OD1-CE 3.42Å; D248-K252 IonicContact OD1-NZ 2.99Å; D248-K252 PolarHBondContact OD1-NZ 3.14Å; D248-K252 WeakPolarHBondContact OD2-CE 3.38Å; D248-K252 IonicContact OD2-NZ 3.77Å; D248-K252 PolarHBondContact OD2-NZ 2.98Å; I249-K252 PolarHBondContact O-N 3.48Å; E250-K252 VanDerWaalsContact C-N 3.35Å; K252-P255 WeakPolarHBondContact O-CD 3.41Å
253	L	64	Low	52	Low	101 Å²	101	119.9 Å²	119.9	53%	0.529	63%	0.631	S	S	.	*	H	α-helix	trans	-89.1	-14.3	176.4	-66.8	176.7	0	0	0	114.2	I249 E250 P255 F256 S257	I249-L253 HydrophobicContact CG2-CD1 3.82Å; I249-L253 HydrophobicContact CG2-CG 4.33Å; I249-L253 WeakPolarHBondContact O-CG 3.36Å; I249-L253 PolarHBondContact O-N 2.84Å; E250-L253 PolarHBondContact O-N 3.46Å; L253-P255 VanDerWaalsContact C-CD 3.41Å; L253-F256 PolarHBondContact O-N 3.13Å; L253-S257 PolarHBondContact O-N 3.4Å; L253-S257 PolarHBondContact O-OG 3.02Å
254	K	64.7	Low	52.3	Low	144 Å²	144	120.4 Å²	120.4	63%	0.626	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54	-36	178.4	-127.2	164.2	-172.3	160.9	0	115.6	E250 Q251 F256 S257	E250-K254 PolarHBondContact O-N 3.28Å; Q251-K254 WeakPolarHBondContact O-CB 3.31Å; K254-F256 VanDerWaalsContact C-N 3.32Å; K254-F256 PolarHBondContact O-N 2.94Å; K254-S257 WeakPolarHBondContact CA-OG 3.49Å; K254-S257 PolarHBondContact O-OG 3.07Å
255	P	53.8	Low	52.1	Low	89 Å²	89	116.4 Å²	116.4	58%	0.578	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-31	174.7	-22.4	34.9	0	0	0	113.6	K252 L253 T258	K252-P255 WeakPolarHBondContact O-CD 3.41Å; L253-P255 VanDerWaalsContact C-CD 3.41Å; P255-T258 PolarHBondContact O-OG1 3.01Å
256	F	49.6	Very low	51.8	Low	175 Å²	175	115.4 Å²	115.4	77%	0.768	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-8	-174.6	-61.5	-77.7	0	0	0	113.9	L253 K254 T258	L253-F256 PolarHBondContact O-N 3.13Å; K254-F256 VanDerWaalsContact C-N 3.32Å; K254-F256 PolarHBondContact O-N 2.94Å; F256-T258 VanDerWaalsContact C-N 3.35Å
257	S	49.8	Very low	51.5	Low	86 Å²	86	115.1 Å²	115.1	60%	0.601	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	1.8	179.7	22	0	0	0	0	113.7	L253 K254	L253-S257 PolarHBondContact O-N 3.4Å; L253-S257 PolarHBondContact O-OG 3.02Å; K254-S257 WeakPolarHBondContact CA-OG 3.49Å; K254-S257 PolarHBondContact O-OG 3.07Å
258	T	46.2	Very low	50.5	Low	102 Å²	102	113.3 Å²	113.3	63%	0.626	61%	0.605	S	S	*	*	S	Bend	trans	-89.2	131.3	169.6	60.5	0	0	0	0	110.5	P255 F256 L260	P255-T258 PolarHBondContact O-OG1 3.01Å; F256-T258 VanDerWaalsContact C-N 3.35Å; T258-L260 PolarHBondContact O-N 3.3Å
259	P	44.2	Very low	49.3	Very low	121 Å²	121	112.5 Å²	112.5	79%	0.786	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-65.1	133.9	177.1	26.4	-33.1	0	0	0	110.1
260	L	46.7	Very low	48.2	Very low	158 Å²	158	110.8 Å²	110.8	83%	0.827	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-50.6	136.6	177.5	-73.2	169.9	0	0	0	110.7	T258 I262	T258-L260 PolarHBondContact O-N 3.3Å; L260-I262 PolarHBondContact O-N 3.42Å
261	P	41.9	Very low	47	Very low	122 Å²	122	111.8 Å²	111.8	79%	0.792	60%	0.596	S	S	*	*			trans	-60.6	113.3	-175.6	23.1	-33	0	0	0	110.6	Y263	P261-Y263 PolarHBondContact O-N 2.95Å; P261-Y263 VanDerWaalsContact O-N 3.15Å
262	I	42.5	Very low	45.9	Very low	150 Å²	150	111.6 Å²	111.6	77%	0.769	60%	0.598	S	S	*	*			trans	-62.7	116.9	176.8	-59.7	174	0	0	0	107.8	L260 I264	L260-I262 PolarHBondContact O-N 3.42Å; I262-I264 PolarHBondContact O-N 3.16Å
263	Y	35.3	Very low	44.6	Very low	180 Å²	180	112.1 Å²	112.1	71%	0.706	61%	0.606	S	S	*	*			trans	-65.8	99.1	174.7	178.5	-97.7	0	0	0	109.7	P261 P265	P261-Y263 PolarHBondContact O-N 2.95Å; P261-Y263 VanDerWaalsContact O-N 3.15Å; Y263-P265 HydrophobicContact CD1-CG 4.11Å; Y263-P265 HydrophobicContact CE1-CB 3.87Å; Y263-P265 HydrophobicContact CE1-CG 3.85Å; Y263-P265 WeakPolarHBondContact O-CD 3.35Å
264	I	43.6	Very low	43.7	Very low	144 Å²	144	115.2 Å²	115.2	74%	0.738	62%	0.616	S	S	*	*			trans	-83.1	112.7	168.3	-59.4	173.1	0	0	0	106.6	I262 S266	I262-I264 PolarHBondContact O-N 3.16Å; I264-S266 PolarHBondContact O-N 3.33Å
265	P	36.5	Very low	42.2	Very low	44 Å²	44	113.6 Å²	113.6	29%	0.286	61%	0.61	S	S	.	*			trans	-64.5	137.5	179.9	-13.7	26.8	0	0	0	109.9	Y263 C269 T270	Y263-P265 HydrophobicContact CD1-CG 4.11Å; Y263-P265 HydrophobicContact CE1-CB 3.87Å; Y263-P265 HydrophobicContact CE1-CG 3.85Å; Y263-P265 WeakPolarHBondContact O-CD 3.35Å; P265-C269 HydrophobicContact CB-CB 4Å; P265-T270 HydrophobicContact CB-CG2 4.14Å; P265-T270 HydrophobicContact CG-CG2 4.41Å
266	S	35.5	Very low	41.4	Very low	70 Å²	70	114.2 Å²	114.2	49%	0.49	62%	0.616	S	S	.	*			trans	-44.1	148.6	177.8	171.5	0	0	0	0	112.3	I264 A268 C269 T270	I264-S266 PolarHBondContact O-N 3.33Å; S266-A268 CarbonylContact O-C 3.6Å; S266-A268 PolarHBondContact O-N 2.94Å; S266-A268 PolarHBondContact OG-N 3.02Å; S266-C269 PolarHBondContact O-N 2.82Å; S266-T270 PolarHBondContact O-N 3.34Å; S266-T270 PolarHBondContact O-OG1 3.17Å
267	T	44.1	Very low	40.8	Very low	92 Å²	92	112.6 Å²	112.6	56%	0.564	61%	0.611	S	S	*	*	H	α-helix	trans	-59.7	-12.7	176.3	68.7	0	0	0	0	113.4	T270 R271	T267-T270 WeakPolarHBondContact CA-OG1 3.49Å; T267-R271 VanDerWaalsContact O-CB 3.31Å; T267-R271 WeakPolarHBondContact O-CB 3.33Å; T267-R271 WeakPolarHBondContact O-CG 3.44Å; T267-R271 PolarHBondContact O-N 2.95Å; T267-R271 PolarHBondContact O-NE 3.01Å; T267-R271 PolarHBondContact OG1-NH2 3.03Å
268	A	38.6	Very low	40.1	Very low	49 Å²	49	113.7 Å²	113.7	41%	0.405	61%	0.614	S	S	.	*	H	α-helix	trans	-74.8	-52.6	166.6	0	0	0	0	0	112.3	S266 T270 R271 I272	S266-A268 CarbonylContact O-C 3.6Å; S266-A268 PolarHBondContact O-N 2.94Å; S266-A268 PolarHBondContact OG-N 3.02Å; A268-T270 PolarHBondContact O-N 2.96Å; A268-R271 WeakPolarHBondContact O-CB 3.33Å; A268-R271 PolarHBondContact O-N 3.29Å; A268-R271 VanDerWaalsContact O-N 3.08Å; A268-I272 WeakPolarHBondContact O-CG1 3.44Å; A268-I272 PolarHBondContact O-N 3.03Å
269	C	35.6	Very low	39.5	Very low	54 Å²	54	117.5 Å²	117.5	37%	0.365	62%	0.618	S	S	.	*	H	α-helix	trans	-62.7	-40.2	177.7	-64	0	0	0	0	112.2	P265 S266 R271 I272 L273	P265-C269 HydrophobicContact CB-CB 4Å; S266-C269 PolarHBondContact O-N 2.82Å; C269-R271 VanDerWaalsContact C-N 3.32Å; C269-I272 PolarHBondContact O-N 3Å; C269-L273 WeakPolarHBondContact O-CB 3.15Å; C269-L273 WeakPolarHBondContact O-CG 3.28Å; C269-L273 PolarHBondContact O-N 3.23Å
270	T	40.7	Very low	38.9	Very low	46 Å²	46	120 Å²	120	28%	0.282	62%	0.617	S	S	.	*	H	α-helix	trans	-72	-23.1	173.8	49.3	0	0	0	0	113.1	P265 S266 T267 A268 K274	P265-T270 HydrophobicContact CB-CG2 4.14Å; P265-T270 HydrophobicContact CG-CG2 4.41Å; S266-T270 PolarHBondContact O-N 3.34Å; S266-T270 PolarHBondContact O-OG1 3.17Å; T267-T270 WeakPolarHBondContact CA-OG1 3.49Å; A268-T270 PolarHBondContact O-N 2.96Å; T270-K274 WeakPolarHBondContact O-CB 3.19Å; T270-K274 VanDerWaalsContact O-CG 3.23Å; T270-K274 WeakPolarHBondContact O-CG 3.49Å; T270-K274 PolarHBondContact O-N 3.3Å
271	R	38.7	Very low	38.2	Very low	158 Å²	158	121.9 Å²	121.9	60%	0.596	62%	0.619	S	S	*	*	H	α-helix	trans	-69	-44.3	167.8	-94.6	176.3	-87.3	-179.8	-8.8	111.5	T267 A268 C269 L273 K274 Q275	T267-R271 VanDerWaalsContact O-CB 3.31Å; T267-R271 WeakPolarHBondContact O-CB 3.33Å; T267-R271 WeakPolarHBondContact O-CG 3.44Å; T267-R271 PolarHBondContact O-N 2.95Å; T267-R271 PolarHBondContact O-NE 3.01Å; T267-R271 PolarHBondContact OG1-NH2 3.03Å; A268-R271 WeakPolarHBondContact O-CB 3.33Å; A268-R271 PolarHBondContact O-N 3.29Å; A268-R271 VanDerWaalsContact O-N 3.08Å; C269-R271 VanDerWaalsContact C-N 3.32Å; R271-L273 PolarHBondContact O-N 3.48Å; R271-K274 PolarHBondContact O-N 3.43Å; R271-Q275 VanDerWaalsContact O-CB 3.32Å; R271-Q275 WeakPolarHBondContact O-CB 3.33Å; R271-Q275 VanDerWaalsContact O-CG 3.31Å; R271-Q275 WeakPolarHBondContact O-CG 3.36Å; R271-Q275 PolarHBondContact O-N 3.37Å
272	I	43.6	Very low	37.7	Very low	127 Å²	127	121.9 Å²	121.9	65%	0.651	62%	0.617	S	S	*	*	H	α-helix	trans	-63.3	-42.3	177.1	-64.2	164.7	0	0	0	110.9	A268 C269	A268-I272 WeakPolarHBondContact O-CG1 3.44Å; A268-I272 PolarHBondContact O-N 3.03Å; C269-I272 PolarHBondContact O-N 3Å
273	L	41.4	Very low	37	Very low	142 Å²	142	118.2 Å²	118.2	74%	0.743	62%	0.616	S	S	*	*	H	α-helix	trans	-79.9	-22.9	179.5	-66.9	170.5	0	0	0	114.4	C269 R271	C269-L273 WeakPolarHBondContact O-CB 3.15Å; C269-L273 WeakPolarHBondContact O-CG 3.28Å; C269-L273 PolarHBondContact O-N 3.23Å; R271-L273 PolarHBondContact O-N 3.48Å
274	K	45.4	Very low	36.7	Very low	167 Å²	167	117.1 Å²	117.1	73%	0.726	62%	0.622	S	S	*	*	H	α-helix	trans	-90.9	-9.7	172.3	-69.5	-176	174.4	-173.8	0	113.7	T270 R271 S276	T270-K274 WeakPolarHBondContact O-CB 3.19Å; T270-K274 VanDerWaalsContact O-CG 3.23Å; T270-K274 WeakPolarHBondContact O-CG 3.49Å; T270-K274 PolarHBondContact O-N 3.3Å; R271-K274 PolarHBondContact O-N 3.43Å; K274-S276 PolarHBondContact O-N 2.95Å; K274-S276 PolarHBondContact O-OG 3.18Å
275	Q	33.4	Very low	36	Very low	110 Å²	110	120.9 Å²	120.9	51%	0.514	63%	0.629	S	S	.	*			trans	-72.9	62.6	170.6	-86.7	-174.8	-18.2	0	0	112.1	R271 E277 V278	R271-Q275 VanDerWaalsContact O-CB 3.32Å; R271-Q275 WeakPolarHBondContact O-CB 3.33Å; R271-Q275 VanDerWaalsContact O-CG 3.31Å; R271-Q275 WeakPolarHBondContact O-CG 3.36Å; R271-Q275 PolarHBondContact O-N 3.37Å; Q275-E277 PolarHBondContact O-N 3.13Å; Q275-V278 HydrophobicContact CB-CG2 4.31Å
276	S	36.1	Very low	35.8	Very low	101 Å²	101	127.2 Å²	127.2	71%	0.706	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	2.1	152.4	48.6	0	0	0	0	112.4	K274	K274-S276 PolarHBondContact O-N 2.95Å; K274-S276 PolarHBondContact O-OG 3.18Å
277	E	36.7	Very low	35.7	Very low	141 Å²	141	128.3 Å²	128.3	66%	0.659	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-2.1	173.7	-63.2	-167.4	126.7	0	0	114.6	Q275 Y279	Q275-E277 PolarHBondContact O-N 3.13Å; E277-Y279 PolarHBondContact O-N 3.43Å
278	V	35.2	Very low	35	Very low	109 Å²	109	132.3 Å²	132.3	66%	0.661	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	24.8	166.4	-158.5	0	0	0	0	111.7	Q275	Q275-V278 HydrophobicContact CB-CG2 4.31Å
279	Y	33.4	Very low	34.9	Very low	183 Å²	183	135 Å²	135	72%	0.718	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106	25.2	171.8	-119.6	-85.4	0	0	0	112.2	E277	E277-Y279 PolarHBondContact O-N 3.43Å
280	K	32.2	Very low	34.7	Very low	172 Å²	172	137.6 Å²	137.6	75%	0.748	71%	0.712	S	S	*	*	S	Bend	trans	-122.3	13.7	179.8	-79.9	-173.5	174.8	174.4	0	115.2
281	F	31.3	Very low	34.2	Very low	199 Å²	199	145.9 Å²	145.9	87%	0.873	74%	0.738	S	S	*	*	S	Bend	trans	-116.3	11.5	178.8	-99	-78.1	0	0	0	115.3
282	T	31	Very low	33.9	Very low	122 Å²	122	144.4 Å²	144.4	75%	0.748	74%	0.742	S	S	*	*	S	Bend	trans	-138.3	110.1	174.1	25.5	0	0	0	0	110.7
283	G	28.8	Very low	33.4	Very low	73 Å²	73	146.7 Å²	146.7	75%	0.753	74%	0.742	S	S	*	*	S	Bend	trans	71.2	81.7	159.1	0	0	0	0	0	117.7
284	D	30.1	Very low	33.1	Very low	156 Å²	156	147.9 Å²	147.9	83%	0.834	74%	0.738	S	S	*	*			trans	-168.5	94.3	148.4	-103.7	-23.4	0	0	0	110.5
285	Y	28.6	Very low	32.5	Very low	224 Å²	224	145.7 Å²	145.7	88%	0.878	73%	0.734	S	S	*	*			trans	-165.7	63.2	155	-97.5	-60.4	0	0	0	111.1
286	N	31.2	Very low	32.6	Very low	176 Å²	176	145.8 Å²	145.8	94%	0.941	74%	0.738	S	S	*	*			trans	-101.4	73.9	163.6	-114.9	-9.8	0	0	0	109.5
287	S	33.4	Very low	32.4	Very low	94 Å²	94	145.7 Å²	145.7	66%	0.657	74%	0.737	S	S	*	*			trans	-157.5	96.2	168.3	45.7	0	0	0	0	112.2
288	Q	29.5	Very low	32.4	Very low	175 Å²	175	147 Å²	147	82%	0.818	74%	0.744	S	S	*	*			trans	-39.3	170.3	148.4	-73.3	-97.3	3.8	0	0	113.7
289	P	36	Very low	32.5	Very low	105 Å²	105	149.1 Å²	149.1	68%	0.682	75%	0.75	S	S	*	*			cis	-136.2	-168.6	1.5	25	0.5	0	0	0	114.9
290	S	31.7	Very low	32.6	Very low	110 Å²	110	143.2 Å²	143.2	77%	0.769	74%	0.744	S	S	*	*			trans	88.6	136.9	165.1	85.9	0	0	0	0	115.7
291	R	29.9	Very low	32.6	Very low	219 Å²	219	144.7 Å²	144.7	83%	0.826	75%	0.751	S	S	*	*			cis	-156.7	118.2	22.4	-163.5	171.8	-166.4	-163.9	5.6	113.2
292	L	33.3	Very low	32.8	Very low	128 Å²	128	143.1 Å²	143.1	67%	0.67	75%	0.751	S	S	*	*			trans	62.1	146.8	155.1	-86.2	88.2	0	0	0	119.8
293	R	33.1	Very low	32.9	Very low	175 Å²	175	142 Å²	142	66%	0.66	75%	0.748	S	S	*	*			cis	-175.3	167.1	-18.4	-141.1	-168.2	-97.8	-170.8	-3	109.3
294	Y	34.9	Very low	33	Very low	167 Å²	167	147 Å²	147	66%	0.655	75%	0.751	S	S	*	*			trans	78.2	107.4	172.8	-65.2	-78	0	0	0	115.8
295	N	32.3	Very low	33.2	Very low	121 Å²	121	144.8 Å²	144.8	65%	0.647	75%	0.748	S	S	*	*				75.5	137.8	73.8	-62	21.9	0	0	0	110.7
296	D	35.6	Very low	33.4	Very low	112 Å²	112	141.7 Å²	141.7	60%	0.599	75%	0.746	S	S	*	*			cis	-131.6	125	34.6	-52.6	-51.5	0	0	0	108.9	K328	D296-K328 IonicContact OD2-NZ 3.09Å; D296-K328 PolarHBondContact OD2-NZ 2.98Å
297	S	31.7	Very low	33.6	Very low	98 Å²	98	138.1 Å²	138.1	69%	0.685	74%	0.735	S	S	*	*				46.5	106.7	81.1	70.8	0	0	0	0	116.2
298	E	36.6	Very low	33.6	Very low	170 Å²	170	141 Å²	141	79%	0.794	74%	0.742	S	S	*	*				-169.8	149	121.2	-110.2	176.8	-157	0	0	113
299	I	38.9	Very low	33.7	Very low	153 Å²	153	137.7 Å²	137.7	79%	0.785	74%	0.738	S	S	*	*			trans	52.3	113	157.2	-51.3	155.7	0	0	0	116.6
300	G	34.1	Very low	33.5	Very low	59 Å²	59	137.4 Å²	137.4	61%	0.608	74%	0.739	S	S	*	*			cis	107.4	113.6	8.6	0	0	0	0	0	112.7
301	K	33.4	Very low	33.6	Very low	203 Å²	203	140.7 Å²	140.7	88%	0.883	74%	0.742	S	S	*	*			trans	78.5	161.2	167.8	-49.6	175.9	-178.6	179.7	0	116.6
302	L	34.4	Very low	33.9	Very low	166 Å²	166	138 Å²	138	87%	0.869	74%	0.743	S	S	*	*			trans	74.8	94.6	175.6	-53.5	165.5	0	0	0	112.9
303	S	33.3	Very low	34	Very low	98 Å²	98	138.7 Å²	138.7	69%	0.685	74%	0.743	S	S	*	*				75.1	115.2	55.7	-167.5	0	0	0	0	113.5
304	H	31.6	Very low	34.1	Very low	178 Å²	178	138.7 Å²	138.7	82%	0.824	75%	0.747	S	S	*	*			trans	16.7	127	155.8	-58.8	-81.3	0	0	0	119.9
305	S	34.1	Very low	34.1	Very low	110 Å²	110	139 Å²	139	77%	0.769	76%	0.759	S	S	*	*				-176.5	137.8	102.3	54	0	0	0	0	112.3
306	D	31.8	Very low	34.1	Very low	158 Å²	158	138.2 Å²	138.2	85%	0.845	76%	0.764	S	S	*	*			trans	-64.9	139.1	166.4	-55.1	-77	0	0	0	111.4
307	S	36.8	Very low	34.3	Very low	102 Å²	102	139.3 Å²	139.3	71%	0.713	77%	0.768	S	S	*	*			trans	-162.6	106.9	157	-73.3	0	0	0	0	113.3
308	I	32.2	Very low	34.4	Very low	154 Å²	154	140.5 Å²	140.5	79%	0.79	77%	0.767	S	S	*	*			trans	27.7	137.5	133.3	-24.4	179.1	0	0	0	120
309	S	32	Very low	34.3	Very low	105 Å²	105	139.5 Å²	139.5	73%	0.734	76%	0.762	S	S	*	*			trans	66	156.2	151.3	37.2	0	0	0	0	117.8
310	S	32.8	Very low	34.2	Very low	100 Å²	100	140.3 Å²	140.3	70%	0.699	76%	0.76	S	S	*	*			cis	-162.9	175.6	-18.7	47.4	0	0	0	0	107.9
311	E	32.7	Very low	34.4	Very low	179 Å²	179	145.7 Å²	145.7	84%	0.836	77%	0.774	S	S	*	*			trans	-1.8	123.6	155.8	-59.7	173.9	127.9	0	0	118.9
312	L	36.4	Very low	34.4	Very low	163 Å²	163	142.9 Å²	142.9	85%	0.853	77%	0.769	S	S	*	*			trans	-178.4	93.7	141.8	-96.4	152	0	0	0	105.4
313	E	34.5	Very low	34.2	Very low	141 Å²	141	138.8 Å²	138.8	66%	0.659	76%	0.755	S	S	*	*				60.3	118.3	83.8	-165.8	171.5	-157.7	0	0	113.9
314	K	35.3	Very low	34.3	Very low	175 Å²	175	144.2 Å²	144.2	76%	0.761	76%	0.761	S	S	*	*			trans	22.5	117.8	157.2	-55.7	162.1	-170	148.6	0	117.5
315	L	36.4	Very low	34.7	Very low	173 Å²	173	141 Å²	141	91%	0.906	75%	0.754	S	S	*	*				-146.5	140.7	128.1	-107.1	164	0	0	0	110.1
316	S	32.2	Very low	34.8	Very low	106 Å²	106	141.6 Å²	141.6	74%	0.741	75%	0.753	S	S	*	*			trans	-90.4	-169.5	179.9	-172.6	0	0	0	0	110.3
317	I	38.8	Very low	34.9	Very low	134 Å²	134	141.1 Å²	141.1	69%	0.687	75%	0.751	S	S	*	*			trans	95.5	86.3	161.3	-52.8	167.4	0	0	0	115.6
318	D	34.8	Very low	34.8	Very low	124 Å²	124	144.5 Å²	144.5	66%	0.663	75%	0.753	S	S	*	*				70.1	131.5	118.1	-71	-57.3	0	0	0	125.1
319	H	33.5	Very low	35	Very low	149 Å²	149	146.8 Å²	146.8	69%	0.69	76%	0.757	S	S	*	*			trans	62.7	105.8	134.3	-76.9	69.3	0	0	0	121.4
320	K	36.2	Very low	35.1	Very low	170 Å²	170	151.6 Å²	151.6	74%	0.739	77%	0.768	S	S	*	*				33.5	114.8	122.1	-66.3	-174.2	175.9	-177	0	118.1
321	N	39.1	Very low	35.3	Very low	171 Å²	171	152.1 Å²	152.1	91%	0.914	77%	0.771	S	S	*	*			trans	-135.1	118.5	138.9	-88.6	-49.3	0	0	0	109.3
322	D	33	Very low	35.5	Very low	145 Å²	145	153.6 Å²	153.6	78%	0.775	78%	0.775	S	S	*	*			trans	-97	159.8	173	-81.6	-52.4	0	0	0	110.5
323	S	31.3	Very low	35.7	Very low	80 Å²	80	155.3 Å²	155.3	56%	0.559	78%	0.775	S	S	*	*			trans	75.7	137.2	177.3	-150.2	0	0	0	0	114.2
324	Y	35.3	Very low	35.9	Very low	211 Å²	211	154.1 Å²	154.1	83%	0.827	78%	0.78	S	S	*	*			cis	-136	130.3	27.6	-75.5	-97.9	0	0	0	111.2
325	V	39	Very low	35.8	Very low	112 Å²	112	153.6 Å²	153.6	68%	0.679	79%	0.786	S	S	*	*				55.9	106.3	92.6	-175.6	0	0	0	0	115.1
326	T	36.6	Very low	35.9	Very low	122 Å²	122	152 Å²	152	75%	0.748	78%	0.777	S	S	*	*				-174.8	121.5	117.6	23.5	0	0	0	0	114.3
327	N	34.3	Very low	36.1	Very low	148 Å²	148	152.9 Å²	152.9	79%	0.791	78%	0.78	S	S	*	*			trans	40.4	112.8	140.3	-58.9	-27.7	0	0	0	122
328	K	34.3	Very low	36	Very low	173 Å²	173	156.9 Å²	156.9	75%	0.752	79%	0.786	S	S	*	*				-159.4	117.5	124.6	-104.5	160.5	-175.3	178.6	0	112.1	D296	D296-K328 IonicContact OD2-NZ 3.09Å; D296-K328 PolarHBondContact OD2-NZ 2.98Å
329	K	37.1	Very low	35.8	Very low	202 Å²	202	159.4 Å²	159.4	88%	0.878	80%	0.799	S	S	*	*			trans	41.4	115.2	156	-66.4	179.1	177.8	175.9	0	120.2	S331	K329-S331 PolarHBondContact O-N 3.45Å
330	Q	34.1	Very low	35.8	Very low	206 Å²	206	159.9 Å²	159.9	96%	0.963	80%	0.801	S	S	*	*			trans	-60.2	129.2	161.9	-68	174.1	-14.5	0	0	112.4
331	S	36.7	Very low	35.7	Very low	111 Å²	111	158.9 Å²	158.9	78%	0.776	80%	0.803	S	S	*	*			trans	-122.1	126.8	155.5	58.4	0	0	0	0	109.4	K329 K333	K329-S331 PolarHBondContact O-N 3.45Å; S331-K333 PolarHBondContact O-N 2.63Å
332	K	36.9	Very low	35.4	Very low	210 Å²	210	156.8 Å²	156.8	91%	0.913	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-59.2	124.4	-177	-67	175.1	177.7	176.7	0	110.8
333	K	40.6	Very low	35.4	Very low	198 Å²	198	154.5 Å²	154.5	86%	0.861	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-60.6	131.5	165.3	-84.1	-177.3	173.5	178.2	0	109	S331	S331-K333 PolarHBondContact O-N 2.63Å
334	P	37.7	Very low	35.6	Very low	117 Å²	117	155.6 Å²	155.6	76%	0.76	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-64.3	139.4	171.6	27.2	-32.9	0	0	0	109.9	I336	P334-I336 PolarHBondContact O-N 3.28Å; P334-I336 VanDerWaalsContact O-N 3.13Å
335	N	34.7	Very low	35.7	Very low	164 Å²	164	151.5 Å²	151.5	88%	0.877	80%	0.801	S	S	*	*			trans	-79.4	96.3	-174.8	-156.1	13.1	0	0	0	109
336	I	38	Very low	35.4	Very low	140 Å²	140	156 Å²	156	72%	0.718	81%	0.812	S	S	*	*			trans	-64	131.8	171.2	-60.4	173.7	0	0	0	107.4	P334 R338	P334-I336 PolarHBondContact O-N 3.28Å; P334-I336 VanDerWaalsContact O-N 3.13Å; I336-R338 VanDerWaalsContact C-N 3.34Å; I336-R338 PolarHBondContact O-N 3.29Å
337	P	36.9	Very low	35.3	Very low	123 Å²	123	158.3 Å²	158.3	80%	0.799	82%	0.819	S	S	*	*			trans	-63.5	93.8	176.6	-20.2	32.5	0	0	0	110.6	L339	P337-L339 PolarHBondContact O-N 3.33Å
338	R	36.6	Very low	35.3	Very low	219 Å²	219	155.2 Å²	155.2	83%	0.826	81%	0.808	S	S	*	*			trans	-55.8	128.2	155.1	-95	179.7	154.2	172.6	-7.7	106.4	I336 Q340	I336-R338 VanDerWaalsContact C-N 3.34Å; I336-R338 PolarHBondContact O-N 3.29Å; R338-Q340 HydrophobicContact CB-CG 4.32Å; R338-Q340 PolarHBondContact O-N 2.73Å
339	L	29.7	Very low	35.3	Very low	176 Å²	176	155 Å²	155	92%	0.921	81%	0.81	S	S	*	*			trans	-60.4	89.5	156.9	-78	166.2	0	0	0	106.9	P337 L341	P337-L339 PolarHBondContact O-N 3.33Å; L339-L341 PolarHBondContact O-N 2.83Å
340	Q	32.9	Very low	35.1	Very low	159 Å²	159	151 Å²	151	74%	0.743	81%	0.807	S	S	*	*			trans	-70.4	103.7	175.3	-74.8	-177.2	-10.6	0	0	106.9	R338	R338-Q340 HydrophobicContact CB-CG 4.32Å; R338-Q340 PolarHBondContact O-N 2.73Å
341	L	34	Very low	35.1	Very low	150 Å²	150	146.1 Å²	146.1	79%	0.785	79%	0.793	S	S	*	*			trans	-47.5	137	153.6	-67.8	169.3	0	0	0	107.7	L339 S343	L339-L341 PolarHBondContact O-N 2.83Å; L341-S343 PolarHBondContact O-N 2.86Å; L341-S343 PolarHBondContact O-OG 2.92Å
342	P	33.9	Very low	35.1	Very low	127 Å²	127	149 Å²	149	83%	0.825	79%	0.792	S	S	*	*			trans	-56	106	-172	21.4	-32.8	0	0	0	109.5	S344	P342-S344 PolarHBondContact O-N 3.13Å
343	S	33.7	Very low	35.1	Very low	96 Å²	96	142.5 Å²	142.5	67%	0.671	77%	0.77	S	S	*	*			trans	-74.8	121.9	-176.6	-62.3	0	0	0	0	107.8	L341	L341-S343 PolarHBondContact O-N 2.86Å; L341-S343 PolarHBondContact O-OG 2.92Å
344	S	35.6	Very low	34.8	Very low	103 Å²	103	137.3 Å²	137.3	72%	0.72	75%	0.751	S	S	*	*			trans	-45.6	137.3	179.8	-47.6	0	0	0	0	111.3	P342 K346	P342-S344 PolarHBondContact O-N 3.13Å; S344-K346 PolarHBondContact O-N 3.09Å
345	P	36.9	Very low	34.7	Very low	126 Å²	126	135.7 Å²	135.7	82%	0.818	74%	0.741	S	S	*	*			trans	-62.5	109.9	-171.5	24.3	-33.6	0	0	0	110.7	L347	P345-L347 PolarHBondContact O-N 3.43Å
346	K	32.1	Very low	34.6	Very low	207 Å²	207	134.9 Å²	134.9	90%	0.9	74%	0.735	S	S	*	*			trans	-72	105.4	167.6	-69.6	178.9	178	178	0	108.2	S344	S344-K346 PolarHBondContact O-N 3.09Å
347	L	35.3	Very low	34.3	Very low	170 Å²	170	139.9 Å²	139.9	89%	0.89	75%	0.745	S	S	*	*			trans	-114.9	142.6	157.1	-80.4	173.3	0	0	0	110	P345	P345-L347 PolarHBondContact O-N 3.43Å
348	S	33	Very low	34.1	Very low	83 Å²	83	140.2 Å²	140.2	58%	0.58	74%	0.739	S	S	*	*			trans	-102.3	165.5	-158.5	46.7	0	0	0	0	112.8
349	H	35.6	Very low	33.9	Very low	168 Å²	168	140.6 Å²	140.6	78%	0.778	74%	0.74	S	S	*	*			trans	78.5	99	165.1	-45	-64.4	0	0	0	118.2
350	S	31.4	Very low	33.9	Very low	118 Å²	118	141 Å²	141	83%	0.825	74%	0.738	S	S	*	*				75.7	143.5	109.3	-162.5	0	0	0	0	119.5
351	P	34.7	Very low	33.8	Very low	103 Å²	103	139.1 Å²	139.1	67%	0.669	74%	0.742	S	S	*	*			trans	-120.6	172.9	-149.5	42.5	-30.6	0	0	0	115.5
352	K	36.6	Very low	33.6	Very low	172 Å²	172	137.3 Å²	137.3	75%	0.748	74%	0.741	S	S	*	*			trans	176.1	129.8	143.4	-100.6	154.6	-173.8	-179.9	0	115
353	T	36.7	Very low	33.6	Very low	73 Å²	73	139.5 Å²	139.5	45%	0.448	75%	0.746	S	S	.	*			trans	43.8	150	136.8	56.9	0	0	0	0	122.4	T1077 T1078	T353-T1077 WeakPolarHBondContact O-CB 3.46Å; T353-T1077 VanDerWaalsContact O-CG2 3.26Å; T353-T1077 WeakPolarHBondContact O-CG2 3.48Å; T353-T1078 CarbonylContact C-O 3.42Å; T353-T1078 WeakPolarHBondContact CA-O 3.37Å; T353-T1078 PolarHBondContact N-O 3.06Å
354	N	34.5	Very low	33.4	Very low	89 Å²	89	140 Å²	140	48%	0.476	75%	0.746	S	S	.	*			cis	-164.5	168.2	-20.6	-109	4.5	0	0	0	109.1	T1078 S1079	N354-T1078 WeakPolarHBondContact CA-O 3.44Å; N354-T1078 PolarHBondContact N-O 3.01Å; N354-T1078 PolarHBondContact OD1-O 3.46Å; N354-S1079 VanDerWaalsContact OD1-C 3.23Å; N354-S1079 PolarHBondContact OD1-O 3.32Å; N354-S1079 PolarHBondContact OD1-OG 3.43Å
355	P	36.1	Very low	33.3	Very low	84 Å²	84	146.2 Å²	146.2	55%	0.545	75%	0.754	S	S	.	*			trans	-109.9	-170.6	-161.3	39.3	-31.3	0	0	0	116.7
356	I	31.4	Very low	33	Very low	147 Å²	147	148.7 Å²	148.7	75%	0.754	75%	0.754	S	S	*	*			trans	89.3	112.3	162.4	-54.2	153.8	0	0	0	118.2
357	R	32.2	Very low	32.9	Very low	245 Å²	245	143.8 Å²	143.8	93%	0.925	75%	0.746	S	S	*	*				-151.4	129.6	126.3	-170.3	162.1	-78.7	-166.6	-3.7	112.8
358	I	33	Very low	32.6	Very low	130 Å²	130	143.6 Å²	143.6	67%	0.667	74%	0.744	S	S	*	*			trans	-82.8	144.6	179.3	-62.7	153	0	0	0	110.8
359	R	32.4	Very low	32.5	Very low	226 Å²	226	144.5 Å²	144.5	85%	0.853	75%	0.748	S	S	*	*			trans	157.4	105	144.3	-86.1	156.3	-164.7	-119.4	2.4	108.3
360	Q	29.7	Very low	32.2	Very low	186 Å²	186	143.1 Å²	143.1	87%	0.869	75%	0.751	S	S	*	*				56.9	107.1	85.3	-74.8	-170.6	-21.3	0	0	114.7
361	S	31.4	Very low	32.2	Very low	119 Å²	119	143 Å²	143	83%	0.832	75%	0.751	S	S	*	*			trans	-153.4	103.6	145.4	60.3	0	0	0	0	109.9
362	S	29.2	Very low	31.9	Very low	111 Å²	111	147.7 Å²	147.7	78%	0.776	76%	0.76	S	S	*	*			trans	-64.7	152.8	169.6	49.7	0	0	0	0	112.7
363	L	32.9	Very low	31.4	Very low	174 Å²	174	143.7 Å²	143.7	91%	0.911	75%	0.754	S	S	*	*			trans	-161.5	134.4	131	-102.2	148.7	0	0	0	109.8
364	P	31.5	Very low	31	Very low	105 Å²	105	146.7 Å²	146.7	68%	0.682	77%	0.767	S	S	*	*			trans	-105.1	164.5	-166.6	39.6	-33.4	0	0	0	113.4
365	R	32.1	Very low	30.7	Very low	235 Å²	235	148.7 Å²	148.7	89%	0.887	78%	0.778	S	S	*	*			trans	-153.5	97.6	149.1	-137.6	171.8	-76	-161.3	-0	113.1
366	H	32	Very low	30.3	Very low	178 Å²	178	152.8 Å²	152.8	82%	0.824	80%	0.795	S	S	*	*			trans	42.8	123.7	155.3	-61.8	-76.4	0	0	0	122
367	S	28.4	Very low	30.3	Very low	103 Å²	103	155.4 Å²	155.4	72%	0.72	80%	0.801	S	S	*	*			trans	-74.6	155.3	174.3	50.2	0	0	0	0	115.2
368	I	29.9	Very low	30.1	Very low	166 Å²	166	150.8 Å²	150.8	85%	0.851	79%	0.793	S	S	*	*				-163.7	147.4	122.2	-97.7	151.8	0	0	0	108.1
369	P	31.2	Very low	30.1	Very low	102 Å²	102	150.4 Å²	150.4	66%	0.662	80%	0.799	S	S	*	*			trans	-103.3	163.3	-137.3	-3.6	24.3	0	0	0	118.1
370	T	29.4	Very low	30.5	Very low	139 Å²	139	148.6 Å²	148.6	85%	0.853	80%	0.797	S	S	*	*			trans	57.8	132.4	150.1	55.1	0	0	0	0	119.7
371	S	30.5	Very low	30.4	Very low	116 Å²	116	145.2 Å²	145.2	81%	0.811	79%	0.794	S	S	*	*			cis	-140	130.1	-9	60.4	0	0	0	0	108.6
372	K	28.4	Very low	30.7	Very low	201 Å²	201	146.5 Å²	146.5	87%	0.874	80%	0.797	S	S	*	*			trans	-89.8	137.3	179.2	-84	-178.2	176.3	177.3	0	110.1
373	S	26.2	Very low	30.6	Very low	89 Å²	89	147 Å²	147	62%	0.622	80%	0.801	S	S	*	*			trans	5.6	140.6	142.6	59.3	0	0	0	0	117.6
374	N	28	Very low	30.5	Very low	135 Å²	135	142.4 Å²	142.4	72%	0.722	78%	0.783	S	S	*	*				-172.2	132.7	115.4	-92.7	-13.9	0	0	0	115
375	N	29.2	Very low	30.4	Very low	132 Å²	132	143.1 Å²	143.1	71%	0.706	79%	0.791	S	S	*	*			trans	74.9	103.2	138.4	-56.9	-16	0	0	0	120.6
376	L	27.1	Very low	30.4	Very low	170 Å²	170	138.4 Å²	138.4	89%	0.89	78%	0.782	S	S	*	*			trans	-8.1	118.1	151.6	-77.5	64.9	0	0	0	116.2
377	K	31.8	Very low	30.5	Very low	202 Å²	202	132 Å²	132	88%	0.878	76%	0.757	S	S	*	*			trans	-128.1	128.6	144.2	-76.8	-174.7	178.7	174.9	0	109.5	P379	K377-P379 WeakPolarHBondContact O-CD 3.21Å
378	I	28.2	Very low	30.9	Very low	147 Å²	147	137.9 Å²	137.9	75%	0.754	76%	0.763	S	S	*	*			trans	-64.9	120.4	-171.6	-60.5	153.8	0	0	0	110.3	K380	I378-K380 HydrophobicContact CG2-CG 4.31Å; I378-K380 PolarHBondContact O-N 3.49Å; I378-K380 VanDerWaalsContact O-N 3.17Å
379	P	32	Very low	31.4	Very low	123 Å²	123	138 Å²	138	80%	0.799	75%	0.753	S	S	*	*			trans	-77.4	100.9	170.2	30.5	-30.8	0	0	0	109.3	K377	K377-P379 WeakPolarHBondContact O-CD 3.21Å
380	K	41	Very low	31.6	Very low	188 Å²	188	138.9 Å²	138.9	82%	0.817	75%	0.749	S	S	*	*			trans	-76.6	135.3	170	-73.7	-175.7	177.1	179.7	0	110	I378	I378-K380 HydrophobicContact CG2-CG 4.31Å; I378-K380 PolarHBondContact O-N 3.49Å; I378-K380 VanDerWaalsContact O-N 3.17Å
381	S	27.9	Very low	31.9	Very low	115 Å²	115	137 Å²	137	80%	0.804	74%	0.739	S	S	*	*			trans	-60.1	137.4	-177	-42.1	0	0	0	0	114.1
382	T	36.9	Very low	32.2	Very low	145 Å²	145	139 Å²	139	89%	0.89	74%	0.74	S	S	*	*			trans	-137.3	100.7	150.2	44.3	0	0	0	0	109.8	S384	T382-S384 PolarHBondContact O-N 2.86Å
383	S	28.1	Very low	32.5	Very low	122 Å²	122	137.4 Å²	137.4	85%	0.853	74%	0.735	S	S	*	*			trans	-82	105.7	169.3	52.5	0	0	0	0	110
384	S	30.6	Very low	32.7	Very low	78 Å²	78	141.3 Å²	141.3	55%	0.545	74%	0.743	S	S	.	*			trans	-159.5	108.6	157.8	-172	0	0	0	0	109.8	T382 C387	T382-S384 PolarHBondContact O-N 2.86Å; S384-C387 PolarHBondContact OG-SG 3.45Å
385	S	29.3	Very low	32.9	Very low	120 Å²	120	143.1 Å²	143.1	84%	0.839	75%	0.747	S	S	*	*	S	Bend	trans	-105.1	41.3	177	61.6	0	0	0	0	111.6
386	L	31.4	Very low	33	Very low	136 Å²	136	144 Å²	144	71%	0.712	75%	0.752	S	S	*	*			trans	-145.6	33.8	-177.8	-75.6	-179.5	0	0	0	113.6
387	C	35.5	Very low	33.3	Very low	44 Å²	44	142.7 Å²	142.7	30%	0.297	75%	0.751	S	S	.	*			trans	-128.6	68.4	-174	-58.7	0	0	0	0	113.1	S384 W389 E390	S384-C387 PolarHBondContact OG-SG 3.45Å; C387-W389 PolarHBondContact O-N 2.94Å; C387-E390 HydrophobicContact CB-CB 3.97Å; C387-E390 HydrophobicContact CB-CG 3.78Å; C387-E390 WeakPolarHBondContact CB-OE2 3.35Å; C387-E390 PolarHBondContact SG-OE2 3.19Å
388	W	36.7	Very low	33.3	Very low	225 Å²	225	138 Å²	138	85%	0.852	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	1	171.6	60.5	-94.8	0	0	0	113.7
389	W	39.1	Very low	33.5	Very low	168 Å²	168	138.6 Å²	138.6	64%	0.636	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.5	3.5	-179.2	60	68.2	0	0	0	114.3	C387 P391	C387-W389 PolarHBondContact O-N 2.94Å; W389-P391 WeakPolarHBondContact O-CD 3.34Å
390	E	36.2	Very low	33.8	Very low	122 Å²	122	139.9 Å²	139.9	57%	0.57	74%	0.743	S	S	*	*			trans	-74.8	123.7	177.7	-88.4	-173.7	144	0	0	110.9	C387 L392	C387-E390 HydrophobicContact CB-CB 3.97Å; C387-E390 HydrophobicContact CB-CG 3.78Å; C387-E390 WeakPolarHBondContact CB-OE2 3.35Å; C387-E390 PolarHBondContact SG-OE2 3.19Å; E390-L392 PolarHBondContact O-N 2.93Å
391	P	35.4	Very low	33.3	Very low	98 Å²	98	139.8 Å²	139.8	64%	0.636	75%	0.745	S	S	*	*			trans	-63.9	118.1	172.2	-19.5	32.9	0	0	0	109.9	W389 H393	W389-P391 WeakPolarHBondContact O-CD 3.34Å; P391-H393 VanDerWaalsContact C-N 3.26Å; P391-H393 PolarHBondContact O-N 3.3Å
392	L	36.7	Very low	33.6	Very low	159 Å²	159	139.7 Å²	139.7	83%	0.832	74%	0.744	S	S	*	*			trans	-67.9	82.6	175.7	-69.9	172.1	0	0	0	110.4	E390 H394	E390-L392 PolarHBondContact O-N 2.93Å; L392-H394 PolarHBondContact O-N 3.38Å; L392-H394 PolarHBondContact O-ND1 3.03Å
393	H	34.6	Very low	33.2	Very low	167 Å²	167	143.1 Å²	143.1	77%	0.773	74%	0.743	S	S	*	*			trans	-60.2	101.3	175.3	-80.1	-69.4	0	0	0	110.6	P391 H395	P391-H393 VanDerWaalsContact C-N 3.26Å; P391-H393 PolarHBondContact O-N 3.3Å; H393-H395 PolarHBondContact O-N 3.13Å
394	H	30.9	Very low	33.4	Very low	172 Å²	172	144.8 Å²	144.8	80%	0.796	74%	0.742	S	S	*	*			trans	-55.3	131.5	178.4	-63	-22.1	0	0	0	112.2	L392	L392-H394 PolarHBondContact O-N 3.38Å; L392-H394 PolarHBondContact O-ND1 3.03Å
395	H	32.5	Very low	33.6	Very low	172 Å²	172	147.8 Å²	147.8	80%	0.796	75%	0.752	S	S	*	*			trans	-146.2	136.6	153.8	-79.3	-57.9	0	0	0	112.3	H393	H393-H395 PolarHBondContact O-N 3.13Å
396	N	30.5	Very low	34.1	Very low	152 Å²	152	150.9 Å²	150.9	81%	0.813	75%	0.75	S	S	*	*			trans	94.3	56.9	159.3	-48.5	-37.2	0	0	0	119.7
397	T	34.1	Very low	34.1	Very low	142 Å²	142	149.9 Å²	149.9	87%	0.871	76%	0.755	S	S	*	*			trans	-124.5	129.1	136.4	29.4	0	0	0	0	109.5
398	P	32.3	Very low	34	Very low	103 Å²	103	153.4 Å²	153.4	67%	0.669	77%	0.77	S	S	*	*			trans	-94.2	147.3	-177.3	36.3	-33.3	0	0	0	111.9
399	I	32.2	Very low	34.6	Very low	159 Å²	159	149.9 Å²	149.9	82%	0.815	77%	0.768	S	S	*	*			trans	70	115.6	166.6	-48	144.7	0	0	0	110.6
400	I	38.4	Very low	35.5	Very low	151 Å²	151	147.5 Å²	147.5	77%	0.774	77%	0.773	S	S	*	*				-146.2	158.6	57	-69.8	170.6	0	0	0	110.8
401	E	30.5	Very low	36.2	Very low	185 Å²	185	150.6 Å²	150.6	86%	0.864	79%	0.788	S	S	*	*			trans	-41.6	125.6	171.8	-58.7	157.9	144	0	0	115.8
402	S	34.4	Very low	37.3	Very low	114 Å²	114	149.9 Å²	149.9	80%	0.797	78%	0.784	S	S	*	*			trans	-157.9	128.5	137.7	-164.1	0	0	0	0	110.3
403	Y	28.3	Very low	38.6	Very low	217 Å²	217	146.2 Å²	146.2	85%	0.851	77%	0.765	S	S	*	*			trans	-91.8	146.8	171.9	-91.2	-104	0	0	0	109.5
404	N	31.7	Very low	40.3	Very low	157 Å²	157	142.6 Å²	142.6	84%	0.84	76%	0.756	S	S	*	*			trans	74.3	92.4	-179.6	-48.8	-33.1	0	0	0	115
405	D	35.9	Very low	42.1	Very low	141 Å²	141	141.3 Å²	141.3	75%	0.754	75%	0.75	S	S	*	*				-138.8	141.6	128.3	-145.3	-14.8	0	0	0	110.1	N408	D405-N408 PolarHBondContact OD1-ND2 3.45Å; D405-N408 VanDerWaalsContact OD1-ND2 3.14Å; D405-N408 PolarHBondContact OD2-ND2 2.99Å
406	K	39.2	Very low	43.9	Very low	185 Å²	185	137.5 Å²	137.5	80%	0.804	74%	0.739	S	S	*	*			trans	-76.4	164.4	176.8	-70	173.8	-176.7	170.7	0	108.4	N408	K406-N408 PolarHBondContact O-N 3.01Å
407	S	30.2	Very low	45.7	Very low	115 Å²	115	133.5 Å²	133.5	80%	0.804	72%	0.717	S	S	*	*			trans	-63.8	79.4	-178.6	54.1	0	0	0	0	112.7	L409	S407-L409 VanDerWaalsContact C-N 3.31Å; S407-L409 PolarHBondContact O-N 3.4Å
408	N	34.6	Very low	47.6	Very low	117 Å²	117	134.3 Å²	134.3	63%	0.626	71%	0.709	S	S	*	*			trans	-79.4	83.3	174	-62.4	-27.6	0	0	0	108.1	D405 K406	D405-N408 PolarHBondContact OD1-ND2 3.45Å; D405-N408 VanDerWaalsContact OD1-ND2 3.14Å; D405-N408 PolarHBondContact OD2-ND2 2.99Å; K406-N408 PolarHBondContact O-N 3.01Å
409	L	49.2	Very low	49.5	Very low	152 Å²	152	134.3 Å²	134.3	80%	0.796	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-54.7	140.3	158.6	-80.4	157.2	0	0	0	108	S407 E411	S407-L409 VanDerWaalsContact C-N 3.31Å; S407-L409 PolarHBondContact O-N 3.4Å; L409-E411 PolarHBondContact O-N 2.72Å
410	P	57.2	Low	51.5	Low	117 Å²	117	131.5 Å²	131.5	76%	0.76	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-58.5	130.9	175.5	25.2	-33.4	0	0	0	109.4
411	E	50.9	Low	53.3	Low	188 Å²	188	131.5 Å²	131.5	88%	0.879	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-57.7	126.7	176.9	-125.3	177.4	-171.3	0	0	109	L409 N413	L409-E411 PolarHBondContact O-N 2.72Å; E411-N413 PolarHBondContact O-N 3.14Å
412	P	58.2	Low	55.6	Low	83 Å²	83	128.9 Å²	128.9	54%	0.539	65%	0.654	S	S	.	*	P	Polyproline II helix	trans	-63.2	131	-179.5	24.4	-32.9	0	0	0	109.9	L417	P412-L417 HydrophobicContact CB-CD1 4.45Å; P412-L417 HydrophobicContact CB-CG 4.5Å; P412-L417 HydrophobicContact CG-CD1 3.93Å; P412-L417 HydrophobicContact CG-CG 4.35Å
413	N	65.1	Low	57.6	Low	81 Å²	81	127 Å²	127	43%	0.433	64%	0.635	S	S	.	*	P	Polyproline II helix	trans	-47.6	125.5	-177	174.7	-8.6	0	0	0	110.8	E411 E415 V416 L417	E411-N413 PolarHBondContact O-N 3.14Å; N413-E415 PolarHBondContact O-N 2.85Å; N413-E415 VanDerWaalsContact O-N 3.08Å; N413-E415 WeakPolarHBondContact OD1-CB 3.48Å; N413-E415 PolarHBondContact OD1-N 3.21Å; N413-V416 HydrophobicContact CB-CB 4.46Å; N413-V416 HydrophobicContact CB-CG2 4.02Å; N413-V416 WeakPolarHBondContact O-CB 3.38Å; N413-V416 PolarHBondContact O-N 3.13Å; N413-L417 PolarHBondContact O-N 3.03Å; N413-L417 VanDerWaalsContact O-N 3.14Å
414	P	70.1	Confident	60	Low	92 Å²	92	119.3 Å²	119.3	60%	0.597	61%	0.612	S	S	*	*	H	α-helix	trans	-58.6	-24.1	-177.1	23	-34.9	0	0	0	113.8	K418	P414-K418 WeakPolarHBondContact O-CB 3.24Å; P414-K418 WeakPolarHBondContact O-CG 3.45Å; P414-K418 PolarHBondContact O-N 2.87Å
415	E	68.9	Low	62.2	Low	144 Å²	144	115.2 Å²	115.2	67%	0.673	60%	0.595	S	S	*	*	H	α-helix	trans	-70.5	-38.9	173	-62	-166.2	153.4	0	0	112.6	N413 K418 H419	N413-E415 PolarHBondContact O-N 2.85Å; N413-E415 VanDerWaalsContact O-N 3.08Å; N413-E415 WeakPolarHBondContact OD1-CB 3.48Å; N413-E415 PolarHBondContact OD1-N 3.21Å; E415-K418 PolarHBondContact O-N 3.12Å; E415-H419 WeakPolarHBondContact O-CB 3.37Å; E415-H419 PolarHBondContact O-N 3.01Å
416	V	69.2	Low	64.4	Low	92 Å²	92	111.1 Å²	111.1	56%	0.558	57%	0.572	S	S	*	*	H	α-helix	trans	-67.4	-39.6	176.1	179.7	0	0	0	0	110.1	N413 H419 Y420	N413-V416 HydrophobicContact CB-CB 4.46Å; N413-V416 HydrophobicContact CB-CG2 4.02Å; N413-V416 WeakPolarHBondContact O-CB 3.38Å; N413-V416 PolarHBondContact O-N 3.13Å; V416-H419 PolarHBondContact O-N 3.01Å; V416-Y420 WeakPolarHBondContact O-CB 3.45Å; V416-Y420 PolarHBondContact O-N 3Å
417	L	70.2	Confident	66.4	Low	69 Å²	69	106.4 Å²	106.4	36%	0.361	55%	0.553	S	S	.	*	H	α-helix	trans	-62.3	-47.4	171.5	-84.4	167.5	0	0	0	112	P412 N413 H419 Y420 Y421	P412-L417 HydrophobicContact CB-CD1 4.45Å; P412-L417 HydrophobicContact CB-CG 4.5Å; P412-L417 HydrophobicContact CG-CD1 3.93Å; P412-L417 HydrophobicContact CG-CG 4.35Å; N413-L417 PolarHBondContact O-N 3.03Å; N413-L417 VanDerWaalsContact O-N 3.14Å; L417-H419 VanDerWaalsContact C-N 3.32Å; L417-H419 PolarHBondContact O-N 3.43Å; L417-Y420 PolarHBondContact O-N 3.34Å; L417-Y421 HydrophobicContact CD2-CE2 4.12Å; L417-Y421 WeakPolarHBondContact O-CD2 3.21Å; L417-Y421 PolarHBondContact O-N 2.9Å
418	K	73	Confident	68.8	Low	159 Å²	159	104.9 Å²	104.9	69%	0.691	54%	0.54	S	S	*	.	H	α-helix	trans	-58.1	-43.7	175.2	-81.3	178.4	177.3	178.9	0	112	P414 E415 Y421 Y422	P414-K418 WeakPolarHBondContact O-CB 3.24Å; P414-K418 WeakPolarHBondContact O-CG 3.45Å; P414-K418 PolarHBondContact O-N 2.87Å; E415-K418 PolarHBondContact O-N 3.12Å; K418-Y421 PolarHBondContact O-N 3.43Å; K418-Y422 WeakPolarHBondContact O-CB 3.26Å; K418-Y422 PolarHBondContact O-N 2.85Å
419	H	72	Confident	71.1	Confident	103 Å²	103	103.5 Å²	103.5	48%	0.477	53%	0.532	S	S	.	.	H	α-helix	trans	-66.1	-41.1	177.7	-170.8	70.8	0	0	0	112	E415 V416 L417 Y422 L423	E415-H419 WeakPolarHBondContact O-CB 3.37Å; E415-H419 PolarHBondContact O-N 3.01Å; V416-H419 PolarHBondContact O-N 3.01Å; L417-H419 VanDerWaalsContact C-N 3.32Å; L417-H419 PolarHBondContact O-N 3.43Å; H419-Y422 WeakPolarHBondContact O-CB 3.43Å; H419-Y422 PolarHBondContact O-N 3.15Å; H419-L423 WeakPolarHBondContact O-CG 3.35Å; H419-L423 PolarHBondContact O-N 3.47Å
420	Y	74.1	Confident	72.5	Confident	99 Å²	99	100.5 Å²	100.5	39%	0.388	51%	0.512	S	S	.	.	H	α-helix	trans	-60.6	-49.4	174.3	180	-99.7	0	0	0	112	V416 L417 Y422 L423 C424	V416-Y420 WeakPolarHBondContact O-CB 3.45Å; V416-Y420 PolarHBondContact O-N 3Å; L417-Y420 PolarHBondContact O-N 3.34Å; Y420-Y422 VanDerWaalsContact C-N 3.3Å; Y420-Y422 PolarHBondContact O-N 3.25Å; Y420-L423 PolarHBondContact O-N 2.88Å; Y420-C424 PolarHBondContact O-N 3.43Å; Y420-C424 PolarHBondContact O-SG 2.87Å; Y420-C424 VanDerWaalsContact O-SG 3.32Å
421	Y	76.6	Confident	73.7	Confident	151 Å²	151	99.7 Å²	99.7	59%	0.592	50%	0.498	S	S	*	.	H	α-helix	trans	-62.4	-35.3	175.8	-76.1	-61.8	0	0	0	112.8	L417 K418 S425	L417-Y421 HydrophobicContact CD2-CE2 4.12Å; L417-Y421 WeakPolarHBondContact O-CD2 3.21Å; L417-Y421 PolarHBondContact O-N 2.9Å; K418-Y421 PolarHBondContact O-N 3.43Å; Y421-S425 WeakPolarHBondContact O-CB 3.28Å; Y421-S425 PolarHBondContact O-N 2.9Å; Y421-S425 PolarHBondContact O-OG 3.12Å
422	Y	78.5	Confident	75.4	Confident	131 Å²	131	93.7 Å²	93.7	51%	0.514	48%	0.48	S	S	.	.	H	α-helix	trans	-63.6	-47	172.1	176.4	-96.8	0	0	0	111.9	K418 H419 Y420 C424 S425 Q426	K418-Y422 WeakPolarHBondContact O-CB 3.26Å; K418-Y422 PolarHBondContact O-N 2.85Å; H419-Y422 WeakPolarHBondContact O-CB 3.43Å; H419-Y422 PolarHBondContact O-N 3.15Å; Y420-Y422 VanDerWaalsContact C-N 3.3Å; Y420-Y422 PolarHBondContact O-N 3.25Å; Y422-C424 PolarHBondContact O-N 2.68Å; Y422-S425 PolarHBondContact O-N 3.4Å; Y422-S425 PolarHBondContact O-OG 3.14Å; Y422-Q426 HydrophobicContact CD1-CG 4.38Å; Y422-Q426 HydrophobicContact CD2-CG 4.47Å; Y422-Q426 HydrophobicContact CE1-CG 3.99Å; Y422-Q426 HydrophobicContact CE2-CG 4.1Å; Y422-Q426 VanDerWaalsContact O-CG 3.3Å; Y422-Q426 WeakPolarHBondContact O-CG 3.45Å; Y422-Q426 PolarHBondContact O-N 3.38Å
423	L	77.4	Confident	76.6	Confident	75 Å²	75	94.2 Å²	94.2	39%	0.393	48%	0.479	S	S	.	.	H	α-helix	trans	-61.3	-43.3	176.6	-71.1	175.2	0	0	0	111.9	H419 Y420 S425 Q426 Q427	H419-L423 WeakPolarHBondContact O-CG 3.35Å; H419-L423 PolarHBondContact O-N 3.47Å; Y420-L423 PolarHBondContact O-N 2.88Å; L423-S425 PolarHBondContact O-N 3.45Å; L423-Q426 PolarHBondContact O-N 2.91Å; L423-Q427 PolarHBondContact O-N 3.05Å; L423-Q427 VanDerWaalsContact O-N 3.12Å
424	C	78.3	Confident	77.6	Confident	54 Å²	54	95.5 Å²	95.5	37%	0.365	49%	0.485	S	S	.	.	H	α-helix	trans	-62.2	-39.3	176	-68	0	0	0	0	112.6	Y420 Y422 Q426 Q427 P428	Y420-C424 PolarHBondContact O-N 3.43Å; Y420-C424 PolarHBondContact O-SG 2.87Å; Y420-C424 VanDerWaalsContact O-SG 3.32Å; Y422-C424 PolarHBondContact O-N 2.68Å; C424-Q426 VanDerWaalsContact C-N 3.35Å; C424-Q427 PolarHBondContact O-N 2.75Å; C424-P428 VanDerWaalsContact O-CD 3.3Å; C424-P428 WeakPolarHBondContact O-CD 3.42Å
425	S	78	Confident	78.4	Confident	71 Å²	71	96.2 Å²	96.2	50%	0.497	48%	0.482	S	S	.	.	H	α-helix	trans	-71.4	-28.4	177.9	70.1	0	0	0	0	113.4	Y421 Y422 L423	Y421-S425 WeakPolarHBondContact O-CB 3.28Å; Y421-S425 PolarHBondContact O-N 2.9Å; Y421-S425 PolarHBondContact O-OG 3.12Å; Y422-S425 PolarHBondContact O-N 3.4Å; Y422-S425 PolarHBondContact O-OG 3.14Å; L423-S425 PolarHBondContact O-N 3.45Å
426	Q	81.8	Confident	79.4	Confident	55 Å²	55	96 Å²	96	26%	0.257	48%	0.479	S	S	.	.	H	α-helix	trans	-80.1	-22.2	176.3	-66.8	-64.9	-17.3	0	0	113.6	Y422 L423 C424 I429 K430	Y422-Q426 HydrophobicContact CD1-CG 4.38Å; Y422-Q426 HydrophobicContact CD2-CG 4.47Å; Y422-Q426 HydrophobicContact CE1-CG 3.99Å; Y422-Q426 HydrophobicContact CE2-CG 4.1Å; Y422-Q426 VanDerWaalsContact O-CG 3.3Å; Y422-Q426 WeakPolarHBondContact O-CG 3.45Å; Y422-Q426 PolarHBondContact O-N 3.38Å; L423-Q426 PolarHBondContact O-N 2.91Å; C424-Q426 VanDerWaalsContact C-N 3.35Å; Q426-I429 PolarHBondContact O-N 3.06Å; Q426-K430 PolarHBondContact O-N 2.87Å
427	Q	80.4	Confident	80.3	Confident	87 Å²	87	94.2 Å²	94.2	41%	0.407	47%	0.473	S	S	.	.	H	α-helix	trans	-61.7	-46.1	-173.4	-178.6	161.2	-12.2	0	0	113.9	L423 C424 I429 K430 E431	L423-Q427 PolarHBondContact O-N 3.05Å; L423-Q427 VanDerWaalsContact O-N 3.12Å; C424-Q427 PolarHBondContact O-N 2.75Å; Q427-I429 PolarHBondContact O-N 3.44Å; Q427-K430 PolarHBondContact O-N 3.24Å; Q427-E431 HydrophobicContact CG-CG 4.37Å; Q427-E431 VanDerWaalsContact CG-OE1 3.3Å; Q427-E431 WeakPolarHBondContact CG-OE1 3.35Å; Q427-E431 PolarHBondContact NE2-OE1 3.23Å; Q427-E431 WeakPolarHBondContact O-CG 3.47Å; Q427-E431 PolarHBondContact O-N 3.05Å
428	P	81.2	Confident	81.1	Confident	83 Å²	83	94.9 Å²	94.9	54%	0.539	48%	0.477	S	S	.	.	H	α-helix	trans	-59.8	-33.6	175.2	-24.7	34.9	0	0	0	113.4	C424 A432	C424-P428 VanDerWaalsContact O-CD 3.3Å; C424-P428 WeakPolarHBondContact O-CD 3.42Å; P428-A432 VanDerWaalsContact O-CB 3.3Å; P428-A432 WeakPolarHBondContact O-CB 3.43Å; P428-A432 PolarHBondContact O-N 3.49Å
429	I	82.8	Confident	81.9	Confident	88 Å²	88	91.2 Å²	91.2	45%	0.451	46%	0.464	S	S	.	.	H	α-helix	trans	-70.8	-43.7	178	-58.2	171.7	0	0	0	110.2	Q426 Q427 A432 N433	Q426-I429 PolarHBondContact O-N 3.06Å; Q427-I429 PolarHBondContact O-N 3.44Å; I429-A432 PolarHBondContact O-N 3.38Å; I429-N433 WeakPolarHBondContact O-CB 3.48Å; I429-N433 PolarHBondContact O-N 2.86Å; I429-N433 PolarHBondContact O-ND2 3.37Å
430	K	79.7	Confident	82.7	Confident	89 Å²	89	92.4 Å²	92.4	39%	0.387	47%	0.47	S	S	.	.	H	α-helix	trans	-61.8	-42.5	174.6	-71.3	-177.1	175	-171.8	0	111.2	D145 Q426 Q427 L434	D145-K430 IonicContact OD2-NZ 2.65Å; D145-K430 PolarHBondContact OD2-NZ 3.07Å; Q426-K430 PolarHBondContact O-N 2.87Å; Q427-K430 PolarHBondContact O-N 3.24Å; K430-L434 PolarHBondContact O-N 2.89Å
431	E	81.7	Confident	83.4	Confident	100 Å²	100	90.6 Å²	90.6	47%	0.467	48%	0.476	S	S	.	.	H	α-helix	trans	-67.6	-42.1	177.5	-72.1	177.9	-165	0	0	112.8	Q427 N433 L434 M435	Q427-E431 HydrophobicContact CG-CG 4.37Å; Q427-E431 VanDerWaalsContact CG-OE1 3.3Å; Q427-E431 WeakPolarHBondContact CG-OE1 3.35Å; Q427-E431 PolarHBondContact NE2-OE1 3.23Å; Q427-E431 WeakPolarHBondContact O-CG 3.47Å; Q427-E431 PolarHBondContact O-N 3.05Å; E431-N433 PolarHBondContact O-N 3.42Å; E431-L434 PolarHBondContact O-N 2.98Å; E431-M435 PolarHBondContact O-N 3.24Å
432	A	86	Confident	84	Confident	61 Å²	61	88 Å²	88	50%	0.504	47%	0.469	S	S	.	.	H	α-helix	trans	-63	-41.6	175.6	0	0	0	0	0	112.5	P428 I429 M435 K436	P428-A432 VanDerWaalsContact O-CB 3.3Å; P428-A432 WeakPolarHBondContact O-CB 3.43Å; P428-A432 PolarHBondContact O-N 3.49Å; I429-A432 PolarHBondContact O-N 3.38Å; A432-M435 PolarHBondContact O-N 3.49Å; A432-K436 PolarHBondContact O-N 3.49Å
433	N	84.6	Confident	84.5	Confident	95 Å²	95	87.3 Å²	87.3	51%	0.508	47%	0.473	S	S	.	.	H	α-helix	trans	-65.4	-38.8	175.8	-75	-26.9	0	0	0	112.2	I429 E431 K436 A437	I429-N433 WeakPolarHBondContact O-CB 3.48Å; I429-N433 PolarHBondContact O-N 2.86Å; I429-N433 PolarHBondContact O-ND2 3.37Å; E431-N433 PolarHBondContact O-N 3.42Å; N433-K436 PolarHBondContact O-N 2.97Å; N433-A437 PolarHBondContact O-N 3.25Å
434	L	86	Confident	85.2	Confident	107 Å²	107	88.7 Å²	88.7	56%	0.56	48%	0.478	S	S	*	.	H	α-helix	trans	-63.8	-45.8	174.8	179.9	61.1	0	0	0	111.7	K430 E431 K436 A437 I438	K430-L434 PolarHBondContact O-N 2.89Å; E431-L434 PolarHBondContact O-N 2.98Å; L434-K436 VanDerWaalsContact C-N 3.31Å; L434-K436 PolarHBondContact O-N 3.38Å; L434-A437 PolarHBondContact O-N 3.49Å; L434-I438 HydrophobicContact CD1-CD1 4.17Å; L434-I438 HydrophobicContact CD1-CG1 4.41Å; L434-I438 HydrophobicContact CG-CD1 3.99Å; L434-I438 WeakPolarHBondContact O-CG1 3.49Å; L434-I438 PolarHBondContact O-N 2.94Å
435	M	85.3	Confident	85.6	Confident	107 Å²	107	88.9 Å²	88.9	53%	0.527	48%	0.483	S	S	.	.	H	α-helix	trans	-61.6	-38.3	176	-75.5	-60.6	-60.3	0	0	112.4	E431 A432 I438 N439	E431-M435 PolarHBondContact O-N 3.24Å; A432-M435 PolarHBondContact O-N 3.49Å; M435-I438 PolarHBondContact O-N 3.09Å; M435-N439 VanDerWaalsContact O-CG 3.28Å; M435-N439 PolarHBondContact O-N 2.93Å; M435-N439 PolarHBondContact O-ND2 3.46Å
436	K	91.2	Very high	86.2	Confident	140 Å²	140	91 Å²	91	61%	0.609	48%	0.483	S	S	*	.	H	α-helix	trans	-61.6	-46.8	173.7	-174.1	-178.4	174.6	-172.9	0	111.6	A432 N433 L434 I438 N439 E440	A432-K436 PolarHBondContact O-N 3.49Å; N433-K436 PolarHBondContact O-N 2.97Å; L434-K436 VanDerWaalsContact C-N 3.31Å; L434-K436 PolarHBondContact O-N 3.38Å; K436-I438 PolarHBondContact O-N 3.11Å; K436-N439 PolarHBondContact O-N 3.35Å; K436-E440 WeakPolarHBondContact O-CB 3.48Å; K436-E440 PolarHBondContact O-N 3.2Å
437	A	87.4	Confident	86.5	Confident	54 Å²	54	95.5 Å²	95.5	45%	0.446	50%	0.499	S	S	.	.	H	α-helix	trans	-64.1	-37.8	178.9	0	0	0	0	0	112.9	N433 L434 E440 A441	N433-A437 PolarHBondContact O-N 3.25Å; L434-A437 PolarHBondContact O-N 3.49Å; A437-E440 PolarHBondContact O-N 3.47Å; A437-A441 WeakPolarHBondContact O-CB 3.4Å; A437-A441 PolarHBondContact O-N 3.43Å
438	I	87.2	Confident	86.9	Confident	84 Å²	84	95.7 Å²	95.7	43%	0.431	50%	0.503	S	S	.	.	H	α-helix	trans	-64	-46.8	174.8	-69.2	167	0	0	0	110.7	L434 M435 K436 E440 A441 E442	L434-I438 HydrophobicContact CD1-CD1 4.17Å; L434-I438 HydrophobicContact CD1-CG1 4.41Å; L434-I438 HydrophobicContact CG-CD1 3.99Å; L434-I438 WeakPolarHBondContact O-CG1 3.49Å; L434-I438 PolarHBondContact O-N 2.94Å; M435-I438 PolarHBondContact O-N 3.09Å; K436-I438 PolarHBondContact O-N 3.11Å; I438-E440 VanDerWaalsContact C-N 3.35Å; I438-E440 PolarHBondContact O-N 2.89Å; I438-A441 PolarHBondContact O-N 3.21Å; I438-E442 PolarHBondContact O-N 2.99Å
439	N	88.9	Confident	87.4	Confident	81 Å²	81	97.8 Å²	97.8	43%	0.433	50%	0.504	S	S	.	.	H	α-helix	trans	-62.6	-40.5	178.4	-71.2	-15.2	0	0	0	112.2	M435 K436 E442 I443	M435-N439 VanDerWaalsContact O-CG 3.28Å; M435-N439 PolarHBondContact O-N 2.93Å; M435-N439 PolarHBondContact O-ND2 3.46Å; K436-N439 PolarHBondContact O-N 3.35Å; N439-E442 PolarHBondContact O-N 3.02Å; N439-I443 WeakPolarHBondContact O-CG1 3.4Å; N439-I443 PolarHBondContact O-N 3.38Å
440	E	89.5	Confident	87.7	Confident	128 Å²	128	97.9 Å²	97.9	60%	0.598	50%	0.504	S	S	*	.	H	α-helix	trans	-64.5	-44.7	176.4	-172	171.7	170.1	0	0	111.6	K436 A437 I438 E442 I443 Q444	K436-E440 WeakPolarHBondContact O-CB 3.48Å; K436-E440 PolarHBondContact O-N 3.2Å; A437-E440 PolarHBondContact O-N 3.47Å; I438-E440 VanDerWaalsContact C-N 3.35Å; I438-E440 PolarHBondContact O-N 2.89Å; E440-E442 VanDerWaalsContact C-N 3.33Å; E440-E442 PolarHBondContact O-N 2.92Å; E440-I443 PolarHBondContact O-N 3.31Å; E440-Q444 PolarHBondContact O-N 2.89Å
441	A	88.6	Confident	88.1	Confident	62 Å²	62	95.6 Å²	95.6	51%	0.512	50%	0.501	S	S	.	.	H	α-helix	trans	-62.4	-36.8	174.2	0	0	0	0	0	112.7	A437 I438 Q444 A445	A437-A441 WeakPolarHBondContact O-CB 3.4Å; A437-A441 PolarHBondContact O-N 3.43Å; I438-A441 PolarHBondContact O-N 3.21Å; A441-Q444 PolarHBondContact O-N 3.48Å; A441-A445 WeakPolarHBondContact O-CB 3.29Å; A441-A445 PolarHBondContact O-N 2.97Å
442	E	90.5	Very high	88.5	Confident	97 Å²	97	95.7 Å²	95.7	45%	0.453	50%	0.502	S	S	.	.	H	α-helix	trans	-67.6	-40.4	176.3	-161.7	-166.7	149.9	0	0	112.1	I438 N439 E440 A445 K446	I438-E442 PolarHBondContact O-N 2.99Å; N439-E442 PolarHBondContact O-N 3.02Å; E440-E442 VanDerWaalsContact C-N 3.33Å; E440-E442 PolarHBondContact O-N 2.92Å; E442-A445 PolarHBondContact O-N 3.15Å; E442-K446 WeakPolarHBondContact O-CG 3.5Å; E442-K446 PolarHBondContact O-N 2.88Å; E442-K446 WeakPolarHBondContact OE1-CE 3.41Å; E442-K446 IonicContact OE1-NZ 3.68Å; E442-K446 PolarHBondContact OE1-NZ 2.92Å
443	I	88.8	Confident	88.5	Confident	115 Å²	115	99.3 Å²	99.3	59%	0.59	50%	0.504	S	S	*	.	H	α-helix	trans	-62.5	-46.3	174	-68.8	165	0	0	0	110.2	N439 E440 A445 K446 Y447	N439-I443 WeakPolarHBondContact O-CG1 3.4Å; N439-I443 PolarHBondContact O-N 3.38Å; E440-I443 PolarHBondContact O-N 3.31Å; I443-A445 PolarHBondContact O-N 3.01Å; I443-K446 PolarHBondContact O-N 3.05Å; I443-Y447 PolarHBondContact O-N 3.44Å
444	Q	91.1	Very high	88.5	Confident	105 Å²	105	100 Å²	100	49%	0.491	50%	0.504	S	S	.	.	H	α-helix	trans	-63.9	-39.9	178.5	-167.9	66.5	2.5	0	0	112.1	E440 A441 K446 Y447 N448	E440-Q444 PolarHBondContact O-N 2.89Å; A441-Q444 PolarHBondContact O-N 3.48Å; Q444-K446 PolarHBondContact O-N 3.35Å; Q444-Y447 PolarHBondContact O-N 3.12Å; Q444-N448 WeakPolarHBondContact O-CB 3.41Å; Q444-N448 VanDerWaalsContact O-CG 3.28Å; Q444-N448 PolarHBondContact O-N 2.92Å
445	A	87.5	Confident	88.6	Confident	58 Å²	58	100.7 Å²	100.7	48%	0.479	50%	0.5	S	S	.	.	H	α-helix	trans	-63.5	-39.3	175	0	0	0	0	0	112.4	A441 E442 I443 K449	A441-A445 WeakPolarHBondContact O-CB 3.29Å; A441-A445 PolarHBondContact O-N 2.97Å; E442-A445 PolarHBondContact O-N 3.15Å; I443-A445 PolarHBondContact O-N 3.01Å; A445-K449 WeakPolarHBondContact O-CB 3.33Å; A445-K449 PolarHBondContact O-N 3.47Å
446	K	90.5	Very high	88.7	Confident	115 Å²	115	98.9 Å²	98.9	50%	0.5	49%	0.492	S	S	.	.	H	α-helix	trans	-64.1	-43.8	173.8	-73.4	168.2	-175.2	167.3	0	111.6	E442 I443 Q444 K449 I450	E442-K446 WeakPolarHBondContact O-CG 3.5Å; E442-K446 PolarHBondContact O-N 2.88Å; E442-K446 WeakPolarHBondContact OE1-CE 3.41Å; E442-K446 IonicContact OE1-NZ 3.68Å; E442-K446 PolarHBondContact OE1-NZ 2.92Å; I443-K446 PolarHBondContact O-N 3.05Å; Q444-K446 PolarHBondContact O-N 3.35Å; K446-K449 PolarHBondContact O-N 2.96Å; K446-I450 WeakPolarHBondContact O-CG1 3.42Å; K446-I450 PolarHBondContact O-N 2.86Å; K446-I450 VanDerWaalsContact O-N 3.12Å
447	Y	88.7	Confident	88.4	Confident	150 Å²	150	101 Å²	101	59%	0.588	50%	0.496	S	S	*	.	H	α-helix	trans	-62.1	-49.5	176.3	-177.4	-97.6	0	0	0	112	I443 Q444 K449 I450 A451	I443-Y447 PolarHBondContact O-N 3.44Å; Q444-Y447 PolarHBondContact O-N 3.12Å; Y447-K449 VanDerWaalsContact C-N 3.28Å; Y447-K449 PolarHBondContact O-N 3.48Å; Y447-I450 PolarHBondContact O-N 2.82Å; Y447-I450 VanDerWaalsContact O-N 3.09Å; Y447-A451 PolarHBondContact O-N 3.41Å
448	N	88.4	Confident	88.3	Confident	91 Å²	91	104.6 Å²	104.6	49%	0.487	50%	0.503	S	S	.	.	H	α-helix	trans	-58.7	-38.9	177.6	-72.2	-7	0	0	0	112.2	Q444 A451 H452	Q444-N448 WeakPolarHBondContact O-CB 3.41Å; Q444-N448 VanDerWaalsContact O-CG 3.28Å; Q444-N448 PolarHBondContact O-N 2.92Å; N448-A451 PolarHBondContact O-N 3.43Å; N448-H452 WeakPolarHBondContact O-CB 3.4Å; N448-H452 PolarHBondContact O-N 3.05Å
449	K	90.8	Very high	88.2	Confident	127 Å²	127	103 Å²	103	55%	0.552	49%	0.493	S	S	*	.	H	α-helix	trans	-63.8	-40.8	175.5	-177.1	171.2	179.7	174.4	0	112.3	A445 K446 Y447 Y453	A445-K449 WeakPolarHBondContact O-CB 3.33Å; A445-K449 PolarHBondContact O-N 3.47Å; K446-K449 PolarHBondContact O-N 2.96Å; Y447-K449 VanDerWaalsContact C-N 3.28Å; Y447-K449 PolarHBondContact O-N 3.48Å; K449-Y453 HydrophobicContact CD-CE2 4.28Å; K449-Y453 HydrophobicContact CG-CD2 4.14Å; K449-Y453 HydrophobicContact CG-CE2 3.65Å; K449-Y453 WeakPolarHBondContact O-CD2 3.21Å; K449-Y453 PolarHBondContact O-N 3.02Å
450	I	89.4	Confident	87.7	Confident	89 Å²	89	102.1 Å²	102.1	46%	0.456	49%	0.493	S	S	.	.	H	α-helix	trans	-65.8	-48.6	175.5	-66.8	166.1	0	0	0	110.3	K446 Y447 H452 Y453 E454	K446-I450 WeakPolarHBondContact O-CG1 3.42Å; K446-I450 PolarHBondContact O-N 2.86Å; K446-I450 VanDerWaalsContact O-N 3.12Å; Y447-I450 PolarHBondContact O-N 2.82Å; Y447-I450 VanDerWaalsContact O-N 3.09Å; I450-H452 VanDerWaalsContact C-N 3.28Å; I450-H452 PolarHBondContact O-N 3.11Å; I450-Y453 PolarHBondContact O-N 2.85Å; I450-Y453 VanDerWaalsContact O-N 3.1Å; I450-E454 PolarHBondContact O-N 3.23Å
451	A	87.3	Confident	87.3	Confident	41 Å²	41	101.5 Å²	101.5	34%	0.339	49%	0.494	S	S	.	.	H	α-helix	trans	-58.3	-38.9	178.6	0	0	0	0	0	112.6	Y447 N448 E454 Y455	Y447-A451 PolarHBondContact O-N 3.41Å; N448-A451 PolarHBondContact O-N 3.43Å; A451-E454 PolarHBondContact O-N 3.01Å; A451-Y455 WeakPolarHBondContact O-CB 3.44Å; A451-Y455 PolarHBondContact O-N 3.46Å
452	H	91	Very high	86.8	Confident	103 Å²	103	104.6 Å²	104.6	48%	0.477	50%	0.497	S	S	.	.	H	α-helix	trans	-63.4	-43.1	174.5	-179.4	69.5	0	0	0	112.6	N448 I450 Y455 L456	N448-H452 WeakPolarHBondContact O-CB 3.4Å; N448-H452 PolarHBondContact O-N 3.05Å; I450-H452 VanDerWaalsContact C-N 3.28Å; I450-H452 PolarHBondContact O-N 3.11Å; H452-Y455 PolarHBondContact O-N 3.43Å; H452-L456 WeakPolarHBondContact O-CG 3.47Å; H452-L456 PolarHBondContact O-N 3.26Å
453	Y	86.2	Confident	86.1	Confident	137 Å²	137	105.1 Å²	105.1	54%	0.537	50%	0.5	S	S	.	.	H	α-helix	trans	-67.8	-33	174.9	-71.3	-54.9	0	0	0	113.3	K449 I450 L456 R457	K449-Y453 HydrophobicContact CD-CE2 4.28Å; K449-Y453 HydrophobicContact CG-CD2 4.14Å; K449-Y453 HydrophobicContact CG-CE2 3.65Å; K449-Y453 WeakPolarHBondContact O-CD2 3.21Å; K449-Y453 PolarHBondContact O-N 3.02Å; I450-Y453 PolarHBondContact O-N 2.85Å; I450-Y453 VanDerWaalsContact O-N 3.1Å; Y453-L456 HydrophobicContact CD1-CD1 4.45Å; Y453-R457 WeakPolarHBondContact O-CB 3.35Å; Y453-R457 PolarHBondContact O-N 2.86Å
454	E	83.8	Confident	85.4	Confident	109 Å²	109	104.7 Å²	104.7	51%	0.509	50%	0.495	S	S	.	.	H	α-helix	trans	-67	-42.5	172.2	-69.4	-158.3	153.9	0	0	111.9	I450 A451 R457 Q458	I450-E454 PolarHBondContact O-N 3.23Å; A451-E454 PolarHBondContact O-N 3.01Å; E454-R457 WeakPolarHBondContact O-CB 3.34Å; E454-R457 PolarHBondContact O-N 2.83Å; E454-Q458 WeakPolarHBondContact O-CG 3.3Å; E454-Q458 PolarHBondContact O-N 3.49Å
455	Y	89.4	Confident	84.5	Confident	122 Å²	122	104.5 Å²	104.5	48%	0.478	49%	0.494	S	S	.	.	H	α-helix	trans	-57.7	-49.1	173.5	173.6	-98.3	0	0	0	111.8	A451 H452 R457 Q458 K459	A451-Y455 WeakPolarHBondContact O-CB 3.44Å; A451-Y455 PolarHBondContact O-N 3.46Å; H452-Y455 PolarHBondContact O-N 3.43Å; Y455-R457 VanDerWaalsContact C-N 3.31Å; Y455-R457 PolarHBondContact O-N 3.03Å; Y455-Q458 PolarHBondContact O-N 3.1Å; Y455-K459 HydrophobicContact CE1-CD 4.13Å; Y455-K459 WeakPolarHBondContact O-CB 3.36Å; Y455-K459 PolarHBondContact O-N 3.18Å
456	L	87.3	Confident	83.7	Confident	68 Å²	68	106.2 Å²	106.2	36%	0.356	49%	0.492	S	S	.	.	H	α-helix	trans	-60.2	-39.8	176.3	-71	176.3	0	0	0	112.2	H452 Y453 K459 S460	H452-L456 WeakPolarHBondContact O-CG 3.47Å; H452-L456 PolarHBondContact O-N 3.26Å; Y453-L456 HydrophobicContact CD1-CD1 4.45Å; L456-K459 PolarHBondContact O-N 2.77Å; L456-S460 WeakPolarHBondContact O-CB 3.31Å; L456-S460 PolarHBondContact O-N 3.31Å
457	R	85.2	Confident	82.4	Confident	185 Å²	185	106.1 Å²	106.1	70%	0.698	49%	0.494	S	S	*	.	H	α-helix	trans	-62.7	-43.2	175.4	-172	-174.3	-63.6	-121.4	2.3	111.7	Y453 E454 Y455 L461	Y453-R457 WeakPolarHBondContact O-CB 3.35Å; Y453-R457 PolarHBondContact O-N 2.86Å; E454-R457 WeakPolarHBondContact O-CB 3.34Å; E454-R457 PolarHBondContact O-N 2.83Å; Y455-R457 VanDerWaalsContact C-N 3.31Å; Y455-R457 PolarHBondContact O-N 3.03Å; R457-L461 HydrophobicContact CG-CD1 4.38Å; R457-L461 WeakPolarHBondContact O-CG 3.42Å; R457-L461 PolarHBondContact O-N 3.47Å
458	Q	83.6	Confident	81	Confident	129 Å²	129	104 Å²	104	60%	0.603	49%	0.489	S	S	*	.	H	α-helix	trans	-65.8	-43	175.7	-69.5	-178.5	19.2	0	0	111.9	E454 Y455 S460 L461 Q462	E454-Q458 WeakPolarHBondContact O-CG 3.3Å; E454-Q458 PolarHBondContact O-N 3.49Å; Y455-Q458 PolarHBondContact O-N 3.1Å; Q458-S460 PolarHBondContact O-N 3.03Å; Q458-L461 PolarHBondContact O-N 3.4Å; Q458-Q462 WeakPolarHBondContact O-CB 3.41Å; Q458-Q462 PolarHBondContact O-N 3.3Å
459	K	84.9	Confident	79.9	Confident	51 Å²	51	104.7 Å²	104.7	22%	0.222	49%	0.488	C	S	.	.	H	α-helix	trans	-60.7	-44.8	176.7	-166.5	178.5	-173.8	-179.2	0	111.6	E20 Y455 L456 Q462 Q463	E20-K459 IonicContact OE1-NZ 3.71Å; E20-K459 PolarHBondContact OE1-NZ 3.31Å; E20-K459 IonicContact OE2-NZ 3.38Å; E20-K459 PolarHBondContact OE2-NZ 2.78Å; Y455-K459 HydrophobicContact CE1-CD 4.13Å; Y455-K459 WeakPolarHBondContact O-CB 3.36Å; Y455-K459 PolarHBondContact O-N 3.18Å; L456-K459 PolarHBondContact O-N 2.77Å; K459-Q462 PolarHBondContact O-N 2.92Å; K459-Q463 WeakPolarHBondContact O-CG 3.23Å; K459-Q463 PolarHBondContact O-N 2.85Å
460	S	79.6	Confident	78.3	Confident	62 Å²	62	106 Å²	106	43%	0.434	49%	0.489	S	S	.	.	H	α-helix	trans	-62	-45.5	175.5	-176.2	0	0	0	0	112.5	L456 Q458 Q462 Q463 Q464	L456-S460 WeakPolarHBondContact O-CB 3.31Å; L456-S460 PolarHBondContact O-N 3.31Å; Q458-S460 PolarHBondContact O-N 3.03Å; S460-Q462 VanDerWaalsContact C-N 3.29Å; S460-Q462 PolarHBondContact O-N 3.34Å; S460-Q463 PolarHBondContact O-N 3.48Å; S460-Q464 WeakPolarHBondContact O-CB 3.3Å; S460-Q464 WeakPolarHBondContact O-CG 3.36Å; S460-Q464 PolarHBondContact O-N 2.91Å
461	L	80.3	Confident	76.8	Confident	115 Å²	115	105.8 Å²	105.8	60%	0.602	49%	0.488	S	S	*	.	H	α-helix	trans	-59.4	-38.8	173.8	-78.6	163.8	0	0	0	112.2	R457 Q458 H465	R457-L461 HydrophobicContact CG-CD1 4.38Å; R457-L461 WeakPolarHBondContact O-CG 3.42Å; R457-L461 PolarHBondContact O-N 3.47Å; Q458-L461 PolarHBondContact O-N 3.4Å; L461-H465 WeakPolarHBondContact O-CB 3.5Å; L461-H465 PolarHBondContact O-N 2.9Å
462	Q	79	Confident	74.9	Confident	127 Å²	127	111.4 Å²	111.4	59%	0.593	50%	0.501	S	S	*	.	H	α-helix	trans	-68.9	-42.6	177.7	-161.6	179	43.6	0	0	111.8	Q458 K459 S460 H465 Q466	Q458-Q462 WeakPolarHBondContact O-CB 3.41Å; Q458-Q462 PolarHBondContact O-N 3.3Å; K459-Q462 PolarHBondContact O-N 2.92Å; S460-Q462 VanDerWaalsContact C-N 3.29Å; S460-Q462 PolarHBondContact O-N 3.34Å; Q462-H465 PolarHBondContact O-N 3.35Å; Q462-Q466 WeakPolarHBondContact O-CG 3.49Å; Q462-Q466 PolarHBondContact O-N 3.09Å
463	Q	76.4	Confident	73	Confident	108 Å²	108	112.9 Å²	112.9	51%	0.505	51%	0.506	S	S	.	.	H	α-helix	trans	-62.3	-46.8	174.2	-75	177.3	-16.5	0	0	111.9	K459 S460 H465 Q466 Q467	K459-Q463 WeakPolarHBondContact O-CG 3.23Å; K459-Q463 PolarHBondContact O-N 2.85Å; S460-Q463 PolarHBondContact O-N 3.48Å; Q463-H465 VanDerWaalsContact C-N 3.29Å; Q463-H465 PolarHBondContact O-N 3.09Å; Q463-Q466 WeakPolarHBondContact O-CB 3.37Å; Q463-Q466 PolarHBondContact O-N 2.88Å; Q463-Q466 VanDerWaalsContact O-N 3.09Å; Q463-Q467 PolarHBondContact O-N 3.14Å
464	Q	73.4	Confident	71.6	Confident	106 Å²	106	111.8 Å²	111.8	50%	0.495	51%	0.508	S	S	.	.	H	α-helix	trans	-53.7	-45.7	172.6	-77.3	-82	-32	0	0	111.4	S460 Q466 Q467 H468	S460-Q464 WeakPolarHBondContact O-CB 3.3Å; S460-Q464 WeakPolarHBondContact O-CG 3.36Å; S460-Q464 PolarHBondContact O-N 2.91Å; Q464-Q466 PolarHBondContact O-N 3.2Å; Q464-Q467 PolarHBondContact O-N 3.12Å; Q464-H468 PolarHBondContact O-CD2 2.92Å; Q464-H468 PolarHBondContact O-N 2.94Å
465	H	72.4	Confident	70	Confident	101 Å²	101	110.7 Å²	110.7	47%	0.468	51%	0.506	S	S	.	.	H	α-helix	trans	-68.3	-32.9	178.1	-162.5	82.1	0	0	0	113	L461 Q462 Q463 K469	L461-H465 WeakPolarHBondContact O-CB 3.5Å; L461-H465 PolarHBondContact O-N 2.9Å; Q462-H465 PolarHBondContact O-N 3.35Å; Q463-H465 VanDerWaalsContact C-N 3.29Å; Q463-H465 PolarHBondContact O-N 3.09Å; H465-K469 VanDerWaalsContact NE2-CE 3.31Å; H465-K469 WeakPolarHBondContact NE2-CE 3.3Å; H465-K469 WeakPolarHBondContact O-CG 3.2Å; H465-K469 PolarHBondContact O-N 3.43Å; H465-K469 VanDerWaalsContact O-N 3.12Å
466	Q	69.3	Low	68.3	Low	94 Å²	94	108.1 Å²	108.1	44%	0.439	51%	0.506	S	S	.	.	H	α-helix	trans	-69	-41.9	171.8	-72.1	-174.9	24.8	0	0	112.2	Q462 Q463 Q464 K469 R470	Q462-Q466 WeakPolarHBondContact O-CG 3.49Å; Q462-Q466 PolarHBondContact O-N 3.09Å; Q463-Q466 WeakPolarHBondContact O-CB 3.37Å; Q463-Q466 PolarHBondContact O-N 2.88Å; Q463-Q466 VanDerWaalsContact O-N 3.09Å; Q464-Q466 PolarHBondContact O-N 3.2Å; Q466-K469 WeakPolarHBondContact O-CB 3.46Å; Q466-K469 PolarHBondContact O-N 2.89Å; Q466-K469 VanDerWaalsContact O-N 3.14Å; Q466-R470 PolarHBondContact O-N 3.12Å
467	Q	64.6	Low	66.6	Low	114 Å²	114	110.6 Å²	110.6	53%	0.533	52%	0.515	S	S	.	.	H	α-helix	trans	-62.8	-45.2	174.4	-69.9	-162.1	3.7	0	0	111.3	Q463 Q464 K469 R470 I471	Q463-Q467 PolarHBondContact O-N 3.14Å; Q464-Q467 PolarHBondContact O-N 3.12Å; Q467-K469 PolarHBondContact O-N 2.92Å; Q467-R470 PolarHBondContact O-N 3.06Å; Q467-R470 VanDerWaalsContact O-N 3.09Å; Q467-I471 WeakPolarHBondContact O-CG1 3.47Å; Q467-I471 PolarHBondContact O-N 2.97Å
468	H	59	Low	65.1	Low	106 Å²	106	107.5 Å²	107.5	49%	0.491	51%	0.509	S	S	.	.	H	α-helix	trans	-62.1	-22.8	173	-90.5	-68	0	0	0	114.5	Q464 R472	Q464-H468 PolarHBondContact O-CD2 2.92Å; Q464-H468 PolarHBondContact O-N 2.94Å; H468-R472 PolarHBondContact O-NE 2.98Å; H468-R472 VanDerWaalsContact O-NE 3.1Å
469	K	64.8	Low	63.6	Low	105 Å²	105	105 Å²	105	46%	0.457	51%	0.506	S	S	.	.	H	α-helix	trans	-77.1	-49.9	168.2	-77.7	175.6	177.5	174.7	0	110.8	H465 Q466 Q467 I471 R472 F473	H465-K469 VanDerWaalsContact NE2-CE 3.31Å; H465-K469 WeakPolarHBondContact NE2-CE 3.3Å; H465-K469 WeakPolarHBondContact O-CG 3.2Å; H465-K469 PolarHBondContact O-N 3.43Å; H465-K469 VanDerWaalsContact O-N 3.12Å; Q466-K469 WeakPolarHBondContact O-CB 3.46Å; Q466-K469 PolarHBondContact O-N 2.89Å; Q466-K469 VanDerWaalsContact O-N 3.14Å; Q467-K469 PolarHBondContact O-N 2.92Å; K469-I471 VanDerWaalsContact C-N 3.34Å; K469-I471 PolarHBondContact O-N 3.44Å; K469-R472 PolarHBondContact O-N 2.94Å; K469-R472 VanDerWaalsContact O-N 3.11Å; K469-F473 HydrophobicContact CB-CE2 4.48Å; K469-F473 WeakPolarHBondContact O-CD2 3.31Å; K469-F473 PolarHBondContact O-N 3.47Å
470	R	57.3	Low	61.9	Low	155 Å²	155	111 Å²	111	59%	0.585	53%	0.527	S	S	*	.	H	α-helix	trans	-55.7	-44.7	177.9	-72.2	-179.6	179.3	-179.6	0.5	112.2	Q466 Q467 R472 F473 L474	Q466-R470 PolarHBondContact O-N 3.12Å; Q467-R470 PolarHBondContact O-N 3.06Å; Q467-R470 VanDerWaalsContact O-N 3.09Å; R470-R472 PolarHBondContact O-N 3.49Å; R470-F473 PolarHBondContact O-N 3.08Å; R470-L474 WeakPolarHBondContact O-CG 3.3Å; R470-L474 PolarHBondContact O-N 3.26Å
471	I	57.8	Low	60.6	Low	84 Å²	84	114.6 Å²	114.6	43%	0.431	54%	0.535	S	S	.	.	H	α-helix	trans	-62.9	-41.9	176.5	-64.6	164.3	0	0	0	111.2	Q467 K469 F473 L474 N475	Q467-I471 WeakPolarHBondContact O-CG1 3.47Å; Q467-I471 PolarHBondContact O-N 2.97Å; K469-I471 VanDerWaalsContact C-N 3.34Å; K469-I471 PolarHBondContact O-N 3.44Å; I471-F473 PolarHBondContact O-N 3.17Å; I471-L474 PolarHBondContact O-N 3.02Å; I471-N475 WeakPolarHBondContact O-CB 3.31Å; I471-N475 VanDerWaalsContact O-CG 3.3Å; I471-N475 PolarHBondContact O-N 3.21Å
472	R	47.3	Very low	59.1	Low	159 Å²	159	115.4 Å²	115.4	60%	0.6	53%	0.534	S	S	*	.	H	α-helix	trans	-64.6	-37.3	174.8	-85.6	-174.7	-81.3	-170.8	-7.5	112.9	H468 K469 R470 S476	H468-R472 PolarHBondContact O-NE 2.98Å; H468-R472 VanDerWaalsContact O-NE 3.1Å; K469-R472 PolarHBondContact O-N 2.94Å; K469-R472 VanDerWaalsContact O-N 3.11Å; R470-R472 PolarHBondContact O-N 3.49Å; R472-S476 WeakPolarHBondContact O-CB 3.48Å; R472-S476 PolarHBondContact O-N 3.34Å; R472-S476 VanDerWaalsContact O-N 3.09Å
473	F	51.3	Low	57.6	Low	133 Å²	133	113.3 Å²	113.3	58%	0.583	53%	0.527	S	S	*	.	H	α-helix	trans	-67.4	-44.7	173.6	-78	-68.8	0	0	0	112.1	K469 R470 I471 N475 S476 H477	K469-F473 HydrophobicContact CB-CE2 4.48Å; K469-F473 WeakPolarHBondContact O-CD2 3.31Å; K469-F473 PolarHBondContact O-N 3.47Å; R470-F473 PolarHBondContact O-N 3.08Å; I471-F473 PolarHBondContact O-N 3.17Å; F473-N475 PolarHBondContact O-N 2.91Å; F473-S476 WeakPolarHBondContact O-CB 3.3Å; F473-S476 PolarHBondContact O-N 2.92Å; F473-H477 PolarHBondContact O-CD2 3.48Å; F473-H477 PolarHBondContact O-N 3.35Å
474	L	56.1	Low	56.6	Low	114 Å²	114	113.5 Å²	113.5	60%	0.597	53%	0.529	S	S	*	.	H	α-helix	trans	-60.6	-45.8	177.6	-75.4	165.3	0	0	0	112.1	R470 I471 S476 H477 Q478	R470-L474 WeakPolarHBondContact O-CG 3.3Å; R470-L474 PolarHBondContact O-N 3.26Å; I471-L474 PolarHBondContact O-N 3.02Å; L474-S476 VanDerWaalsContact C-N 3.34Å; L474-S476 PolarHBondContact O-N 2.82Å; L474-H477 PolarHBondContact O-N 3.33Å; L474-Q478 PolarHBondContact O-N 2.95Å
475	N	51.8	Low	55.7	Low	86 Å²	86	113.6 Å²	113.6	46%	0.46	53%	0.53	S	S	.	.	H	α-helix	trans	-63.6	-39.4	176.7	-68.5	-1.8	0	0	0	111.6	I471 F473 H477 Q478 S479	I471-N475 WeakPolarHBondContact O-CB 3.31Å; I471-N475 VanDerWaalsContact O-CG 3.3Å; I471-N475 PolarHBondContact O-N 3.21Å; F473-N475 PolarHBondContact O-N 2.91Å; N475-H477 VanDerWaalsContact C-N 3.34Å; N475-H477 PolarHBondContact O-N 2.89Å; N475-Q478 PolarHBondContact O-N 3.33Å; N475-S479 PolarHBondContact O-N 3.49Å; N475-S479 PolarHBondContact O-OG 3.41Å; N475-S479 VanDerWaalsContact O-OG 3.13Å
476	S	53	Low	54.8	Low	68 Å²	68	113.7 Å²	113.7	48%	0.476	53%	0.533	S	S	.	.	H	α-helix	trans	-59.8	-41.5	173.4	179.8	0	0	0	0	112.6	R472 F473 L474 R480	R472-S476 WeakPolarHBondContact O-CB 3.48Å; R472-S476 PolarHBondContact O-N 3.34Å; R472-S476 VanDerWaalsContact O-N 3.09Å; F473-S476 WeakPolarHBondContact O-CB 3.3Å; F473-S476 PolarHBondContact O-N 2.92Å; L474-S476 VanDerWaalsContact C-N 3.34Å; L474-S476 PolarHBondContact O-N 2.82Å; S476-R480 WeakPolarHBondContact O-CB 3.35Å; S476-R480 PolarHBondContact O-N 3.42Å
477	H	50.6	Low	54.1	Low	120 Å²	120	115.1 Å²	115.1	56%	0.556	54%	0.538	S	S	*	.	H	α-helix	trans	-72.1	-35.5	177.8	-80.4	-72.3	0	0	0	113.5	F473 L474 N475 K481	F473-H477 PolarHBondContact O-CD2 3.48Å; F473-H477 PolarHBondContact O-N 3.35Å; L474-H477 PolarHBondContact O-N 3.33Å; N475-H477 VanDerWaalsContact C-N 3.34Å; N475-H477 PolarHBondContact O-N 2.89Å; H477-K481 PolarHBondContact O-N 2.88Å; H477-K481 VanDerWaalsContact O-N 3.13Å
478	Q	53.7	Low	53.5	Low	120 Å²	120	116.3 Å²	116.3	56%	0.561	54%	0.543	S	S	*	.	H	α-helix	trans	-65.1	-49.8	171	-82.8	-175.3	-18.2	0	0	111.3	L474 N475 R480 K481 F482	L474-Q478 PolarHBondContact O-N 2.95Å; N475-Q478 PolarHBondContact O-N 3.33Å; Q478-R480 VanDerWaalsContact C-N 3.29Å; Q478-R480 PolarHBondContact O-N 2.86Å; Q478-K481 PolarHBondContact O-N 3.25Å; Q478-F482 WeakPolarHBondContact O-CD2 3.43Å; Q478-F482 PolarHBondContact O-N 3.4Å
479	S	52.8	Low	53	Low	78 Å²	78	116.3 Å²	116.3	55%	0.545	55%	0.546	S	S	.	.	H	α-helix	trans	-55.8	-43.8	176.8	-62.8	0	0	0	0	111.7	N475 K481 F482 D483	N475-S479 PolarHBondContact O-N 3.49Å; N475-S479 PolarHBondContact O-OG 3.41Å; N475-S479 VanDerWaalsContact O-OG 3.13Å; S479-K481 VanDerWaalsContact C-N 3.33Å; S479-K481 PolarHBondContact O-N 3.1Å; S479-F482 PolarHBondContact O-N 2.65Å; S479-D483 WeakPolarHBondContact O-CB 3.37Å; S479-D483 PolarHBondContact O-N 3.28Å
480	R	49.3	Very low	52.4	Low	177 Å²	177	113.9 Å²	113.9	67%	0.668	54%	0.538	S	S	*	.	H	α-helix	trans	-66.6	-28.2	177.5	-171.5	-179.7	-88.8	-166	-4.3	113.6	S476 Q478 M484	S476-R480 WeakPolarHBondContact O-CB 3.35Å; S476-R480 PolarHBondContact O-N 3.42Å; Q478-R480 VanDerWaalsContact C-N 3.29Å; Q478-R480 PolarHBondContact O-N 2.86Å; R480-M484 WeakPolarHBondContact O-CG 3.33Å; R480-M484 PolarHBondContact O-N 2.8Å
481	K	52	Low	51.9	Low	136 Å²	136	114.3 Å²	114.3	59%	0.591	54%	0.544	S	S	*	.	H	α-helix	trans	-71	-51.1	171.7	-93.7	-168.9	171.1	-170.4	0	111.6	H477 Q478 S479 D483 M484 E485	H477-K481 PolarHBondContact O-N 2.88Å; H477-K481 VanDerWaalsContact O-N 3.13Å; Q478-K481 PolarHBondContact O-N 3.25Å; S479-K481 VanDerWaalsContact C-N 3.33Å; S479-K481 PolarHBondContact O-N 3.1Å; K481-D483 PolarHBondContact O-N 2.91Å; K481-M484 PolarHBondContact O-N 2.88Å; K481-E485 PolarHBondContact O-N 3.28Å
482	F	48.5	Very low	51.5	Low	132 Å²	132	116.2 Å²	116.2	58%	0.579	55%	0.554	S	S	*	*	H	α-helix	trans	-57.3	-38.7	176.5	-78.3	-68.9	0	0	0	111.8	Q478 S479 M484 E485 L486	Q478-F482 WeakPolarHBondContact O-CD2 3.43Å; Q478-F482 PolarHBondContact O-N 3.4Å; S479-F482 PolarHBondContact O-N 2.65Å; F482-M484 VanDerWaalsContact C-N 3.28Å; F482-M484 PolarHBondContact O-N 3.06Å; F482-E485 PolarHBondContact O-N 2.96Å; F482-L486 WeakPolarHBondContact O-CB 3.37Å; F482-L486 PolarHBondContact O-N 3.25Å
483	D	49.3	Very low	51.5	Low	84 Å²	84	114.5 Å²	114.5	45%	0.449	56%	0.557	S	S	.	*	H	α-helix	trans	-64.9	-26.3	176.8	-129	37	0	0	0	114.1	S479 K481 K487	S479-D483 WeakPolarHBondContact O-CB 3.37Å; S479-D483 PolarHBondContact O-N 3.28Å; K481-D483 PolarHBondContact O-N 2.91Å; D483-K487 WeakPolarHBondContact O-CB 3.32Å; D483-K487 WeakPolarHBondContact O-CD 3.45Å; D483-K487 WeakPolarHBondContact O-CE 3.17Å; D483-K487 WeakPolarHBondContact O-CG 3.49Å; D483-K487 IonicContact OD2-NZ 2.73Å; D483-K487 PolarHBondContact OD2-NZ 2.91Å
484	M	54.6	Low	51.3	Low	111 Å²	111	111.3 Å²	111.3	55%	0.547	54%	0.543	S	S	.	.	H	α-helix	trans	-83.4	-39.6	174.8	-72.5	-170	-62.1	0	0	111.7	R480 K481 F482 K487 H488	R480-M484 WeakPolarHBondContact O-CG 3.33Å; R480-M484 PolarHBondContact O-N 2.8Å; K481-M484 PolarHBondContact O-N 2.88Å; F482-M484 VanDerWaalsContact C-N 3.28Å; F482-M484 PolarHBondContact O-N 3.06Å; M484-K487 PolarHBondContact O-N 3.22Å; M484-H488 PolarHBondContact O-N 2.76Å
485	E	54.1	Low	50.7	Low	109 Å²	109	114.1 Å²	114.1	51%	0.509	55%	0.553	S	S	.	*	H	α-helix	trans	-66.5	-41.8	176.4	-71.7	172.8	-172.4	0	0	111.3	K481 F482 K487 H488 L489	K481-E485 PolarHBondContact O-N 3.28Å; F482-E485 PolarHBondContact O-N 2.96Å; E485-K487 VanDerWaalsContact C-N 3.3Å; E485-K487 PolarHBondContact O-N 3.02Å; E485-H488 PolarHBondContact O-N 2.96Å; E485-L489 PolarHBondContact O-N 3.23Å
486	L	53.2	Low	50.1	Low	102 Å²	102	117.9 Å²	117.9	53%	0.534	57%	0.567	S	S	.	*	H	α-helix	trans	-61.4	-36.1	173.2	-123.8	81.3	0	0	0	112.7	F482 N490	F482-L486 WeakPolarHBondContact O-CB 3.37Å; F482-L486 PolarHBondContact O-N 3.25Å; L486-N490 WeakPolarHBondContact O-CB 3.11Å; L486-N490 PolarHBondContact O-N 3.14Å; L486-N490 PolarHBondContact O-ND2 3.29Å; L486-N490 VanDerWaalsContact O-ND2 3.14Å
487	K	54.7	Low	49.3	Very low	125 Å²	125	121.9 Å²	121.9	54%	0.543	58%	0.584	S	S	.	*	H	α-helix	trans	-74.4	-27.4	178.1	-75.7	168.7	-163.5	149.8	0	112.6	D483 M484 E485	D483-K487 WeakPolarHBondContact O-CB 3.32Å; D483-K487 WeakPolarHBondContact O-CD 3.45Å; D483-K487 WeakPolarHBondContact O-CE 3.17Å; D483-K487 WeakPolarHBondContact O-CG 3.49Å; D483-K487 IonicContact OD2-NZ 2.73Å; D483-K487 PolarHBondContact OD2-NZ 2.91Å; M484-K487 PolarHBondContact O-N 3.22Å; E485-K487 VanDerWaalsContact C-N 3.3Å; E485-K487 PolarHBondContact O-N 3.02Å
488	H	52	Low	48.5	Very low	138 Å²	138	122.3 Å²	122.3	64%	0.639	60%	0.595	S	S	*	*	H	α-helix	trans	-75	-45.2	170.1	-100.3	-87.6	0	0	0	112.1	M484 E485 K491 I492	M484-H488 PolarHBondContact O-N 2.76Å; E485-H488 PolarHBondContact O-N 2.96Å; H488-K491 PolarHBondContact O-N 2.96Å; H488-I492 PolarHBondContact O-N 3.14Å
489	L	49.8	Very low	47.6	Very low	107 Å²	107	121.9 Å²	121.9	56%	0.56	61%	0.605	S	S	*	*	H	α-helix	trans	-64.2	-42.6	179.1	-79.3	157.4	0	0	0	112.7	E485 K491 I492 N493	E485-L489 PolarHBondContact O-N 3.23Å; L489-K491 PolarHBondContact O-N 3.18Å; L489-I492 PolarHBondContact O-N 3Å; L489-N493 PolarHBondContact O-N 3.43Å
490	N	50.7	Low	46.8	Very low	53 Å²	53	124.2 Å²	124.2	28%	0.283	62%	0.616	S	S	.	*	H	α-helix	trans	-69.1	-17.4	175.9	-78.4	-42.8	0	0	0	114.1	L486 H494	L486-N490 WeakPolarHBondContact O-CB 3.11Å; L486-N490 PolarHBondContact O-N 3.14Å; L486-N490 PolarHBondContact O-ND2 3.29Å; L486-N490 VanDerWaalsContact O-ND2 3.14Å; N490-H494 PolarHBondContact O-CD2 2.74Å
491	K	46.7	Very low	46.2	Very low	165 Å²	165	121.6 Å²	121.6	72%	0.717	62%	0.62	S	S	*	*	H	α-helix	trans	-80.6	-27.1	175.5	-112.9	-178.7	175.7	-176.1	0	113.3	H488 L489	H488-K491 PolarHBondContact O-N 2.96Å; L489-K491 PolarHBondContact O-N 3.18Å
492	I	51	Low	45.4	Very low	124 Å²	124	120.6 Å²	120.6	64%	0.636	63%	0.626	S	S	*	*	H	α-helix	trans	-84.2	-36	-178.2	-63.6	168.4	0	0	0	110.6	H488 L489 H494	H488-I492 PolarHBondContact O-N 3.14Å; L489-I492 PolarHBondContact O-N 3Å; I492-H494 VanDerWaalsContact C-N 3.28Å; I492-H494 PolarHBondContact O-N 3.01Å
493	N	46.6	Very low	44.8	Very low	122 Å²	122	120 Å²	120	65%	0.652	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	1.7	-178.3	-82.9	-17.1	0	0	0	116.2	L489	L489-N493 PolarHBondContact O-N 3.43Å
494	H	46.3	Very low	44.1	Very low	67 Å²	67	122.3 Å²	122.3	31%	0.31	65%	0.645	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.3	8.2	-175.9	-91.2	-45.5	0	0	0	116	N490 I492 H514 L516	N490-H494 PolarHBondContact O-CD2 2.74Å; I492-H494 VanDerWaalsContact C-N 3.28Å; I492-H494 PolarHBondContact O-N 3.01Å; H494-H514 PolarHBondContact CE1-O 2.99Å; H494-H514 VanDerWaalsContact CE1-O 3.31Å; H494-L516 VanDerWaalsContact CD2-CD1 3.45Å; H494-L516 WeakPolarHBondContact CD2-CD1 3.42Å
495	H	44.6	Very low	43.1	Very low	172 Å²	172	123.1 Å²	123.1	80%	0.796	65%	0.652	S	S	*	*	S	Bend	trans	-106.9	2.8	-176.4	-103.1	-64.9	0	0	0	116.5
496	H	39	Very low	42.1	Very low	165 Å²	165	124.3 Å²	124.3	76%	0.764	66%	0.662	S	S	*	*	S	Bend	trans	-121.9	138.4	172.3	-79.8	-78.3	0	0	0	111.7
497	N	35.8	Very low	41.2	Very low	152 Å²	152	127 Å²	127	81%	0.813	68%	0.677	S	S	*	*			trans	70	115.5	-176.2	-47.8	-25.7	0	0	0	112.8
498	T	34.1	Very low	40.1	Very low	130 Å²	130	126.3 Å²	126.3	80%	0.798	69%	0.688	S	S	*	*			cis	-163.3	137.1	45.3	46.2	0	0	0	0	111.4
499	S	33.9	Very low	39.1	Very low	110 Å²	110	125.9 Å²	125.9	77%	0.769	70%	0.7	S	S	*	*			trans	-110.3	157.9	162.3	-71.8	0	0	0	0	110.5
500	T	37	Very low	38.3	Very low	127 Å²	127	127.6 Å²	127.6	78%	0.779	71%	0.708	S	S	*	*			trans	66.5	95.4	160.5	51	0	0	0	0	120.5
501	T	35.6	Very low	37.2	Very low	123 Å²	123	132 Å²	132	76%	0.755	73%	0.732	S	S	*	*				78.8	127.8	119.3	52	0	0	0	0	124.4
502	T	36.1	Very low	36.3	Very low	115 Å²	115	129 Å²	129	71%	0.706	73%	0.732	S	S	*	*			trans	83.6	102.1	135	48.7	0	0	0	0	123.3
503	T	35	Very low	35.2	Very low	119 Å²	119	129.4 Å²	129.4	73%	0.73	74%	0.74	S	S	*	*				77.6	123	125.5	55.8	0	0	0	0	123.4
504	N	35.3	Very low	34.3	Very low	132 Å²	132	130.3 Å²	130.3	71%	0.706	74%	0.74	S	S	*	*			trans	87.3	101.3	138.1	-67	2.4	0	0	0	121.5
505	N	32.8	Very low	33.5	Very low	129 Å²	129	137.4 Å²	137.4	69%	0.69	76%	0.764	S	S	*	*				83.9	113.6	122.8	-66.5	-1.4	0	0	0	121.2
506	N	34.4	Very low	32.8	Very low	133 Å²	133	133.8 Å²	133.8	71%	0.711	75%	0.75	S	S	*	*			trans	92.9	110.1	137.3	-59.5	-8.9	0	0	0	119.3
507	N	33	Very low	32.3	Very low	159 Å²	159	130.9 Å²	130.9	85%	0.85	75%	0.748	S	S	*	*			trans	87.4	139.2	147.8	-56.8	-19.7	0	0	0	119.1
508	S	32.7	Very low	32	Very low	111 Å²	111	131.2 Å²	131.2	78%	0.776	75%	0.749	S	S	*	*			trans	73.4	104.5	177.2	-146	0	0	0	0	116.5	I510	S508-I510 PolarHBondContact O-N 2.82Å
509	S	30.1	Very low	31.9	Very low	128 Å²	128	130.2 Å²	130.2	90%	0.895	75%	0.746	S	S	*	*			trans	-61.5	110.2	179.6	177.2	0	0	0	0	112.4
510	I	33.2	Very low	31.8	Very low	143 Å²	143	135.6 Å²	135.6	73%	0.733	75%	0.75	S	S	*	*			trans	-109.1	127.8	170.9	-66.5	174.4	0	0	0	109.7	S508	S508-I510 PolarHBondContact O-N 2.82Å
511	N	27.5	Very low	31.4	Very low	146 Å²	146	135 Å²	135	78%	0.781	75%	0.748	S	S	*	*			trans	16.8	138.3	151.3	-58	-27.2	0	0	0	121.4
512	S	27.7	Very low	31.1	Very low	103 Å²	103	136.6 Å²	136.6	72%	0.72	75%	0.747	S	S	*	*			trans	70.6	102.4	140.4	-175.5	0	0	0	0	118.3
513	T	28.5	Very low	30.8	Very low	131 Å²	131	138.9 Å²	138.9	80%	0.804	75%	0.75	S	S	*	*				-147.7	122.4	128.7	-21.1	0	0	0	0	111	R515	T513-R515 PolarHBondContact O-N 2.98Å
514	H	29	Very low	30.6	Very low	142 Å²	142	144.1 Å²	144.1	66%	0.657	76%	0.763	S	S	*	*			trans	-56.8	126.2	157.7	-77.9	-110.5	0	0	0	108.3	H494	H494-H514 PolarHBondContact CE1-O 2.99Å; H494-H514 VanDerWaalsContact CE1-O 3.31Å
515	R	28.2	Very low	30.3	Very low	215 Å²	215	141.4 Å²	141.4	81%	0.811	75%	0.751	S	S	*	*			trans	-148.6	119.8	155.7	-107.1	-172.9	-179.8	-162.4	-0.6	110.3	T513 S517	T513-R515 PolarHBondContact O-N 2.98Å; R515-S517 PolarHBondContact O-N 2.95Å
516	L	29.7	Very low	30.2	Very low	97 Å²	97	142.9 Å²	142.9	51%	0.508	75%	0.753	S	S	.	*			trans	-56	123.5	167	-70	166.2	0	0	0	110.6	H494 L518	H494-L516 VanDerWaalsContact CD2-CD1 3.45Å; H494-L516 WeakPolarHBondContact CD2-CD1 3.42Å; L516-L518 HydrophobicContact CD2-CD1 4.39Å
517	S	29.3	Very low	30	Very low	103 Å²	103	144.5 Å²	144.5	72%	0.72	76%	0.761	S	S	*	*			trans	-117.9	91.8	153.6	48.6	0	0	0	0	109.1	R515 C519	R515-S517 PolarHBondContact O-N 2.95Å; S517-C519 PolarHBondContact O-N 3.45Å
518	L	28.8	Very low	30	Very low	159 Å²	159	145.3 Å²	145.3	83%	0.832	77%	0.765	S	S	*	*			trans	-67.2	89.8	158.8	-92.4	84.1	0	0	0	108.2	L516	L516-L518 HydrophobicContact CD2-CD1 4.39Å
519	C	31.6	Very low	29.9	Very low	109 Å²	109	148.9 Å²	148.9	74%	0.736	77%	0.769	S	S	*	*			trans	-119.5	100.5	165.6	-70	0	0	0	0	109.3	S517	S517-C519 PolarHBondContact O-N 3.45Å
520	R	33	Very low	29.9	Very low	224 Å²	224	151.2 Å²	151.2	85%	0.845	76%	0.763	S	S	*	*			trans	-47.5	145.9	146.5	-107.2	175.8	166.5	176.2	-7.7	108.1
521	P	28.3	Very low	29.9	Very low	115 Å²	115	151 Å²	151	75%	0.747	76%	0.759	S	S	*	*				-142	-177.6	63.1	35.3	-15.7	0	0	0	115.7
522	E	28.9	Very low	30.3	Very low	156 Å²	156	149.8 Å²	149.8	73%	0.729	75%	0.752	S	S	*	*			trans	-48.4	162.5	157.5	-64.6	131	-167.2	0	0	111.7
523	Q	30.5	Very low	30.6	Very low	162 Å²	162	153.9 Å²	153.9	76%	0.757	76%	0.757	S	S	*	*			trans	95.8	62.1	-178.6	-55.1	178.3	17.2	0	0	116.7	T525	Q523-T525 VanDerWaalsContact C-N 3.3Å; Q523-T525 WeakPolarHBondContact CB-OG1 3.46Å; Q523-T525 HydrophobicContact CG-CG2 4.37Å
524	F	30.4	Very low	30.8	Very low	230 Å²	230	153.4 Å²	153.4	100%	1.009	76%	0.756	S	S	*	*			trans	-91.9	79.3	132	-108.7	-79.9	0	0	0	108.3
525	T	29.5	Very low	31.1	Very low	75 Å²	75	153.2 Å²	153.2	46%	0.46	76%	0.76	S	S	.	*			trans	-91.3	152.3	-175.6	9.8	0	0	0	0	111.6	Q523	Q523-T525 VanDerWaalsContact C-N 3.3Å; Q523-T525 WeakPolarHBondContact CB-OG1 3.46Å; Q523-T525 HydrophobicContact CG-CG2 4.37Å
526	H	31	Very low	31.2	Very low	159 Å²	159	151.5 Å²	151.5	74%	0.736	76%	0.758	S	S	*	*			trans	60.8	78.6	152.7	-54.9	-45.9	0	0	0	119.3
527	L	29.3	Very low	31	Very low	168 Å²	168	151.5 Å²	151.5	88%	0.88	77%	0.767	S	S	*	*	S	Bend		-148.2	134.2	129.6	-105	138.4	0	0	0	109.4
528	L	32.1	Very low	31	Very low	176 Å²	176	155.1 Å²	155.1	92%	0.921	77%	0.77	S	S	*	*	S	Bend	trans	71.6	33.2	-179.7	-51.4	-179.4	0	0	0	118.3
529	Q	30.4	Very low	31	Very low	186 Å²	186	155.4 Å²	155.4	87%	0.869	77%	0.767	S	S	*	*			trans	-119	103.6	142.8	-167.2	177.3	30.1	0	0	108.9
530	K	31.6	Very low	30.7	Very low	176 Å²	176	161.2 Å²	161.2	77%	0.765	78%	0.775	S	S	*	*			trans	-136.8	115.5	169.1	-171.2	169.4	-176.2	-169.3	0	109.2
531	E	32	Very low	30.6	Very low	139 Å²	139	156.2 Å²	156.2	65%	0.65	77%	0.771	S	S	*	*	S	Bend	trans	69.5	134.8	164	-64.1	-177.7	99.2	0	0	117.9
532	N	35.8	Very low	30.6	Very low	120 Å²	120	157.8 Å²	157.8	64%	0.642	77%	0.774	S	S	*	*			cis	-148.4	126.9	-7.9	-104.9	-36.5	0	0	0	112.9
533	K	34	Very low	30.8	Very low	190 Å²	190	158.6 Å²	158.6	83%	0.826	78%	0.775	S	S	*	*			trans	21	134.2	154.4	-65.3	176	178	174.6	0	122
534	P	34.4	Very low	30.9	Very low	120 Å²	120	157.7 Å²	157.7	78%	0.779	78%	0.775	S	S	*	*			trans	-88.9	156.4	168.4	37.3	-34.2	0	0	0	113.7
535	N	33.3	Very low	31.1	Very low	138 Å²	138	154.5 Å²	154.5	74%	0.738	77%	0.769	S	S	*	*			trans	-146.4	112.7	158.7	-92.1	-42.2	0	0	0	106.4
536	K	31	Very low	31.2	Very low	179 Å²	179	155 Å²	155	78%	0.778	77%	0.773	S	S	*	*				96.8	126.8	86.1	-86	-175.8	-176.1	-179.2	0	112.5
537	S	26.4	Very low	31.3	Very low	97 Å²	97	152.4 Å²	152.4	68%	0.678	76%	0.758	S	S	*	*			trans	65.7	160.5	156.5	46.8	0	0	0	0	119.5
538	F	29.1	Very low	31.5	Very low	179 Å²	179	149 Å²	149	79%	0.785	75%	0.745	S	S	*	*			trans	76.7	87	177.5	-53.6	-72.1	0	0	0	114.9
539	Q	27.7	Very low	31.5	Very low	166 Å²	166	148.7 Å²	148.7	78%	0.776	74%	0.743	S	S	*	*				82.6	119.4	64	-171.7	173.3	7.1	0	0	111.2	P541	Q539-P541 WeakPolarHBondContact O-CD 3.37Å
540	Y	26.1	Very low	31.5	Very low	230 Å²	230	147.7 Å²	147.7	90%	0.902	74%	0.74	S	S	*	*			trans	-53.9	127.6	176.7	-81.1	-98.8	0	0	0	111.3
541	P	30	Very low	31.7	Very low	119 Å²	119	146.9 Å²	146.9	77%	0.773	74%	0.741	S	S	*	*			trans	-81.9	142.3	144.7	13.2	4.8	0	0	0	109.3	Q539	Q539-P541 WeakPolarHBondContact O-CD 3.37Å
542	N	28.8	Very low	31.9	Very low	149 Å²	149	148.6 Å²	148.6	80%	0.797	75%	0.747	S	S	*	*			trans	-63.3	179.1	-176.7	-150.3	-3.9	0	0	0	113
543	K	33	Very low	31.7	Very low	173 Å²	173	152.5 Å²	152.5	75%	0.752	76%	0.758	S	S	*	*	S	Bend	trans	-56.6	167.4	156.6	-61.2	177.9	179.1	-179.8	0	109.9
544	D	32.1	Very low	31.7	Very low	142 Å²	142	149 Å²	149	76%	0.759	76%	0.757	S	S	*	*			trans	81	79.5	171.9	-39	-34.6	0	0	0	114.9
545	D	34.6	Very low	31.7	Very low	164 Å²	164	153 Å²	153	88%	0.877	76%	0.762	S	S	*	*				-174.8	141	121.9	-105.2	-25.2	0	0	0	113.7
546	P	31.6	Very low	31.8	Very low	86 Å²	86	155.1 Å²	155.1	56%	0.558	77%	0.765	S	S	*	*			trans	-97.6	144.9	173.3	36.1	-30.9	0	0	0	112.8
547	Y	34.3	Very low	31.9	Very low	103 Å²	103	154.5 Å²	154.5	40%	0.404	77%	0.765	S	S	.	*				178.6	155	126.2	-111	-121	0	0	0	112.7	E125 K127	E125-Y547 HydrophobicContact CB-CE2 4.45Å; E125-Y547 VanDerWaalsContact CB-OH 3.25Å; E125-Y547 WeakPolarHBondContact CB-OH 3.5Å; E125-Y547 PolarHBondContact O-OH 2.91Å; E125-Y547 WeakPolarHBondContact OE2-CE2 3.48Å; K127-Y547 HydrophobicContact CD-CD1 4.38Å; K127-Y547 HydrophobicContact CD-CD2 4.42Å; K127-Y547 HydrophobicContact CD-CE1 3.8Å; K127-Y547 HydrophobicContact CD-CE2 3.86Å; K127-Y547 HydrophobicContact CG-CE1 4.37Å; K127-Y547 HydrophobicContact CG-CE2 4.22Å; K127-Y547 WeakPolarHBondContact CG-OH 3.34Å; K127-Y547 PolarHBondContact N-OH 2.99Å; K127-Y547 VanDerWaalsContact NZ-CG 3.34Å
548	P	32.5	Very low	32	Very low	96 Å²	96	161.3 Å²	161.3	62%	0.623	78%	0.776	S	S	*	*			trans	-99.9	149.3	-170.7	37.2	-32	0	0	0	113.9
549	I	33.1	Very low	31.9	Very low	170 Å²	170	157.3 Å²	157.3	87%	0.872	77%	0.77	S	S	*	*			trans	-115.9	105.1	168.7	-65.5	-179.8	0	0	0	110.2
550	M	30.6	Very low	32	Very low	165 Å²	165	156.1 Å²	156.1	81%	0.813	77%	0.767	S	S	*	*			trans	-60.7	140.7	164.3	-67	159.2	46.9	0	0	110.8
551	M	36.3	Very low	32.1	Very low	159 Å²	159	152.5 Å²	152.5	78%	0.783	76%	0.763	S	S	*	*			trans	-164	133.2	140.9	-102.6	-51.3	176.3	0	0	113.3
552	K	35.4	Very low	32.1	Very low	175 Å²	175	152 Å²	152	76%	0.761	76%	0.762	S	S	*	*			trans	68.5	91.1	151.4	-64.3	175	-176.3	178.8	0	119.4	S554	K552-S554 PolarHBondContact O-N 3.25Å
553	K	30.6	Very low	32.2	Very low	203 Å²	203	150.5 Å²	150.5	88%	0.883	76%	0.764	S	S	*	*			trans	-52.9	127.6	149.8	-66.5	175.2	176.8	174.3	0	110.6
554	S	35.8	Very low	31.9	Very low	115 Å²	115	148.4 Å²	148.4	80%	0.804	77%	0.765	S	S	*	*			trans	-127.6	96.2	163.5	44.3	0	0	0	0	110.4	K552 K556	K552-S554 PolarHBondContact O-N 3.25Å; S554-K556 PolarHBondContact O-N 3.26Å
555	K	32.7	Very low	31.9	Very low	205 Å²	205	147 Å²	147	89%	0.891	76%	0.762	S	S	*	*			trans	-74.3	115.8	166.9	-76	-177.4	173.6	-176.8	0	109
556	K	37.2	Very low	31.8	Very low	183 Å²	183	146.5 Å²	146.5	80%	0.796	75%	0.754	S	S	*	*			trans	-175.1	137.7	146.4	-107.7	163.6	-174.5	178.9	0	113.3	S554	S554-K556 PolarHBondContact O-N 3.26Å
557	Q	31.8	Very low	31.9	Very low	165 Å²	165	149 Å²	149	77%	0.771	76%	0.762	S	S	*	*			trans	53.2	104.2	148.9	-67.6	161.3	-49.6	0	0	117.3
558	R	28.4	Very low	31.9	Very low	240 Å²	240	149.2 Å²	149.2	91%	0.906	78%	0.779	S	S	*	*				69.7	119.2	62.4	-159.7	-171.5	-162.9	-154.3	6.6	113.1
559	S	28.4	Very low	32.2	Very low	95 Å²	95	153.9 Å²	153.9	66%	0.664	79%	0.792	S	S	*	*			trans	88.5	126.3	155.7	102.1	0	0	0	0	120.1
560	I	28.9	Very low	32.3	Very low	142 Å²	142	151.8 Å²	151.8	73%	0.728	79%	0.79	S	S	*	*			trans	82.9	102.8	131.8	-65.6	165.9	0	0	0	118.8
561	L	29.2	Very low	32.7	Very low	153 Å²	153	155.5 Å²	155.5	80%	0.801	80%	0.795	S	S	*	*				54.6	150.5	127.7	-56.9	176.3	0	0	0	122.5
562	S	29	Very low	32.8	Very low	108 Å²	108	156.7 Å²	156.7	76%	0.755	80%	0.796	S	S	*	*			trans	83.8	105	147.1	-60.7	0	0	0	0	119.4
563	S	30.7	Very low	32.9	Very low	119 Å²	119	154.9 Å²	154.9	83%	0.832	80%	0.799	S	S	*	*				162	150.4	115.5	51	0	0	0	0	108.6
564	T	28	Very low	33.3	Very low	128 Å²	128	150.9 Å²	150.9	79%	0.785	80%	0.797	S	S	*	*	S	Bend	cis	-93.4	147.7	7.4	-4.4	0	0	0	0	110.5
565	V	30.4	Very low	33.2	Very low	114 Å²	114	150.5 Å²	150.5	69%	0.691	79%	0.794	S	S	*	*	S	Bend	cis	-148.2	126.4	41.3	176.2	0	0	0	0	112.5
566	H	32.7	Very low	33.3	Very low	152 Å²	152	152.8 Å²	152.8	70%	0.704	80%	0.797	S	S	*	*			trans	65.8	109.1	157.5	-64.7	-43.1	0	0	0	124.3
567	N	34.3	Very low	33.1	Very low	138 Å²	138	149 Å²	149	74%	0.738	79%	0.794	S	S	*	*				103.2	114	124.1	-63.7	-1.5	0	0	0	122.6
568	S	34.9	Very low	33.3	Very low	109 Å²	109	148.7 Å²	148.7	76%	0.762	80%	0.797	S	S	*	*			trans	77.3	101.8	139.9	49.3	0	0	0	0	124.3
569	Q	39	Very low	33.6	Very low	193 Å²	193	141.6 Å²	141.6	90%	0.902	79%	0.785	S	S	*	*			trans	70.5	127.9	132.4	-65.2	-169.6	-13.2	0	0	123.3
570	P	34.8	Very low	34	Very low	127 Å²	127	145 Å²	145	83%	0.825	79%	0.79	S	S	*	*			trans	-119.6	161	176.6	41.5	-32.1	0	0	0	116.4
571	R	39.3	Very low	34.3	Very low	242 Å²	242	144 Å²	144	91%	0.913	79%	0.791	S	S	*	*			trans	-157.2	109.1	159.7	-132.6	-179	-167.4	-165.1	3.8	117.3
572	K	37.4	Very low	34.7	Very low	184 Å²	184	148 Å²	148	80%	0.8	80%	0.795	S	S	*	*			trans	46.7	130.8	138.4	-76.6	-168.2	172.6	-174.4	0	125.6
573	V	38.7	Very low	34.8	Very low	138 Å²	138	147.9 Å²	147.9	84%	0.836	79%	0.794	S	S	*	*			trans	62.7	146	140.7	-51.9	0	0	0	0	120.1
574	S	37.3	Very low	35.1	Very low	118 Å²	118	147.5 Å²	147.5	83%	0.825	79%	0.791	S	S	*	*			cis	-165.2	168.9	33.2	-168.6	0	0	0	0	110.6
575	S	33.6	Very low	35.2	Very low	108 Å²	108	149.2 Å²	149.2	76%	0.755	80%	0.795	S	S	*	*			trans	-109.8	154.6	-172.6	49.5	0	0	0	0	114.7
576	R	36.8	Very low	35.5	Very low	252 Å²	252	153.5 Å²	153.5	95%	0.951	80%	0.804	S	S	*	*			trans	-162.6	139.4	152.3	-125.5	171	166.1	179.2	-7	112.9
577	S	32.2	Very low	35.5	Very low	104 Å²	104	152.2 Å²	152.2	73%	0.727	81%	0.807	S	S	*	*			trans	-99.3	-178	-175.6	-55.5	0	0	0	0	113.5
578	N	36.6	Very low	35.6	Very low	158 Å²	158	155.8 Å²	155.8	85%	0.845	81%	0.81	S	S	*	*			trans	102.3	146	166.6	-56.1	-5.8	0	0	0	113.8
579	S	33.3	Very low	35.5	Very low	91 Å²	91	157.8 Å²	157.8	64%	0.636	81%	0.812	S	S	*	*			cis	-176.1	165.5	-18.2	-178.1	0	0	0	0	108
580	Q	36.7	Very low	35.5	Very low	167 Å²	167	155.1 Å²	155.1	78%	0.78	80%	0.804	S	S	*	*			trans	70.4	119.7	156.1	-81.1	162.7	-56.1	0	0	122
581	V	35.7	Very low	35.3	Very low	122 Å²	122	153.7 Å²	153.7	74%	0.739	80%	0.797	S	S	*	*				71.2	109	126.5	-179.5	0	0	0	0	118.8
582	R	36.6	Very low	35	Very low	235 Å²	235	149.3 Å²	149.3	89%	0.887	79%	0.791	S	S	*	*				-159.4	124.1	116.7	-121.3	171.5	170.8	159.4	-3	113.6
583	S	32.6	Very low	34.9	Very low	106 Å²	106	145.8 Å²	145.8	74%	0.741	78%	0.781	S	S	*	*			trans	-74.7	145	156.5	45.4	0	0	0	0	110.2
584	S	36.6	Very low	34.7	Very low	111 Å²	111	146.4 Å²	146.4	78%	0.776	77%	0.773	S	S	*	*			trans	173.6	131.2	134	33.6	0	0	0	0	111.7
585	L	29.4	Very low	34.6	Very low	164 Å²	164	147 Å²	147	86%	0.859	77%	0.767	S	S	*	*			trans	-63.5	143.6	166.4	-79.4	73.4	0	0	0	110.2
586	K	36.3	Very low	34.5	Very low	204 Å²	204	148.2 Å²	148.2	89%	0.887	76%	0.76	S	S	*	*			trans	-154.6	100	141.2	-123.7	165.2	-174.9	170.7	0	112.1
587	V	34.2	Very low	34.4	Very low	126 Å²	126	145.8 Å²	145.8	76%	0.764	75%	0.752	S	S	*	*			trans	-60	133.9	160	174.4	0	0	0	0	107.9
588	R	35.3	Very low	34.7	Very low	213 Å²	213	147.8 Å²	147.8	80%	0.804	75%	0.75	S	S	*	*			trans	-134.5	96.3	171.6	-157.3	176.7	-166	151.2	4.2	110	N590	R588-N590 PolarHBondContact O-N 3.38Å
589	N	34.3	Very low	34.8	Very low	151 Å²	151	148.3 Å²	148.3	81%	0.807	75%	0.748	S	S	*	*			trans	-64.6	116.3	159.2	-79.8	-22.1	0	0	0	107.9
590	N	38	Very low	34.7	Very low	136 Å²	136	150.5 Å²	150.5	73%	0.727	75%	0.752	S	S	*	*			trans	-113.3	94.4	161.2	-86.4	16.8	0	0	0	107.5	R588	R588-N590 PolarHBondContact O-N 3.38Å
591	S	30.2	Very low	34.8	Very low	98 Å²	98	150.4 Å²	150.4	69%	0.685	76%	0.757	S	S	*	*			trans	-87.3	162.2	152.9	61.5	0	0	0	0	108.6
592	L	33.4	Very low	34.7	Very low	150 Å²	150	151.3 Å²	151.3	79%	0.785	76%	0.757	S	S	*	*			trans	77.5	145.9	172.8	-72.7	140.1	0	0	0	118.4
593	D	34.7	Very low	34.8	Very low	109 Å²	109	147.6 Å²	147.6	58%	0.583	75%	0.754	S	S	*	*			trans	72.6	135.3	155.7	-69	1.2	0	0	0	118.7
594	K	35.7	Very low	34.9	Very low	152 Å²	152	148.7 Å²	148.7	66%	0.661	75%	0.751	S	S	*	*			cis	-173.6	159.4	-13.3	-122.3	166.5	-161.4	133.5	0	106.8
595	N	34.8	Very low	35	Very low	131 Å²	131	152.4 Å²	152.4	70%	0.701	76%	0.756	S	S	*	*			trans	67.6	155	158.3	-60.1	12.6	0	0	0	115.6
596	E	31.2	Very low	35.2	Very low	132 Å²	132	151.3 Å²	151.3	62%	0.617	75%	0.746	S	S	*	*			cis	-175.9	178.7	-15.5	177.8	162.3	-149.5	0	0	106.2
597	Y	35.8	Very low	35.2	Very low	201 Å²	201	149.3 Å²	149.3	79%	0.788	75%	0.745	S	S	*	*			trans	73.3	144.6	179.3	-58	-93.9	0	0	0	117.9
598	H	38	Very low	35.3	Very low	146 Å²	146	150 Å²	150	68%	0.676	74%	0.739	S	S	*	*			cis	-174.4	166.8	-40.7	-119.1	-62.6	0	0	0	107.5
599	Q	37.4	Very low	35	Very low	170 Å²	170	145.8 Å²	145.8	79%	0.794	73%	0.732	S	S	*	*			trans	72.9	102.7	173.3	-60.1	169.5	-4	0	0	113.7
600	N	31.7	Very low	35.1	Very low	136 Å²	136	145 Å²	145	73%	0.727	73%	0.728	S	S	*	*				62.8	113.1	70	-63.9	-5.9	0	0	0	112.6
601	D	38.9	Very low	34.9	Very low	165 Å²	165	146.6 Å²	146.6	88%	0.882	73%	0.731	S	S	*	*				-155.3	142.6	109.4	-102.6	-26.4	0	0	0	112.8
602	N	33.1	Very low	35.3	Very low	141 Å²	141	150.6 Å²	150.6	75%	0.754	74%	0.739	S	S	*	*			trans	-84.1	134.3	-178.8	-70.2	-69.3	0	0	0	111
603	I	39.2	Very low	35.2	Very low	158 Å²	158	152 Å²	152	81%	0.81	74%	0.741	S	S	*	*			trans	-133.6	106.1	141.2	-60.5	-174.7	0	0	0	109.1
604	N	35.4	Very low	35.4	Very low	128 Å²	128	158.3 Å²	158.3	68%	0.684	76%	0.757	S	S	*	*			trans	-61.3	140.7	163.4	-85.4	-54	0	0	0	110.1
605	H	38.3	Very low	35.3	Very low	189 Å²	189	161.2 Å²	161.2	88%	0.875	76%	0.764	S	S	*	*			trans	-142.3	121.1	134	-94	-65.2	0	0	0	111.5
606	H	33.3	Very low	35.5	Very low	141 Å²	141	162.4 Å²	162.4	65%	0.653	77%	0.769	S	S	*	*			trans	-65	158.2	174.3	-116.7	38.8	0	0	0	112.7
607	N	36.2	Very low	35.8	Very low	162 Å²	162	163 Å²	163	87%	0.866	77%	0.772	S	S	*	*			trans	156.7	78.4	153	-80.6	-13.5	0	0	0	106.2
608	H	35.6	Very low	35.9	Very low	140 Å²	140	158.7 Å²	158.7	65%	0.648	77%	0.771	S	S	*	*				60.1	119.3	58.3	-143.8	-74	0	0	0	113.5
609	L	29.9	Very low	35.8	Very low	125 Å²	125	155.9 Å²	155.9	65%	0.654	77%	0.768	S	S	*	*			trans	4	144.8	166.2	-79.4	75.5	0	0	0	119.1
610	D	35.9	Very low	35.8	Very low	134 Å²	134	154.4 Å²	154.4	72%	0.717	77%	0.765	S	S	*	*				-164.8	160.7	68.2	-119.7	-37.4	0	0	0	117.8
611	H	35	Very low	36.1	Very low	170 Å²	170	153.9 Å²	153.9	79%	0.787	76%	0.762	S	S	*	*			trans	-78	144.5	161.2	-77.9	-89.2	0	0	0	110.2
612	H	37.1	Very low	36	Very low	183 Å²	183	156.3 Å²	156.3	85%	0.847	76%	0.759	S	S	*	*			trans	-153.9	124.9	147.8	-100.1	-51.4	0	0	0	114.9
613	E	32.4	Very low	36.2	Very low	180 Å²	180	160.1 Å²	160.1	84%	0.841	76%	0.763	S	S	*	*			trans	-76.4	138.6	170.5	-43.6	170	122	0	0	111.8
614	R	38.6	Very low	36.1	Very low	241 Å²	241	158.2 Å²	158.2	91%	0.909	76%	0.759	S	S	*	*			trans	-155.7	103.4	144.9	-61	-166.3	-175.4	-166.9	1.2	107.5
615	R	33.3	Very low	36	Very low	213 Å²	213	161.4 Å²	161.4	80%	0.804	77%	0.77	S	S	*	*				68.5	87.5	61.6	-166.5	-176.7	-176.2	165.8	3.8	114.6
616	L	38.5	Very low	35.8	Very low	156 Å²	156	155.5 Å²	155.5	82%	0.817	76%	0.76	S	S	*	*			trans	-148.1	111.3	147.1	-66.3	-179.5	0	0	0	106.9
617	H	39.2	Very low	35.8	Very low	144 Å²	144	153.9 Å²	153.9	67%	0.667	76%	0.764	S	S	*	*				55	122	99.7	-60.4	-62.8	0	0	0	113.2
618	S	36.1	Very low	35.9	Very low	110 Å²	110	154.5 Å²	154.5	77%	0.769	76%	0.762	S	S	*	*			cis	-167.2	174.2	25.5	-97.4	0	0	0	0	109.5
619	S	36.7	Very low	35.7	Very low	88 Å²	88	152.8 Å²	152.8	62%	0.615	77%	0.766	S	S	*	*			cis	-173.4	176.4	-7.7	48.7	0	0	0	0	110.1
620	N	37.7	Very low	36.1	Very low	138 Å²	138	152.8 Å²	152.8	74%	0.738	77%	0.773	S	S	*	*			trans	73	136.1	167.8	-54.6	-26.6	0	0	0	116.7
621	N	37.8	Very low	36.1	Very low	125 Å²	125	153.9 Å²	153.9	67%	0.668	78%	0.777	S	S	*	*			cis	-159.2	138.7	1	-121.4	-31.3	0	0	0	112.7
622	R	37.8	Very low	36.2	Very low	217 Å²	217	151.9 Å²	151.9	82%	0.819	77%	0.773	S	S	*	*			trans	50.8	119.7	148	-67.3	176.1	179.2	-158.3	-2.5	121
623	R	35.9	Very low	35.9	Very low	220 Å²	220	149.4 Å²	149.4	83%	0.83	77%	0.765	S	S	*	*				95.6	132.1	77.7	-157.6	-166.5	-178.1	-153.2	3.3	111
624	T	37.6	Very low	36.2	Very low	119 Å²	119	150.3 Å²	150.3	73%	0.73	77%	0.767	S	S	*	*			cis	-144.3	-175.9	21.5	-20	0	0	0	0	114.4
625	Q	32.9	Very low	35.9	Very low	195 Å²	195	149.1 Å²	149.1	91%	0.911	76%	0.762	S	S	*	*			trans	-87.2	170.5	179.4	-69.2	175	-25.4	0	0	117.5
626	G	33.7	Very low	36	Very low	64 Å²	64	146.2 Å²	146.2	66%	0.66	76%	0.762	S	S	*	*			trans	155.4	96.5	152.8	0	0	0	0	0	111.8
627	S	34.6	Very low	35.6	Very low	107 Å²	107	145.7 Å²	145.7	75%	0.748	76%	0.759	S	S	*	*				55.5	124.4	83	75.5	0	0	0	0	113
628	Q	36.8	Very low	35.3	Very low	175 Å²	175	146.2 Å²	146.2	82%	0.818	77%	0.765	S	S	*	*			cis	-159.6	176.7	16.8	-86.5	126.7	-61.8	0	0	107.9
629	S	32.8	Very low	35.3	Very low	105 Å²	105	149.8 Å²	149.8	73%	0.734	77%	0.767	S	S	*	*			cis	-167.9	156.8	-16.2	45.9	0	0	0	0	109.2
630	P	37.3	Very low	35.1	Very low	124 Å²	124	152.6 Å²	152.6	81%	0.805	78%	0.775	S	S	*	*			trans	-106	151.5	-172.3	38.6	-32.5	0	0	0	115.5
631	I	36.6	Very low	34.9	Very low	157 Å²	157	149.7 Å²	149.7	81%	0.805	77%	0.765	S	S	*	*			trans	-141.4	111.9	168.4	-68.1	-174.1	0	0	0	111.7
632	D	37.2	Very low	34.7	Very low	129 Å²	129	151.3 Å²	151.3	69%	0.69	77%	0.774	S	S	*	*			trans	60.3	119	136.6	-66.9	-1.7	0	0	0	126.6
633	N	31.1	Very low	34.5	Very low	130 Å²	130	149.3 Å²	149.3	70%	0.695	77%	0.768	S	S	*	*				70.7	106.2	122.3	-64	-38.9	0	0	0	121.8
634	K	37.1	Very low	34.3	Very low	199 Å²	199	146.8 Å²	146.8	87%	0.865	77%	0.771	S	S	*	*				-177.9	119.9	98.5	-98.4	164.9	-176.5	171.8	0	115.9
635	R	32.8	Very low	34	Very low	217 Å²	217	148.5 Å²	148.5	82%	0.819	76%	0.764	S	S	*	*			trans	22.9	117.7	146.1	-64.8	-177.1	-179.8	169.9	0.1	121.1
636	N	35.2	Very low	33.9	Very low	151 Å²	151	144.5 Å²	144.5	81%	0.807	76%	0.757	S	S	*	*				168.5	81.5	115.8	-83.4	-9.8	0	0	0	107.4
637	I	31.2	Very low	33.9	Very low	145 Å²	145	148.2 Å²	148.2	74%	0.744	76%	0.761	S	S	*	*				43.1	96.6	87.6	-51	-178.3	0	0	0	113.8
638	I	33.3	Very low	33.8	Very low	155 Å²	155	149.2 Å²	149.2	80%	0.795	75%	0.753	S	S	*	*			trans	-176.6	92.9	133.8	-86	149.7	0	0	0	101.9
639	K	35.2	Very low	33.3	Very low	185 Å²	185	145.4 Å²	145.4	80%	0.804	75%	0.746	S	S	*	*				40.7	97.9	89.3	-84.5	-164.4	173.1	-171.8	0	113.1
640	D	32.2	Very low	33.3	Very low	148 Å²	148	146.4 Å²	146.4	79%	0.791	75%	0.75	S	S	*	*			trans	174.4	102.2	136.6	-86.5	-8.3	0	0	0	106.2
641	S	34.4	Very low	33.1	Very low	76 Å²	76	146.1 Å²	146.1	53%	0.531	74%	0.741	S	S	.	*				83.2	128.8	85	74.2	0	0	0	0	112.1	Y643	S641-Y643 PolarHBondContact O-N 2.91Å
642	D	32.2	Very low	32.7	Very low	160 Å²	160	142.6 Å²	142.6	86%	0.856	73%	0.73	S	S	*	*			trans	-52	106.4	-176.2	-57.5	-85.1	0	0	0	113.7
643	Y	33.4	Very low	32.3	Very low	174 Å²	174	146 Å²	146	68%	0.682	74%	0.735	S	S	*	*			trans	-103.6	75.7	164.1	-91.3	-61.7	0	0	0	111.1	S641 R645	S641-Y643 PolarHBondContact O-N 2.91Å; Y643-R645 HydrophobicContact CD1-CB 3.78Å; Y643-R645 HydrophobicContact CD1-CG 3.75Å; Y643-R645 HydrophobicContact CE1-CG 4.16Å; Y643-R645 HydrophobicContact CG-CB 4.39Å; Y643-R645 PolarHBondContact O-N 3.28Å
644	N	31.8	Very low	32.3	Very low	168 Å²	168	148.1 Å²	148.1	90%	0.898	74%	0.738	S	S	*	*			trans	-63.6	70.2	140.8	-85.7	-41.7	0	0	0	108.5
645	R	32.6	Very low	32	Very low	154 Å²	154	144.6 Å²	144.6	58%	0.581	73%	0.728	S	S	*	*			trans	-93.3	113.3	175	-139.5	173.9	-165.5	-98.2	2.6	108.1	Y643 I647	Y643-R645 HydrophobicContact CD1-CB 3.78Å; Y643-R645 HydrophobicContact CD1-CG 3.75Å; Y643-R645 HydrophobicContact CE1-CG 4.16Å; Y643-R645 HydrophobicContact CG-CB 4.39Å; Y643-R645 PolarHBondContact O-N 3.28Å; R645-I647 PolarHBondContact O-N 2.92Å
646	S	29.5	Very low	32	Very low	111 Å²	111	139.6 Å²	139.6	78%	0.776	72%	0.717	S	S	*	*			trans	-56.3	105.8	160.5	-175.3	0	0	0	0	108.1	H648	S646-H648 PolarHBondContact O-N 3.37Å
647	I	33.9	Very low	31.8	Very low	142 Å²	142	140.9 Å²	140.9	73%	0.728	72%	0.716	S	S	*	*			trans	-88.4	90.6	173.7	-54	-177.8	0	0	0	106.9	R645	R645-I647 PolarHBondContact O-N 2.92Å
648	H	32.6	Very low	31.8	Very low	128 Å²	128	140.1 Å²	140.1	59%	0.593	71%	0.714	S	S	*	*			trans	37.6	115.6	150.1	-63.1	-78	0	0	0	118	S646	S646-H648 PolarHBondContact O-N 3.37Å
649	S	26.3	Very low	31.9	Very low	96 Å²	96	140.3 Å²	140.3	67%	0.671	72%	0.716	S	S	*	*			trans	-37.8	148.3	145.4	-41.7	0	0	0	0	111.2	I651	S649-I651 PolarHBondContact O-N 3.22Å
650	P	32.4	Very low	31.8	Very low	126 Å²	126	138.7 Å²	138.7	82%	0.818	71%	0.709	S	S	*	*			trans	-52	119.2	154.3	-14.8	28.4	0	0	0	106.4	S652	P650-S652 PolarHBondContact O-N 3.33Å; P650-S652 VanDerWaalsContact O-N 3.08Å
651	I	34.6	Very low	31.9	Very low	118 Å²	118	137.6 Å²	137.6	61%	0.605	71%	0.71	S	S	*	*			trans	-56.6	121.4	176.4	-75.6	169.3	0	0	0	106.4	S649 Y653	S649-I651 PolarHBondContact O-N 3.22Å; I651-Y653 VanDerWaalsContact C-N 3.33Å; I651-Y653 PolarHBondContact O-N 2.94Å
652	S	28	Very low	31.8	Very low	83 Å²	83	139.2 Å²	139.2	58%	0.58	71%	0.713	S	S	*	*			trans	-61	102.3	168.4	-169.1	0	0	0	0	106.8	P650 F654	P650-S652 PolarHBondContact O-N 3.33Å; P650-S652 VanDerWaalsContact O-N 3.08Å; S652-F654 PolarHBondContact O-N 3.06Å; S652-F654 WeakPolarHBondContact OG-CD2 3.44Å; S652-F654 VanDerWaalsContact OG-CE2 3.28Å; S652-F654 WeakPolarHBondContact OG-CE2 3.31Å
653	Y	28.7	Very low	31.8	Very low	200 Å²	200	142.2 Å²	142.2	78%	0.784	71%	0.714	S	S	*	*			trans	-71.3	78.1	160.7	-75.7	-80.3	0	0	0	107	I651 L655	I651-Y653 VanDerWaalsContact C-N 3.33Å; I651-Y653 PolarHBondContact O-N 2.94Å; Y653-L655 PolarHBondContact O-N 3.5Å
654	F	30.3	Very low	31.7	Very low	174 Å²	174	141.1 Å²	141.1	76%	0.763	72%	0.72	S	S	*	*			trans	-58.9	84.3	146.7	-78.1	-82.6	0	0	0	106.8	S652 D656	S652-F654 PolarHBondContact O-N 3.06Å; S652-F654 WeakPolarHBondContact OG-CD2 3.44Å; S652-F654 VanDerWaalsContact OG-CE2 3.28Å; S652-F654 WeakPolarHBondContact OG-CE2 3.31Å; F654-D656 PolarHBondContact O-N 3.29Å
655	L	31.7	Very low	31.8	Very low	125 Å²	125	142.2 Å²	142.2	65%	0.654	72%	0.72	S	S	*	*			trans	-71.5	88.6	149.3	-78.8	172.7	0	0	0	105.7	Y653 F657	Y653-L655 PolarHBondContact O-N 3.5Å; L655-F657 HydrophobicContact CB-CD2 3.92Å; L655-F657 HydrophobicContact CB-CE2 3.69Å; L655-F657 HydrophobicContact CB-CZ 4.5Å; L655-F657 HydrophobicContact CD1-CE2 3.97Å; L655-F657 HydrophobicContact CD1-CZ 4.33Å; L655-F657 HydrophobicContact CG-CE2 4.36Å; L655-F657 PolarHBondContact O-N 3.19Å
656	D	32.3	Very low	31.7	Very low	112 Å²	112	143.2 Å²	143.2	60%	0.599	73%	0.731	S	S	*	*			trans	-63.5	86.4	167.5	-140.3	-20.5	0	0	0	107	F654 N658	F654-D656 PolarHBondContact O-N 3.29Å; D656-N658 PolarHBondContact O-N 2.96Å; D656-N658 PolarHBondContact OD1-ND2 3.01Å
657	F	31.2	Very low	31.7	Very low	178 Å²	178	144.4 Å²	144.4	78%	0.781	74%	0.737	S	S	*	*			trans	-75.6	55	168.6	-78.7	-74.1	0	0	0	109.7	L655	L655-F657 HydrophobicContact CB-CD2 3.92Å; L655-F657 HydrophobicContact CB-CE2 3.69Å; L655-F657 HydrophobicContact CB-CZ 4.5Å; L655-F657 HydrophobicContact CD1-CE2 3.97Å; L655-F657 HydrophobicContact CD1-CZ 4.33Å; L655-F657 HydrophobicContact CG-CE2 4.36Å; L655-F657 PolarHBondContact O-N 3.19Å
658	N	31.5	Very low	31.5	Very low	130 Å²	130	143.2 Å²	143.2	70%	0.695	74%	0.737	S	S	*	*			trans	-111.6	21.7	170.9	-83.8	-54.1	0	0	0	111.5	D656 K660	D656-N658 PolarHBondContact O-N 2.96Å; D656-N658 PolarHBondContact OD1-ND2 3.01Å; N658-K660 PolarHBondContact O-N 2.71Å; N658-K660 VanDerWaalsContact O-N 3.14Å
659	D	35.4	Very low	31.3	Very low	158 Å²	158	143.9 Å²	143.9	85%	0.845	75%	0.745	S	S	*	*			trans	-79.3	88.6	161.5	-89.6	-26.1	0	0	0	109.7	P661	D659-P661 WeakPolarHBondContact O-CD 3.46Å
660	K	32.2	Very low	31.5	Very low	151 Å²	151	147.1 Å²	147.1	66%	0.657	75%	0.753	S	S	*	*			trans	-61.3	131.5	159.4	-73.8	-179.6	164.1	-162.1	0	109.8	N658 D662	N658-K660 PolarHBondContact O-N 2.71Å; N658-K660 VanDerWaalsContact O-N 3.14Å; K660-D662 WeakPolarHBondContact CD-OD2 3.4Å; K660-D662 IonicContact NZ-OD1 3.88Å; K660-D662 PolarHBondContact NZ-OD1 2.6Å; K660-D662 IonicContact NZ-OD2 2.68Å; K660-D662 PolarHBondContact NZ-OD2 2.66Å; K660-D662 PolarHBondContact O-N 2.98Å
661	P	34	Very low	31.3	Very low	126 Å²	126	150 Å²	150	82%	0.818	76%	0.755	S	S	*	*			trans	-76.4	74.6	151	33.1	-31.4	0	0	0	109.2	D659 Y663	D659-P661 WeakPolarHBondContact O-CD 3.46Å; P661-Y663 PolarHBondContact O-N 2.99Å
662	D	32.8	Very low	31.2	Very low	109 Å²	109	147.9 Å²	147.9	58%	0.583	75%	0.751	S	S	*	*			trans	-69.8	82.2	159.4	-88.8	-26.5	0	0	0	107.5	K660	K660-D662 WeakPolarHBondContact CD-OD2 3.4Å; K660-D662 IonicContact NZ-OD1 3.88Å; K660-D662 PolarHBondContact NZ-OD1 2.6Å; K660-D662 IonicContact NZ-OD2 2.68Å; K660-D662 PolarHBondContact NZ-OD2 2.66Å; K660-D662 PolarHBondContact O-N 2.98Å
663	Y	33.2	Very low	31.2	Very low	223 Å²	223	150.7 Å²	150.7	88%	0.875	76%	0.755	S	S	*	*			trans	-143.5	106.1	159	-108.3	-72.7	0	0	0	112.9	P661 Q665	P661-Y663 PolarHBondContact O-N 2.99Å; Y663-Q665 PolarHBondContact O-N 2.74Å
664	N	30.8	Very low	31.2	Very low	151 Å²	151	150.9 Å²	150.9	81%	0.807	76%	0.756	S	S	*	*			trans	-51	124	165.5	-68.2	-65.1	0	0	0	111.3
665	Q	34.5	Very low	31.2	Very low	192 Å²	192	146.4 Å²	146.4	90%	0.897	75%	0.746	S	S	*	*			trans	-145	122.7	148	-114.6	166.2	34.4	0	0	110.9	Y663 C667	Y663-Q665 PolarHBondContact O-N 2.74Å; Q665-C667 PolarHBondContact O-N 3.2Å
666	H	30.1	Very low	31	Very low	175 Å²	175	149.9 Å²	149.9	81%	0.81	76%	0.758	S	S	*	*			trans	-63	124.8	177.5	-65.6	-105	0	0	0	110.9
667	C	29.8	Very low	31	Very low	135 Å²	135	150.8 Å²	150.8	91%	0.912	76%	0.762	S	S	*	*			trans	-144.6	86.9	151.3	-96.9	0	0	0	0	109.6	Q665	Q665-C667 PolarHBondContact O-N 3.2Å
668	T	30.1	Very low	30.9	Very low	118 Å²	118	149.9 Å²	149.9	72%	0.724	77%	0.765	S	S	*	*			trans	-65.8	151.4	161.9	45.3	0	0	0	0	111.3
669	N	28.2	Very low	31	Very low	142 Å²	142	151.6 Å²	151.6	76%	0.759	77%	0.766	S	S	*	*			trans	59.5	99.5	162	-72	-17	0	0	0	119.1
670	L	30.3	Very low	30.8	Very low	163 Å²	163	151.7 Å²	151.7	85%	0.853	76%	0.761	S	S	*	*			trans	-138.3	86.2	137.9	-80.4	167.6	0	0	0	105.8
671	H	28.4	Very low	30.6	Very low	186 Å²	186	152 Å²	152	86%	0.861	77%	0.77	S	S	*	*				-23	92.2	70.4	-72.8	88.2	0	0	0	116.2
672	S	31.1	Very low	30.6	Very low	74 Å²	74	150.1 Å²	150.1	52%	0.517	77%	0.766	S	S	.	*			trans	-131	117	139.9	-170.2	0	0	0	0	108.1
673	E	28.7	Very low	30.6	Very low	142 Å²	142	152.1 Å²	152.1	66%	0.664	78%	0.776	S	S	*	*			trans	-47.7	137.3	151.3	-52.3	162.2	141.1	0	0	108.3
674	Y	28.7	Very low	30.2	Very low	204 Å²	204	147 Å²	147	80%	0.8	77%	0.773	S	S	*	*			trans	-128.5	95.5	145.1	-107.2	-83.5	0	0	0	108.5
675	C	29.7	Very low	30.5	Very low	81 Å²	81	145.1 Å²	145.1	55%	0.547	77%	0.769	S	S	.	*			trans	-53.7	152.5	167.9	-49.8	0	0	0	0	110.4	I677	C675-I677 PolarHBondContact O-N 3.11Å; C675-I677 VanDerWaalsContact O-N 3.1Å
676	H	28.2	Very low	30.5	Very low	197 Å²	197	141 Å²	141	91%	0.912	76%	0.757	S	S	*	*			trans	-48.8	118.4	157.6	-68.5	-80	0	0	0	110.2
677	I	32.3	Very low	30.3	Very low	132 Å²	132	143.3 Å²	143.3	68%	0.677	76%	0.76	S	S	*	*			trans	-127.1	93.6	159.1	-56.4	-177.9	0	0	0	107.4	C675 K679	C675-I677 PolarHBondContact O-N 3.11Å; C675-I677 VanDerWaalsContact O-N 3.1Å; I677-K679 PolarHBondContact O-N 2.97Å
678	N	28.2	Very low	30.5	Very low	159 Å²	159	143.3 Å²	143.3	85%	0.85	75%	0.75	S	S	*	*			trans	-58.1	115.5	154.3	-88.3	-22.4	0	0	0	108.5
679	K	34.6	Very low	30.3	Very low	166 Å²	166	146.4 Å²	146.4	72%	0.722	76%	0.756	S	S	*	*			trans	-170	102.4	148.5	-102.7	153	-175.3	-174	0	107	I677	I677-K679 PolarHBondContact O-N 2.97Å
680	Q	31.3	Very low	30.6	Very low	159 Å²	159	143 Å²	143	74%	0.743	74%	0.743	S	S	*	*				72	108.2	90.1	-78.4	-179.4	-31.5	0	0	112.3
681	N	28.5	Very low	30.7	Very low	158 Å²	158	142.9 Å²	142.9	85%	0.845	74%	0.738	S	S	*	*			trans	46.1	95.2	131.4	-53.9	-0.3	0	0	0	117.3
682	A	32.5	Very low	30.9	Very low	87 Å²	87	143.3 Å²	143.3	72%	0.719	73%	0.734	S	S	*	*			trans	-148.1	104.4	141.6	0	0	0	0	0	109.3
683	D	33	Very low	31.1	Very low	151 Å²	151	146.9 Å²	146.9	81%	0.807	74%	0.742	S	S	*	*			trans	49.4	99.1	140.4	-49.1	-32.9	0	0	0	119.9
684	S	26.1	Very low	31.4	Very low	114 Å²	114	146.3 Å²	146.3	80%	0.797	74%	0.744	S	S	*	*				11.9	157.5	115.5	-49.9	0	0	0	0	119.6
685	P	37.1	Very low	31.7	Very low	113 Å²	113	144.2 Å²	144.2	73%	0.734	75%	0.746	S	S	*	*				-130.8	-157.5	-56.6	37.9	-20.3	0	0	0	108.4
686	T	32.7	Very low	32	Very low	106 Å²	106	148.3 Å²	148.3	65%	0.65	76%	0.762	S	S	*	*				159	111.3	126.6	-65.9	0	0	0	0	110.1	I688	T686-I688 HydrophobicContact CG2-CG1 3.71Å; T686-I688 PolarHBondContact O-N 2.97Å
687	Y	26.4	Very low	32.3	Very low	223 Å²	223	144.4 Å²	144.4	88%	0.875	75%	0.754	S	S	*	*			trans	-74.3	109.7	160.1	-124	-100.2	0	0	0	107.4	H689	Y687-H689 PolarHBondContact O-N 2.81Å
688	I	33.7	Very low	32.3	Very low	134 Å²	134	147.7 Å²	147.7	69%	0.687	76%	0.763	S	S	*	*			trans	-86	103.7	171.2	-58.3	-179.9	0	0	0	107.8	T686	T686-I688 HydrophobicContact CG2-CG1 3.71Å; T686-I688 PolarHBondContact O-N 2.97Å
689	H	26.7	Very low	32.3	Very low	183 Å²	183	147.4 Å²	147.4	85%	0.847	76%	0.757	S	S	*	*			trans	-81.3	122.3	152.3	-99.2	-70.2	0	0	0	107.7	Y687	Y687-H689 PolarHBondContact O-N 2.81Å
690	S	33.8	Very low	32.2	Very low	72 Å²	72	149 Å²	149	50%	0.503	76%	0.764	S	S	.	*			trans	-146.6	119	169.8	56.3	0	0	0	0	109.9
691	E	32.5	Very low	32.1	Very low	159 Å²	159	148.1 Å²	148.1	74%	0.743	76%	0.76	S	S	*	*			trans	56.4	132.9	149.8	-62	132.8	-143	0	0	117.8
692	Y	32.6	Very low	32.3	Very low	195 Å²	195	145.8 Å²	145.8	77%	0.765	76%	0.756	S	S	*	*			cis	-133.7	128.9	37.7	-86.1	-104.6	0	0	0	111.1
693	E	34.7	Very low	32.4	Very low	149 Å²	149	147.2 Å²	147.2	70%	0.696	76%	0.756	S	S	*	*				68.3	105.4	96.6	-69	-164.1	149.6	0	0	116.1
694	D	35.3	Very low	32.1	Very low	131 Å²	131	147 Å²	147	70%	0.701	76%	0.755	S	S	*	*				46.8	111.1	123.1	-56.7	-6.1	0	0	0	120.1
695	N	36.2	Very low	32.5	Very low	160 Å²	160	147.9 Å²	147.9	86%	0.856	75%	0.75	S	S	*	*				-175.5	157.4	88.5	-96.3	-71.6	0	0	0	114.2
696	L	35.7	Very low	32.2	Very low	167 Å²	167	150.4 Å²	150.4	87%	0.874	75%	0.752	S	S	*	*			trans	-80.4	169.8	-165.5	-83.7	159.1	0	0	0	115.4
697	P	34.1	Very low	32.3	Very low	114 Å²	114	150.7 Å²	150.7	74%	0.74	75%	0.754	S	S	*	*			trans	-95.3	167.8	-152.2	38	-38.6	0	0	0	115.6
698	K	32	Very low	32.6	Very low	201 Å²	201	147.6 Å²	147.6	87%	0.874	75%	0.747	S	S	*	*			trans	-117	119.1	164.2	-82.9	-178	177	174	0	112.5
699	Q	28.9	Very low	32.5	Very low	153 Å²	153	146.4 Å²	146.4	72%	0.715	74%	0.742	S	S	*	*			trans	-86.4	135.3	171.7	-165	-179.8	5.9	0	0	109	H701	Q699-H701 PolarHBondContact NE2-NE2 3.35Å
700	F	32.9	Very low	32.9	Very low	199 Å²	199	144.4 Å²	144.4	87%	0.873	74%	0.738	S	S	*	*			trans	-141.7	122.3	159.2	-93.7	-71.7	0	0	0	111.3
701	H	29.3	Very low	32.8	Very low	142 Å²	142	145.8 Å²	145.8	66%	0.657	75%	0.747	S	S	*	*			trans	-84.5	157	175.2	-78.1	-93.1	0	0	0	112	Q699	Q699-H701 PolarHBondContact NE2-NE2 3.35Å
702	S	33.2	Very low	32.9	Very low	108 Å²	108	143.4 Å²	143.4	76%	0.755	75%	0.747	S	S	*	*			trans	179.5	106.6	133	-78.3	0	0	0	0	109.1
703	T	33	Very low	32.8	Very low	118 Å²	118	142 Å²	142	72%	0.724	75%	0.748	S	S	*	*				64	138.8	81.3	59.9	0	0	0	0	114
704	N	27.3	Very low	32.8	Very low	146 Å²	146	141.6 Å²	141.6	78%	0.781	75%	0.75	S	S	*	*			cis	174.4	-170.2	-11.8	-136.7	-23.8	0	0	0	105.3
705	L	33.8	Very low	32.7	Very low	132 Å²	132	143 Å²	143	69%	0.691	75%	0.753	S	S	*	*			trans	92.2	108.8	165	-51.2	164.4	0	0	0	116.2
706	Q	32.4	Very low	32.5	Very low	166 Å²	166	139.8 Å²	139.8	78%	0.776	74%	0.742	S	S	*	*				81.3	142	99	-74.2	174.4	-14.9	0	0	113.2
707	T	34	Very low	32.3	Very low	113 Å²	113	142.2 Å²	142.2	69%	0.693	74%	0.742	S	S	*	*			cis	-157.9	133.2	2.7	6.1	0	0	0	0	105
708	E	32.5	Very low	32.2	Very low	157 Å²	157	144 Å²	144	73%	0.734	75%	0.745	S	S	*	*				76.8	136.9	87.1	-147.5	-170.2	-114.5	0	0	115.9
709	N	32.6	Very low	32.4	Very low	110 Å²	110	144.4 Å²	144.4	59%	0.588	75%	0.746	S	S	*	*			trans	84.1	119.6	162.8	-56.3	-51.8	0	0	0	122.1
710	N	33.5	Very low	32.4	Very low	141 Å²	141	142.2 Å²	142.2	75%	0.754	75%	0.748	S	S	*	*				54.7	151.2	117.4	-47.4	-19.5	0	0	0	119.7
711	S	32.2	Very low	32.4	Very low	101 Å²	101	140 Å²	140	71%	0.706	74%	0.744	S	S	*	*			cis	-177.3	161.8	-6.9	42.9	0	0	0	0	109
712	C	34.5	Very low	32.6	Very low	109 Å²	109	142.6 Å²	142.6	74%	0.736	76%	0.756	S	S	*	*			trans	60.8	111.4	157.7	-64.3	0	0	0	0	120.8
713	E	30.2	Very low	32.6	Very low	166 Å²	166	142.4 Å²	142.4	78%	0.776	76%	0.755	S	S	*	*				46.9	156.5	109.9	-64.4	178.1	147.3	0	0	123
714	N	34.8	Very low	32.6	Very low	139 Å²	139	147.9 Å²	147.9	74%	0.743	76%	0.762	S	S	*	*			trans	75.5	141.9	170.1	-57.7	-12.5	0	0	0	116.8
715	E	34.2	Very low	32.9	Very low	162 Å²	162	151.8 Å²	151.8	76%	0.757	77%	0.766	S	S	*	*			cis	-165.6	156.2	-22.3	-128.5	178.4	153.6	0	0	109.2
716	S	31.9	Very low	32.9	Very low	92 Å²	92	151.9 Å²	151.9	64%	0.643	77%	0.767	S	S	*	*			trans	76.1	150.2	143	80.9	0	0	0	0	123.6
717	Y	31.7	Very low	32.9	Very low	218 Å²	218	151.4 Å²	151.4	86%	0.855	77%	0.77	S	S	*	*			trans	78.3	110.9	160.6	-69.2	-71.4	0	0	0	123.7
718	N	31.2	Very low	33	Very low	151 Å²	151	154.5 Å²	154.5	81%	0.807	78%	0.781	S	S	*	*			trans	-56.8	139.7	165.8	-63.7	-64.6	0	0	0	114.3
719	K	36.4	Very low	33	Very low	209 Å²	209	158.1 Å²	158.1	91%	0.909	79%	0.788	S	S	*	*				-169.3	152	122.2	-105.4	160.4	-174.7	176	0	112.7
720	S	29.5	Very low	33	Very low	107 Å²	107	157.6 Å²	157.6	75%	0.748	79%	0.79	S	S	*	*			trans	-43.8	142.4	172.9	-179.5	0	0	0	0	114.5
721	I	32.7	Very low	33.1	Very low	152 Å²	152	157.8 Å²	157.8	78%	0.779	79%	0.79	S	S	*	*			trans	170.5	134.2	130.4	-87.1	152.1	0	0	0	109.3	S723	I721-S723 PolarHBondContact O-N 3.38Å
722	H	34.2	Very low	33.1	Very low	198 Å²	198	160.6 Å²	160.6	92%	0.917	79%	0.792	S	S	*	*			trans	-69.5	107.9	168.5	-65.9	-39	0	0	0	111.4
723	S	31.6	Very low	33	Very low	104 Å²	104	162.2 Å²	162.2	73%	0.727	79%	0.788	S	S	*	*			trans	-176.8	165.9	150.1	-166.1	0	0	0	0	109.9	I721	I721-S723 PolarHBondContact O-N 3.38Å
724	R	34.1	Very low	33.2	Very low	233 Å²	233	159.2 Å²	159.2	88%	0.879	78%	0.783	S	S	*	*			trans	68.5	98.4	-169.1	-46.4	174.3	-176.6	-159.3	-0.1	111.1
725	R	32.7	Very low	33.2	Very low	228 Å²	228	160.8 Å²	160.8	86%	0.86	79%	0.791	S	S	*	*			cis	55.9	108.9	32.2	-143.7	175.9	-167.7	160.2	4.9	112.2
726	N	33.8	Very low	33.1	Very low	134 Å²	134	156.4 Å²	156.4	72%	0.717	78%	0.779	S	S	*	*			trans	66.9	101.5	169.1	-51.6	-9	0	0	0	116.2
727	N	33.7	Very low	33	Very low	156 Å²	156	157.7 Å²	157.7	83%	0.834	79%	0.788	S	S	*	*			trans	170.5	71	132.4	-85.3	-19.7	0	0	0	112.3
728	L	35.1	Very low	33	Very low	177 Å²	177	156.1 Å²	156.1	93%	0.927	79%	0.786	S	S	*	*			trans	-131.6	114.9	149.3	-75.8	178.7	0	0	0	107.1
729	R	32.3	Very low	33.1	Very low	233 Å²	233	157.6 Å²	157.6	88%	0.879	79%	0.788	S	S	*	*			trans	-71.6	143.2	-175.1	-72.2	-178.1	172.1	-160.6	-1	110.4	I731	R729-I731 PolarHBondContact O-N 2.7Å
730	P	32.6	Very low	32.8	Very low	99 Å²	99	158.2 Å²	158.2	64%	0.643	78%	0.784	S	S	*	*			trans	-72.3	118.4	170.2	30.1	-32	0	0	0	109.7	H732	P730-H732 PolarHBondContact O-N 2.93Å; P730-H732 VanDerWaalsContact O-N 3.12Å
731	I	35.6	Very low	32.9	Very low	145 Å²	145	161.4 Å²	161.4	74%	0.744	79%	0.793	S	S	*	*			trans	-75.3	99.3	163.8	-62.6	178.6	0	0	0	106.8	R729 H733	R729-I731 PolarHBondContact O-N 2.7Å; I731-H733 PolarHBondContact O-N 2.95Å; I731-H733 VanDerWaalsContact O-N 3.07Å
732	H	32.5	Very low	32.8	Very low	160 Å²	160	158.1 Å²	158.1	74%	0.741	78%	0.783	S	S	*	*			trans	-66.9	101.5	173.1	-88.4	-104.4	0	0	0	109.9	P730 P734	P730-H732 PolarHBondContact O-N 2.93Å; P730-H732 VanDerWaalsContact O-N 3.12Å; H732-P734 VanDerWaalsContact O-CD 3.27Å; H732-P734 WeakPolarHBondContact O-CD 3.46Å
733	H	31.2	Very low	32.8	Very low	143 Å²	143	155.2 Å²	155.2	66%	0.662	78%	0.775	S	S	*	*			trans	-89.3	104.8	155.8	-74.4	-74.3	0	0	0	108.7	I731	I731-H733 PolarHBondContact O-N 2.95Å; I731-H733 VanDerWaalsContact O-N 3.07Å
734	P	36	Very low	32.9	Very low	103 Å²	103	158.9 Å²	158.9	67%	0.669	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	148.1	164.8	29.1	-32.9	0	0	0	108.9	H732	H732-P734 VanDerWaalsContact O-CD 3.27Å; H732-P734 WeakPolarHBondContact O-CD 3.46Å
735	N	33.8	Very low	32.9	Very low	172 Å²	172	151.6 Å²	151.6	92%	0.92	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	83	11.3	-179.6	-46.2	-19	0	0	0	117.2
736	S	33.5	Very low	33.5	Very low	71 Å²	71	144.8 Å²	144.8	50%	0.497	76%	0.757	S	S	.	*			trans	-103.5	111.5	165.1	-172.1	0	0	0	0	111.2	F738	S736-F738 VanDerWaalsContact C-N 3.27Å; S736-F738 PolarHBondContact O-N 2.65Å; S736-F738 WeakPolarHBondContact OG-CD2 3.33Å; S736-F738 VanDerWaalsContact OG-CE2 3.28Å; S736-F738 WeakPolarHBondContact OG-CE2 3.35Å
737	S	29.7	Very low	34.4	Very low	119 Å²	119	140.3 Å²	140.3	83%	0.832	74%	0.743	S	S	*	*			trans	-78.1	70.1	179.7	62.3	0	0	0	0	112.2	H739	S737-H739 VanDerWaalsContact C-N 3.29Å; S737-H739 PolarHBondContact O-N 3.17Å
738	F	31.2	Very low	35.7	Very low	184 Å²	184	136.9 Å²	136.9	81%	0.807	73%	0.731	S	S	*	*			trans	-72.8	84.3	163.2	-79.7	-80	0	0	0	110.1	S736 R740	S736-F738 VanDerWaalsContact C-N 3.27Å; S736-F738 PolarHBondContact O-N 2.65Å; S736-F738 WeakPolarHBondContact OG-CD2 3.33Å; S736-F738 VanDerWaalsContact OG-CE2 3.28Å; S736-F738 WeakPolarHBondContact OG-CE2 3.35Å; F738-R740 PolarHBondContact O-N 2.83Å
739	H	32.6	Very low	36.9	Very low	183 Å²	183	133 Å²	133	85%	0.847	71%	0.711	S	S	*	*			trans	-68.7	127.7	155.6	-105.4	-80.9	0	0	0	108.7	S737	S737-H739 VanDerWaalsContact C-N 3.29Å; S737-H739 PolarHBondContact O-N 3.17Å
740	R	30.6	Very low	38.4	Very low	222 Å²	222	125.1 Å²	125.1	84%	0.838	69%	0.686	S	S	*	*			trans	-63.6	153.4	-173.3	-69.2	176.3	169.3	-172.4	-3.3	112.4	F738 S742	F738-R740 PolarHBondContact O-N 2.83Å; R740-S742 PolarHBondContact O-N 2.94Å
741	N	31.7	Very low	40.3	Very low	174 Å²	174	129.7 Å²	129.7	93%	0.93	69%	0.69	S	S	*	*	S	Bend	trans	-67.4	94.4	162.5	-66.3	-35.5	0	0	0	110.6
742	S	30.2	Very low	42.2	Very low	83 Å²	83	127.4 Å²	127.4	58%	0.58	68%	0.679	S	S	*	*			trans	-163.9	152.9	153.4	53.4	0	0	0	0	107.6	R740	R740-S742 PolarHBondContact O-N 2.94Å
743	D	35.1	Very low	44.4	Very low	137 Å²	137	126 Å²	126	73%	0.733	67%	0.667	S	S	*	*			trans	71.4	78.4	174	-43.1	-38.1	0	0	0	116.2	S745	D743-S745 PolarHBondContact O-N 2.92Å
744	L	32	Very low	46.6	Very low	180 Å²	180	127.5 Å²	127.5	94%	0.942	67%	0.667	S	S	*	*			trans	-69.3	65.7	152.6	-70.1	169.1	0	0	0	109.4
745	S	35.4	Very low	48.6	Very low	81 Å²	81	130 Å²	130	57%	0.566	66%	0.663	S	S	*	*			trans	-135.7	130	-170.3	-174.1	0	0	0	0	111.6	D743 G747	D743-S745 PolarHBondContact O-N 2.92Å; S745-G747 VanDerWaalsContact C-N 3.27Å; S745-G747 PolarHBondContact O-N 2.85Å
746	S	44.7	Very low	50.7	Low	85 Å²	85	124.3 Å²	124.3	59%	0.594	64%	0.636	S	S	*	*	S	Bend	trans	52.2	-58.2	176.5	64.9	0	0	0	0	118.5	S748 L749 D750	S746-S748 PolarHBondContact O-N 3.36Å; S746-L749 WeakPolarHBondContact O-CB 3.49Å; S746-L749 PolarHBondContact O-N 2.85Å; S746-D750 PolarHBondContact O-N 3.29Å; S746-D750 VanDerWaalsContact O-N 3.07Å
747	G	53.4	Low	52.7	Low	40 Å²	40	125.4 Å²	125.4	41%	0.412	63%	0.633	S	S	.	*	H	α-helix	trans	-64.5	-30.1	-166.3	0	0	0	0	0	115.6	S745 R751	S745-G747 VanDerWaalsContact C-N 3.27Å; S745-G747 PolarHBondContact O-N 2.85Å; G747-R751 WeakPolarHBondContact O-CB 3.39Å; G747-R751 PolarHBondContact O-N 2.93Å
748	S	61.1	Low	55	Low	83 Å²	83	122.3 Å²	122.3	58%	0.58	61%	0.612	S	S	*	*	H	α-helix	trans	-71.7	-36.1	174.4	67.5	0	0	0	0	111.9	S746 R751 L752	S746-S748 PolarHBondContact O-N 3.36Å; S748-R751 PolarHBondContact O-N 3.34Å; S748-L752 VanDerWaalsContact O-CB 3.3Å; S748-L752 WeakPolarHBondContact O-CB 3.35Å; S748-L752 PolarHBondContact O-N 2.73Å
749	L	60.5	Low	57.2	Low	97 Å²	97	117 Å²	117	51%	0.508	59%	0.591	S	S	.	*	H	α-helix	trans	-69.3	-44.8	177.3	-164.8	79.5	0	0	0	110.8	S746 R751 L752 R753	S746-L749 WeakPolarHBondContact O-CB 3.49Å; S746-L749 PolarHBondContact O-N 2.85Å; L749-R751 VanDerWaalsContact C-N 3.31Å; L749-R751 PolarHBondContact O-N 2.89Å; L749-L752 PolarHBondContact O-N 2.87Å; L749-R753 WeakPolarHBondContact O-CB 3.47Å; L749-R753 PolarHBondContact O-N 3.3Å
750	D	63.7	Low	59.2	Low	66 Å²	66	113.8 Å²	113.8	35%	0.353	58%	0.576	S	S	.	*	H	α-helix	trans	-68.9	-29.6	176.8	-73.7	-33.2	0	0	0	112.9	S746 R753 R754	S746-D750 PolarHBondContact O-N 3.29Å; S746-D750 VanDerWaalsContact O-N 3.07Å; D750-R753 IonicContact OD1-NH1 3.39Å; D750-R753 PolarHBondContact OD1-NH1 2.86Å; D750-R754 VanDerWaalsContact O-CB 3.31Å; D750-R754 WeakPolarHBondContact O-CB 3.39Å; D750-R754 WeakPolarHBondContact O-CG 3.32Å; D750-R754 PolarHBondContact O-N 3.44Å; D750-R754 PolarHBondContact O-NE 3.39Å
751	R	72.4	Confident	61.4	Low	196 Å²	196	111.7 Å²	111.7	74%	0.74	57%	0.568	S	S	*	*	H	α-helix	trans	-72.7	-37.6	171.9	-170.3	175.9	179.2	-163.8	-0.8	111.4	G747 S748 L749 R755	G747-R751 WeakPolarHBondContact O-CB 3.39Å; G747-R751 PolarHBondContact O-N 2.93Å; S748-R751 PolarHBondContact O-N 3.34Å; L749-R751 VanDerWaalsContact C-N 3.31Å; L749-R751 PolarHBondContact O-N 2.89Å; R751-R755 WeakPolarHBondContact O-CB 3.49Å; R751-R755 PolarHBondContact O-N 2.84Å
752	L	75.8	Confident	63.5	Low	96 Å²	96	109 Å²	109	50%	0.503	55%	0.55	S	S	.	.	H	α-helix	trans	-65.9	-48.1	172.7	-177.8	63.1	0	0	0	111.1	S748 L749 R754 R755 C756	S748-L752 VanDerWaalsContact O-CB 3.3Å; S748-L752 WeakPolarHBondContact O-CB 3.35Å; S748-L752 PolarHBondContact O-N 2.73Å; L749-L752 PolarHBondContact O-N 2.87Å; L752-R754 PolarHBondContact O-N 2.94Å; L752-R755 CarbonylContact O-C 3.55Å; L752-R755 WeakPolarHBondContact O-CA 3.33Å; L752-R755 WeakPolarHBondContact O-CB 3.33Å; L752-R755 PolarHBondContact O-N 3.39Å; L752-C756 PolarHBondContact O-N 3.42Å; L752-C756 PolarHBondContact O-SG 3.16Å
753	R	77.5	Confident	65.6	Low	130 Å²	130	109.7 Å²	109.7	49%	0.491	55%	0.547	S	S	.	.	H	α-helix	trans	-60.3	-44.9	178.3	-164	-174.6	-68.5	154.2	-6.7	111.5	L749 D750 R755 C756 H757	L749-R753 WeakPolarHBondContact O-CB 3.47Å; L749-R753 PolarHBondContact O-N 3.3Å; D750-R753 IonicContact OD1-NH1 3.39Å; D750-R753 PolarHBondContact OD1-NH1 2.86Å; R753-R755 VanDerWaalsContact C-N 3.32Å; R753-R755 PolarHBondContact O-N 2.99Å; R753-C756 PolarHBondContact O-N 3.24Å; R753-H757 PolarHBondContact O-N 3.2Å
754	R	76.9	Confident	67	Low	176 Å²	176	104.2 Å²	104.2	66%	0.664	52%	0.523	S	S	*	.	H	α-helix	trans	-61.7	-36.4	171.4	-80	-175.6	-77.6	176.2	-10.4	113.1	D750 L752 S758	D750-R754 VanDerWaalsContact O-CB 3.31Å; D750-R754 WeakPolarHBondContact O-CB 3.39Å; D750-R754 WeakPolarHBondContact O-CG 3.32Å; D750-R754 PolarHBondContact O-N 3.44Å; D750-R754 PolarHBondContact O-NE 3.39Å; L752-R754 PolarHBondContact O-N 2.94Å; R754-S758 PolarHBondContact O-N 2.99Å
755	R	79.4	Confident	68.9	Low	154 Å²	154	98.8 Å²	98.8	58%	0.581	50%	0.498	S	S	*	.	H	α-helix	trans	-67.7	-42.3	174.9	-169.9	-178.9	-179.6	-161.2	0	111.4	R751 L752 R753 S758 I759	R751-R755 WeakPolarHBondContact O-CB 3.49Å; R751-R755 PolarHBondContact O-N 2.84Å; L752-R755 CarbonylContact O-C 3.55Å; L752-R755 WeakPolarHBondContact O-CA 3.33Å; L752-R755 WeakPolarHBondContact O-CB 3.33Å; L752-R755 PolarHBondContact O-N 3.39Å; R753-R755 VanDerWaalsContact C-N 3.32Å; R753-R755 PolarHBondContact O-N 2.99Å; R755-S758 WeakPolarHBondContact O-CB 3.41Å; R755-S758 PolarHBondContact O-N 3.07Å; R755-S758 VanDerWaalsContact O-N 3.14Å; R755-I759 HydrophobicContact CG-CD1 4.06Å; R755-I759 WeakPolarHBondContact O-CG1 3.35Å; R755-I759 PolarHBondContact O-N 2.94Å
756	C	77.5	Confident	70.4	Confident	53 Å²	53	99.2 Å²	99.2	36%	0.358	49%	0.492	S	S	.	.	H	α-helix	trans	-58.6	-50.3	173.7	-63.4	0	0	0	0	111.3	L752 R753 S758 I759 E760	L752-C756 PolarHBondContact O-N 3.42Å; L752-C756 PolarHBondContact O-SG 3.16Å; R753-C756 PolarHBondContact O-N 3.24Å; C756-S758 PolarHBondContact O-N 3.41Å; C756-I759 PolarHBondContact O-N 2.78Å; C756-E760 WeakPolarHBondContact O-CG 3.47Å; C756-E760 PolarHBondContact O-N 3.06Å
757	H	75.3	Confident	71.1	Confident	95 Å²	95	101.1 Å²	101.1	44%	0.44	49%	0.492	S	S	.	.	H	α-helix	trans	-66.2	-17.7	175.6	-63.5	-25.1	0	0	0	114.5	R753 E760 R761	R753-H757 PolarHBondContact O-N 3.2Å; H757-E760 WeakPolarHBondContact CA-OE2 3.47Å; H757-E760 IonicContact CE1-OE2 2.72Å; H757-E760 IonicContact CG-OE2 2.63Å; H757-E760 IonicContact ND1-OE2 3.45Å; H757-E760 PolarHBondContact ND1-OE2 3.46Å; H757-R761 WeakPolarHBondContact O-CG 3.37Å; H757-R761 PolarHBondContact O-N 3.14Å; H757-R761 PolarHBondContact O-NE 3.45Å
758	S	78.7	Confident	71.4	Confident	54 Å²	54	107.2 Å²	107.2	38%	0.378	50%	0.502	S	S	.	.	H	α-helix	trans	-76.4	-45.7	169.2	-155.7	0	0	0	0	110.7	R754 R755 C756 R761 E762	R754-S758 PolarHBondContact O-N 2.99Å; R755-S758 WeakPolarHBondContact O-CB 3.41Å; R755-S758 PolarHBondContact O-N 3.07Å; R755-S758 VanDerWaalsContact O-N 3.14Å; C756-S758 PolarHBondContact O-N 3.41Å; S758-R761 PolarHBondContact O-N 2.82Å; S758-E762 PolarHBondContact O-N 2.83Å
759	I	76.8	Confident	71.1	Confident	72 Å²	72	107.2 Å²	107.2	37%	0.369	50%	0.496	S	S	.	.	H	α-helix	trans	-65.7	-39.9	177.9	-66.1	164	0	0	0	110.9	R755 C756 R761 E762 L763	R755-I759 HydrophobicContact CG-CD1 4.06Å; R755-I759 WeakPolarHBondContact O-CG1 3.35Å; R755-I759 PolarHBondContact O-N 2.94Å; C756-I759 PolarHBondContact O-N 2.78Å; I759-R761 VanDerWaalsContact C-N 3.29Å; I759-R761 PolarHBondContact O-N 3.37Å; I759-E762 PolarHBondContact O-N 2.97Å; I759-L763 HydrophobicContact CG2-CD1 3.91Å; I759-L763 HydrophobicContact CG2-CG 4.26Å; I759-L763 WeakPolarHBondContact O-CB 3.46Å; I759-L763 VanDerWaalsContact O-CG 3.27Å; I759-L763 WeakPolarHBondContact O-CG 3.46Å; I759-L763 PolarHBondContact O-N 3.3Å
760	E	75.4	Confident	70.8	Confident	116 Å²	116	109.6 Å²	109.6	54%	0.542	50%	0.502	S	S	.	.	H	α-helix	trans	-61.3	-37.7	174.4	-72.9	165.6	166.4	0	0	111.8	C756 H757 G764	C756-E760 WeakPolarHBondContact O-CG 3.47Å; C756-E760 PolarHBondContact O-N 3.06Å; H757-E760 WeakPolarHBondContact CA-OE2 3.47Å; H757-E760 IonicContact CE1-OE2 2.72Å; H757-E760 IonicContact CG-OE2 2.63Å; H757-E760 IonicContact ND1-OE2 3.45Å; H757-E760 PolarHBondContact ND1-OE2 3.46Å; E760-G764 PolarHBondContact O-N 3.1Å
761	R	76.2	Confident	70	Confident	178 Å²	178	114.2 Å²	114.2	67%	0.672	52%	0.516	S	S	*	.	H	α-helix	trans	-71.3	-42.7	174.9	-76.8	-177.2	-68.8	174.8	4.8	112.4	H757 S758 I759 G764 T765	H757-R761 WeakPolarHBondContact O-CG 3.37Å; H757-R761 PolarHBondContact O-N 3.14Å; H757-R761 PolarHBondContact O-NE 3.45Å; S758-R761 PolarHBondContact O-N 2.82Å; I759-R761 VanDerWaalsContact C-N 3.29Å; I759-R761 PolarHBondContact O-N 3.37Å; R761-G764 PolarHBondContact O-N 3.23Å; R761-T765 PolarHBondContact O-N 3.27Å; R761-T765 PolarHBondContact O-OG1 3.19Å
762	E	74.7	Confident	69	Low	116 Å²	116	111.4 Å²	111.4	54%	0.542	51%	0.511	S	S	.	.	H	α-helix	trans	-62.9	-39.6	173.9	-76.7	-177.6	144.5	0	0	112.4	S758 I759 T765 I766	S758-E762 PolarHBondContact O-N 2.83Å; I759-E762 PolarHBondContact O-N 2.97Å; E762-T765 WeakPolarHBondContact CA-OG1 3.4Å; E762-T765 PolarHBondContact O-N 3.35Å; E762-T765 PolarHBondContact O-OG1 3.23Å; E762-I766 WeakPolarHBondContact O-CB 3.35Å; E762-I766 WeakPolarHBondContact O-CD1 3.35Å; E762-I766 WeakPolarHBondContact O-CG1 3.4Å; E762-I766 PolarHBondContact O-N 3.01Å
763	L	74.5	Confident	67.6	Low	98 Å²	98	114.5 Å²	114.5	51%	0.513	52%	0.523	S	S	.	.	H	α-helix	trans	-66.3	-41.4	174.9	-71.8	173.6	0	0	0	111.2	I759 T765 I766 E767	I759-L763 HydrophobicContact CG2-CD1 3.91Å; I759-L763 HydrophobicContact CG2-CG 4.26Å; I759-L763 WeakPolarHBondContact O-CB 3.46Å; I759-L763 VanDerWaalsContact O-CG 3.27Å; I759-L763 WeakPolarHBondContact O-CG 3.46Å; I759-L763 PolarHBondContact O-N 3.3Å; L763-T765 VanDerWaalsContact C-N 3.35Å; L763-T765 PolarHBondContact O-N 2.98Å; L763-I766 PolarHBondContact O-N 3.38Å; L763-E767 WeakPolarHBondContact O-CB 3.43Å; L763-E767 PolarHBondContact O-N 2.86Å
764	G	65.9	Low	66	Low	23 Å²	23	112.8 Å²	112.8	24%	0.237	53%	0.527	C	S	.	.	H	α-helix	trans	-66.1	-30.7	174.8	0	0	0	0	0	114.1	E760 R761 R768	E760-G764 PolarHBondContact O-N 3.1Å; R761-G764 PolarHBondContact O-N 3.23Å; G764-R768 WeakPolarHBondContact O-CG 3.42Å; G764-R768 PolarHBondContact O-N 2.76Å
765	T	70.9	Confident	64.4	Low	66 Å²	66	111.8 Å²	111.8	41%	0.405	53%	0.534	S	S	.	.	H	α-helix	trans	-75.3	-43.8	170.3	52.5	0	0	0	0	111.4	R761 E762 L763 E767 R768 D769	R761-T765 PolarHBondContact O-N 3.27Å; R761-T765 PolarHBondContact O-OG1 3.19Å; E762-T765 WeakPolarHBondContact CA-OG1 3.4Å; E762-T765 PolarHBondContact O-N 3.35Å; E762-T765 PolarHBondContact O-OG1 3.23Å; L763-T765 VanDerWaalsContact C-N 3.35Å; L763-T765 PolarHBondContact O-N 2.98Å; T765-E767 PolarHBondContact O-N 3.35Å; T765-R768 CarbonylContact O-C 3.57Å; T765-R768 PolarHBondContact O-N 2.94Å; T765-R768 VanDerWaalsContact O-N 3.07Å; T765-D769 WeakPolarHBondContact O-CB 3.49Å; T765-D769 PolarHBondContact O-N 2.92Å
766	I	67.4	Low	62.3	Low	89 Å²	89	108.7 Å²	108.7	46%	0.456	54%	0.536	S	S	.	.	H	α-helix	trans	-61.8	-33.2	176.9	-68.3	162.4	0	0	0	111.8	E762 L763 K770	E762-I766 WeakPolarHBondContact O-CB 3.35Å; E762-I766 WeakPolarHBondContact O-CD1 3.35Å; E762-I766 WeakPolarHBondContact O-CG1 3.4Å; E762-I766 PolarHBondContact O-N 3.01Å; L763-I766 PolarHBondContact O-N 3.38Å; I766-K770 WeakPolarHBondContact O-CB 3.47Å; I766-K770 WeakPolarHBondContact O-CG 3.39Å; I766-K770 PolarHBondContact O-N 2.94Å
767	E	59.4	Low	60.5	Low	125 Å²	125	112.8 Å²	112.8	58%	0.584	55%	0.554	S	S	*	*	H	α-helix	trans	-66.9	-48.3	172.2	-166.9	162.8	-142.9	0	0	110.9	L763 T765 K770 Y771	L763-E767 WeakPolarHBondContact O-CB 3.43Å; L763-E767 PolarHBondContact O-N 2.86Å; T765-E767 PolarHBondContact O-N 3.35Å; E767-K770 PolarHBondContact O-N 2.9Å; E767-Y771 HydrophobicContact CG-CD2 4.3Å; E767-Y771 HydrophobicContact CG-CE2 4.07Å; E767-Y771 WeakPolarHBondContact O-CD2 3.42Å; E767-Y771 PolarHBondContact O-N 3.43Å
768	R	58.8	Low	58.7	Low	168 Å²	168	114.3 Å²	114.3	63%	0.634	57%	0.573	S	S	*	*	H	α-helix	trans	-62.5	-46.7	174.9	-76.4	-169.8	-179.2	108.7	0.2	113.7	G764 T765 K770 Y771 E772	G764-R768 WeakPolarHBondContact O-CG 3.42Å; G764-R768 PolarHBondContact O-N 2.76Å; T765-R768 CarbonylContact O-C 3.57Å; T765-R768 PolarHBondContact O-N 2.94Å; T765-R768 VanDerWaalsContact O-N 3.07Å; R768-K770 PolarHBondContact O-N 3.35Å; R768-Y771 CarbonylContact O-C 3.56Å; R768-Y771 WeakPolarHBondContact O-CA 3.42Å; R768-Y771 PolarHBondContact O-N 3.39Å; R768-E772 PolarHBondContact O-N 3.46Å
769	D	56.3	Low	57.3	Low	83 Å²	83	118.9 Å²	118.9	44%	0.444	59%	0.592	S	S	.	*	H	α-helix	trans	-60.6	-33.8	-179	-63.9	-22.1	0	0	0	111.1	T765 Q773	T765-D769 WeakPolarHBondContact O-CB 3.49Å; T765-D769 PolarHBondContact O-N 2.92Å; D769-Q773 WeakPolarHBondContact O-CB 3.37Å; D769-Q773 PolarHBondContact O-N 3.13Å
770	K	52.5	Low	55.7	Low	147 Å²	147	121 Å²	121	64%	0.639	61%	0.61	S	S	*	*	H	α-helix	trans	-70.5	-30.7	171.9	-79.7	-172.3	173.4	-164.9	0	113.7	I766 E767 R768 T774	I766-K770 WeakPolarHBondContact O-CB 3.47Å; I766-K770 WeakPolarHBondContact O-CG 3.39Å; I766-K770 PolarHBondContact O-N 2.94Å; E767-K770 PolarHBondContact O-N 2.9Å; R768-K770 PolarHBondContact O-N 3.35Å; K770-T774 WeakPolarHBondContact O-CG2 3.48Å; K770-T774 PolarHBondContact O-OG1 2.88Å
771	Y	47.6	Very low	54.8	Low	163 Å²	163	119.3 Å²	119.3	64%	0.639	61%	0.611	S	S	*	*	H	α-helix	trans	-81	-29	173.6	-79.2	-66.7	0	0	0	113.1	E767 R768 T774	E767-Y771 HydrophobicContact CG-CD2 4.3Å; E767-Y771 HydrophobicContact CG-CE2 4.07Å; E767-Y771 WeakPolarHBondContact O-CD2 3.42Å; E767-Y771 PolarHBondContact O-N 3.43Å; R768-Y771 CarbonylContact O-C 3.56Å; R768-Y771 WeakPolarHBondContact O-CA 3.42Å; R768-Y771 PolarHBondContact O-N 3.39Å; Y771-T774 PolarHBondContact O-OG1 3.48Å
772	E	50.8	Low	54.1	Low	137 Å²	137	113.4 Å²	113.4	64%	0.64	59%	0.593	S	S	*	*	H	α-helix	trans	-83.6	-32.6	178	-70.7	-174.7	-174.5	0	0	112.8	R768 T774	R768-E772 PolarHBondContact O-N 3.46Å; E772-T774 VanDerWaalsContact C-N 3.32Å; E772-T774 PolarHBondContact O-N 3.15Å
773	Q	47	Very low	54.2	Low	162 Å²	162	111 Å²	111	76%	0.757	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-8	172.8	-72.4	-172.3	-0.7	0	0	114.8	D769	D769-Q773 WeakPolarHBondContact O-CB 3.37Å; D769-Q773 PolarHBondContact O-N 3.13Å
774	T	45.1	Very low	53.9	Low	94 Å²	94	115.1 Å²	115.1	58%	0.577	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	2.7	178.5	45.2	0	0	0	0	114.6	K770 Y771 E772 S776	K770-T774 WeakPolarHBondContact O-CG2 3.48Å; K770-T774 PolarHBondContact O-OG1 2.88Å; Y771-T774 PolarHBondContact O-OG1 3.48Å; E772-T774 VanDerWaalsContact C-N 3.32Å; E772-T774 PolarHBondContact O-N 3.15Å; T774-S776 PolarHBondContact O-N 2.96Å
775	L	42.8	Very low	54.4	Low	154 Å²	154	118 Å²	118	81%	0.806	61%	0.608	S	S	*	*	S	Bend	trans	-76.4	-2.8	174.4	-75.7	166.5	0	0	0	114.2
776	S	35.8	Very low	54.5	Low	89 Å²	89	118.7 Å²	118.7	62%	0.622	61%	0.609	S	S	*	*	S	Bend	trans	-118.5	102.8	171.8	60.8	0	0	0	0	111.5	T774	T774-S776 PolarHBondContact O-N 2.96Å
777	N	38	Very low	54.9	Low	139 Å²	139	117 Å²	117	74%	0.743	61%	0.608	S	S	*	*			trans	66.5	122.6	178	-56.9	-33.7	0	0	0	115.8	I779	N777-I779 PolarHBondContact O-N 3.31Å
778	P	38.6	Very low	55.9	Low	128 Å²	128	116.2 Å²	116.2	83%	0.831	61%	0.608	S	S	*	*			trans	-70.9	98.9	169.7	30.4	-32.4	0	0	0	109.1
779	I	48.4	Very low	57	Low	150 Å²	150	112.4 Å²	112.4	77%	0.769	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-58.2	125.3	162.2	-60.3	175.8	0	0	0	106	N777 S781	N777-I779 PolarHBondContact O-N 3.31Å; I779-S781 PolarHBondContact O-N 3.08Å; I779-S781 VanDerWaalsContact O-N 3.08Å
780	P	44.6	Very low	58.2	Low	117 Å²	117	110.5 Å²	110.5	76%	0.76	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-56.2	121.1	-178.2	22.2	-32.9	0	0	0	108.9	D782	P780-D782 PolarHBondContact O-N 3.02Å
781	S	54.6	Low	59.7	Low	79 Å²	79	105.6 Å²	105.6	55%	0.552	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-62	122.6	-171	54.8	0	0	0	0	109.7	I779 P783 D786	I779-S781 PolarHBondContact O-N 3.08Å; I779-S781 VanDerWaalsContact O-N 3.08Å; S781-P783 VanDerWaalsContact O-CD 3.28Å; S781-P783 WeakPolarHBondContact O-CD 3.31Å; S781-P783 VanDerWaalsContact O-N 3.16Å; S781-D786 VanDerWaalsContact CB-OD2 3.26Å; S781-D786 WeakPolarHBondContact CB-OD2 3.4Å; S781-D786 PolarHBondContact OG-OD2 2.87Å
782	D	63.5	Low	61.5	Low	55 Å²	55	101.5 Å²	101.5	29%	0.294	57%	0.573	S	S	.	*	P	Polyproline II helix	trans	-64.1	116.8	175.1	-178.7	-22.9	0	0	0	107	P780 R784 V785 D786	P780-D782 PolarHBondContact O-N 3.02Å; D782-R784 PolarHBondContact O-N 3.25Å; D782-R784 WeakPolarHBondContact OD1-CB 3.39Å; D782-R784 VanDerWaalsContact OD1-CG 3.29Å; D782-R784 WeakPolarHBondContact OD1-CG 3.31Å; D782-R784 IonicContact OD1-CZ 2.97Å; D782-R784 PolarHBondContact OD1-N 3.5Å; D782-R784 IonicContact OD1-NE 3.85Å; D782-R784 PolarHBondContact OD1-NE 2.93Å; D782-R784 IonicContact OD1-NH2 2.66Å; D782-R784 IonicContact OD2-CZ 2.96Å; D782-R784 VanDerWaalsContact OD2-CZ 3.29Å; D782-R784 IonicContact OD2-NE 3.29Å; D782-R784 PolarHBondContact OD2-NE 3.34Å; D782-R784 VanDerWaalsContact OD2-NE 3.09Å; D782-R784 IonicContact OD2-NH2 2.6Å; D782-R784 PolarHBondContact OD2-NH2 3.32Å; D782-V785 HydrophobicContact CB-CB 4.37Å; D782-V785 HydrophobicContact CB-CG2 3.95Å; D782-V785 WeakPolarHBondContact O-CA 3.32Å; D782-V785 WeakPolarHBondContact O-CB 3.42Å; D782-V785 PolarHBondContact O-N 2.8Å; D782-D786 PolarHBondContact O-N 3.42Å
783	P	74.7	Confident	63.2	Low	64 Å²	64	104.6 Å²	104.6	42%	0.416	58%	0.578	S	S	.	*	H	α-helix	trans	-60.5	-18.3	-175.3	23.5	-33.8	0	0	0	112.4	S781 A787	S781-P783 VanDerWaalsContact O-CD 3.28Å; S781-P783 WeakPolarHBondContact O-CD 3.31Å; S781-P783 VanDerWaalsContact O-N 3.16Å; P783-A787 WeakPolarHBondContact O-CB 3.43Å; P783-A787 PolarHBondContact O-N 2.85Å
784	R	69.8	Low	65.1	Low	186 Å²	186	100.8 Å²	100.8	70%	0.702	56%	0.563	S	S	*	*	H	α-helix	trans	-71.4	-34.9	172	-56.1	174.6	-66.6	-176.6	2.3	112.2	D782 L788	D782-R784 PolarHBondContact O-N 3.25Å; D782-R784 WeakPolarHBondContact OD1-CB 3.39Å; D782-R784 VanDerWaalsContact OD1-CG 3.29Å; D782-R784 WeakPolarHBondContact OD1-CG 3.31Å; D782-R784 IonicContact OD1-CZ 2.97Å; D782-R784 PolarHBondContact OD1-N 3.5Å; D782-R784 IonicContact OD1-NE 3.85Å; D782-R784 PolarHBondContact OD1-NE 2.93Å; D782-R784 IonicContact OD1-NH2 2.66Å; D782-R784 IonicContact OD2-CZ 2.96Å; D782-R784 VanDerWaalsContact OD2-CZ 3.29Å; D782-R784 IonicContact OD2-NE 3.29Å; D782-R784 PolarHBondContact OD2-NE 3.34Å; D782-R784 VanDerWaalsContact OD2-NE 3.09Å; D782-R784 IonicContact OD2-NH2 2.6Å; D782-R784 PolarHBondContact OD2-NH2 3.32Å; R784-L788 WeakPolarHBondContact O-CB 3.19Å; R784-L788 PolarHBondContact O-N 3.45Å
785	V	75.6	Confident	67.2	Low	82 Å²	82	101.1 Å²	101.1	50%	0.497	56%	0.56	S	S	.	*	H	α-helix	trans	-71.6	-41.4	175.9	176.7	0	0	0	0	110.2	D782 L788 T789	D782-V785 HydrophobicContact CB-CB 4.37Å; D782-V785 HydrophobicContact CB-CG2 3.95Å; D782-V785 WeakPolarHBondContact O-CA 3.32Å; D782-V785 WeakPolarHBondContact O-CB 3.42Å; D782-V785 PolarHBondContact O-N 2.8Å; V785-L788 PolarHBondContact O-N 2.85Å; V785-T789 VanDerWaalsContact O-CB 3.28Å; V785-T789 WeakPolarHBondContact O-CB 3.47Å; V785-T789 PolarHBondContact O-N 3.05Å; V785-T789 PolarHBondContact O-OG1 3.45Å
786	D	73.3	Confident	69.4	Low	81 Å²	81	102.3 Å²	102.3	43%	0.433	55%	0.554	S	S	.	*	H	α-helix	trans	-65.5	-45.9	176	-67.8	-18.9	0	0	0	111.1	S781 D782 L788 T789 S790	S781-D786 VanDerWaalsContact CB-OD2 3.26Å; S781-D786 WeakPolarHBondContact CB-OD2 3.4Å; S781-D786 PolarHBondContact OG-OD2 2.87Å; D782-D786 PolarHBondContact O-N 3.42Å; D786-L788 PolarHBondContact O-N 2.79Å; D786-T789 PolarHBondContact O-N 3.21Å; D786-S790 WeakPolarHBondContact O-CB 3.41Å; D786-S790 PolarHBondContact O-N 2.83Å
787	A	76	Confident	72	Confident	53 Å²	53	103 Å²	103	44%	0.438	55%	0.547	S	S	.	.	H	α-helix	trans	-61.2	-42.7	174.6	0	0	0	0	0	112.7	P783 T789 S790 A791	P783-A787 WeakPolarHBondContact O-CB 3.43Å; P783-A787 PolarHBondContact O-N 2.85Å; A787-T789 VanDerWaalsContact C-N 3.35Å; A787-S790 PolarHBondContact O-N 2.87Å; A787-A791 VanDerWaalsContact O-CB 3.31Å; A787-A791 WeakPolarHBondContact O-CB 3.45Å; A787-A791 PolarHBondContact O-N 3.33Å
788	L	80.7	Confident	74.4	Confident	109 Å²	109	104.1 Å²	104.1	57%	0.571	54%	0.541	S	S	*	.	H	α-helix	trans	-67.5	-35.1	176.7	-175.9	63.5	0	0	0	112	R784 V785 D786 N792	R784-L788 WeakPolarHBondContact O-CB 3.19Å; R784-L788 PolarHBondContact O-N 3.45Å; V785-L788 PolarHBondContact O-N 2.85Å; D786-L788 PolarHBondContact O-N 2.79Å; L788-N792 WeakPolarHBondContact O-CB 3.47Å; L788-N792 PolarHBondContact O-N 3.17Å; L788-N792 PolarHBondContact O-ND2 3.39Å
789	T	81	Confident	77	Confident	89 Å²	89	103.7 Å²	103.7	55%	0.546	53%	0.531	S	S	.	.	H	α-helix	trans	-69.2	-43.9	176.4	-59	0	0	0	0	110.8	V785 D786 A787 N792 R793	V785-T789 VanDerWaalsContact O-CB 3.28Å; V785-T789 WeakPolarHBondContact O-CB 3.47Å; V785-T789 PolarHBondContact O-N 3.05Å; V785-T789 PolarHBondContact O-OG1 3.45Å; D786-T789 PolarHBondContact O-N 3.21Å; A787-T789 VanDerWaalsContact C-N 3.35Å; T789-N792 PolarHBondContact O-N 3.02Å; T789-R793 PolarHBondContact O-N 3.33Å
790	S	82	Confident	79.1	Confident	43 Å²	43	103 Å²	103	30%	0.301	52%	0.52	S	S	.	.	H	α-helix	trans	-61.4	-47.2	173.2	-175.2	0	0	0	0	112	D786 A787 N792 R793 I794	D786-S790 WeakPolarHBondContact O-CB 3.41Å; D786-S790 PolarHBondContact O-N 2.83Å; A787-S790 PolarHBondContact O-N 2.87Å; S790-N792 VanDerWaalsContact C-N 3.35Å; S790-N792 PolarHBondContact O-N 3.3Å; S790-R793 WeakPolarHBondContact O-CB 3.46Å; S790-R793 PolarHBondContact O-N 2.9Å; S790-R793 VanDerWaalsContact O-N 3.12Å; S790-I794 WeakPolarHBondContact O-CG1 3.36Å; S790-I794 PolarHBondContact O-N 3.1Å
791	A	83.5	Confident	81.2	Confident	43 Å²	43	100.7 Å²	100.7	36%	0.355	50%	0.501	S	S	.	.	H	α-helix	trans	-59	-43.1	175.6	0	0	0	0	0	112.3	A787 I794 L795	A787-A791 VanDerWaalsContact O-CB 3.31Å; A787-A791 WeakPolarHBondContact O-CB 3.45Å; A787-A791 PolarHBondContact O-N 3.33Å; A791-I794 PolarHBondContact O-N 2.94Å; A791-L795 WeakPolarHBondContact O-CB 3.27Å; A791-L795 VanDerWaalsContact O-CG 3.3Å; A791-L795 WeakPolarHBondContact O-CG 3.26Å; A791-L795 PolarHBondContact O-N 3.28Å
792	N	85.4	Confident	83	Confident	77 Å²	77	101.4 Å²	101.4	41%	0.412	50%	0.497	S	S	.	.	H	α-helix	trans	-64.6	-37.1	174.9	-83.6	-60.4	0	0	0	112.8	L788 T789 S790 L795 R796	L788-N792 WeakPolarHBondContact O-CB 3.47Å; L788-N792 PolarHBondContact O-N 3.17Å; L788-N792 PolarHBondContact O-ND2 3.39Å; T789-N792 PolarHBondContact O-N 3.02Å; S790-N792 VanDerWaalsContact C-N 3.35Å; S790-N792 PolarHBondContact O-N 3.3Å; N792-L795 PolarHBondContact O-N 2.97Å; N792-R796 WeakPolarHBondContact O-CB 3.38Å; N792-R796 VanDerWaalsContact O-CG 3.32Å; N792-R796 WeakPolarHBondContact O-CG 3.41Å; N792-R796 PolarHBondContact O-N 2.88Å
793	R	86.2	Confident	84.3	Confident	202 Å²	202	103.7 Å²	103.7	76%	0.762	51%	0.507	S	S	*	.	H	α-helix	trans	-63.9	-45.1	174.3	-173.3	178.3	179.2	-180	-0.3	111.4	T789 S790 R796 Q797	T789-R793 PolarHBondContact O-N 3.33Å; S790-R793 WeakPolarHBondContact O-CB 3.46Å; S790-R793 PolarHBondContact O-N 2.9Å; S790-R793 VanDerWaalsContact O-N 3.12Å; R793-R796 PolarHBondContact O-N 3.31Å; R793-Q797 PolarHBondContact O-N 3.45Å
794	I	87.7	Confident	85	Confident	83 Å²	83	105.9 Å²	105.9	43%	0.426	51%	0.509	S	S	.	.	H	α-helix	trans	-64.2	-40.8	176.6	-65.9	165.9	0	0	0	111.2	S790 A791 Q797 R798	S790-I794 WeakPolarHBondContact O-CG1 3.36Å; S790-I794 PolarHBondContact O-N 3.1Å; A791-I794 PolarHBondContact O-N 2.94Å; I794-Q797 PolarHBondContact O-N 2.98Å; I794-R798 WeakPolarHBondContact O-CG 3.29Å; I794-R798 PolarHBondContact O-N 3.34Å
795	L	90	Very high	86	Confident	100 Å²	100	101.4 Å²	101.4	52%	0.524	50%	0.503	S	S	.	.	H	α-helix	trans	-63.7	-42.7	175.5	-75	170.3	0	0	0	112	A791 N792 R798 L799	A791-L795 WeakPolarHBondContact O-CB 3.27Å; A791-L795 VanDerWaalsContact O-CG 3.3Å; A791-L795 WeakPolarHBondContact O-CG 3.26Å; A791-L795 PolarHBondContact O-N 3.28Å; N792-L795 PolarHBondContact O-N 2.97Å; L795-R798 PolarHBondContact O-N 3.13Å; L795-L799 WeakPolarHBondContact O-CB 3.29Å; L795-L799 VanDerWaalsContact O-CG 3.3Å; L795-L799 WeakPolarHBondContact O-CG 3.3Å; L795-L799 PolarHBondContact O-N 2.9Å
796	R	88.7	Confident	86.6	Confident	179 Å²	179	103.5 Å²	103.5	68%	0.675	51%	0.507	S	S	*	.	H	α-helix	trans	-62.3	-42.9	174.8	-74.4	173.5	-178.6	-88.1	2.9	112.1	N792 R793 L799 Y800	N792-R796 WeakPolarHBondContact O-CB 3.38Å; N792-R796 VanDerWaalsContact O-CG 3.32Å; N792-R796 WeakPolarHBondContact O-CG 3.41Å; N792-R796 PolarHBondContact O-N 2.88Å; R793-R796 PolarHBondContact O-N 3.31Å; R796-L799 PolarHBondContact O-N 2.96Å; R796-Y800 PolarHBondContact O-N 3.02Å
797	Q	89	Confident	87.4	Confident	103 Å²	103	104.4 Å²	104.4	48%	0.481	51%	0.509	S	S	.	.	H	α-helix	trans	-61.2	-48.7	175.2	-173.8	60.1	50.8	0	0	111.4	R793 I794 L799 Y800 D801	R793-Q797 PolarHBondContact O-N 3.45Å; I794-Q797 PolarHBondContact O-N 2.98Å; Q797-L799 VanDerWaalsContact C-N 3.31Å; Q797-L799 PolarHBondContact O-N 3.24Å; Q797-Y800 WeakPolarHBondContact O-CB 3.46Å; Q797-Y800 PolarHBondContact O-N 3.09Å; Q797-Y800 VanDerWaalsContact O-N 3.14Å; Q797-D801 PolarHBondContact NE2-OD1 3.39Å; Q797-D801 PolarHBondContact O-N 3.4Å
798	R	89.3	Confident	88	Confident	164 Å²	164	106.8 Å²	106.8	62%	0.619	51%	0.514	S	S	*	.	H	α-helix	trans	-62	-36.6	178	-73.5	-178.8	177.6	-168.1	0.1	113	I794 L795 D801 I802	I794-R798 WeakPolarHBondContact O-CG 3.29Å; I794-R798 PolarHBondContact O-N 3.34Å; L795-R798 PolarHBondContact O-N 3.13Å; R798-D801 PolarHBondContact O-N 2.93Å; R798-I802 WeakPolarHBondContact O-CB 3.16Å; R798-I802 WeakPolarHBondContact O-CD1 3.22Å; R798-I802 WeakPolarHBondContact O-CG1 3.48Å; R798-I802 PolarHBondContact O-N 3.37Å
799	L	93.2	Very high	88.5	Confident	118 Å²	118	110.1 Å²	110.1	62%	0.618	52%	0.519	S	S	*	.	H	α-helix	trans	-64	-42.4	174.4	-75.8	167.1	0	0	0	111.6	L795 R796 Q797 I802 Q803	L795-L799 WeakPolarHBondContact O-CB 3.29Å; L795-L799 VanDerWaalsContact O-CG 3.3Å; L795-L799 WeakPolarHBondContact O-CG 3.3Å; L795-L799 PolarHBondContact O-N 2.9Å; R796-L799 PolarHBondContact O-N 2.96Å; Q797-L799 VanDerWaalsContact C-N 3.31Å; Q797-L799 PolarHBondContact O-N 3.24Å; L799-I802 PolarHBondContact O-N 3.01Å; L799-Q803 WeakPolarHBondContact O-CB 3.46Å; L799-Q803 PolarHBondContact O-N 3.49Å
800	Y	92.5	Very high	88.9	Confident	137 Å²	137	111.7 Å²	111.7	54%	0.537	52%	0.52	S	S	.	.	H	α-helix	trans	-63.5	-44.2	174.5	179.1	-99.1	0	0	0	112.3	R796 Q797 I802 Q803 K804	R796-Y800 PolarHBondContact O-N 3.02Å; Q797-Y800 WeakPolarHBondContact O-CB 3.46Å; Q797-Y800 PolarHBondContact O-N 3.09Å; Q797-Y800 VanDerWaalsContact O-N 3.14Å; Y800-I802 VanDerWaalsContact C-N 3.34Å; Y800-I802 PolarHBondContact O-N 3.12Å; Y800-Q803 PolarHBondContact O-N 3.3Å; Y800-K804 WeakPolarHBondContact O-CB 3.27Å; Y800-K804 PolarHBondContact O-N 2.91Å
801	D	88.7	Confident	89.3	Confident	68 Å²	68	116.1 Å²	116.1	36%	0.364	54%	0.536	S	S	.	.	H	α-helix	trans	-65	-37.7	178.3	-60	-28.3	0	0	0	111.8	Q797 R798 T805	Q797-D801 PolarHBondContact NE2-OD1 3.39Å; Q797-D801 PolarHBondContact O-N 3.4Å; R798-D801 PolarHBondContact O-N 2.93Å; D801-T805 WeakPolarHBondContact O-CB 3.28Å; D801-T805 PolarHBondContact O-N 3.45Å; D801-T805 PolarHBondContact O-OG1 3.31Å
802	I	91.8	Very high	89.5	Confident	93 Å²	93	116.9 Å²	116.9	48%	0.477	54%	0.542	S	S	.	.	H	α-helix	trans	-65.7	-45.4	173.5	-71.4	165.1	0	0	0	110.8	R798 L799 Y800 T805 Q806	R798-I802 WeakPolarHBondContact O-CB 3.16Å; R798-I802 WeakPolarHBondContact O-CD1 3.22Å; R798-I802 WeakPolarHBondContact O-CG1 3.48Å; R798-I802 PolarHBondContact O-N 3.37Å; L799-I802 PolarHBondContact O-N 3.01Å; Y800-I802 VanDerWaalsContact C-N 3.34Å; Y800-I802 PolarHBondContact O-N 3.12Å; I802-T805 WeakPolarHBondContact O-CB 3.32Å; I802-T805 PolarHBondContact O-N 2.89Å; I802-Q806 WeakPolarHBondContact O-CG 3.39Å; I802-Q806 PolarHBondContact O-N 3.07Å
803	Q	91.3	Very high	89.7	Confident	104 Å²	104	117.2 Å²	117.2	49%	0.486	54%	0.544	S	S	.	.	H	α-helix	trans	-60	-49.2	177.3	-175.8	-175.8	-31.3	0	0	111	L799 Y800 T805 Q806 E807	L799-Q803 WeakPolarHBondContact O-CB 3.46Å; L799-Q803 PolarHBondContact O-N 3.49Å; Y800-Q803 PolarHBondContact O-N 3.3Å; Q803-T805 PolarHBondContact O-N 2.94Å; Q803-Q806 WeakPolarHBondContact O-CA 3.38Å; Q803-Q806 WeakPolarHBondContact O-CB 3.37Å; Q803-Q806 PolarHBondContact O-N 2.95Å; Q803-E807 WeakPolarHBondContact CG-OE1 3.47Å; Q803-E807 PolarHBondContact NE2-OE1 3.21Å; Q803-E807 PolarHBondContact O-N 2.96Å
804	K	90.4	Very high	89.9	Confident	109 Å²	109	112 Å²	112	47%	0.474	53%	0.531	S	S	.	.	H	α-helix	trans	-58.8	-34.8	175.7	-173.3	177.1	-178.9	-178.9	0	112.6	Y800 N808	Y800-K804 WeakPolarHBondContact O-CB 3.27Å; Y800-K804 PolarHBondContact O-N 2.91Å; K804-N808 WeakPolarHBondContact O-CB 3.37Å; K804-N808 VanDerWaalsContact O-CG 3.23Å; K804-N808 PolarHBondContact O-N 3.08Å; K804-N808 PolarHBondContact O-ND2 3.31Å
805	T	90.2	Very high	90.2	Very high	92 Å²	92	114 Å²	114	56%	0.564	54%	0.536	S	S	*	.	H	α-helix	trans	-70.5	-34.8	174.9	-57.2	0	0	0	0	112	D801 I802 Q803 R809	D801-T805 WeakPolarHBondContact O-CB 3.28Å; D801-T805 PolarHBondContact O-N 3.45Å; D801-T805 PolarHBondContact O-OG1 3.31Å; I802-T805 WeakPolarHBondContact O-CB 3.32Å; I802-T805 PolarHBondContact O-N 2.89Å; Q803-T805 PolarHBondContact O-N 2.94Å; T805-R809 WeakPolarHBondContact O-CB 3.43Å; T805-R809 PolarHBondContact O-N 3.36Å
806	Q	88.4	Confident	90.1	Very high	126 Å²	126	111.5 Å²	111.5	59%	0.589	53%	0.53	S	S	*	.	H	α-helix	trans	-68	-46.1	173.4	-71.2	175.6	-5.5	0	0	111.5	I802 Q803 N808 R809 E810	I802-Q806 WeakPolarHBondContact O-CG 3.39Å; I802-Q806 PolarHBondContact O-N 3.07Å; Q803-Q806 WeakPolarHBondContact O-CA 3.38Å; Q803-Q806 WeakPolarHBondContact O-CB 3.37Å; Q803-Q806 PolarHBondContact O-N 2.95Å; Q806-N808 PolarHBondContact O-N 2.98Å; Q806-R809 WeakPolarHBondContact O-CB 3.12Å; Q806-R809 PolarHBondContact O-N 2.91Å; Q806-R809 VanDerWaalsContact O-N 3.12Å; Q806-E810 PolarHBondContact O-N 2.91Å
807	E	88.5	Confident	90.1	Very high	101 Å²	101	108.3 Å²	108.3	47%	0.472	52%	0.523	S	S	.	.	H	α-helix	trans	-58.9	-45.8	175.8	-69.6	168	-170.2	0	0	111.7	Q803 R809 E810 H811	Q803-E807 WeakPolarHBondContact CG-OE1 3.47Å; Q803-E807 PolarHBondContact NE2-OE1 3.21Å; Q803-E807 PolarHBondContact O-N 2.96Å; E807-R809 VanDerWaalsContact C-N 3.31Å; E807-R809 PolarHBondContact O-N 3.37Å; E807-E810 PolarHBondContact O-N 2.82Å; E807-H811 PolarHBondContact O-N 3.44Å
808	N	89.4	Confident	90.2	Very high	102 Å²	102	110.3 Å²	110.3	55%	0.545	53%	0.532	S	S	.	.	H	α-helix	trans	-61.3	-38.1	174.4	-76	-23.9	0	0	0	112.6	K804 Q806 A812	K804-N808 WeakPolarHBondContact O-CB 3.37Å; K804-N808 VanDerWaalsContact O-CG 3.23Å; K804-N808 PolarHBondContact O-N 3.08Å; K804-N808 PolarHBondContact O-ND2 3.31Å; Q806-N808 PolarHBondContact O-N 2.98Å; N808-A812 WeakPolarHBondContact O-CB 3.38Å; N808-A812 PolarHBondContact O-N 3.42Å
809	R	91	Very high	90.3	Very high	180 Å²	180	108.2 Å²	108.2	68%	0.679	53%	0.531	S	S	*	.	H	α-helix	trans	-68.5	-40.9	177.2	-178.4	179.3	177.8	179.1	-0.2	111.5	T805 Q806 E807 A812 L813	T805-R809 WeakPolarHBondContact O-CB 3.43Å; T805-R809 PolarHBondContact O-N 3.36Å; Q806-R809 WeakPolarHBondContact O-CB 3.12Å; Q806-R809 PolarHBondContact O-N 2.91Å; Q806-R809 VanDerWaalsContact O-N 3.12Å; E807-R809 VanDerWaalsContact C-N 3.31Å; E807-R809 PolarHBondContact O-N 3.37Å; R809-A812 PolarHBondContact O-N 3.31Å; R809-L813 HydrophobicContact CG-CD1 4.12Å; R809-L813 WeakPolarHBondContact O-CB 3.47Å; R809-L813 VanDerWaalsContact O-CG 3.31Å; R809-L813 WeakPolarHBondContact O-CG 3.41Å; R809-L813 PolarHBondContact O-N 2.71Å
810	E	90.3	Very high	90.2	Very high	122 Å²	122	106.5 Å²	106.5	57%	0.57	53%	0.525	S	S	*	.	H	α-helix	trans	-62.9	-46.3	175.7	-172.6	175.5	169.5	0	0	111	Q806 E807 A812 L813 N814	Q806-E810 PolarHBondContact O-N 2.91Å; E807-E810 PolarHBondContact O-N 2.82Å; E810-A812 VanDerWaalsContact C-N 3.33Å; E810-A812 PolarHBondContact O-N 3.47Å; E810-L813 PolarHBondContact O-N 2.92Å; E810-N814 WeakPolarHBondContact O-CB 3.49Å; E810-N814 VanDerWaalsContact O-CG 3.25Å; E810-N814 PolarHBondContact O-N 3.23Å; E810-N814 PolarHBondContact O-ND2 3.38Å
811	H	89.2	Confident	90.1	Very high	136 Å²	136	104.9 Å²	104.9	63%	0.63	53%	0.526	S	S	*	.	H	α-helix	trans	-58.8	-42.2	174.3	-176.2	-73	0	0	0	112.5	E807 K815	E807-H811 PolarHBondContact O-N 3.44Å; H811-K815 PolarHBondContact O-N 2.83Å; H811-K815 VanDerWaalsContact O-N 3.09Å
812	A	87.7	Confident	90.2	Very high	58 Å²	58	103.1 Å²	103.1	48%	0.479	52%	0.524	S	S	.	.	H	α-helix	trans	-65.7	-40.6	176.8	0	0	0	0	0	112.7	N808 R809 E810 A816	N808-A812 WeakPolarHBondContact O-CB 3.38Å; N808-A812 PolarHBondContact O-N 3.42Å; R809-A812 PolarHBondContact O-N 3.31Å; E810-A812 VanDerWaalsContact C-N 3.33Å; E810-A812 PolarHBondContact O-N 3.47Å; A812-A816 WeakPolarHBondContact O-CB 3.39Å; A812-A816 PolarHBondContact O-N 2.55Å
813	L	90.4	Very high	90.2	Very high	85 Å²	85	103.4 Å²	103.4	45%	0.445	53%	0.526	S	S	.	.	H	α-helix	trans	-66.2	-43.7	175.6	-72.9	170.7	0	0	0	111.6	R809 E810 K815 A816 H817	R809-L813 HydrophobicContact CG-CD1 4.12Å; R809-L813 WeakPolarHBondContact O-CB 3.47Å; R809-L813 VanDerWaalsContact O-CG 3.31Å; R809-L813 WeakPolarHBondContact O-CG 3.41Å; R809-L813 PolarHBondContact O-N 2.71Å; E810-L813 PolarHBondContact O-N 2.92Å; L813-K815 VanDerWaalsContact C-N 3.34Å; L813-K815 PolarHBondContact O-N 2.88Å; L813-A816 WeakPolarHBondContact O-CB 3.5Å; L813-A816 PolarHBondContact O-N 3.37Å; L813-A816 VanDerWaalsContact O-N 3.13Å; L813-H817 PolarHBondContact O-CD2 2.88Å; L813-H817 PolarHBondContact O-N 3.34Å
814	N	90.6	Very high	90.1	Very high	92 Å²	92	103.4 Å²	103.4	49%	0.492	53%	0.529	S	S	.	.	H	α-helix	trans	-60.5	-43	177.5	-70.6	-18.1	0	0	0	111.6	E810 A816 H817 E818	E810-N814 WeakPolarHBondContact O-CB 3.49Å; E810-N814 VanDerWaalsContact O-CG 3.25Å; E810-N814 PolarHBondContact O-N 3.23Å; E810-N814 PolarHBondContact O-ND2 3.38Å; N814-A816 PolarHBondContact O-N 3.46Å; N814-H817 PolarHBondContact O-N 2.85Å; N814-E818 PolarHBondContact O-N 2.78Å
815	K	92.6	Very high	90.1	Very high	124 Å²	124	103.5 Å²	103.5	54%	0.539	53%	0.534	S	S	.	.	H	α-helix	trans	-63.5	-39.1	173.7	-172.4	178.2	-179.4	-177.5	0	112.5	H811 L813 E818 M819	H811-K815 PolarHBondContact O-N 2.83Å; H811-K815 VanDerWaalsContact O-N 3.09Å; L813-K815 VanDerWaalsContact C-N 3.34Å; L813-K815 PolarHBondContact O-N 2.88Å; K815-E818 PolarHBondContact O-N 2.79Å; K815-M819 WeakPolarHBondContact O-CG 3.3Å; K815-M819 PolarHBondContact O-N 3.27Å
816	A	88.1	Confident	90.1	Very high	48 Å²	48	105.8 Å²	105.8	40%	0.397	54%	0.537	S	S	.	.	H	α-helix	trans	-66	-40.7	175.8	0	0	0	0	0	111.9	A812 L813 N814 M819 V820	A812-A816 WeakPolarHBondContact O-CB 3.39Å; A812-A816 PolarHBondContact O-N 2.55Å; L813-A816 WeakPolarHBondContact O-CB 3.5Å; L813-A816 PolarHBondContact O-N 3.37Å; L813-A816 VanDerWaalsContact O-N 3.13Å; N814-A816 PolarHBondContact O-N 3.46Å; A816-M819 PolarHBondContact O-N 3.23Å; A816-V820 WeakPolarHBondContact O-CG2 3.31Å; A816-V820 PolarHBondContact O-N 3Å
817	H	90	Very high	90.2	Very high	112 Å²	112	106 Å²	106	52%	0.519	54%	0.537	S	S	.	.	H	α-helix	trans	-60.9	-47.3	173.4	-79.2	-65.7	0	0	0	111.8	L813 N814 M819 V820 D821	L813-H817 PolarHBondContact O-CD2 2.88Å; L813-H817 PolarHBondContact O-N 3.34Å; N814-H817 PolarHBondContact O-N 2.85Å; H817-M819 VanDerWaalsContact C-N 3.31Å; H817-M819 PolarHBondContact O-N 3.05Å; H817-V820 PolarHBondContact O-N 2.83Å; H817-V820 VanDerWaalsContact O-N 3.13Å; H817-D821 PolarHBondContact O-N 3.05Å
818	E	91.3	Very high	90.2	Very high	146 Å²	146	106 Å²	106	68%	0.682	54%	0.538	S	S	*	.	H	α-helix	trans	-58.4	-40.9	176.1	-172.6	-176.6	-174.4	0	0	112.3	N814 K815 G822	N814-E818 PolarHBondContact O-N 2.78Å; K815-E818 PolarHBondContact O-N 2.79Å; E818-G822 PolarHBondContact O-N 3Å
819	M	89.9	Confident	90.2	Very high	119 Å²	119	107.8 Å²	107.8	59%	0.586	54%	0.54	S	S	*	.	H	α-helix	trans	-65.7	-41	175.2	-72.7	177.4	62.3	0	0	112.7	K815 A816 H817 G822 L823	K815-M819 WeakPolarHBondContact O-CG 3.3Å; K815-M819 PolarHBondContact O-N 3.27Å; A816-M819 PolarHBondContact O-N 3.23Å; H817-M819 VanDerWaalsContact C-N 3.31Å; H817-M819 PolarHBondContact O-N 3.05Å; M819-G822 PolarHBondContact O-N 3.18Å; M819-L823 WeakPolarHBondContact O-CG 3.49Å; M819-L823 PolarHBondContact O-N 2.98Å
820	V	92.8	Very high	90	Very high	83 Å²	83	105.2 Å²	105.2	50%	0.503	54%	0.536	S	S	.	.	H	α-helix	trans	-66.8	-45.1	177.1	169	0	0	0	0	111.1	A816 H817 G822 L823 L824	A816-V820 WeakPolarHBondContact O-CG2 3.31Å; A816-V820 PolarHBondContact O-N 3Å; H817-V820 PolarHBondContact O-N 2.83Å; H817-V820 VanDerWaalsContact O-N 3.13Å; V820-G822 VanDerWaalsContact C-N 3.32Å; V820-G822 PolarHBondContact O-N 3.2Å; V820-L823 PolarHBondContact O-N 3.31Å; V820-L824 WeakPolarHBondContact O-CB 3.4Å; V820-L824 PolarHBondContact O-N 3.4Å
821	D	90.1	Very high	89.6	Confident	102 Å²	102	101 Å²	101	55%	0.545	52%	0.523	S	S	.	.	H	α-helix	trans	-64.6	-38.2	176.3	-73.2	-22.8	0	0	0	111.4	H817 L823 L824 N825	H817-D821 PolarHBondContact O-N 3.05Å; D821-L823 PolarHBondContact O-N 3.06Å; D821-L824 PolarHBondContact O-N 2.87Å; D821-N825 WeakPolarHBondContact O-CB 3.49Å; D821-N825 PolarHBondContact O-N 2.88Å
822	G	90.5	Very high	89.2	Confident	32 Å²	32	97 Å²	97	33%	0.33	51%	0.51	S	S	.	.	H	α-helix	trans	-61.8	-39	172.1	0	0	0	0	0	113.2	E818 M819 V820 K826	E818-G822 PolarHBondContact O-N 3Å; M819-G822 PolarHBondContact O-N 3.18Å; V820-G822 VanDerWaalsContact C-N 3.32Å; V820-G822 PolarHBondContact O-N 3.2Å; G822-K826 WeakPolarHBondContact O-CB 3.35Å; G822-K826 WeakPolarHBondContact O-CD 3.36Å; G822-K826 VanDerWaalsContact O-CG 3.23Å; G822-K826 WeakPolarHBondContact O-CG 3.46Å; G822-K826 PolarHBondContact O-N 3.07Å; G822-K826 VanDerWaalsContact O-N 3.15Å
823	L	91.5	Very high	88.9	Confident	99 Å²	99	99 Å²	99	52%	0.518	51%	0.511	S	S	.	.	H	α-helix	trans	-70.8	-44.3	174.1	-75.7	167.5	0	0	0	112	M819 V820 D821 N825 K826 Q827	M819-L823 WeakPolarHBondContact O-CG 3.49Å; M819-L823 PolarHBondContact O-N 2.98Å; V820-L823 PolarHBondContact O-N 3.31Å; D821-L823 PolarHBondContact O-N 3.06Å; L823-N825 VanDerWaalsContact C-N 3.35Å; L823-N825 PolarHBondContact O-N 3.37Å; L823-K826 WeakPolarHBondContact O-CB 3.35Å; L823-K826 PolarHBondContact O-N 3.21Å; L823-Q827 WeakPolarHBondContact O-CG 3.24Å; L823-Q827 PolarHBondContact O-N 3.36Å
824	L	89.5	Confident	88.4	Confident	103 Å²	103	100 Å²	100	54%	0.539	52%	0.516	S	S	.	.	H	α-helix	trans	-65.1	-38.2	179.6	-172.6	137.5	0	0	0	111.5	V820 D821 Q827 Q828	V820-L824 WeakPolarHBondContact O-CB 3.4Å; V820-L824 PolarHBondContact O-N 3.4Å; D821-L824 PolarHBondContact O-N 2.87Å; L824-Q827 PolarHBondContact O-N 2.73Å; L824-Q828 VanDerWaalsContact O-CB 3.29Å; L824-Q828 WeakPolarHBondContact O-CB 3.33Å; L824-Q828 PolarHBondContact O-N 3.49Å
825	N	89.4	Confident	87.8	Confident	112 Å²	112	101.5 Å²	101.5	60%	0.599	52%	0.515	S	S	*	.	H	α-helix	trans	-66.6	-41.9	172.9	-167.4	-6.5	0	0	0	111.7	D821 L823 Q827 Q828 K829	D821-N825 WeakPolarHBondContact O-CB 3.49Å; D821-N825 PolarHBondContact O-N 2.88Å; L823-N825 VanDerWaalsContact C-N 3.35Å; L823-N825 PolarHBondContact O-N 3.37Å; N825-Q827 PolarHBondContact O-N 3.43Å; N825-Q828 PolarHBondContact O-N 3.5Å; N825-K829 WeakPolarHBondContact O-CB 3.36Å; N825-K829 PolarHBondContact O-N 2.89Å
826	K	91.5	Very high	87	Confident	140 Å²	140	99.9 Å²	99.9	61%	0.609	51%	0.509	S	S	*	.	H	α-helix	trans	-59.3	-46.1	172.2	-76	168.9	-176.9	177.5	0	111.8	G822 L823 K829 Q830	G822-K826 WeakPolarHBondContact O-CB 3.35Å; G822-K826 WeakPolarHBondContact O-CD 3.36Å; G822-K826 VanDerWaalsContact O-CG 3.23Å; G822-K826 WeakPolarHBondContact O-CG 3.46Å; G822-K826 PolarHBondContact O-N 3.07Å; G822-K826 VanDerWaalsContact O-N 3.15Å; L823-K826 WeakPolarHBondContact O-CB 3.35Å; L823-K826 PolarHBondContact O-N 3.21Å; K826-K829 PolarHBondContact O-N 3.23Å; K826-Q830 WeakPolarHBondContact O-CG 3.27Å; K826-Q830 PolarHBondContact O-N 3.12Å
827	Q	89.3	Confident	86.2	Confident	130 Å²	130	100.5 Å²	100.5	61%	0.607	51%	0.51	S	S	*	.	H	α-helix	trans	-63.3	-45.8	176.3	-74.4	-179.7	-8.7	0	0	111.9	L823 L824 N825 K829 Q830 A831	L823-Q827 WeakPolarHBondContact O-CG 3.24Å; L823-Q827 PolarHBondContact O-N 3.36Å; L824-Q827 PolarHBondContact O-N 2.73Å; N825-Q827 PolarHBondContact O-N 3.43Å; Q827-K829 VanDerWaalsContact C-N 3.3Å; Q827-K829 PolarHBondContact O-N 2.61Å; Q827-Q830 PolarHBondContact O-N 3.26Å; Q827-A831 WeakPolarHBondContact O-CB 3.25Å; Q827-A831 PolarHBondContact O-N 3.36Å
828	Q	89.3	Confident	85.3	Confident	102 Å²	102	99 Å²	99	48%	0.477	51%	0.51	S	S	.	.	H	α-helix	trans	-64.6	-34.3	178	-178.7	66.9	-30.4	0	0	112	L824 N825 S832	L824-Q828 VanDerWaalsContact O-CB 3.29Å; L824-Q828 WeakPolarHBondContact O-CB 3.33Å; L824-Q828 PolarHBondContact O-N 3.49Å; N825-Q828 PolarHBondContact O-N 3.5Å; Q828-S832 VanDerWaalsContact O-CB 3.3Å; Q828-S832 WeakPolarHBondContact O-CB 3.39Å; Q828-S832 PolarHBondContact O-N 3.04Å; Q828-S832 PolarHBondContact O-OG 3.44Å
829	K	89.2	Confident	83.9	Confident	139 Å²	139	98.7 Å²	98.7	60%	0.604	50%	0.502	S	S	*	.	H	α-helix	trans	-67.1	-46.3	172.7	-170.7	174.2	-177.5	178	0	111.6	N825 K826 Q827 S832 I833	N825-K829 WeakPolarHBondContact O-CB 3.36Å; N825-K829 PolarHBondContact O-N 2.89Å; K826-K829 PolarHBondContact O-N 3.23Å; Q827-K829 VanDerWaalsContact C-N 3.3Å; Q827-K829 PolarHBondContact O-N 2.61Å; K829-S832 PolarHBondContact O-N 2.93Å; K829-I833 HydrophobicContact CG-CD1 4.35Å; K829-I833 WeakPolarHBondContact O-CG1 3.35Å; K829-I833 PolarHBondContact O-N 2.84Å
830	Q	87.1	Confident	82.2	Confident	125 Å²	125	97.8 Å²	97.8	58%	0.584	50%	0.499	S	S	*	.	H	α-helix	trans	-61.3	-46.9	174.5	-74.5	178.7	-11.4	0	0	112	K826 Q827 S832 I833 I834	K826-Q830 WeakPolarHBondContact O-CG 3.27Å; K826-Q830 PolarHBondContact O-N 3.12Å; Q827-Q830 PolarHBondContact O-N 3.26Å; Q830-S832 PolarHBondContact O-N 3.3Å; Q830-I833 PolarHBondContact O-N 2.86Å; Q830-I834 WeakPolarHBondContact O-CG1 3.2Å; Q830-I834 PolarHBondContact O-N 3.39Å
831	A	80.9	Confident	80.3	Confident	35 Å²	35	102.8 Å²	102.8	29%	0.289	51%	0.511	S	S	.	.	H	α-helix	trans	-60.1	-34.9	175.7	0	0	0	0	0	112.2	Q827 R835	Q827-A831 WeakPolarHBondContact O-CB 3.25Å; Q827-A831 PolarHBondContact O-N 3.36Å; A831-R835 WeakPolarHBondContact O-CB 3.4Å; A831-R835 VanDerWaalsContact O-CG 3.26Å; A831-R835 WeakPolarHBondContact O-CG 3.32Å; A831-R835 PolarHBondContact O-N 2.93Å; A831-R835 PolarHBondContact O-NE 2.88Å
832	S	81.3	Confident	78.5	Confident	51 Å²	51	102 Å²	102	36%	0.357	52%	0.519	S	S	.	.	H	α-helix	trans	-72.3	-38.5	176	-56.5	0	0	0	0	112.5	Q828 K829 Q830 R835 E836	Q828-S832 VanDerWaalsContact O-CB 3.3Å; Q828-S832 WeakPolarHBondContact O-CB 3.39Å; Q828-S832 PolarHBondContact O-N 3.04Å; Q828-S832 PolarHBondContact O-OG 3.44Å; K829-S832 PolarHBondContact O-N 2.93Å; Q830-S832 PolarHBondContact O-N 3.3Å; S832-R835 PolarHBondContact O-N 3.46Å; S832-R835 PolarHBondContact OG-NH2 3.32Å; S832-E836 PolarHBondContact O-N 2.98Å
833	I	81.3	Confident	76.5	Confident	101 Å²	101	107.7 Å²	107.7	52%	0.518	54%	0.536	S	S	.	.	H	α-helix	trans	-60.4	-47.6	170.8	-67	162.7	0	0	0	110	K829 Q830 R835 E836 S837	K829-I833 HydrophobicContact CG-CD1 4.35Å; K829-I833 WeakPolarHBondContact O-CG1 3.35Å; K829-I833 PolarHBondContact O-N 2.84Å; Q830-I833 PolarHBondContact O-N 2.86Å; I833-R835 PolarHBondContact O-N 3.47Å; I833-E836 PolarHBondContact O-N 2.92Å; I833-S837 WeakPolarHBondContact O-CB 3.48Å; I833-S837 PolarHBondContact O-N 3.26Å; I833-S837 PolarHBondContact O-OG 2.96Å
834	I	79.4	Confident	74	Confident	106 Å²	106	107.5 Å²	107.5	54%	0.544	54%	0.54	S	S	.	.	H	α-helix	trans	-62.1	-42.2	178.4	-65.5	163.8	0	0	0	111.5	Q830 E836 S837 T838	Q830-I834 WeakPolarHBondContact O-CG1 3.2Å; Q830-I834 PolarHBondContact O-N 3.39Å; I834-E836 PolarHBondContact O-N 3.43Å; I834-S837 PolarHBondContact O-N 2.88Å; I834-T838 WeakPolarHBondContact O-CB 3.42Å; I834-T838 WeakPolarHBondContact O-CG2 3.43Å; I834-T838 PolarHBondContact O-N 3.45Å; I834-T838 PolarHBondContact O-OG1 2.8Å
835	R	78.4	Confident	71.5	Confident	123 Å²	123	108 Å²	108	46%	0.464	55%	0.549	S	S	.	.	H	α-helix	trans	-62.1	-39.9	175.8	-78.2	-178.7	-67.3	-130.3	0	112.3	A831 S832 I833 T838 R839	A831-R835 WeakPolarHBondContact O-CB 3.4Å; A831-R835 VanDerWaalsContact O-CG 3.26Å; A831-R835 WeakPolarHBondContact O-CG 3.32Å; A831-R835 PolarHBondContact O-N 2.93Å; A831-R835 PolarHBondContact O-NE 2.88Å; S832-R835 PolarHBondContact O-N 3.46Å; S832-R835 PolarHBondContact OG-NH2 3.32Å; I833-R835 PolarHBondContact O-N 3.47Å; R835-T838 WeakPolarHBondContact CA-OG1 3.49Å; R835-T838 PolarHBondContact O-OG1 3.31Å; R835-T838 VanDerWaalsContact O-OG1 3.14Å; R835-R839 WeakPolarHBondContact O-CB 3.37Å; R835-R839 PolarHBondContact O-N 3.17Å
836	E	76.1	Confident	68.8	Low	89 Å²	89	108.8 Å²	108.8	42%	0.416	56%	0.563	S	S	.	*	H	α-helix	trans	-74.9	-39.4	178.2	-160.6	58.2	-150.7	0	0	112	S832 I833 I834 T838 R839 N840	S832-E836 PolarHBondContact O-N 2.98Å; I833-E836 PolarHBondContact O-N 2.92Å; I834-E836 PolarHBondContact O-N 3.43Å; E836-T838 PolarHBondContact O-N 2.89Å; E836-R839 PolarHBondContact O-N 3.45Å; E836-R839 IonicContact OE1-NH1 3.99Å; E836-R839 IonicContact OE2-CZ 3.78Å; E836-R839 IonicContact OE2-NH1 2.68Å; E836-R839 PolarHBondContact OE2-NH1 3.48Å; E836-N840 PolarHBondContact O-N 3.33Å; E836-N840 PolarHBondContact O-ND2 2.98Å
837	S	72.3	Confident	66.2	Low	61 Å²	61	107.7 Å²	107.7	43%	0.427	57%	0.568	S	S	.	*	H	α-helix	trans	-58.8	-46.8	172.3	-60	0	0	0	0	111.8	I833 I834 N840 Y841	I833-S837 WeakPolarHBondContact O-CB 3.48Å; I833-S837 PolarHBondContact O-N 3.26Å; I833-S837 PolarHBondContact O-OG 2.96Å; I834-S837 PolarHBondContact O-N 2.88Å; S837-N840 PolarHBondContact O-N 2.88Å; S837-Y841 WeakPolarHBondContact O-CD2 3.36Å; S837-Y841 PolarHBondContact O-N 3.45Å
838	T	69.7	Low	63.4	Low	82 Å²	82	108.3 Å²	108.3	50%	0.503	58%	0.575	S	S	.	*	H	α-helix	trans	-70.6	-31.6	180	47.4	0	0	0	0	113.3	I834 R835 E836 N840 Y841 A842	I834-T838 WeakPolarHBondContact O-CB 3.42Å; I834-T838 WeakPolarHBondContact O-CG2 3.43Å; I834-T838 PolarHBondContact O-N 3.45Å; I834-T838 PolarHBondContact O-OG1 2.8Å; R835-T838 WeakPolarHBondContact CA-OG1 3.49Å; R835-T838 PolarHBondContact O-OG1 3.31Å; R835-T838 VanDerWaalsContact O-OG1 3.14Å; E836-T838 PolarHBondContact O-N 2.89Å; T838-N840 VanDerWaalsContact C-N 3.3Å; T838-N840 PolarHBondContact O-N 2.97Å; T838-Y841 PolarHBondContact O-N 2.89Å; T838-A842 WeakPolarHBondContact O-CB 3.41Å; T838-A842 PolarHBondContact O-N 3.44Å
839	R	62.4	Low	60.6	Low	138 Å²	138	111.6 Å²	111.6	52%	0.521	60%	0.595	S	S	.	*	H	α-helix	trans	-59.5	-39.4	172	-178.3	177.4	-74.8	145.2	-8.4	112.3	R835 E836 A842	R835-R839 WeakPolarHBondContact O-CB 3.37Å; R835-R839 PolarHBondContact O-N 3.17Å; E836-R839 PolarHBondContact O-N 3.45Å; E836-R839 IonicContact OE1-NH1 3.99Å; E836-R839 IonicContact OE2-CZ 3.78Å; E836-R839 IonicContact OE2-NH1 2.68Å; E836-R839 PolarHBondContact OE2-NH1 3.48Å; R839-A842 PolarHBondContact O-N 3.33Å
840	N	53.9	Low	57.8	Low	100 Å²	100	110.6 Å²	110.6	54%	0.535	60%	0.601	S	S	.	*	H	α-helix	trans	-67.8	-33.8	176.5	-70.1	-52.2	0	0	0	113	E836 S837 T838	E836-N840 PolarHBondContact O-N 3.33Å; E836-N840 PolarHBondContact O-ND2 2.98Å; S837-N840 PolarHBondContact O-N 2.88Å; T838-N840 VanDerWaalsContact C-N 3.3Å; T838-N840 PolarHBondContact O-N 2.97Å
841	Y	52.7	Low	55.1	Low	189 Å²	189	110.4 Å²	110.4	74%	0.741	61%	0.608	S	S	*	*	H	α-helix	trans	-75.5	-27.7	174	-83.7	-82.3	0	0	0	113.7	S837 T838 Q843 T844	S837-Y841 WeakPolarHBondContact O-CD2 3.36Å; S837-Y841 PolarHBondContact O-N 3.45Å; T838-Y841 PolarHBondContact O-N 2.89Å; Y841-Q843 VanDerWaalsContact C-N 3.29Å; Y841-Q843 PolarHBondContact O-N 3.41Å; Y841-T844 PolarHBondContact O-OG1 2.86Å
842	A	52	Low	52.7	Low	86 Å²	86	116.2 Å²	116.2	71%	0.711	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-9	-179.8	0	0	0	0	0	114.2	T838 R839	T838-A842 WeakPolarHBondContact O-CB 3.41Å; T838-A842 PolarHBondContact O-N 3.44Å; R839-A842 PolarHBondContact O-N 3.33Å
843	Q	50.2	Low	50.6	Low	150 Å²	150	122.3 Å²	122.3	70%	0.701	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	-9.4	179.8	-71	-175.3	-5.9	0	0	114.2	Y841	Y841-Q843 VanDerWaalsContact C-N 3.29Å; Y841-Q843 PolarHBondContact O-N 3.41Å
844	T	38.5	Very low	48.2	Very low	96 Å²	96	124.7 Å²	124.7	59%	0.589	67%	0.671	S	S	*	*	S	Bend	trans	-80.7	124.4	168	41.6	0	0	0	0	110.5	Y841 S846	Y841-T844 PolarHBondContact O-OG1 2.86Å; T844-S846 PolarHBondContact O-N 3.4Å
845	P	37.1	Very low	46.2	Very low	113 Å²	113	126.6 Å²	126.6	73%	0.734	68%	0.68	S	S	*	*			trans	-59.4	128.5	178.6	-23.4	33.7	0	0	0	111.7	T847	P845-T847 PolarHBondContact O-N 2.86Å; P845-T847 VanDerWaalsContact O-N 3.11Å
846	S	32.3	Very low	44	Very low	128 Å²	128	127.6 Å²	127.6	90%	0.895	70%	0.695	S	S	*	*			trans	-74.5	100.6	177.8	-168.7	0	0	0	0	110.3	T844	T844-S846 PolarHBondContact O-N 3.4Å
847	T	36.8	Very low	42.2	Very low	117 Å²	117	129.6 Å²	129.6	72%	0.718	71%	0.709	S	S	*	*			trans	-117.2	96	172.8	51.5	0	0	0	0	111.8	P845	P845-T847 PolarHBondContact O-N 2.86Å; P845-T847 VanDerWaalsContact O-N 3.11Å
848	L	30.3	Very low	40.5	Very low	143 Å²	143	133 Å²	133	75%	0.749	72%	0.722	S	S	*	*			trans	62.1	87.7	140.2	-60	166	0	0	0	117.8
849	L	31.6	Very low	39.2	Very low	171 Å²	171	135.8 Å²	135.8	90%	0.895	73%	0.734	S	S	*	*			trans	-126.1	66.1	148.4	-90.6	168.8	0	0	0	109.9
850	T	30.4	Very low	38.2	Very low	119 Å²	119	136 Å²	136	73%	0.73	75%	0.745	S	S	*	*			trans	-115.3	84.2	169.6	53.1	0	0	0	0	109.3
851	T	30	Very low	37.4	Very low	120 Å²	120	136.4 Å²	136.4	74%	0.736	75%	0.747	S	S	*	*			trans	-132.2	81.2	171.5	53.6	0	0	0	0	109.2
852	N	29.3	Very low	36.7	Very low	157 Å²	157	135.1 Å²	135.1	84%	0.84	75%	0.748	S	S	*	*			trans	-166.7	76.7	161.9	-87.7	-25.5	0	0	0	106.6
853	H	37.3	Very low	35.9	Very low	179 Å²	179	136.8 Å²	136.8	83%	0.829	75%	0.745	S	S	*	*			trans	-134.4	113	158.1	-106.8	-60.6	0	0	0	107.6	I855	H853-I855 PolarHBondContact O-N 3.37Å
854	D	30.8	Very low	35.2	Very low	151 Å²	151	138.7 Å²	138.7	81%	0.807	75%	0.746	S	S	*	*			trans	-54.5	124	149.1	-65.2	-62.4	0	0	0	107.7
855	I	37.9	Very low	35	Very low	146 Å²	146	141.8 Å²	141.8	75%	0.749	75%	0.751	S	S	*	*			trans	-161.3	99.1	139.4	-85.5	133.6	0	0	0	102.6	H853	H853-I855 PolarHBondContact O-N 3.37Å
856	N	32.6	Very low	34.8	Very low	144 Å²	144	141.7 Å²	141.7	77%	0.77	75%	0.753	S	S	*	*			trans	-66.4	131.7	143.5	-53.8	-62.1	0	0	0	104.6
857	D	37.5	Very low	34.5	Very low	131 Å²	131	145.5 Å²	145.5	70%	0.701	75%	0.749	S	S	*	*			trans	176	116.8	131.8	-81.3	-13.2	0	0	0	107.2
858	D	37.9	Very low	34.5	Very low	134 Å²	134	145.4 Å²	145.4	72%	0.717	75%	0.751	S	S	*	*			trans	63.1	139.3	137.9	-56.3	-17.1	0	0	0	122.6
859	D	42	Very low	34.5	Very low	139 Å²	139	144.3 Å²	144.3	74%	0.743	75%	0.75	S	S	*	*			trans	67	93.9	144.7	-59	-9.6	0	0	0	119.4
860	D	40.6	Very low	34.8	Very low	142 Å²	142	142.6 Å²	142.6	76%	0.759	74%	0.742	S	S	*	*				121.9	140.9	99.5	-110.7	-11.5	0	0	0	119.1
861	D	38.1	Very low	34.9	Very low	109 Å²	109	144.5 Å²	144.5	58%	0.583	75%	0.747	S	S	*	*			trans	51.6	99	151.2	-94.9	19.7	0	0	0	122
862	H	38.3	Very low	34.8	Very low	162 Å²	162	149 Å²	149	75%	0.75	75%	0.752	S	S	*	*				75.3	126.4	112.1	-72.1	14.8	0	0	0	118.2
863	N	35	Very low	35.1	Very low	122 Å²	122	151 Å²	151	65%	0.652	75%	0.753	S	S	*	*				136.6	100.3	108	-145.2	11.3	0	0	0	112.9
864	R	34.4	Very low	34.9	Very low	190 Å²	190	147 Å²	147	72%	0.717	74%	0.743	S	S	*	*			trans	73.8	152.7	148.1	-61.1	164	-178.3	-142.3	-0.1	118.8
865	K	34.6	Very low	35.1	Very low	161 Å²	161	147.3 Å²	147.3	70%	0.7	74%	0.741	S	S	*	*			cis	-164.8	157.9	-17.3	-111.9	167.7	-175.4	177.2	0	108.4
866	S	32.9	Very low	35	Very low	111 Å²	111	146.3 Å²	146.3	78%	0.776	74%	0.736	S	S	*	*			trans	67.3	105.6	157.7	-61.2	0	0	0	0	119.5
867	Y	26.1	Very low	35	Very low	207 Å²	207	149.2 Å²	149.2	81%	0.812	74%	0.742	S	S	*	*			trans	-54	157.4	140.3	-71.2	-94.8	0	0	0	110.8
868	P	36.2	Very low	34.9	Very low	116 Å²	116	151.6 Å²	151.6	75%	0.753	75%	0.749	S	S	*	*				-131.6	118.9	109.5	34.5	-26.5	0	0	0	113.1	N870	P868-N870 PolarHBondContact O-N 3.31Å
869	T	31.5	Very low	34.7	Very low	119 Å²	119	152.2 Å²	152.2	73%	0.73	75%	0.752	S	S	*	*			trans	-55.1	119.9	154.7	-43.7	0	0	0	0	108.9
870	N	36.5	Very low	34.4	Very low	136 Å²	136	151.3 Å²	151.3	73%	0.727	76%	0.757	S	S	*	*			trans	-166.7	124.1	157.2	-100.1	-32.1	0	0	0	114.8	P868	P868-N870 PolarHBondContact O-N 3.31Å
871	L	33.5	Very low	34.3	Very low	158 Å²	158	151.9 Å²	151.9	83%	0.827	76%	0.759	S	S	*	*			trans	70.5	99.1	139.8	-63.4	164.1	0	0	0	120.4
872	Y	28.7	Very low	34.2	Very low	216 Å²	216	154.4 Å²	154.4	85%	0.847	77%	0.772	S	S	*	*			trans	-41.1	139.8	157	-142.4	-119.9	0	0	0	115	P874	Y872-P874 HydrophobicContact CD1-CG 3.9Å; Y872-P874 HydrophobicContact CE1-CG 3.73Å
873	K	34.3	Very low	34.1	Very low	198 Å²	198	154.4 Å²	154.4	86%	0.861	78%	0.777	S	S	*	*			trans	-152.6	104.4	158.5	-129.5	-173.9	-175.1	-173.9	0	111.2
874	P	34.4	Very low	34.1	Very low	95 Å²	95	154.7 Å²	154.7	62%	0.617	79%	0.785	S	S	*	*			trans	-105.6	108.5	177.2	35.8	-28.1	0	0	0	112	Y872	Y872-P874 HydrophobicContact CD1-CG 3.9Å; Y872-P874 HydrophobicContact CE1-CG 3.73Å
875	M	33.1	Very low	34.2	Very low	158 Å²	158	151.8 Å²	151.8	78%	0.778	79%	0.789	S	S	*	*			trans	-157.9	140.1	170.3	-85.1	166.9	69.6	0	0	105.9
876	I	36	Very low	33.9	Very low	125 Å²	125	154 Å²	154	64%	0.641	80%	0.795	S	S	*	*			cis	-152.1	158.8	1.2	-103.9	158.6	0	0	0	107.4
877	K	32.8	Very low	34.2	Very low	205 Å²	205	153.9 Å²	153.9	89%	0.891	79%	0.789	S	S	*	*			trans	-76.9	129.9	165.4	-67.7	176.7	178.3	178.2	0	109.4
878	E	36.8	Very low	34.8	Very low	181 Å²	181	149.6 Å²	149.6	85%	0.846	79%	0.787	S	S	*	*			trans	-148.5	145.6	157.2	-120.6	165.2	-130.9	0	0	111
879	D	33.4	Very low	34.8	Very low	147 Å²	147	149.8 Å²	149.8	79%	0.786	79%	0.786	S	S	*	*			trans	-80.4	145.9	-163.8	-62	-71.7	0	0	0	113.7
880	S	35.6	Very low	35	Very low	119 Å²	119	152.7 Å²	152.7	83%	0.832	79%	0.788	S	S	*	*			trans	-160.6	91.7	146.4	-2.1	0	0	0	0	111.5
881	L	37.4	Very low	34.8	Very low	155 Å²	155	158.1 Å²	158.1	81%	0.812	80%	0.801	S	S	*	*			trans	-61.5	137	159.9	-66.7	103.3	0	0	0	109.6
882	N	36.9	Very low	34.6	Very low	161 Å²	161	153.5 Å²	153.5	86%	0.861	79%	0.792	S	S	*	*			trans	-166.9	40.4	158	-99.9	-29.8	0	0	0	114.5
883	L	36.9	Very low	34.9	Very low	162 Å²	162	152.1 Å²	152.1	85%	0.848	79%	0.792	S	S	*	*	S	Bend	trans	-120.3	135.3	162.6	-95.5	85.4	0	0	0	110.8	T885	L883-T885 PolarHBondContact O-N 2.89Å
884	P	34.3	Very low	34.9	Very low	128 Å²	128	153.3 Å²	153.3	83%	0.831	79%	0.793	S	S	*	*			trans	-83	103	-168	31.6	-35.1	0	0	0	112.9	Y886	P884-Y886 PolarHBondContact O-N 3.34Å
885	T	35.7	Very low	34.8	Very low	130 Å²	130	154.8 Å²	154.8	80%	0.798	79%	0.792	S	S	*	*			trans	-71	108.9	168.1	-58.6	0	0	0	0	110.3	L883 T887	L883-T885 PolarHBondContact O-N 2.89Å; T885-T887 PolarHBondContact O-N 3.38Å
886	Y	29.6	Very low	34.9	Very low	207 Å²	207	155 Å²	155	81%	0.812	80%	0.796	S	S	*	*			trans	-66	109.3	-178.8	-172.8	-86.5	0	0	0	112	P884 P888	P884-Y886 PolarHBondContact O-N 3.34Å; Y886-P888 WeakPolarHBondContact O-CD 3.3Å
887	T	38.2	Very low	34.8	Very low	108 Å²	108	155.3 Å²	155.3	66%	0.663	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-84.7	121.8	176.6	50.8	0	0	0	0	112.3	T885	T885-T887 PolarHBondContact O-N 3.38Å
888	P	39.9	Very low	34.9	Very low	117 Å²	117	154.7 Å²	154.7	76%	0.76	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-65.1	135.9	167.8	-19	33.1	0	0	0	111.2	Y886	Y886-P888 WeakPolarHBondContact O-CD 3.3Å
889	T	35.1	Very low	34.6	Very low	121 Å²	121	153.7 Å²	153.7	74%	0.742	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-91	120	-166.3	-59.6	0	0	0	0	113
890	K	36.4	Very low	34.8	Very low	179 Å²	179	155 Å²	155	78%	0.778	80%	0.795	S	S	*	*			trans	50.4	102.3	151.6	-61.3	175.4	-177.3	-179.1	0	119.8
891	Y	32.1	Very low	34.6	Very low	250 Å²	250	156.2 Å²	156.2	98%	0.98	79%	0.788	S	S	*	*				-159.3	130.6	119.2	-88.4	-80.6	0	0	0	105.3
892	G	29.9	Very low	34.5	Very low	62 Å²	62	154.8 Å²	154.8	64%	0.639	79%	0.789	S	S	*	*			cis	144.7	59.1	6.6	0	0	0	0	0	109.7
893	H	34.8	Very low	34.2	Very low	187 Å²	187	154.7 Å²	154.7	87%	0.866	78%	0.784	S	S	*	*			trans	-139.2	158.1	180	-105	53.5	0	0	0	112.9
894	Y	33.8	Very low	34.1	Very low	222 Å²	222	156.2 Å²	156.2	87%	0.871	79%	0.786	S	S	*	*			trans	-77.6	142.1	-149.5	-83.7	-105.3	0	0	0	115.9
895	H	32	Very low	34.1	Very low	127 Å²	127	157 Å²	157	59%	0.588	78%	0.783	S	S	*	*			trans	-66.9	131.1	168.2	178.5	96	0	0	0	111.6	Q897	H895-Q897 VanDerWaalsContact CE1-CG 3.41Å; H895-Q897 WeakPolarHBondContact CE1-CG 3.44Å; H895-Q897 WeakPolarHBondContact NE2-CG 3.41Å; H895-Q897 PolarHBondContact NE2-OE1 3.42Å
896	N	36	Very low	34.2	Very low	163 Å²	163	156.1 Å²	156.1	87%	0.872	78%	0.779	S	S	*	*			trans	-145.1	107.1	152.6	-98.7	-39.5	0	0	0	109.1
897	Q	33.1	Very low	34.4	Very low	130 Å²	130	153.2 Å²	153.2	61%	0.607	78%	0.778	S	S	*	*			trans	-67.6	132.9	175.4	-76.9	153.3	-45	0	0	110.7	H895	H895-Q897 VanDerWaalsContact CE1-CG 3.41Å; H895-Q897 WeakPolarHBondContact CE1-CG 3.44Å; H895-Q897 WeakPolarHBondContact NE2-CG 3.41Å; H895-Q897 PolarHBondContact NE2-OE1 3.42Å
898	H	35.6	Very low	34.3	Very low	193 Å²	193	156.7 Å²	156.7	89%	0.894	79%	0.786	S	S	*	*			trans	-138.2	93.2	137.1	-92.7	-72.8	0	0	0	109.1	L900	H898-L900 PolarHBondContact O-N 3.02Å
899	H	30.9	Very low	34.1	Very low	159 Å²	159	158.5 Å²	158.5	74%	0.736	79%	0.788	S	S	*	*			trans	-53.7	133.3	155.6	-103.9	-80.6	0	0	0	108.4
900	L	37.2	Very low	34.1	Very low	174 Å²	174	158 Å²	158	91%	0.911	79%	0.785	S	S	*	*			trans	-156.3	117.2	138.1	-108.2	161.7	0	0	0	109.9	H898	H898-L900 PolarHBondContact O-N 3.02Å
901	Q	31.7	Very low	34.1	Very low	146 Å²	146	156.4 Å²	156.4	68%	0.682	79%	0.785	S	S	*	*			trans	-90.5	130.1	-174.8	165.4	-175.1	-0.2	0	0	109.2
902	C	33.3	Very low	34.4	Very low	124 Å²	124	155.2 Å²	155.2	84%	0.838	78%	0.781	S	S	*	*			trans	-146.9	124.4	162.3	-92.1	0	0	0	0	111
903	H	31.7	Very low	34.8	Very low	160 Å²	160	163.1 Å²	163.1	74%	0.741	79%	0.793	S	S	*	*			trans	-66.9	155.3	164.4	-73.7	-112.6	0	0	0	110.5
904	H	35.8	Very low	34.7	Very low	194 Å²	194	157.3 Å²	157.3	90%	0.898	78%	0.783	S	S	*	*			trans	-150	146.3	136.4	-94.6	-57.5	0	0	0	112.2
905	D	33.3	Very low	34.8	Very low	143 Å²	143	157 Å²	157	77%	0.765	78%	0.78	S	S	*	*			trans	-103.7	132.2	-168.9	-161.8	-2.4	0	0	0	109.6
906	P	38.2	Very low	34.9	Very low	112 Å²	112	158 Å²	158	73%	0.727	79%	0.785	S	S	*	*			trans	-112	81.9	-178.2	37.7	-27.7	0	0	0	112.6
907	N	34.2	Very low	34.8	Very low	146 Å²	146	155 Å²	155	78%	0.781	78%	0.776	S	S	*	*			trans	-158	89.2	166.6	-91.7	-45.5	0	0	0	112.3
908	H	35.2	Very low	34.7	Very low	181 Å²	181	156.1 Å²	156.1	84%	0.838	79%	0.787	S	S	*	*			trans	179.9	150.6	146.6	-108	-69.4	0	0	0	111.2
909	I	36.2	Very low	34.8	Very low	156 Å²	156	155.4 Å²	155.4	80%	0.8	78%	0.784	S	S	*	*			trans	74.5	121.5	171.7	-53.3	147.9	0	0	0	111.6
910	T	35.3	Very low	34.9	Very low	111 Å²	111	156 Å²	156	68%	0.681	79%	0.787	S	S	*	*			cis	-152.7	159.9	17.3	-23.1	0	0	0	0	109.8
911	D	36.8	Very low	34.6	Very low	145 Å²	145	153 Å²	153	78%	0.775	78%	0.78	S	S	*	*				166	111.5	119.4	-86.6	-21.6	0	0	0	112.2
912	Y	36.8	Very low	34.8	Very low	225 Å²	225	150.7 Å²	150.7	88%	0.882	78%	0.778	S	S	*	*			trans	-140.5	73.8	173.8	-149.8	-81.7	0	0	0	109.7
913	Y	38.8	Very low	34.8	Very low	228 Å²	228	154.5 Å²	154.5	89%	0.894	78%	0.776	S	S	*	*			trans	-124.4	102.2	170.5	-84.6	-76.5	0	0	0	110.6
914	G	32.6	Very low	34.9	Very low	64 Å²	64	153.5 Å²	153.5	66%	0.66	78%	0.776	S	S	*	*			trans	-82.1	172.6	162.1	0	0	0	0	0	111.7
915	R	35.6	Very low	34.6	Very low	215 Å²	215	154.9 Å²	154.9	81%	0.811	78%	0.775	S	S	*	*			trans	87	95.9	171.9	-63.6	-170.5	-168.4	-107.3	6.5	118.5
916	H	35.6	Very low	34.4	Very low	148 Å²	148	153.9 Å²	153.9	69%	0.685	78%	0.778	S	S	*	*				104.8	139.8	112.8	-67.5	-35.6	0	0	0	119.8
917	S	32.8	Very low	34	Very low	100 Å²	100	153.2 Å²	153.2	70%	0.699	77%	0.774	S	S	*	*			trans	56.3	103.2	163.7	41.5	0	0	0	0	116.3
918	N	32.1	Very low	33.8	Very low	155 Å²	155	154.1 Å²	154.1	83%	0.829	78%	0.778	S	S	*	*				48.1	106.9	81.3	-71.1	-16.7	0	0	0	113.1
919	Q	36.1	Very low	33.5	Very low	177 Å²	177	154.2 Å²	154.2	83%	0.827	78%	0.779	S	S	*	*				-169.7	140.5	116.2	-97.4	169.6	21.3	0	0	110.3
920	H	33.8	Very low	33.2	Very low	171 Å²	171	157.8 Å²	157.8	79%	0.792	78%	0.783	S	S	*	*			trans	9.9	142.9	158.6	-50.6	-75.5	0	0	0	120
921	S	29.8	Very low	33.1	Very low	111 Å²	111	161.5 Å²	161.5	78%	0.776	79%	0.79	S	S	*	*			cis	-162.4	165.9	35.1	-134.5	0	0	0	0	112.4
922	P	36.9	Very low	32.9	Very low	99 Å²	99	159.5 Å²	159.5	64%	0.643	78%	0.784	S	S	*	*			trans	-102.7	168.4	-162.8	40.2	-35.5	0	0	0	115.1
923	Y	32.5	Very low	32.7	Very low	204 Å²	204	157.9 Å²	157.9	80%	0.8	78%	0.782	S	S	*	*				176.8	147.1	119.3	-106.7	-77.9	0	0	0	112.8
924	N	34.3	Very low	32.4	Very low	138 Å²	138	153.7 Å²	153.7	74%	0.738	78%	0.775	S	S	*	*			trans	62	96.2	164.1	-57	-29.6	0	0	0	116.7
925	Y	30.8	Very low	32.3	Very low	224 Å²	224	157.6 Å²	157.6	88%	0.878	77%	0.774	S	S	*	*			cis	65.4	89.3	45	-126.4	-77.2	0	0	0	113.6
926	C	28.8	Very low	32.4	Very low	121 Å²	121	153 Å²	153	82%	0.818	77%	0.77	S	S	*	*				-168.2	152.8	125.5	-113.1	0	0	0	0	111.4
927	P	28.7	Very low	32.7	Very low	98 Å²	98	151.9 Å²	151.9	64%	0.636	77%	0.769	S	S	*	*			trans	-90.9	157.5	-155.4	35.4	-37.3	0	0	0	114.7	Q929	P927-Q929 PolarHBondContact O-N 2.79Å
928	N	29.6	Very low	32.9	Very low	165 Å²	165	151.9 Å²	151.9	88%	0.882	76%	0.758	S	S	*	*			trans	10.3	70.3	151.8	-77.5	-28.6	0	0	0	116.9	R930	N928-R930 PolarHBondContact O-N 3.45Å
929	Q	30	Very low	33.4	Very low	184 Å²	184	151.2 Å²	151.2	86%	0.86	75%	0.75	S	S	*	*			trans	-70.1	100.2	156.7	-71.5	-170.1	0.6	0	0	107.4	P927 K931	P927-Q929 PolarHBondContact O-N 2.79Å; Q929-K931 PolarHBondContact O-N 3.1Å
930	R	30	Very low	34.1	Very low	231 Å²	231	146.2 Å²	146.2	87%	0.872	73%	0.734	S	S	*	*			trans	-48.4	111.4	156.3	-75.7	177.1	173.6	159.2	-3.3	105.9	N928	N928-R930 PolarHBondContact O-N 3.45Å
931	K	33.4	Very low	35.3	Very low	189 Å²	189	141.7 Å²	141.7	82%	0.822	72%	0.719	S	S	*	*			trans	-51.9	132.8	172	-76	-176.2	175.2	-178.5	0	107.3	Q929 F933	Q929-K931 PolarHBondContact O-N 3.1Å; K931-F933 PolarHBondContact O-N 2.96Å
932	P	32.9	Very low	37	Very low	102 Å²	102	140.7 Å²	140.7	66%	0.662	71%	0.705	S	S	*	*			trans	-51.9	135.7	166.1	-20.4	31.8	0	0	0	107.6	D934	P932-D934 VanDerWaalsContact C-N 3.29Å; P932-D934 PolarHBondContact O-N 3.32Å
933	F	32.2	Very low	38.4	Very low	192 Å²	192	139.8 Å²	139.8	84%	0.842	70%	0.697	S	S	*	*			trans	-63.1	102.6	160.2	-108.7	-100.8	0	0	0	105.5	K931 F935	K931-F933 PolarHBondContact O-N 2.96Å; F933-F935 WeakPolarHBondContact O-CD2 3.32Å; F933-F935 PolarHBondContact O-N 2.8Å
934	D	32.2	Very low	40.3	Very low	140 Å²	140	135.3 Å²	135.3	75%	0.749	69%	0.687	S	S	*	*			trans	-61.7	105.6	177.9	-81.2	-40.8	0	0	0	108.3	P932 T936	P932-D934 VanDerWaalsContact C-N 3.29Å; P932-D934 PolarHBondContact O-N 3.32Å; D934-T936 VanDerWaalsContact C-N 3.25Å; D934-T936 PolarHBondContact O-N 3.17Å
935	F	30	Very low	42.4	Very low	145 Å²	145	132.9 Å²	132.9	64%	0.636	67%	0.673	S	S	*	*			trans	-67.9	82.1	179.8	-81.4	-97.6	0	0	0	110.1	F933 N937 H938	F933-F935 WeakPolarHBondContact O-CD2 3.32Å; F933-F935 PolarHBondContact O-N 2.8Å; F935-N937 PolarHBondContact O-N 2.9Å; F935-H938 HydrophobicContact CB-CB 4.14Å; F935-H938 WeakPolarHBondContact CB-CD2 3.2Å; F935-H938 AromaticContact CD1-CD2 3.63Å; F935-H938 AromaticContact CD1-NE2 3.54Å; F935-H938 AromaticContact CE1-NE2 3.99Å; F935-H938 AromaticContact CG-CD2 3.49Å; F935-H938 VanDerWaalsContact CG-CD2 3.49Å; F935-H938 WeakPolarHBondContact CG-CD2 3.27Å; F935-H938 AromaticContact CG-NE2 3.86Å; F935-H938 PolarHBondContact O-N 3.25Å
936	T	38.3	Very low	44.4	Very low	118 Å²	118	127.3 Å²	127.3	72%	0.724	66%	0.655	S	S	*	*	H	α-helix	trans	-56.9	-20.3	175.4	44.4	0	0	0	0	113.3	D934	D934-T936 VanDerWaalsContact C-N 3.25Å; D934-T936 PolarHBondContact O-N 3.17Å
937	N	40.6	Very low	46.6	Very low	125 Å²	125	127.8 Å²	127.8	67%	0.668	64%	0.643	S	S	*	*	H	α-helix	trans	-76.1	-27.9	172.5	-73.6	-22.1	0	0	0	114.3	F935 H939 S940	F935-N937 PolarHBondContact O-N 2.9Å; N937-H939 VanDerWaalsContact C-N 3.34Å; N937-H939 PolarHBondContact O-N 3.24Å; N937-S940 PolarHBondContact O-N 3.42Å; N937-S940 PolarHBondContact O-OG 2.72Å
938	H	37.7	Very low	49.2	Very low	100 Å²	100	127.8 Å²	127.8	46%	0.463	64%	0.637	S	S	.	*	H	α-helix	trans	-75.7	-19.7	-180	-73	-36.5	0	0	0	113.6	F935 N942	F935-H938 HydrophobicContact CB-CB 4.14Å; F935-H938 WeakPolarHBondContact CB-CD2 3.2Å; F935-H938 AromaticContact CD1-CD2 3.63Å; F935-H938 AromaticContact CD1-NE2 3.54Å; F935-H938 AromaticContact CE1-NE2 3.99Å; F935-H938 AromaticContact CG-CD2 3.49Å; F935-H938 VanDerWaalsContact CG-CD2 3.49Å; F935-H938 WeakPolarHBondContact CG-CD2 3.27Å; F935-H938 AromaticContact CG-NE2 3.86Å; F935-H938 PolarHBondContact O-N 3.25Å; H938-N942 WeakPolarHBondContact O-CB 3.44Å; H938-N942 PolarHBondContact O-N 2.95Å; H938-N942 VanDerWaalsContact O-N 3.17Å; H938-N942 PolarHBondContact O-ND2 3.47Å
939	H	42.6	Very low	51.7	Low	141 Å²	141	127.3 Å²	127.3	65%	0.653	62%	0.623	S	S	*	*	H	α-helix	trans	-69.6	-37.8	174.6	-157.5	51.4	0	0	0	111.1	N937 V943	N937-H939 VanDerWaalsContact C-N 3.34Å; N937-H939 PolarHBondContact O-N 3.24Å; H939-V943 WeakPolarHBondContact O-CB 3.49Å; H939-V943 VanDerWaalsContact O-CG2 3.22Å; H939-V943 WeakPolarHBondContact O-CG2 3.32Å; H939-V943 PolarHBondContact O-N 2.93Å
940	S	51.6	Low	53.7	Low	73 Å²	73	121.6 Å²	121.6	51%	0.51	60%	0.603	S	S	.	*	H	α-helix	trans	-63.1	-45.4	178.8	72.9	0	0	0	0	113.3	N937 L944	N937-S940 PolarHBondContact O-N 3.42Å; N937-S940 PolarHBondContact O-OG 2.72Å; S940-L944 VanDerWaalsContact O-CB 3.29Å; S940-L944 WeakPolarHBondContact O-CB 3.47Å; S940-L944 PolarHBondContact O-N 3.3Å
941	T	59.5	Low	56.1	Low	75 Å²	75	114.5 Å²	114.5	46%	0.46	58%	0.583	S	S	.	*	H	α-helix	trans	-72.9	-37.3	179.2	34.5	0	0	0	0	112.6	L944 L945	T941-L944 PolarHBondContact O-N 3.46Å; T941-L945 WeakPolarHBondContact O-CB 3.39Å; T941-L945 VanDerWaalsContact O-CG 3.25Å; T941-L945 WeakPolarHBondContact O-CG 3.32Å; T941-L945 PolarHBondContact O-N 3.36Å
942	N	63.7	Low	58.4	Low	90 Å²	90	113.8 Å²	113.8	48%	0.481	58%	0.576	S	S	.	*	H	α-helix	trans	-68.1	-41.1	174.5	-76.4	-64.7	0	0	0	112.1	H938 L944 L945 E946	H938-N942 WeakPolarHBondContact O-CB 3.44Å; H938-N942 PolarHBondContact O-N 2.95Å; H938-N942 VanDerWaalsContact O-N 3.17Å; H938-N942 PolarHBondContact O-ND2 3.47Å; N942-L944 VanDerWaalsContact C-N 3.31Å; N942-L944 PolarHBondContact O-N 2.96Å; N942-L945 PolarHBondContact O-N 3.25Å; N942-E946 WeakPolarHBondContact O-CB 3.18Å; N942-E946 PolarHBondContact O-N 3.42Å
943	V	66.9	Low	60.5	Low	80 Å²	80	111.1 Å²	111.1	49%	0.485	56%	0.562	S	S	.	*	H	α-helix	trans	-63	-38.1	174.1	168.8	0	0	0	0	111.4	H939 E946 K947	H939-V943 WeakPolarHBondContact O-CB 3.49Å; H939-V943 VanDerWaalsContact O-CG2 3.22Å; H939-V943 WeakPolarHBondContact O-CG2 3.32Å; H939-V943 PolarHBondContact O-N 2.93Å; V943-E946 PolarHBondContact O-N 3.47Å; V943-K947 WeakPolarHBondContact O-CB 3.48Å; V943-K947 PolarHBondContact O-N 2.81Å
944	L	72.3	Confident	62.5	Low	111 Å²	111	106.7 Å²	106.7	58%	0.581	55%	0.548	S	S	*	.	H	α-helix	trans	-73	-35	177.8	-161.4	143.1	0	0	0	112.4	S940 T941 N942 L948	S940-L944 VanDerWaalsContact O-CB 3.29Å; S940-L944 WeakPolarHBondContact O-CB 3.47Å; S940-L944 PolarHBondContact O-N 3.3Å; T941-L944 PolarHBondContact O-N 3.46Å; N942-L944 VanDerWaalsContact C-N 3.31Å; N942-L944 PolarHBondContact O-N 2.96Å; L944-L948 HydrophobicContact CD2-CD1 3.75Å; L944-L948 HydrophobicContact CD2-CG 4.31Å; L944-L948 WeakPolarHBondContact O-CB 3.37Å; L944-L948 VanDerWaalsContact O-CG 3.27Å; L944-L948 WeakPolarHBondContact O-CG 3.35Å; L944-L948 PolarHBondContact O-N 3.31Å
945	L	78	Confident	64.9	Low	86 Å²	86	105 Å²	105	45%	0.45	54%	0.538	S	S	.	.	H	α-helix	trans	-67.2	-40.3	170.5	-76.2	168.6	0	0	0	112.2	T941 N942 L948 R949	T941-L945 WeakPolarHBondContact O-CB 3.39Å; T941-L945 VanDerWaalsContact O-CG 3.25Å; T941-L945 WeakPolarHBondContact O-CG 3.32Å; T941-L945 PolarHBondContact O-N 3.36Å; N942-L945 PolarHBondContact O-N 3.25Å; L945-L948 PolarHBondContact O-N 3.33Å; L945-R949 VanDerWaalsContact O-CG 3.31Å; L945-R949 WeakPolarHBondContact O-CG 3.39Å; L945-R949 PolarHBondContact O-N 3.05Å
946	E	73	Confident	67.1	Low	107 Å²	107	100.4 Å²	100.4	50%	0.5	53%	0.527	S	S	.	.	H	α-helix	trans	-66.9	-41.5	177.2	-151.3	71.9	167.5	0	0	110.8	N942 V943 R949 S950	N942-E946 WeakPolarHBondContact O-CB 3.18Å; N942-E946 PolarHBondContact O-N 3.42Å; V943-E946 PolarHBondContact O-N 3.47Å; E946-R949 WeakPolarHBondContact O-CB 3.22Å; E946-R949 PolarHBondContact O-N 3.48Å; E946-R949 WeakPolarHBondContact OE2-CD 3.36Å; E946-R949 IonicContact OE2-CZ 3.14Å; E946-R949 IonicContact OE2-NH1 2.83Å; E946-R949 PolarHBondContact OE2-NH1 2.8Å; E946-S950 PolarHBondContact O-N 3.46Å; E946-S950 PolarHBondContact O-OG 2.96Å
947	K	75.9	Confident	68.8	Low	132 Å²	132	98.6 Å²	98.6	57%	0.574	51%	0.513	S	S	*	.	H	α-helix	trans	-61.6	-45.4	171.9	-176.9	162.3	-177.3	164.7	0	112.2	V943 R949 S950 D951	V943-K947 WeakPolarHBondContact O-CB 3.48Å; V943-K947 PolarHBondContact O-N 2.81Å; K947-R949 VanDerWaalsContact C-N 3.26Å; K947-R949 PolarHBondContact O-N 2.98Å; K947-S950 WeakPolarHBondContact O-CB 3.45Å; K947-S950 PolarHBondContact O-N 3.42Å; K947-S950 VanDerWaalsContact O-N 3.16Å; K947-D951 WeakPolarHBondContact O-CB 3.35Å; K947-D951 PolarHBondContact O-N 3.5Å
948	L	82.9	Confident	70.4	Confident	97 Å²	97	94.9 Å²	94.9	51%	0.508	50%	0.497	S	S	.	.	H	α-helix	trans	-62.3	-31.5	175.1	-75.4	172	0	0	0	112.8	L944 L945 Y952	L944-L948 HydrophobicContact CD2-CD1 3.75Å; L944-L948 HydrophobicContact CD2-CG 4.31Å; L944-L948 WeakPolarHBondContact O-CB 3.37Å; L944-L948 VanDerWaalsContact O-CG 3.27Å; L944-L948 WeakPolarHBondContact O-CG 3.35Å; L944-L948 PolarHBondContact O-N 3.31Å; L945-L948 PolarHBondContact O-N 3.33Å; L948-Y952 WeakPolarHBondContact O-CB 3.44Å; L948-Y952 PolarHBondContact O-N 3.22Å
949	R	81.8	Confident	72.3	Confident	156 Å²	156	93.3 Å²	93.3	59%	0.589	49%	0.494	S	S	*	.	H	α-helix	trans	-68	-43.2	172.2	-74.7	167.1	176.7	156.9	-1.1	111.8	L945 E946 K947 A953	L945-R949 VanDerWaalsContact O-CG 3.31Å; L945-R949 WeakPolarHBondContact O-CG 3.39Å; L945-R949 PolarHBondContact O-N 3.05Å; E946-R949 WeakPolarHBondContact O-CB 3.22Å; E946-R949 PolarHBondContact O-N 3.48Å; E946-R949 WeakPolarHBondContact OE2-CD 3.36Å; E946-R949 IonicContact OE2-CZ 3.14Å; E946-R949 IonicContact OE2-NH1 2.83Å; E946-R949 PolarHBondContact OE2-NH1 2.8Å; K947-R949 VanDerWaalsContact C-N 3.26Å; K947-R949 PolarHBondContact O-N 2.98Å; R949-A953 WeakPolarHBondContact O-CB 3.41Å; R949-A953 PolarHBondContact O-N 2.99Å
950	S	73.2	Confident	74.1	Confident	63 Å²	63	92.3 Å²	92.3	44%	0.441	49%	0.485	S	S	.	.	H	α-helix	trans	-61.4	-53.4	173.3	-63.5	0	0	0	0	111.3	E946 K947 Y952 A953 D954	E946-S950 PolarHBondContact O-N 3.46Å; E946-S950 PolarHBondContact O-OG 2.96Å; K947-S950 WeakPolarHBondContact O-CB 3.45Å; K947-S950 PolarHBondContact O-N 3.42Å; K947-S950 VanDerWaalsContact O-N 3.16Å; S950-Y952 VanDerWaalsContact C-N 3.25Å; S950-Y952 PolarHBondContact O-N 3.02Å; S950-A953 WeakPolarHBondContact O-CB 3.46Å; S950-A953 PolarHBondContact O-N 3.41Å; S950-D954 PolarHBondContact O-N 3Å
951	D	80	Confident	75.3	Confident	82 Å²	82	95 Å²	95	44%	0.439	48%	0.484	S	S	.	.	H	α-helix	trans	-56.8	-39.2	179.6	-63.5	-12.6	0	0	0	111.3	K947 L955	K947-D951 WeakPolarHBondContact O-CB 3.35Å; K947-D951 PolarHBondContact O-N 3.5Å; D951-L955 VanDerWaalsContact O-CB 3.29Å; D951-L955 WeakPolarHBondContact O-CB 3.45Å; D951-L955 PolarHBondContact O-N 3.06Å
952	Y	80.7	Confident	76.1	Confident	175 Å²	175	96.6 Å²	96.6	69%	0.686	49%	0.489	S	S	*	.	H	α-helix	trans	-71.6	-37.6	175.8	-170.5	-91.4	0	0	0	113.1	L948 S950 A956	L948-Y952 WeakPolarHBondContact O-CB 3.44Å; L948-Y952 PolarHBondContact O-N 3.22Å; S950-Y952 VanDerWaalsContact C-N 3.25Å; S950-Y952 PolarHBondContact O-N 3.02Å; Y952-A956 WeakPolarHBondContact O-CB 3.37Å; Y952-A956 PolarHBondContact O-N 3.14Å
953	A	76.8	Confident	76.9	Confident	45 Å²	45	97.6 Å²	97.6	37%	0.372	49%	0.49	S	S	.	.	H	α-helix	trans	-66	-42.2	175.3	0	0	0	0	0	111.6	R949 S950 A956 N957	R949-A953 WeakPolarHBondContact O-CB 3.41Å; R949-A953 PolarHBondContact O-N 2.99Å; S950-A953 WeakPolarHBondContact O-CB 3.46Å; S950-A953 PolarHBondContact O-N 3.41Å; A953-A956 PolarHBondContact O-N 2.97Å; A953-N957 WeakPolarHBondContact O-CB 3.08Å; A953-N957 VanDerWaalsContact O-CG 3.22Å; A953-N957 PolarHBondContact O-N 3.42Å; A953-N957 PolarHBondContact O-ND2 3.39Å; A953-N957 VanDerWaalsContact O-ND2 3.12Å
954	D	75	Confident	77.5	Confident	100 Å²	100	97.4 Å²	97.4	54%	0.535	48%	0.484	S	S	.	.	H	α-helix	trans	-68.2	-38.1	176.8	-71.2	-32.4	0	0	0	112	S950 N957 S958	S950-D954 PolarHBondContact O-N 3Å; D954-N957 PolarHBondContact O-N 3.5Å; D954-S958 WeakPolarHBondContact O-CB 3.31Å; D954-S958 PolarHBondContact O-N 3.3Å
955	L	82.5	Confident	77.9	Confident	104 Å²	104	99.3 Å²	99.3	55%	0.545	49%	0.488	S	S	.	.	H	α-helix	trans	-62.1	-46.6	170.9	-178.4	60.7	0	0	0	111.7	D951 N957 S958 V959	D951-L955 VanDerWaalsContact O-CB 3.29Å; D951-L955 WeakPolarHBondContact O-CB 3.45Å; D951-L955 PolarHBondContact O-N 3.06Å; L955-N957 PolarHBondContact O-N 3.09Å; L955-S958 WeakPolarHBondContact O-CB 3.34Å; L955-S958 PolarHBondContact O-N 3.15Å; L955-S958 VanDerWaalsContact O-N 3.12Å; L955-V959 HydrophobicContact CD1-CG2 4.43Å; L955-V959 WeakPolarHBondContact O-CG2 3.35Å; L955-V959 PolarHBondContact O-N 2.96Å
956	A	76.3	Confident	77.9	Confident	48 Å²	48	98 Å²	98	40%	0.397	49%	0.489	S	S	.	.	H	α-helix	trans	-61.4	-43	177.5	0	0	0	0	0	112	Y952 A953 S958 V959 Y960	Y952-A956 WeakPolarHBondContact O-CB 3.37Å; Y952-A956 PolarHBondContact O-N 3.14Å; A953-A956 PolarHBondContact O-N 2.97Å; A956-S958 VanDerWaalsContact C-N 3.31Å; A956-S958 PolarHBondContact O-N 2.68Å; A956-V959 PolarHBondContact O-N 3.26Å; A956-Y960 WeakPolarHBondContact O-CB 3.37Å; A956-Y960 PolarHBondContact O-N 3.43Å
957	N	74.4	Confident	78.4	Confident	81 Å²	81	98.9 Å²	98.9	43%	0.433	49%	0.488	S	S	.	.	H	α-helix	trans	-62.2	-37.6	173.1	-73.2	-34.2	0	0	0	111.9	A953 D954 L955 R961	A953-N957 WeakPolarHBondContact O-CB 3.08Å; A953-N957 VanDerWaalsContact O-CG 3.22Å; A953-N957 PolarHBondContact O-N 3.42Å; A953-N957 PolarHBondContact O-ND2 3.39Å; A953-N957 VanDerWaalsContact O-ND2 3.12Å; D954-N957 PolarHBondContact O-N 3.5Å; L955-N957 PolarHBondContact O-N 3.09Å; N957-R961 VanDerWaalsContact O-CG 3.31Å; N957-R961 WeakPolarHBondContact O-CG 3.15Å; N957-R961 PolarHBondContact O-N 2.88Å; N957-R961 VanDerWaalsContact O-N 3.12Å; N957-R961 PolarHBondContact O-NE 2.7Å
958	S	73.1	Confident	78.6	Confident	47 Å²	47	97.5 Å²	97.5	33%	0.329	49%	0.486	S	S	.	.	H	α-helix	trans	-66.7	-46.3	176.1	-158.8	0	0	0	0	112	D954 L955 A956 R961 I962	D954-S958 WeakPolarHBondContact O-CB 3.31Å; D954-S958 PolarHBondContact O-N 3.3Å; L955-S958 WeakPolarHBondContact O-CB 3.34Å; L955-S958 PolarHBondContact O-N 3.15Å; L955-S958 VanDerWaalsContact O-N 3.12Å; A956-S958 VanDerWaalsContact C-N 3.31Å; A956-S958 PolarHBondContact O-N 2.68Å; S958-R961 PolarHBondContact O-N 3.37Å; S958-I962 VanDerWaalsContact O-CG1 3.3Å; S958-I962 WeakPolarHBondContact O-CG1 3.39Å; S958-I962 PolarHBondContact O-N 3.01Å
959	V	77.9	Confident	78.4	Confident	66 Å²	66	95.5 Å²	95.5	40%	0.4	48%	0.484	S	S	.	.	H	α-helix	trans	-59.7	-47.5	175.3	173.1	0	0	0	0	110.8	L955 A956 R961 I962 E963	L955-V959 HydrophobicContact CD1-CG2 4.43Å; L955-V959 WeakPolarHBondContact O-CG2 3.35Å; L955-V959 PolarHBondContact O-N 2.96Å; A956-V959 PolarHBondContact O-N 3.26Å; V959-R961 VanDerWaalsContact C-N 3.34Å; V959-R961 PolarHBondContact O-N 3.45Å; V959-I962 WeakPolarHBondContact O-CB 3.34Å; V959-I962 PolarHBondContact O-N 3Å; V959-E963 HydrophobicContact CG1-CG 4.37Å; V959-E963 WeakPolarHBondContact O-CG 3.26Å; V959-E963 PolarHBondContact O-N 3.21Å
960	Y	80.4	Confident	78.3	Confident	121 Å²	121	90.6 Å²	90.6	48%	0.475	48%	0.477	S	S	.	.	H	α-helix	trans	-56.2	-45.9	177.1	179.8	-88.4	0	0	0	112.3	A956 I962 E963 E964	A956-Y960 WeakPolarHBondContact O-CB 3.37Å; A956-Y960 PolarHBondContact O-N 3.43Å; Y960-I962 VanDerWaalsContact C-N 3.31Å; Y960-I962 PolarHBondContact O-N 2.96Å; Y960-E963 PolarHBondContact O-N 2.98Å; Y960-E964 WeakPolarHBondContact O-CB 3.36Å; Y960-E964 PolarHBondContact O-N 2.95Å
961	R	76.8	Confident	78.6	Confident	130 Å²	130	90.8 Å²	90.8	49%	0.491	48%	0.478	S	S	.	.	H	α-helix	trans	-64.9	-31.4	176.5	-71.3	-180	-60.3	-122.3	4	113	N957 S958 V959 K965	N957-R961 VanDerWaalsContact O-CG 3.31Å; N957-R961 WeakPolarHBondContact O-CG 3.15Å; N957-R961 PolarHBondContact O-N 2.88Å; N957-R961 VanDerWaalsContact O-N 3.12Å; N957-R961 PolarHBondContact O-NE 2.7Å; S958-R961 PolarHBondContact O-N 3.37Å; V959-R961 VanDerWaalsContact C-N 3.34Å; V959-R961 PolarHBondContact O-N 3.45Å; R961-K965 WeakPolarHBondContact O-CB 3.3Å; R961-K965 WeakPolarHBondContact O-CG 3.37Å; R961-K965 PolarHBondContact O-N 2.88Å; R961-K965 VanDerWaalsContact O-N 3.1Å
962	I	77.4	Confident	78.6	Confident	108 Å²	108	90.8 Å²	90.8	55%	0.554	49%	0.485	S	S	*	.	H	α-helix	trans	-72.3	-42.8	174.9	-68.8	164.6	0	0	0	110.3	S958 V959 Y960 K965 A966	S958-I962 VanDerWaalsContact O-CG1 3.3Å; S958-I962 WeakPolarHBondContact O-CG1 3.39Å; S958-I962 PolarHBondContact O-N 3.01Å; V959-I962 WeakPolarHBondContact O-CB 3.34Å; V959-I962 PolarHBondContact O-N 3Å; Y960-I962 VanDerWaalsContact C-N 3.31Å; Y960-I962 PolarHBondContact O-N 2.96Å; I962-K965 PolarHBondContact O-N 3.44Å; I962-A966 WeakPolarHBondContact O-CB 3.38Å; I962-A966 PolarHBondContact O-N 2.97Å
963	E	79.2	Confident	78.5	Confident	110 Å²	110	86.5 Å²	86.5	51%	0.514	48%	0.477	S	S	.	.	H	α-helix	trans	-65.7	-36	175.7	-71.4	-177.2	171.8	0	0	113	V959 Y960 A966 R967	V959-E963 HydrophobicContact CG1-CG 4.37Å; V959-E963 WeakPolarHBondContact O-CG 3.26Å; V959-E963 PolarHBondContact O-N 3.21Å; Y960-E963 PolarHBondContact O-N 2.98Å; E963-A966 PolarHBondContact O-N 3.46Å; E963-R967 WeakPolarHBondContact O-CB 3.4Å; E963-R967 WeakPolarHBondContact O-CG 3.45Å; E963-R967 PolarHBondContact O-N 2.68Å; E963-R967 PolarHBondContact O-NE 2.96Å
964	E	79.2	Confident	78.6	Confident	76 Å²	76	90.9 Å²	90.9	36%	0.355	49%	0.489	S	S	.	.	H	α-helix	trans	-63.9	-52	172	-171.6	165.2	-121	0	0	111	Y960 A966 R967 D968	Y960-E964 WeakPolarHBondContact O-CB 3.36Å; Y960-E964 PolarHBondContact O-N 2.95Å; E964-A966 VanDerWaalsContact C-N 3.26Å; E964-A966 PolarHBondContact O-N 3.36Å; E964-R967 WeakPolarHBondContact O-CB 3.29Å; E964-R967 PolarHBondContact O-N 3.09Å; E964-D968 PolarHBondContact O-N 2.95Å
965	K	81.8	Confident	78.6	Confident	152 Å²	152	89.2 Å²	89.2	66%	0.661	49%	0.486	S	S	*	.	H	α-helix	trans	-59	-34.7	174.2	-75	177.6	178.8	-178.5	0	113.3	R961 I962 A969	R961-K965 WeakPolarHBondContact O-CB 3.3Å; R961-K965 WeakPolarHBondContact O-CG 3.37Å; R961-K965 PolarHBondContact O-N 2.88Å; R961-K965 VanDerWaalsContact O-N 3.1Å; I962-K965 PolarHBondContact O-N 3.44Å; K965-A969 VanDerWaalsContact O-CB 3.29Å; K965-A969 WeakPolarHBondContact O-CB 3.27Å; K965-A969 PolarHBondContact O-N 2.95Å
966	A	76.9	Confident	78.4	Confident	57 Å²	57	87.8 Å²	87.8	47%	0.471	48%	0.478	S	S	.	.	H	α-helix	trans	-69	-40	175.1	0	0	0	0	0	112	I962 E963 E964 A970	I962-A966 WeakPolarHBondContact O-CB 3.38Å; I962-A966 PolarHBondContact O-N 2.97Å; E963-A966 PolarHBondContact O-N 3.46Å; E964-A966 VanDerWaalsContact C-N 3.26Å; E964-A966 PolarHBondContact O-N 3.36Å; A966-A970 VanDerWaalsContact O-CB 3.29Å; A966-A970 WeakPolarHBondContact O-CB 3.31Å; A966-A970 PolarHBondContact O-N 2.69Å
967	R	85.2	Confident	78.5	Confident	127 Å²	127	90.5 Å²	90.5	48%	0.479	49%	0.485	S	S	.	.	H	α-helix	trans	-65.3	-40.8	172.9	-77.9	178.8	-73	150.3	-4.7	112	E963 E964 A970 S971	E963-R967 WeakPolarHBondContact O-CB 3.4Å; E963-R967 WeakPolarHBondContact O-CG 3.45Å; E963-R967 PolarHBondContact O-N 2.68Å; E963-R967 PolarHBondContact O-NE 2.96Å; E964-R967 WeakPolarHBondContact O-CB 3.29Å; E964-R967 PolarHBondContact O-N 3.09Å; R967-A970 PolarHBondContact O-N 3.48Å; R967-S971 VanDerWaalsContact O-CB 3.28Å; R967-S971 WeakPolarHBondContact O-CB 3.48Å; R967-S971 PolarHBondContact O-N 3.46Å; R967-S971 PolarHBondContact O-OG 2.92Å
968	D	80.2	Confident	78.5	Confident	102 Å²	102	93.3 Å²	93.3	55%	0.545	49%	0.494	S	S	.	.	H	α-helix	trans	-66	-44.2	176	-72.4	-17.3	0	0	0	111.7	E964 S971 S972	E964-D968 PolarHBondContact O-N 2.95Å; D968-S971 PolarHBondContact O-N 3.45Å; D968-S972 WeakPolarHBondContact O-CB 3.41Å; D968-S972 PolarHBondContact O-N 3.3Å
969	A	78.4	Confident	78.4	Confident	56 Å²	56	97.1 Å²	97.1	46%	0.463	51%	0.506	S	S	.	.	H	α-helix	trans	-62.6	-43.7	175.1	0	0	0	0	0	111.8	K965 S972 V973	K965-A969 VanDerWaalsContact O-CB 3.29Å; K965-A969 WeakPolarHBondContact O-CB 3.27Å; K965-A969 PolarHBondContact O-N 2.95Å; A969-S972 PolarHBondContact O-N 2.93Å; A969-V973 WeakPolarHBondContact O-CG2 3.17Å; A969-V973 PolarHBondContact O-N 3.04Å
970	A	79.5	Confident	77.9	Confident	52 Å²	52	98.5 Å²	98.5	43%	0.43	51%	0.507	S	S	.	.	H	α-helix	trans	-63	-40.9	174.8	0	0	0	0	0	112.1	A966 R967 V973 Q974	A966-A970 VanDerWaalsContact O-CB 3.29Å; A966-A970 WeakPolarHBondContact O-CB 3.31Å; A966-A970 PolarHBondContact O-N 2.69Å; R967-A970 PolarHBondContact O-N 3.48Å; A970-V973 PolarHBondContact O-N 3.32Å; A970-Q974 WeakPolarHBondContact O-CG 3.21Å; A970-Q974 PolarHBondContact O-N 3.12Å
971	S	79.9	Confident	77.1	Confident	67 Å²	67	98.8 Å²	98.8	47%	0.469	51%	0.513	S	S	.	.	H	α-helix	trans	-67.4	-37.2	176.4	-58.6	0	0	0	0	112	R967 D968 Q974 S975	R967-S971 VanDerWaalsContact O-CB 3.28Å; R967-S971 WeakPolarHBondContact O-CB 3.48Å; R967-S971 PolarHBondContact O-N 3.46Å; R967-S971 PolarHBondContact O-OG 2.92Å; D968-S971 PolarHBondContact O-N 3.45Å; S971-Q974 PolarHBondContact O-N 2.96Å; S971-S975 VanDerWaalsContact O-CB 3.27Å; S971-S975 WeakPolarHBondContact O-CB 3.45Å; S971-S975 PolarHBondContact O-N 3.2Å
972	S	78.9	Confident	76.2	Confident	82 Å²	82	97.5 Å²	97.5	57%	0.573	51%	0.514	S	S	*	.	H	α-helix	trans	-64.1	-44.4	172.9	-173.2	0	0	0	0	111.3	D968 A969 S975 L976	D968-S972 WeakPolarHBondContact O-CB 3.41Å; D968-S972 PolarHBondContact O-N 3.3Å; A969-S972 PolarHBondContact O-N 2.93Å; S972-S975 PolarHBondContact O-N 3.27Å; S972-L976 WeakPolarHBondContact O-CB 3.38Å; S972-L976 PolarHBondContact O-N 3.47Å
973	V	79.6	Confident	75	Confident	86 Å²	86	95 Å²	95	52%	0.521	51%	0.514	S	S	.	.	H	α-helix	trans	-65	-40.6	174.7	170.9	0	0	0	0	111.7	A969 A970 L976 L977	A969-V973 WeakPolarHBondContact O-CG2 3.17Å; A969-V973 PolarHBondContact O-N 3.04Å; A970-V973 PolarHBondContact O-N 3.32Å; V973-L976 PolarHBondContact O-N 2.91Å; V973-L977 HydrophobicContact CG1-CD1 4Å; V973-L977 WeakPolarHBondContact O-CB 3.32Å; V973-L977 WeakPolarHBondContact O-CG 3.46Å; V973-L977 PolarHBondContact O-N 3.2Å
974	Q	78.5	Confident	73.4	Confident	137 Å²	137	96.9 Å²	96.9	64%	0.64	53%	0.527	S	S	*	.	H	α-helix	trans	-65.8	-40.1	173.4	-77.4	-169.9	2.3	0	0	112.5	A970 S971 L977 K978	A970-Q974 WeakPolarHBondContact O-CG 3.21Å; A970-Q974 PolarHBondContact O-N 3.12Å; S971-Q974 PolarHBondContact O-N 2.96Å; Q974-L977 PolarHBondContact O-N 3.17Å; Q974-K978 WeakPolarHBondContact O-CB 3.41Å; Q974-K978 PolarHBondContact O-N 3.27Å
975	S	74.6	Confident	71.6	Confident	65 Å²	65	98.5 Å²	98.5	46%	0.455	54%	0.537	S	S	.	.	H	α-helix	trans	-63.9	-43	175.3	-171.8	0	0	0	0	111	S971 S972 K978 Q979	S971-S975 VanDerWaalsContact O-CB 3.27Å; S971-S975 WeakPolarHBondContact O-CB 3.45Å; S971-S975 PolarHBondContact O-N 3.2Å; S972-S975 PolarHBondContact O-N 3.27Å; S975-K978 CarbonylContact O-C 3.14Å; S975-K978 PolarHBondContact O-N 3.25Å; S975-Q979 WeakPolarHBondContact O-CG 3.28Å; S975-Q979 PolarHBondContact O-N 3.38Å
976	L	78.1	Confident	69.4	Low	73 Å²	73	97.9 Å²	97.9	38%	0.382	54%	0.538	S	S	.	.	H	α-helix	trans	-64	-43.5	174.2	-177.4	63.4	0	0	0	111.8	S972 V973 K978 Q979 F980	S972-L976 WeakPolarHBondContact O-CB 3.38Å; S972-L976 PolarHBondContact O-N 3.47Å; V973-L976 PolarHBondContact O-N 2.91Å; L976-K978 VanDerWaalsContact C-N 3.31Å; L976-K978 PolarHBondContact O-N 3.04Å; L976-Q979 PolarHBondContact O-N 2.71Å; L976-F980 HydrophobicContact CD1-CD2 4.28Å; L976-F980 HydrophobicContact CD1-CE2 4.04Å; L976-F980 HydrophobicContact CD2-CE2 4.24Å; L976-F980 HydrophobicContact CG-CD2 3.99Å; L976-F980 HydrophobicContact CG-CE2 3.81Å; L976-F980 WeakPolarHBondContact O-CD2 3.45Å; L976-F980 PolarHBondContact O-N 2.97Å
977	L	78.6	Confident	67.4	Low	106 Å²	106	103.1 Å²	103.1	56%	0.555	55%	0.553	S	S	*	*	H	α-helix	trans	-59	-42	172.2	-84.3	161	0	0	0	111.6	V973 Q974 F980 Q981	V973-L977 HydrophobicContact CG1-CD1 4Å; V973-L977 WeakPolarHBondContact O-CB 3.32Å; V973-L977 WeakPolarHBondContact O-CG 3.46Å; V973-L977 PolarHBondContact O-N 3.2Å; Q974-L977 PolarHBondContact O-N 3.17Å; L977-F980 WeakPolarHBondContact O-CB 3.47Å; L977-F980 PolarHBondContact O-N 2.98Å; L977-Q981 WeakPolarHBondContact O-CB 3.02Å; L977-Q981 PolarHBondContact O-N 2.83Å
978	K	73.8	Confident	65	Low	140 Å²	140	102.5 Å²	102.5	61%	0.609	57%	0.565	S	S	*	*	H	α-helix	trans	-68	-37.1	175.7	-168.1	174.9	-178.4	179.6	0	111.8	Q974 S975 L976 Q981 M982	Q974-K978 WeakPolarHBondContact O-CB 3.41Å; Q974-K978 PolarHBondContact O-N 3.27Å; S975-K978 CarbonylContact O-C 3.14Å; S975-K978 PolarHBondContact O-N 3.25Å; L976-K978 VanDerWaalsContact C-N 3.31Å; L976-K978 PolarHBondContact O-N 3.04Å; K978-Q981 PolarHBondContact O-N 3.03Å; K978-M982 HydrophobicContact CG-CG 4.34Å; K978-M982 WeakPolarHBondContact O-CB 3.44Å; K978-M982 WeakPolarHBondContact O-CG 3.3Å; K978-M982 PolarHBondContact O-N 2.84Å
979	Q	71.2	Confident	62.8	Low	127 Å²	127	102.6 Å²	102.6	59%	0.593	57%	0.569	S	S	*	*	H	α-helix	trans	-65.5	-39.1	172	-76.5	-179.1	-7.2	0	0	112.1	S975 L976 G983	S975-Q979 WeakPolarHBondContact O-CG 3.28Å; S975-Q979 PolarHBondContact O-N 3.38Å; L976-Q979 PolarHBondContact O-N 2.71Å; Q979-G983 WeakPolarHBondContact O-CA 3.46Å; Q979-G983 PolarHBondContact O-N 3.32Å
980	F	67.3	Low	60.6	Low	95 Å²	95	105.7 Å²	105.7	42%	0.417	58%	0.578	S	S	.	*	H	α-helix	trans	-62.7	-42.8	170.2	-82.9	-68	0	0	0	111.6	R147 L976 L977 G983 L984	R147-F980 VanDerWaalsContact CZ-CZ 3.42Å; R147-F980 VanDerWaalsContact NH1-CZ 3.26Å; R147-F980 VanDerWaalsContact NH2-CZ 3.3Å; L976-F980 HydrophobicContact CD1-CD2 4.28Å; L976-F980 HydrophobicContact CD1-CE2 4.04Å; L976-F980 HydrophobicContact CD2-CE2 4.24Å; L976-F980 HydrophobicContact CG-CD2 3.99Å; L976-F980 HydrophobicContact CG-CE2 3.81Å; L976-F980 WeakPolarHBondContact O-CD2 3.45Å; L976-F980 PolarHBondContact O-N 2.97Å; L977-F980 WeakPolarHBondContact O-CB 3.47Å; L977-F980 PolarHBondContact O-N 2.98Å; F980-G983 PolarHBondContact O-N 3.14Å; F980-L984 WeakPolarHBondContact O-CB 3.34Å; F980-L984 VanDerWaalsContact O-CG 3.29Å; F980-L984 WeakPolarHBondContact O-CG 3.26Å; F980-L984 PolarHBondContact O-N 2.99Å
981	Q	64.8	Low	58.3	Low	127 Å²	127	112.2 Å²	112.2	59%	0.593	60%	0.597	S	S	*	*	H	α-helix	trans	-68.1	-42.2	-179.4	-158.1	165.6	34.4	0	0	111.7	L977 K978 L984 I985	L977-Q981 WeakPolarHBondContact O-CB 3.02Å; L977-Q981 PolarHBondContact O-N 2.83Å; K978-Q981 PolarHBondContact O-N 3.03Å; Q981-L984 PolarHBondContact O-N 3.44Å; Q981-I985 HydrophobicContact CG-CD1 4.39Å; Q981-I985 VanDerWaalsContact O-CD1 3.27Å; Q981-I985 WeakPolarHBondContact O-CD1 3.36Å; Q981-I985 WeakPolarHBondContact O-CG1 3.18Å; Q981-I985 PolarHBondContact O-N 3.17Å
982	M	57.7	Low	56	Low	103 Å²	103	115.3 Å²	115.3	51%	0.507	61%	0.608	S	S	.	*	H	α-helix	trans	-70.4	-36.6	173.9	-66.9	-62.5	-61.7	0	0	112.4	K978 L984 I985 M986	K978-M982 HydrophobicContact CG-CG 4.34Å; K978-M982 WeakPolarHBondContact O-CB 3.44Å; K978-M982 WeakPolarHBondContact O-CG 3.3Å; K978-M982 PolarHBondContact O-N 2.84Å; M982-L984 PolarHBondContact O-N 2.82Å; M982-I985 CarbonylContact O-C 3.56Å; M982-I985 WeakPolarHBondContact O-CA 3.35Å; M982-I985 PolarHBondContact O-N 3.37Å; M982-M986 PolarHBondContact O-N 3.17Å; M982-M986 VanDerWaalsContact O-N 3.1Å
983	G	51.2	Low	53.8	Low	54 Å²	54	117 Å²	117	56%	0.557	62%	0.62	S	S	*	*	H	α-helix	trans	-68.5	-20.7	175.1	0	0	0	0	0	113.7	Q979 F980	Q979-G983 WeakPolarHBondContact O-CA 3.46Å; Q979-G983 PolarHBondContact O-N 3.32Å; F980-G983 PolarHBondContact O-N 3.14Å
984	L	45.6	Very low	51.4	Low	151 Å²	151	121.1 Å²	121.1	79%	0.791	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-9.4	167.6	-71.6	167.7	0	0	0	113.3	F980 Q981 M982	F980-L984 WeakPolarHBondContact O-CB 3.34Å; F980-L984 VanDerWaalsContact O-CG 3.29Å; F980-L984 WeakPolarHBondContact O-CG 3.26Å; F980-L984 PolarHBondContact O-N 2.99Å; Q981-L984 PolarHBondContact O-N 3.44Å; M982-L984 PolarHBondContact O-N 2.82Å
985	I	41.7	Very low	49.2	Very low	109 Å²	109	121.6 Å²	121.6	56%	0.559	64%	0.643	S	S	*	*	S	Bend	trans	-108.7	4.9	179.8	-64.8	165.5	0	0	0	111.2	Q981 M982 E987	Q981-I985 HydrophobicContact CG-CD1 4.39Å; Q981-I985 VanDerWaalsContact O-CD1 3.27Å; Q981-I985 WeakPolarHBondContact O-CD1 3.36Å; Q981-I985 WeakPolarHBondContact O-CG1 3.18Å; Q981-I985 PolarHBondContact O-N 3.17Å; M982-I985 CarbonylContact O-C 3.56Å; M982-I985 WeakPolarHBondContact O-CA 3.35Å; M982-I985 PolarHBondContact O-N 3.37Å; I985-E987 PolarHBondContact O-N 3.34Å
986	M	35.6	Very low	47.4	Very low	139 Å²	139	127.8 Å²	127.8	69%	0.685	66%	0.664	S	S	*	*			trans	-75.2	75.5	164.6	-68.9	-81.8	77.7	0	0	110.1	M982	M982-M986 PolarHBondContact O-N 3.17Å; M982-M986 VanDerWaalsContact O-N 3.1Å
987	E	35.4	Very low	45.4	Very low	167 Å²	167	132.2 Å²	132.2	78%	0.78	69%	0.688	S	S	*	*			trans	-50.8	145.5	152.3	-94.7	-164	129.7	0	0	109.3	I985 V989	I985-E987 PolarHBondContact O-N 3.34Å; E987-V989 PolarHBondContact O-N 2.98Å
988	P	33.7	Very low	43.2	Very low	115 Å²	115	132.5 Å²	132.5	75%	0.747	70%	0.696	S	S	*	*			trans	-62.8	111.3	172.8	27.5	-32.6	0	0	0	108.3	N990	P988-N990 PolarHBondContact O-N 3.27Å
989	V	34.5	Very low	41.4	Very low	104 Å²	104	133.6 Å²	133.6	63%	0.63	71%	0.709	S	S	*	*			trans	-55.4	105.4	172.4	175.5	0	0	0	0	107.4	E987 F991	E987-V989 PolarHBondContact O-N 2.98Å; V989-F991 WeakPolarHBondContact O-CD2 3.28Å; V989-F991 PolarHBondContact O-N 3.33Å
990	N	31.6	Very low	39.4	Very low	120 Å²	120	132 Å²	132	64%	0.642	71%	0.712	S	S	*	*			trans	-71.3	98.4	-172.9	-173.4	2.2	0	0	0	108.3	P988 N992	P988-N990 PolarHBondContact O-N 3.27Å; N990-N992 PolarHBondContact O-N 2.83Å; N990-N992 WeakPolarHBondContact OD1-CB 3.29Å; N990-N992 PolarHBondContact OD1-ND2 3.46Å
991	F	32.5	Very low	37.7	Very low	190 Å²	190	134.3 Å²	134.3	83%	0.833	73%	0.728	S	S	*	*			trans	-65	16.5	-178.1	-83.4	-84.1	0	0	0	114.7	V989 S993	V989-F991 WeakPolarHBondContact O-CD2 3.28Å; V989-F991 PolarHBondContact O-N 3.33Å; F991-S993 PolarHBondContact O-N 2.96Å
992	N	30.4	Very low	36.2	Very low	132 Å²	132	133.5 Å²	133.5	71%	0.706	74%	0.736	S	S	*	*			trans	-95.4	61.2	178.4	-69	-53.5	0	0	0	112.2	N990	N990-N992 PolarHBondContact O-N 2.83Å; N990-N992 WeakPolarHBondContact OD1-CB 3.29Å; N990-N992 PolarHBondContact OD1-ND2 3.46Å
993	S	33.1	Very low	34.9	Very low	118 Å²	118	139 Å²	139	83%	0.825	75%	0.753	S	S	*	*			trans	-157.7	41.1	159.9	-82.4	0	0	0	0	113.1	F991 N995	F991-S993 PolarHBondContact O-N 2.96Å; S993-N995 VanDerWaalsContact C-N 3.29Å; S993-N995 PolarHBondContact O-N 3.27Å
994	M	30.1	Very low	33.8	Very low	172 Å²	172	145 Å²	145	85%	0.847	77%	0.767	S	S	*	*			trans	-69.1	90.5	152.1	-85.1	-77.7	-74.5	0	0	108.1
995	N	32.8	Very low	33.2	Very low	146 Å²	146	142.6 Å²	142.6	78%	0.781	76%	0.762	S	S	*	*			trans	169.1	80.8	154.5	-88.2	-28.2	0	0	0	112.4	S993	S993-N995 VanDerWaalsContact C-N 3.29Å; S993-N995 PolarHBondContact O-N 3.27Å
996	Q	35.3	Very low	32.6	Very low	195 Å²	195	147.4 Å²	147.4	91%	0.911	78%	0.779	S	S	*	*				-177.2	145.2	128.1	-99.6	152.5	99	0	0	111.9
997	L	36	Very low	32.4	Very low	166 Å²	166	147.9 Å²	147.9	87%	0.869	79%	0.785	S	S	*	*			trans	-72.1	160.7	-173.3	-109.8	68.4	0	0	0	112.9
998	P	32.8	Very low	32.4	Very low	113 Å²	113	149.2 Å²	149.2	73%	0.734	79%	0.788	S	S	*	*			trans	-79.2	146.5	-179.6	34.4	-32.8	0	0	0	111.1
999	N	36.2	Very low	32.2	Very low	163 Å²	163	152.3 Å²	152.3	87%	0.872	79%	0.792	S	S	*	*			trans	-130.1	134.7	152.9	-103.5	-16.9	0	0	0	108.8
1000	S	29.9	Very low	32.1	Very low	94 Å²	94	152.5 Å²	152.5	66%	0.657	80%	0.799	S	S	*	*			trans	-66.9	147.5	173.7	54.6	0	0	0	0	110.9
1001	D	30.7	Very low	32	Very low	142 Å²	142	154.5 Å²	154.5	76%	0.759	80%	0.804	S	S	*	*				159.4	163	123.6	-75.9	-12.6	0	0	0	111.2
1002	S	33.8	Very low	32.1	Very low	110 Å²	110	149.8 Å²	149.8	77%	0.769	80%	0.795	S	S	*	*			trans	67.7	90.4	171.4	60.1	0	0	0	0	119.2
1003	Y	29.8	Very low	32.1	Very low	218 Å²	218	150.6 Å²	150.6	86%	0.855	80%	0.799	S	S	*	*				15.2	141.6	122.7	-74	-97.1	0	0	0	121.5
1004	E	29.4	Very low	32.6	Very low	182 Å²	182	152.4 Å²	152.4	85%	0.85	80%	0.795	S	S	*	*			trans	61.7	105	148.8	-68	-174	133	0	0	120.6
1005	S	31.7	Very low	33.1	Very low	99 Å²	99	152.5 Å²	152.5	69%	0.692	80%	0.798	S	S	*	*			trans	-163	85.9	131.8	-175.6	0	0	0	0	111.4	N1007	S1005-N1007 PolarHBondContact O-N 3.18Å
1006	F	28.8	Very low	33.6	Very low	210 Å²	210	154.2 Å²	154.2	92%	0.921	79%	0.794	S	S	*	*			trans	-73.7	77.2	160.5	-82	-86.1	0	0	0	109
1007	N	32.7	Very low	34.3	Very low	149 Å²	149	148.9 Å²	148.9	80%	0.797	77%	0.772	S	S	*	*			trans	-177.2	82	161.3	-92.2	-32.8	0	0	0	110.2	S1005	S1005-N1007 PolarHBondContact O-N 3.18Å
1008	K	34.4	Very low	35.8	Very low	196 Å²	196	149.5 Å²	149.5	85%	0.852	77%	0.768	S	S	*	*			trans	-137.8	99.1	160.2	-111.4	177.2	-177.6	176.3	0	110.5	S1010	K1008-S1010 PolarHBondContact O-N 3.08Å
1009	E	29.2	Very low	37.6	Very low	179 Å²	179	146.4 Å²	146.4	84%	0.836	75%	0.749	S	S	*	*			trans	-63.5	104.5	171.8	-172.5	168.6	-152.7	0	0	109.3	Q1011	E1009-Q1011 PolarHBondContact O-N 2.91Å
1010	S	32.8	Very low	39.2	Very low	109 Å²	109	141.3 Å²	141.3	76%	0.762	72%	0.723	S	S	*	*			trans	-71.4	96.5	177.5	-68.6	0	0	0	0	110.5	K1008 S1012	K1008-S1010 PolarHBondContact O-N 3.08Å; S1010-S1012 PolarHBondContact O-N 3.38Å
1011	Q	28.8	Very low	41.2	Very low	161 Å²	161	140.7 Å²	140.7	75%	0.752	71%	0.711	S	S	*	*			trans	-69.9	70.2	164	-66.3	-172.7	2.7	0	0	110.8	E1009 N1013	E1009-Q1011 PolarHBondContact O-N 2.91Å; Q1011-N1013 VanDerWaalsContact C-N 3.3Å; Q1011-N1013 PolarHBondContact O-N 3.07Å
1012	S	34.8	Very low	43.3	Very low	92 Å²	92	141.7 Å²	141.7	64%	0.643	71%	0.709	S	S	*	*			trans	-79.9	80.7	167.5	45.5	0	0	0	0	110.3	S1010 E1014	S1010-S1012 PolarHBondContact O-N 3.38Å; S1012-E1014 PolarHBondContact O-N 2.98Å
1013	N	32	Very low	45.3	Very low	149 Å²	149	143.7 Å²	143.7	80%	0.797	70%	0.7	S	S	*	*			trans	-71.2	57	167.9	-81.8	-49	0	0	0	111.3	Q1011	Q1011-N1013 VanDerWaalsContact C-N 3.3Å; Q1011-N1013 PolarHBondContact O-N 3.07Å
1014	E	41.8	Very low	47.8	Very low	156 Å²	156	137.7 Å²	137.7	73%	0.729	68%	0.682	S	S	*	*			trans	-125.8	116.9	-174.6	-69.5	-174	140.3	0	0	112.7	S1012 Y1016	S1012-E1014 PolarHBondContact O-N 2.98Å; E1014-Y1016 PolarHBondContact O-N 2.96Å
1015	L	42.2	Very low	50.2	Low	174 Å²	174	133.2 Å²	133.2	91%	0.911	66%	0.661	S	S	*	*			trans	59.7	38.6	153.3	-59.4	172.5	0	0	0	118.5	D1017	L1015-D1017 PolarHBondContact O-N 3.26Å
1016	Y	42.9	Very low	52.8	Low	182 Å²	182	134.8 Å²	134.8	71%	0.714	66%	0.655	S	S	*	*			trans	-61.9	105.5	147.7	-89.9	-85.8	0	0	0	109.3	E1014 K1018 M1021	E1014-Y1016 PolarHBondContact O-N 2.96Å; Y1016-K1018 PolarHBondContact O-N 3.42Å; Y1016-M1021 HydrophobicContact CD1-CG 4.1Å; Y1016-M1021 HydrophobicContact CD1-SD 3.92Å; Y1016-M1021 HydrophobicContact CE1-SD 4.47Å; Y1016-M1021 HydrophobicContact CG-CG 4.39Å
1017	D	49.8	Very low	55.2	Low	82 Å²	82	127.6 Å²	127.6	44%	0.439	64%	0.635	S	S	.	*			trans	-50.5	117.8	173.9	170.6	16.6	0	0	0	109.2	L1015 S1019 V1020 M1021 R1023	L1015-D1017 PolarHBondContact O-N 3.26Å; D1017-S1019 VanDerWaalsContact CG-OG 3.29Å; D1017-S1019 PolarHBondContact O-N 3.26Å; D1017-S1019 WeakPolarHBondContact OD1-CB 3.2Å; D1017-S1019 PolarHBondContact OD1-N 3.37Å; D1017-S1019 PolarHBondContact OD1-OG 3.3Å; D1017-S1019 WeakPolarHBondContact OD2-CB 3.19Å; D1017-S1019 PolarHBondContact OD2-OG 2.93Å; D1017-V1020 HydrophobicContact CB-CB 4.4Å; D1017-V1020 HydrophobicContact CB-CG2 4.01Å; D1017-V1020 WeakPolarHBondContact O-CA 3.3Å; D1017-V1020 WeakPolarHBondContact O-CB 3.3Å; D1017-V1020 PolarHBondContact O-N 3.5Å; D1017-M1021 PolarHBondContact O-N 2.88Å; D1017-M1021 VanDerWaalsContact O-N 3.1Å; D1017-R1023 IonicContact OD2-NH2 3.72Å
1018	K	67.4	Low	57.5	Low	180 Å²	180	127.9 Å²	127.9	78%	0.783	63%	0.625	S	S	*	*	H	α-helix	trans	-54	-30.5	179.6	-69.5	178.1	-179.7	173.8	0	110.8	Y1016 F1022	Y1016-K1018 PolarHBondContact O-N 3.42Å; K1018-F1022 VanDerWaalsContact O-CB 3.25Å; K1018-F1022 WeakPolarHBondContact O-CB 3.44Å; K1018-F1022 PolarHBondContact O-N 2.92Å
1019	S	70.8	Confident	59.8	Low	48 Å²	48	122.6 Å²	122.6	34%	0.336	61%	0.605	S	S	.	*	H	α-helix	trans	-67.8	-37.1	175.7	98.1	0	0	0	0	113	D1017 R1023	D1017-S1019 VanDerWaalsContact CG-OG 3.29Å; D1017-S1019 PolarHBondContact O-N 3.26Å; D1017-S1019 WeakPolarHBondContact OD1-CB 3.2Å; D1017-S1019 PolarHBondContact OD1-N 3.37Å; D1017-S1019 PolarHBondContact OD1-OG 3.3Å; D1017-S1019 WeakPolarHBondContact OD2-CB 3.19Å; D1017-S1019 PolarHBondContact OD2-OG 2.93Å; S1019-R1023 WeakPolarHBondContact O-CB 3.43Å; S1019-R1023 VanDerWaalsContact O-CG 3.24Å; S1019-R1023 WeakPolarHBondContact O-CG 3.35Å; S1019-R1023 PolarHBondContact O-N 3.26Å; S1019-R1023 PolarHBondContact O-NE 3.14Å; S1019-R1023 VanDerWaalsContact OG-CZ 3.28Å; S1019-R1023 PolarHBondContact OG-NH1 3.28Å; S1019-R1023 PolarHBondContact OG-NH2 3.34Å
1020	V	69.5	Low	62.1	Low	55 Å²	55	117 Å²	117	33%	0.333	58%	0.584	S	S	.	*	H	α-helix	trans	-67.7	-48.1	173.6	177.3	0	0	0	0	110.4	D1017 F1022 R1023 L1024	D1017-V1020 HydrophobicContact CB-CB 4.4Å; D1017-V1020 HydrophobicContact CB-CG2 4.01Å; D1017-V1020 WeakPolarHBondContact O-CA 3.3Å; D1017-V1020 WeakPolarHBondContact O-CB 3.3Å; D1017-V1020 PolarHBondContact O-N 3.5Å; V1020-F1022 PolarHBondContact O-N 3.18Å; V1020-R1023 VanDerWaalsContact CG2-NH2 3.25Å; V1020-R1023 PolarHBondContact O-N 3.44Å; V1020-L1024 HydrophobicContact CG1-CD1 3.96Å; V1020-L1024 HydrophobicContact CG1-CG 4.48Å; V1020-L1024 PolarHBondContact O-N 3.08Å
1021	M	72.1	Confident	64.2	Low	82 Å²	82	116.1 Å²	116.1	40%	0.404	57%	0.57	S	S	.	*	H	α-helix	trans	-63.4	-39.5	178.2	-74.5	-58.2	-62.6	0	0	112.4	Y1016 D1017 L1024 Q1025	Y1016-M1021 HydrophobicContact CD1-CG 4.1Å; Y1016-M1021 HydrophobicContact CD1-SD 3.92Å; Y1016-M1021 HydrophobicContact CE1-SD 4.47Å; Y1016-M1021 HydrophobicContact CG-CG 4.39Å; D1017-M1021 PolarHBondContact O-N 2.88Å; D1017-M1021 VanDerWaalsContact O-N 3.1Å; M1021-L1024 PolarHBondContact O-N 3.14Å; M1021-L1024 HydrophobicContact SD-CD1 4.47Å; M1021-Q1025 WeakPolarHBondContact O-CB 3.39Å; M1021-Q1025 PolarHBondContact O-N 2.93Å
1022	F	74.3	Confident	66.5	Low	163 Å²	163	112.7 Å²	112.7	72%	0.715	56%	0.557	S	S	*	*	H	α-helix	trans	-67.6	-35	175.6	-143.2	-83	0	0	0	112.2	K1018 V1020 K1026	K1018-F1022 VanDerWaalsContact O-CB 3.25Å; K1018-F1022 WeakPolarHBondContact O-CB 3.44Å; K1018-F1022 PolarHBondContact O-N 2.92Å; V1020-F1022 PolarHBondContact O-N 3.18Å; F1022-K1026 WeakPolarHBondContact O-CB 3.49Å; F1022-K1026 PolarHBondContact O-N 2.89Å
1023	R	77.1	Confident	68.4	Low	152 Å²	152	114.2 Å²	114.2	57%	0.574	55%	0.554	S	S	*	*	H	α-helix	trans	-67.9	-43.6	173	-77.1	-179.3	-63.2	-126.8	-2.4	112	D1017 S1019 V1020 A1027	D1017-R1023 IonicContact OD2-NH2 3.72Å; S1019-R1023 WeakPolarHBondContact O-CB 3.43Å; S1019-R1023 VanDerWaalsContact O-CG 3.24Å; S1019-R1023 WeakPolarHBondContact O-CG 3.35Å; S1019-R1023 PolarHBondContact O-N 3.26Å; S1019-R1023 PolarHBondContact O-NE 3.14Å; S1019-R1023 VanDerWaalsContact OG-CZ 3.28Å; S1019-R1023 PolarHBondContact OG-NH1 3.28Å; S1019-R1023 PolarHBondContact OG-NH2 3.34Å; V1020-R1023 VanDerWaalsContact CG2-NH2 3.25Å; V1020-R1023 PolarHBondContact O-N 3.44Å; R1023-A1027 VanDerWaalsContact O-CB 3.3Å; R1023-A1027 WeakPolarHBondContact O-CB 3.37Å; R1023-A1027 PolarHBondContact O-N 2.93Å
1024	L	81.1	Confident	70.2	Confident	91 Å²	91	112.6 Å²	112.6	48%	0.476	55%	0.545	S	S	.	.	H	α-helix	trans	-66.1	-42.2	176.6	-77.1	170.4	0	0	0	112	V1020 M1021 A1027 R1028	V1020-L1024 HydrophobicContact CG1-CD1 3.96Å; V1020-L1024 HydrophobicContact CG1-CG 4.48Å; V1020-L1024 PolarHBondContact O-N 3.08Å; M1021-L1024 PolarHBondContact O-N 3.14Å; M1021-L1024 HydrophobicContact SD-CD1 4.47Å; L1024-A1027 PolarHBondContact O-N 3.42Å; L1024-R1028 WeakPolarHBondContact O-CG 3.49Å; L1024-R1028 PolarHBondContact O-N 2.87Å
1025	Q	80.4	Confident	71.7	Confident	88 Å²	88	111.3 Å²	111.3	41%	0.411	54%	0.536	S	S	.	.	H	α-helix	trans	-63.9	-49.5	175	-170	58.8	46.2	0	0	110.5	M1021 A1027 R1028 D1029	M1021-Q1025 WeakPolarHBondContact O-CB 3.39Å; M1021-Q1025 PolarHBondContact O-N 2.93Å; Q1025-A1027 VanDerWaalsContact C-N 3.26Å; Q1025-A1027 PolarHBondContact O-N 3.34Å; Q1025-R1028 CarbonylContact O-C 3.49Å; Q1025-R1028 WeakPolarHBondContact O-CA 3.41Å; Q1025-R1028 WeakPolarHBondContact O-CB 3.25Å; Q1025-R1028 PolarHBondContact O-N 2.96Å; Q1025-D1029 PolarHBondContact NE2-OD1 3.23Å; Q1025-D1029 PolarHBondContact O-N 2.93Å
1026	K	85.4	Confident	72.7	Confident	133 Å²	133	107.2 Å²	107.2	58%	0.578	52%	0.522	S	S	*	.	H	α-helix	trans	-58.4	-36.4	175.6	-174.5	175.7	-178.1	179.8	0	112.8	F1022 T1030	F1022-K1026 WeakPolarHBondContact O-CB 3.49Å; F1022-K1026 PolarHBondContact O-N 2.89Å; K1026-T1030 WeakPolarHBondContact O-CB 3.15Å; K1026-T1030 PolarHBondContact O-N 3.07Å; K1026-T1030 PolarHBondContact O-OG1 3.46Å
1027	A	80.7	Confident	73	Confident	59 Å²	59	104 Å²	104	49%	0.488	52%	0.518	S	S	.	.	H	α-helix	trans	-67.4	-39.5	175.2	0	0	0	0	0	112.1	R1023 L1024 Q1025 L1031	R1023-A1027 VanDerWaalsContact O-CB 3.3Å; R1023-A1027 WeakPolarHBondContact O-CB 3.37Å; R1023-A1027 PolarHBondContact O-N 2.93Å; L1024-A1027 PolarHBondContact O-N 3.42Å; Q1025-A1027 VanDerWaalsContact C-N 3.26Å; Q1025-A1027 PolarHBondContact O-N 3.34Å; A1027-L1031 VanDerWaalsContact O-CB 3.3Å; A1027-L1031 WeakPolarHBondContact O-CB 3.5Å; A1027-L1031 PolarHBondContact O-N 3.49Å
1028	R	81.2	Confident	72.5	Confident	155 Å²	155	104 Å²	104	59%	0.585	52%	0.524	S	S	*	.	H	α-helix	trans	-63.5	-51	171.1	-74	175.6	172.7	170.9	-3.4	111.4	L1024 Q1025 T1030 L1031 D1032	L1024-R1028 WeakPolarHBondContact O-CG 3.49Å; L1024-R1028 PolarHBondContact O-N 2.87Å; Q1025-R1028 CarbonylContact O-C 3.49Å; Q1025-R1028 WeakPolarHBondContact O-CA 3.41Å; Q1025-R1028 WeakPolarHBondContact O-CB 3.25Å; Q1025-R1028 PolarHBondContact O-N 2.96Å; R1028-T1030 VanDerWaalsContact C-N 3.27Å; R1028-T1030 PolarHBondContact O-N 3.37Å; R1028-L1031 PolarHBondContact O-N 2.76Å; R1028-D1032 PolarHBondContact O-N 3.44Å
1029	D	81.9	Confident	71.1	Confident	84 Å²	84	104.4 Å²	104.4	45%	0.449	53%	0.526	S	S	.	.	H	α-helix	trans	-57.6	-40.2	178.5	-55.7	-23.5	0	0	0	111.4	Q1025 Q1033	Q1025-D1029 PolarHBondContact NE2-OD1 3.23Å; Q1025-D1029 PolarHBondContact O-N 2.93Å; D1029-Q1033 WeakPolarHBondContact O-CB 3.47Å; D1029-Q1033 PolarHBondContact O-N 3.11Å
1030	T	77.2	Confident	69.3	Low	62 Å²	62	112 Å²	112	38%	0.38	55%	0.547	S	S	.	.	H	α-helix	trans	-70.5	-38.2	176.8	-50.7	0	0	0	0	111.7	K1026 R1028 Q1033 L1034	K1026-T1030 WeakPolarHBondContact O-CB 3.15Å; K1026-T1030 PolarHBondContact O-N 3.07Å; K1026-T1030 PolarHBondContact O-OG1 3.46Å; R1028-T1030 VanDerWaalsContact C-N 3.27Å; R1028-T1030 PolarHBondContact O-N 3.37Å; T1030-Q1033 PolarHBondContact O-N 3.02Å; T1030-L1034 HydrophobicContact CG2-CD1 4.33Å; T1030-L1034 WeakPolarHBondContact O-CB 3.42Å; T1030-L1034 VanDerWaalsContact O-CG 3.3Å; T1030-L1034 WeakPolarHBondContact O-CG 3.49Å; T1030-L1034 PolarHBondContact O-N 3.22Å
1031	L	78	Confident	67.3	Low	91 Å²	91	115.1 Å²	115.1	48%	0.476	57%	0.569	S	S	.	*	H	α-helix	trans	-67.8	-39.9	176.4	-178.9	62.3	0	0	0	111.6	A1027 R1028 L1034 K1035	A1027-L1031 VanDerWaalsContact O-CB 3.3Å; A1027-L1031 WeakPolarHBondContact O-CB 3.5Å; A1027-L1031 PolarHBondContact O-N 3.49Å; R1028-L1031 PolarHBondContact O-N 2.76Å; L1031-L1034 PolarHBondContact O-N 3.1Å; L1031-K1035 HydrophobicContact CG-CD 4.5Å; L1031-K1035 WeakPolarHBondContact O-CB 3.37Å; L1031-K1035 VanDerWaalsContact O-CG 3.3Å; L1031-K1035 WeakPolarHBondContact O-CG 3.3Å; L1031-K1035 PolarHBondContact O-N 3.22Å
1032	D	76.5	Confident	65.6	Low	89 Å²	89	115.2 Å²	115.2	48%	0.476	58%	0.578	S	S	.	*	H	α-helix	trans	-74	-31.9	176.7	-69.3	-21.8	0	0	0	111.5	R1028 K1035 S1036	R1028-D1032 PolarHBondContact O-N 3.44Å; D1032-K1035 PolarHBondContact O-N 3.49Å; D1032-K1035 IonicContact OD1-NZ 3.84Å; D1032-S1036 WeakPolarHBondContact O-CB 3.49Å; D1032-S1036 PolarHBondContact O-N 3.03Å; D1032-S1036 PolarHBondContact O-OG 2.86Å
1033	Q	73.8	Confident	63.7	Low	123 Å²	123	114.2 Å²	114.2	58%	0.575	58%	0.578	S	S	*	*	H	α-helix	trans	-62.7	-45.8	167.7	-175.1	159.8	67.5	0	0	111.5	D1029 T1030 K1035 S1036 D1037	D1029-Q1033 WeakPolarHBondContact O-CB 3.47Å; D1029-Q1033 PolarHBondContact O-N 3.11Å; T1030-Q1033 PolarHBondContact O-N 3.02Å; Q1033-K1035 PolarHBondContact O-N 2.79Å; Q1033-S1036 WeakPolarHBondContact CA-OG 3.43Å; Q1033-S1036 PolarHBondContact O-N 2.96Å; Q1033-S1036 PolarHBondContact O-OG 2.79Å; Q1033-D1037 WeakPolarHBondContact O-CB 3.19Å; Q1033-D1037 PolarHBondContact O-N 2.94Å
1034	L	71.3	Confident	61.5	Low	116 Å²	116	113.7 Å²	113.7	61%	0.607	59%	0.587	S	S	*	*	H	α-helix	trans	-66.4	-33.7	175.8	-72.5	169.2	0	0	0	113.3	T1030 L1031	T1030-L1034 HydrophobicContact CG2-CD1 4.33Å; T1030-L1034 WeakPolarHBondContact O-CB 3.42Å; T1030-L1034 VanDerWaalsContact O-CG 3.3Å; T1030-L1034 WeakPolarHBondContact O-CG 3.49Å; T1030-L1034 PolarHBondContact O-N 3.22Å; L1031-L1034 PolarHBondContact O-N 3.1Å
1035	K	72	Confident	59.1	Low	128 Å²	128	116 Å²	116	56%	0.557	61%	0.609	S	S	*	*	H	α-helix	trans	-70.2	-36.4	172.4	-75.2	171.5	-178.2	171	0	112.6	L1031 D1032 Q1033 S1038	L1031-K1035 HydrophobicContact CG-CD 4.5Å; L1031-K1035 WeakPolarHBondContact O-CB 3.37Å; L1031-K1035 VanDerWaalsContact O-CG 3.3Å; L1031-K1035 WeakPolarHBondContact O-CG 3.3Å; L1031-K1035 PolarHBondContact O-N 3.22Å; D1032-K1035 PolarHBondContact O-N 3.49Å; D1032-K1035 IonicContact OD1-NZ 3.84Å; Q1033-K1035 PolarHBondContact O-N 2.79Å; K1035-S1038 VanDerWaalsContact O-CB 3.24Å; K1035-S1038 WeakPolarHBondContact O-CB 3.37Å; K1035-S1038 PolarHBondContact O-N 3.07Å
1036	S	63.6	Low	56.8	Low	88 Å²	88	119 Å²	119	62%	0.615	62%	0.623	S	S	*	*	H	α-helix	trans	-80.5	-28.2	179.5	49.5	0	0	0	0	113.3	D1032 Q1033 S1038	D1032-S1036 WeakPolarHBondContact O-CB 3.49Å; D1032-S1036 PolarHBondContact O-N 3.03Å; D1032-S1036 PolarHBondContact O-OG 2.86Å; Q1033-S1036 WeakPolarHBondContact CA-OG 3.43Å; Q1033-S1036 PolarHBondContact O-N 2.96Å; Q1033-S1036 PolarHBondContact O-OG 2.79Å; S1036-S1038 PolarHBondContact O-N 3.11Å
1037	D	48.8	Very low	54.2	Low	116 Å²	116	122 Å²	122	62%	0.62	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-7	168.6	-80.9	-29.3	0	0	0	113.2	Q1033 F1039	Q1033-D1037 WeakPolarHBondContact O-CB 3.19Å; Q1033-D1037 PolarHBondContact O-N 2.94Å; D1037-F1039 PolarHBondContact O-N 3.16Å
1038	S	40.2	Very low	51.8	Low	80 Å²	80	127.1 Å²	127.1	56%	0.559	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	15.1	-179.4	-167.9	0	0	0	0	115.4	K1035 S1036	K1035-S1038 VanDerWaalsContact O-CB 3.24Å; K1035-S1038 WeakPolarHBondContact O-CB 3.37Å; K1035-S1038 PolarHBondContact O-N 3.07Å; S1036-S1038 PolarHBondContact O-N 3.11Å
1039	F	36.7	Very low	49.6	Very low	189 Å²	189	125.2 Å²	125.2	83%	0.829	65%	0.65	S	S	*	*			trans	-144.1	72.7	170.3	-76	-73	0	0	0	113.3	D1037	D1037-F1039 PolarHBondContact O-N 3.16Å
1040	R	32.8	Very low	47	Very low	208 Å²	208	127.5 Å²	127.5	79%	0.785	66%	0.662	S	S	*	*			trans	-134.2	78.5	165.5	-147.9	174.4	-161	-106.8	1.8	113.9	S1042	R1040-S1042 VanDerWaalsContact C-N 3.25Å; R1040-S1042 PolarHBondContact O-N 3.16Å; R1040-S1042 PolarHBondContact O-OG 3.31Å
1041	P	29.3	Very low	44.9	Very low	120 Å²	120	134.3 Å²	134.3	78%	0.779	68%	0.682	S	S	*	*			trans	-68.3	84.2	168.5	30.3	-34	0	0	0	109.8	I1043	P1041-I1043 VanDerWaalsContact C-N 3.3Å; P1041-I1043 PolarHBondContact O-N 3.36Å
1042	S	34.9	Very low	42.7	Very low	85 Å²	85	135.5 Å²	135.5	59%	0.594	69%	0.693	S	S	*	*			trans	-85.7	72.3	-178.1	35.6	0	0	0	0	112.4	R1040	R1040-S1042 VanDerWaalsContact C-N 3.25Å; R1040-S1042 PolarHBondContact O-N 3.16Å; R1040-S1042 PolarHBondContact O-OG 3.31Å
1043	I	34.4	Very low	40.5	Very low	141 Å²	141	137.5 Å²	137.5	72%	0.723	71%	0.708	S	S	*	*			trans	70.1	132.4	130.7	-64.1	159.7	0	0	0	118.8	P1041	P1041-I1043 VanDerWaalsContact C-N 3.3Å; P1041-I1043 PolarHBondContact O-N 3.36Å
1044	N	31.3	Very low	38.5	Very low	142 Å²	142	136.7 Å²	136.7	76%	0.759	71%	0.714	S	S	*	*			trans	74	81.4	163.3	-70.7	-10.6	0	0	0	119.8
1045	C	30.1	Very low	36.4	Very low	139 Å²	139	138.8 Å²	138.8	94%	0.939	72%	0.724	S	S	*	*				-145	84.8	128.4	-86.3	0	0	0	0	108.3
1046	H	32.3	Very low	34.4	Very low	151 Å²	151	138.5 Å²	138.5	70%	0.699	73%	0.734	S	S	*	*			trans	-126.8	128.9	179.8	-145	69.9	0	0	0	110.8
1047	R	32	Very low	32.6	Very low	195 Å²	195	141.4 Å²	141.4	74%	0.736	74%	0.741	S	S	*	*			trans	52	112.8	161.2	-67.7	-179.3	-168.8	-142.4	-0.7	120.3
1048	Q	30.1	Very low	31.6	Very low	168 Å²	168	140.9 Å²	140.9	79%	0.785	75%	0.746	S	S	*	*				68.7	134.7	108.5	-136.5	171.6	17	0	0	120.2
1049	V	34.5	Very low	30.8	Very low	115 Å²	115	144 Å²	144	70%	0.697	76%	0.761	S	S	*	*			trans	85.6	98.7	163	-163	0	0	0	0	118.4
1050	D	27.6	Very low	30.5	Very low	131 Å²	131	140.8 Å²	140.8	70%	0.701	76%	0.758	S	S	*	*			trans	44.5	149.3	135.6	-51.7	-29.6	0	0	0	124.9
1051	Y	32	Very low	30.3	Very low	206 Å²	206	137.3 Å²	137.3	81%	0.808	76%	0.76	S	S	*	*			trans	91.8	86.6	163.9	-56.6	-75.8	0	0	0	120.7
1052	T	33.4	Very low	30.4	Very low	115 Å²	115	137.5 Å²	137.5	71%	0.706	76%	0.759	S	S	*	*				67.5	95.9	117.4	-47.6	0	0	0	0	122
1053	V	29.4	Very low	30.3	Very low	131 Å²	131	139.7 Å²	139.7	79%	0.794	77%	0.768	S	S	*	*				63.3	142.1	124.8	174.7	0	0	0	0	120.1
1054	P	31.9	Very low	30.2	Very low	107 Å²	107	140 Å²	140	70%	0.695	77%	0.771	S	S	*	*			cis	-138.8	178.8	-33.3	40.2	-19.8	0	0	0	115.6
1055	L	27	Very low	30	Very low	159 Å²	159	138.7 Å²	138.7	83%	0.832	77%	0.774	S	S	*	*			trans	4.7	129.2	154.1	-72.4	155.5	0	0	0	121.7
1056	T	29.5	Very low	30.2	Very low	122 Å²	122	140.6 Å²	140.6	75%	0.748	77%	0.774	S	S	*	*				-169.3	130.9	116.5	30.7	0	0	0	0	114.2
1057	I	26.2	Very low	30	Very low	150 Å²	150	141.5 Å²	141.5	77%	0.769	78%	0.783	S	S	*	*			trans	46.4	122.3	135.8	-40.9	160.5	0	0	0	117.7
1058	S	27.1	Very low	30.1	Very low	104 Å²	104	138.4 Å²	138.4	73%	0.727	79%	0.791	S	S	*	*				-171.8	147.7	84.6	-62.3	0	0	0	0	113.8
1059	V	25.2	Very low	29.9	Very low	146 Å²	146	136.1 Å²	136.1	89%	0.885	79%	0.793	S	S	*	*			trans	-95.6	129.9	167.8	176.1	0	0	0	0	109.2
1060	T	29.8	Very low	29.8	Very low	122 Å²	122	136.5 Å²	136.5	75%	0.748	80%	0.801	S	S	*	*			trans	-132.6	122.1	173.3	52.8	0	0	0	0	112.1
1061	T	27.7	Very low	29.8	Very low	135 Å²	135	135.3 Å²	135.3	83%	0.828	80%	0.803	S	S	*	*			trans	-83	127.6	168.9	46.5	0	0	0	0	110.8
1062	T	32.4	Very low	29.8	Very low	123 Å²	123	133 Å²	133	76%	0.755	80%	0.803	S	S	*	*			trans	-101.4	110.1	-178.3	-13.7	0	0	0	0	112.3
1063	T	31.9	Very low	29.6	Very low	131 Å²	131	132.7 Å²	132.7	80%	0.804	80%	0.803	S	S	*	*			trans	-103.9	118	162.9	47.2	0	0	0	0	109.2
1064	N	33.2	Very low	29.5	Very low	147 Å²	147	133.4 Å²	133.4	79%	0.786	80%	0.802	S	S	*	*			trans	-96.2	121.4	176	-74.8	-16.1	0	0	0	110.7
1065	S	27.8	Very low	29.3	Very low	116 Å²	116	136.7 Å²	136.7	81%	0.811	81%	0.81	S	S	*	*			trans	-137.4	121.5	163.3	-71.2	0	0	0	0	107.2
1066	L	32.2	Very low	29.3	Very low	179 Å²	179	134.5 Å²	134.5	94%	0.937	80%	0.804	S	S	*	*			trans	-116.9	119.1	172.7	-76.7	176.2	0	0	0	109.2
1067	L	29.9	Very low	29.2	Very low	170 Å²	170	133.6 Å²	133.6	89%	0.89	80%	0.798	S	S	*	*			trans	-75.8	143.1	169.5	-72.9	149.8	0	0	0	109.4
1068	S	32.4	Very low	29.4	Very low	129 Å²	129	130.2 Å²	130.2	90%	0.902	78%	0.784	S	S	*	*			trans	-151.1	138	149.2	-81.7	0	0	0	0	109.1
1069	S	27.5	Very low	29.4	Very low	120 Å²	120	128.7 Å²	128.7	84%	0.839	77%	0.773	S	S	*	*			trans	-113.2	136.8	-154.5	48.1	0	0	0	0	113.1
1070	S	31.6	Very low	29.7	Very low	123 Å²	123	125.1 Å²	125.1	86%	0.86	77%	0.767	S	S	*	*			trans	-147.5	133.8	138.9	63	0	0	0	0	111.4
1071	S	28.8	Very low	29.7	Very low	106 Å²	106	125.7 Å²	125.7	74%	0.741	77%	0.77	S	S	*	*			trans	-80.3	153.7	175.6	44.8	0	0	0	0	110.9
1072	I	31.8	Very low	29.8	Very low	158 Å²	158	125.9 Å²	125.9	81%	0.81	77%	0.771	S	S	*	*				-178	155.3	91	-90.6	171.3	0	0	0	108.1
1073	P	29.5	Very low	29.5	Very low	108 Å²	108	125.9 Å²	125.9	70%	0.701	78%	0.776	S	S	*	*			trans	-123.5	177.3	-138.8	44.8	-35.2	0	0	0	117.3
1074	L	26.9	Very low	29.5	Very low	147 Å²	147	124.9 Å²	124.9	77%	0.77	77%	0.774	S	S	*	*			trans	52.6	129.2	145.9	-119.5	73.4	0	0	0	121.2
1075	M	27	Very low	29.2	Very low	175 Å²	175	127.6 Å²	127.6	86%	0.862	78%	0.779	S	S	*	*				-168.2	139.7	120.3	-101.3	-72.6	157.6	0	0	110.7
1076	T	26	Very low	29.5	Very low	114 Å²	114	129.3 Å²	129.3	70%	0.699	78%	0.778	S	S	*	*			trans	-139.9	138.5	-175.5	49.6	0	0	0	0	110.6
1077	T	29.1	Very low	29.5	Very low	103 Å²	103	127.2 Å²	127.2	63%	0.632	77%	0.767	S	S	*	*			trans	-155.2	162.7	158.5	40.7	0	0	0	0	112.2	T353	T353-T1077 WeakPolarHBondContact O-CB 3.46Å; T353-T1077 VanDerWaalsContact O-CG2 3.26Å; T353-T1077 WeakPolarHBondContact O-CG2 3.48Å
1078	T	29.7	Very low	29.4	Very low	79 Å²	79	127.6 Å²	127.6	49%	0.485	76%	0.764	S	S	.	*			trans	-139.7	167.3	-152.9	48.6	0	0	0	0	114.5	T353 N354	T353-T1078 CarbonylContact C-O 3.42Å; T353-T1078 WeakPolarHBondContact CA-O 3.37Å; T353-T1078 PolarHBondContact N-O 3.06Å; N354-T1078 WeakPolarHBondContact CA-O 3.44Å; N354-T1078 PolarHBondContact N-O 3.01Å; N354-T1078 PolarHBondContact OD1-O 3.46Å
1079	S	28.3	Very low	29.3	Very low	71 Å²	71	131.9 Å²	131.9	50%	0.497	76%	0.762	S	S	.	*			trans	98.1	163.2	152.4	87.6	0	0	0	0	119.5	N354	N354-S1079 VanDerWaalsContact OD1-C 3.23Å; N354-S1079 PolarHBondContact OD1-O 3.32Å; N354-S1079 PolarHBondContact OD1-OG 3.43Å
1080	G	30.3	Very low	29.4	Very low	72 Å²	72	133.1 Å²	133.1	74%	0.742	76%	0.759	S	S	*	*			trans	149.9	74.4	-173	0	0	0	0	0	113.2
1081	T	29.5	Very low	29.4	Very low	133 Å²	133	135 Å²	135	82%	0.816	76%	0.759	S	S	*	*			trans	-85.6	144.1	-175.5	47	0	0	0	0	114.6
1082	V	29.7	Very low	29.6	Very low	140 Å²	140	138.1 Å²	138.1	85%	0.848	76%	0.761	S	S	*	*			trans	-141.2	141.8	147.2	-177.4	0	0	0	0	109
1083	S	27.6	Very low	29.6	Very low	123 Å²	123	137.6 Å²	137.6	86%	0.86	76%	0.755	S	S	*	*			trans	-139.6	137	167.6	-62	0	0	0	0	109.9
1084	S	30.2	Very low	29.9	Very low	110 Å²	110	138 Å²	138	77%	0.769	76%	0.758	S	S	*	*			trans	-128.8	113.6	171.2	52.4	0	0	0	0	109.8
1085	K	28.5	Very low	30	Very low	204 Å²	204	139.9 Å²	139.9	89%	0.887	76%	0.756	S	S	*	*			trans	-71.5	143.7	163.5	-65.2	174.9	175.5	179.4	0	108.7
1086	I	32.9	Very low	30.2	Very low	152 Å²	152	139.9 Å²	139.9	78%	0.779	75%	0.752	S	S	*	*			trans	-146.6	112.6	150.5	-98.2	144.1	0	0	0	109.3
1087	N	32.4	Very low	30.5	Very low	135 Å²	135	142.4 Å²	142.4	72%	0.722	75%	0.753	S	S	*	*			trans	45.5	127	143.9	-52.5	-15	0	0	0	122.5
1088	H	27.7	Very low	30.4	Very low	177 Å²	177	146.7 Å²	146.7	82%	0.819	77%	0.765	S	S	*	*			trans	-64.7	145.5	159.6	-62	-78.6	0	0	0	112.3
1089	Y	31.6	Very low	30.8	Very low	220 Å²	220	148.5 Å²	148.5	86%	0.863	78%	0.779	S	S	*	*			trans	-134	127.6	145	-85	-80.9	0	0	0	109.4
1090	N	28.7	Very low	30.9	Very low	146 Å²	146	152.7 Å²	152.7	78%	0.781	80%	0.795	S	S	*	*			trans	-77.3	147.5	167.2	-67.7	-34.8	0	0	0	109.4
1091	L	32.2	Very low	31	Very low	163 Å²	163	158 Å²	158	85%	0.853	80%	0.803	S	S	*	*			trans	-175.1	101.3	144.7	-94.1	146.1	0	0	0	106.1
1092	H	32.6	Very low	30.9	Very low	170 Å²	170	161.5 Å²	161.5	79%	0.787	80%	0.803	S	S	*	*				98.1	104.2	84.2	-136.5	-59.4	0	0	0	111.5
1093	E	31.1	Very low	31.2	Very low	147 Å²	147	161 Å²	161	69%	0.687	80%	0.795	S	S	*	*			trans	-78	152.3	165	-168.7	178.1	-118.9	0	0	109.4
1094	P	36.6	Very low	31.3	Very low	116 Å²	116	163.2 Å²	163.2	75%	0.753	79%	0.792	S	S	*	*			trans	-136.6	128.2	143.1	33.9	-20	0	0	0	113.6
1095	Y	28.2	Very low	31.4	Very low	187 Å²	187	163.3 Å²	163.3	73%	0.733	79%	0.79	S	S	*	*			trans	-55.7	151.1	157.9	-77.2	-112.1	0	0	0	111.4
1096	F	31.4	Very low	31.3	Very low	176 Å²	176	165 Å²	165	77%	0.772	79%	0.792	S	S	*	*				-169.9	132.9	128.5	-97.3	-47.3	0	0	0	116.5
1097	K	33	Very low	31.2	Very low	167 Å²	167	163.1 Å²	163.1	73%	0.726	79%	0.793	S	S	*	*			trans	54.2	112.2	139.5	-74.6	155.4	-177	164	0	121.4
1098	H	27.3	Very low	31	Very low	192 Å²	192	164.1 Å²	164.1	89%	0.889	80%	0.798	S	S	*	*			trans	-70.5	151.4	135.8	-71.6	-82.5	0	0	0	111.2
1099	P	36.5	Very low	31.4	Very low	118 Å²	118	160.9 Å²	160.9	77%	0.766	79%	0.793	S	S	*	*			trans	-121.8	151.9	148.7	35.1	-24.6	0	0	0	113
1100	N	30.7	Very low	31.3	Very low	158 Å²	158	158.2 Å²	158.2	85%	0.845	79%	0.792	S	S	*	*			trans	-60.9	150.2	-178.9	-54.9	-46.3	0	0	0	114.2
1101	M	32.2	Very low	31.3	Very low	184 Å²	184	162.6 Å²	162.6	91%	0.906	80%	0.798	S	S	*	*				-148.5	119.4	129.9	-82.2	-145.3	72.6	0	0	110.8
1102	Y	28.7	Very low	31.3	Very low	206 Å²	206	159.4 Å²	159.4	81%	0.808	79%	0.79	S	S	*	*			trans	-101.9	171.4	167.8	-118.7	-97	0	0	0	109
1103	N	34	Very low	31.1	Very low	130 Å²	130	157.8 Å²	157.8	70%	0.695	79%	0.792	S	S	*	*			trans	80.1	137.1	177.2	-49.7	-27.3	0	0	0	113.9
1104	H	31.4	Very low	31.2	Very low	169 Å²	169	160.8 Å²	160.8	78%	0.782	80%	0.797	S	S	*	*			cis	-142.8	-159.9	7.8	-78.1	-71.4	0	0	0	109.5
1105	P	31.8	Very low	30.9	Very low	113 Å²	113	163 Å²	163	73%	0.734	80%	0.803	S	S	*	*				-120	176.8	-77.1	37.8	-23.4	0	0	0	112.7	S1107	P1105-S1107 PolarHBondContact O-N 3.34Å
1106	Y	25.6	Very low	31.3	Very low	238 Å²	238	160.6 Å²	160.6	93%	0.933	80%	0.801	S	S	*	*			trans	-61.7	128.2	166.9	-85.3	-103.7	0	0	0	111.8
1107	S	32	Very low	31.5	Very low	113 Å²	113	161.5 Å²	161.5	79%	0.79	83%	0.829	S	S	*	*			trans	-134.7	128	157.7	58.3	0	0	0	0	109.8	P1105	P1105-S1107 PolarHBondContact O-N 3.34Å
1108	N	28.2	Very low	31.5	Very low	157 Å²	157	161.3 Å²	161.3	84%	0.84	83%	0.834	S	S	*	*			trans	-85.6	171.7	-174	-122.3	-4	0	0	0	111.1
1109	P	35.5	Very low	31.7	Very low	108 Å²	108	159.6 Å²	159.6	70%	0.701	83%	0.832	S	S	*	*			trans	-82.4	156.4	-144.8	34.2	-39.7	0	0	0	114.3
1110	L	29.6	Very low	31.4	Very low	164 Å²	164	161.9 Å²	161.9	86%	0.859	84%	0.835	S	S	*	*			trans	-169.8	118.5	146.7	-103.9	163.4	0	0	0	112
1111	R	28.2	Very low	31.4	Very low	238 Å²	238	162.2 Å²	162.2	90%	0.898	84%	0.835	S	S	*	*			trans	44.1	92.6	135	-165	-178.4	-161.2	-104.9	4.9	118.9
1112	S	32.9	Very low	31.4	Very low	97 Å²	97	160.8 Å²	160.8	68%	0.678	83%	0.83	S	S	*	*			trans	-155.3	123.6	147.5	-162	0	0	0	0	112.7	W1114	S1112-W1114 PolarHBondContact OG-NE1 3.33Å
1113	T	29.1	Very low	31.6	Very low	136 Å²	136	157.8 Å²	157.8	83%	0.834	83%	0.832	S	S	*	*			trans	-76.7	128.7	168.3	44.2	0	0	0	0	110.4
1114	W	32.8	Very low	31.4	Very low	209 Å²	209	159.8 Å²	159.8	79%	0.792	84%	0.841	S	S	*	*			trans	-135.9	109.7	165.3	-81.8	76.4	0	0	0	110.1	S1112 I1116	S1112-W1114 PolarHBondContact OG-NE1 3.33Å; W1114-I1116 HydrophobicContact CE3-CD1 4.4Å; W1114-I1116 HydrophobicContact CE3-CG1 4.45Å
1115	N	29.8	Very low	31.4	Very low	164 Å²	164	159.1 Å²	159.1	88%	0.877	85%	0.846	S	S	*	*			trans	-76.4	137.8	158.2	-68	-17.3	0	0	0	107.7
1116	I	36.8	Very low	31.4	Very low	136 Å²	136	162.9 Å²	162.9	70%	0.697	86%	0.855	S	S	*	*			trans	-138.7	122.4	162.9	-60.6	-176.4	0	0	0	108.6	W1114	W1114-I1116 HydrophobicContact CE3-CD1 4.4Å; W1114-I1116 HydrophobicContact CE3-CG1 4.45Å
1117	S	36	Very low	31.9	Very low	195 Å²	195	156.1 Å²	156.1	100%	1.364	85%	0.848	S	S	*	*			trans	66	0	173.4	-63.9	0	0	0	0	117.1

Retrieved 1,117 of 1,117 residues in 164.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).