A0A5K4F5P4_SCHMA Loading...

SH2 domain-containing protein

AlphaFold DB (A0A5K4F7I0), UniProt , Accession A0A5K4F5P4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 983 aa.

						>A0A5K4F5P4_SCHMA|A0A5K4F5P4
MAPGKSLNLRGGSVSPSSRSYETSVMKVGGEVFDPDGYRMDVTVWFRHRNEALYYVDSGGNVHGPMDQRHTARLGNISRSGQFIPGSRYYLGDNLTSERFKRRQSDSGAWDSRSESKHRTYSETRRLNEYTDNSIATRYPNQLNQQPYYKTTASHNISNHSPLNTHISRWSSMQTSGTQGLWRGTNSGRYATTLTRQHIKKHHDPIEMVVKHTPSAGASRVDLLSVDNRQGSLPHLAYSIHNTGISEREQKLQNELLNTQRELQQLKRSRSLTGEQNLTHSTTLKQTLKSGSSQYLNDGFWTTYSLKKNEGQPCGARIAVQPQRTSSQMNISGPSTMTKTAWLSETNLRNSTTCKQPPMYSTYSAHKENMRRMQEQRRTTEDWQASNRQLHDSRSVGSRAVLEEMETITLQPIGRGVHDLEPPTGSIARSVRATTPSGLSTFPTLLNRPHSSAGRIDLSVSGIKRSISKDYYSPIRMQRSTIDIPYSQTTQALISPPINRRLVGFANLGHSSRISSINKSVLLPTIHHDPIIYGNHIVNNQSPELINQSYMNRNSYARQTLTQNIQEITQKQRLLSPNQQYYATPSYNKLANRSYAPGLEQQDGFRTIATTNYHREMHTSGPQSPYLGTMRQNSQYEATPIVNRSIVQQSVIPFSPNGSLSGTNIGVDIVDGDTVGMRQVLDTSKYWYLPGISRPDVIALLRDKEPGSFVIRNSNTYADSFGLALKIPPSSPRIISNKDDIQSEWVRHFLIGTVPMHDGRGNGVHLRGFSSDPTFPSLAAFVHYHIHKQGALPCTLRLPLFTNQTLFNQQRTTVNEQTVYGLEPSLQTILPTTNTMSTDMLYLGSVEVDRLENMNAAIRGIGKILSLAQTYSDGLPKRCEVQIKVIPHDGITFTEKYKRAVWRKTIKPNNLLWCGLDPENREFNDAELRSKGMYGSKILALVARKQRFWLHENVVYVFCEIDHNHSALNLVRFINTIFPNLRD
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34	Very low	34.1	Very low	248 Å²	248	145.2 Å²	145.2	100%	1.222	82%	0.823	S	S	*	*				0	141.1	0	-64.9	160	81	0	0	107.6
2	A	33.4	Very low	33.9	Very low	92 Å²	92	138.2 Å²	138.2	76%	0.76	81%	0.807	S	S	*	*			trans	-114.7	143.1	171.1	0	0	0	0	0	108.9
3	P	37.1	Very low	33.7	Very low	116 Å²	116	137.5 Å²	137.5	75%	0.753	81%	0.814	S	S	*	*			trans	-70.6	137.4	-175.7	28.4	-34.4	0	0	0	111.5	K5	P3-K5 PolarHBondContact O-N 3.04Å; P3-K5 VanDerWaalsContact O-N 3.12Å
4	G	34.5	Very low	33.5	Very low	85 Å²	85	134 Å²	134	88%	0.876	80%	0.795	S	S	*	*			trans	-68.7	106.3	179.5	0	0	0	0	0	112
5	K	35.6	Very low	33.4	Very low	195 Å²	195	130.9 Å²	130.9	85%	0.848	78%	0.782	S	S	*	*			trans	-77.3	124	169.3	-68	-176.7	177.6	-179	0	109.7	P3 L7	P3-K5 PolarHBondContact O-N 3.04Å; P3-K5 VanDerWaalsContact O-N 3.12Å; K5-L7 PolarHBondContact O-N 2.64Å
6	S	35.5	Very low	33.4	Very low	102 Å²	102	132 Å²	132	71%	0.713	79%	0.794	S	S	*	*			trans	-73.6	118.6	173.1	39.5	0	0	0	0	111.1	N8	S6-N8 PolarHBondContact O-N 3.05Å; S6-N8 VanDerWaalsContact O-N 3.12Å
7	L	33.1	Very low	33.7	Very low	151 Å²	151	130.8 Å²	130.8	79%	0.791	79%	0.793	S	S	*	*			trans	-82.8	83.3	177.9	-92	165.6	0	0	0	111.4	K5 L9	K5-L7 PolarHBondContact O-N 2.64Å; L7-L9 PolarHBondContact O-N 2.98Å
8	N	33.8	Very low	34	Very low	152 Å²	152	127.5 Å²	127.5	81%	0.813	78%	0.777	S	S	*	*			trans	-72.4	90.5	172.2	-86	-35.6	0	0	0	111.6	S6 R10	S6-N8 PolarHBondContact O-N 3.05Å; S6-N8 VanDerWaalsContact O-N 3.12Å; N8-R10 PolarHBondContact O-N 2.97Å
9	L	35.3	Very low	34.4	Very low	151 Å²	151	131.6 Å²	131.6	79%	0.791	78%	0.777	S	S	*	*			trans	-88.2	96.2	173.2	-65.4	179	0	0	0	111.2	L7	L7-L9 PolarHBondContact O-N 2.98Å
10	R	32.2	Very low	34.6	Very low	253 Å²	253	131.4 Å²	131.4	96%	0.955	78%	0.782	S	S	*	*			trans	-90.5	105.3	-177.2	-172.3	-174.8	-170.8	-155.6	4.4	111.5	N8	N8-R10 PolarHBondContact O-N 2.97Å
11	G	30.5	Very low	35.1	Very low	52 Å²	52	130.8 Å²	130.8	54%	0.536	77%	0.767	S	S	.	*			trans	175.6	148	172	0	0	0	0	0	116	R49	G11-R49 PolarHBondContact O-NH2 2.9Å
12	G	32.3	Very low	36.7	Very low	61 Å²	61	127.1 Å²	127.1	63%	0.629	75%	0.747	S	S	*	*			trans	87.8	110.1	175.2	0	0	0	0	0	114.1	R49	G12-R49 PolarHBondContact O-NH1 3.47Å
13	S	31.4	Very low	38.7	Very low	129 Å²	129	125.9 Å²	125.9	90%	0.902	73%	0.73	S	S	*	*			trans	-63	153.2	176.4	45.5	0	0	0	0	112.7
14	V	30.8	Very low	40.8	Very low	89 Å²	89	122.6 Å²	122.6	54%	0.539	71%	0.71	S	S	.	*			trans	-134	131.9	-174	179	0	0	0	0	109.7	S18	V14-S18 WeakPolarHBondContact CG1-OG 3.2Å
15	S	31.1	Very low	43.1	Very low	87 Å²	87	123.1 Å²	123.1	61%	0.608	70%	0.696	S	S	*	*			trans	-71.4	150.7	179	-49.7	0	0	0	0	112	S17	S15-S17 PolarHBondContact O-N 3.06Å
16	P	33.4	Very low	45.4	Very low	149 Å²	149	114.9 Å²	114.9	97%	0.968	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	10.5	-168.2	-22.7	35.1	0	0	0	118
17	S	39.7	Very low	47.6	Very low	112 Å²	112	111.3 Å²	111.3	78%	0.783	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119	-8.4	-171	57.7	0	0	0	0	115.4	S15	S15-S17 PolarHBondContact O-N 3.06Å
18	S	37.7	Very low	50.1	Low	71 Å²	71	108.8 Å²	108.8	50%	0.497	62%	0.623	S	S	.	*	S	Bend	trans	-84.4	126.7	177.3	61.7	0	0	0	0	111.8	V14	V14-S18 WeakPolarHBondContact CG1-OG 3.2Å
19	R	43.1	Very low	52.4	Low	205 Å²	205	103 Å²	103	77%	0.774	60%	0.6	S	S	*	*			trans	-59.9	139.4	170.7	-67.6	179.3	175.3	-179.3	-3.3	110.7	Y21	R19-Y21 HydrophobicContact CB-CD2 4.43Å; R19-Y21 HydrophobicContact CB-CE2 4Å; R19-Y21 VanDerWaalsContact O-CD2 3.31Å; R19-Y21 WeakPolarHBondContact O-CD2 3.49Å; R19-Y21 PolarHBondContact O-N 3.46Å
20	S	38.3	Very low	54.7	Low	127 Å²	127	97.3 Å²	97.3	89%	0.888	58%	0.577	S	S	*	*			trans	-69.4	86.6	-179.5	-52.9	0	0	0	0	112.3	E22	S20-E22 PolarHBondContact O-N 3.08Å
21	Y	44.8	Very low	57.1	Low	119 Å²	119	90.1 Å²	90.1	47%	0.467	55%	0.554	S	S	.	*			trans	-81.4	102.7	164.6	-69.3	-78.9	0	0	0	108.9	R19 R49	R19-Y21 HydrophobicContact CB-CD2 4.43Å; R19-Y21 HydrophobicContact CB-CE2 4Å; R19-Y21 VanDerWaalsContact O-CD2 3.31Å; R19-Y21 WeakPolarHBondContact O-CD2 3.49Å; R19-Y21 PolarHBondContact O-N 3.46Å; Y21-R49 WeakPolarHBondContact O-CA 3.39Å; Y21-R49 WeakPolarHBondContact O-CB 3.37Å
22	E	67.7	Low	59.5	Low	171 Å²	171	88.4 Å²	88.4	80%	0.799	53%	0.533	S	S	*	.			trans	-72.5	150.7	175.4	-169.3	168	-161.1	0	0	111.4	S20 S24	S20-E22 PolarHBondContact O-N 3.08Å; E22-S24 PolarHBondContact O-N 3.08Å
23	T	75.8	Confident	61.7	Low	67 Å²	67	91.8 Å²	91.8	41%	0.411	53%	0.531	S	S	.	.			trans	-68.8	111.1	177.7	-65.2	0	0	0	0	110	F46 R47	T23-F46 HydrophobicContact CG2-CB 4.34Å; T23-F46 HydrophobicContact CG2-CD2 3.59Å; T23-F46 HydrophobicContact CG2-CE2 4.3Å; T23-F46 HydrophobicContact CG2-CG 4.32Å; T23-R47 CarbonylContact C-O 3.59Å; T23-R47 VanDerWaalsContact CA-O 3.32Å; T23-R47 WeakPolarHBondContact CA-O 3.47Å
24	S	79.7	Confident	63.7	Low	47 Å²	47	87.2 Å²	87.2	33%	0.329	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	130.2	-175.9	60.2	0	0	0	0	112.8	E22 M26 F46 R47	E22-S24 PolarHBondContact O-N 3.08Å; S24-M26 PolarHBondContact O-N 2.96Å; S24-F46 CarbonylContact O-C 3.58Å; S24-F46 VanDerWaalsContact O-CA 3.32Å; S24-F46 WeakPolarHBondContact O-CA 3.43Å; S24-R47 PolarHBondContact N-O 3.06Å; S24-R47 PolarHBondContact O-N 2.97Å
25	V	84.2	Confident	65.7	Low	95 Å²	95	89.4 Å²	89.4	58%	0.576	51%	0.512	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.4	120.4	169.9	173.8	0	0	0	0	108.6	V28 V44	V25-V28 HydrophobicContact CG1-CG2 4.21Å; V25-V44 HydrophobicContact CG1-CG1 3.86Å; V25-V44 HydrophobicContact CG2-CG1 4.12Å
26	M	82.6	Confident	67.9	Low	22 Å²	22	91.8 Å²	91.8	11%	0.108	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	-32	178	-67.3	-167.5	73.6	0	0	112.4	S24 W45 R47 L53 L74 I77	S24-M26 PolarHBondContact O-N 2.96Å; M26-W45 HydrophobicContact CB-CB 4.43Å; M26-W45 PolarHBondContact N-O 2.81Å; M26-R47 HydrophobicContact CG-CB 4.01Å; M26-R47 HydrophobicContact SD-CB 3.83Å; M26-R47 HydrophobicContact SD-CG 4.45Å; M26-L53 HydrophobicContact SD-CD1 3.72Å; M26-L74 HydrophobicContact CE-CB 4.05Å; M26-I77 HydrophobicContact CE-CB 4.31Å
27	K	81.8	Confident	69.7	Low	28 Å²	28	87 Å²	87	12%	0.122	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	150.2	-179.7	169.4	163.4	-167.7	101.3	0	112.6	G29 V44 W45 F948 W949	K27-G29 WeakPolarHBondContact CD-O 3.46Å; K27-G29 WeakPolarHBondContact CE-O 3.45Å; K27-G29 VanDerWaalsContact CG-O 3.23Å; K27-G29 WeakPolarHBondContact CG-O 3.29Å; K27-V44 CarbonylContact O-C 3.54Å; K27-V44 WeakPolarHBondContact O-CA 3.38Å; K27-W45 HydrophobicContact CB-CB 4.02Å; K27-W45 HydrophobicContact CB-CG 4.13Å; K27-W45 PolarHBondContact N-O 2.94Å; K27-W45 PolarHBondContact O-N 3.22Å; K27-F948 HydrophobicContact CD-CD1 3.73Å; K27-F948 HydrophobicContact CD-CE1 4.42Å; K27-F948 PolarHBondContact NZ-O 3.17Å; K27-W949 HydrophobicContact CB-CH2 4.31Å; K27-W949 HydrophobicContact CB-CZ2 3.5Å; K27-W949 VanDerWaalsContact CB-CZ2 3.5Å; K27-W949 HydrophobicContact CD-CH2 3.97Å; K27-W949 HydrophobicContact CD-CZ2 3.63Å; K27-W949 HydrophobicContact CG-CH2 3.63Å; K27-W949 HydrophobicContact CG-CZ2 3.27Å; K27-W949 VanDerWaalsContact NZ-CE3 3.34Å
28	V	85.1	Confident	71.4	Confident	98 Å²	98	89.5 Å²	89.5	59%	0.594	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.9	138	164.9	-178.6	0	0	0	0	107.3	V25 T43	V25-V28 HydrophobicContact CG1-CG2 4.21Å; V28-T43 WeakPolarHBondContact CA-O 3.25Å; V28-T43 WeakPolarHBondContact CG1-O 3.33Å
29	G	82.3	Confident	73.4	Confident	31 Å²	31	93.2 Å²	93.2	32%	0.32	49%	0.492	S	S	.	.	S	Bend	trans	76.1	154.6	-173.9	0	0	0	0	0	114.1	K27 V42 T43	K27-G29 WeakPolarHBondContact CD-O 3.46Å; K27-G29 WeakPolarHBondContact CE-O 3.45Å; K27-G29 VanDerWaalsContact CG-O 3.23Å; K27-G29 WeakPolarHBondContact CG-O 3.29Å; G29-V42 CarbonylContact C-O 3.53Å; G29-V42 WeakPolarHBondContact CA-O 3.34Å; G29-V42 PolarHBondContact N-O 2.59Å; G29-T43 PolarHBondContact N-O 3.21Å
30	G	83.8	Confident	75.2	Confident	30 Å²	30	86.2 Å²	86.2	31%	0.309	47%	0.469	S	S	.	.			trans	151.8	-176.9	176.4	0	0	0	0	0	111.5	V42	G30-V42 PolarHBondContact N-O 2.91Å; G30-V42 VanDerWaalsContact N-O 3.1Å; G30-V42 PolarHBondContact O-N 3.41Å
31	E	83.4	Confident	77.3	Confident	103 Å²	103	84 Å²	84	48%	0.481	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	140.6	-178.9	-61.8	172.9	-153.6	0	0	108.7	R39 M40	E31-R39 VanDerWaalsContact CD-NE 3.35Å; E31-R39 IonicContact OE1-CZ 3.11Å; E31-R39 IonicContact OE1-NE 3.35Å; E31-R39 IonicContact OE1-NH2 3.86Å; E31-R39 PolarHBondContact OE1-NH2 3.22Å; E31-R39 IonicContact OE2-CZ 2.64Å; E31-R39 IonicContact OE2-NE 3.65Å; E31-R39 PolarHBondContact OE2-NE 3.06Å; E31-R39 IonicContact OE2-NH2 2.8Å; E31-R39 PolarHBondContact OE2-NH2 2.88Å; E31-R39 VanDerWaalsContact OE2-NH2 3.14Å; E31-M40 WeakPolarHBondContact CA-O 3.41Å
32	V	79.7	Confident	79.4	Confident	15 Å²	15	78.6 Å²	78.6	9%	0.091	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	153.4	172.8	169.8	0	0	0	0	107.9	M40 V42 W45 Y55 M66	V32-M40 PolarHBondContact N-O 2.99Å; V32-M40 PolarHBondContact O-N 3.04Å; V32-V42 HydrophobicContact CB-CG2 4.04Å; V32-V42 HydrophobicContact CG2-CG2 3.62Å; V32-W45 HydrophobicContact CG2-CH2 3.48Å; V32-W45 VanDerWaalsContact CG2-CH2 3.48Å; V32-W45 HydrophobicContact CG2-CZ2 3.54Å; V32-Y55 HydrophobicContact CB-CE2 4.44Å; V32-Y55 HydrophobicContact CG1-CE1 4.24Å; V32-Y55 HydrophobicContact CG2-CE1 4.27Å; V32-Y55 HydrophobicContact CG2-CE2 4.43Å; V32-M66 HydrophobicContact CG1-CE 4.15Å; V32-M66 HydrophobicContact CG2-CE 4.39Å
33	F	78.9	Confident	80.3	Confident	133 Å²	133	73.7 Å²	73.7	58%	0.583	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.6	133.4	166.3	-67.2	-92.2	0	0	0	108	G37 Y38 R39	F33-G37 WeakPolarHBondContact CD1-O 3.45Å; F33-Y38 VanDerWaalsContact CA-O 3.32Å; F33-Y38 WeakPolarHBondContact CA-O 3.49Å; F33-R39 HydrophobicContact CD1-CB 4.22Å; F33-R39 HydrophobicContact CE1-CB 3.8Å; F33-R39 HydrophobicContact CE1-CG 4.34Å; F33-R39 HydrophobicContact CZ-CB 4.34Å; F33-R39 HydrophobicContact CZ-CG 4.39Å
34	D	73.9	Confident	80.9	Confident	33 Å²	33	72.1 Å²	72.1	18%	0.176	40%	0.399	C	S	.	.			trans	-72.8	174.6	171.5	72.9	10.9	0	0	0	111	D36 G37 Y38 M40	D34-D36 PolarHBondContact O-N 3.49Å; D34-D36 PolarHBondContact OD1-N 3.26Å; D34-D36 VanDerWaalsContact OD1-N 3.11Å; D34-G37 PolarHBondContact O-N 3.41Å; D34-G37 PolarHBondContact OD1-N 2.89Å; D34-Y38 PolarHBondContact N-O 3.33Å; D34-Y38 PolarHBondContact OD1-N 2.72Å; D34-M40 HydrophobicContact CB-CE 4.34Å
35	P	71.9	Confident	81.4	Confident	135 Å²	135	70.6 Å²	70.6	88%	0.877	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-24.7	-179.3	-25.1	36.4	0	0	0	114.6
36	D	78.4	Confident	81.6	Confident	137 Å²	137	67.6 Å²	67.6	73%	0.733	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-9.1	-178.8	-61	-51.4	0	0	0	112.3	D34 Y38	D34-D36 PolarHBondContact O-N 3.49Å; D34-D36 PolarHBondContact OD1-N 3.26Å; D34-D36 VanDerWaalsContact OD1-N 3.11Å; D36-Y38 HydrophobicContact CB-CD2 3.99Å; D36-Y38 HydrophobicContact CB-CE2 4.03Å
37	G	70	Confident	81.8	Confident	47 Å²	47	68.8 Å²	68.8	49%	0.485	37%	0.368	S	S	.	.			trans	98.1	9.7	173.9	0	0	0	0	0	114.8	F33 D34	F33-G37 WeakPolarHBondContact CD1-O 3.45Å; D34-G37 PolarHBondContact O-N 3.41Å; D34-G37 PolarHBondContact OD1-N 2.89Å
38	Y	77.3	Confident	81.9	Confident	166 Å²	166	69.9 Å²	69.9	65%	0.651	37%	0.373	S	S	*	.			trans	-78.2	137.9	174.3	-61.8	-81.7	0	0	0	111.3	F33 D34 D36 M40	F33-Y38 VanDerWaalsContact CA-O 3.32Å; F33-Y38 WeakPolarHBondContact CA-O 3.49Å; D34-Y38 PolarHBondContact N-O 3.33Å; D34-Y38 PolarHBondContact OD1-N 2.72Å; D36-Y38 HydrophobicContact CB-CD2 3.99Å; D36-Y38 HydrophobicContact CB-CE2 4.03Å; Y38-M40 PolarHBondContact O-N 3.36Å
39	R	79.7	Confident	81.7	Confident	149 Å²	149	70.4 Å²	70.4	56%	0.562	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.9	112.4	177.8	-179.5	177	176.7	-115.6	4.8	109.8	E31 F33	E31-R39 VanDerWaalsContact CD-NE 3.35Å; E31-R39 IonicContact OE1-CZ 3.11Å; E31-R39 IonicContact OE1-NE 3.35Å; E31-R39 IonicContact OE1-NH2 3.86Å; E31-R39 PolarHBondContact OE1-NH2 3.22Å; E31-R39 IonicContact OE2-CZ 2.64Å; E31-R39 IonicContact OE2-NE 3.65Å; E31-R39 PolarHBondContact OE2-NE 3.06Å; E31-R39 IonicContact OE2-NH2 2.8Å; E31-R39 PolarHBondContact OE2-NH2 2.88Å; E31-R39 VanDerWaalsContact OE2-NH2 3.14Å; F33-R39 HydrophobicContact CD1-CB 4.22Å; F33-R39 HydrophobicContact CE1-CB 3.8Å; F33-R39 HydrophobicContact CE1-CG 4.34Å; F33-R39 HydrophobicContact CZ-CB 4.34Å; F33-R39 HydrophobicContact CZ-CG 4.39Å
40	M	79.3	Confident	81.7	Confident	58 Å²	58	73.2 Å²	73.2	29%	0.286	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	126.2	173	-67.1	-164.3	171.2	0	0	110.8	E31 V32 D34 Y38	E31-M40 WeakPolarHBondContact CA-O 3.41Å; V32-M40 PolarHBondContact N-O 2.99Å; V32-M40 PolarHBondContact O-N 3.04Å; D34-M40 HydrophobicContact CB-CE 4.34Å; Y38-M40 PolarHBondContact O-N 3.36Å
41	D	83.7	Confident	81.4	Confident	81 Å²	81	76 Å²	76	43%	0.433	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	135.5	170.8	-66.4	-42.2	0	0	0	110.1	D57 S58	D41-D57 CarbonylContact O-C 3.59Å; D41-D57 WeakPolarHBondContact O-CA 3.25Å; D41-S58 PolarHBondContact O-N 2.83Å
42	V	87.3	Confident	81.3	Confident	4 Å²	4	72.1 Å²	72.1	2%	0.024	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	116	-179	177.6	0	0	0	0	110.4	G29 G30 V32 W45 Y55 V56	G29-V42 CarbonylContact C-O 3.53Å; G29-V42 WeakPolarHBondContact CA-O 3.34Å; G29-V42 PolarHBondContact N-O 2.59Å; G30-V42 PolarHBondContact N-O 2.91Å; G30-V42 VanDerWaalsContact N-O 3.1Å; G30-V42 PolarHBondContact O-N 3.41Å; V32-V42 HydrophobicContact CB-CG2 4.04Å; V32-V42 HydrophobicContact CG2-CG2 3.62Å; V42-W45 HydrophobicContact CG1-CD2 4.28Å; V42-W45 HydrophobicContact CG1-CG 4.19Å; V42-W45 HydrophobicContact CG1-CZ2 4.41Å; V42-W45 VanDerWaalsContact CG1-NE1 3.35Å; V42-W45 HydrophobicContact CG2-CZ2 4.24Å; V42-Y55 HydrophobicContact CB-CD2 4.29Å; V42-Y55 HydrophobicContact CG1-CD2 3.85Å; V42-Y55 HydrophobicContact CG1-CG 4.16Å; V42-Y55 HydrophobicContact CG2-CD2 3.56Å; V42-Y55 HydrophobicContact CG2-CE2 3.86Å; V42-Y55 HydrophobicContact CG2-CG 4.25Å; V42-V56 CarbonylContact C-O 3.44Å; V42-V56 WeakPolarHBondContact CG1-O 3.38Å
43	T	87.1	Confident	81.5	Confident	68 Å²	68	71.5 Å²	71.5	42%	0.417	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	-50.3	177.1	-50.3	0	0	0	0	111.3	V28 G29 V56 D57	V28-T43 WeakPolarHBondContact CA-O 3.25Å; V28-T43 WeakPolarHBondContact CG1-O 3.33Å; G29-T43 PolarHBondContact N-O 3.21Å; T43-V56 PolarHBondContact N-O 3.21Å; T43-D57 PolarHBondContact OG1-O 2.98Å
44	V	88.8	Confident	82	Confident	35 Å²	35	67.2 Å²	67.2	21%	0.212	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	137.3	-176.3	-175.1	0	0	0	0	111.3	V25 K27 Y55 V56	V25-V44 HydrophobicContact CG1-CG1 3.86Å; V25-V44 HydrophobicContact CG2-CG1 4.12Å; K27-V44 CarbonylContact O-C 3.54Å; K27-V44 WeakPolarHBondContact O-CA 3.38Å; V44-Y55 CarbonylContact O-C 3.57Å; V44-Y55 WeakPolarHBondContact O-CA 3.41Å; V44-V56 HydrophobicContact CB-CB 4.38Å; V44-V56 HydrophobicContact CB-CG2 4.22Å; V44-V56 PolarHBondContact N-O 3.35Å; V44-V56 PolarHBondContact O-N 2.81Å
45	W	90	Very high	82.7	Confident	14 Å²	14	66.3 Å²	66.3	5%	0.053	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	133.9	163.2	-62.1	78.3	0	0	0	109.5	M26 K27 V32 V42 L53 Y54 Y55 M66 L74	M26-W45 HydrophobicContact CB-CB 4.43Å; M26-W45 PolarHBondContact N-O 2.81Å; K27-W45 HydrophobicContact CB-CB 4.02Å; K27-W45 HydrophobicContact CB-CG 4.13Å; K27-W45 PolarHBondContact N-O 2.94Å; K27-W45 PolarHBondContact O-N 3.22Å; V32-W45 HydrophobicContact CG2-CH2 3.48Å; V32-W45 VanDerWaalsContact CG2-CH2 3.48Å; V32-W45 HydrophobicContact CG2-CZ2 3.54Å; V42-W45 HydrophobicContact CG1-CD2 4.28Å; V42-W45 HydrophobicContact CG1-CG 4.19Å; V42-W45 HydrophobicContact CG1-CZ2 4.41Å; V42-W45 VanDerWaalsContact CG1-NE1 3.35Å; V42-W45 HydrophobicContact CG2-CZ2 4.24Å; W45-L53 HydrophobicContact CE3-CD1 4.05Å; W45-L53 HydrophobicContact CE3-CD2 4.04Å; W45-L53 HydrophobicContact CE3-CG 4.14Å; W45-L53 HydrophobicContact CZ3-CD2 3.97Å; W45-L53 HydrophobicContact CZ3-CG 4.41Å; W45-Y54 WeakPolarHBondContact CA-O 3.48Å; W45-Y55 HydrophobicContact CH2-CD1 4.38Å; W45-Y55 HydrophobicContact CZ3-CD1 4.12Å; W45-Y55 HydrophobicContact CZ3-CG 4.43Å; W45-M66 HydrophobicContact CH2-CE 4.42Å; W45-M66 HydrophobicContact CH2-SD 4.07Å; W45-M66 HydrophobicContact CZ3-SD 3.73Å; W45-L74 HydrophobicContact CD2-CD1 4.14Å; W45-L74 HydrophobicContact CE3-CD1 3.71Å; W45-L74 HydrophobicContact CZ3-CD1 3.92Å
46	F	88.5	Confident	83.6	Confident	32 Å²	32	61 Å²	61	14%	0.14	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	152	177.3	65.6	-86.9	0	0	0	112.2	T23 S24 H48 Y54 V56 V62	T23-F46 HydrophobicContact CG2-CB 4.34Å; T23-F46 HydrophobicContact CG2-CD2 3.59Å; T23-F46 HydrophobicContact CG2-CE2 4.3Å; T23-F46 HydrophobicContact CG2-CG 4.32Å; S24-F46 CarbonylContact O-C 3.58Å; S24-F46 VanDerWaalsContact O-CA 3.32Å; S24-F46 WeakPolarHBondContact O-CA 3.43Å; F46-H48 HydrophobicContact CD2-CB 4.5Å; F46-H48 HydrophobicContact CE2-CB 4.38Å; F46-Y54 HydrophobicContact CE2-CD2 4.08Å; F46-Y54 AromaticContact CE2-CG 3.95Å; F46-Y54 HydrophobicContact CE2-CG 3.95Å; F46-Y54 HydrophobicContact CZ-CG 4Å; F46-Y54 PolarHBondContact N-O 2.93Å; F46-Y54 PolarHBondContact O-N 3.2Å; F46-Y54 VanDerWaalsContact O-O 3.1Å; F46-V56 HydrophobicContact CD1-CG2 4.18Å; F46-V56 HydrophobicContact CE1-CG2 3.76Å; F46-V62 HydrophobicContact CE1-CG1 4.14Å; F46-V62 HydrophobicContact CZ-CG1 3.76Å
47	R	87.6	Confident	84	Confident	47 Å²	47	54.9 Å²	54.9	18%	0.177	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	112.8	174.7	-166.7	178	68.4	131.8	30.2	108	T23 S24 M26 E51 A52	T23-R47 CarbonylContact C-O 3.59Å; T23-R47 VanDerWaalsContact CA-O 3.32Å; T23-R47 WeakPolarHBondContact CA-O 3.47Å; S24-R47 PolarHBondContact N-O 3.06Å; S24-R47 PolarHBondContact O-N 2.97Å; M26-R47 HydrophobicContact CG-CB 4.01Å; M26-R47 HydrophobicContact SD-CB 3.83Å; M26-R47 HydrophobicContact SD-CG 4.45Å; R47-E51 WeakPolarHBondContact CG-O 3.42Å; R47-E51 VanDerWaalsContact CZ-CD 3.5Å; R47-E51 IonicContact CZ-OE1 2.74Å; R47-E51 IonicContact CZ-OE2 2.76Å; R47-E51 IonicContact NH1-OE1 2.72Å; R47-E51 PolarHBondContact NH1-OE1 2.9Å; R47-E51 IonicContact NH1-OE2 3.65Å; R47-E51 PolarHBondContact NH1-OE2 3.42Å; R47-E51 IonicContact NH2-OE1 3.69Å; R47-E51 PolarHBondContact NH2-OE1 3.47Å; R47-E51 IonicContact NH2-OE2 3.85Å; R47-A52 WeakPolarHBondContact CA-O 3.41Å
48	H	83.4	Confident	84.6	Confident	51 Å²	51	56.8 Å²	56.8	24%	0.236	27%	0.272	C	S	.	.			trans	-75.8	165.1	-177.6	173.8	-113.2	0	0	0	111	F46 N50 E51 A52 Y54	F46-H48 HydrophobicContact CD2-CB 4.5Å; F46-H48 HydrophobicContact CE2-CB 4.38Å; H48-N50 VanDerWaalsContact ND1-CG 3.29Å; H48-N50 PolarHBondContact ND1-OD1 2.92Å; H48-N50 PolarHBondContact O-N 3.25Å; H48-E51 PolarHBondContact O-N 3.29Å; H48-A52 PolarHBondContact N-O 2.85Å; H48-Y54 HydrophobicContact CB-CD2 3.76Å; H48-Y54 HydrophobicContact CB-CE2 3.65Å
49	R	80.4	Confident	84.9	Confident	110 Å²	110	51.9 Å²	51.9	42%	0.415	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-16.1	179.4	57.1	171.4	166.3	169.3	-5.5	116.1	G11 G12 Y21 E51	G11-R49 PolarHBondContact O-NH2 2.9Å; G12-R49 PolarHBondContact O-NH1 3.47Å; Y21-R49 WeakPolarHBondContact O-CA 3.39Å; Y21-R49 WeakPolarHBondContact O-CB 3.37Å; R49-E51 VanDerWaalsContact C-N 3.32Å
50	N	82.5	Confident	85.1	Confident	89 Å²	89	47.1 Å²	47.1	48%	0.476	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	18.5	173.3	68.9	-19.5	0	0	0	113.6	H48 A52	H48-N50 VanDerWaalsContact ND1-CG 3.29Å; H48-N50 PolarHBondContact ND1-OD1 2.92Å; H48-N50 PolarHBondContact O-N 3.25Å; N50-A52 PolarHBondContact O-N 2.98Å; N50-A52 WeakPolarHBondContact OD1-CB 3.33Å; N50-A52 PolarHBondContact OD1-N 3.26Å
51	E	77.8	Confident	85.3	Confident	89 Å²	89	49 Å²	49	42%	0.416	28%	0.281	S	S	.	.	S	Bend	trans	60.9	-2.9	-174.8	-72	-81.9	138.9	0	0	115.4	R47 H48 R49	R47-E51 WeakPolarHBondContact CG-O 3.42Å; R47-E51 VanDerWaalsContact CZ-CD 3.5Å; R47-E51 IonicContact CZ-OE1 2.74Å; R47-E51 IonicContact CZ-OE2 2.76Å; R47-E51 IonicContact NH1-OE1 2.72Å; R47-E51 PolarHBondContact NH1-OE1 2.9Å; R47-E51 IonicContact NH1-OE2 3.65Å; R47-E51 PolarHBondContact NH1-OE2 3.42Å; R47-E51 IonicContact NH2-OE1 3.69Å; R47-E51 PolarHBondContact NH2-OE1 3.47Å; R47-E51 IonicContact NH2-OE2 3.85Å; H48-E51 PolarHBondContact O-N 3.29Å; R49-E51 VanDerWaalsContact C-N 3.32Å
52	A	81.3	Confident	85.4	Confident	22 Å²	22	49.6 Å²	49.6	18%	0.182	29%	0.287	C	S	.	.			trans	-77.8	147.1	179.4	0	0	0	0	0	112.4	R47 H48 N50 Y54 P65	R47-A52 WeakPolarHBondContact CA-O 3.41Å; H48-A52 PolarHBondContact N-O 2.85Å; N50-A52 PolarHBondContact O-N 2.98Å; N50-A52 WeakPolarHBondContact OD1-CB 3.33Å; N50-A52 PolarHBondContact OD1-N 3.26Å; A52-Y54 HydrophobicContact CB-CE2 3.92Å; A52-Y54 WeakPolarHBondContact O-CD2 3.45Å; A52-P65 HydrophobicContact CB-CB 3.72Å
53	L	83.6	Confident	85.3	Confident	2 Å²	2	52 Å²	52	1%	0.01	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	132.2	-179.3	178.7	70.7	0	0	0	111	M26 W45 P65 M66 T71 L74	M26-L53 HydrophobicContact SD-CD1 3.72Å; W45-L53 HydrophobicContact CE3-CD1 4.05Å; W45-L53 HydrophobicContact CE3-CD2 4.04Å; W45-L53 HydrophobicContact CE3-CG 4.14Å; W45-L53 HydrophobicContact CZ3-CD2 3.97Å; W45-L53 HydrophobicContact CZ3-CG 4.41Å; L53-P65 WeakPolarHBondContact O-CA 3.48Å; L53-M66 HydrophobicContact CB-CB 4.48Å; L53-M66 HydrophobicContact CD2-CB 4.29Å; L53-M66 HydrophobicContact CD2-SD 4.49Å; L53-M66 PolarHBondContact O-N 3.11Å; L53-T71 HydrophobicContact CB-CG2 3.98Å; L53-T71 HydrophobicContact CD2-CG2 4.4Å; L53-L74 HydrophobicContact CD1-CD1 4.11Å; L53-L74 HydrophobicContact CD2-CD1 3.51Å; L53-L74 HydrophobicContact CG-CD1 4.44Å
54	Y	88.7	Confident	85.1	Confident	42 Å²	42	50.9 Å²	50.9	17%	0.165	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	162.2	174.3	-65.8	-96.7	0	0	0	110.1	W45 F46 H48 A52 V62 H63 P65	W45-Y54 WeakPolarHBondContact CA-O 3.48Å; F46-Y54 HydrophobicContact CE2-CD2 4.08Å; F46-Y54 AromaticContact CE2-CG 3.95Å; F46-Y54 HydrophobicContact CE2-CG 3.95Å; F46-Y54 HydrophobicContact CZ-CG 4Å; F46-Y54 PolarHBondContact N-O 2.93Å; F46-Y54 PolarHBondContact O-N 3.2Å; F46-Y54 VanDerWaalsContact O-O 3.1Å; H48-Y54 HydrophobicContact CB-CD2 3.76Å; H48-Y54 HydrophobicContact CB-CE2 3.65Å; A52-Y54 HydrophobicContact CB-CE2 3.92Å; A52-Y54 WeakPolarHBondContact O-CD2 3.45Å; Y54-V62 HydrophobicContact CD1-CG1 4.17Å; Y54-H63 CarbonylContact C-O 3.11Å; Y54-H63 VanDerWaalsContact CA-O 3.25Å; Y54-H63 WeakPolarHBondContact CA-O 3.48Å; Y54-P65 HydrophobicContact CE1-CB 4.37Å; Y54-P65 HydrophobicContact CE2-CB 4.4Å
55	Y	90.4	Very high	84.6	Confident	14 Å²	14	53.3 Å²	53.3	6%	0.055	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	164	169	74.2	-91.9	0	0	0	112.2	V32 V42 V44 W45 D57 V62 H63 M66	V32-Y55 HydrophobicContact CB-CE2 4.44Å; V32-Y55 HydrophobicContact CG1-CE1 4.24Å; V32-Y55 HydrophobicContact CG2-CE1 4.27Å; V32-Y55 HydrophobicContact CG2-CE2 4.43Å; V42-Y55 HydrophobicContact CB-CD2 4.29Å; V42-Y55 HydrophobicContact CG1-CD2 3.85Å; V42-Y55 HydrophobicContact CG1-CG 4.16Å; V42-Y55 HydrophobicContact CG2-CD2 3.56Å; V42-Y55 HydrophobicContact CG2-CE2 3.86Å; V42-Y55 HydrophobicContact CG2-CG 4.25Å; V44-Y55 CarbonylContact O-C 3.57Å; V44-Y55 WeakPolarHBondContact O-CA 3.41Å; W45-Y55 HydrophobicContact CH2-CD1 4.38Å; W45-Y55 HydrophobicContact CZ3-CD1 4.12Å; W45-Y55 HydrophobicContact CZ3-CG 4.43Å; Y55-D57 HydrophobicContact CE2-CB 4.46Å; Y55-V62 CarbonylContact O-C 3.55Å; Y55-V62 WeakPolarHBondContact O-CA 3.41Å; Y55-H63 HydrophobicContact CD1-CB 3.72Å; Y55-H63 HydrophobicContact CD2-CB 4.07Å; Y55-H63 HydrophobicContact CE1-CB 3.31Å; Y55-H63 HydrophobicContact CE2-CB 3.72Å; Y55-H63 AromaticContact CE2-CD2 3.52Å; Y55-H63 AromaticContact CE2-CG 3.7Å; Y55-H63 HydrophobicContact CG-CB 4.08Å; Y55-H63 AromaticContact CZ-CD2 3.83Å; Y55-H63 AromaticContact CZ-CG 3.5Å; Y55-H63 PolarHBondContact N-O 3.1Å; Y55-H63 PolarHBondContact O-N 3.47Å; Y55-M66 HydrophobicContact CD1-CE 4.38Å; Y55-M66 HydrophobicContact CE1-CE 3.93Å
56	V	88.9	Confident	83.8	Confident	25 Å²	25	54.3 Å²	54.3	15%	0.152	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	123.1	175.3	-170.3	0	0	0	0	107.5	V42 T43 V44 F46 N61 V62	V42-V56 CarbonylContact C-O 3.44Å; V42-V56 WeakPolarHBondContact CG1-O 3.38Å; T43-V56 PolarHBondContact N-O 3.21Å; V44-V56 HydrophobicContact CB-CB 4.38Å; V44-V56 HydrophobicContact CB-CG2 4.22Å; V44-V56 PolarHBondContact N-O 3.35Å; V44-V56 PolarHBondContact O-N 2.81Å; F46-V56 HydrophobicContact CD1-CG2 4.18Å; F46-V56 HydrophobicContact CE1-CG2 3.76Å; V56-N61 VanDerWaalsContact CA-O 3.28Å; V56-N61 WeakPolarHBondContact CA-O 3.29Å; V56-V62 HydrophobicContact CG2-CG2 4.4Å
57	D	87.3	Confident	82.6	Confident	8 Å²	8	58.1 Å²	58.1	4%	0.043	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	-178.2	177	68.2	24	0	0	0	112.4	D41 T43 Y55 G59 G60 N61 H63	D41-D57 CarbonylContact O-C 3.59Å; D41-D57 WeakPolarHBondContact O-CA 3.25Å; T43-D57 PolarHBondContact OG1-O 2.98Å; Y55-D57 HydrophobicContact CE2-CB 4.46Å; D57-G59 VanDerWaalsContact C-N 3.29Å; D57-G59 VanDerWaalsContact OD1-C 3.31Å; D57-G59 VanDerWaalsContact OD1-CA 3.25Å; D57-G59 WeakPolarHBondContact OD1-CA 3.41Å; D57-G59 PolarHBondContact OD1-N 3.37Å; D57-G60 PolarHBondContact O-N 3.04Å; D57-G60 PolarHBondContact OD1-N 3.35Å; D57-N61 PolarHBondContact N-O 3.11Å; D57-N61 PolarHBondContact OD1-N 3.03Å; D57-N61 PolarHBondContact OD1-ND2 3.19Å; D57-N61 WeakPolarHBondContact OD2-CB 3.5Å; D57-N61 PolarHBondContact OD2-ND2 2.98Å; D57-H63 IonicContact OD2-CD2 2.7Å; D57-H63 IonicContact OD2-CE1 3.23Å; D57-H63 IonicContact OD2-NE2 2.88Å; D57-H63 PolarHBondContact OD2-NE2 3.3Å
58	S	83.6	Confident	80.8	Confident	86 Å²	86	64.1 Å²	64.1	60%	0.601	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-15.1	176	54.2	0	0	0	0	114.3	D41	D41-S58 PolarHBondContact O-N 2.83Å
59	G	82.6	Confident	79.2	Confident	64 Å²	64	71.7 Å²	71.7	66%	0.66	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-13	169	0	0	0	0	0	113.7	D57	D57-G59 VanDerWaalsContact C-N 3.29Å; D57-G59 VanDerWaalsContact OD1-C 3.31Å; D57-G59 VanDerWaalsContact OD1-CA 3.25Å; D57-G59 WeakPolarHBondContact OD1-CA 3.41Å; D57-G59 PolarHBondContact OD1-N 3.37Å
60	G	83.5	Confident	77.9	Confident	49 Å²	49	70.8 Å²	70.8	51%	0.505	40%	0.401	S	S	.	.			trans	92.5	5.7	-177.2	0	0	0	0	0	114.7	D57	D57-G60 PolarHBondContact O-N 3.04Å; D57-G60 PolarHBondContact OD1-N 3.35Å
61	N	83.7	Confident	75.9	Confident	97 Å²	97	68.5 Å²	68.5	52%	0.519	39%	0.39	S	S	.	.			trans	-76.6	143.2	178.6	-45.4	-73.8	0	0	0	110.6	V56 D57 H63	V56-N61 VanDerWaalsContact CA-O 3.28Å; V56-N61 WeakPolarHBondContact CA-O 3.29Å; D57-N61 PolarHBondContact N-O 3.11Å; D57-N61 PolarHBondContact OD1-N 3.03Å; D57-N61 PolarHBondContact OD1-ND2 3.19Å; D57-N61 WeakPolarHBondContact OD2-CB 3.5Å; D57-N61 PolarHBondContact OD2-ND2 2.98Å; N61-H63 PolarHBondContact O-CD2 3.42Å
62	V	87.4	Confident	74	Confident	93 Å²	93	67.7 Å²	67.7	56%	0.564	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.7	124.3	177.8	-179.4	0	0	0	0	110.1	F46 Y54 Y55 V56	F46-V62 HydrophobicContact CE1-CG1 4.14Å; F46-V62 HydrophobicContact CZ-CG1 3.76Å; Y54-V62 HydrophobicContact CD1-CG1 4.17Å; Y55-V62 CarbonylContact O-C 3.55Å; Y55-V62 WeakPolarHBondContact O-CA 3.41Å; V56-V62 HydrophobicContact CG2-CG2 4.4Å
63	H	83.6	Confident	72.3	Confident	54 Å²	54	75.6 Å²	75.6	25%	0.25	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	135.1	-178.1	-66.6	-95.5	0	0	0	111.2	Y54 Y55 D57 N61	Y54-H63 CarbonylContact C-O 3.11Å; Y54-H63 VanDerWaalsContact CA-O 3.25Å; Y54-H63 WeakPolarHBondContact CA-O 3.48Å; Y55-H63 HydrophobicContact CD1-CB 3.72Å; Y55-H63 HydrophobicContact CD2-CB 4.07Å; Y55-H63 HydrophobicContact CE1-CB 3.31Å; Y55-H63 HydrophobicContact CE2-CB 3.72Å; Y55-H63 AromaticContact CE2-CD2 3.52Å; Y55-H63 AromaticContact CE2-CG 3.7Å; Y55-H63 HydrophobicContact CG-CB 4.08Å; Y55-H63 AromaticContact CZ-CD2 3.83Å; Y55-H63 AromaticContact CZ-CG 3.5Å; Y55-H63 PolarHBondContact N-O 3.1Å; Y55-H63 PolarHBondContact O-N 3.47Å; D57-H63 IonicContact OD2-CD2 2.7Å; D57-H63 IonicContact OD2-CE1 3.23Å; D57-H63 IonicContact OD2-NE2 2.88Å; D57-H63 PolarHBondContact OD2-NE2 3.3Å; N61-H63 PolarHBondContact O-CD2 3.42Å
64	G	83.5	Confident	70.7	Confident	46 Å²	46	75.7 Å²	75.7	47%	0.474	43%	0.425	S	S	.	.			trans	140.6	-179.4	178.1	0	0	0	0	0	112.8
65	P	78.8	Confident	68.2	Low	86 Å²	86	76.4 Å²	76.4	56%	0.558	44%	0.444	S	S	*	.			cis	-72.9	140.3	5.1	30.6	-36	0	0	0	112.7	A52 L53 Y54	A52-P65 HydrophobicContact CB-CB 3.72Å; L53-P65 WeakPolarHBondContact O-CA 3.48Å; Y54-P65 HydrophobicContact CE1-CB 4.37Å; Y54-P65 HydrophobicContact CE2-CB 4.4Å
66	M	73.7	Confident	65.8	Low	34 Å²	34	80.4 Å²	80.4	17%	0.167	47%	0.467	C	S	.	.			trans	-87.3	128.7	-177.5	-136.9	-178.4	-158.9	0	0	112.4	V32 W45 L53 Y55 H70 T71	V32-M66 HydrophobicContact CG1-CE 4.15Å; V32-M66 HydrophobicContact CG2-CE 4.39Å; W45-M66 HydrophobicContact CH2-CE 4.42Å; W45-M66 HydrophobicContact CH2-SD 4.07Å; W45-M66 HydrophobicContact CZ3-SD 3.73Å; L53-M66 HydrophobicContact CB-CB 4.48Å; L53-M66 HydrophobicContact CD2-CB 4.29Å; L53-M66 HydrophobicContact CD2-SD 4.49Å; L53-M66 PolarHBondContact O-N 3.11Å; Y55-M66 HydrophobicContact CD1-CE 4.38Å; Y55-M66 HydrophobicContact CE1-CE 3.93Å; M66-H70 HydrophobicContact CB-CB 4.33Å; M66-H70 HydrophobicContact CE-CB 4.41Å; M66-H70 WeakPolarHBondContact CE-ND1 3.41Å; M66-H70 HydrophobicContact CG-CB 3.73Å; M66-H70 HydrophobicContact SD-CB 3.51Å; M66-H70 VanDerWaalsContact SD-CB 3.51Å; M66-T71 PolarHBondContact O-OG1 3.08Å; M66-T71 VanDerWaalsContact O-OG1 3.05Å
67	D	62.6	Low	63.6	Low	113 Å²	113	82 Å²	82	60%	0.604	47%	0.474	S	S	*	.			trans	-45.1	148.9	179.7	-106.4	6.4	0	0	0	114.8	R69 H70 T71	D67-R69 PolarHBondContact O-N 3.12Å; D67-H70 WeakPolarHBondContact O-CA 3.44Å; D67-H70 WeakPolarHBondContact O-CB 3.46Å; D67-H70 PolarHBondContact O-N 3.19Å; D67-T71 VanDerWaalsContact C-OG1 3.31Å; D67-T71 PolarHBondContact O-N 3.46Å; D67-T71 PolarHBondContact O-OG1 2.84Å
68	Q	49	Very low	61.1	Low	172 Å²	172	84.5 Å²	84.5	80%	0.804	49%	0.492	S	S	*	.	H	α-helix	trans	-51.2	-29.3	178.1	-81.1	-169.3	-4.5	0	0	114.1	H70 T71 A72	Q68-H70 VanDerWaalsContact C-N 3.25Å; Q68-H70 PolarHBondContact O-N 2.87Å; Q68-T71 VanDerWaalsContact CA-OG1 3.25Å; Q68-T71 WeakPolarHBondContact CA-OG1 3.25Å; Q68-T71 PolarHBondContact N-OG1 3.22Å; Q68-T71 PolarHBondContact O-N 2.8Å; Q68-A72 VanDerWaalsContact O-CB 3.25Å; Q68-A72 WeakPolarHBondContact O-CB 3.36Å; Q68-A72 PolarHBondContact O-N 3.45Å
69	R	49.8	Very low	58.9	Low	211 Å²	211	92.3 Å²	92.3	80%	0.796	51%	0.509	S	S	*	.	H	α-helix	trans	-62.1	-31.4	175.4	-60.3	-179.1	-177	-170.4	2.5	112.7	D67	D67-R69 PolarHBondContact O-N 3.12Å
70	H	52.6	Low	56.5	Low	90 Å²	90	92.6 Å²	92.6	42%	0.417	50%	0.5	S	S	.	.	H	α-helix	trans	-89.2	-43.1	172.5	-66.9	-109.6	0	0	0	111.2	M66 D67 Q68 A72 R73	M66-H70 HydrophobicContact CB-CB 4.33Å; M66-H70 HydrophobicContact CE-CB 4.41Å; M66-H70 WeakPolarHBondContact CE-ND1 3.41Å; M66-H70 HydrophobicContact CG-CB 3.73Å; M66-H70 HydrophobicContact SD-CB 3.51Å; M66-H70 VanDerWaalsContact SD-CB 3.51Å; D67-H70 WeakPolarHBondContact O-CA 3.44Å; D67-H70 WeakPolarHBondContact O-CB 3.46Å; D67-H70 PolarHBondContact O-N 3.19Å; Q68-H70 VanDerWaalsContact C-N 3.25Å; Q68-H70 PolarHBondContact O-N 2.87Å; H70-A72 PolarHBondContact O-N 2.86Å; H70-R73 WeakPolarHBondContact O-CB 3.49Å; H70-R73 PolarHBondContact O-N 2.94Å
71	T	42.5	Very low	54	Low	41 Å²	41	93.9 Å²	93.9	25%	0.252	51%	0.513	S	S	.	.	H	α-helix	trans	-57.9	-36.6	-179.9	-19.2	0	0	0	0	112.2	L53 M66 D67 Q68 R73 L74 G75	L53-T71 HydrophobicContact CB-CG2 3.98Å; L53-T71 HydrophobicContact CD2-CG2 4.4Å; M66-T71 PolarHBondContact O-OG1 3.08Å; M66-T71 VanDerWaalsContact O-OG1 3.05Å; D67-T71 VanDerWaalsContact C-OG1 3.31Å; D67-T71 PolarHBondContact O-N 3.46Å; D67-T71 PolarHBondContact O-OG1 2.84Å; Q68-T71 VanDerWaalsContact CA-OG1 3.25Å; Q68-T71 WeakPolarHBondContact CA-OG1 3.25Å; Q68-T71 PolarHBondContact N-OG1 3.22Å; Q68-T71 PolarHBondContact O-N 2.8Å; T71-R73 PolarHBondContact O-N 2.82Å; T71-R73 VanDerWaalsContact O-N 3.13Å; T71-L74 PolarHBondContact O-N 3.29Å; T71-G75 PolarHBondContact O-N 2.74Å
72	A	36.2	Very low	51.7	Low	73 Å²	73	96.5 Å²	96.5	60%	0.603	52%	0.523	S	S	*	.	H	α-helix	trans	-60.1	-20.7	177	0	0	0	0	0	114.4	Q68 H70	Q68-A72 VanDerWaalsContact O-CB 3.25Å; Q68-A72 WeakPolarHBondContact O-CB 3.36Å; Q68-A72 PolarHBondContact O-N 3.45Å; H70-A72 PolarHBondContact O-N 2.86Å
73	R	46	Very low	49.1	Very low	188 Å²	188	101.2 Å²	101.2	71%	0.709	54%	0.536	S	S	*	.	H	α-helix	trans	-77.8	-28.1	174.3	-65.8	-177	163.3	174.2	-3.6	112.6	H70 T71 F948	H70-R73 WeakPolarHBondContact O-CB 3.49Å; H70-R73 PolarHBondContact O-N 2.94Å; T71-R73 PolarHBondContact O-N 2.82Å; T71-R73 VanDerWaalsContact O-N 3.13Å; R73-F948 HydrophobicContact CB-CE2 3.97Å; R73-F948 HydrophobicContact CB-CZ 4.5Å; R73-F948 WeakPolarHBondContact O-CE2 3.38Å
74	L	49.9	Very low	46.7	Very low	4 Å²	4	105.7 Å²	105.7	2%	0.021	56%	0.56	C	S	.	*	H	α-helix	trans	-103.5	-22.7	-177.1	-79.4	158.1	0	0	0	114	M26 W45 L53 T71 N76 I77 F948	M26-L74 HydrophobicContact CE-CB 4.05Å; W45-L74 HydrophobicContact CD2-CD1 4.14Å; W45-L74 HydrophobicContact CE3-CD1 3.71Å; W45-L74 HydrophobicContact CZ3-CD1 3.92Å; L53-L74 HydrophobicContact CD1-CD1 4.11Å; L53-L74 HydrophobicContact CD2-CD1 3.51Å; L53-L74 HydrophobicContact CG-CD1 4.44Å; T71-L74 PolarHBondContact O-N 3.29Å; L74-N76 PolarHBondContact O-N 2.8Å; L74-I77 HydrophobicContact CD2-CD1 3.87Å; L74-I77 WeakPolarHBondContact O-CG1 3.43Å; L74-I77 PolarHBondContact O-N 2.92Å; L74-F948 HydrophobicContact CD1-CZ 4.21Å; L74-F948 HydrophobicContact CD2-CB 4.48Å; L74-F948 HydrophobicContact CD2-CD1 3.85Å; L74-F948 HydrophobicContact CD2-CD2 3.59Å; L74-F948 HydrophobicContact CD2-CE1 3.87Å; L74-F948 HydrophobicContact CD2-CE2 3.63Å; L74-F948 HydrophobicContact CD2-CG 3.7Å; L74-F948 HydrophobicContact CD2-CZ 3.77Å; L74-F948 HydrophobicContact CG-CD2 4.06Å; L74-F948 HydrophobicContact CG-CE1 4.28Å; L74-F948 HydrophobicContact CG-CE2 3.61Å; L74-F948 HydrophobicContact CG-CZ 3.73Å
75	G	37	Very low	44.1	Very low	56 Å²	56	109.7 Å²	109.7	58%	0.577	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	1.4	-171.4	0	0	0	0	0	118	T71	T71-G75 PolarHBondContact O-N 2.74Å
76	N	40.3	Very low	41.8	Very low	99 Å²	99	109.2 Å²	109.2	53%	0.529	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.8	-9.4	174.6	-78	-61.6	0	0	0	114.1	L74	L74-N76 PolarHBondContact O-N 2.8Å
77	I	41.6	Very low	39.9	Very low	57 Å²	57	113.4 Å²	113.4	29%	0.292	62%	0.621	S	S	.	*	G	3₁₀ helix	trans	-84.4	-22.3	-167.1	-63.5	168.6	0	0	0	112.6	M26 L74 R79 F948	M26-I77 HydrophobicContact CE-CB 4.31Å; L74-I77 HydrophobicContact CD2-CD1 3.87Å; L74-I77 WeakPolarHBondContact O-CG1 3.43Å; L74-I77 PolarHBondContact O-N 2.92Å; I77-R79 PolarHBondContact O-N 3.43Å; I77-F948 HydrophobicContact CD1-CB 4.27Å
78	S	36.1	Very low	38.2	Very low	62 Å²	62	118.7 Å²	118.7	43%	0.434	63%	0.632	S	S	.	*	G	3₁₀ helix	trans	-95.6	23.6	-170.8	-49.6	0	0	0	0	115.4
79	R	36.8	Very low	37.4	Very low	250 Å²	250	120.4 Å²	120.4	94%	0.943	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-134.9	0.4	174.1	-68.7	-166.8	-178.7	-161.4	1.6	115.3	I77	I77-R79 PolarHBondContact O-N 3.43Å
80	S	31.6	Very low	36.7	Very low	69 Å²	69	119.2 Å²	119.2	48%	0.483	63%	0.63	S	S	.	*			trans	-102.3	110.2	172.9	49.1	0	0	0	0	110.1	Q82	S80-Q82 PolarHBondContact O-N 2.82Å
81	G	30.7	Very low	35.6	Very low	76 Å²	76	122.1 Å²	122.1	78%	0.784	65%	0.648	S	S	*	*			trans	-73.2	42.9	-177.7	0	0	0	0	0	115.4	F83	G81-F83 PolarHBondContact O-N 3.39Å
82	Q	36.4	Very low	35.1	Very low	153 Å²	153	123.8 Å²	123.8	72%	0.715	67%	0.673	S	S	*	*			trans	-84.2	96.2	175.8	-79.2	180	-36.7	0	0	110.2	S80	S80-Q82 PolarHBondContact O-N 2.82Å
83	F	32	Very low	34.7	Very low	191 Å²	191	126.9 Å²	126.9	84%	0.838	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-58.2	141.7	169.2	-82.5	-103.2	0	0	0	111.2	G81 P85	G81-F83 PolarHBondContact O-N 3.39Å; F83-P85 WeakPolarHBondContact O-CD 3.45Å
84	I	33.5	Very low	34.1	Very low	148 Å²	148	124.8 Å²	124.8	76%	0.759	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-73.7	122.8	170.1	-59.4	174	0	0	0	108.2	G86	I84-G86 PolarHBondContact O-N 2.77Å
85	P	28.5	Very low	33.1	Very low	130 Å²	130	131.3 Å²	131.3	84%	0.844	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	117.2	174.3	-19.9	33	0	0	0	110.5	F83	F83-P85 WeakPolarHBondContact O-CD 3.45Å
86	G	31.9	Very low	32.8	Very low	76 Å²	76	134.1 Å²	134.1	78%	0.784	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	153.8	-29.7	176.7	0	0	0	0	0	115	I84 R88	I84-G86 PolarHBondContact O-N 2.77Å; G86-R88 PolarHBondContact O-N 2.93Å
87	S	32.7	Very low	32.2	Very low	122 Å²	122	134.3 Å²	134.3	85%	0.853	73%	0.732	S	S	*	*			trans	-84.3	91.5	-180	-167.9	0	0	0	0	112
88	R	27.5	Very low	31.5	Very low	224 Å²	224	138.7 Å²	138.7	85%	0.845	75%	0.751	S	S	*	*			trans	-97	135.8	159.7	-61	-178	-171.9	170.2	2.6	108.6	G86	G86-R88 PolarHBondContact O-N 2.93Å
89	Y	32.7	Very low	31.1	Very low	208 Å²	208	145.3 Å²	145.3	82%	0.816	77%	0.766	S	S	*	*			trans	-167.5	138.9	135.5	-92.1	-52.2	0	0	0	111
90	Y	34.4	Very low	30.9	Very low	187 Å²	187	142.6 Å²	142.6	73%	0.733	76%	0.762	S	S	*	*			trans	32.9	110	169.1	-60.1	-80.2	0	0	0	119.6
91	L	28.8	Very low	30.7	Very low	151 Å²	151	148.9 Å²	148.9	79%	0.791	78%	0.78	S	S	*	*				74.9	126	74.3	-89.8	154.9	0	0	0	114.1
92	G	31.8	Very low	30.6	Very low	76 Å²	76	156 Å²	156	78%	0.784	78%	0.784	S	S	*	*			trans	163	45.7	179.3	0	0	0	0	0	114.9
93	D	29.1	Very low	30.1	Very low	137 Å²	137	158.5 Å²	158.5	73%	0.733	79%	0.787	S	S	*	*			trans	-67.7	141.7	175	-63.9	-80.9	0	0	0	112.1
94	N	32.7	Very low	29.9	Very low	145 Å²	145	156.8 Å²	156.8	78%	0.775	78%	0.781	S	S	*	*				-173.4	146.2	121	-94.9	-35.8	0	0	0	114.7
95	L	29.7	Very low	29.6	Very low	141 Å²	141	154.2 Å²	154.2	74%	0.738	78%	0.776	S	S	*	*			trans	-2.8	149.3	143.9	-75.4	71.2	0	0	0	118.2
96	T	29.3	Very low	29.5	Very low	115 Å²	115	154.4 Å²	154.4	71%	0.706	77%	0.77	S	S	*	*			cis	-163.7	159.9	15.2	-1.7	0	0	0	0	113.6
97	S	28.1	Very low	29.3	Very low	103 Å²	103	155.9 Å²	155.9	72%	0.72	77%	0.768	S	S	*	*			trans	56.9	135.2	139.8	-66.7	0	0	0	0	124.6
98	E	27.9	Very low	29	Very low	148 Å²	148	153.8 Å²	153.8	69%	0.692	77%	0.767	S	S	*	*			trans	78.9	136.9	146.9	-71.3	-135.2	150.9	0	0	122.5
99	R	27.2	Very low	29.1	Very low	201 Å²	201	147.4 Å²	147.4	76%	0.758	76%	0.762	S	S	*	*			trans	53.1	101.1	157.8	-61.8	173	-146.4	-160.5	5.6	118.1
100	F	32.7	Very low	28.9	Very low	193 Å²	193	148.8 Å²	148.8	85%	0.846	77%	0.766	S	S	*	*				-147	122.9	100.2	-117.6	-76	0	0	0	113
101	K	26.7	Very low	28.5	Very low	201 Å²	201	147.2 Å²	147.2	87%	0.874	77%	0.77	S	S	*	*			trans	-91.9	106.8	173.7	-72.6	178.8	178.5	174	0	110.5
102	R	29.1	Very low	28.4	Very low	227 Å²	227	144.1 Å²	144.1	86%	0.857	76%	0.761	S	S	*	*			trans	-140.2	104.4	151.1	-71.4	-169.6	175.6	174.3	-1	106.9
103	R	26.6	Very low	28.2	Very low	205 Å²	205	152.6 Å²	152.6	77%	0.774	77%	0.769	S	S	*	*				52.8	119.4	63.6	-93.7	-174.9	167.2	-125.9	8.6	113.5
104	Q	27.6	Very low	28.1	Very low	154 Å²	154	150.6 Å²	150.6	72%	0.72	77%	0.766	S	S	*	*			trans	64.4	155.5	150.3	-59.1	165.6	-81.3	0	0	114.9
105	S	26.2	Very low	27.9	Very low	95 Å²	95	153.3 Å²	153.3	66%	0.664	77%	0.774	S	S	*	*			cis	-148.8	-158.9	-28.3	51.2	0	0	0	0	105.6
106	D	27.1	Very low	27.9	Very low	133 Å²	133	151.8 Å²	151.8	71%	0.711	78%	0.775	S	S	*	*			cis	-160.4	-171.2	13.9	-145.4	-74.1	0	0	0	110.5
107	S	27.2	Very low	28	Very low	107 Å²	107	155.4 Å²	155.4	75%	0.748	78%	0.781	S	S	*	*			trans	-58.8	157.4	160.3	57.3	0	0	0	0	113.2
108	G	27.1	Very low	28.3	Very low	79 Å²	79	158.5 Å²	158.5	81%	0.814	78%	0.784	S	S	*	*			trans	-169.5	102.2	178.9	0	0	0	0	0	114
109	A	29.8	Very low	28.4	Very low	90 Å²	90	162 Å²	162	74%	0.744	79%	0.79	S	S	*	*			trans	-75.2	163.7	169.5	0	0	0	0	0	111.8
110	W	27.6	Very low	28.7	Very low	237 Å²	237	157.2 Å²	157.2	90%	0.898	78%	0.784	S	S	*	*			trans	12.8	134	151.7	-63.8	62	0	0	0	118.5
111	D	26	Very low	28.6	Very low	153 Å²	153	157.8 Å²	157.8	82%	0.818	78%	0.782	S	S	*	*				-156.8	159.5	111.4	-136	-24.2	0	0	0	115.4
112	S	27.7	Very low	28.9	Very low	86 Å²	86	152.6 Å²	152.6	60%	0.601	77%	0.771	S	S	*	*			trans	-84.8	123.5	169.9	-60	0	0	0	0	110.4	S114	S112-S114 PolarHBondContact O-N 3.48Å
113	R	27.3	Very low	29	Very low	255 Å²	255	149 Å²	149	96%	0.962	76%	0.764	S	S	*	*			trans	-89.8	75.6	165.4	-80.5	-169.4	170.2	-168.2	-3.3	111.5
114	S	26.9	Very low	29.4	Very low	94 Å²	94	143.8 Å²	143.8	66%	0.657	76%	0.755	S	S	*	*			trans	-62.6	155.6	145.5	39.4	0	0	0	0	109.8	S112 S116	S112-S114 PolarHBondContact O-N 3.48Å; S114-S116 PolarHBondContact O-N 3.1Å
115	E	27.9	Very low	29.6	Very low	202 Å²	202	145.3 Å²	145.3	94%	0.944	75%	0.754	S	S	*	*			trans	-63	131.4	169.3	-68.1	178.1	94.8	0	0	109.8
116	S	29.4	Very low	29.8	Very low	110 Å²	110	149.6 Å²	149.6	77%	0.769	76%	0.756	S	S	*	*			trans	-140.3	122.3	-179	-172	0	0	0	0	111	S114	S114-S116 PolarHBondContact O-N 3.1Å
117	K	31.7	Very low	29.9	Very low	190 Å²	190	149.3 Å²	149.3	83%	0.826	75%	0.754	S	S	*	*			trans	-116.9	98.1	173.9	-81.9	-174.7	176.9	177.6	0	109.6
118	H	33.7	Very low	30	Very low	168 Å²	168	150.3 Å²	150.3	78%	0.778	75%	0.75	S	S	*	*			trans	60.7	150.9	163.3	-54	-82.8	0	0	0	115.9
119	R	31.4	Very low	30.1	Very low	221 Å²	221	152.9 Å²	152.9	83%	0.834	74%	0.742	S	S	*	*			cis	-153.2	130.7	21.7	-148.7	158.6	178.7	-154.8	-0.9	110
120	T	32.8	Very low	30.2	Very low	102 Å²	102	158.1 Å²	158.1	63%	0.626	74%	0.743	S	S	*	*				67.2	104.5	127.6	-63.7	0	0	0	0	119
121	Y	30.5	Very low	30.3	Very low	204 Å²	204	152.1 Å²	152.1	80%	0.8	73%	0.733	S	S	*	*				76.4	140.3	99.7	-82.1	-77.4	0	0	0	113.9
122	S	33.1	Very low	30.5	Very low	92 Å²	92	151 Å²	151	64%	0.643	73%	0.727	S	S	*	*			cis	-147.7	151.1	0.1	-21.5	0	0	0	0	108.8
123	E	32.4	Very low	30.6	Very low	152 Å²	152	153 Å²	153	71%	0.71	73%	0.731	S	S	*	*				53.8	136.1	91.7	-59.9	-154.8	102.9	0	0	116.3
124	T	33.2	Very low	30.7	Very low	96 Å²	96	145.5 Å²	145.5	59%	0.589	72%	0.718	S	S	*	*			cis	-168.6	143.9	5.4	13	0	0	0	0	113.5
125	R	32	Very low	30.8	Very low	186 Å²	186	148.5 Å²	148.5	70%	0.702	73%	0.725	S	S	*	*			trans	53.8	155.9	132.7	-72	175.2	170.6	157.5	-4.5	120.7
126	R	30.3	Very low	30.9	Very low	184 Å²	184	142.9 Å²	142.9	69%	0.694	71%	0.713	S	S	*	*			cis	-162.5	152.3	11.9	-131.6	164.1	-176.5	152.5	-1.9	112.7
127	L	29.6	Very low	31	Very low	128 Å²	128	143.8 Å²	143.8	67%	0.67	71%	0.714	S	S	*	*			trans	38	125.1	140.3	-97.7	74	0	0	0	120.9
128	N	30.6	Very low	30.8	Very low	127 Å²	127	145 Å²	145	68%	0.679	71%	0.713	S	S	*	*				79.6	153.8	94.1	-76.8	27.7	0	0	0	114.1
129	E	28.5	Very low	30.7	Very low	134 Å²	134	147.3 Å²	147.3	63%	0.626	72%	0.717	S	S	*	*			cis	-163.4	156.7	15.2	-130.4	157.6	-117.7	0	0	111.7
130	Y	30.9	Very low	31.2	Very low	200 Å²	200	141 Å²	141	78%	0.784	71%	0.705	S	S	*	*			trans	54.6	161.7	162	-72.6	-69.8	0	0	0	118.6
131	T	31	Very low	31.2	Very low	110 Å²	110	142.1 Å²	142.1	68%	0.675	71%	0.707	S	S	*	*			cis	-153.2	158.6	15.4	-21.7	0	0	0	0	111.8
132	D	29.4	Very low	31.5	Very low	129 Å²	129	139.8 Å²	139.8	69%	0.69	70%	0.703	S	S	*	*			trans	69.2	140.8	142.3	-93.9	23.6	0	0	0	125.9
133	N	30.8	Very low	31.4	Very low	129 Å²	129	141.7 Å²	141.7	69%	0.69	71%	0.705	S	S	*	*			trans	70.4	105	142.4	-64	-34.1	0	0	0	123.6
134	S	28.9	Very low	31.4	Very low	98 Å²	98	140 Å²	140	69%	0.685	70%	0.701	S	S	*	*				98.4	132.6	113.5	78.2	0	0	0	0	121.9
135	I	29.1	Very low	31.2	Very low	156 Å²	156	143.1 Å²	143.1	80%	0.8	71%	0.709	S	S	*	*			trans	65.8	99	136	-63.4	169.5	0	0	0	119.6
136	A	29.2	Very low	31.3	Very low	85 Å²	85	141.2 Å²	141.2	70%	0.702	71%	0.708	S	S	*	*				73.7	172	129.1	0	0	0	0	0	121.8
137	T	32.8	Very low	31.7	Very low	128 Å²	128	135 Å²	135	79%	0.785	69%	0.691	S	S	*	*			trans	57	118.6	175.8	39.6	0	0	0	0	116.7
138	R	27.4	Very low	31.9	Very low	217 Å²	217	135.2 Å²	135.2	82%	0.819	68%	0.684	S	S	*	*			cis	118.5	114.9	22.2	-95.6	-164.5	-170.5	-166.2	6.6	107.9
139	Y	31.3	Very low	32	Very low	215 Å²	215	136 Å²	136	84%	0.843	68%	0.679	S	S	*	*			trans	60.6	160.5	132.6	-78.7	-110.3	0	0	0	120.1
140	P	42.6	Very low	32.3	Very low	90 Å²	90	137.3 Å²	137.3	58%	0.584	68%	0.682	S	S	*	*			cis	-147.9	-144.5	-38	41.5	-21	0	0	0	113.3
141	N	32.8	Very low	32.3	Very low	125 Å²	125	133.3 Å²	133.3	67%	0.668	68%	0.679	S	S	*	*			trans	81.8	143.5	164.1	-66.7	-19.8	0	0	0	116.1
142	Q	34.9	Very low	32.3	Very low	154 Å²	154	134.1 Å²	134.1	72%	0.72	68%	0.684	S	S	*	*			cis	-165.2	165.1	-0.7	-114.4	160.7	-6.5	0	0	107.7
143	L	32.5	Very low	32.4	Very low	133 Å²	133	131.9 Å²	131.9	70%	0.696	68%	0.684	S	S	*	*			cis	-158.5	140.6	-10.2	-161.6	56.3	0	0	0	104.7
144	N	31.4	Very low	32.4	Very low	117 Å²	117	130.7 Å²	130.7	63%	0.626	69%	0.685	S	S	*	*				48.2	135	77.1	-124.3	16.3	0	0	0	113.5
145	Q	30.3	Very low	32.6	Very low	160 Å²	160	133.7 Å²	133.7	75%	0.748	69%	0.688	S	S	*	*			cis	-144.9	161.6	20.3	-80	177.5	95.1	0	0	110.8
146	Q	33.2	Very low	32.7	Very low	147 Å²	147	132.5 Å²	132.5	69%	0.687	68%	0.683	S	S	*	*			cis	87.2	163.8	41.4	-79.5	-126.3	-8.3	0	0	113.5
147	P	37.7	Very low	32.7	Very low	52 Å²	52	135.1 Å²	135.1	34%	0.338	68%	0.684	S	S	.	*				-140.1	-162.4	-89.8	22.5	6.8	0	0	0	116.3	T611	P147-T611 CarbonylContact C-O 3.58Å; P147-T611 WeakPolarHBondContact CA-O 3.49Å; P147-T611 WeakPolarHBondContact CB-O 3.44Å
148	Y	34.8	Very low	32.5	Very low	133 Å²	133	133.3 Å²	133.3	52%	0.522	68%	0.676	S	S	.	*			trans	151.9	135.2	144.7	-66.8	-1.2	0	0	0	120.5	I608 A609 T610 T611	Y148-I608 WeakPolarHBondContact CE2-O 3.45Å; Y148-A609 VanDerWaalsContact CD2-C 3.46Å; Y148-A609 WeakPolarHBondContact CD2-O 3.47Å; Y148-A609 WeakPolarHBondContact CE2-O 3.48Å; Y148-A609 VanDerWaalsContact CG-O 3.25Å; Y148-T610 VanDerWaalsContact CA-OG1 3.29Å; Y148-T610 WeakPolarHBondContact CA-OG1 3.32Å; Y148-T610 WeakPolarHBondContact CB-OG1 3.47Å; Y148-T610 VanDerWaalsContact CD1-O 3.26Å; Y148-T610 WeakPolarHBondContact CD1-O 3.41Å; Y148-T610 VanDerWaalsContact CE1-O 3.32Å; Y148-T610 WeakPolarHBondContact CE1-O 3.04Å; Y148-T611 VanDerWaalsContact C-N 3.34Å; Y148-T611 PolarHBondContact N-O 3.41Å; Y148-T611 PolarHBondContact O-OG1 3.18Å
149	Y	33.1	Very low	32.7	Very low	145 Å²	145	129.2 Å²	129.2	57%	0.569	67%	0.671	S	S	*	*			trans	-121.4	160.9	-169.5	34.6	-111.6	0	0	0	114.6	T610 T611	Y149-T610 HydrophobicContact CD2-CG2 3.08Å; Y149-T610 HydrophobicContact CE2-CG2 3.25Å; Y149-T610 HydrophobicContact CG-CG2 3.91Å; Y149-T610 PolarHBondContact N-OG1 3.2Å; Y149-T610 VanDerWaalsContact O-CB 3.31Å; Y149-T610 WeakPolarHBondContact O-CB 3.06Å; Y149-T610 VanDerWaalsContact O-CG2 3.32Å; Y149-T610 WeakPolarHBondContact O-CG2 3.34Å; Y149-T610 PolarHBondContact O-OG1 3.14Å; Y149-T611 WeakPolarHBondContact CA-OG1 3.23Å; Y149-T611 WeakPolarHBondContact CB-OG1 3.33Å; Y149-T611 HydrophobicContact CD1-CG2 3.57Å; Y149-T611 WeakPolarHBondContact CD1-OG1 3.35Å; Y149-T611 HydrophobicContact CE1-CG2 4.3Å; Y149-T611 VanDerWaalsContact CE1-N 3.29Å; Y149-T611 HydrophobicContact CG-CG2 4.49Å; Y149-T611 VanDerWaalsContact N-N 3.18Å; Y149-T611 PolarHBondContact N-OG1 2.87Å
150	K	34.1	Very low	32.8	Very low	160 Å²	160	127 Å²	127	70%	0.696	67%	0.668	S	S	*	*				-169.1	163.7	124.8	-112.5	170	-177.1	-179.1	0	118.4	T610	K150-T610 HydrophobicContact CD-CG2 4.45Å; K150-T610 HydrophobicContact CG-CG2 4.3Å
151	T	31.4	Very low	32.4	Very low	116 Å²	116	127.7 Å²	127.7	71%	0.712	68%	0.675	S	S	*	*			trans	-32.1	162.4	165.8	49.1	0	0	0	0	118.6
152	T	31.6	Very low	32.8	Very low	127 Å²	127	127.4 Å²	127.4	78%	0.779	68%	0.679	S	S	*	*			cis	-158.6	175	43.1	52.2	0	0	0	0	114.4
153	A	30	Very low	32.8	Very low	83 Å²	83	127.7 Å²	127.7	69%	0.686	69%	0.685	S	S	*	*			trans	79.9	107.2	139.1	0	0	0	0	0	123.8
154	S	30.5	Very low	32.8	Very low	103 Å²	103	128 Å²	128	72%	0.72	69%	0.688	S	S	*	*				94.4	138.1	121.2	-60	0	0	0	0	124.5
155	H	33	Very low	33.2	Very low	161 Å²	161	127.3 Å²	127.3	75%	0.745	69%	0.688	S	S	*	*			trans	76.8	125	148.9	-76.8	-60.1	0	0	0	124
156	N	31.6	Very low	33.5	Very low	131 Å²	131	126.9 Å²	126.9	70%	0.701	69%	0.685	S	S	*	*			trans	71.8	153.1	138.7	-60.4	0.9	0	0	0	119.4
157	I	29.4	Very low	33.4	Very low	141 Å²	141	125.8 Å²	125.8	72%	0.723	68%	0.683	S	S	*	*			cis	-167.6	152.9	-33.2	-114.1	161.8	0	0	0	108.2
158	S	29.6	Very low	33.3	Very low	89 Å²	89	128 Å²	128	62%	0.622	70%	0.7	S	S	*	*			trans	61.6	118.1	160.3	66.7	0	0	0	0	124.5
159	N	30.5	Very low	33	Very low	132 Å²	132	131.6 Å²	131.6	71%	0.706	71%	0.713	S	S	*	*				75.8	147.6	118.8	-58.4	1.4	0	0	0	125.5
160	H	33.8	Very low	32.8	Very low	169 Å²	169	134.6 Å²	134.6	78%	0.782	72%	0.723	S	S	*	*			trans	74.9	146.1	159.4	-56.5	-52.7	0	0	0	118.2
161	S	34.8	Very low	32.7	Very low	103 Å²	103	132.2 Å²	132.2	72%	0.72	73%	0.726	S	S	*	*			cis	-163.8	168.8	-16.4	-98.1	0	0	0	0	110.2
162	P	40.3	Very low	32.6	Very low	119 Å²	119	132.1 Å²	132.1	77%	0.773	73%	0.73	S	S	*	*			trans	-112.5	169.3	-161.1	41.4	-35.7	0	0	0	118
163	L	36	Very low	32.6	Very low	160 Å²	160	134 Å²	134	84%	0.838	73%	0.733	S	S	*	*			trans	-136.1	135.1	155.9	-74.3	112.8	0	0	0	107.9
164	N	32.6	Very low	32.8	Very low	140 Å²	140	137.4 Å²	137.4	75%	0.749	73%	0.734	S	S	*	*			cis	78.6	131	49.7	-157.8	31.4	0	0	0	111.8
165	T	39.1	Very low	32.8	Very low	102 Å²	102	138 Å²	138	63%	0.626	73%	0.733	S	S	*	*			cis	-106.5	-154.9	12.2	57.2	0	0	0	0	112.6
166	H	35.9	Very low	32.8	Very low	151 Å²	151	135.8 Å²	135.8	70%	0.699	74%	0.736	S	S	*	*			cis	-154.3	137.8	9.3	-151.2	-103.1	0	0	0	106.6
167	I	31	Very low	32.8	Very low	124 Å²	124	132.9 Å²	132.9	64%	0.636	74%	0.737	S	S	*	*				67.7	115.9	60.2	-58	171.1	0	0	0	111.6
168	S	35.6	Very low	32.9	Very low	100 Å²	100	132.3 Å²	132.3	70%	0.699	74%	0.741	S	S	*	*			cis	-137.7	177.5	10.6	-92.8	0	0	0	0	110.5
169	R	30.2	Very low	32.9	Very low	208 Å²	208	137.6 Å²	137.6	79%	0.785	76%	0.755	S	S	*	*			cis	74.3	142	32.8	-60.2	-168	175.1	-171.3	-0.2	114.7
170	W	28.7	Very low	32.9	Very low	207 Å²	207	134.1 Å²	134.1	78%	0.784	75%	0.751	S	S	*	*			cis	-163	155.3	2.3	-129.7	29.7	0	0	0	114.2
171	S	30.2	Very low	32.7	Very low	110 Å²	110	133.2 Å²	133.2	77%	0.769	75%	0.751	S	S	*	*			trans	64.4	162.9	144.6	63.7	0	0	0	0	123.8
172	S	30.1	Very low	32.5	Very low	114 Å²	114	137.3 Å²	137.3	80%	0.797	75%	0.751	S	S	*	*			trans	-141	162.9	-172.9	59.8	0	0	0	0	113.3
173	M	32.7	Very low	32	Very low	168 Å²	168	141.9 Å²	141.9	83%	0.828	75%	0.753	S	S	*	*			trans	150.4	158.4	161.6	-89.6	174	77	0	0	110.2
174	Q	33.3	Very low	31.7	Very low	154 Å²	154	137.7 Å²	137.7	72%	0.72	75%	0.748	S	S	*	*			cis	-167.8	171	-35.2	-137.5	179.1	31.5	0	0	109.2
175	T	30.9	Very low	31.9	Very low	114 Å²	114	138.1 Å²	138.1	70%	0.699	76%	0.756	S	S	*	*			trans	66.3	100.4	156	52.8	0	0	0	0	124.5
176	S	32.8	Very low	31.5	Very low	115 Å²	115	141.4 Å²	141.4	80%	0.804	77%	0.77	S	S	*	*				57.7	125.1	118.5	65.7	0	0	0	0	126.9
177	G	31.3	Very low	31.5	Very low	70 Å²	70	139.9 Å²	139.9	72%	0.722	78%	0.776	S	S	*	*			trans	84.1	159	136.1	0	0	0	0	0	119.8
178	T	31.8	Very low	31.7	Very low	130 Å²	130	136.9 Å²	136.9	80%	0.798	78%	0.775	S	S	*	*			cis	-165.3	139	-15.7	-21.6	0	0	0	0	111.3
179	Q	30.3	Very low	31.7	Very low	199 Å²	199	141.7 Å²	141.7	93%	0.93	78%	0.778	S	S	*	*			trans	59.5	159.2	170	-56.1	-159.3	10.1	0	0	117.8
180	G	29.4	Very low	31.9	Very low	59 Å²	59	140.7 Å²	140.7	61%	0.608	78%	0.776	S	S	*	*			cis	174.1	170.3	-7.4	0	0	0	0	0	112.8
181	L	29.5	Very low	32	Very low	150 Å²	150	135 Å²	135	79%	0.785	77%	0.773	S	S	*	*			trans	69.5	151.1	-179.7	-51.2	169.5	0	0	0	114.6
182	W	30.5	Very low	32.3	Very low	190 Å²	190	136.4 Å²	136.4	72%	0.72	78%	0.777	S	S	*	*			cis	-144.8	160.5	22.8	-73.6	86.4	0	0	0	114.1
183	R	30.6	Very low	32.3	Very low	215 Å²	215	137.2 Å²	137.2	81%	0.811	78%	0.777	S	S	*	*			trans	42	134.1	149.8	-62.6	168	-167.3	-88	1.4	120.2
184	G	30.2	Very low	32.4	Very low	72 Å²	72	137.3 Å²	137.3	74%	0.742	78%	0.781	S	S	*	*			cis	117.4	121.3	-5.5	0	0	0	0	0	115
185	T	36.4	Very low	32.3	Very low	149 Å²	149	136.1 Å²	136.1	91%	0.914	78%	0.784	S	S	*	*			trans	-143.8	153.4	169.8	43.1	0	0	0	0	111
186	N	30.6	Very low	32.3	Very low	170 Å²	170	141.7 Å²	141.7	91%	0.909	79%	0.792	S	S	*	*			trans	-107.1	155.3	-165.8	-74.9	-28.6	0	0	0	114.7
187	S	36.1	Very low	32.3	Very low	120 Å²	120	144.7 Å²	144.7	84%	0.839	79%	0.793	S	S	*	*				157.1	137.2	122.7	-168.9	0	0	0	0	112.1
188	G	35.3	Very low	32.5	Very low	60 Å²	60	150 Å²	150	62%	0.619	80%	0.799	S	S	*	*			cis	157.6	148.6	-13.3	0	0	0	0	0	115.5
189	R	34.8	Very low	32.5	Very low	202 Å²	202	151.1 Å²	151.1	76%	0.762	80%	0.798	S	S	*	*			trans	70.8	154.6	161.2	-34.3	-176.5	-169.3	-168.6	0.8	116.5
190	Y	33.6	Very low	32.7	Very low	186 Å²	186	151 Å²	151	73%	0.729	80%	0.795	S	S	*	*			cis	-136.9	144.3	2.9	-75.4	-81.5	0	0	0	109.6
191	A	32	Very low	32.8	Very low	89 Å²	89	157.4 Å²	157.4	74%	0.736	81%	0.806	S	S	*	*				58.1	143.6	102	0	0	0	0	0	116.5
192	T	37	Very low	33	Very low	138 Å²	138	157.8 Å²	157.8	85%	0.847	80%	0.803	S	S	*	*			cis	-142.9	164.3	27.5	48.3	0	0	0	0	114.7
193	T	29.5	Very low	33.3	Very low	131 Å²	131	157.8 Å²	157.8	80%	0.804	81%	0.811	S	S	*	*			trans	-95.6	144.9	176.8	-34.1	0	0	0	0	112.1
194	L	34.6	Very low	33.4	Very low	171 Å²	171	153.4 Å²	153.4	90%	0.895	80%	0.804	S	S	*	*			trans	-151.3	136	155.4	-109.2	177.3	0	0	0	111.8
195	T	30.3	Very low	34	Very low	128 Å²	128	155.9 Å²	155.9	79%	0.785	81%	0.807	S	S	*	*			trans	-98.5	139.5	-179.5	38.6	0	0	0	0	112
196	R	32.3	Very low	34	Very low	231 Å²	231	155.7 Å²	155.7	87%	0.872	80%	0.799	S	S	*	*			trans	-152.6	131.2	154.4	-132.6	175.4	-168	-84.2	-1.1	112.2
197	Q	31.9	Very low	33.9	Very low	179 Å²	179	156.1 Å²	156.1	84%	0.836	80%	0.795	S	S	*	*			trans	-72.6	146.1	174.4	-62.1	160	-29.7	0	0	110.4
198	H	35.7	Very low	33.7	Very low	180 Å²	180	158.3 Å²	158.3	83%	0.833	79%	0.794	S	S	*	*			trans	-149.9	126.9	151.4	-122.5	-84.7	0	0	0	111.4
199	I	31.6	Very low	33.5	Very low	154 Å²	154	160.5 Å²	160.5	79%	0.79	80%	0.796	S	S	*	*			trans	-91	133.3	-175.1	-62.2	161.9	0	0	0	109.9
200	K	34.1	Very low	33.7	Very low	196 Å²	196	156.4 Å²	156.4	85%	0.852	79%	0.793	S	S	*	*			trans	-159.8	97.1	154.5	-121.5	170.2	-175.9	178.4	0	115.9
201	K	32.8	Very low	33.6	Very low	194 Å²	194	155.8 Å²	155.8	84%	0.843	79%	0.794	S	S	*	*			trans	54.5	123.6	143.7	-61	-166.4	171	-166.1	0	121.3
202	H	32.5	Very low	33.8	Very low	158 Å²	158	160 Å²	160	73%	0.731	80%	0.798	S	S	*	*			trans	-60	163.7	159	-79.9	-107.7	0	0	0	113.7	D204	H202-D204 IonicContact ND1-OD2 3.04Å; H202-D204 PolarHBondContact ND1-OD2 2.76Å; H202-D204 VanDerWaalsContact ND1-OD2 3.11Å
203	H	36.4	Very low	33.8	Very low	190 Å²	190	159.5 Å²	159.5	88%	0.88	80%	0.795	S	S	*	*			trans	-153.5	109.3	136.1	-114.3	-74.1	0	0	0	111.2
204	D	33.2	Very low	34.3	Very low	123 Å²	123	159.2 Å²	159.2	66%	0.658	80%	0.795	S	S	*	*			trans	-121	132.6	171.8	-60.5	-73.3	0	0	0	108.9	H202	H202-D204 IonicContact ND1-OD2 3.04Å; H202-D204 PolarHBondContact ND1-OD2 2.76Å; H202-D204 VanDerWaalsContact ND1-OD2 3.11Å
205	P	43	Very low	34.4	Very low	125 Å²	125	156.4 Å²	156.4	81%	0.812	79%	0.79	S	S	*	*			trans	-97.9	94.1	-178.2	34.8	-31.2	0	0	0	113.8
206	I	36	Very low	34.8	Very low	145 Å²	145	155 Å²	155	74%	0.744	79%	0.792	S	S	*	*			trans	46.4	114.1	133.1	-57.6	169.9	0	0	0	118.2	M208	I206-M208 HydrophobicContact CG2-CG 4.12Å
207	E	28.3	Very low	34.8	Very low	178 Å²	178	147.7 Å²	147.7	83%	0.832	79%	0.787	S	S	*	*			trans	-71.5	143	150.6	-73.2	-169.1	126	0	0	111.1
208	M	33.1	Very low	35	Very low	167 Å²	167	144.1 Å²	144.1	82%	0.823	79%	0.788	S	S	*	*			trans	-128.2	102.2	162.5	-95.1	-178.8	58.4	0	0	110.5	I206	I206-M208 HydrophobicContact CG2-CG 4.12Å
209	V	30.6	Very low	35	Very low	106 Å²	106	140.7 Å²	140.7	64%	0.642	79%	0.785	S	S	*	*			trans	-92.6	127.1	171.2	175.7	0	0	0	0	109.4	K211	V209-K211 HydrophobicContact CG1-CG 4.23Å
210	V	38.7	Very low	35	Very low	116 Å²	116	144.5 Å²	144.5	70%	0.703	79%	0.789	S	S	*	*			trans	-127.1	114.7	162.8	-178.7	0	0	0	0	108.4
211	K	31.6	Very low	35	Very low	172 Å²	172	140.4 Å²	140.4	75%	0.748	78%	0.781	S	S	*	*			trans	-97.3	135.5	172.9	-72.2	178.4	176.5	176.1	0	109.7	V209	V209-K211 HydrophobicContact CG1-CG 4.23Å
212	H	37.1	Very low	35	Very low	178 Å²	178	138 Å²	138	82%	0.824	78%	0.777	S	S	*	*			trans	-137	139.4	153.2	-76	-71.8	0	0	0	110.9
213	T	35.9	Very low	35.3	Very low	128 Å²	128	138 Å²	138	79%	0.785	78%	0.781	S	S	*	*			trans	-160.8	166.2	-174	48.5	0	0	0	0	107.9
214	P	40.7	Very low	35.3	Very low	124 Å²	124	136.1 Å²	136.1	81%	0.805	78%	0.777	S	S	*	*			cis	-134.3	168.9	-34.6	37.1	-21.6	0	0	0	113
215	S	37.5	Very low	35.5	Very low	113 Å²	113	135.5 Å²	135.5	79%	0.79	78%	0.782	S	S	*	*			trans	-163.9	128.1	157.5	-167.1	0	0	0	0	107.7
216	A	37.1	Very low	35.3	Very low	99 Å²	99	135.1 Å²	135.1	82%	0.818	78%	0.777	S	S	*	*			cis	97.1	117.9	29.8	0	0	0	0	0	114.3
217	G	33.6	Very low	35.5	Very low	76 Å²	76	134.5 Å²	134.5	78%	0.784	78%	0.776	S	S	*	*			trans	113.7	143.4	165.5	0	0	0	0	0	117.2
218	A	35.7	Very low	35.9	Very low	104 Å²	104	131 Å²	131	86%	0.86	76%	0.763	S	S	*	*			trans	54.2	125.6	169.9	0	0	0	0	0	118.2
219	S	34.8	Very low	36.1	Very low	109 Å²	109	133 Å²	133	76%	0.762	76%	0.761	S	S	*	*			cis	75.4	83.4	5.9	-171.7	0	0	0	0	119.6
220	R	32.7	Very low	36.3	Very low	234 Å²	234	137.4 Å²	137.4	88%	0.883	78%	0.775	S	S	*	*				81.8	155.1	125.2	-157.6	-178.7	178.3	159	-0.5	119.8
221	V	34.3	Very low	36.1	Very low	110 Å²	110	135.9 Å²	135.9	67%	0.667	78%	0.782	S	S	*	*			trans	94.2	104.3	163.5	-169.5	0	0	0	0	118.1
222	D	32.8	Very low	36.2	Very low	143 Å²	143	132.9 Å²	132.9	77%	0.765	78%	0.783	S	S	*	*				31.9	147.8	130	-43.5	-33.2	0	0	0	124
223	L	38.1	Very low	36.1	Very low	157 Å²	157	132.2 Å²	132.2	82%	0.822	79%	0.785	S	S	*	*			trans	156.2	100.9	145.6	-85.2	170.5	0	0	0	108.3
224	L	35.6	Very low	36.2	Very low	151 Å²	151	131.4 Å²	131.4	79%	0.791	78%	0.782	S	S	*	*				79.7	135.3	73.7	-73.4	-173.4	0	0	0	116.7
225	S	37.4	Very low	35.8	Very low	110 Å²	110	133.9 Å²	133.9	77%	0.769	78%	0.782	S	S	*	*			trans	75	149.9	156.2	-63.6	0	0	0	0	119
226	V	39.7	Very low	35.5	Very low	117 Å²	117	136 Å²	136	71%	0.709	78%	0.784	S	S	*	*			cis	-162.8	150	-7.6	119.2	0	0	0	0	111.6
227	D	39.5	Very low	35	Very low	132 Å²	132	135.6 Å²	135.6	71%	0.706	78%	0.78	S	S	*	*			trans	58.4	165.1	160.3	-79.1	13.3	0	0	0	120.8
228	N	36.9	Very low	35	Very low	106 Å²	106	143.3 Å²	143.3	57%	0.567	79%	0.787	S	S	*	*			cis	-149.6	157	5.1	-133.7	-44.8	0	0	0	114.5
229	R	36.9	Very low	34.6	Very low	208 Å²	208	143.5 Å²	143.5	79%	0.785	78%	0.782	S	S	*	*			trans	44.7	107.8	153.7	-76.1	151.1	-151.1	-134.4	0	123.4
230	Q	34.7	Very low	34.5	Very low	199 Å²	199	145.4 Å²	145.4	93%	0.93	78%	0.782	S	S	*	*				28.9	123.8	118.6	-60.7	-179.9	1.9	0	0	120.7
231	G	35	Very low	34.7	Very low	83 Å²	83	142.9 Å²	142.9	86%	0.856	78%	0.78	S	S	*	*			trans	-161.7	162.8	163	0	0	0	0	0	110.3
232	S	33.4	Very low	34.8	Very low	109 Å²	109	145.5 Å²	145.5	76%	0.762	79%	0.79	S	S	*	*			trans	-125.1	173.7	-169.9	62.1	0	0	0	0	114.5
233	L	36.3	Very low	35.5	Very low	165 Å²	165	144.8 Å²	144.8	86%	0.864	79%	0.792	S	S	*	*			trans	82	160.5	169.2	-61.8	171.6	0	0	0	117.6
234	P	38.1	Very low	35.8	Very low	111 Å²	111	141.1 Å²	141.1	72%	0.721	79%	0.791	S	S	*	*			trans	-121.7	-178.2	-153.6	43.7	-32.3	0	0	0	116
235	H	32.1	Very low	36.9	Very low	175 Å²	175	139 Å²	139	81%	0.81	78%	0.78	S	S	*	*			trans	86.3	154.7	158.9	-127.7	-91.2	0	0	0	118.5
236	L	29.7	Very low	38.6	Very low	159 Å²	159	136.2 Å²	136.2	83%	0.832	76%	0.76	S	S	*	*			trans	80.2	135.6	173.5	-62.2	172.4	0	0	0	119.4
237	A	27.6	Very low	40.3	Very low	89 Å²	89	136.9 Å²	136.9	74%	0.736	76%	0.756	S	S	*	*			trans	-61.7	150.9	-169.8	0	0	0	0	0	116.4
238	Y	34	Very low	42	Very low	238 Å²	238	139.7 Å²	139.7	93%	0.933	76%	0.756	S	S	*	*			trans	-129.5	156.6	149.2	-89.4	-85.1	0	0	0	110.8
239	S	27.3	Very low	44	Very low	109 Å²	109	139.3 Å²	139.3	76%	0.762	75%	0.751	S	S	*	*			trans	-117.4	-173	-174.4	-173.7	0	0	0	0	110.5
240	I	33.3	Very low	46.1	Very low	148 Å²	148	135 Å²	135	76%	0.759	74%	0.74	S	S	*	*			trans	73.3	103.9	167.1	-48.4	163.1	0	0	0	115.1
241	H	35.6	Very low	48.4	Very low	182 Å²	182	131 Å²	131	84%	0.843	72%	0.719	S	S	*	*				-158	129	104.9	39.3	-80.9	0	0	0	110.5
242	N	36.1	Very low	50.8	Low	164 Å²	164	131.1 Å²	131.1	88%	0.877	70%	0.7	S	S	*	*			trans	-119.6	118.8	-178.4	-166.9	25.4	0	0	0	107.6
243	T	47.9	Very low	53.1	Low	129 Å²	129	131.3 Å²	131.3	79%	0.791	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-93.1	140.9	-177.7	43.2	0	0	0	0	111.1
244	G	45.4	Very low	55.6	Low	79 Å²	79	127.7 Å²	127.7	81%	0.814	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-70.7	133.5	-158.2	0	0	0	0	0	115.8
245	I	57.3	Low	58	Low	108 Å²	108	128.2 Å²	128.2	55%	0.554	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-57.8	137.6	156.5	-63.6	173.1	0	0	0	108.1	E249	I245-E249 HydrophobicContact CG2-CB 3.53Å
246	S	73.6	Confident	60.7	Low	51 Å²	51	124.7 Å²	124.7	36%	0.357	65%	0.65	S	S	.	*	P	Polyproline II helix	trans	-68.6	149.1	-178.7	69.2	0	0	0	0	112.1	R248 E249 Q250	S246-R248 PolarHBondContact O-N 2.83Å; S246-E249 VanDerWaalsContact CB-OE2 3.25Å; S246-E249 WeakPolarHBondContact CB-OE2 3.19Å; S246-E249 PolarHBondContact N-OE2 3.04Å; S246-E249 PolarHBondContact O-N 2.74Å; S246-E249 WeakPolarHBondContact OG-CG 3.47Å; S246-E249 PolarHBondContact OG-N 3.05Å; S246-E249 PolarHBondContact OG-OE2 3.4Å; S246-Q250 PolarHBondContact O-N 3.18Å
247	E	74.9	Confident	63.5	Low	131 Å²	131	121.3 Å²	121.3	61%	0.612	63%	0.632	S	S	*	*	H	α-helix	trans	-56.6	-27.5	176.6	-157.6	-149.4	175	0	0	112	K251	E247-K251 WeakPolarHBondContact O-CB 3.46Å; E247-K251 VanDerWaalsContact O-CG 3.29Å; E247-K251 WeakPolarHBondContact O-CG 3.23Å; E247-K251 PolarHBondContact O-N 2.81Å; E247-K251 WeakPolarHBondContact OE1-CE 3.41Å; E247-K251 IonicContact OE1-NZ 2.8Å; E247-K251 PolarHBondContact OE1-NZ 3.41Å; E247-K251 IonicContact OE2-NZ 2.73Å; E247-K251 PolarHBondContact OE2-NZ 3.12Å
248	R	75.6	Confident	66.4	Low	191 Å²	191	121.2 Å²	121.2	72%	0.721	62%	0.619	S	S	*	*	H	α-helix	trans	-70.3	-45.1	174.1	-176.2	174.3	-179.7	-109.6	0.3	112.5	S246 Q250 K251 L252	S246-R248 PolarHBondContact O-N 2.83Å; R248-Q250 VanDerWaalsContact C-N 3.35Å; R248-K251 PolarHBondContact O-N 2.88Å; R248-L252 HydrophobicContact CG-CD1 4.31Å; R248-L252 WeakPolarHBondContact O-CG 3.03Å; R248-L252 PolarHBondContact O-N 3.19Å
249	E	79.4	Confident	69	Low	97 Å²	97	113 Å²	113	45%	0.453	59%	0.594	S	S	.	*	H	α-helix	trans	-64.8	-39.5	174.2	-74.2	162.1	113.7	0	0	111.5	I245 S246 K251 L252 Q253	I245-E249 HydrophobicContact CG2-CB 3.53Å; S246-E249 VanDerWaalsContact CB-OE2 3.25Å; S246-E249 WeakPolarHBondContact CB-OE2 3.19Å; S246-E249 PolarHBondContact N-OE2 3.04Å; S246-E249 PolarHBondContact O-N 2.74Å; S246-E249 WeakPolarHBondContact OG-CG 3.47Å; S246-E249 PolarHBondContact OG-N 3.05Å; S246-E249 PolarHBondContact OG-OE2 3.4Å; E249-K251 VanDerWaalsContact C-N 3.34Å; E249-K251 PolarHBondContact O-N 2.76Å; E249-L252 PolarHBondContact O-N 2.83Å; E249-Q253 WeakPolarHBondContact O-CB 3.28Å; E249-Q253 WeakPolarHBondContact O-CG 3.32Å; E249-Q253 PolarHBondContact O-N 3.11Å
250	Q	80.7	Confident	71.9	Confident	117 Å²	117	113.5 Å²	113.5	55%	0.547	58%	0.584	S	S	.	*	H	α-helix	trans	-65.3	-37.4	177.3	-160.9	177.6	44.6	0	0	111.9	S246 R248 N254	S246-Q250 PolarHBondContact O-N 3.18Å; R248-Q250 VanDerWaalsContact C-N 3.35Å; Q250-N254 WeakPolarHBondContact O-CB 3.5Å; Q250-N254 PolarHBondContact O-N 3.03Å; Q250-N254 VanDerWaalsContact O-N 3.08Å; Q250-N254 PolarHBondContact O-ND2 2.74Å; Q250-N254 VanDerWaalsContact O-ND2 3.08Å
251	K	84.2	Confident	74.5	Confident	115 Å²	115	112 Å²	112	50%	0.5	57%	0.569	S	S	.	*	H	α-helix	trans	-63.2	-46.2	170.3	-75.7	166.8	-173.6	166.1	0	111.8	E247 R248 E249 Q253 N254 E255	E247-K251 WeakPolarHBondContact O-CB 3.46Å; E247-K251 VanDerWaalsContact O-CG 3.29Å; E247-K251 WeakPolarHBondContact O-CG 3.23Å; E247-K251 PolarHBondContact O-N 2.81Å; E247-K251 WeakPolarHBondContact OE1-CE 3.41Å; E247-K251 IonicContact OE1-NZ 2.8Å; E247-K251 PolarHBondContact OE1-NZ 3.41Å; E247-K251 IonicContact OE2-NZ 2.73Å; E247-K251 PolarHBondContact OE2-NZ 3.12Å; R248-K251 PolarHBondContact O-N 2.88Å; E249-K251 VanDerWaalsContact C-N 3.34Å; E249-K251 PolarHBondContact O-N 2.76Å; K251-Q253 PolarHBondContact O-N 3.2Å; K251-N254 PolarHBondContact O-N 3.28Å; K251-E255 PolarHBondContact O-N 3.47Å
252	L	84.6	Confident	76.8	Confident	86 Å²	86	109 Å²	109	45%	0.45	56%	0.556	S	S	.	*	H	α-helix	trans	-63.1	-40.8	177.3	-72.3	167.3	0	0	0	112.8	R248 E249 E255 L256	R248-L252 HydrophobicContact CG-CD1 4.31Å; R248-L252 WeakPolarHBondContact O-CG 3.03Å; R248-L252 PolarHBondContact O-N 3.19Å; E249-L252 PolarHBondContact O-N 2.83Å; L252-E255 PolarHBondContact O-N 3.01Å; L252-L256 WeakPolarHBondContact O-CB 3.42Å; L252-L256 PolarHBondContact O-N 3.22Å
253	Q	81.8	Confident	79.1	Confident	114 Å²	114	106 Å²	106	53%	0.533	54%	0.539	S	S	.	.	H	α-helix	trans	-63.3	-41.3	174.7	-74.6	179.4	0.3	0	0	111.7	E249 K251 L256 L257	E249-Q253 WeakPolarHBondContact O-CB 3.28Å; E249-Q253 WeakPolarHBondContact O-CG 3.32Å; E249-Q253 PolarHBondContact O-N 3.11Å; K251-Q253 PolarHBondContact O-N 3.2Å; Q253-L256 PolarHBondContact O-N 3.14Å; Q253-L257 WeakPolarHBondContact O-CB 3.43Å; Q253-L257 PolarHBondContact O-N 2.98Å
254	N	87.9	Confident	80.7	Confident	88 Å²	88	105 Å²	105	47%	0.471	53%	0.525	S	S	.	.	H	α-helix	trans	-65	-38.2	175.2	-79.5	-39.9	0	0	0	112.6	Q250 K251 L257 N258	Q250-N254 WeakPolarHBondContact O-CB 3.5Å; Q250-N254 PolarHBondContact O-N 3.03Å; Q250-N254 VanDerWaalsContact O-N 3.08Å; Q250-N254 PolarHBondContact O-ND2 2.74Å; Q250-N254 VanDerWaalsContact O-ND2 3.08Å; K251-N254 PolarHBondContact O-N 3.28Å; N254-L257 PolarHBondContact O-N 3.48Å; N254-N258 WeakPolarHBondContact O-CB 3.31Å; N254-N258 PolarHBondContact O-N 3.28Å
255	E	88.7	Confident	82.3	Confident	123 Å²	123	107.6 Å²	107.6	58%	0.575	52%	0.516	S	S	*	.	H	α-helix	trans	-66.8	-42.2	175.3	-169	176.8	174.1	0	0	111.9	K251 L252 L257 N258 T259	K251-E255 PolarHBondContact O-N 3.47Å; L252-E255 PolarHBondContact O-N 3.01Å; E255-L257 VanDerWaalsContact C-N 3.34Å; E255-L257 PolarHBondContact O-N 2.83Å; E255-N258 PolarHBondContact O-N 3.38Å; E255-T259 WeakPolarHBondContact O-CG2 3.25Å; E255-T259 PolarHBondContact O-N 2.89Å; E255-T259 PolarHBondContact O-OG1 2.89Å
256	L	88.3	Confident	83.3	Confident	100 Å²	100	106.7 Å²	106.7	52%	0.524	51%	0.512	S	S	.	.	H	α-helix	trans	-63.9	-38.8	174.2	-141.5	170.6	0	0	0	111.3	L252 Q253 T259 Q260	L252-L256 WeakPolarHBondContact O-CB 3.42Å; L252-L256 PolarHBondContact O-N 3.22Å; Q253-L256 PolarHBondContact O-N 3.14Å; L256-T259 WeakPolarHBondContact CA-OG1 3.38Å; L256-T259 PolarHBondContact O-OG1 2.93Å; L256-T259 VanDerWaalsContact O-OG1 3.06Å; L256-Q260 HydrophobicContact CD2-CG 4.14Å; L256-Q260 WeakPolarHBondContact O-CB 3.46Å; L256-Q260 WeakPolarHBondContact O-CG 3.42Å; L256-Q260 PolarHBondContact O-N 3.1Å
257	L	89.1	Confident	83.3	Confident	88 Å²	88	111.4 Å²	111.4	46%	0.461	53%	0.526	S	S	.	.	H	α-helix	trans	-72	-31.1	176.3	-169.7	67.3	0	0	0	113	Q253 N254 E255 R261	Q253-L257 WeakPolarHBondContact O-CB 3.43Å; Q253-L257 PolarHBondContact O-N 2.98Å; N254-L257 PolarHBondContact O-N 3.48Å; E255-L257 VanDerWaalsContact C-N 3.34Å; E255-L257 PolarHBondContact O-N 2.83Å; L257-R261 PolarHBondContact O-N 2.74Å; L257-R261 PolarHBondContact O-NE 3.18Å
258	N	89.6	Confident	83.2	Confident	88 Å²	88	113.1 Å²	113.1	47%	0.471	53%	0.527	S	S	.	.	H	α-helix	trans	-68.7	-51.9	171.2	-87.5	-9.3	0	0	0	110.8	N254 E255 Q260 R261 E262	N254-N258 WeakPolarHBondContact O-CB 3.31Å; N254-N258 PolarHBondContact O-N 3.28Å; E255-N258 PolarHBondContact O-N 3.38Å; N258-Q260 VanDerWaalsContact C-N 3.31Å; N258-Q260 PolarHBondContact O-N 3.42Å; N258-R261 WeakPolarHBondContact O-CA 3.5Å; N258-R261 WeakPolarHBondContact O-CB 3.32Å; N258-R261 PolarHBondContact O-N 3.1Å; N258-R261 PolarHBondContact OD1-NH1 2.79Å; N258-R261 PolarHBondContact OD1-NH2 3.41Å; N258-E262 PolarHBondContact O-N 2.82Å
259	T	88.3	Confident	82.7	Confident	65 Å²	65	107 Å²	107	40%	0.399	51%	0.513	S	S	.	.	H	α-helix	trans	-62.9	-34.8	-179.6	50.5	0	0	0	0	112.4	E255 L256 E262 L263	E255-T259 WeakPolarHBondContact O-CG2 3.25Å; E255-T259 PolarHBondContact O-N 2.89Å; E255-T259 PolarHBondContact O-OG1 2.89Å; L256-T259 WeakPolarHBondContact CA-OG1 3.38Å; L256-T259 PolarHBondContact O-OG1 2.93Å; L256-T259 VanDerWaalsContact O-OG1 3.06Å; T259-E262 PolarHBondContact O-N 3.17Å; T259-L263 WeakPolarHBondContact O-CB 3.33Å; T259-L263 PolarHBondContact O-N 3.24Å
260	Q	86.9	Confident	81.4	Confident	120 Å²	120	112.4 Å²	112.4	56%	0.561	53%	0.529	S	S	*	.	H	α-helix	trans	-63.1	-43.1	169.5	-79.8	-169.5	3.9	0	0	113	L256 N258 L263 Q264	L256-Q260 HydrophobicContact CD2-CG 4.14Å; L256-Q260 WeakPolarHBondContact O-CB 3.46Å; L256-Q260 WeakPolarHBondContact O-CG 3.42Å; L256-Q260 PolarHBondContact O-N 3.1Å; N258-Q260 VanDerWaalsContact C-N 3.31Å; N258-Q260 PolarHBondContact O-N 3.42Å; Q260-L263 PolarHBondContact O-N 2.88Å; Q260-Q264 WeakPolarHBondContact O-CB 3.32Å; Q260-Q264 PolarHBondContact O-N 2.83Å
261	R	88.9	Confident	80	Confident	115 Å²	115	111.5 Å²	111.5	43%	0.434	54%	0.536	S	S	.	.	H	α-helix	trans	-63.5	-42.3	175.7	-89.1	179.9	-79.7	128.4	-0.6	111.6	L257 N258 Q264 Q265	L257-R261 PolarHBondContact O-N 2.74Å; L257-R261 PolarHBondContact O-NE 3.18Å; N258-R261 WeakPolarHBondContact O-CA 3.5Å; N258-R261 WeakPolarHBondContact O-CB 3.32Å; N258-R261 PolarHBondContact O-N 3.1Å; N258-R261 PolarHBondContact OD1-NH1 2.79Å; N258-R261 PolarHBondContact OD1-NH2 3.41Å; R261-Q264 PolarHBondContact O-N 2.96Å; R261-Q265 WeakPolarHBondContact O-CG 3.4Å; R261-Q265 PolarHBondContact O-N 3.32Å
262	E	84.7	Confident	78.1	Confident	121 Å²	121	113.2 Å²	113.2	57%	0.565	55%	0.55	S	S	*	.	H	α-helix	trans	-64.7	-44.1	176.8	-169.5	172.5	-138.3	0	0	111.8	N258 T259 Q264 Q265 L266	N258-E262 PolarHBondContact O-N 2.82Å; T259-E262 PolarHBondContact O-N 3.17Å; E262-Q264 VanDerWaalsContact C-N 3.28Å; E262-Q264 PolarHBondContact O-N 3.26Å; E262-Q265 PolarHBondContact O-N 2.99Å; E262-L266 HydrophobicContact CG-CD1 4.27Å; E262-L266 WeakPolarHBondContact O-CB 3.14Å; E262-L266 WeakPolarHBondContact O-CG 3.34Å; E262-L266 PolarHBondContact O-N 2.78Å
263	L	83.1	Confident	75.9	Confident	99 Å²	99	114.6 Å²	114.6	52%	0.518	56%	0.562	S	S	.	*	H	α-helix	trans	-61	-34.5	171.4	-105.1	163.7	0	0	0	112.9	T259 Q260 K267	T259-L263 WeakPolarHBondContact O-CB 3.33Å; T259-L263 PolarHBondContact O-N 3.24Å; Q260-L263 PolarHBondContact O-N 2.88Å; L263-K267 WeakPolarHBondContact O-CB 3.33Å; L263-K267 VanDerWaalsContact O-CG 3.25Å; L263-K267 WeakPolarHBondContact O-CG 3.47Å; L263-K267 PolarHBondContact O-N 2.85Å
264	Q	81.2	Confident	73.8	Confident	109 Å²	109	112.3 Å²	112.3	51%	0.509	57%	0.569	S	S	.	*	H	α-helix	trans	-74.1	-34.9	176.5	-162.7	179.6	73.8	0	0	111.9	Q260 R261 E262 R268	Q260-Q264 WeakPolarHBondContact O-CB 3.32Å; Q260-Q264 PolarHBondContact O-N 2.83Å; R261-Q264 PolarHBondContact O-N 2.96Å; E262-Q264 VanDerWaalsContact C-N 3.28Å; E262-Q264 PolarHBondContact O-N 3.26Å; Q264-R268 WeakPolarHBondContact O-CG 3.42Å; Q264-R268 PolarHBondContact O-N 2.96Å; Q264-R268 VanDerWaalsContact O-N 3.1Å
265	Q	80.5	Confident	71.1	Confident	134 Å²	134	117.4 Å²	117.4	63%	0.626	59%	0.59	S	S	*	*	H	α-helix	trans	-66.2	-45.6	169.8	-72.2	-179.3	12.4	0	0	111.5	R261 E262 K267 R268 S269	R261-Q265 WeakPolarHBondContact O-CG 3.4Å; R261-Q265 PolarHBondContact O-N 3.32Å; E262-Q265 PolarHBondContact O-N 2.99Å; Q265-K267 VanDerWaalsContact C-N 3.3Å; Q265-K267 PolarHBondContact O-N 2.92Å; Q265-R268 CarbonylContact O-C 3.58Å; Q265-R268 WeakPolarHBondContact O-CA 3.22Å; Q265-R268 WeakPolarHBondContact O-CB 3.41Å; Q265-R268 PolarHBondContact O-N 3.33Å; Q265-S269 PolarHBondContact O-N 3.36Å; Q265-S269 PolarHBondContact O-OG 2.87Å
266	L	77	Confident	68.6	Low	88 Å²	88	120.5 Å²	120.5	46%	0.461	60%	0.604	S	S	.	*	H	α-helix	trans	-61.6	-34.6	175.7	-75.5	166.5	0	0	0	112.8	E262 S269 R270	E262-L266 HydrophobicContact CG-CD1 4.27Å; E262-L266 WeakPolarHBondContact O-CB 3.14Å; E262-L266 WeakPolarHBondContact O-CG 3.34Å; E262-L266 PolarHBondContact O-N 2.78Å; L266-S269 WeakPolarHBondContact CA-OG 3.48Å; L266-S269 PolarHBondContact O-OG 2.97Å; L266-R270 VanDerWaalsContact O-CB 3.29Å; L266-R270 WeakPolarHBondContact O-CB 3.48Å; L266-R270 WeakPolarHBondContact O-CG 3.36Å; L266-R270 PolarHBondContact O-N 2.94Å
267	K	74.8	Confident	66	Low	151 Å²	151	122.3 Å²	122.3	66%	0.657	62%	0.615	S	S	*	*	H	α-helix	trans	-69.6	-32.9	171.7	-77.2	172.1	-180	179.9	0	112.7	L263 Q265	L263-K267 WeakPolarHBondContact O-CB 3.33Å; L263-K267 VanDerWaalsContact O-CG 3.25Å; L263-K267 WeakPolarHBondContact O-CG 3.47Å; L263-K267 PolarHBondContact O-N 2.85Å; Q265-K267 VanDerWaalsContact C-N 3.3Å; Q265-K267 PolarHBondContact O-N 2.92Å
268	R	72.9	Confident	63.4	Low	167 Å²	167	126 Å²	126	63%	0.63	63%	0.634	S	S	*	*	H	α-helix	trans	-73.6	-44.5	174	-74.4	173.9	174.8	167.4	1	112	Q264 Q265 S271	Q264-R268 WeakPolarHBondContact O-CG 3.42Å; Q264-R268 PolarHBondContact O-N 2.96Å; Q264-R268 VanDerWaalsContact O-N 3.1Å; Q265-R268 CarbonylContact O-C 3.58Å; Q265-R268 WeakPolarHBondContact O-CA 3.22Å; Q265-R268 WeakPolarHBondContact O-CB 3.41Å; Q265-R268 PolarHBondContact O-N 3.33Å; R268-S271 WeakPolarHBondContact O-CB 3.49Å; R268-S271 PolarHBondContact O-N 3.33Å
269	S	64.2	Low	60.7	Low	61 Å²	61	127.5 Å²	127.5	43%	0.427	65%	0.647	S	S	.	*	H	α-helix	trans	-70.4	-36.7	-179.6	61.6	0	0	0	0	113	Q265 L266 S271 L272	Q265-S269 PolarHBondContact O-N 3.36Å; Q265-S269 PolarHBondContact O-OG 2.87Å; L266-S269 WeakPolarHBondContact CA-OG 3.48Å; L266-S269 PolarHBondContact O-OG 2.97Å; S269-S271 PolarHBondContact O-N 2.86Å; S269-S271 VanDerWaalsContact O-N 3.11Å; S269-L272 PolarHBondContact O-N 2.72Å
270	R	52.8	Low	58.3	Low	212 Å²	212	132.3 Å²	132.3	80%	0.8	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	-4	171.4	-76.7	-177.5	167.3	-105.7	-0.5	114.8	L266	L266-R270 VanDerWaalsContact O-CB 3.29Å; L266-R270 WeakPolarHBondContact O-CB 3.48Å; L266-R270 WeakPolarHBondContact O-CG 3.36Å; L266-R270 PolarHBondContact O-N 2.94Å
271	S	49.7	Very low	55.8	Low	98 Å²	98	131.7 Å²	131.7	69%	0.685	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	-0.4	169.8	-167	0	0	0	0	113.3	R268 S269	R268-S271 WeakPolarHBondContact O-CB 3.49Å; R268-S271 PolarHBondContact O-N 3.33Å; S269-S271 PolarHBondContact O-N 2.86Å; S269-S271 VanDerWaalsContact O-N 3.11Å
272	L	44.9	Very low	53.4	Low	151 Å²	151	132 Å²	132	79%	0.791	69%	0.688	S	S	*	*	S	Bend	trans	-133.4	27.2	-171.4	-80.4	168.3	0	0	0	113.6	S269	S269-L272 PolarHBondContact O-N 2.72Å
273	T	39.4	Very low	51.1	Low	114 Å²	114	132.2 Å²	132.2	70%	0.699	70%	0.698	S	S	*	*			trans	-124.2	79.4	167.7	59.1	0	0	0	0	110.3
274	G	35.8	Very low	48.7	Very low	67 Å²	67	134.6 Å²	134.6	69%	0.691	71%	0.71	S	S	*	*			trans	-64.3	165.4	155.8	0	0	0	0	0	110.7	Q276	G274-Q276 PolarHBondContact O-N 3.35Å
275	E	32.5	Very low	46.5	Very low	194 Å²	194	137.4 Å²	137.4	91%	0.907	72%	0.721	S	S	*	*			trans	-51.9	120.9	-171.1	-57.5	178.6	133.6	0	0	113.5
276	Q	36.9	Very low	44.2	Very low	188 Å²	188	139.2 Å²	139.2	88%	0.879	73%	0.729	S	S	*	*			trans	-132.2	138.1	159.5	-71	-160.1	2.8	0	0	110.6	G274	G274-Q276 PolarHBondContact O-N 3.35Å
277	N	32	Very low	42.1	Very low	139 Å²	139	141.7 Å²	141.7	74%	0.743	75%	0.748	S	S	*	*			trans	-83.5	136	-167.2	-61.8	-78.1	0	0	0	111.9
278	L	34.9	Very low	40.1	Very low	164 Å²	164	142 Å²	142	86%	0.859	76%	0.756	S	S	*	*			trans	-113.7	79.2	161.8	-75.9	174.8	0	0	0	109.7
279	T	33.8	Very low	38.3	Very low	121 Å²	121	143.6 Å²	143.6	74%	0.742	77%	0.768	S	S	*	*			trans	-113.5	103.5	171.1	51.6	0	0	0	0	109.5
280	H	37	Very low	36.8	Very low	166 Å²	166	145.8 Å²	145.8	77%	0.769	78%	0.783	S	S	*	*			trans	-102.6	125.5	167.2	-80.5	-78	0	0	0	110.1
281	S	34	Very low	36	Very low	106 Å²	106	139.6 Å²	139.6	74%	0.741	79%	0.785	S	S	*	*			trans	50.6	119.3	149	-51.1	0	0	0	0	117.7
282	T	38.9	Very low	35.1	Very low	122 Å²	122	140.6 Å²	140.6	75%	0.748	79%	0.792	S	S	*	*			cis	-158.9	137.6	43.2	45.5	0	0	0	0	114.1
283	T	36.2	Very low	34.7	Very low	125 Å²	125	138.6 Å²	138.6	77%	0.767	79%	0.791	S	S	*	*			trans	34	116.5	146.3	57.6	0	0	0	0	119.5
284	L	32.5	Very low	34.5	Very low	150 Å²	150	140.8 Å²	140.8	79%	0.785	79%	0.793	S	S	*	*				-170.1	143.2	77.2	-93	166.6	0	0	0	113.6
285	K	34.7	Very low	34.1	Very low	167 Å²	167	147.8 Å²	147.8	73%	0.726	80%	0.8	S	S	*	*			trans	47.8	110.8	152.8	-66	-177.3	178.8	-178.3	0	119.4
286	Q	32.7	Very low	34.1	Very low	172 Å²	172	147 Å²	147	80%	0.804	80%	0.801	S	S	*	*				65.4	125.5	96.5	-69	172.6	-39.3	0	0	114
287	T	34.4	Very low	33.8	Very low	140 Å²	140	144.4 Å²	144.4	86%	0.859	79%	0.793	S	S	*	*				-151.2	163.6	50.6	-62.3	0	0	0	0	113.3
288	L	32.1	Very low	33.7	Very low	158 Å²	158	144.9 Å²	144.9	83%	0.827	80%	0.796	S	S	*	*			trans	-88.1	150.7	-172.4	-62.9	156.9	0	0	0	115.1
289	K	34.8	Very low	33.5	Very low	201 Å²	201	140.1 Å²	140.1	87%	0.874	79%	0.787	S	S	*	*			trans	155.4	151.2	135.7	-89.2	172	179.8	-177.8	0	111.9
290	S	33.5	Very low	33.3	Very low	107 Å²	107	144.1 Å²	144.1	75%	0.748	79%	0.794	S	S	*	*			cis	-174.2	129.2	-31.5	46.4	0	0	0	0	111.1
291	G	35.3	Very low	32.9	Very low	82 Å²	82	147.5 Å²	147.5	85%	0.845	80%	0.8	S	S	*	*			trans	81.3	168.6	163.8	0	0	0	0	0	118.1
292	S	30.9	Very low	32.7	Very low	119 Å²	119	147.1 Å²	147.1	83%	0.832	79%	0.794	S	S	*	*			cis	172.3	108.9	-27.7	170.6	0	0	0	0	110.2
293	S	35.8	Very low	32.4	Very low	109 Å²	109	148.2 Å²	148.2	76%	0.762	80%	0.8	S	S	*	*			trans	170.7	104.6	149	-171.8	0	0	0	0	107.5
294	Q	34.8	Very low	32.2	Very low	160 Å²	160	151.7 Å²	151.7	75%	0.748	80%	0.801	S	S	*	*				61	109.3	84.2	-67.9	-157.1	5.3	0	0	115.6
295	Y	28.6	Very low	32	Very low	214 Å²	214	150.3 Å²	150.3	84%	0.839	80%	0.803	S	S	*	*			trans	32.4	125.9	146.5	-56.7	-80.2	0	0	0	121.9
296	L	33.2	Very low	31.9	Very low	178 Å²	178	150.5 Å²	150.5	93%	0.932	81%	0.812	S	S	*	*				-161.4	166	107.7	-105.5	169.1	0	0	0	111.5
297	N	29.7	Very low	31.9	Very low	132 Å²	132	151.5 Å²	151.5	71%	0.706	81%	0.813	S	S	*	*			trans	-103.9	165.3	-169.4	-130.8	50.4	0	0	0	113.4
298	D	29.6	Very low	32.1	Very low	149 Å²	149	154.7 Å²	154.7	80%	0.797	82%	0.815	S	S	*	*			trans	44.1	111.6	158.6	-56.9	-42.5	0	0	0	119.8
299	G	31.5	Very low	32.2	Very low	65 Å²	65	152.8 Å²	152.8	67%	0.67	81%	0.806	S	S	*	*			trans	-163	121.5	170.6	0	0	0	0	0	114.1
300	F	28.3	Very low	32.3	Very low	204 Å²	204	152.3 Å²	152.3	90%	0.895	81%	0.807	S	S	*	*			trans	-57.4	142.1	174.2	-74.5	-108.8	0	0	0	112.3
301	W	29	Very low	32.5	Very low	238 Å²	238	150.6 Å²	150.6	90%	0.902	81%	0.806	S	S	*	*			trans	-126.1	96.2	163.5	-80.7	99.3	0	0	0	112.3
302	T	30	Very low	32.6	Very low	98 Å²	98	155.8 Å²	155.8	60%	0.601	81%	0.808	S	S	*	*			trans	-81.3	123.7	160.6	43.4	0	0	0	0	109.1	Y304	T302-Y304 PolarHBondContact O-N 2.83Å; T302-Y304 VanDerWaalsContact O-N 3.17Å
303	T	33.1	Very low	33.3	Very low	144 Å²	144	155 Å²	155	88%	0.883	80%	0.801	S	S	*	*			trans	-83	93	175.5	-47.8	0	0	0	0	110.5
304	Y	31.3	Very low	33.2	Very low	198 Å²	198	156.5 Å²	156.5	78%	0.776	81%	0.809	S	S	*	*			trans	-78	138.7	166.6	-88.5	-93.2	0	0	0	111.4	T302	T302-Y304 PolarHBondContact O-N 2.83Å; T302-Y304 VanDerWaalsContact O-N 3.17Å
305	S	28.3	Very low	33.2	Very low	121 Å²	121	152.7 Å²	152.7	85%	0.846	81%	0.813	S	S	*	*			trans	-77.3	126	172	-61.2	0	0	0	0	111.1
306	L	33.7	Very low	33.4	Very low	171 Å²	171	147.2 Å²	147.2	90%	0.895	81%	0.812	S	S	*	*			trans	-111.9	120.8	168.2	-81.7	168.8	0	0	0	110.9
307	K	32.6	Very low	33.5	Very low	193 Å²	193	150 Å²	150	84%	0.839	81%	0.81	S	S	*	*			trans	-83.1	155.2	161.7	-73.5	-177.6	175.4	-179.7	0	109.4
308	K	37.3	Very low	33.8	Very low	207 Å²	207	151.3 Å²	151.3	90%	0.9	82%	0.815	S	S	*	*			trans	-115	141.9	158.3	-168	174.1	-179.3	-179.2	0	108.7
309	N	35.5	Very low	34.1	Very low	118 Å²	118	149 Å²	149	63%	0.631	82%	0.817	S	S	*	*			trans	-103.6	-178.3	-173.3	-69.4	-20	0	0	0	112.6
310	E	36.4	Very low	34.3	Very low	192 Å²	192	151.7 Å²	151.7	90%	0.897	82%	0.82	S	S	*	*			trans	81	131.7	159.1	-63.2	161.9	-137.8	0	0	117.5
311	G	36.9	Very low	34.7	Very low	71 Å²	71	150.2 Å²	150.2	73%	0.732	82%	0.816	S	S	*	*			cis	-179.4	154.3	-8.8	0	0	0	0	0	116.8
312	Q	37.9	Very low	35.1	Very low	191 Å²	191	143.7 Å²	143.7	89%	0.893	80%	0.804	S	S	*	*			trans	63.4	151.3	162.1	-69.2	-70.3	-25.3	0	0	122
313	P	45.3	Very low	35.3	Very low	103 Å²	103	147.2 Å²	147.2	67%	0.669	81%	0.814	S	S	*	*			trans	-130	-178	-175.6	45.1	-29.9	0	0	0	115.7
314	C	33.4	Very low	35.5	Very low	140 Å²	140	150.8 Å²	150.8	95%	0.946	81%	0.811	S	S	*	*			trans	172.9	162	142.3	-99.6	0	0	0	0	114.1
315	G	35.1	Very low	35.8	Very low	79 Å²	79	147.6 Å²	147.6	81%	0.814	81%	0.812	S	S	*	*			trans	123.9	143.1	162.7	0	0	0	0	0	117.3
316	A	34.5	Very low	36	Very low	100 Å²	100	147.4 Å²	147.4	83%	0.826	81%	0.811	S	S	*	*			trans	-156.8	178.9	-171	0	0	0	0	0	116.6
317	R	35.1	Very low	36.2	Very low	237 Å²	237	145.3 Å²	145.3	89%	0.894	81%	0.811	S	S	*	*			trans	106.6	132.3	179.2	-65	176.3	174.2	-172.2	-2.3	113.8
318	I	35.5	Very low	36.2	Very low	158 Å²	158	144.6 Å²	144.6	81%	0.81	81%	0.811	S	S	*	*			cis	110.6	111	16.9	-69.1	165.1	0	0	0	113
319	A	35.1	Very low	36.3	Very low	102 Å²	102	144 Å²	144	84%	0.843	81%	0.813	S	S	*	*			trans	-172.7	169.2	157.8	0	0	0	0	0	111.7
320	V	36.7	Very low	36.2	Very low	120 Å²	120	145.2 Å²	145.2	73%	0.727	82%	0.82	S	S	*	*				-152.4	141.3	-121.4	135.3	0	0	0	0	117.2
321	Q	35.8	Very low	36.2	Very low	173 Å²	173	143.5 Å²	143.5	81%	0.808	82%	0.815	S	S	*	*			trans	67.4	176.2	152.3	-82.5	-169.6	19.4	0	0	122.3
322	P	37.4	Very low	36.3	Very low	101 Å²	101	145.8 Å²	145.8	66%	0.656	82%	0.82	S	S	*	*			cis	-148.3	165.5	-47.3	43.4	-26.2	0	0	0	120.3
323	Q	35.1	Very low	36	Very low	172 Å²	172	140.1 Å²	140.1	80%	0.804	81%	0.813	S	S	*	*			trans	76.6	156.2	131.2	-82.5	-73.8	-11.2	0	0	128.3
324	R	36.6	Very low	35.8	Very low	219 Å²	219	141 Å²	141	83%	0.826	82%	0.818	S	S	*	*			trans	74.4	149.1	164.2	-63	-158.2	176.3	176.8	-0.8	120.6
325	T	37.8	Very low	35.9	Very low	131 Å²	131	139.1 Å²	139.1	80%	0.804	81%	0.807	S	S	*	*			cis	-159	178.8	-11.7	16.2	0	0	0	0	112
326	S	33.5	Very low	36	Very low	118 Å²	118	142.4 Å²	142.4	83%	0.825	81%	0.811	S	S	*	*			trans	-132.2	165.7	-165.9	22.4	0	0	0	0	116.9
327	S	36.1	Very low	35.9	Very low	127 Å²	127	145.5 Å²	145.5	89%	0.888	81%	0.811	S	S	*	*			trans	-171.2	171.3	157.8	51.6	0	0	0	0	114.6
328	Q	34.4	Very low	36	Very low	178 Å²	178	139.8 Å²	139.8	83%	0.832	80%	0.802	S	S	*	*			trans	-138.4	164.6	-174.8	-72	-177.2	-23.3	0	0	113.1
329	M	38.5	Very low	36.1	Very low	193 Å²	193	140.8 Å²	140.8	95%	0.951	80%	0.801	S	S	*	*			trans	-167.7	173.2	137.3	-110	-178.9	-71.1	0	0	114.3
330	N	33	Very low	36.1	Very low	145 Å²	145	142 Å²	142	78%	0.775	80%	0.798	S	S	*	*			trans	-116.3	172.7	-167.1	-76.8	-59.5	0	0	0	114.3
331	I	37.5	Very low	35.8	Very low	156 Å²	156	139.6 Å²	139.6	80%	0.8	79%	0.791	S	S	*	*				161.7	131	120.5	-83.4	162.2	0	0	0	117.1
332	S	37.3	Very low	35.6	Very low	119 Å²	119	142.3 Å²	142.3	83%	0.832	79%	0.794	S	S	*	*			trans	64.5	158.2	153.8	74	0	0	0	0	125.4
333	G	32.8	Very low	35.3	Very low	71 Å²	71	144.3 Å²	144.3	73%	0.732	80%	0.798	S	S	*	*			trans	-108.6	-132.5	-176.1	0	0	0	0	0	114.6
334	P	40	Very low	35	Very low	121 Å²	121	140.6 Å²	140.6	79%	0.786	79%	0.791	S	S	*	*			cis	-143.9	174.1	0	42.6	-22.7	0	0	0	119
335	S	35.3	Very low	34.8	Very low	102 Å²	102	139 Å²	139	71%	0.713	79%	0.793	S	S	*	*			trans	53.2	133.4	144.5	62	0	0	0	0	126.2
336	T	38	Very low	34.4	Very low	147 Å²	147	138 Å²	138	90%	0.902	79%	0.787	S	S	*	*				-169	161.3	123.3	13.8	0	0	0	0	115.5
337	M	33.6	Very low	34.1	Very low	165 Å²	165	139.5 Å²	139.5	81%	0.813	79%	0.786	S	S	*	*			trans	-59.5	172.7	-173.3	-56.6	-102.6	73.9	0	0	116.3
338	T	37	Very low	34	Very low	117 Å²	117	140.8 Å²	140.8	72%	0.718	78%	0.782	S	S	*	*			cis	-158.8	-167.2	21.7	-23.7	0	0	0	0	108.4
339	K	37	Very low	33.8	Very low	179 Å²	179	142.5 Å²	142.5	78%	0.778	78%	0.781	S	S	*	*			cis	-161.4	117.7	-3	-154.7	165.1	-175.6	176.6	0	106.4
340	T	34.4	Very low	33.3	Very low	127 Å²	127	139.5 Å²	139.5	78%	0.779	77%	0.769	S	S	*	*				45.5	143.9	92.6	57.9	0	0	0	0	118.5
341	A	31.3	Very low	33.3	Very low	71 Å²	71	138 Å²	138	59%	0.587	77%	0.77	S	S	*	*			cis	-175	-167	-15.5	0	0	0	0	0	110.9
342	W	31.9	Very low	33	Very low	229 Å²	229	136.3 Å²	136.3	87%	0.867	77%	0.767	S	S	*	*			trans	84.6	156.6	163.1	-49.9	97.1	0	0	0	119.2
343	L	29.6	Very low	32.8	Very low	143 Å²	143	137.9 Å²	137.9	75%	0.749	77%	0.771	S	S	*	*				-172.1	178	-61.7	-107.7	167.8	0	0	0	109.1
344	S	30.1	Very low	32.6	Very low	94 Å²	94	139.5 Å²	139.5	66%	0.657	77%	0.77	S	S	*	*			trans	-88.9	143.6	-172.9	54.2	0	0	0	0	116
345	E	31.4	Very low	32.2	Very low	186 Å²	186	143.7 Å²	143.7	87%	0.869	78%	0.776	S	S	*	*			trans	-166.5	128.4	152	-100.1	152.7	-145	0	0	105.7
346	T	30.5	Very low	31.9	Very low	110 Å²	110	147.2 Å²	147.2	68%	0.675	78%	0.782	S	S	*	*			cis	87	112.7	44	64.7	0	0	0	0	116.5
347	N	25.9	Very low	31.7	Very low	149 Å²	149	145.7 Å²	145.7	80%	0.797	77%	0.774	S	S	*	*			trans	74.7	166.1	156.5	-67.9	-56.9	0	0	0	120.5
348	L	34.2	Very low	31.9	Very low	155 Å²	155	144 Å²	144	81%	0.812	78%	0.776	S	S	*	*			trans	77.1	148.6	171.9	-54.5	158	0	0	0	117.1
349	R	30.2	Very low	31.6	Very low	213 Å²	213	146.6 Å²	146.6	80%	0.804	78%	0.782	S	S	*	*			cis	-161.4	144.5	-45.8	-135.9	-177.9	-176.7	175.3	0.4	110.3
350	N	29.2	Very low	31.4	Very low	130 Å²	130	149.1 Å²	149.1	70%	0.695	79%	0.788	S	S	*	*			trans	13.4	131	159.3	-53.5	4	0	0	0	122.2
351	S	32.8	Very low	31.6	Very low	115 Å²	115	146.9 Å²	146.9	80%	0.804	78%	0.777	S	S	*	*				177.4	106	127.9	-76.1	0	0	0	0	109.5
352	T	31.3	Very low	32.4	Very low	119 Å²	119	149.2 Å²	149.2	73%	0.73	78%	0.784	S	S	*	*				81.5	95.5	54.2	65.9	0	0	0	0	116.7
353	T	33.4	Very low	32.8	Very low	152 Å²	152	146.7 Å²	146.7	93%	0.933	78%	0.776	S	S	*	*			trans	175.6	160.6	139.4	25.4	0	0	0	0	110.5
354	C	28.2	Very low	34.3	Very low	105 Å²	105	144 Å²	144	71%	0.709	77%	0.769	S	S	*	*				-177.5	125.2	-65.9	174.3	0	0	0	0	108.8
355	K	30.9	Very low	35.9	Very low	209 Å²	209	142.5 Å²	142.5	91%	0.909	76%	0.763	S	S	*	*			trans	-150.9	147	157	-71.7	-162.3	177.5	-177.9	0	109.5
356	Q	29.4	Very low	38	Very low	177 Å²	177	139.7 Å²	139.7	83%	0.827	75%	0.749	S	S	*	*			trans	-128.3	154.8	-176.5	-71.3	-168.1	-6.8	0	0	113.4
357	P	33	Very low	40	Very low	115 Å²	115	141.7 Å²	141.7	75%	0.747	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-88.6	168.8	161.8	37.1	-33.2	0	0	0	112.7
358	P	38	Very low	42.2	Very low	130 Å²	130	138.3 Å²	138.3	84%	0.844	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-85.2	160.7	-161.3	-13.5	31.4	0	0	0	117.4
359	M	30.4	Very low	44	Very low	171 Å²	171	135.1 Å²	135.1	84%	0.842	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-70.6	151.2	173.5	-74.7	-83.6	-75.4	0	0	113.8
360	Y	32.4	Very low	46.2	Very low	232 Å²	232	129.3 Å²	129.3	91%	0.91	70%	0.695	S	S	*	*			trans	-132.1	151.3	160.1	-114.2	-93.8	0	0	0	111.2
361	S	40.2	Very low	48.5	Very low	80 Å²	80	130.2 Å²	130.2	56%	0.559	69%	0.688	S	S	*	*			trans	-68.2	140.4	-158.9	-177.3	0	0	0	0	116.2	Y363	S361-Y363 VanDerWaalsContact C-N 3.26Å; S361-Y363 PolarHBondContact O-N 2.88Å; S361-Y363 PolarHBondContact OG-N 3.07Å
362	T	46.4	Very low	50.4	Low	119 Å²	119	131.7 Å²	131.7	73%	0.73	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-21.5	173.1	46.2	0	0	0	0	114	S364 A365	T362-S364 VanDerWaalsContact C-N 3.3Å; T362-S364 PolarHBondContact O-N 3.44Å; T362-A365 PolarHBondContact O-N 3.21Å
363	Y	41.6	Very low	52.5	Low	176 Å²	176	131.5 Å²	131.5	69%	0.69	67%	0.669	S	S	*	*	H	α-helix	trans	-60.3	-37	-174	-166	-99.2	0	0	0	113.1	S361 A365 H366 K367	S361-Y363 VanDerWaalsContact C-N 3.26Å; S361-Y363 PolarHBondContact O-N 2.88Å; S361-Y363 PolarHBondContact OG-N 3.07Å; Y363-A365 VanDerWaalsContact C-N 3.3Å; Y363-A365 PolarHBondContact O-N 3.07Å; Y363-H366 PolarHBondContact O-N 3.34Å; Y363-K367 PolarHBondContact O-N 2.92Å
364	S	61.5	Low	54.6	Low	87 Å²	87	129.8 Å²	129.8	61%	0.608	65%	0.65	S	S	*	*	H	α-helix	trans	-62.7	-34	-179.8	-56.5	0	0	0	0	113.2	T362 E368	T362-S364 VanDerWaalsContact C-N 3.3Å; T362-S364 PolarHBondContact O-N 3.44Å; S364-E368 PolarHBondContact O-N 3.14Å
365	A	62.4	Low	56.8	Low	63 Å²	63	128.3 Å²	128.3	52%	0.521	63%	0.632	S	S	.	*	H	α-helix	trans	-70.7	-33.7	-179.7	0	0	0	0	0	112.5	T362 Y363 N369	T362-A365 PolarHBondContact O-N 3.21Å; Y363-A365 VanDerWaalsContact C-N 3.3Å; Y363-A365 PolarHBondContact O-N 3.07Å; A365-N369 PolarHBondContact O-N 3.01Å
366	H	75.3	Confident	58.7	Low	127 Å²	127	124.8 Å²	124.8	59%	0.588	62%	0.619	S	S	*	*	H	α-helix	trans	-69	-44.5	177	-176.3	83.9	0	0	0	111.6	Y363 E368 N369 M370	Y363-H366 PolarHBondContact O-N 3.34Å; H366-E368 VanDerWaalsContact C-N 3.34Å; H366-E368 PolarHBondContact O-N 2.96Å; H366-N369 PolarHBondContact O-N 2.94Å; H366-M370 PolarHBondContact O-N 3.21Å
367	K	73.9	Confident	60.7	Low	152 Å²	152	124.5 Å²	124.5	66%	0.661	61%	0.611	S	S	*	*	H	α-helix	trans	-61.8	-39.9	178.9	-169.1	173.3	-178.2	177.2	0	112.4	Y363 M370 R371	Y363-K367 PolarHBondContact O-N 2.92Å; K367-M370 PolarHBondContact O-N 3.23Å; K367-R371 PolarHBondContact O-N 3.19Å; K367-R371 VanDerWaalsContact O-N 3.08Å
368	E	70.6	Confident	62.4	Low	78 Å²	78	126.4 Å²	126.4	36%	0.364	60%	0.603	S	S	.	*	H	α-helix	trans	-66.1	-42.6	175.4	174.8	62.4	-177.3	0	0	112.5	S364 H366 M370 R371 R372	S364-E368 PolarHBondContact O-N 3.14Å; H366-E368 VanDerWaalsContact C-N 3.34Å; H366-E368 PolarHBondContact O-N 2.96Å; E368-M370 PolarHBondContact O-N 3.06Å; E368-R371 PolarHBondContact O-N 3.46Å; E368-R372 WeakPolarHBondContact O-CG 3.43Å; E368-R372 PolarHBondContact O-N 3.33Å; E368-R372 IonicContact OE1-CZ 3.57Å; E368-R372 IonicContact OE1-NE 2.93Å; E368-R372 PolarHBondContact OE1-NE 3.43Å; E368-R372 IonicContact OE1-NH2 2.74Å; E368-R372 PolarHBondContact OE1-NH2 2.7Å
369	N	71.9	Confident	63.7	Low	88 Å²	88	124.3 Å²	124.3	47%	0.471	59%	0.588	S	S	.	*	H	α-helix	trans	-63.4	-41	175.5	-86.5	-15	0	0	0	112.5	A365 H366 R371 R372 M373	A365-N369 PolarHBondContact O-N 3.01Å; H366-N369 PolarHBondContact O-N 2.94Å; N369-R371 VanDerWaalsContact C-N 3.34Å; N369-R371 PolarHBondContact O-N 3.2Å; N369-R372 PolarHBondContact O-N 3.48Å; N369-M373 PolarHBondContact O-N 3.47Å
370	M	76.5	Confident	65.5	Low	90 Å²	90	119.9 Å²	119.9	44%	0.443	57%	0.57	S	S	.	*	H	α-helix	trans	-60.7	-42.5	173.8	-85.2	-67.5	-71.9	0	0	112	H366 K367 E368 M373 Q374	H366-M370 PolarHBondContact O-N 3.21Å; K367-M370 PolarHBondContact O-N 3.23Å; E368-M370 PolarHBondContact O-N 3.06Å; M370-M373 PolarHBondContact O-N 2.88Å; M370-Q374 PolarHBondContact O-N 3.37Å; M370-Q374 VanDerWaalsContact O-N 3.15Å
371	R	77.6	Confident	67	Low	150 Å²	150	114 Å²	114	57%	0.566	55%	0.552	S	S	*	*	H	α-helix	trans	-61.2	-47	176.2	-165	-155.1	139.8	163.4	-0.4	111.5	K367 E368 N369 M373 Q374 E375	K367-R371 PolarHBondContact O-N 3.19Å; K367-R371 VanDerWaalsContact O-N 3.08Å; E368-R371 PolarHBondContact O-N 3.46Å; N369-R371 VanDerWaalsContact C-N 3.34Å; N369-R371 PolarHBondContact O-N 3.2Å; R371-M373 VanDerWaalsContact C-N 3.31Å; R371-M373 PolarHBondContact O-N 3.17Å; R371-Q374 PolarHBondContact O-N 2.96Å; R371-E375 IonicContact CZ-OE2 2.71Å; R371-E375 VanDerWaalsContact CZ-OE2 3.23Å; R371-E375 IonicContact NE-OE2 2.75Å; R371-E375 PolarHBondContact NE-OE2 3.18Å; R371-E375 IonicContact NH2-OE2 3.59Å; R371-E375 PolarHBondContact NH2-OE2 2.76Å; R371-E375 PolarHBondContact O-N 2.89Å
372	R	72.8	Confident	67.9	Low	146 Å²	146	115.2 Å²	115.2	55%	0.551	55%	0.552	S	S	*	*	H	α-helix	trans	-60.1	-38.4	177.8	-70.4	174.5	-175.4	-135.2	-5.3	112.9	E368 N369 E375 Q376	E368-R372 WeakPolarHBondContact O-CG 3.43Å; E368-R372 PolarHBondContact O-N 3.33Å; E368-R372 IonicContact OE1-CZ 3.57Å; E368-R372 IonicContact OE1-NE 2.93Å; E368-R372 PolarHBondContact OE1-NE 3.43Å; E368-R372 IonicContact OE1-NH2 2.74Å; E368-R372 PolarHBondContact OE1-NH2 2.7Å; N369-R372 PolarHBondContact O-N 3.48Å; R372-E375 WeakPolarHBondContact O-CB 3.35Å; R372-E375 PolarHBondContact O-N 3.34Å; R372-Q376 PolarHBondContact O-N 3.45Å
373	M	76.3	Confident	67.8	Low	115 Å²	115	117.2 Å²	117.2	57%	0.567	55%	0.546	S	S	*	.	H	α-helix	trans	-67.7	-35.2	177.8	-166	-178.2	-64.7	0	0	112.3	N369 M370 R371 R377	N369-M373 PolarHBondContact O-N 3.47Å; M370-M373 PolarHBondContact O-N 2.88Å; R371-M373 VanDerWaalsContact C-N 3.31Å; R371-M373 PolarHBondContact O-N 3.17Å; M373-R377 PolarHBondContact O-N 2.75Å
374	Q	77.2	Confident	68.3	Low	116 Å²	116	113.7 Å²	113.7	54%	0.542	54%	0.536	S	S	.	.	H	α-helix	trans	-71.4	-38.8	172.5	-71.4	-178.8	-20.4	0	0	112.3	M370 R371 R377 R378	M370-Q374 PolarHBondContact O-N 3.37Å; M370-Q374 VanDerWaalsContact O-N 3.15Å; R371-Q374 PolarHBondContact O-N 2.96Å; Q374-R377 PolarHBondContact O-N 2.81Å; Q374-R378 PolarHBondContact O-N 3.42Å; Q374-R378 VanDerWaalsContact O-N 3.08Å
375	E	74.6	Confident	67.8	Low	73 Å²	73	111.9 Å²	111.9	34%	0.341	53%	0.526	S	S	.	.	H	α-helix	trans	-57.8	-48.1	173.7	-137.6	83.4	-100	0	0	110.9	R371 R372 R377 R378 T379	R371-E375 IonicContact CZ-OE2 2.71Å; R371-E375 VanDerWaalsContact CZ-OE2 3.23Å; R371-E375 IonicContact NE-OE2 2.75Å; R371-E375 PolarHBondContact NE-OE2 3.18Å; R371-E375 IonicContact NH2-OE2 3.59Å; R371-E375 PolarHBondContact NH2-OE2 2.76Å; R371-E375 PolarHBondContact O-N 2.89Å; R372-E375 WeakPolarHBondContact O-CB 3.35Å; R372-E375 PolarHBondContact O-N 3.34Å; E375-R377 PolarHBondContact O-N 2.81Å; E375-R378 PolarHBondContact O-N 2.92Å; E375-T379 PolarHBondContact O-N 3Å; E375-T379 PolarHBondContact O-OG1 3.05Å
376	Q	70.9	Confident	67.2	Low	135 Å²	135	112.3 Å²	112.3	63%	0.631	53%	0.525	S	S	*	.	H	α-helix	trans	-63	-39.6	178.4	-76.8	-175.8	-22.2	0	0	113.3	R372 T379 T380	R372-Q376 PolarHBondContact O-N 3.45Å; Q376-T379 WeakPolarHBondContact CA-OG1 3.42Å; Q376-T379 PolarHBondContact O-N 3.36Å; Q376-T379 PolarHBondContact O-OG1 3.13Å; Q376-T380 PolarHBondContact O-N 3.02Å; Q376-T380 VanDerWaalsContact O-N 3.1Å; Q376-T380 PolarHBondContact O-OG1 2.94Å
377	R	71.4	Confident	65.7	Low	172 Å²	172	110.2 Å²	110.2	65%	0.649	52%	0.518	S	S	*	.	H	α-helix	trans	-60.5	-49.1	173.6	-81.6	-166.1	175.6	-159.3	0.1	111.9	M373 Q374 E375 T379 T380 E381	M373-R377 PolarHBondContact O-N 2.75Å; Q374-R377 PolarHBondContact O-N 2.81Å; E375-R377 PolarHBondContact O-N 2.81Å; R377-T379 PolarHBondContact O-N 2.89Å; R377-T380 WeakPolarHBondContact O-CA 3.48Å; R377-T380 WeakPolarHBondContact O-CB 3.26Å; R377-T380 PolarHBondContact O-N 2.89Å; R377-E381 WeakPolarHBondContact O-CG 3.5Å; R377-E381 PolarHBondContact O-N 3.4Å
378	R	68.8	Low	64.4	Low	155 Å²	155	110.5 Å²	110.5	59%	0.585	52%	0.515	S	S	*	.	H	α-helix	trans	-55.3	-51.1	176.6	-74.2	177.3	171.5	172.4	-4.5	111.6	Q374 E375 T380 E381 D382	Q374-R378 PolarHBondContact O-N 3.42Å; Q374-R378 VanDerWaalsContact O-N 3.08Å; E375-R378 PolarHBondContact O-N 2.92Å; R378-T380 PolarHBondContact O-N 2.9Å; R378-T380 VanDerWaalsContact O-N 3.07Å; R378-E381 PolarHBondContact O-N 3.37Å; R378-D382 WeakPolarHBondContact O-CB 3.46Å; R378-D382 VanDerWaalsContact O-CG 3.25Å; R378-D382 PolarHBondContact O-N 3.22Å; R378-D382 VanDerWaalsContact O-OD2 3.13Å
379	T	65.7	Low	63.3	Low	85 Å²	85	114.7 Å²	114.7	52%	0.521	54%	0.535	S	S	.	.	H	α-helix	trans	-60.8	-23.6	177.9	55.2	0	0	0	0	114	E375 Q376 R377 W383	E375-T379 PolarHBondContact O-N 3Å; E375-T379 PolarHBondContact O-OG1 3.05Å; Q376-T379 WeakPolarHBondContact CA-OG1 3.42Å; Q376-T379 PolarHBondContact O-N 3.36Å; Q376-T379 PolarHBondContact O-OG1 3.13Å; R377-T379 PolarHBondContact O-N 2.89Å; T379-W383 PolarHBondContact O-N 3Å
380	T	68.2	Low	62	Low	78 Å²	78	116 Å²	116	48%	0.479	54%	0.541	S	S	.	.	H	α-helix	trans	-82.2	-40.2	174.8	-51.5	0	0	0	0	111.5	Q376 R377 R378 W383 Q384	Q376-T380 PolarHBondContact O-N 3.02Å; Q376-T380 VanDerWaalsContact O-N 3.1Å; Q376-T380 PolarHBondContact O-OG1 2.94Å; R377-T380 WeakPolarHBondContact O-CA 3.48Å; R377-T380 WeakPolarHBondContact O-CB 3.26Å; R377-T380 PolarHBondContact O-N 2.89Å; R378-T380 PolarHBondContact O-N 2.9Å; R378-T380 VanDerWaalsContact O-N 3.07Å; T380-W383 PolarHBondContact O-N 2.68Å; T380-Q384 WeakPolarHBondContact O-CG 3.47Å; T380-Q384 PolarHBondContact O-N 2.66Å; T380-Q384 VanDerWaalsContact O-N 3.13Å
381	E	62.2	Low	60.4	Low	110 Å²	110	118.1 Å²	118.1	51%	0.514	55%	0.55	S	S	.	.	H	α-helix	trans	-67.4	-42.2	178.1	-71.8	162.3	-167.7	0	0	111.1	R377 R378 W383 Q384 A385	R377-E381 WeakPolarHBondContact O-CG 3.5Å; R377-E381 PolarHBondContact O-N 3.4Å; R378-E381 PolarHBondContact O-N 3.37Å; E381-W383 VanDerWaalsContact C-N 3.34Å; E381-W383 PolarHBondContact O-N 2.97Å; E381-Q384 PolarHBondContact O-N 2.88Å; E381-A385 PolarHBondContact O-N 3.26Å
382	D	60.3	Low	58.5	Low	105 Å²	105	118.3 Å²	118.3	56%	0.561	56%	0.562	S	S	*	*	H	α-helix	trans	-60.7	-40.6	173.3	-65.8	-35.5	0	0	0	111.7	R378 Q384 A385 S386	R378-D382 WeakPolarHBondContact O-CB 3.46Å; R378-D382 VanDerWaalsContact O-CG 3.25Å; R378-D382 PolarHBondContact O-N 3.22Å; R378-D382 VanDerWaalsContact O-OD2 3.13Å; D382-Q384 PolarHBondContact O-N 3.43Å; D382-A385 PolarHBondContact O-N 3.27Å; D382-S386 PolarHBondContact O-N 2.69Å
383	W	45.1	Very low	56.9	Low	160 Å²	160	116.6 Å²	116.6	61%	0.606	57%	0.572	S	S	*	*	H	α-helix	trans	-64.9	-39.1	176.9	-139	87	0	0	0	112	T379 T380 E381 N387	T379-W383 PolarHBondContact O-N 3Å; T380-W383 PolarHBondContact O-N 2.68Å; E381-W383 VanDerWaalsContact C-N 3.34Å; E381-W383 PolarHBondContact O-N 2.97Å; W383-N387 WeakPolarHBondContact CZ3-ND2 3.4Å; W383-N387 PolarHBondContact O-N 2.88Å; W383-N387 VanDerWaalsContact O-N 3.17Å
384	Q	51.1	Low	54.8	Low	103 Å²	103	121.5 Å²	121.5	48%	0.481	59%	0.585	S	S	.	*	H	α-helix	trans	-72.6	-29.7	173.9	-67.6	-171.4	13	0	0	113.2	T380 E381 D382 R388	T380-Q384 WeakPolarHBondContact O-CG 3.47Å; T380-Q384 PolarHBondContact O-N 2.66Å; T380-Q384 VanDerWaalsContact O-N 3.13Å; E381-Q384 PolarHBondContact O-N 2.88Å; D382-Q384 PolarHBondContact O-N 3.43Å; Q384-R388 WeakPolarHBondContact O-CG 3.35Å; Q384-R388 PolarHBondContact O-N 2.93Å; Q384-R388 PolarHBondContact O-NE 2.89Å; Q384-R388 PolarHBondContact O-NH2 3.24Å
385	A	51.1	Low	52.6	Low	49 Å²	49	121.2 Å²	121.2	41%	0.405	60%	0.595	S	S	.	*	H	α-helix	trans	-66.4	-50.9	173.3	0	0	0	0	0	110.8	E381 D382 N387 R388 Q389	E381-A385 PolarHBondContact O-N 3.26Å; D382-A385 PolarHBondContact O-N 3.27Å; A385-N387 PolarHBondContact O-N 2.97Å; A385-R388 PolarHBondContact O-N 2.8Å; A385-R388 VanDerWaalsContact O-N 3.13Å; A385-Q389 PolarHBondContact O-N 2.85Å
386	S	49.7	Very low	50.6	Low	71 Å²	71	124.1 Å²	124.1	50%	0.497	62%	0.618	S	S	.	*	H	α-helix	trans	-57.4	-46.5	178.5	-172.3	0	0	0	0	112.4	D382 R388 Q389	D382-S386 PolarHBondContact O-N 2.69Å; S386-R388 VanDerWaalsContact C-N 3.31Å; S386-R388 PolarHBondContact O-N 2.75Å; S386-Q389 PolarHBondContact O-N 2.71Å
387	N	43.9	Very low	48.6	Very low	83 Å²	83	121.4 Å²	121.4	44%	0.444	63%	0.626	S	S	.	*	H	α-helix	trans	-66.3	-26.8	177.8	-101.7	-10.8	0	0	0	114.5	W383 A385	W383-N387 WeakPolarHBondContact CZ3-ND2 3.4Å; W383-N387 PolarHBondContact O-N 2.88Å; W383-N387 VanDerWaalsContact O-N 3.17Å; A385-N387 PolarHBondContact O-N 2.97Å
388	R	47.5	Very low	46.6	Very low	159 Å²	159	118.1 Å²	118.1	60%	0.6	63%	0.63	S	S	*	*	H	α-helix	trans	-71.6	-35.2	174.3	-82	-178.4	-76.4	-109.9	-0.4	111.8	Q384 A385 S386 L390 H391	Q384-R388 WeakPolarHBondContact O-CG 3.35Å; Q384-R388 PolarHBondContact O-N 2.93Å; Q384-R388 PolarHBondContact O-NE 2.89Å; Q384-R388 PolarHBondContact O-NH2 3.24Å; A385-R388 PolarHBondContact O-N 2.8Å; A385-R388 VanDerWaalsContact O-N 3.13Å; S386-R388 VanDerWaalsContact C-N 3.31Å; S386-R388 PolarHBondContact O-N 2.75Å; R388-L390 VanDerWaalsContact C-N 3.26Å; R388-L390 PolarHBondContact O-N 3Å; R388-H391 PolarHBondContact O-N 2.84Å
389	Q	46.2	Very low	44.9	Very low	166 Å²	166	119.9 Å²	119.9	78%	0.776	64%	0.636	S	S	*	*	H	α-helix	trans	-74.3	-13.7	-177.5	-156.8	167.9	8.7	0	0	114	A385 S386	A385-Q389 PolarHBondContact O-N 2.85Å; S386-Q389 PolarHBondContact O-N 2.71Å
390	L	44.5	Very low	43.4	Very low	115 Å²	115	119.4 Å²	119.4	60%	0.602	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-2.7	178.7	-71.5	171.7	0	0	0	114.7	R388	R388-L390 VanDerWaalsContact C-N 3.26Å; R388-L390 PolarHBondContact O-N 3Å
391	H	42.4	Very low	42.3	Very low	135 Å²	135	117.9 Å²	117.9	63%	0.625	63%	0.631	S	S	*	*	S	Bend	trans	-91	-20.1	-170.8	-111.4	-90.4	0	0	0	115.8	R388	R388-H391 PolarHBondContact O-N 2.84Å
392	D	39.3	Very low	41.8	Very low	153 Å²	153	117.2 Å²	117.2	82%	0.818	63%	0.631	S	S	*	*	S	Bend	trans	-83.3	-12.3	-176.9	-70.5	-37.9	0	0	0	114.4	R394	D392-R394 VanDerWaalsContact C-N 3.27Å; D392-R394 PolarHBondContact O-N 2.56Å
393	S	37.8	Very low	41.5	Very low	111 Å²	111	115.7 Å²	115.7	78%	0.776	62%	0.62	S	S	*	*			trans	-86.9	47.5	-176.6	-61.3	0	0	0	0	113.8
394	R	32.6	Very low	41.7	Very low	218 Å²	218	108.1 Å²	108.1	82%	0.823	59%	0.591	S	S	*	*			trans	-119.9	68.1	177.2	-75.4	-170.3	172.5	-166.7	-0.2	113	D392	D392-R394 VanDerWaalsContact C-N 3.27Å; D392-R394 PolarHBondContact O-N 2.56Å
395	S	31.6	Very low	41.7	Very low	110 Å²	110	109.7 Å²	109.7	77%	0.769	60%	0.601	S	S	*	*			trans	-150.2	159.2	165.5	-168.3	0	0	0	0	111.2
396	V	33.4	Very low	41.3	Very low	133 Å²	133	110.4 Å²	110.4	81%	0.806	60%	0.596	S	S	*	*	S	Bend	trans	65.9	124.8	-177.3	-169.7	0	0	0	0	114.7	S398	V396-S398 PolarHBondContact O-N 3.41Å
397	G	28	Very low	40.8	Very low	78 Å²	78	112.6 Å²	112.6	80%	0.804	61%	0.606	S	S	*	*			trans	-75.5	108.5	179.7	0	0	0	0	0	112.9
398	S	30	Very low	40.5	Very low	104 Å²	104	116 Å²	116	73%	0.727	62%	0.623	S	S	*	*			trans	-147.9	142.9	159.6	-83.1	0	0	0	0	110.1	V396 A400	V396-S398 PolarHBondContact O-N 3.41Å; S398-A400 PolarHBondContact O-N 3.32Å
399	R	32.4	Very low	39.8	Very low	191 Å²	191	114.5 Å²	114.5	72%	0.721	63%	0.631	S	S	*	*			trans	-79.4	66.4	-171.4	-170.2	175.6	175.9	176.3	-3.3	110.8	V401	R399-V401 PolarHBondContact O-N 2.97Å
400	A	33.9	Very low	39	Very low	75 Å²	75	114.2 Å²	114.2	62%	0.62	63%	0.634	S	S	*	*			trans	-63.9	112.9	-179.1	0	0	0	0	0	110.8	S398 L402	S398-A400 PolarHBondContact O-N 3.32Å; A400-L402 PolarHBondContact O-N 3.48Å
401	V	45.6	Very low	38.5	Very low	46 Å²	46	117.4 Å²	117.4	28%	0.279	65%	0.646	S	S	.	*			trans	-72.6	119.2	169.6	-177	0	0	0	0	107.4	R399 E403 F749 F769	R399-V401 PolarHBondContact O-N 2.97Å; V401-E403 HydrophobicContact CG1-CG 4.09Å; V401-E403 PolarHBondContact O-N 3.37Å; V401-F749 HydrophobicContact CG1-CD1 4Å; V401-F749 HydrophobicContact CG1-CE1 3.81Å; V401-F769 HydrophobicContact CG1-CE2 4.45Å; V401-F769 HydrophobicContact CG1-CZ 4.4Å; V401-F769 HydrophobicContact CG2-CZ 4.16Å
402	L	51.8	Low	38.2	Very low	96 Å²	96	116.9 Å²	116.9	50%	0.503	66%	0.655	S	S	.	*			trans	-78.7	88.5	173	-72.5	173.5	0	0	0	109.1	A400	A400-L402 PolarHBondContact O-N 3.48Å
403	E	52.8	Low	38.1	Very low	74 Å²	74	117.7 Å²	117.7	35%	0.346	66%	0.657	S	S	.	*	P	Polyproline II helix	trans	-74.9	145.8	172	-58.9	-152.5	150.4	0	0	111.6	V401 M405 H748	V401-E403 HydrophobicContact CG1-CG 4.09Å; V401-E403 PolarHBondContact O-N 3.37Å; E403-M405 PolarHBondContact O-N 3.28Å; E403-H748 WeakPolarHBondContact CA-O 3.25Å
404	E	50.7	Low	37.9	Very low	0 Å²	0	115.7 Å²	115.7	0%	0	65%	0.654	C	S	.	*	P	Polyproline II helix	trans	-76.7	116.9	173.5	-170	-174.4	-159.5	0	0	110	R694 R712 S714 N715	E404-R694 PolarHBondContact O-NE 2.93Å; E404-R694 PolarHBondContact O-NH2 3.03Å; E404-R712 IonicContact OE1-NH2 3.48Å; E404-R712 PolarHBondContact OE1-NH2 2.83Å; E404-R712 VanDerWaalsContact OE1-NH2 3.12Å; E404-R712 IonicContact OE2-CZ 3.68Å; E404-R712 IonicContact OE2-NE 3.18Å; E404-R712 PolarHBondContact OE2-NE 2.92Å; E404-R712 IonicContact OE2-NH2 3.84Å; E404-R712 PolarHBondContact OE2-NH2 3.39Å; E404-S714 WeakPolarHBondContact OE1-CA 3.39Å; E404-S714 WeakPolarHBondContact OE1-CB 3.26Å; E404-S714 PolarHBondContact OE1-OG 2.99Å; E404-N715 PolarHBondContact OE1-N 3.22Å
405	M	50.7	Low	38.1	Very low	137 Å²	137	117.8 Å²	117.8	68%	0.675	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-102.4	139.2	167.4	-58.9	-178.5	78.3	0	0	109.1	E403 T716	E403-M405 PolarHBondContact O-N 3.28Å; M405-T716 WeakPolarHBondContact O-CG2 3.41Å; M405-T716 PolarHBondContact O-OG1 3.06Å
406	E	43.2	Very low	38.2	Very low	64 Å²	64	115.8 Å²	115.8	30%	0.299	66%	0.658	S	S	.	*	P	Polyproline II helix	trans	-102.2	120.3	175.2	-69.9	-172.6	138.1	0	0	110.5	R694 R712 N715	E406-R694 HydrophobicContact CG-CB 4.42Å; E406-R694 WeakPolarHBondContact OE2-CB 3.5Å; E406-R712 VanDerWaalsContact CD-NH2 3.35Å; E406-R712 IonicContact OE1-CZ 2.71Å; E406-R712 VanDerWaalsContact OE1-CZ 3.24Å; E406-R712 IonicContact OE1-NH1 2.64Å; E406-R712 PolarHBondContact OE1-NH1 2.89Å; E406-R712 IonicContact OE1-NH2 2.7Å; E406-R712 PolarHBondContact OE1-NH2 3.48Å; E406-R712 IonicContact OE2-NH1 3.68Å; E406-N715 PolarHBondContact OE1-ND2 3.32Å
407	T	38.5	Very low	38.4	Very low	116 Å²	116	115.6 Å²	115.6	71%	0.712	66%	0.657	S	S	*	*			trans	-99.4	115.8	176.1	18.9	0	0	0	0	111.1	T409	T407-T409 PolarHBondContact O-N 3.22Å
408	I	36.8	Very low	39	Very low	156 Å²	156	120.3 Å²	120.3	80%	0.8	66%	0.658	S	S	*	*			trans	-77	120.8	175.5	-58	174.8	0	0	0	109.5	L410	I408-L410 HydrophobicContact CG2-CD2 4.28Å; I408-L410 HydrophobicContact CG2-CG 4.45Å
409	T	32.8	Very low	39.2	Very low	126 Å²	126	122.2 Å²	122.2	77%	0.773	66%	0.66	S	S	*	*			trans	-100	101.3	175.2	46.2	0	0	0	0	111.2	T407	T407-T409 PolarHBondContact O-N 3.22Å
410	L	31.2	Very low	39.6	Very low	161 Å²	161	121.5 Å²	121.5	84%	0.843	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-79.6	119.6	171.9	-64.4	177.6	0	0	0	110.1	I408	I408-L410 HydrophobicContact CG2-CD2 4.28Å; I408-L410 HydrophobicContact CG2-CG 4.45Å
411	Q	33.2	Very low	39.7	Very low	181 Å²	181	127 Å²	127	85%	0.846	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-81.2	136.6	170.1	-68.3	-161.3	-8.6	0	0	110.9
412	P	35.7	Very low	39.4	Very low	125 Å²	125	129.9 Å²	129.9	81%	0.812	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-73.1	133.1	-178.7	29	-34.2	0	0	0	111.8
413	I	37.7	Very low	38.9	Very low	170 Å²	170	131.3 Å²	131.3	87%	0.872	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-69.8	143.3	171.6	-61.1	175.6	0	0	0	109.2
414	G	34.1	Very low	38.3	Very low	69 Å²	69	134.6 Å²	134.6	71%	0.711	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-62	148.9	-173	0	0	0	0	0	114.6
415	R	35.2	Very low	37.4	Very low	262 Å²	262	138.6 Å²	138.6	99%	0.989	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-61.8	140	-177.3	-67.7	-178.9	175.5	-176.9	-3.3	112.9
416	G	34.8	Very low	36.6	Very low	67 Å²	67	137.4 Å²	137.4	69%	0.691	79%	0.789	S	S	*	*			trans	-158.2	121.7	164.4	0	0	0	0	0	112.6
417	V	37.3	Very low	36	Very low	129 Å²	129	141.8 Å²	141.8	78%	0.782	81%	0.813	S	S	*	*	S	Bend	trans	75.3	122	154.1	-174.3	0	0	0	0	119.3
418	H	40.2	Very low	35.7	Very low	178 Å²	178	140.1 Å²	140.1	82%	0.824	81%	0.811	S	S	*	*			trans	76.1	136.7	158.7	-69.5	-36.9	0	0	0	122.7
419	D	35.1	Very low	35.7	Very low	144 Å²	144	143.2 Å²	143.2	77%	0.77	81%	0.812	S	S	*	*			trans	-100.3	139	-174.7	-38.2	-100.8	0	0	0	110.7
420	L	40.3	Very low	35.7	Very low	176 Å²	176	142.3 Å²	142.3	92%	0.921	81%	0.811	S	S	*	*			trans	-145.6	139.1	149.1	-76.8	-176.6	0	0	0	107.7
421	E	36.6	Very low	36	Very low	189 Å²	189	140.5 Å²	140.5	88%	0.883	81%	0.806	S	S	*	*			trans	-75.1	155.8	-176.6	-89.7	-162.5	117.1	0	0	113.9
422	P	39.7	Very low	36	Very low	108 Å²	108	142.7 Å²	142.7	70%	0.701	81%	0.807	S	S	*	*			trans	-82.6	176.8	178.3	37	-37.3	0	0	0	112.3
423	P	40.4	Very low	36.1	Very low	125 Å²	125	140.5 Å²	140.5	81%	0.812	80%	0.8	S	S	*	*				-132.2	157.4	117.3	37.2	-31.1	0	0	0	114.7
424	T	39.2	Very low	36.2	Very low	144 Å²	144	137.6 Å²	137.6	88%	0.883	79%	0.79	S	S	*	*			trans	-67	137.7	173.8	49.4	0	0	0	0	113
425	G	33.3	Very low	36.8	Very low	84 Å²	84	140.4 Å²	140.4	87%	0.866	79%	0.793	S	S	*	*			trans	-161	124.3	167	0	0	0	0	0	111.1
426	S	32.9	Very low	37	Very low	111 Å²	111	133 Å²	133	78%	0.776	78%	0.78	S	S	*	*			trans	-129.8	169.8	-178	-174.8	0	0	0	0	110.4
427	I	31.4	Very low	37.2	Very low	156 Å²	156	135.5 Å²	135.5	80%	0.8	79%	0.786	S	S	*	*			trans	65.6	149	-177.2	-19.7	179.8	0	0	0	109.5
428	A	32.4	Very low	37.1	Very low	81 Å²	81	132.8 Å²	132.8	67%	0.669	78%	0.784	S	S	*	*			cis	-171.7	-178.2	29.3	0	0	0	0	0	108.9
429	R	35.8	Very low	37	Very low	222 Å²	222	132.5 Å²	132.5	84%	0.838	79%	0.788	S	S	*	*			cis	-173.6	164.9	-4.9	-135.3	169.9	-166.8	167.9	2.5	110.7
430	S	33.8	Very low	37.1	Very low	106 Å²	106	130.9 Å²	130.9	74%	0.741	79%	0.788	S	S	*	*			trans	68.6	170.9	148.5	-133.2	0	0	0	0	115.8
431	V	37.8	Very low	36.9	Very low	123 Å²	123	128.4 Å²	128.4	75%	0.745	78%	0.78	S	S	*	*			cis	-136.1	136.1	12.7	-177.9	0	0	0	0	108
432	R	32.1	Very low	36.7	Very low	227 Å²	227	128.7 Å²	128.7	86%	0.857	78%	0.779	S	S	*	*				-167.5	160.8	73.7	-138.9	148.1	-170	-175.9	4.1	107.4
433	A	37.4	Very low	37	Very low	80 Å²	80	128.5 Å²	128.5	66%	0.661	78%	0.778	S	S	*	*			cis	-151	147.5	30.3	0	0	0	0	0	116.4
434	T	41	Very low	36.9	Very low	108 Å²	108	127.9 Å²	127.9	66%	0.663	77%	0.772	S	S	*	*			trans	42	105.8	142.5	55.4	0	0	0	0	121.6
435	T	45.3	Very low	36.9	Very low	128 Å²	128	128.4 Å²	128.4	79%	0.785	77%	0.768	S	S	*	*				66.8	150	127.1	55.5	0	0	0	0	121.9
436	P	40.1	Very low	37.3	Very low	108 Å²	108	131.1 Å²	131.1	70%	0.701	76%	0.762	S	S	*	*			cis	-137.4	167.6	-25.9	37.5	-19.9	0	0	0	115.8
437	S	38.9	Very low	37.5	Very low	118 Å²	118	132.5 Å²	132.5	83%	0.825	76%	0.761	S	S	*	*			trans	44.2	127.8	147.9	59.5	0	0	0	0	122.4
438	G	35.2	Very low	37.8	Very low	72 Å²	72	135.4 Å²	135.4	74%	0.742	76%	0.762	S	S	*	*			trans	148.6	71	147.4	0	0	0	0	0	120.5
439	L	38.7	Very low	38.5	Very low	172 Å²	172	136.6 Å²	136.6	90%	0.901	76%	0.763	S	S	*	*			trans	35.7	139.5	141.4	-67	163.4	0	0	0	123.5
440	S	36.3	Very low	38.8	Very low	111 Å²	111	133.9 Å²	133.9	78%	0.776	76%	0.759	S	S	*	*			trans	76.5	143.8	139.8	-168.3	0	0	0	0	119.6
441	T	37.4	Very low	39.1	Very low	124 Å²	124	133.3 Å²	133.3	76%	0.761	76%	0.755	S	S	*	*			cis	-162.2	160.4	-19.2	-80.2	0	0	0	0	108.9
442	F	31.9	Very low	39.2	Very low	195 Å²	195	133.1 Å²	133.1	86%	0.855	76%	0.759	S	S	*	*			trans	-84.8	-157.6	174.7	-70.3	-92.8	0	0	0	112
443	P	46.3	Very low	39.5	Very low	104 Å²	104	127.5 Å²	127.5	68%	0.675	76%	0.762	S	S	*	*			cis	-136.1	-166.7	-19.5	26.4	-0.8	0	0	0	115.5
444	T	38.6	Very low	39.7	Very low	112 Å²	112	127.5 Å²	127.5	69%	0.687	77%	0.769	S	S	*	*			trans	93	127.2	133.7	27.4	0	0	0	0	124.5
445	L	38	Very low	39.4	Very low	154 Å²	154	134 Å²	134	81%	0.806	78%	0.782	S	S	*	*			trans	69.8	156	148.4	-56.9	170.1	0	0	0	117.8
446	L	41.4	Very low	39.2	Very low	141 Å²	141	136.2 Å²	136.2	74%	0.738	79%	0.787	S	S	*	*			cis	-135.3	-166.7	6.3	-152.6	57.6	0	0	0	107.4
447	N	38.2	Very low	39	Very low	141 Å²	141	137.5 Å²	137.5	75%	0.754	79%	0.788	S	S	*	*			cis	-158.1	-172.3	5.4	-159.8	-0.7	0	0	0	111.4
448	R	37.7	Very low	38.7	Very low	217 Å²	217	139 Å²	139	82%	0.819	79%	0.786	S	S	*	*			trans	-125.8	-167.7	170.5	-139	-174.7	178.5	168.2	-0.7	109.8
449	P	47.1	Very low	38.8	Very low	105 Å²	105	140.6 Å²	140.6	68%	0.682	79%	0.785	S	S	*	*			cis	-129.3	-141	42.7	30.1	-3	0	0	0	111.5
450	H	42.6	Very low	38.8	Very low	166 Å²	166	138.8 Å²	138.8	77%	0.769	78%	0.781	S	S	*	*			cis	-150.6	-117.1	-0	-153.6	-37.5	0	0	0	114.5
451	S	40.1	Very low	39	Very low	93 Å²	93	138.7 Å²	138.7	65%	0.65	78%	0.78	S	S	*	*			trans	-157.6	179.4	-163.2	-48.3	0	0	0	0	109.7
452	S	39.8	Very low	39.1	Very low	119 Å²	119	136.1 Å²	136.1	83%	0.832	78%	0.779	S	S	*	*			cis	-154.6	-177.7	17.2	-50.2	0	0	0	0	111.4
453	A	38.1	Very low	39.4	Very low	110 Å²	110	134.3 Å²	134.3	91%	0.909	78%	0.776	S	S	*	*			trans	-98	165.3	-178.6	0	0	0	0	0	115.4
454	G	41.1	Very low	39	Very low	80 Å²	80	137.3 Å²	137.3	83%	0.825	78%	0.779	S	S	*	*			trans	-167.6	148.2	169.9	0	0	0	0	0	113
455	R	34.5	Very low	38.9	Very low	245 Å²	245	142.1 Å²	142.1	93%	0.925	78%	0.784	S	S	*	*			trans	-112.4	156.9	173.3	-76.2	175.3	163.4	148.9	-7.9	109.7
456	I	41.1	Very low	38.6	Very low	174 Å²	174	139.3 Å²	139.3	89%	0.892	78%	0.778	S	S	*	*			trans	-179.2	169.4	136.3	-95.8	156.3	0	0	0	110.7
457	D	35.9	Very low	38.4	Very low	134 Å²	134	140.1 Å²	140.1	72%	0.717	78%	0.781	S	S	*	*			trans	-93.6	167.1	-156.4	-90.7	-66.3	0	0	0	118.4
458	L	33.7	Very low	38.2	Very low	151 Å²	151	138.4 Å²	138.4	79%	0.791	78%	0.78	S	S	*	*			trans	36.8	129.1	142.4	-59.2	164.1	0	0	0	119.2
459	S	36.3	Very low	38.1	Very low	104 Å²	104	136.5 Å²	136.5	73%	0.727	78%	0.778	S	S	*	*				167	163.5	75.8	49.9	0	0	0	0	112.9
460	V	39.4	Very low	37.5	Very low	135 Å²	135	137.9 Å²	137.9	82%	0.818	78%	0.78	S	S	*	*			trans	58.1	131.6	142.1	163.5	0	0	0	0	119.6
461	S	39.6	Very low	37	Very low	108 Å²	108	139.4 Å²	139.4	76%	0.755	78%	0.78	S	S	*	*			cis	-172.1	155.3	-6.8	56.3	0	0	0	0	113.8
462	G	39.4	Very low	36.7	Very low	71 Å²	71	145 Å²	145	73%	0.732	79%	0.788	S	S	*	*			trans	88	156.6	153.6	0	0	0	0	0	117.2
463	I	39.6	Very low	36.4	Very low	156 Å²	156	144.8 Å²	144.8	80%	0.8	79%	0.787	S	S	*	*			cis	-140.4	141.6	-2.1	-71.5	-173	0	0	0	110.8
464	K	36.8	Very low	36.5	Very low	168 Å²	168	144.6 Å²	144.6	73%	0.73	78%	0.776	S	S	*	*			trans	-2.2	149.9	149.1	-59.5	160.5	-178.5	169.6	0	117.6
465	R	36	Very low	36.2	Very low	212 Å²	212	148.1 Å²	148.1	80%	0.8	77%	0.774	S	S	*	*			cis	-162	170.7	14.9	-132.8	175.7	-65.1	-152.8	6.9	111.9
466	S	31.4	Very low	35.9	Very low	96 Å²	96	147.5 Å²	147.5	67%	0.671	77%	0.772	S	S	*	*			trans	-66.2	158.6	168.3	48	0	0	0	0	114.3
467	I	38.1	Very low	35.7	Very low	158 Å²	158	147.7 Å²	147.7	81%	0.81	77%	0.771	S	S	*	*				175.1	138.7	122	-92.2	159.3	0	0	0	113.2
468	S	34.4	Very low	35.5	Very low	104 Å²	104	147.8 Å²	147.8	73%	0.727	77%	0.767	S	S	*	*			trans	45.2	153.1	155.6	-153.2	0	0	0	0	124
469	K	34.5	Very low	35.5	Very low	177 Å²	177	151.1 Å²	151.1	77%	0.77	77%	0.77	S	S	*	*			trans	-63.7	156.5	153.9	-47.7	164.4	-177.3	171.5	0	109.9
470	D	36.1	Very low	35.6	Very low	135 Å²	135	151.3 Å²	151.3	72%	0.722	77%	0.771	S	S	*	*				-173.1	-175.9	96.6	-102.7	-32.8	0	0	0	114.6
471	Y	30.9	Very low	35.2	Very low	198 Å²	198	150 Å²	150	78%	0.776	76%	0.764	S	S	*	*			trans	-62.7	175.3	-166.8	-82	-106.1	0	0	0	118.4
472	Y	34.7	Very low	35.4	Very low	211 Å²	211	152.9 Å²	152.9	83%	0.827	77%	0.769	S	S	*	*			trans	90.7	104.2	158.7	-76.7	-79.4	0	0	0	119.5
473	S	33.9	Very low	35.2	Very low	114 Å²	114	155 Å²	155	80%	0.797	76%	0.763	S	S	*	*			trans	-78.9	142.1	156.4	56	0	0	0	0	112.3
474	P	39.8	Very low	35.2	Very low	106 Å²	106	154.6 Å²	154.6	69%	0.688	76%	0.761	S	S	*	*			trans	-136.8	138.7	151.7	27	-7.6	0	0	0	115.9
475	I	33.7	Very low	35.5	Very low	153 Å²	153	152 Å²	152	79%	0.785	76%	0.762	S	S	*	*			trans	60.4	94.1	132.3	-52	173.2	0	0	0	119.1
476	R	29.7	Very low	35.3	Very low	233 Å²	233	152.3 Å²	152.3	88%	0.879	76%	0.764	S	S	*	*				39.2	100.3	113.7	-171.6	-161.1	-160.6	177	7.5	119.2
477	M	35.1	Very low	35.6	Very low	178 Å²	178	152.3 Å²	152.3	88%	0.877	76%	0.764	S	S	*	*			trans	-160.5	162	148.9	-81.2	-144	-170.3	0	0	109.1
478	Q	33.6	Very low	35.6	Very low	135 Å²	135	153.4 Å²	153.4	63%	0.631	77%	0.766	S	S	*	*			cis	-168.1	152	-33.5	-162.4	-163.3	50.5	0	0	106.8
479	R	32.5	Very low	35.6	Very low	222 Å²	222	154 Å²	154	84%	0.838	77%	0.765	S	S	*	*			trans	70.7	162.9	173.3	-51.1	170.5	-178.7	-107.6	-2	114
480	S	38.1	Very low	35.6	Very low	108 Å²	108	150.4 Å²	150.4	76%	0.755	76%	0.758	S	S	*	*			cis	-137.8	148.9	6.5	51.9	0	0	0	0	113.4
481	T	32.4	Very low	35.5	Very low	108 Å²	108	152.5 Å²	152.5	66%	0.663	76%	0.764	S	S	*	*			trans	-70.1	149.5	171	-39.8	0	0	0	0	112.4	D483	T481-D483 VanDerWaalsContact CG2-OD2 3.23Å; T481-D483 WeakPolarHBondContact CG2-OD2 3.37Å
482	I	42.4	Very low	35.7	Very low	168 Å²	168	147.4 Å²	147.4	86%	0.862	76%	0.763	S	S	*	*			trans	-135.9	142.5	153.9	-62.4	-176.1	0	0	0	107.1
483	D	34.6	Very low	35.7	Very low	116 Å²	116	144.8 Å²	144.8	62%	0.62	76%	0.762	S	S	*	*			trans	-131	157.7	-161.8	-82.6	-63.6	0	0	0	113.5	T481	T481-D483 VanDerWaalsContact CG2-OD2 3.23Å; T481-D483 WeakPolarHBondContact CG2-OD2 3.37Å
484	I	40.4	Very low	35.8	Very low	146 Å²	146	146.7 Å²	146.7	75%	0.749	76%	0.762	S	S	*	*			trans	69	161.2	148.2	-74.7	164.8	0	0	0	116.1
485	P	43	Very low	35.5	Very low	115 Å²	115	146.7 Å²	146.7	75%	0.747	77%	0.765	S	S	*	*			cis	-112.6	175.7	-1.9	21.4	1.7	0	0	0	114.1
486	Y	32.7	Very low	35.9	Very low	217 Å²	217	145.2 Å²	145.2	85%	0.851	77%	0.765	S	S	*	*			cis	90.2	87.4	3.4	-136.5	-65.8	0	0	0	120
487	S	37.9	Very low	36.9	Very low	97 Å²	97	139.3 Å²	139.3	68%	0.678	76%	0.756	S	S	*	*			trans	-165	126	158.8	58.8	0	0	0	0	110.9
488	Q	37.7	Very low	37.1	Very low	181 Å²	181	136.7 Å²	136.7	85%	0.846	75%	0.745	S	S	*	*				68.6	157.9	101.4	-65.7	-170.5	32.3	0	0	114.9
489	T	34.3	Very low	37.5	Very low	115 Å²	115	137 Å²	137	71%	0.706	75%	0.751	S	S	*	*			cis	-176.4	149	-10.6	-91.5	0	0	0	0	106.4
490	T	35	Very low	37.8	Very low	103 Å²	103	136.2 Å²	136.2	63%	0.632	75%	0.748	S	S	*	*			cis	-172.6	151.4	-16.2	-83.1	0	0	0	0	109.9
491	Q	34.1	Very low	37.8	Very low	179 Å²	179	141.3 Å²	141.3	84%	0.836	75%	0.75	S	S	*	*			trans	66.7	116.5	162	-79.5	169.4	29.1	0	0	123.8
492	A	33.7	Very low	37.9	Very low	91 Å²	91	142.9 Å²	142.9	75%	0.752	75%	0.754	S	S	*	*				83.3	161.5	114.9	0	0	0	0	0	124.6
493	L	34.4	Very low	37.7	Very low	156 Å²	156	141.1 Å²	141.1	82%	0.817	75%	0.751	S	S	*	*			trans	96.2	120.8	157.2	-68	173.6	0	0	0	122.5
494	I	36.7	Very low	37.7	Very low	153 Å²	153	138.6 Å²	138.6	79%	0.785	75%	0.753	S	S	*	*			trans	87.4	123.4	144	-63.3	161.4	0	0	0	120.1
495	S	34	Very low	37.4	Very low	107 Å²	107	141.5 Å²	141.5	75%	0.748	76%	0.76	S	S	*	*			trans	-109.9	169.3	168.4	-42.4	0	0	0	0	110.6
496	P	41.3	Very low	37.1	Very low	122 Å²	122	140 Å²	140	79%	0.792	76%	0.758	S	S	*	*				-147.2	176.1	119.3	33.7	-13.6	0	0	0	114.5
497	P	50.2	Low	37	Very low	108 Å²	108	137 Å²	137	70%	0.701	76%	0.756	S	S	*	*			trans	-147.6	-154.6	-133.5	38.6	-12.9	0	0	0	117.8
498	I	40.6	Very low	36.9	Very low	123 Å²	123	140.4 Å²	140.4	63%	0.631	77%	0.766	S	S	*	*			trans	86.7	109.5	150.5	-72.5	164.8	0	0	0	121.3
499	N	41	Very low	36.6	Very low	142 Å²	142	134.8 Å²	134.8	76%	0.759	76%	0.756	S	S	*	*				179.8	122.4	107.8	-95.6	-50.3	0	0	0	109
500	R	39.8	Very low	36.6	Very low	206 Å²	206	138.3 Å²	138.3	78%	0.777	77%	0.765	S	S	*	*				66	132.4	58.6	-70.7	-169.6	171.7	-165	-1.2	112.9
501	R	37.4	Very low	36.5	Very low	214 Å²	214	139 Å²	139	81%	0.808	77%	0.773	S	S	*	*			cis	-136.1	145.4	22.7	-94.7	179.9	160.5	164.6	-5.6	111.6
502	L	35.5	Very low	36.5	Very low	142 Å²	142	135.3 Å²	135.3	74%	0.743	77%	0.768	S	S	*	*				55.8	131.7	85.8	-72.6	157	0	0	0	113.7
503	V	37.5	Very low	36.4	Very low	130 Å²	130	142.3 Å²	142.3	79%	0.788	78%	0.775	S	S	*	*			cis	-156.4	174.7	6.8	-94.1	0	0	0	0	109.3
504	G	34.7	Very low	36.2	Very low	64 Å²	64	143.1 Å²	143.1	66%	0.66	78%	0.778	S	S	*	*			cis	153.9	147	-8	0	0	0	0	0	115.3
505	F	35.1	Very low	36	Very low	206 Å²	206	140.4 Å²	140.4	90%	0.904	77%	0.773	S	S	*	*			trans	64.5	116.5	160.3	-64.2	-75.2	0	0	0	125.3
506	A	35.7	Very low	35.9	Very low	84 Å²	84	140 Å²	140	69%	0.694	77%	0.77	S	S	*	*				80.6	110.6	122.2	0	0	0	0	0	124.8
507	N	31.5	Very low	35.7	Very low	153 Å²	153	141.5 Å²	141.5	82%	0.818	77%	0.77	S	S	*	*				66.6	150.7	129	-84.1	-9.4	0	0	0	124.9
508	L	34.7	Very low	34.7	Very low	169 Å²	169	142.3 Å²	142.3	89%	0.885	77%	0.768	S	S	*	*			trans	71.5	99.1	155.3	-72.4	157.2	0	0	0	120.7
509	G	31.4	Very low	34.4	Very low	63 Å²	63	145.5 Å²	145.5	65%	0.649	78%	0.777	S	S	*	*				105.7	135	111.4	0	0	0	0	0	121.4
510	H	35	Very low	34	Very low	190 Å²	190	143.6 Å²	143.6	88%	0.88	78%	0.775	S	S	*	*			trans	72.7	93.8	145	-68.6	47.8	0	0	0	121.1
511	S	32.4	Very low	33.6	Very low	116 Å²	116	140.1 Å²	140.1	81%	0.811	78%	0.776	S	S	*	*				54	159.6	115.8	-151.3	0	0	0	0	123.5
512	S	33.7	Very low	33.5	Very low	103 Å²	103	137.5 Å²	137.5	72%	0.72	78%	0.778	S	S	*	*			trans	68.8	114.4	177.1	66.7	0	0	0	0	116
513	R	31.8	Very low	33.2	Very low	238 Å²	238	138.3 Å²	138.3	90%	0.898	78%	0.782	S	S	*	*				67.3	107.7	71.7	-79.1	-171.8	173.3	-175.5	-0.2	114.2
514	I	30.8	Very low	33.4	Very low	173 Å²	173	137.5 Å²	137.5	89%	0.887	78%	0.779	S	S	*	*				-175.3	172.4	116.8	-95.4	159.2	0	0	0	109.5
515	S	31.2	Very low	33.4	Very low	96 Å²	96	140.7 Å²	140.7	67%	0.671	79%	0.786	S	S	*	*			trans	-121.9	175.3	-155.9	55.9	0	0	0	0	115.3
516	S	33.4	Very low	33.2	Very low	99 Å²	99	137.3 Å²	137.3	69%	0.692	78%	0.776	S	S	*	*			trans	88.7	167	146.4	80.9	0	0	0	0	119.7
517	I	35.9	Very low	33.2	Very low	153 Å²	153	141.6 Å²	141.6	79%	0.785	78%	0.782	S	S	*	*			trans	78.4	137.7	173.7	-58.2	168.7	0	0	0	115.3
518	N	30.5	Very low	33.2	Very low	125 Å²	125	142 Å²	142	67%	0.668	78%	0.778	S	S	*	*			cis	-174.2	146.1	-39.3	-131.3	-40.2	0	0	0	109
519	K	32.7	Very low	33.3	Very low	189 Å²	189	141.2 Å²	141.2	82%	0.822	78%	0.775	S	S	*	*			trans	62.8	166.9	163.2	-59.8	176.3	-177.8	179.2	0	114.8
520	S	33.1	Very low	33.6	Very low	102 Å²	102	143.2 Å²	143.2	71%	0.713	78%	0.777	S	S	*	*			cis	-156.4	150.3	-10.1	22.7	0	0	0	0	110.9
521	V	31.4	Very low	33.6	Very low	133 Å²	133	140.3 Å²	140.3	81%	0.806	77%	0.766	S	S	*	*			trans	32.3	121.3	139.2	-173.4	0	0	0	0	119
522	L	35.6	Very low	33.8	Very low	160 Å²	160	142.3 Å²	142.3	84%	0.838	77%	0.766	S	S	*	*				-170.2	143.4	121.2	-102.4	167.2	0	0	0	112.1
523	L	29.4	Very low	33.8	Very low	158 Å²	158	147 Å²	147	83%	0.827	77%	0.769	S	S	*	*			trans	-109	149.6	162.7	-111.6	78.8	0	0	0	108.6
524	P	41.8	Very low	34.1	Very low	114 Å²	114	139.2 Å²	139.2	74%	0.74	76%	0.764	S	S	*	*			trans	-136.1	173.5	132.9	38.2	-27.7	0	0	0	111.5
525	T	33.9	Very low	34.3	Very low	130 Å²	130	136.8 Å²	136.8	80%	0.798	75%	0.752	S	S	*	*			cis	-164.1	154.5	-33	-84.3	0	0	0	0	105.8
526	I	31.3	Very low	34.7	Very low	135 Å²	135	140.6 Å²	140.6	69%	0.692	76%	0.759	S	S	*	*			trans	-69.6	144.8	-179.1	-62.8	162	0	0	0	111.3
527	H	35.8	Very low	34.9	Very low	175 Å²	175	142 Å²	142	81%	0.81	76%	0.757	S	S	*	*			trans	-127.6	141.2	154.5	-114.2	-96	0	0	0	110.4
528	H	32.7	Very low	35	Very low	160 Å²	160	140.4 Å²	140.4	74%	0.741	76%	0.755	S	S	*	*			trans	-120.6	142	175.3	-94.9	-79.3	0	0	0	108.6
529	D	35.4	Very low	35.1	Very low	153 Å²	153	140.7 Å²	140.7	82%	0.818	76%	0.756	S	S	*	*			trans	-130.7	131	164.6	-74.8	-55.2	0	0	0	109.2
530	P	38.5	Very low	35.2	Very low	106 Å²	106	137.4 Å²	137.4	69%	0.688	75%	0.748	S	S	*	*			trans	-132.5	179	-176.6	44.6	-32	0	0	0	115.6
531	I	34.3	Very low	35.3	Very low	128 Å²	128	140.2 Å²	140.2	66%	0.656	75%	0.75	S	S	*	*			trans	81.8	124.9	161	-55.6	164.9	0	0	0	118.3	Y533	I531-Y533 HydrophobicContact CG2-CD2 3.48Å; I531-Y533 VanDerWaalsContact CG2-CD2 3.48Å; I531-Y533 HydrophobicContact CG2-CE2 3.66Å
532	I	36.2	Very low	35.3	Very low	159 Å²	159	139.2 Å²	139.2	82%	0.815	75%	0.748	S	S	*	*			trans	176.7	98.1	131.1	-88.9	155.5	0	0	0	105.7
533	Y	34	Very low	35.3	Very low	200 Å²	200	137.3 Å²	137.3	78%	0.784	75%	0.746	S	S	*	*				76.3	121.6	83.1	-90.6	-66.1	0	0	0	116.2	I531	I531-Y533 HydrophobicContact CG2-CD2 3.48Å; I531-Y533 VanDerWaalsContact CG2-CD2 3.48Å; I531-Y533 HydrophobicContact CG2-CE2 3.66Å
534	G	39.1	Very low	35.4	Very low	76 Å²	76	138.1 Å²	138.1	78%	0.784	75%	0.745	S	S	*	*			trans	170.9	107.1	172.7	0	0	0	0	0	111.6
535	N	35	Very low	34.9	Very low	122 Å²	122	139.7 Å²	139.7	65%	0.652	75%	0.747	S	S	*	*			trans	-104.7	157.6	-171.5	-71.1	-28.1	0	0	0	113.4
536	H	38.9	Very low	34.9	Very low	176 Å²	176	140.4 Å²	140.4	82%	0.815	74%	0.744	S	S	*	*			trans	-178.2	106.4	132.3	-95.2	-69.2	0	0	0	107.4
537	I	37.8	Very low	34.9	Very low	127 Å²	127	139.9 Å²	139.9	65%	0.651	74%	0.743	S	S	*	*				54.3	121.9	79.9	-41.3	163.3	0	0	0	110.2
538	V	37.3	Very low	34.7	Very low	120 Å²	120	139 Å²	139	73%	0.727	74%	0.739	S	S	*	*				-159.3	147.8	60	176.7	0	0	0	0	113
539	N	34	Very low	34.6	Very low	132 Å²	132	135.8 Å²	135.8	71%	0.706	74%	0.735	S	S	*	*			trans	-1.2	163	147.9	-43.1	-14.6	0	0	0	121.1
540	N	34.1	Very low	34.4	Very low	119 Å²	119	140 Å²	140	64%	0.636	74%	0.741	S	S	*	*			cis	-165.7	171.4	-5.8	-120.1	-15.8	0	0	0	111.4
541	Q	34.7	Very low	34.1	Very low	162 Å²	162	142.9 Å²	142.9	76%	0.757	75%	0.747	S	S	*	*			trans	17.5	135.3	139.5	-54.9	166.2	17.2	0	0	118.8
542	S	31.5	Very low	34	Very low	111 Å²	111	144.7 Å²	144.7	78%	0.776	76%	0.758	S	S	*	*			cis	-156.1	167.7	30.9	-70.6	0	0	0	0	112.2
543	P	36.6	Very low	33.9	Very low	121 Å²	121	146.7 Å²	146.7	79%	0.786	76%	0.755	S	S	*	*			trans	-96.8	152.7	-177.7	37.4	-34	0	0	0	114.6
544	E	30.8	Very low	33.9	Very low	174 Å²	174	143.4 Å²	143.4	81%	0.813	75%	0.751	S	S	*	*				-173.5	168.3	109.6	-119.3	-168.1	-172.4	0	0	115
545	L	31	Very low	33.5	Very low	148 Å²	148	145.4 Å²	145.4	78%	0.775	75%	0.753	S	S	*	*			trans	75.5	138.8	157.5	-74.7	164	0	0	0	122.3
546	I	33.9	Very low	33.2	Very low	144 Å²	144	149.7 Å²	149.7	74%	0.738	76%	0.762	S	S	*	*			trans	86.9	94.3	159	-62.2	158.7	0	0	0	119.3
547	N	31.6	Very low	33	Very low	125 Å²	125	146.2 Å²	146.2	67%	0.668	76%	0.763	S	S	*	*			trans	70	119.2	136.5	-75.4	-31.3	0	0	0	124
548	Q	32.5	Very low	32.7	Very low	157 Å²	157	152.1 Å²	152.1	73%	0.734	78%	0.777	S	S	*	*				61.2	89.8	126.4	-60.5	173.9	48.4	0	0	117.9
549	S	29.9	Very low	32.5	Very low	92 Å²	92	155 Å²	155	64%	0.643	78%	0.783	S	S	*	*				72.6	104.5	73.4	77.6	0	0	0	0	116.1
550	Y	31.8	Very low	32.5	Very low	242 Å²	242	155.2 Å²	155.2	95%	0.949	79%	0.789	S	S	*	*			trans	-148.5	111.4	131.8	-98.8	-66.7	0	0	0	109.8
551	M	31.3	Very low	32.3	Very low	165 Å²	165	157.7 Å²	157.7	81%	0.813	80%	0.801	S	S	*	*			trans	-88	112.7	-176.1	-77.8	-83.5	174	0	0	111.1	R553	M551-R553 PolarHBondContact O-N 2.96Å
552	N	32.1	Very low	32.2	Very low	167 Å²	167	156.2 Å²	156.2	89%	0.893	80%	0.804	S	S	*	*			trans	-88.7	96	167.2	-168.8	0.3	0	0	0	110
553	R	34.2	Very low	32.2	Very low	200 Å²	200	159.6 Å²	159.6	76%	0.755	81%	0.807	S	S	*	*			trans	-99.2	111.3	-177.2	-86.8	-167.7	-177.6	-170.9	2.4	112.1	M551	M551-R553 PolarHBondContact O-N 2.96Å
554	N	33.7	Very low	32.1	Very low	131 Å²	131	162.1 Å²	162.1	70%	0.701	81%	0.814	S	S	*	*				162.8	90.6	109.2	-84.5	-21.4	0	0	0	112.7	Y556	N554-Y556 PolarHBondContact O-N 3.37Å; N554-Y556 VanDerWaalsContact O-N 3.08Å
555	S	30.3	Very low	32.3	Very low	118 Å²	118	161 Å²	161	83%	0.825	81%	0.812	S	S	*	*			trans	-83.6	51.6	173.6	-54.3	0	0	0	0	113
556	Y	30.1	Very low	32.3	Very low	213 Å²	213	162.4 Å²	162.4	84%	0.835	82%	0.815	S	S	*	*			trans	-136.9	85.1	-175.8	-71.9	-72.7	0	0	0	113.5	N554	N554-Y556 PolarHBondContact O-N 3.37Å; N554-Y556 VanDerWaalsContact O-N 3.08Å
557	A	34.7	Very low	32.4	Very low	103 Å²	103	164.2 Å²	164.2	85%	0.851	82%	0.82	S	S	*	*			trans	-154.7	36.6	170	0	0	0	0	0	113.3
558	R	31.8	Very low	32.7	Very low	250 Å²	250	166.8 Å²	166.8	94%	0.943	83%	0.832	S	S	*	*	S	Bend	trans	-140	28	-179.7	-138.7	-177.3	-166.7	-149.8	3.2	116
559	Q	31.4	Very low	32.8	Very low	182 Å²	182	164.2 Å²	164.2	85%	0.85	83%	0.827	S	S	*	*			trans	-148.5	94.5	170	-82.6	-179.6	-16.6	0	0	109.6
560	T	34.7	Very low	32.9	Very low	135 Å²	135	167.9 Å²	167.9	83%	0.828	83%	0.834	S	S	*	*			trans	-174.7	50.1	163.8	21.4	0	0	0	0	111.5
561	L	29.4	Very low	33.2	Very low	171 Å²	171	166.1 Å²	166.1	90%	0.895	83%	0.832	S	S	*	*	S	Bend	trans	-114.5	26.3	175.1	-159.6	74.7	0	0	0	113.5
562	T	32.9	Very low	33.4	Very low	132 Å²	132	167.1 Å²	167.1	81%	0.81	83%	0.834	S	S	*	*	S	Bend	trans	-163.4	77.3	169.8	43.7	0	0	0	0	110.5
563	Q	32.4	Very low	33.3	Very low	182 Å²	182	170 Å²	170	85%	0.85	83%	0.832	S	S	*	*			trans	-174	93.5	165.9	-108.4	157.6	10.9	0	0	109.9
564	N	32.8	Very low	33.3	Very low	174 Å²	174	167.6 Å²	167.6	93%	0.93	83%	0.834	S	S	*	*			trans	-167.9	29.4	165.3	-109.3	-32.1	0	0	0	112.6
565	I	35.4	Very low	33.5	Very low	150 Å²	150	168.5 Å²	168.5	77%	0.769	84%	0.838	S	S	*	*	S	Bend	trans	-136.8	130.7	175.5	-68	178.9	0	0	0	106.1
566	Q	32	Very low	33.5	Very low	177 Å²	177	168.3 Å²	168.3	83%	0.827	84%	0.837	S	S	*	*			trans	64.7	81.6	176.9	-62.8	162	16.6	0	0	117.3
567	E	34.7	Very low	34	Very low	183 Å²	183	163.8 Å²	163.8	86%	0.855	83%	0.833	S	S	*	*			trans	-162.4	71.8	141.3	-126.1	176.2	-162.6	0	0	115.6
568	I	38.5	Very low	34	Very low	179 Å²	179	165.2 Å²	165.2	92%	0.918	83%	0.827	S	S	*	*			trans	-134.5	101.2	142.8	-63.5	-173.5	0	0	0	106.9
569	T	35.5	Very low	34.1	Very low	102 Å²	102	160.3 Å²	160.3	63%	0.626	81%	0.814	S	S	*	*			trans	-127.1	128	-171.1	-67.1	0	0	0	0	110.3
570	Q	30.6	Very low	34.2	Very low	169 Å²	169	157.4 Å²	157.4	79%	0.79	80%	0.801	S	S	*	*			trans	67.9	145.1	165.9	-66.3	168.9	21.3	0	0	119.8
571	K	38.4	Very low	34.2	Very low	206 Å²	206	158.8 Å²	158.8	90%	0.896	79%	0.792	S	S	*	*			trans	93	115.9	-175.8	-58.7	161.7	-178	172.4	0	111.7
572	Q	36.7	Very low	34.4	Very low	185 Å²	185	160.2 Å²	160.2	86%	0.864	79%	0.787	S	S	*	*			cis	-139.4	131.1	8.1	-50.4	163.8	14.5	0	0	105.5
573	R	29.5	Very low	34.5	Very low	228 Å²	228	158.3 Å²	158.3	86%	0.86	78%	0.784	S	S	*	*				56.9	132.6	56.9	-154.1	-170.2	-72.3	-166.4	2.3	114.3
574	L	34.7	Very low	34.6	Very low	149 Å²	149	156 Å²	156	78%	0.78	78%	0.783	S	S	*	*			trans	81.7	131.5	179.9	-51	174.3	0	0	0	113.7
575	L	37.3	Very low	34.7	Very low	151 Å²	151	152.7 Å²	152.7	79%	0.791	77%	0.771	S	S	*	*			cis	-135.8	127.7	-12.5	-62.2	95.9	0	0	0	107.1
576	S	31.1	Very low	34.5	Very low	114 Å²	114	150.5 Å²	150.5	80%	0.797	77%	0.769	S	S	*	*				85.5	140.9	81.3	-57	0	0	0	0	115.7
577	P	39	Very low	34.6	Very low	117 Å²	117	152.2 Å²	152.2	76%	0.76	77%	0.769	S	S	*	*			trans	-129.6	-179.4	-159.4	43.1	-26.7	0	0	0	116.2
578	N	35.3	Very low	34.4	Very low	134 Å²	134	150.6 Å²	150.6	72%	0.717	77%	0.766	S	S	*	*			trans	-136.6	130.3	155	-94	-29.5	0	0	0	108.7
579	Q	34.2	Very low	34.1	Very low	147 Å²	147	150.9 Å²	150.9	69%	0.687	76%	0.761	S	S	*	*				73.6	136	69.8	-68	-169.2	21.3	0	0	112.4
580	Q	33.7	Very low	33.7	Very low	120 Å²	120	153.7 Å²	153.7	56%	0.561	77%	0.771	S	S	*	*			cis	-165.8	157.3	7.2	-126.6	169.2	10.1	0	0	113.2
581	Y	33.3	Very low	33.7	Very low	165 Å²	165	149.9 Å²	149.9	65%	0.647	77%	0.769	S	S	*	*			trans	59.8	158.5	156.8	-60.2	-54.4	0	0	0	119.4
582	Y	35.3	Very low	33.2	Very low	201 Å²	201	147.6 Å²	147.6	79%	0.788	77%	0.766	S	S	*	*			cis	-135.6	153.9	5.7	-97.8	-66.1	0	0	0	113.6
583	A	34.5	Very low	32.9	Very low	92 Å²	92	149.3 Å²	149.3	76%	0.76	77%	0.765	S	S	*	*			trans	58.1	124.6	143.8	0	0	0	0	0	123.5
584	T	33.4	Very low	32.7	Very low	133 Å²	133	143.4 Å²	143.4	82%	0.816	76%	0.759	S	S	*	*			trans	-80.1	-169.6	158.4	52.1	0	0	0	0	110.2
585	P	35.2	Very low	32.8	Very low	104 Å²	104	147.1 Å²	147.1	68%	0.675	76%	0.764	S	S	*	*			cis	-142.5	-178.7	8.7	42.7	-21.7	0	0	0	118.7
586	S	31.5	Very low	32.9	Very low	104 Å²	104	143.7 Å²	143.7	73%	0.727	76%	0.758	S	S	*	*			trans	-67.3	157.8	168.8	54.4	0	0	0	0	115.5
587	Y	33.5	Very low	33.3	Very low	214 Å²	214	144.5 Å²	144.5	84%	0.839	76%	0.76	S	S	*	*			trans	-145.9	147.5	156	-102.9	-75.4	0	0	0	114.9
588	N	30.7	Very low	33.1	Very low	148 Å²	148	142 Å²	142	79%	0.791	76%	0.755	S	S	*	*			trans	-102.8	146.2	168	-69.3	-67.6	0	0	0	110.7
589	K	33.5	Very low	33.2	Very low	185 Å²	185	142.8 Å²	142.8	80%	0.804	76%	0.759	S	S	*	*			trans	174.9	138.5	147.2	-95.1	153.5	-178.4	-176.6	0	108.4
590	L	27.3	Very low	33.2	Very low	162 Å²	162	142.8 Å²	142.8	85%	0.848	76%	0.759	S	S	*	*				74.7	148	60.2	-84.7	149.2	0	0	0	114.3
591	A	30	Very low	33.4	Very low	89 Å²	89	143.5 Å²	143.5	74%	0.736	76%	0.762	S	S	*	*			trans	70.3	134.4	-174.3	0	0	0	0	0	114.9
592	N	27.7	Very low	33.5	Very low	158 Å²	158	143.5 Å²	143.5	85%	0.845	77%	0.768	S	S	*	*			cis	83.5	139.8	41.7	-80.8	-18.1	0	0	0	114.8
593	R	29.7	Very low	33.4	Very low	221 Å²	221	140.7 Å²	140.7	83%	0.834	77%	0.766	S	S	*	*			trans	74.4	118.7	-179.8	-61.3	173.4	173.5	-126.8	-3.9	113.1
594	S	26.9	Very low	33.2	Very low	104 Å²	104	138.8 Å²	138.8	73%	0.727	76%	0.756	S	S	*	*				75.2	115.6	59	-59.6	0	0	0	0	112.7
595	Y	35.4	Very low	33.2	Very low	226 Å²	226	141 Å²	141	89%	0.886	76%	0.755	S	S	*	*				-168.7	158.4	113.3	-104.1	-74.9	0	0	0	110.8
596	A	39.5	Very low	33	Very low	80 Å²	80	146.4 Å²	146.4	66%	0.661	76%	0.762	S	S	*	*			trans	-98.5	-179	-179.7	0	0	0	0	0	111.1
597	P	39.9	Very low	33	Very low	131 Å²	131	147.6 Å²	147.6	85%	0.851	77%	0.765	S	S	*	*				-107.7	171.2	62.3	-5.6	27.2	0	0	0	113.2
598	G	33.9	Very low	32.8	Very low	64 Å²	64	144 Å²	144	66%	0.66	76%	0.759	S	S	*	*			cis	104.8	129.6	22.3	0	0	0	0	0	109.3
599	L	38.6	Very low	32.8	Very low	151 Å²	151	139.5 Å²	139.5	79%	0.791	74%	0.742	S	S	*	*			cis	-148.8	152.4	14.3	-87.3	160.3	0	0	0	111.5
600	E	33.9	Very low	32.8	Very low	146 Å²	146	131.8 Å²	131.8	68%	0.682	71%	0.711	S	S	*	*			trans	63	148	145.2	-64.7	178.5	117.5	0	0	120.5
601	Q	38.3	Very low	33	Very low	135 Å²	135	125.7 Å²	125.7	63%	0.631	68%	0.68	S	S	*	*			cis	-152.4	150.2	-1.4	-122.7	166.5	37.5	0	0	109.9
602	Q	34.4	Very low	33.3	Very low	165 Å²	165	128.1 Å²	128.1	77%	0.771	68%	0.681	S	S	*	*			trans	26.3	150.1	144.9	-64.7	167.9	-13.6	0	0	121.1
603	D	33.9	Very low	33.7	Very low	142 Å²	142	130.1 Å²	130.1	76%	0.759	68%	0.678	S	S	*	*			cis	-172.2	177.8	-25.1	-123.5	-77.4	0	0	0	106
604	G	30.9	Very low	34.2	Very low	53 Å²	53	127.2 Å²	127.2	55%	0.546	67%	0.673	S	S	.	*			cis	179.4	160.6	0.5	0	0	0	0	0	113
605	F	32	Very low	34.7	Very low	180 Å²	180	129 Å²	129	79%	0.789	66%	0.664	S	S	*	*			trans	51.7	126.2	159.6	-62.2	-75.7	0	0	0	124.7
606	R	31.9	Very low	34.7	Very low	216 Å²	216	124.6 Å²	124.6	82%	0.815	65%	0.652	S	S	*	*			trans	75.6	97.3	135.2	-68.4	172.8	179.8	-88.5	0.3	122.9
607	T	30.7	Very low	34.5	Very low	130 Å²	130	127.3 Å²	127.3	80%	0.798	65%	0.652	S	S	*	*				37.2	119.2	117.8	-36.7	0	0	0	0	122.1
608	I	30	Very low	34.5	Very low	137 Å²	137	127.7 Å²	127.7	70%	0.703	64%	0.643	S	S	*	*				-175.2	161.7	122.1	-91.9	155.9	0	0	0	110	Y148	Y148-I608 WeakPolarHBondContact CE2-O 3.45Å
609	A	31.3	Very low	34.7	Very low	54 Å²	54	131.6 Å²	131.6	45%	0.446	65%	0.654	S	S	.	*			trans	-94.5	-165.7	-165	0	0	0	0	0	116.1	Y148	Y148-A609 VanDerWaalsContact CD2-C 3.46Å; Y148-A609 WeakPolarHBondContact CD2-O 3.47Å; Y148-A609 WeakPolarHBondContact CE2-O 3.48Å; Y148-A609 VanDerWaalsContact CG-O 3.25Å
610	T	32.4	Very low	34.6	Very low	24 Å²	24	130.2 Å²	130.2	15%	0.147	66%	0.657	C	S	.	*			trans	138.2	-147.8	146.8	66.5	0	0	0	0	125.5	Y148 Y149 K150	Y148-T610 VanDerWaalsContact CA-OG1 3.29Å; Y148-T610 WeakPolarHBondContact CA-OG1 3.32Å; Y148-T610 WeakPolarHBondContact CB-OG1 3.47Å; Y148-T610 VanDerWaalsContact CD1-O 3.26Å; Y148-T610 WeakPolarHBondContact CD1-O 3.41Å; Y148-T610 VanDerWaalsContact CE1-O 3.32Å; Y148-T610 WeakPolarHBondContact CE1-O 3.04Å; Y149-T610 HydrophobicContact CD2-CG2 3.08Å; Y149-T610 HydrophobicContact CE2-CG2 3.25Å; Y149-T610 HydrophobicContact CG-CG2 3.91Å; Y149-T610 PolarHBondContact N-OG1 3.2Å; Y149-T610 VanDerWaalsContact O-CB 3.31Å; Y149-T610 WeakPolarHBondContact O-CB 3.06Å; Y149-T610 VanDerWaalsContact O-CG2 3.32Å; Y149-T610 WeakPolarHBondContact O-CG2 3.34Å; Y149-T610 PolarHBondContact O-OG1 3.14Å; K150-T610 HydrophobicContact CD-CG2 4.45Å; K150-T610 HydrophobicContact CG-CG2 4.3Å
611	T	31.2	Very low	34.8	Very low	33 Å²	33	126.9 Å²	126.9	20%	0.202	66%	0.661	C	S	.	*			trans	-74.2	146.8	-162.8	-7.5	0	0	0	0	127.7	P147 Y148 Y149	P147-T611 CarbonylContact C-O 3.58Å; P147-T611 WeakPolarHBondContact CA-O 3.49Å; P147-T611 WeakPolarHBondContact CB-O 3.44Å; Y148-T611 VanDerWaalsContact C-N 3.34Å; Y148-T611 PolarHBondContact N-O 3.41Å; Y148-T611 PolarHBondContact O-OG1 3.18Å; Y149-T611 WeakPolarHBondContact CA-OG1 3.23Å; Y149-T611 WeakPolarHBondContact CB-OG1 3.33Å; Y149-T611 HydrophobicContact CD1-CG2 3.57Å; Y149-T611 WeakPolarHBondContact CD1-OG1 3.35Å; Y149-T611 HydrophobicContact CE1-CG2 4.3Å; Y149-T611 VanDerWaalsContact CE1-N 3.29Å; Y149-T611 HydrophobicContact CG-CG2 4.49Å; Y149-T611 VanDerWaalsContact N-N 3.18Å; Y149-T611 PolarHBondContact N-OG1 2.87Å
612	N	37.3	Very low	35.1	Very low	140 Å²	140	126.3 Å²	126.3	75%	0.749	67%	0.669	S	S	*	*			trans	-28.9	178.6	149.5	-58.5	-21.9	0	0	0	122.1
613	Y	36.4	Very low	35.2	Very low	201 Å²	201	127.4 Å²	127.4	79%	0.788	67%	0.674	S	S	*	*			trans	107	163.4	173	-71.2	-74.8	0	0	0	114.6
614	H	38.5	Very low	35.3	Very low	159 Å²	159	125.8 Å²	125.8	74%	0.736	67%	0.674	S	S	*	*			cis	-136.7	-166.7	2.7	-138.2	-13.8	0	0	0	109
615	R	37.4	Very low	35.9	Very low	142 Å²	142	128.6 Å²	128.6	54%	0.536	68%	0.683	S	S	.	*			cis	-143.9	-156.3	-1	-140.8	175	152.5	-138.4	0.5	106.4	H618	R615-H618 PolarHBondContact NH2-NE2 3.34Å
616	E	35.9	Very low	36.2	Very low	134 Å²	134	130.6 Å²	130.6	63%	0.626	69%	0.687	S	S	*	*			cis	-158.2	162.2	3.9	-122.5	161.5	-141.6	0	0	107.6
617	M	36.9	Very low	36.3	Very low	136 Å²	136	127.5 Å²	127.5	67%	0.67	69%	0.685	S	S	*	*			cis	-140	-179.9	11.1	-103.1	-57.8	-179	0	0	112.2
618	H	38	Very low	36.4	Very low	140 Å²	140	124.2 Å²	124.2	65%	0.648	68%	0.678	S	S	*	*			trans	-83.8	171.9	-174.8	-60.8	-112.4	0	0	0	113.2	R615	R615-H618 PolarHBondContact NH2-NE2 3.34Å
619	T	38.1	Very low	36.7	Very low	145 Å²	145	124.4 Å²	124.4	89%	0.89	69%	0.686	S	S	*	*				-156.5	-159.2	56.5	53.2	0	0	0	0	114.5
620	S	38	Very low	36.7	Very low	123 Å²	123	129.1 Å²	129.1	86%	0.86	70%	0.7	S	S	*	*			trans	-143.7	153.4	-148.9	56.1	0	0	0	0	118.3
621	G	36.9	Very low	36.6	Very low	75 Å²	75	138.5 Å²	138.5	77%	0.773	73%	0.733	S	S	*	*			trans	-174.4	144.5	164.9	0	0	0	0	0	115.5
622	P	45.5	Very low	36.9	Very low	123 Å²	123	146.5 Å²	146.5	80%	0.799	77%	0.768	S	S	*	*			trans	-135.8	-169.2	-167.1	42	-23.5	0	0	0	118.8
623	Q	36.6	Very low	36.5	Very low	189 Å²	189	146.8 Å²	146.8	88%	0.883	77%	0.77	S	S	*	*			trans	91.3	149.4	172.3	-56.3	-171	-4.6	0	0	117.4
624	S	36.1	Very low	36.4	Very low	108 Å²	108	142.1 Å²	142.1	76%	0.755	77%	0.766	S	S	*	*			cis	-157.4	160.2	-4.5	-152.3	0	0	0	0	113.3
625	P	43.6	Very low	36	Very low	112 Å²	112	142.8 Å²	142.8	73%	0.727	77%	0.769	S	S	*	*			trans	-125.9	169.3	178.1	42.1	-30.4	0	0	0	116.9
626	Y	36.7	Very low	35.8	Very low	222 Å²	222	145.9 Å²	145.9	87%	0.871	78%	0.783	S	S	*	*			trans	-166.3	179.4	156.2	-131.2	-105.6	0	0	0	116.9
627	L	34.7	Very low	35.5	Very low	150 Å²	150	148.5 Å²	148.5	79%	0.785	80%	0.795	S	S	*	*			trans	-87.3	176	-166.3	-82.8	62.5	0	0	0	116.2
628	G	32.2	Very low	35.2	Very low	62 Å²	62	145.4 Å²	145.4	64%	0.639	79%	0.791	S	S	*	*			cis	157.8	-169.1	-4.9	0	0	0	0	0	115.8
629	T	36.9	Very low	34.9	Very low	141 Å²	141	145.1 Å²	145.1	87%	0.865	80%	0.799	S	S	*	*			trans	85.8	125.9	164.3	65.4	0	0	0	0	125.4
630	M	32.3	Very low	34.9	Very low	153 Å²	153	143.2 Å²	143.2	75%	0.754	79%	0.789	S	S	*	*			trans	68	112.2	134	-67.7	-70.6	-96.1	0	0	126.6
631	R	29.5	Very low	34.5	Very low	221 Å²	221	144.6 Å²	144.6	83%	0.834	79%	0.785	S	S	*	*			trans	31	130.1	132.5	-63.3	-176.4	178.4	-147.3	0.3	122.7
632	Q	36.6	Very low	34.2	Very low	201 Å²	201	146 Å²	146	94%	0.939	78%	0.779	S	S	*	*				-160.7	177.6	119.1	-113.3	-177.1	28	0	0	112.8
633	N	29.4	Very low	33.6	Very low	146 Å²	146	147.8 Å²	147.8	78%	0.781	78%	0.781	S	S	*	*			trans	-141.8	141	-164.8	-165.3	34.2	0	0	0	111.7
634	S	35.1	Very low	33.3	Very low	103 Å²	103	149.7 Å²	149.7	72%	0.72	78%	0.781	S	S	*	*			trans	-169.2	151.8	164.3	-84.5	0	0	0	0	112.6
635	Q	29.8	Very low	33.2	Very low	172 Å²	172	149.9 Å²	149.9	80%	0.804	78%	0.782	S	S	*	*			trans	-120.2	135	-177.5	-42.2	159.1	-95.4	0	0	110.5
636	Y	33.8	Very low	32.7	Very low	208 Å²	208	152.3 Å²	152.3	82%	0.816	79%	0.787	S	S	*	*			trans	-157.9	119.1	151.9	-51.6	-73	0	0	0	105.1
637	E	28.9	Very low	32.3	Very low	189 Å²	189	147.9 Å²	147.9	88%	0.883	78%	0.783	S	S	*	*				69	127	70	-161.8	153.6	-142.9	0	0	112.3
638	A	31.2	Very low	32	Very low	70 Å²	70	148.6 Å²	148.6	58%	0.579	78%	0.782	S	S	*	*			cis	-156.8	135	13.1	0	0	0	0	0	116.5
639	T	32.2	Very low	31.8	Very low	134 Å²	134	153.7 Å²	153.7	82%	0.822	79%	0.789	S	S	*	*			trans	69.9	-177.8	136.2	77.9	0	0	0	0	119.7
640	P	36.7	Very low	31.3	Very low	106 Å²	106	151.7 Å²	151.7	69%	0.688	78%	0.781	S	S	*	*				-138.7	-170.9	-112.5	36.1	-10.7	0	0	0	116.4
641	I	29.5	Very low	31.5	Very low	151 Å²	151	148.4 Å²	148.4	77%	0.774	77%	0.77	S	S	*	*				168.4	122.7	124.3	-86.7	162.4	0	0	0	113.8
642	V	31.5	Very low	31.5	Very low	104 Å²	104	143.8 Å²	143.8	63%	0.63	76%	0.76	S	S	*	*			trans	26.2	127.2	145.5	-169.8	0	0	0	0	120.8
643	N	32	Very low	31.3	Very low	161 Å²	161	136.6 Å²	136.6	86%	0.861	73%	0.731	S	S	*	*			trans	-136	160.4	132.4	-144.8	-21.7	0	0	0	111.1
644	R	31.3	Very low	31.5	Very low	229 Å²	229	134.1 Å²	134.1	86%	0.864	71%	0.713	S	S	*	*			trans	-86.2	141.1	-159.6	-60.2	179.6	178.1	-164.7	-0.9	114.6
645	S	32.5	Very low	31.3	Very low	112 Å²	112	133.4 Å²	133.4	78%	0.783	71%	0.708	S	S	*	*			trans	-111.9	141	155.6	-75.7	0	0	0	0	110.7
646	I	33.2	Very low	31.4	Very low	163 Å²	163	130.8 Å²	130.8	84%	0.836	71%	0.707	S	S	*	*			trans	-82.6	115.8	164.9	-64.8	171.7	0	0	0	106.6	Q648	I646-Q648 PolarHBondContact O-N 2.99Å; I646-Q648 VanDerWaalsContact O-N 3.11Å
647	V	29.1	Very low	31.2	Very low	130 Å²	130	128.5 Å²	128.5	79%	0.788	71%	0.708	S	S	*	*			trans	-82.1	91.7	179.3	-177.3	0	0	0	0	108.9
648	Q	28.6	Very low	31.1	Very low	164 Å²	164	122.2 Å²	122.2	77%	0.766	70%	0.695	S	S	*	*			trans	-99.8	114.1	162.9	-155.1	166.8	10.9	0	0	106.7	I646 S650	I646-Q648 PolarHBondContact O-N 2.99Å; I646-Q648 VanDerWaalsContact O-N 3.11Å; Q648-S650 VanDerWaalsContact C-N 3.34Å; Q648-S650 PolarHBondContact O-N 2.96Å
649	Q	27.5	Very low	31	Very low	169 Å²	169	123.5 Å²	123.5	79%	0.79	70%	0.699	S	S	*	*			trans	-79	78.3	-160.6	-167.2	167.9	-5.3	0	0	112.1	V651	Q649-V651 PolarHBondContact O-N 3.47Å
650	S	26.9	Very low	30.9	Very low	99 Å²	99	125 Å²	125	69%	0.692	70%	0.701	S	S	*	*			trans	-73	82.9	179	61.2	0	0	0	0	111.8	Q648 I652	Q648-S650 VanDerWaalsContact C-N 3.34Å; Q648-S650 PolarHBondContact O-N 2.96Å; S650-I652 WeakPolarHBondContact O-CG1 3.37Å; S650-I652 PolarHBondContact O-N 2.9Å
651	V	35.9	Very low	30.4	Very low	84 Å²	84	125.3 Å²	125.3	51%	0.509	71%	0.706	S	S	.	*			trans	-66.2	125.9	158.8	-175.5	0	0	0	0	107.2	Q649 P653	Q649-V651 PolarHBondContact O-N 3.47Å; V651-P653 VanDerWaalsContact C-CD 3.44Å; V651-P653 WeakPolarHBondContact O-CD 3.31Å
652	I	30.8	Very low	30.3	Very low	124 Å²	124	120 Å²	120	64%	0.636	69%	0.689	S	S	*	*			trans	-108.9	83.2	-174.8	-46.7	175.6	0	0	0	110.3	S650	S650-I652 WeakPolarHBondContact O-CG1 3.37Å; S650-I652 PolarHBondContact O-N 2.9Å
653	P	30.9	Very low	30.3	Very low	51 Å²	51	119.3 Å²	119.3	33%	0.331	69%	0.685	S	S	.	*			trans	-73.3	152.6	156.9	34.9	-33	0	0	0	109.2	V651 Y688	V651-P653 VanDerWaalsContact C-CD 3.44Å; V651-P653 WeakPolarHBondContact O-CD 3.31Å; P653-Y688 HydrophobicContact CG-CE1 3.96Å
654	F	35.4	Very low	30.1	Very low	93 Å²	93	119.6 Å²	119.6	41%	0.408	69%	0.686	S	S	.	*			trans	66.2	56.4	172.7	-38.7	-66.6	0	0	0	116.7	P656 L681 Y688	F654-P656 WeakPolarHBondContact O-CD 3.4Å; F654-L681 HydrophobicContact CD1-CD2 4.18Å; F654-L681 HydrophobicContact CE1-CD2 4.27Å; F654-Y688 AromaticContact CE2-CD1 3.98Å; F654-Y688 HydrophobicContact CE2-CD1 3.98Å; F654-Y688 HydrophobicContact CE2-CE1 4.17Å; F654-Y688 HydrophobicContact CZ-CD1 4.45Å
655	S	29.3	Very low	30.3	Very low	88 Å²	88	114.6 Å²	114.6	62%	0.615	68%	0.676	S	S	*	*			trans	-82.2	112.8	153.3	-75.5	0	0	0	0	109.8	N657	S655-N657 PolarHBondContact O-N 2.85Å
656	P	32.4	Very low	30	Very low	118 Å²	118	113.3 Å²	113.3	77%	0.766	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-8.1	-177.9	-19.2	34.2	0	0	0	114.6	F654 G658	F654-P656 WeakPolarHBondContact O-CD 3.4Å; P656-G658 PolarHBondContact O-N 2.88Å
657	N	29.5	Very low	29.9	Very low	159 Å²	159	110.6 Å²	110.6	85%	0.85	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	12.1	-172	-64.6	2	0	0	0	113.9	S655 S659	S655-N657 PolarHBondContact O-N 2.85Å; N657-S659 PolarHBondContact O-N 3.14Å
658	G	28	Very low	29.8	Very low	58 Å²	58	112.2 Å²	112.2	60%	0.598	68%	0.675	S	S	*	*	S	Bend	trans	-73.8	108.9	164.5	0	0	0	0	0	109.7	P656 L660	P656-G658 PolarHBondContact O-N 2.88Å; G658-L660 PolarHBondContact O-N 3.11Å
659	S	27.1	Very low	30	Very low	96 Å²	96	110 Å²	110	67%	0.671	67%	0.667	S	S	*	*			trans	-51.7	125.6	-175.8	-177.5	0	0	0	0	112.8	N657 S661	N657-S659 PolarHBondContact O-N 3.14Å; S659-S661 PolarHBondContact O-N 3.37Å; S659-S661 PolarHBondContact OG-N 3.36Å
660	L	31.2	Very low	30.3	Very low	166 Å²	166	107.4 Å²	107.4	87%	0.869	66%	0.663	S	S	*	*	S	Bend	trans	-69	-7.3	173.5	-74.6	167.4	0	0	0	113.1	G658 G662	G658-L660 PolarHBondContact O-N 3.11Å; L660-G662 PolarHBondContact O-N 2.91Å
661	S	26.9	Very low	31	Very low	112 Å²	112	109.1 Å²	109.1	78%	0.783	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	81.3	175.6	-53.3	0	0	0	0	111.5	S659	S659-S661 PolarHBondContact O-N 3.37Å; S659-S661 PolarHBondContact OG-N 3.36Å
662	G	27.2	Very low	31.2	Very low	41 Å²	41	107.5 Å²	107.5	42%	0.423	67%	0.665	S	S	.	*	T	Hydrogen-bonded Turn	trans	175.5	-7.7	171.3	0	0	0	0	0	120.1	L660 N664 R760	L660-G662 PolarHBondContact O-N 2.91Å; G662-N664 PolarHBondContact O-N 3.47Å; G662-R760 PolarHBondContact O-NH1 3.47Å
663	T	31.8	Very low	32.6	Very low	88 Å²	88	105.7 Å²	105.7	54%	0.54	66%	0.656	S	S	.	*			trans	-93.4	72.1	-178.2	47.4	0	0	0	0	112.8	I665	T663-I665 VanDerWaalsContact C-N 3.31Å; T663-I665 PolarHBondContact O-N 3.49Å
664	N	26.6	Very low	34.2	Very low	167 Å²	167	107.6 Å²	107.6	89%	0.893	67%	0.667	S	S	*	*			trans	-70.7	91	156.7	-85.9	-63.2	0	0	0	108.8	G662	G662-N664 PolarHBondContact O-N 3.47Å
665	I	34.8	Very low	35.6	Very low	125 Å²	125	107.8 Å²	107.8	64%	0.641	68%	0.675	S	S	*	*			trans	-114.4	122.2	160.6	-62.4	178.6	0	0	0	105.5	T663 V667	T663-I665 VanDerWaalsContact C-N 3.31Å; T663-I665 PolarHBondContact O-N 3.49Å; I665-V667 PolarHBondContact O-N 3.28Å
666	G	26.8	Very low	38	Very low	85 Å²	85	104.2 Å²	104.2	88%	0.876	65%	0.653	S	S	*	*	S	Bend	trans	-71.8	88.4	-168.9	0	0	0	0	0	114
667	V	31.6	Very low	40.4	Very low	105 Å²	105	101.4 Å²	101.4	64%	0.636	63%	0.63	S	S	*	*	S	Bend	trans	-143.7	139.6	158.5	-80.8	0	0	0	0	107.6	I665 I669	I665-V667 PolarHBondContact O-N 3.28Å; V667-I669 PolarHBondContact O-N 3.42Å
668	D	27.9	Very low	42.8	Very low	164 Å²	164	101.6 Å²	101.6	88%	0.877	62%	0.619	S	S	*	*			trans	-69.6	104.1	-172.7	-57.9	-74.3	0	0	0	111.6	V670	D668-V670 PolarHBondContact O-N 2.97Å
669	I	31	Very low	45.6	Very low	117 Å²	117	103.8 Å²	103.8	60%	0.6	61%	0.613	S	S	*	*			trans	-74.3	94.1	-178.1	-55.6	-179.7	0	0	0	109.9	V667	V667-I669 PolarHBondContact O-N 3.42Å
670	V	35.3	Very low	48.6	Very low	116 Å²	116	99.2 Å²	99.2	70%	0.703	58%	0.581	S	S	*	*			trans	-71.7	143.1	155.8	-171.2	0	0	0	0	108	D668 G672 D673	D668-V670 PolarHBondContact O-N 2.97Å; V670-G672 PolarHBondContact O-N 3.32Å; V670-D673 PolarHBondContact O-N 2.88Å
671	D	39.9	Very low	51.3	Low	135 Å²	135	94.8 Å²	94.8	72%	0.722	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.2	-23.7	-167.2	-67	-74.4	0	0	0	116.8	D673 T674	D671-D673 VanDerWaalsContact C-N 3.33Å; D671-D673 PolarHBondContact O-N 2.91Å; D671-T674 PolarHBondContact O-N 3.26Å; D671-T674 PolarHBondContact O-OG1 2.74Å
672	G	40.5	Very low	54.1	Low	50 Å²	50	92.7 Å²	92.7	52%	0.515	54%	0.538	S	S	.	.	H	α-helix	trans	-60.1	-31	-174.7	0	0	0	0	0	115.8	V670 T674 V675 G676	V670-G672 PolarHBondContact O-N 3.32Å; G672-T674 PolarHBondContact O-N 2.92Å; G672-V675 WeakPolarHBondContact O-CB 3.34Å; G672-V675 PolarHBondContact O-N 3.29Å; G672-G676 PolarHBondContact O-N 3.47Å
673	D	60.3	Low	57	Low	86 Å²	86	90.8 Å²	90.8	46%	0.46	52%	0.519	S	S	.	.	H	α-helix	trans	-64.4	-27.6	-176.3	-122.4	21.8	0	0	0	112.3	V670 D671 M677 H783	V670-D673 PolarHBondContact O-N 2.88Å; D671-D673 VanDerWaalsContact C-N 3.33Å; D671-D673 PolarHBondContact O-N 2.91Å; D673-M677 WeakPolarHBondContact O-CB 3.42Å; D673-M677 PolarHBondContact O-N 2.8Å; D673-M677 VanDerWaalsContact O-N 3.14Å; D673-H783 IonicContact OD1-CE1 2.77Å; D673-H783 PolarHBondContact OD1-CE1 3.48Å
674	T	63.9	Low	59.8	Low	90 Å²	90	87.8 Å²	87.8	55%	0.552	50%	0.501	S	S	*	.	H	α-helix	trans	-68.3	-34.7	174.6	68.8	0	0	0	0	112.4	D671 G672 R678	D671-T674 PolarHBondContact O-N 3.26Å; D671-T674 PolarHBondContact O-OG1 2.74Å; G672-T674 PolarHBondContact O-N 2.92Å; T674-R678 WeakPolarHBondContact O-CB 3.42Å; T674-R678 PolarHBondContact O-N 3.09Å; T674-R678 VanDerWaalsContact O-N 3.12Å
675	V	66.3	Low	62.7	Low	97 Å²	97	84.7 Å²	84.7	59%	0.588	48%	0.48	S	S	*	.	H	α-helix	trans	-74.3	-42.6	-179.2	-174.8	0	0	0	0	110.3	G672 R678 Q679	G672-V675 WeakPolarHBondContact O-CB 3.34Å; G672-V675 PolarHBondContact O-N 3.29Å; V675-R678 PolarHBondContact O-N 3.47Å; V675-Q679 PolarHBondContact O-N 2.85Å
676	G	79.3	Confident	65.3	Low	14 Å²	14	83 Å²	83	14%	0.144	47%	0.466	C	S	.	.	H	α-helix	trans	-62.6	-47.8	175.7	0	0	0	0	0	112.5	G672 R678 Q679 V680 H783	G672-G676 PolarHBondContact O-N 3.47Å; G676-R678 VanDerWaalsContact C-N 3.3Å; G676-R678 PolarHBondContact O-N 2.61Å; G676-Q679 PolarHBondContact O-N 3.21Å; G676-V680 WeakPolarHBondContact O-CG2 3.35Å; G676-V680 PolarHBondContact O-N 3.19Å; G676-H783 WeakPolarHBondContact CA-NE2 3.34Å
677	M	83	Confident	68.4	Low	58 Å²	58	79 Å²	79	29%	0.286	42%	0.424	S	S	.	.	H	α-helix	trans	-59.2	-39.9	175	-83.9	-65.4	-58.7	0	0	112.4	D673 V680 L681 A779 H783	D673-M677 WeakPolarHBondContact O-CB 3.42Å; D673-M677 PolarHBondContact O-N 2.8Å; D673-M677 VanDerWaalsContact O-N 3.14Å; M677-V680 PolarHBondContact O-N 3.13Å; M677-L681 WeakPolarHBondContact O-CG 3.49Å; M677-L681 PolarHBondContact O-N 3.02Å; M677-A779 HydrophobicContact CE-CB 4.37Å; M677-H783 HydrophobicContact CG-CB 4.49Å; M677-H783 PolarHBondContact N-CD2 2.69Å; M677-H783 PolarHBondContact N-NE2 2.85Å; M677-H783 HydrophobicContact SD-CB 3.43Å; M677-H783 WeakPolarHBondContact SD-CB 3.44Å; M677-H783 VanDerWaalsContact SD-CG 3.52Å
678	R	80.2	Confident	71.5	Confident	164 Å²	164	75 Å²	75	62%	0.619	40%	0.398	S	S	*	.	H	α-helix	trans	-63.7	-45	174.5	-179.9	173.8	177.4	170.1	2.7	111.9	T674 V675 G676 V680 L681 D682	T674-R678 WeakPolarHBondContact O-CB 3.42Å; T674-R678 PolarHBondContact O-N 3.09Å; T674-R678 VanDerWaalsContact O-N 3.12Å; V675-R678 PolarHBondContact O-N 3.47Å; G676-R678 VanDerWaalsContact C-N 3.3Å; G676-R678 PolarHBondContact O-N 2.61Å; R678-V680 VanDerWaalsContact C-N 3.27Å; R678-V680 PolarHBondContact O-N 3.32Å; R678-L681 PolarHBondContact O-N 2.94Å; R678-L681 VanDerWaalsContact O-N 3.07Å; R678-D682 WeakPolarHBondContact CG-OD2 3.41Å; R678-D682 IonicContact NE-OD2 3.81Å; R678-D682 PolarHBondContact NE-OD2 2.99Å; R678-D682 PolarHBondContact O-N 2.95Å
679	Q	86	Confident	74.6	Confident	103 Å²	103	69.7 Å²	69.7	48%	0.481	37%	0.369	S	S	.	.	H	α-helix	trans	-59.6	-37.2	177.4	-169	-175.7	2.5	0	0	112.2	V675 G676 T683 L798	V675-Q679 PolarHBondContact O-N 2.85Å; G676-Q679 PolarHBondContact O-N 3.21Å; Q679-T683 WeakPolarHBondContact O-CB 3.49Å; Q679-T683 WeakPolarHBondContact O-CG2 3.5Å; Q679-T683 PolarHBondContact O-N 2.78Å; Q679-T683 PolarHBondContact O-OG1 2.97Å; Q679-L798 HydrophobicContact CG-CD1 3.93Å
680	V	89.7	Confident	77.4	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-64.6	-40.4	174.2	173.5	0	0	0	0	111.8	G676 M677 R678 T683 S684 W687 A779 V782 H783 I786 L798	G676-V680 WeakPolarHBondContact O-CG2 3.35Å; G676-V680 PolarHBondContact O-N 3.19Å; M677-V680 PolarHBondContact O-N 3.13Å; R678-V680 VanDerWaalsContact C-N 3.27Å; R678-V680 PolarHBondContact O-N 3.32Å; V680-T683 WeakPolarHBondContact CA-OG1 3.36Å; V680-T683 PolarHBondContact O-OG1 2.91Å; V680-S684 PolarHBondContact O-N 2.78Å; V680-W687 HydrophobicContact CG1-CH2 4.44Å; V680-W687 HydrophobicContact CG1-CZ2 3.64Å; V680-W687 WeakPolarHBondContact O-CZ2 3.5Å; V680-W687 PolarHBondContact O-NE1 2.86Å; V680-A779 HydrophobicContact CG1-CB 4.1Å; V680-V782 HydrophobicContact CG1-CB 3.99Å; V680-V782 HydrophobicContact CG1-CG1 3.7Å; V680-V782 HydrophobicContact CG2-CG1 4.34Å; V680-H783 HydrophobicContact CG2-CB 4.06Å; V680-I786 HydrophobicContact CG2-CD1 3.57Å; V680-L798 HydrophobicContact CG2-CD1 4.04Å; V680-L798 HydrophobicContact CG2-CD2 4.44Å
681	L	89.5	Confident	79.9	Confident	74 Å²	74	65.2 Å²	65.2	39%	0.387	37%	0.365	S	S	.	.	H	α-helix	trans	-69.7	-44.2	176.4	-68.2	168.5	0	0	0	112.1	F654 M677 R678 T683 S684 A779	F654-L681 HydrophobicContact CD1-CD2 4.18Å; F654-L681 HydrophobicContact CE1-CD2 4.27Å; M677-L681 WeakPolarHBondContact O-CG 3.49Å; M677-L681 PolarHBondContact O-N 3.02Å; R678-L681 PolarHBondContact O-N 2.94Å; R678-L681 VanDerWaalsContact O-N 3.07Å; L681-T683 VanDerWaalsContact C-N 3.27Å; L681-T683 PolarHBondContact O-N 3.47Å; L681-S684 WeakPolarHBondContact O-CB 3.41Å; L681-S684 PolarHBondContact O-N 3.43Å; L681-S684 VanDerWaalsContact O-N 3.11Å; L681-S684 PolarHBondContact O-OG 2.83Å; L681-A779 HydrophobicContact CD2-CB 3.66Å; L681-A779 HydrophobicContact CG-CB 4.33Å
682	D	85	Confident	82.2	Confident	68 Å²	68	60.2 Å²	60.2	36%	0.364	34%	0.338	S	S	.	.	H	α-helix	trans	-66.3	-29.2	-179.4	-67.5	-17.4	0	0	0	112.2	R678 K685	R678-D682 WeakPolarHBondContact CG-OD2 3.41Å; R678-D682 IonicContact NE-OD2 3.81Å; R678-D682 PolarHBondContact NE-OD2 2.99Å; R678-D682 PolarHBondContact O-N 2.95Å; D682-K685 PolarHBondContact O-NZ 3.48Å
683	T	88.4	Confident	84.5	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.006	33%	0.326	C	S	.	.	H	α-helix	trans	-84.2	-12	173.9	53.3	0	0	0	0	114.6	Q679 V680 L681 K685 Y686 W687 L798 F801	Q679-T683 WeakPolarHBondContact O-CB 3.49Å; Q679-T683 WeakPolarHBondContact O-CG2 3.5Å; Q679-T683 PolarHBondContact O-N 2.78Å; Q679-T683 PolarHBondContact O-OG1 2.97Å; V680-T683 WeakPolarHBondContact CA-OG1 3.36Å; V680-T683 PolarHBondContact O-OG1 2.91Å; L681-T683 VanDerWaalsContact C-N 3.27Å; L681-T683 PolarHBondContact O-N 3.47Å; T683-K685 VanDerWaalsContact C-N 3.32Å; T683-K685 PolarHBondContact O-N 2.91Å; T683-K685 VanDerWaalsContact O-N 3.11Å; T683-Y686 WeakPolarHBondContact O-CD2 3.27Å; T683-Y686 PolarHBondContact O-N 3.06Å; T683-W687 PolarHBondContact OG1-NE1 3.32Å; T683-W687 VanDerWaalsContact OG1-NE1 3.09Å; T683-L798 HydrophobicContact CG2-CB 4.48Å; T683-L798 HydrophobicContact CG2-CD1 4.32Å; T683-L798 WeakPolarHBondContact OG1-CD2 3.29Å; T683-F801 HydrophobicContact CG2-CD2 4.46Å; T683-F801 HydrophobicContact CG2-CE2 3.47Å; T683-F801 VanDerWaalsContact CG2-CE2 3.47Å; T683-F801 HydrophobicContact CG2-CZ 3.71Å
684	S	90.9	Very high	85.8	Confident	24 Å²	24	57.7 Å²	57.7	17%	0.168	31%	0.312	C	S	.	.	H	α-helix	trans	-48.2	-46	-168.6	57.5	0	0	0	0	114.9	V680 L681 Y686 W687 Y688	V680-S684 PolarHBondContact O-N 2.78Å; L681-S684 WeakPolarHBondContact O-CB 3.41Å; L681-S684 PolarHBondContact O-N 3.43Å; L681-S684 VanDerWaalsContact O-N 3.11Å; L681-S684 PolarHBondContact O-OG 2.83Å; S684-Y686 PolarHBondContact O-N 3.28Å; S684-W687 PolarHBondContact O-N 2.85Å; S684-W687 VanDerWaalsContact O-N 3.11Å; S684-Y688 WeakPolarHBondContact O-CB 3.43Å; S684-Y688 PolarHBondContact O-N 2.8Å
685	K	87.1	Confident	87	Confident	102 Å²	102	57.3 Å²	57.3	44%	0.443	31%	0.311	S	S	.	.	H	α-helix	trans	-58.2	-8.1	178.3	68.4	-153.2	172.3	-156.9	0	116.6	D682 T683 L826	D682-K685 PolarHBondContact O-NZ 3.48Å; T683-K685 VanDerWaalsContact C-N 3.32Å; T683-K685 PolarHBondContact O-N 2.91Å; T683-K685 VanDerWaalsContact O-N 3.11Å; K685-L826 HydrophobicContact CD-CD2 4.47Å
686	Y	88.1	Confident	88.1	Confident	90 Å²	90	56.9 Å²	56.9	35%	0.353	31%	0.306	S	S	.	.	H	α-helix	trans	-108.9	-17.9	177.9	-58.4	-82.7	0	0	0	113.9	T683 S684 F801	T683-Y686 WeakPolarHBondContact O-CD2 3.27Å; T683-Y686 PolarHBondContact O-N 3.06Å; S684-Y686 PolarHBondContact O-N 3.28Å; Y686-F801 AromaticContact CD2-CE1 3.67Å; Y686-F801 HydrophobicContact CD2-CE1 3.67Å; Y686-F801 AromaticContact CD2-CZ 3.38Å; Y686-F801 HydrophobicContact CD2-CZ 3.38Å; Y686-F801 HydrophobicContact CE1-CE1 4.45Å; Y686-F801 AromaticContact CE2-CE1 3.43Å; Y686-F801 HydrophobicContact CE2-CE1 3.43Å; Y686-F801 VanDerWaalsContact CE2-CE1 3.43Å; Y686-F801 HydrophobicContact CE2-CE2 4.3Å; Y686-F801 AromaticContact CE2-CZ 3.24Å; Y686-F801 HydrophobicContact CE2-CZ 3.24Å; Y686-F801 HydrophobicContact CG-CE1 4.25Å; Y686-F801 HydrophobicContact CG-CZ 4.32Å; Y686-F801 AromaticContact CZ-CE1 3.88Å
687	W	93.8	Very high	88.6	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-117.2	-18.6	177.5	58.9	-105.9	0	0	0	113.4	V680 T683 S684 F709 V710 I711 L778 V782	V680-W687 HydrophobicContact CG1-CH2 4.44Å; V680-W687 HydrophobicContact CG1-CZ2 3.64Å; V680-W687 WeakPolarHBondContact O-CZ2 3.5Å; V680-W687 PolarHBondContact O-NE1 2.86Å; T683-W687 PolarHBondContact OG1-NE1 3.32Å; T683-W687 VanDerWaalsContact OG1-NE1 3.09Å; S684-W687 PolarHBondContact O-N 2.85Å; S684-W687 VanDerWaalsContact O-N 3.11Å; W687-F709 HydrophobicContact CB-CD2 4.24Å; W687-F709 HydrophobicContact CB-CE1 4.29Å; W687-F709 HydrophobicContact CB-CE2 3.65Å; W687-F709 HydrophobicContact CB-CZ 3.67Å; W687-F709 AromaticContact CD1-CZ 3.99Å; W687-F709 AromaticContact CD2-CE2 3.8Å; W687-F709 HydrophobicContact CD2-CE2 3.8Å; W687-F709 AromaticContact CD2-CZ 3.88Å; W687-F709 HydrophobicContact CD2-CZ 3.88Å; W687-F709 AromaticContact CE3-CE2 3.83Å; W687-F709 HydrophobicContact CE3-CE2 3.83Å; W687-F709 HydrophobicContact CE3-CZ 4.36Å; W687-F709 HydrophobicContact CG-CE1 4.47Å; W687-F709 AromaticContact CG-CE2 3.75Å; W687-F709 HydrophobicContact CG-CE2 3.75Å; W687-F709 AromaticContact CG-CZ 3.57Å; W687-F709 HydrophobicContact CG-CZ 3.57Å; W687-V710 CarbonylContact O-C 3.57Å; W687-V710 WeakPolarHBondContact O-CA 3.41Å; W687-I711 HydrophobicContact CE3-CD1 4.13Å; W687-I711 HydrophobicContact CE3-CG1 4.43Å; W687-I711 HydrophobicContact CZ3-CD1 4.07Å; W687-I711 PolarHBondContact O-N 3.07Å; W687-L778 HydrophobicContact CZ3-CD2 4.02Å; W687-L778 HydrophobicContact CZ3-CG 4.22Å; W687-V782 HydrophobicContact CE3-CG2 4.14Å; W687-V782 HydrophobicContact CH2-CB 4.3Å; W687-V782 HydrophobicContact CH2-CG2 3.88Å; W687-V782 HydrophobicContact CZ2-CB 4.38Å; W687-V782 HydrophobicContact CZ2-CG1 4.17Å; W687-V782 HydrophobicContact CZ2-CG2 4.32Å; W687-V782 HydrophobicContact CZ3-CG2 3.77Å
688	Y	95.6	Very high	88.8	Confident	21 Å²	21	54.4 Å²	54.4	8%	0.082	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-102.5	105.2	170.6	-177.4	-115.6	0	0	0	110.3	P653 F654 S684 P690 I711 N713 F721 L778	P653-Y688 HydrophobicContact CG-CE1 3.96Å; F654-Y688 AromaticContact CE2-CD1 3.98Å; F654-Y688 HydrophobicContact CE2-CD1 3.98Å; F654-Y688 HydrophobicContact CE2-CE1 4.17Å; F654-Y688 HydrophobicContact CZ-CD1 4.45Å; S684-Y688 WeakPolarHBondContact O-CB 3.43Å; S684-Y688 PolarHBondContact O-N 2.8Å; Y688-P690 HydrophobicContact CD1-CG 4.47Å; Y688-P690 HydrophobicContact CE1-CB 4.08Å; Y688-P690 HydrophobicContact CE1-CG 3.98Å; Y688-P690 HydrophobicContact CE2-CB 4.45Å; Y688-I711 CarbonylContact C-O 3.6Å; Y688-I711 WeakPolarHBondContact CA-O 3.28Å; Y688-I711 HydrophobicContact CD2-CB 4.29Å; Y688-I711 HydrophobicContact CD2-CG2 4.25Å; Y688-N713 PolarHBondContact OH-OD1 2.98Å; Y688-N713 VanDerWaalsContact OH-OD1 3.12Å; Y688-F721 HydrophobicContact CE2-CD1 4.01Å; Y688-F721 HydrophobicContact CE2-CE1 4.13Å; Y688-L778 HydrophobicContact CD2-CD2 3.64Å; Y688-L778 HydrophobicContact CE2-CD2 3.82Å; Y688-L778 HydrophobicContact CG-CD2 4.42Å
689	L	92.4	Very high	89.2	Confident	54 Å²	54	48.2 Å²	48.2	28%	0.283	27%	0.274	S	S	.	.			trans	-121.1	82.8	-178.7	-60.6	-179.5	0	0	0	108.1	G691 I692 L700 V710 I711 R712	L689-G691 VanDerWaalsContact C-N 3.29Å; L689-G691 PolarHBondContact O-N 2.78Å; L689-G691 VanDerWaalsContact O-N 3.14Å; L689-I692 HydrophobicContact CB-CB 4.24Å; L689-I692 HydrophobicContact CB-CG2 3.86Å; L689-I692 HydrophobicContact CD1-CD1 4.04Å; L689-I692 VanDerWaalsContact O-CG2 3.28Å; L689-I692 WeakPolarHBondContact O-CG2 3.43Å; L689-I692 PolarHBondContact O-N 2.75Å; L689-L700 HydrophobicContact CD1-CD1 4.29Å; L689-V710 HydrophobicContact CB-CG1 4.03Å; L689-V710 HydrophobicContact CD1-CG1 3.95Å; L689-V710 HydrophobicContact CG-CG1 4.12Å; L689-I711 PolarHBondContact N-O 3.35Å; L689-R712 WeakPolarHBondContact O-CA 3.48Å; L689-R712 WeakPolarHBondContact O-CB 3.42Å
690	P	90.1	Very high	89.4	Confident	55 Å²	55	45.8 Å²	45.8	36%	0.357	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-29	-164.9	19.3	-31.7	0	0	0	115.2	Y688 N713	Y688-P690 HydrophobicContact CD1-CG 4.47Å; Y688-P690 HydrophobicContact CE1-CB 4.08Å; Y688-P690 HydrophobicContact CE1-CG 3.98Å; Y688-P690 HydrophobicContact CE2-CB 4.45Å; P690-N713 VanDerWaalsContact O-CB 3.3Å; P690-N713 WeakPolarHBondContact O-CB 3.3Å; P690-N713 PolarHBondContact O-N 2.76Å
691	G	88.1	Confident	89.4	Confident	83 Å²	83	46.1 Å²	46.1	86%	0.856	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	16.8	-173.4	0	0	0	0	0	116.3	L689	L689-G691 VanDerWaalsContact C-N 3.29Å; L689-G691 PolarHBondContact O-N 2.78Å; L689-G691 VanDerWaalsContact O-N 3.14Å
692	I	88.6	Confident	89.2	Confident	31 Å²	31	49 Å²	49	16%	0.159	27%	0.272	C	S	.	.			trans	-85.6	146.1	-178.9	-165.2	165.5	0	0	0	112.3	L689 D696 V697 L700 V710 R712	L689-I692 HydrophobicContact CB-CB 4.24Å; L689-I692 HydrophobicContact CB-CG2 3.86Å; L689-I692 HydrophobicContact CD1-CD1 4.04Å; L689-I692 VanDerWaalsContact O-CG2 3.28Å; L689-I692 WeakPolarHBondContact O-CG2 3.43Å; L689-I692 PolarHBondContact O-N 2.75Å; I692-D696 HydrophobicContact CD1-CB 3.92Å; I692-D696 HydrophobicContact CG1-CB 3.61Å; I692-V697 HydrophobicContact CB-CG2 4.23Å; I692-V697 HydrophobicContact CD1-CG2 3.93Å; I692-V697 HydrophobicContact CG1-CG2 3.92Å; I692-V697 HydrophobicContact CG2-CG2 3.3Å; I692-L700 HydrophobicContact CD1-CD1 3.38Å; I692-V710 HydrophobicContact CG2-CG1 4.37Å; I692-R712 HydrophobicContact CG2-CB 3.8Å; I692-R712 WeakPolarHBondContact O-CD 3.45Å; I692-R712 PolarHBondContact O-NH1 3.5Å
693	S	88.7	Confident	89.1	Confident	36 Å²	36	50.9 Å²	50.9	25%	0.252	28%	0.281	S	S	.	.			trans	-78.5	157.9	178.1	82.3	0	0	0	0	112.4	P695 D696 V697	S693-P695 WeakPolarHBondContact OG-CD 3.38Å; S693-D696 WeakPolarHBondContact CB-OD2 3.29Å; S693-D696 PolarHBondContact O-N 3.19Å; S693-D696 PolarHBondContact OG-N 3.31Å; S693-D696 PolarHBondContact OG-OD2 3.25Å; S693-V697 WeakPolarHBondContact O-CG2 3.49Å; S693-V697 PolarHBondContact O-N 3.44Å
694	R	86.4	Confident	89	Confident	46 Å²	46	56.1 Å²	56.1	17%	0.174	30%	0.304	C	S	.	.	H	α-helix	trans	-60.2	-43.4	176.7	-172.4	-172.5	-173.8	-80.2	6.3	112.1	E404 E406 V697 I698	E404-R694 PolarHBondContact O-NE 2.93Å; E404-R694 PolarHBondContact O-NH2 3.03Å; E406-R694 HydrophobicContact CG-CB 4.42Å; E406-R694 WeakPolarHBondContact OE2-CB 3.5Å; R694-V697 PolarHBondContact O-N 3.48Å; R694-I698 HydrophobicContact CG-CD1 4.48Å; R694-I698 WeakPolarHBondContact O-CG1 3.34Å; R694-I698 PolarHBondContact O-N 2.91Å
695	P	89.1	Confident	88.9	Confident	83 Å²	83	60.2 Å²	60.2	54%	0.539	32%	0.321	S	S	.	.	H	α-helix	trans	-59.2	-43.4	172.8	-26.5	36	0	0	0	114.5	S693 V697 I698 A699	S693-P695 WeakPolarHBondContact OG-CD 3.38Å; P695-V697 VanDerWaalsContact C-N 3.29Å; P695-V697 PolarHBondContact O-N 2.87Å; P695-I698 WeakPolarHBondContact O-CB 3.19Å; P695-I698 PolarHBondContact O-N 3.39Å; P695-A699 PolarHBondContact O-N 2.78Å
696	D	89.3	Confident	89	Confident	87 Å²	87	57.2 Å²	57.2	47%	0.465	31%	0.312	S	S	.	.	H	α-helix	trans	-64.3	-35.5	-178.9	-62.7	-43.3	0	0	0	111.8	I692 S693 A699 L700	I692-D696 HydrophobicContact CD1-CB 3.92Å; I692-D696 HydrophobicContact CG1-CB 3.61Å; S693-D696 WeakPolarHBondContact CB-OD2 3.29Å; S693-D696 PolarHBondContact O-N 3.19Å; S693-D696 PolarHBondContact OG-N 3.31Å; S693-D696 PolarHBondContact OG-OD2 3.25Å; D696-A699 PolarHBondContact O-N 2.77Å; D696-L700 WeakPolarHBondContact O-CB 3.42Å; D696-L700 WeakPolarHBondContact O-CG 3.41Å; D696-L700 PolarHBondContact O-N 3.12Å
697	V	90.5	Very high	89.2	Confident	1 Å²	1	53 Å²	53	1%	0.006	30%	0.295	C	S	.	.	H	α-helix	trans	-68.2	-40	176.2	175.8	0	0	0	0	111.8	I692 S693 R694 P695 A699 L700 L701 V710 A724	I692-V697 HydrophobicContact CB-CG2 4.23Å; I692-V697 HydrophobicContact CD1-CG2 3.93Å; I692-V697 HydrophobicContact CG1-CG2 3.92Å; I692-V697 HydrophobicContact CG2-CG2 3.3Å; S693-V697 WeakPolarHBondContact O-CG2 3.49Å; S693-V697 PolarHBondContact O-N 3.44Å; R694-V697 PolarHBondContact O-N 3.48Å; P695-V697 VanDerWaalsContact C-N 3.29Å; P695-V697 PolarHBondContact O-N 2.87Å; V697-A699 VanDerWaalsContact C-N 3.33Å; V697-L700 PolarHBondContact O-N 3.42Å; V697-L701 HydrophobicContact CG1-CD1 3.8Å; V697-L701 HydrophobicContact CG1-CG 4.35Å; V697-L701 WeakPolarHBondContact O-CB 3.36Å; V697-L701 WeakPolarHBondContact O-CG 3.3Å; V697-L701 PolarHBondContact O-N 3.36Å; V697-V710 HydrophobicContact CG1-CB 3.87Å; V697-V710 HydrophobicContact CG1-CG1 4.35Å; V697-V710 HydrophobicContact CG1-CG2 4.33Å; V697-V710 HydrophobicContact CG2-CB 4.46Å; V697-V710 HydrophobicContact CG2-CG1 4.05Å; V697-A724 HydrophobicContact CG1-CB 3.25Å
698	I	88.1	Confident	89.1	Confident	19 Å²	19	54.2 Å²	54.2	10%	0.097	30%	0.304	C	S	.	.	H	α-helix	trans	-60	-46.7	172.2	-66.4	161.3	0	0	0	109.5	R694 P695 L700 L701 R702 Q742 V746	R694-I698 HydrophobicContact CG-CD1 4.48Å; R694-I698 WeakPolarHBondContact O-CG1 3.34Å; R694-I698 PolarHBondContact O-N 2.91Å; P695-I698 WeakPolarHBondContact O-CB 3.19Å; P695-I698 PolarHBondContact O-N 3.39Å; I698-L700 VanDerWaalsContact C-N 3.35Å; I698-L700 PolarHBondContact O-N 3.05Å; I698-L701 PolarHBondContact O-N 3.22Å; I698-R702 WeakPolarHBondContact O-CB 3.43Å; I698-R702 PolarHBondContact O-N 3.19Å; I698-Q742 VanDerWaalsContact CG2-O 3.25Å; I698-Q742 WeakPolarHBondContact CG2-O 3.27Å; I698-V746 HydrophobicContact CG1-CG1 4.48Å
699	A	88.3	Confident	89.1	Confident	34 Å²	34	53.7 Å²	53.7	28%	0.281	30%	0.302	S	S	.	.	H	α-helix	trans	-61.9	-37.7	177.3	0	0	0	0	0	113.3	P695 D696 V697	P695-A699 PolarHBondContact O-N 2.78Å; D696-A699 PolarHBondContact O-N 2.77Å; V697-A699 VanDerWaalsContact C-N 3.33Å
700	L	89.1	Confident	89.2	Confident	53 Å²	53	51.5 Å²	51.5	28%	0.277	29%	0.291	S	S	.	.	H	α-helix	trans	-69.6	-36.3	175.5	-80.8	172.4	0	0	0	113.7	L689 I692 D696 V697 I698 K704 L822	L689-L700 HydrophobicContact CD1-CD1 4.29Å; I692-L700 HydrophobicContact CD1-CD1 3.38Å; D696-L700 WeakPolarHBondContact O-CB 3.42Å; D696-L700 WeakPolarHBondContact O-CG 3.41Å; D696-L700 PolarHBondContact O-N 3.12Å; V697-L700 PolarHBondContact O-N 3.42Å; I698-L700 VanDerWaalsContact C-N 3.35Å; I698-L700 PolarHBondContact O-N 3.05Å; L700-K704 VanDerWaalsContact O-CE 3.25Å; L700-K704 WeakPolarHBondContact O-CE 3.46Å; L700-K704 WeakPolarHBondContact O-CG 3.46Å; L700-L822 HydrophobicContact CD2-CD2 3.84Å
701	L	90.9	Very high	89.5	Confident	6 Å²	6	48.9 Å²	48.9	3%	0.031	27%	0.274	C	S	.	.	H	α-helix	trans	-93.7	-25.3	-172.4	-72.9	-180	0	0	0	114.2	V697 I698 D703 K704 V710 A724 K726 V746	V697-L701 HydrophobicContact CG1-CD1 3.8Å; V697-L701 HydrophobicContact CG1-CG 4.35Å; V697-L701 WeakPolarHBondContact O-CB 3.36Å; V697-L701 WeakPolarHBondContact O-CG 3.3Å; V697-L701 PolarHBondContact O-N 3.36Å; I698-L701 PolarHBondContact O-N 3.22Å; L701-D703 PolarHBondContact O-N 3.11Å; L701-K704 WeakPolarHBondContact O-CB 3.34Å; L701-K704 PolarHBondContact O-N 2.79Å; L701-K704 VanDerWaalsContact O-N 3.09Å; L701-V710 HydrophobicContact CD1-CG2 4.35Å; L701-V710 HydrophobicContact CD2-CG2 4.22Å; L701-V710 HydrophobicContact CG-CG2 4.26Å; L701-A724 HydrophobicContact CD1-CB 3.74Å; L701-K726 HydrophobicContact CB-CB 4.37Å; L701-K726 WeakPolarHBondContact O-CD 3.34Å; L701-V746 HydrophobicContact CB-CG1 4.09Å; L701-V746 HydrophobicContact CB-CG2 3.88Å; L701-V746 HydrophobicContact CD1-CG1 3.89Å
702	R	85.1	Confident	89.8	Confident	136 Å²	136	45.1 Å²	45.1	51%	0.513	23%	0.234	S	C	.	.	H	α-helix	trans	-54.2	-39.6	-176.6	74.5	-176.6	-168.3	-162.4	-4.2	112.6	I698 K704 K726	I698-R702 WeakPolarHBondContact O-CB 3.43Å; I698-R702 PolarHBondContact O-N 3.19Å; R702-K704 VanDerWaalsContact C-N 3.34Å; R702-K704 PolarHBondContact O-N 2.92Å; R702-K726 PolarHBondContact O-NZ 3.02Å
703	D	82.7	Confident	90	Very high	106 Å²	106	46 Å²	46	57%	0.567	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.6	21.6	-175.5	-60.2	-39.7	0	0	0	112.6	L701	L701-D703 PolarHBondContact O-N 3.11Å
704	K	87	Confident	90.1	Very high	111 Å²	111	45 Å²	45	48%	0.483	23%	0.232	S	C	.	.	S	Bend	trans	-113.5	164.5	-178.8	-55.3	-59.6	177.6	-162.3	0	113	L700 L701 R702 K726	L700-K704 VanDerWaalsContact O-CE 3.25Å; L700-K704 WeakPolarHBondContact O-CE 3.46Å; L700-K704 WeakPolarHBondContact O-CG 3.46Å; L701-K704 WeakPolarHBondContact O-CB 3.34Å; L701-K704 PolarHBondContact O-N 2.79Å; L701-K704 VanDerWaalsContact O-N 3.09Å; R702-K704 VanDerWaalsContact C-N 3.34Å; R702-K704 PolarHBondContact O-N 2.92Å; K704-K726 VanDerWaalsContact O-CE 3.24Å; K704-K726 WeakPolarHBondContact O-CE 3.36Å; K704-K726 WeakPolarHBondContact O-CG 3.29Å
705	E	87.4	Confident	90	Very high	111 Å²	111	48.1 Å²	48.1	52%	0.519	25%	0.252	S	S	.	.			trans	-60.3	141.4	172.3	-82.3	-81.8	102.5	0	0	112.2	G707 S708 R797	E705-G707 PolarHBondContact O-N 2.86Å; E705-S708 WeakPolarHBondContact O-CB 3.17Å; E705-S708 PolarHBondContact O-N 3.3Å; E705-S708 PolarHBondContact O-OG 3.44Å; E705-R797 IonicContact OE2-CZ 2.85Å; E705-R797 IonicContact OE2-NH1 2.69Å; E705-R797 PolarHBondContact OE2-NH1 2.91Å; E705-R797 IonicContact OE2-NH2 3.96Å; E705-R797 PolarHBondContact OE2-NH2 2.93Å
706	P	89.7	Confident	89.6	Confident	39 Å²	39	46.8 Å²	46.8	25%	0.253	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	136.3	166.8	-28.1	36.9	0	0	0	112.8	P728 R797	P706-P728 HydrophobicContact CB-CB 3.94Å; P706-P728 HydrophobicContact CG-CB 4.14Å; P706-R797 WeakPolarHBondContact O-CD 3.42Å; P706-R797 PolarHBondContact O-NH1 3.37Å
707	G	91.6	Very high	89.4	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.01	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.9	-12.4	-170.6	0	0	0	0	0	114.4	E705 K726 T795 R797	E705-G707 PolarHBondContact O-N 2.86Å; G707-K726 PolarHBondContact N-O 2.89Å; G707-T795 VanDerWaalsContact CA-O 3.3Å; G707-T795 WeakPolarHBondContact CA-O 3.25Å; G707-R797 PolarHBondContact O-N 2.86Å
708	S	92.8	Very high	89.1	Confident	26 Å²	26	50.7 Å²	50.7	18%	0.182	27%	0.266	C	S	.	.			trans	-68.2	136.4	174.1	-55	0	0	0	0	110.9	E705 K726	E705-S708 WeakPolarHBondContact O-CB 3.17Å; E705-S708 PolarHBondContact O-N 3.3Å; E705-S708 PolarHBondContact O-OG 3.44Å; S708-K726 WeakPolarHBondContact O-CB 3.46Å; S708-K726 PolarHBondContact O-N 2.7Å
709	F	95.5	Very high	88.9	Confident	9 Å²	9	55.7 Å²	55.7	4%	0.039	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	158.5	-170.9	73.7	-77.5	0	0	0	113.4	W687 I711 L723 A724 L725 V782 L796 R797 L798	W687-F709 HydrophobicContact CB-CD2 4.24Å; W687-F709 HydrophobicContact CB-CE1 4.29Å; W687-F709 HydrophobicContact CB-CE2 3.65Å; W687-F709 HydrophobicContact CB-CZ 3.67Å; W687-F709 AromaticContact CD1-CZ 3.99Å; W687-F709 AromaticContact CD2-CE2 3.8Å; W687-F709 HydrophobicContact CD2-CE2 3.8Å; W687-F709 AromaticContact CD2-CZ 3.88Å; W687-F709 HydrophobicContact CD2-CZ 3.88Å; W687-F709 AromaticContact CE3-CE2 3.83Å; W687-F709 HydrophobicContact CE3-CE2 3.83Å; W687-F709 HydrophobicContact CE3-CZ 4.36Å; W687-F709 HydrophobicContact CG-CE1 4.47Å; W687-F709 AromaticContact CG-CE2 3.75Å; W687-F709 HydrophobicContact CG-CE2 3.75Å; W687-F709 AromaticContact CG-CZ 3.57Å; W687-F709 HydrophobicContact CG-CZ 3.57Å; F709-I711 HydrophobicContact CD2-CD1 4.36Å; F709-I711 HydrophobicContact CD2-CG1 4.08Å; F709-I711 HydrophobicContact CE2-CD1 4.17Å; F709-I711 HydrophobicContact CE2-CG1 4.27Å; F709-L723 HydrophobicContact CB-CD1 4.06Å; F709-L723 HydrophobicContact CD2-CD1 3.91Å; F709-L723 HydrophobicContact CG-CD1 4.42Å; F709-A724 VanDerWaalsContact CA-O 3.24Å; F709-A724 WeakPolarHBondContact CA-O 3.49Å; F709-A724 WeakPolarHBondContact CB-O 3.25Å; F709-L725 HydrophobicContact CB-CD1 4.06Å; F709-V782 HydrophobicContact CE2-CG1 4.23Å; F709-V782 HydrophobicContact CE2-CG2 3.98Å; F709-V782 HydrophobicContact CZ-CG1 3.74Å; F709-V782 HydrophobicContact CZ-CG2 4.34Å; F709-L796 HydrophobicContact CB-CD2 3.85Å; F709-L796 HydrophobicContact CD1-CB 3.84Å; F709-L796 HydrophobicContact CD1-CD1 4.42Å; F709-L796 HydrophobicContact CD1-CD2 4.02Å; F709-L796 HydrophobicContact CD1-CG 4.3Å; F709-L796 HydrophobicContact CD2-CD1 4.14Å; F709-L796 HydrophobicContact CD2-CD2 4.31Å; F709-L796 HydrophobicContact CE1-CB 3.86Å; F709-L796 HydrophobicContact CE1-CD1 4.37Å; F709-L796 HydrophobicContact CE2-CD1 4.07Å; F709-L796 HydrophobicContact CG-CB 4.44Å; F709-L796 HydrophobicContact CG-CD1 4.32Å; F709-L796 HydrophobicContact CG-CD2 3.81Å; F709-L796 HydrophobicContact CG-CG 4.4Å; F709-L796 HydrophobicContact CZ-CB 4.44Å; F709-L796 HydrophobicContact CZ-CD1 4.2Å; F709-R797 WeakPolarHBondContact CE1-O 3.35Å; F709-L798 HydrophobicContact CE1-CD2 4.47Å; F709-L798 HydrophobicContact CZ-CD2 4.35Å
710	V	94.9	Very high	89	Confident	9 Å²	9	54.6 Å²	54.6	6%	0.055	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	138.8	170.1	177.6	0	0	0	0	108.5	W687 L689 I692 V697 L701 A724	W687-V710 CarbonylContact O-C 3.57Å; W687-V710 WeakPolarHBondContact O-CA 3.41Å; L689-V710 HydrophobicContact CB-CG1 4.03Å; L689-V710 HydrophobicContact CD1-CG1 3.95Å; L689-V710 HydrophobicContact CG-CG1 4.12Å; I692-V710 HydrophobicContact CG2-CG1 4.37Å; V697-V710 HydrophobicContact CG1-CB 3.87Å; V697-V710 HydrophobicContact CG1-CG1 4.35Å; V697-V710 HydrophobicContact CG1-CG2 4.33Å; V697-V710 HydrophobicContact CG2-CB 4.46Å; V697-V710 HydrophobicContact CG2-CG1 4.05Å; L701-V710 HydrophobicContact CD1-CG2 4.35Å; L701-V710 HydrophobicContact CD2-CG2 4.22Å; L701-V710 HydrophobicContact CG-CG2 4.26Å; V710-A724 PolarHBondContact N-O 2.88Å; V710-A724 PolarHBondContact O-N 2.8Å
711	I	96.3	Very high	89.3	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	131.1	171.3	-53.1	179.8	0	0	0	108.7	W687 Y688 L689 F709 F721 G722 L723 I751 L778 V782	W687-I711 HydrophobicContact CE3-CD1 4.13Å; W687-I711 HydrophobicContact CE3-CG1 4.43Å; W687-I711 HydrophobicContact CZ3-CD1 4.07Å; W687-I711 PolarHBondContact O-N 3.07Å; Y688-I711 CarbonylContact C-O 3.6Å; Y688-I711 WeakPolarHBondContact CA-O 3.28Å; Y688-I711 HydrophobicContact CD2-CB 4.29Å; Y688-I711 HydrophobicContact CD2-CG2 4.25Å; L689-I711 PolarHBondContact N-O 3.35Å; F709-I711 HydrophobicContact CD2-CD1 4.36Å; F709-I711 HydrophobicContact CD2-CG1 4.08Å; F709-I711 HydrophobicContact CE2-CD1 4.17Å; F709-I711 HydrophobicContact CE2-CG1 4.27Å; I711-F721 HydrophobicContact CG2-CB 3.73Å; I711-F721 HydrophobicContact CG2-CG 4.45Å; I711-G722 CarbonylContact C-O 3.4Å; I711-G722 VanDerWaalsContact CA-O 3.3Å; I711-G722 WeakPolarHBondContact CA-O 3.43Å; I711-L723 HydrophobicContact CD1-CD1 4.19Å; I711-L723 HydrophobicContact CG1-CB 4.3Å; I711-L723 HydrophobicContact CG1-CD1 3.67Å; I711-I751 HydrophobicContact CD1-CD1 4.09Å; I711-L778 HydrophobicContact CB-CD2 4.48Å; I711-L778 HydrophobicContact CD1-CD1 3.96Å; I711-L778 HydrophobicContact CD1-CD2 4.31Å; I711-L778 HydrophobicContact CD1-CG 4.15Å; I711-L778 HydrophobicContact CG2-CD1 4.25Å; I711-L778 HydrophobicContact CG2-CD2 3.94Å; I711-V782 HydrophobicContact CD1-CG2 3.71Å
712	R	94.3	Very high	89.5	Confident	4 Å²	4	53.2 Å²	53.2	2%	0.015	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	168.2	179.9	63	176.2	-157.1	133.3	5.3	110.6	E404 E406 L689 I692 N715 F721 G722	E404-R712 IonicContact OE1-NH2 3.48Å; E404-R712 PolarHBondContact OE1-NH2 2.83Å; E404-R712 VanDerWaalsContact OE1-NH2 3.12Å; E404-R712 IonicContact OE2-CZ 3.68Å; E404-R712 IonicContact OE2-NE 3.18Å; E404-R712 PolarHBondContact OE2-NE 2.92Å; E404-R712 IonicContact OE2-NH2 3.84Å; E404-R712 PolarHBondContact OE2-NH2 3.39Å; E406-R712 VanDerWaalsContact CD-NH2 3.35Å; E406-R712 IonicContact OE1-CZ 2.71Å; E406-R712 VanDerWaalsContact OE1-CZ 3.24Å; E406-R712 IonicContact OE1-NH1 2.64Å; E406-R712 PolarHBondContact OE1-NH1 2.89Å; E406-R712 IonicContact OE1-NH2 2.7Å; E406-R712 PolarHBondContact OE1-NH2 3.48Å; E406-R712 IonicContact OE2-NH1 3.68Å; L689-R712 WeakPolarHBondContact O-CA 3.48Å; L689-R712 WeakPolarHBondContact O-CB 3.42Å; I692-R712 HydrophobicContact CG2-CB 3.8Å; I692-R712 WeakPolarHBondContact O-CD 3.45Å; I692-R712 PolarHBondContact O-NH1 3.5Å; R712-N715 PolarHBondContact NH1-ND2 2.86Å; R712-F721 CarbonylContact O-C 3.57Å; R712-F721 WeakPolarHBondContact O-CA 3.41Å; R712-F721 VanDerWaalsContact O-CB 3.31Å; R712-F721 WeakPolarHBondContact O-CB 3.44Å; R712-G722 WeakPolarHBondContact CG-O 3.31Å; R712-G722 PolarHBondContact N-O 2.8Å; R712-G722 PolarHBondContact O-N 2.73Å
713	N	92.4	Very high	90	Very high	50 Å²	50	46.8 Å²	46.8	27%	0.267	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	141.9	165.2	-63.9	-8	0	0	0	108.7	Y688 P690	Y688-N713 PolarHBondContact OH-OD1 2.98Å; Y688-N713 VanDerWaalsContact OH-OD1 3.12Å; P690-N713 VanDerWaalsContact O-CB 3.3Å; P690-N713 WeakPolarHBondContact O-CB 3.3Å; P690-N713 PolarHBondContact O-N 2.76Å
714	S	90.3	Very high	90.5	Very high	14 Å²	14	41.8 Å²	41.8	10%	0.098	23%	0.225	C	C	.	.			trans	-75	131	172	-179.8	0	0	0	0	109.8	E404 T716 Y717 S720	E404-S714 WeakPolarHBondContact OE1-CA 3.39Å; E404-S714 WeakPolarHBondContact OE1-CB 3.26Å; E404-S714 PolarHBondContact OE1-OG 2.99Å; S714-T716 PolarHBondContact OG-N 2.65Å; S714-Y717 WeakPolarHBondContact CB-O 3.47Å; S714-Y717 PolarHBondContact OG-N 3.17Å; S714-S720 WeakPolarHBondContact CB-O 3.25Å; S714-S720 PolarHBondContact N-O 2.84Å
715	N	84	Confident	90.9	Very high	112 Å²	112	36.5 Å²	36.5	60%	0.599	20%	0.202	S	C	*	.	S	Bend	trans	-83.8	-21.6	176.7	-73	-31.6	0	0	0	112.2	E404 E406 R712	E404-N715 PolarHBondContact OE1-N 3.22Å; E406-N715 PolarHBondContact OE1-ND2 3.32Å; R712-N715 PolarHBondContact NH1-ND2 2.86Å
716	T	82.5	Confident	91.1	Very high	54 Å²	54	32.5 Å²	32.5	33%	0.331	18%	0.183	S	C	.	.	S	Bend	trans	-105.4	-21.6	-177.8	44	0	0	0	0	114.3	M405 S714	M405-T716 WeakPolarHBondContact O-CG2 3.41Å; M405-T716 PolarHBondContact O-OG1 3.06Å; S714-T716 PolarHBondContact OG-N 2.65Å
717	Y	85	Confident	91.1	Very high	102 Å²	102	30.8 Å²	30.8	40%	0.4	17%	0.171	S	C	.	.	S	Bend	trans	-117.5	110.4	176.4	-63	-83.7	0	0	0	111.1	S714 S720 L750	S714-Y717 WeakPolarHBondContact CB-O 3.47Å; S714-Y717 PolarHBondContact OG-N 3.17Å; Y717-S720 WeakPolarHBondContact O-CB 3.39Å; Y717-S720 PolarHBondContact O-N 3.44Å; Y717-L750 HydrophobicContact CD1-CD2 3.95Å; Y717-L750 HydrophobicContact CD2-CD1 3.74Å; Y717-L750 HydrophobicContact CD2-CD2 3.52Å; Y717-L750 HydrophobicContact CD2-CG 4.28Å; Y717-L750 HydrophobicContact CE1-CD2 4.25Å; Y717-L750 HydrophobicContact CE2-CD2 3.83Å; Y717-L750 HydrophobicContact CG-CD1 4.1Å; Y717-L750 HydrophobicContact CG-CD2 3.57Å
718	A	83	Confident	90.7	Very high	69 Å²	69	32.2 Å²	32.2	57%	0.57	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.9	146.1	174.9	0	0	0	0	0	111.9	S720	A718-S720 PolarHBondContact O-N 3.06Å; A718-S720 PolarHBondContact O-OG 3.22Å; A718-S720 VanDerWaalsContact O-OG 3.05Å
719	D	84	Confident	89.6	Confident	123 Å²	123	35.2 Å²	35.2	66%	0.658	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.2	37.4	-178.4	-57.3	-33	0	0	0	114.1	T753	D719-T753 WeakPolarHBondContact O-CB 3.24Å; D719-T753 WeakPolarHBondContact O-CG2 3.3Å; D719-T753 PolarHBondContact O-N 2.79Å; D719-T753 PolarHBondContact O-OG1 3.44Å
720	S	91.3	Very high	88.1	Confident	12 Å²	12	40 Å²	40	8%	0.084	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	160.5	178.6	-54.3	0	0	0	0	111	S714 Y717 A718 I751	S714-S720 WeakPolarHBondContact CB-O 3.25Å; S714-S720 PolarHBondContact N-O 2.84Å; Y717-S720 WeakPolarHBondContact O-CB 3.39Å; Y717-S720 PolarHBondContact O-N 3.44Å; A718-S720 PolarHBondContact O-N 3.06Å; A718-S720 PolarHBondContact O-OG 3.22Å; A718-S720 VanDerWaalsContact O-OG 3.05Å; S720-I751 CarbonylContact C-O 3.55Å; S720-I751 WeakPolarHBondContact CA-O 3.03Å
721	F	94.7	Very high	86.5	Confident	28 Å²	28	40.4 Å²	40.4	12%	0.123	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	137	-178.5	-49.6	-82.9	0	0	0	110.7	Y688 I711 R712 I751 T753 V764 L778	Y688-F721 HydrophobicContact CE2-CD1 4.01Å; Y688-F721 HydrophobicContact CE2-CE1 4.13Å; I711-F721 HydrophobicContact CG2-CB 3.73Å; I711-F721 HydrophobicContact CG2-CG 4.45Å; R712-F721 CarbonylContact O-C 3.57Å; R712-F721 WeakPolarHBondContact O-CA 3.41Å; R712-F721 VanDerWaalsContact O-CB 3.31Å; R712-F721 WeakPolarHBondContact O-CB 3.44Å; F721-I751 HydrophobicContact CB-CB 4.28Å; F721-I751 HydrophobicContact CD2-CG2 4.39Å; F721-I751 PolarHBondContact N-O 3.47Å; F721-I751 PolarHBondContact O-N 2.9Å; F721-T753 HydrophobicContact CE2-CG2 4.18Å; F721-V764 HydrophobicContact CE2-CG1 4.07Å; F721-L778 HydrophobicContact CD2-CD1 4.33Å
722	G	94.5	Very high	84.5	Confident	2 Å²	2	45.2 Å²	45.2	2%	0.021	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	122.2	170.1	0	0	0	0	0	110.2	I711 R712	I711-G722 CarbonylContact C-O 3.4Å; I711-G722 VanDerWaalsContact CA-O 3.3Å; I711-G722 WeakPolarHBondContact CA-O 3.43Å; R712-G722 WeakPolarHBondContact CG-O 3.31Å; R712-G722 PolarHBondContact N-O 2.8Å; R712-G722 PolarHBondContact O-N 2.73Å
723	L	95.6	Very high	82.4	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	117.4	170.6	163.8	66.3	0	0	0	108.8	F709 I711 H748 F749 I751 F781 L792	F709-L723 HydrophobicContact CB-CD1 4.06Å; F709-L723 HydrophobicContact CD2-CD1 3.91Å; F709-L723 HydrophobicContact CG-CD1 4.42Å; I711-L723 HydrophobicContact CD1-CD1 4.19Å; I711-L723 HydrophobicContact CG1-CB 4.3Å; I711-L723 HydrophobicContact CG1-CD1 3.67Å; L723-H748 CarbonylContact O-C 3.53Å; L723-H748 WeakPolarHBondContact O-CA 3.43Å; L723-F749 HydrophobicContact CB-CB 4.39Å; L723-F749 HydrophobicContact CD2-CB 4.42Å; L723-F749 HydrophobicContact CD2-CD2 4.44Å; L723-F749 HydrophobicContact CG-CD2 4.48Å; L723-F749 PolarHBondContact N-O 3.11Å; L723-F749 PolarHBondContact O-N 2.97Å; L723-I751 HydrophobicContact CB-CD1 3.89Å; L723-I751 HydrophobicContact CB-CG1 4.23Å; L723-I751 HydrophobicContact CD2-CD1 4.3Å; L723-F781 HydrophobicContact CD2-CE1 4.07Å; L723-F781 HydrophobicContact CD2-CZ 4.09Å; L723-L792 HydrophobicContact CD2-CD1 4.06Å; L723-L792 HydrophobicContact CD2-CD2 3.84Å
724	A	94.5	Very high	80.4	Confident	2 Å²	2	54 Å²	54	2%	0.017	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	138.3	167.4	0	0	0	0	0	110.4	V697 L701 F709 V710 V746 R747	V697-A724 HydrophobicContact CG1-CB 3.25Å; L701-A724 HydrophobicContact CD1-CB 3.74Å; F709-A724 VanDerWaalsContact CA-O 3.24Å; F709-A724 WeakPolarHBondContact CA-O 3.49Å; F709-A724 WeakPolarHBondContact CB-O 3.25Å; V710-A724 PolarHBondContact N-O 2.88Å; V710-A724 PolarHBondContact O-N 2.8Å; A724-V746 HydrophobicContact CB-CG1 4.15Å; A724-R747 WeakPolarHBondContact CA-O 3.25Å
725	L	94.4	Very high	78.3	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	122.8	-175.5	176.1	57	0	0	0	110.8	F709 I727 V746 R747 F749 L792 L796	F709-L725 HydrophobicContact CB-CD1 4.06Å; L725-I727 HydrophobicContact CD2-CG1 4.38Å; L725-I727 HydrophobicContact CG-CG1 4Å; L725-I727 WeakPolarHBondContact O-CG1 3.3Å; L725-V746 WeakPolarHBondContact O-CA 3.31Å; L725-R747 PolarHBondContact N-O 2.88Å; L725-R747 PolarHBondContact O-N 3.33Å; L725-F749 HydrophobicContact CB-CE2 4.3Å; L725-F749 HydrophobicContact CD2-CE2 4.49Å; L725-L792 HydrophobicContact CD2-CB 4.06Å; L725-L792 HydrophobicContact CD2-CD1 4.24Å; L725-L796 HydrophobicContact CD1-CD2 3.68Å; L725-L796 HydrophobicContact CD2-CD2 4.15Å; L725-L796 HydrophobicContact CG-CD2 4.46Å
726	K	93	Very high	76.5	Confident	26 Å²	26	57.7 Å²	57.7	11%	0.113	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	123.3	168.2	177.3	64.7	-179.2	-162.2	0	109.4	L701 R702 K704 G707 S708 W745 V746	L701-K726 HydrophobicContact CB-CB 4.37Å; L701-K726 WeakPolarHBondContact O-CD 3.34Å; R702-K726 PolarHBondContact O-NZ 3.02Å; K704-K726 VanDerWaalsContact O-CE 3.24Å; K704-K726 WeakPolarHBondContact O-CE 3.36Å; K704-K726 WeakPolarHBondContact O-CG 3.29Å; G707-K726 PolarHBondContact N-O 2.89Å; S708-K726 WeakPolarHBondContact O-CB 3.46Å; S708-K726 PolarHBondContact O-N 2.7Å; K726-W745 WeakPolarHBondContact CA-O 3.13Å; K726-W745 HydrophobicContact CD-CB 4.11Å; K726-V746 HydrophobicContact CD-CG2 4.14Å
727	I	89.2	Confident	74.9	Confident	3 Å²	3	60.9 Å²	60.9	2%	0.015	34%	0.342	C	S	.	.			trans	-112.9	147.1	-168	-77	164.5	0	0	0	110.1	L725 S731 W745 R747 P793	L725-I727 HydrophobicContact CD2-CG1 4.38Å; L725-I727 HydrophobicContact CG-CG1 4Å; L725-I727 WeakPolarHBondContact O-CG1 3.3Å; I727-S731 WeakPolarHBondContact CG2-OG 3.22Å; I727-W745 PolarHBondContact N-O 2.55Å; I727-R747 HydrophobicContact CD1-CB 3.59Å; I727-R747 HydrophobicContact CD1-CG 3.56Å; I727-P793 HydrophobicContact CD1-CB 3.89Å; I727-P793 HydrophobicContact CD1-CG 3.69Å; I727-P793 HydrophobicContact CG1-CB 4.09Å; I727-P793 HydrophobicContact CG1-CG 4.38Å; I727-P793 HydrophobicContact CG2-CB 4.3Å
728	P	83	Confident	73.1	Confident	31 Å²	31	64.8 Å²	64.8	20%	0.201	36%	0.361	C	S	.	.			trans	-67.4	144.6	178	27.4	-35.3	0	0	0	111.3	P706 S730 S731	P706-P728 HydrophobicContact CB-CB 3.94Å; P706-P728 HydrophobicContact CG-CB 4.14Å; P728-S730 PolarHBondContact O-N 2.81Å; P728-S731 VanDerWaalsContact O-CB 3.3Å; P728-S731 WeakPolarHBondContact O-CB 3.3Å; P728-S731 PolarHBondContact O-N 3.35Å
729	P	69.9	Low	71.5	Confident	90 Å²	90	67.9 Å²	67.9	58%	0.584	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-7.5	-173.1	26.1	-34.4	0	0	0	115.3	W745	P729-W745 HydrophobicContact CB-CD2 4.26Å; P729-W745 HydrophobicContact CB-CE3 4.04Å; P729-W745 HydrophobicContact CB-CH2 3.54Å; P729-W745 HydrophobicContact CB-CZ2 3.81Å; P729-W745 HydrophobicContact CB-CZ3 3.73Å; P729-W745 WeakPolarHBondContact O-CH2 3.49Å; P729-W745 WeakPolarHBondContact O-CZ3 3.4Å
730	S	64.7	Low	70.1	Confident	108 Å²	108	64.7 Å²	64.7	76%	0.755	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-5.6	170.5	51.3	0	0	0	0	114.4	P728	P728-S730 PolarHBondContact O-N 2.81Å
731	S	60.6	Low	68.2	Low	18 Å²	18	71 Å²	71	13%	0.126	38%	0.383	C	S	.	.	S	Bend	trans	-68.9	132.9	175.8	-170.6	0	0	0	0	110.4	I727 P728 R733 R747	I727-S731 WeakPolarHBondContact CG2-OG 3.22Å; P728-S731 VanDerWaalsContact O-CB 3.3Å; P728-S731 WeakPolarHBondContact O-CB 3.3Å; P728-S731 PolarHBondContact O-N 3.35Å; S731-R733 PolarHBondContact O-N 2.88Å; S731-R733 VanDerWaalsContact O-N 3.13Å; S731-R747 PolarHBondContact OG-NH2 2.9Å
732	P	54	Low	66	Low	102 Å²	102	77.8 Å²	77.8	66%	0.662	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-60.1	119.1	-173.7	22	-33	0	0	0	111.7	I734 R747	P732-I734 PolarHBondContact O-N 2.9Å; P732-R747 PolarHBondContact O-NH2 2.84Å
733	R	50.1	Low	64.4	Low	128 Å²	128	78.4 Å²	78.4	48%	0.483	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-64	117	174.3	-65.2	-172	-178.2	-144.4	0.1	109.1	S731 I735 E744	S731-R733 PolarHBondContact O-N 2.88Å; S731-R733 VanDerWaalsContact O-N 3.13Å; R733-I735 HydrophobicContact CB-CD1 4.42Å; R733-I735 HydrophobicContact CB-CG1 3.76Å; R733-E744 IonicContact CZ-OE1 2.72Å; R733-E744 IonicContact NH1-OE1 3.8Å; R733-E744 PolarHBondContact NH1-OE1 3.47Å; R733-E744 VanDerWaalsContact NH2-CD 3.31Å; R733-E744 IonicContact NH2-OE1 2.74Å; R733-E744 PolarHBondContact NH2-OE1 2.91Å; R733-E744 IonicContact NH2-OE2 3.14Å
734	I	49.7	Very low	63.1	Low	109 Å²	109	82.5 Å²	82.5	56%	0.559	44%	0.438	S	S	*	.			trans	-94.3	91.5	161.1	-59.8	177.1	0	0	0	103.8	P732 S736	P732-I734 PolarHBondContact O-N 2.9Å; I734-S736 PolarHBondContact O-N 2.92Å
735	I	47.7	Very low	62.6	Low	136 Å²	136	85.1 Å²	85.1	70%	0.697	45%	0.448	S	S	*	.			trans	-74.8	108.9	-173.5	-56.2	175.6	0	0	0	108.2	R733	R733-I735 HydrophobicContact CB-CD1 4.42Å; R733-I735 HydrophobicContact CB-CG1 3.76Å
736	S	45.4	Very low	62.3	Low	68 Å²	68	85.4 Å²	85.4	48%	0.476	45%	0.449	S	S	.	.			trans	-142.4	118	175.8	53.9	0	0	0	0	111.5	I734	I734-S736 PolarHBondContact O-N 2.92Å
737	N	49.2	Very low	62.1	Low	121 Å²	121	86.4 Å²	86.4	65%	0.647	45%	0.452	S	S	*	.			trans	77.4	150.3	177	-48.6	-37.6	0	0	0	115.9	D739 D740	N737-D739 VanDerWaalsContact C-N 3.35Å; N737-D739 PolarHBondContact O-N 2.78Å; N737-D740 WeakPolarHBondContact O-CB 3.33Å
738	K	45.7	Very low	62.3	Low	184 Å²	184	86.4 Å²	86.4	80%	0.8	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-75.8	-19.7	-170.4	-77.5	-174.5	173.7	-178.2	0	114.2	D740 I741	K738-D740 PolarHBondContact O-N 3.45Å; K738-I741 WeakPolarHBondContact O-CG1 3.31Å
739	D	51.4	Low	62.8	Low	134 Å²	134	85.1 Å²	85.1	72%	0.717	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-73.9	-13.1	-178.2	-46.2	-71.2	0	0	0	112.5	N737 I741 Q742	N737-D739 VanDerWaalsContact C-N 3.35Å; N737-D739 PolarHBondContact O-N 2.78Å; D739-I741 PolarHBondContact O-N 3.23Å; D739-I741 VanDerWaalsContact O-N 3.17Å; D739-Q742 PolarHBondContact O-N 3.41Å
740	D	53.9	Low	63.9	Low	56 Å²	56	81.2 Å²	81.2	30%	0.299	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-63.5	-16.7	177	-166	33.7	0	0	0	113.2	N737 K738 Q742 S743 E744	N737-D740 WeakPolarHBondContact O-CB 3.33Å; K738-D740 PolarHBondContact O-N 3.45Å; D740-Q742 PolarHBondContact O-N 3.05Å; D740-S743 CarbonylContact O-C 3.56Å; D740-S743 WeakPolarHBondContact O-CA 3.16Å; D740-S743 PolarHBondContact O-N 3.14Å; D740-E744 WeakPolarHBondContact O-CA 3.43Å; D740-E744 PolarHBondContact O-N 2.78Å
741	I	50.2	Low	65.3	Low	144 Å²	144	76.1 Å²	76.1	74%	0.738	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-58.6	-33.2	176.9	-61.4	170.5	0	0	0	111.9	K738 D739	K738-I741 WeakPolarHBondContact O-CG1 3.31Å; D739-I741 PolarHBondContact O-N 3.23Å; D739-I741 VanDerWaalsContact O-N 3.17Å
742	Q	49.8	Very low	66.8	Low	171 Å²	171	75.2 Å²	75.2	80%	0.799	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-86.5	-15.4	173.6	-64.7	-166.5	1.3	0	0	113.4	I698 D739 D740	I698-Q742 VanDerWaalsContact CG2-O 3.25Å; I698-Q742 WeakPolarHBondContact CG2-O 3.27Å; D739-Q742 PolarHBondContact O-N 3.41Å; D740-Q742 PolarHBondContact O-N 3.05Å
743	S	61.4	Low	68.5	Low	15 Å²	15	72.1 Å²	72.1	11%	0.105	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	5.8	-175.7	-52.3	0	0	0	0	113.4	D740 W745 V746	D740-S743 CarbonylContact O-C 3.56Å; D740-S743 WeakPolarHBondContact O-CA 3.16Å; D740-S743 PolarHBondContact O-N 3.14Å; S743-W745 PolarHBondContact O-N 3.25Å; S743-V746 PolarHBondContact O-N 2.79Å
744	E	67.8	Low	70.3	Confident	86 Å²	86	67.5 Å²	67.5	40%	0.402	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.9	-21.4	-153.5	-155.8	-167.6	-157.6	0	0	117.1	R733 D740	R733-E744 IonicContact CZ-OE1 2.72Å; R733-E744 IonicContact NH1-OE1 3.8Å; R733-E744 PolarHBondContact NH1-OE1 3.47Å; R733-E744 VanDerWaalsContact NH2-CD 3.31Å; R733-E744 IonicContact NH2-OE1 2.74Å; R733-E744 PolarHBondContact NH2-OE1 2.91Å; R733-E744 IonicContact NH2-OE2 3.14Å; D740-E744 WeakPolarHBondContact O-CA 3.43Å; D740-E744 PolarHBondContact O-N 2.78Å
745	W	82.4	Confident	72	Confident	58 Å²	58	67.3 Å²	67.3	22%	0.22	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.2	15.8	179.5	-50.9	104.2	0	0	0	114.6	K726 I727 P729 S743	K726-W745 WeakPolarHBondContact CA-O 3.13Å; K726-W745 HydrophobicContact CD-CB 4.11Å; I727-W745 PolarHBondContact N-O 2.55Å; P729-W745 HydrophobicContact CB-CD2 4.26Å; P729-W745 HydrophobicContact CB-CE3 4.04Å; P729-W745 HydrophobicContact CB-CH2 3.54Å; P729-W745 HydrophobicContact CB-CZ2 3.81Å; P729-W745 HydrophobicContact CB-CZ3 3.73Å; P729-W745 WeakPolarHBondContact O-CH2 3.49Å; P729-W745 WeakPolarHBondContact O-CZ3 3.4Å; S743-W745 PolarHBondContact O-N 3.25Å
746	V	88.9	Confident	73.7	Confident	5 Å²	5	62.2 Å²	62.2	3%	0.03	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	94.1	-177.1	-175.1	0	0	0	0	110.3	I698 L701 A724 L725 K726 S743 H748	I698-V746 HydrophobicContact CG1-CG1 4.48Å; L701-V746 HydrophobicContact CB-CG1 4.09Å; L701-V746 HydrophobicContact CB-CG2 3.88Å; L701-V746 HydrophobicContact CD1-CG1 3.89Å; A724-V746 HydrophobicContact CB-CG1 4.15Å; L725-V746 WeakPolarHBondContact O-CA 3.31Å; K726-V746 HydrophobicContact CD-CG2 4.14Å; S743-V746 PolarHBondContact O-N 2.79Å; V746-H748 PolarHBondContact O-CE1 2.95Å; V746-H748 PolarHBondContact O-ND1 2.8Å
747	R	89.9	Confident	75.2	Confident	47 Å²	47	67.7 Å²	67.7	18%	0.177	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	155	176.4	-64.3	-175.5	-145.9	-122.4	11.3	111.7	A724 L725 I727 S731 P732 F749	A724-R747 WeakPolarHBondContact CA-O 3.25Å; L725-R747 PolarHBondContact N-O 2.88Å; L725-R747 PolarHBondContact O-N 3.33Å; I727-R747 HydrophobicContact CD1-CB 3.59Å; I727-R747 HydrophobicContact CD1-CG 3.56Å; S731-R747 PolarHBondContact OG-NH2 2.9Å; P732-R747 PolarHBondContact O-NH2 2.84Å; R747-F749 HydrophobicContact CB-CE2 3.83Å; R747-F749 HydrophobicContact CB-CZ 3.93Å
748	H	91.8	Very high	76.7	Confident	4 Å²	4	65 Å²	65	2%	0.019	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	132.6	-178.6	-64.5	73.3	0	0	0	110.6	E403 L723 V746	E403-H748 WeakPolarHBondContact CA-O 3.25Å; L723-H748 CarbonylContact O-C 3.53Å; L723-H748 WeakPolarHBondContact O-CA 3.43Å; V746-H748 PolarHBondContact O-CE1 2.95Å; V746-H748 PolarHBondContact O-ND1 2.8Å
749	F	93.4	Very high	78.1	Confident	4 Å²	4	59.5 Å²	59.5	2%	0.018	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	144.5	-179.7	-56	-87.7	0	0	0	109.9	V401 L723 L725 R747 L766 F769 L792 P793	V401-F749 HydrophobicContact CG1-CD1 4Å; V401-F749 HydrophobicContact CG1-CE1 3.81Å; L723-F749 HydrophobicContact CB-CB 4.39Å; L723-F749 HydrophobicContact CD2-CB 4.42Å; L723-F749 HydrophobicContact CD2-CD2 4.44Å; L723-F749 HydrophobicContact CG-CD2 4.48Å; L723-F749 PolarHBondContact N-O 3.11Å; L723-F749 PolarHBondContact O-N 2.97Å; L725-F749 HydrophobicContact CB-CE2 4.3Å; L725-F749 HydrophobicContact CD2-CE2 4.49Å; R747-F749 HydrophobicContact CB-CE2 3.83Å; R747-F749 HydrophobicContact CB-CZ 3.93Å; F749-L766 HydrophobicContact CB-CD1 3.9Å; F749-F769 HydrophobicContact CD1-CE2 4.02Å; F749-F769 HydrophobicContact CD1-CZ 4.43Å; F749-F769 HydrophobicContact CE1-CE2 4.32Å; F749-F769 HydrophobicContact CE1-CZ 4.28Å; F749-L792 HydrophobicContact CD1-CD2 4.38Å; F749-L792 HydrophobicContact CD2-CD2 4.08Å; F749-L792 HydrophobicContact CE2-CD2 4.31Å; F749-L792 HydrophobicContact CG-CD2 4.14Å; F749-P793 VanDerWaalsContact CZ-CD 3.43Å; F749-P793 HydrophobicContact CZ-CG 3.71Å
750	L	93.7	Very high	79.3	Confident	8 Å²	8	60 Å²	60	4%	0.042	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	119.8	177.6	-174.1	69.1	0	0	0	111.1	Y717 R767	Y717-L750 HydrophobicContact CD1-CD2 3.95Å; Y717-L750 HydrophobicContact CD2-CD1 3.74Å; Y717-L750 HydrophobicContact CD2-CD2 3.52Å; Y717-L750 HydrophobicContact CD2-CG 4.28Å; Y717-L750 HydrophobicContact CE1-CD2 4.25Å; Y717-L750 HydrophobicContact CE2-CD2 3.83Å; Y717-L750 HydrophobicContact CG-CD1 4.1Å; Y717-L750 HydrophobicContact CG-CD2 3.57Å; L750-R767 HydrophobicContact CB-CB 4.15Å; L750-R767 HydrophobicContact CD2-CB 4.22Å; L750-R767 HydrophobicContact CD2-CG 4.04Å; L750-R767 HydrophobicContact CG-CB 4.33Å; L750-R767 HydrophobicContact CG-CG 4.17Å; L750-R767 WeakPolarHBondContact O-CB 3.43Å; L750-R767 PolarHBondContact O-N 3.11Å
751	I	94.4	Very high	80.7	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	105.6	169.5	-57.1	170.8	0	0	0	107.2	I711 S720 F721 L723 V764 L766 L778 F781	I711-I751 HydrophobicContact CD1-CD1 4.09Å; S720-I751 CarbonylContact C-O 3.55Å; S720-I751 WeakPolarHBondContact CA-O 3.03Å; F721-I751 HydrophobicContact CB-CB 4.28Å; F721-I751 HydrophobicContact CD2-CG2 4.39Å; F721-I751 PolarHBondContact N-O 3.47Å; F721-I751 PolarHBondContact O-N 2.9Å; L723-I751 HydrophobicContact CB-CD1 3.89Å; L723-I751 HydrophobicContact CB-CG1 4.23Å; L723-I751 HydrophobicContact CD2-CD1 4.3Å; I751-V764 HydrophobicContact CG2-CB 3.76Å; I751-V764 HydrophobicContact CG2-CG1 4.42Å; I751-V764 HydrophobicContact CG2-CG2 4.4Å; I751-L766 HydrophobicContact CG1-CD1 3.82Å; I751-L778 HydrophobicContact CD1-CD1 3.89Å; I751-L778 HydrophobicContact CG2-CD1 4.39Å; I751-F781 HydrophobicContact CD1-CD1 3.87Å; I751-F781 HydrophobicContact CD1-CE1 3.49Å; I751-F781 VanDerWaalsContact CD1-CE1 3.49Å; I751-F781 HydrophobicContact CD1-CE2 4.43Å; I751-F781 HydrophobicContact CD1-CZ 3.81Å; I751-F781 HydrophobicContact CG1-CE1 4.34Å; I751-F781 HydrophobicContact CG1-CZ 4.16Å
752	G	91.6	Very high	82.3	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	146.6	176.7	0	0	0	0	0	111.4	H765	G752-H765 PolarHBondContact N-O 3.49Å; G752-H765 PolarHBondContact O-N 3.15Å
753	T	90.6	Very high	84.1	Confident	36 Å²	36	49.2 Å²	49.2	22%	0.221	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	148.4	159.6	57.6	0	0	0	0	110.6	D719 F721 G763 V764 R767	D719-T753 WeakPolarHBondContact O-CB 3.24Å; D719-T753 WeakPolarHBondContact O-CG2 3.3Å; D719-T753 PolarHBondContact O-N 2.79Å; D719-T753 PolarHBondContact O-OG1 3.44Å; F721-T753 HydrophobicContact CE2-CG2 4.18Å; T753-G763 VanDerWaalsContact CA-O 3.28Å; T753-G763 WeakPolarHBondContact CA-O 3.31Å; T753-V764 HydrophobicContact CG2-CG1 4.35Å; T753-R767 PolarHBondContact O-NH2 3.44Å
754	V	87.5	Confident	85.6	Confident	32 Å²	32	48.9 Å²	48.9	19%	0.194	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	140.6	176	-70.4	0	0	0	0	109.6	M756 N762 G763 H765 T774	V754-M756 PolarHBondContact O-N 3.29Å; V754-N762 CarbonylContact O-C 3.48Å; V754-N762 WeakPolarHBondContact O-CA 3.3Å; V754-G763 PolarHBondContact N-O 2.85Å; V754-G763 PolarHBondContact O-N 2.82Å; V754-H765 HydrophobicContact CG2-CB 3.84Å; V754-T774 HydrophobicContact CG2-CG2 3.57Å
755	P	85.2	Confident	86.7	Confident	104 Å²	104	46.3 Å²	46.3	68%	0.675	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.8	134.1	172.4	-24.2	35.1	0	0	0	111.5
756	M	83.2	Confident	87.3	Confident	30 Å²	30	43.5 Å²	43.5	15%	0.148	24%	0.243	C	C	.	.			trans	-74.7	139.4	175.4	-67.2	-175	61.9	0	0	111	V754 D758 G759 R760 G761 T774 P776	V754-M756 PolarHBondContact O-N 3.29Å; M756-D758 VanDerWaalsContact CB-OD1 3.3Å; M756-D758 WeakPolarHBondContact CB-OD1 3.42Å; M756-D758 PolarHBondContact O-N 3Å; M756-D758 VanDerWaalsContact O-N 3.12Å; M756-G759 PolarHBondContact O-N 3.36Å; M756-R760 HydrophobicContact SD-CB 4.45Å; M756-G761 PolarHBondContact N-O 2.79Å; M756-T774 HydrophobicContact CG-CG2 4.24Å; M756-P776 HydrophobicContact CE-CB 4.21Å; M756-P776 HydrophobicContact SD-CB 4.03Å
757	H	77.4	Confident	87.2	Confident	183 Å²	183	48.4 Å²	48.4	85%	0.847	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-18.8	-178.3	68.1	-93.7	0	0	0	114.2
758	D	80.4	Confident	86.9	Confident	63 Å²	63	48.5 Å²	48.5	34%	0.337	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	4.4	178.5	66.6	0.8	0	0	0	113.5	M756 R760	M756-D758 VanDerWaalsContact CB-OD1 3.3Å; M756-D758 WeakPolarHBondContact CB-OD1 3.42Å; M756-D758 PolarHBondContact O-N 3Å; M756-D758 VanDerWaalsContact O-N 3.12Å; D758-R760 VanDerWaalsContact C-N 3.3Å; D758-R760 PolarHBondContact O-N 2.91Å; D758-R760 WeakPolarHBondContact OD1-CG 3.4Å; D758-R760 PolarHBondContact OD1-N 3.32Å; D758-R760 IonicContact OD1-NE 3.22Å; D758-R760 IonicContact OD2-CZ 3.48Å; D758-R760 IonicContact OD2-NE 2.76Å; D758-R760 PolarHBondContact OD2-NE 3.21Å; D758-R760 IonicContact OD2-NH2 3.12Å; D758-R760 PolarHBondContact OD2-NH2 2.79Å
759	G	75.3	Confident	86.4	Confident	69 Å²	69	49 Å²	49	71%	0.711	28%	0.279	S	S	*	.	S	Bend	trans	74.9	7.8	175.4	0	0	0	0	0	115.6	M756 G761	M756-G759 PolarHBondContact O-N 3.36Å; G759-G761 PolarHBondContact O-N 3.07Å; G759-G761 VanDerWaalsContact O-N 3.1Å
760	R	77.1	Confident	85.5	Confident	144 Å²	144	54.7 Å²	54.7	54%	0.543	32%	0.319	S	S	.	.	S	Bend	trans	-67.9	-5.2	179.5	-67.4	-171.4	-141.2	-126.6	-1.7	115.1	G662 M756 D758	G662-R760 PolarHBondContact O-NH1 3.47Å; M756-R760 HydrophobicContact SD-CB 4.45Å; D758-R760 VanDerWaalsContact C-N 3.3Å; D758-R760 PolarHBondContact O-N 2.91Å; D758-R760 WeakPolarHBondContact OD1-CG 3.4Å; D758-R760 PolarHBondContact OD1-N 3.32Å; D758-R760 IonicContact OD1-NE 3.22Å; D758-R760 IonicContact OD2-CZ 3.48Å; D758-R760 IonicContact OD2-NE 2.76Å; D758-R760 PolarHBondContact OD2-NE 3.21Å; D758-R760 IonicContact OD2-NH2 3.12Å; D758-R760 PolarHBondContact OD2-NH2 2.79Å
761	G	82.1	Confident	84.6	Confident	36 Å²	36	59.1 Å²	59.1	37%	0.371	35%	0.351	S	S	.	.	S	Bend	trans	126	-150.8	-178.4	0	0	0	0	0	111.7	M756 G759	M756-G761 PolarHBondContact N-O 2.79Å; G759-G761 PolarHBondContact O-N 3.07Å; G759-G761 VanDerWaalsContact O-N 3.1Å
762	N	84.6	Confident	83.9	Confident	109 Å²	109	59.6 Å²	59.6	58%	0.583	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.8	122.9	177	-66.2	-13.7	0	0	0	110.4	V754	V754-N762 CarbonylContact O-C 3.48Å; V754-N762 WeakPolarHBondContact O-CA 3.3Å
763	G	88.2	Confident	83.6	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	-173.1	166.6	0	0	0	0	0	111.6	T753 V754 F775	T753-G763 VanDerWaalsContact CA-O 3.28Å; T753-G763 WeakPolarHBondContact CA-O 3.31Å; V754-G763 PolarHBondContact N-O 2.85Å; V754-G763 PolarHBondContact O-N 2.82Å; G763-F775 CarbonylContact C-O 3.33Å; G763-F775 WeakPolarHBondContact CA-O 3.49Å
764	V	92.2	Very high	83.6	Confident	8 Å²	8	63.5 Å²	63.5	5%	0.048	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	143.9	178.3	-61.9	0	0	0	0	111.2	F721 I751 T753 F775 S777 F781	F721-V764 HydrophobicContact CE2-CG1 4.07Å; I751-V764 HydrophobicContact CG2-CB 3.76Å; I751-V764 HydrophobicContact CG2-CG1 4.42Å; I751-V764 HydrophobicContact CG2-CG2 4.4Å; T753-V764 HydrophobicContact CG2-CG1 4.35Å; V764-F775 HydrophobicContact CG2-CB 3.99Å; V764-F775 PolarHBondContact N-O 3.01Å; V764-F775 PolarHBondContact O-N 2.75Å; V764-S777 WeakPolarHBondContact CG2-O 3.5Å; V764-F781 HydrophobicContact CG2-CB 3.95Å
765	H	91.9	Very high	83.7	Confident	32 Å²	32	62.7 Å²	62.7	15%	0.148	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	145.2	-177.5	171.1	68.3	0	0	0	111.3	G752 V754 R767 F769 D772 P773	G752-H765 PolarHBondContact N-O 3.49Å; G752-H765 PolarHBondContact O-N 3.15Å; V754-H765 HydrophobicContact CG2-CB 3.84Å; H765-R767 PolarHBondContact O-N 3.3Å; H765-F769 PolarHBondContact CE1-O 3.2Å; H765-F769 VanDerWaalsContact CE1-O 3.27Å; H765-D772 PolarHBondContact CE1-O 2.82Å; H765-D772 PolarHBondContact ND1-O 2.88Å; H765-P773 PolarHBondContact ND1-O 3.06Å
766	L	93.1	Very high	84	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	107.9	-177.3	-161.4	70.8	0	0	0	111.4	F749 I751 G768 F769 F781 A791 L792	F749-L766 HydrophobicContact CB-CD1 3.9Å; I751-L766 HydrophobicContact CG1-CD1 3.82Å; L766-G768 PolarHBondContact O-N 3.03Å; L766-F769 HydrophobicContact CB-CB 4.5Å; L766-F769 HydrophobicContact CD2-CB 4.25Å; L766-F769 HydrophobicContact CD2-CD2 3.57Å; L766-F769 HydrophobicContact CD2-CE2 4.1Å; L766-F769 HydrophobicContact CD2-CG 4.04Å; L766-F769 HydrophobicContact CG-CD2 3.88Å; L766-F769 PolarHBondContact O-N 3.4Å; L766-F769 VanDerWaalsContact O-N 3.16Å; L766-F781 HydrophobicContact CB-CE2 4.3Å; L766-F781 HydrophobicContact CD1-CE2 4.26Å; L766-F781 HydrophobicContact CD1-CZ 4.07Å; L766-A791 HydrophobicContact CD2-CB 3.59Å; L766-L792 HydrophobicContact CD1-CD2 4.43Å; L766-L792 HydrophobicContact CD2-CD2 3.76Å
767	R	88.7	Confident	84.4	Confident	108 Å²	108	62.2 Å²	62.2	41%	0.408	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	135.6	-178.7	-67.6	-81.5	178.8	139.4	-0.7	110	L750 T753 H765	L750-R767 HydrophobicContact CB-CB 4.15Å; L750-R767 HydrophobicContact CD2-CB 4.22Å; L750-R767 HydrophobicContact CD2-CG 4.04Å; L750-R767 HydrophobicContact CG-CB 4.33Å; L750-R767 HydrophobicContact CG-CG 4.17Å; L750-R767 WeakPolarHBondContact O-CB 3.43Å; L750-R767 PolarHBondContact O-N 3.11Å; T753-R767 PolarHBondContact O-NH2 3.44Å; H765-R767 PolarHBondContact O-N 3.3Å
768	G	82.8	Confident	85.2	Confident	48 Å²	48	54.2 Å²	54.2	50%	0.495	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	91	-10.7	-174.7	0	0	0	0	0	115	L766	L766-G768 PolarHBondContact O-N 3.03Å
769	F	82.2	Confident	85.8	Confident	15 Å²	15	51.3 Å²	51.3	7%	0.066	32%	0.32	C	S	.	.			trans	-125.5	74.5	-174.3	-62.8	-90.6	0	0	0	112.4	V401 F749 H765 L766 S771 D772 A791	V401-F769 HydrophobicContact CG1-CE2 4.45Å; V401-F769 HydrophobicContact CG1-CZ 4.4Å; V401-F769 HydrophobicContact CG2-CZ 4.16Å; F749-F769 HydrophobicContact CD1-CE2 4.02Å; F749-F769 HydrophobicContact CD1-CZ 4.43Å; F749-F769 HydrophobicContact CE1-CE2 4.32Å; F749-F769 HydrophobicContact CE1-CZ 4.28Å; H765-F769 PolarHBondContact CE1-O 3.2Å; H765-F769 VanDerWaalsContact CE1-O 3.27Å; L766-F769 HydrophobicContact CB-CB 4.5Å; L766-F769 HydrophobicContact CD2-CB 4.25Å; L766-F769 HydrophobicContact CD2-CD2 3.57Å; L766-F769 HydrophobicContact CD2-CE2 4.1Å; L766-F769 HydrophobicContact CD2-CG 4.04Å; L766-F769 HydrophobicContact CG-CD2 3.88Å; L766-F769 PolarHBondContact O-N 3.4Å; L766-F769 VanDerWaalsContact O-N 3.16Å; F769-S771 PolarHBondContact O-N 3.41Å; F769-D772 WeakPolarHBondContact O-CB 3.16Å; F769-D772 PolarHBondContact O-N 2.82Å; F769-A791 HydrophobicContact CB-CB 3.64Å; F769-A791 HydrophobicContact CD1-CB 3.64Å; F769-A791 HydrophobicContact CD2-CB 4.39Å; F769-A791 HydrophobicContact CE1-CB 4.35Å; F769-A791 HydrophobicContact CG-CB 3.65Å
770	S	73.6	Confident	86.6	Confident	123 Å²	123	48.9 Å²	48.9	86%	0.86	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-6.5	-179	55.9	0	0	0	0	116
771	S	75.2	Confident	87.4	Confident	101 Å²	101	42 Å²	42	71%	0.706	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-17.9	171.9	56.3	0	0	0	0	113.9	F769	F769-S771 PolarHBondContact O-N 3.41Å
772	D	79.4	Confident	88	Confident	10 Å²	10	40.3 Å²	40.3	5%	0.053	25%	0.25	C	S	.	.	S	Bend	trans	-87.8	139.2	-175.4	-152.3	50.6	0	0	0	110	H765 F769 H785 A791	H765-D772 PolarHBondContact CE1-O 2.82Å; H765-D772 PolarHBondContact ND1-O 2.88Å; F769-D772 WeakPolarHBondContact O-CB 3.16Å; F769-D772 PolarHBondContact O-N 2.82Å; D772-H785 IonicContact OD1-CE1 3.47Å; D772-H785 IonicContact OD1-NE2 2.61Å; D772-H785 IonicContact OD2-CE1 3.99Å; D772-H785 PolarHBondContact OD2-CE1 3.19Å; D772-H785 VanDerWaalsContact OD2-CE1 3.31Å; D772-H785 IonicContact OD2-NE2 2.69Å; D772-A791 HydrophobicContact CB-CB 4.24Å
773	P	85.7	Confident	88.5	Confident	58 Å²	58	36 Å²	36	38%	0.377	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-69.9	170	-176.9	27.7	-32.3	0	0	0	112.3	H765 F775	H765-P773 PolarHBondContact ND1-O 3.06Å; P773-F775 HydrophobicContact CG-CE1 3.92Å; P773-F775 HydrophobicContact CG-CE2 3.9Å; P773-F775 HydrophobicContact CG-CZ 3.52Å; P773-F775 WeakPolarHBondContact O-CD2 3.5Å; P773-F775 WeakPolarHBondContact O-CE2 3.35Å
774	T	88.9	Confident	88.7	Confident	60 Å²	60	39.6 Å²	39.6	37%	0.368	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-89	123.7	164.9	-63.5	0	0	0	0	108.8	V754 M756	V754-T774 HydrophobicContact CG2-CG2 3.57Å; M756-T774 HydrophobicContact CG-CG2 4.24Å
775	F	90.8	Very high	88.7	Confident	15 Å²	15	39.2 Å²	39.2	7%	0.066	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-97.1	145.7	-179.3	-58	-92.2	0	0	0	110.7	G763 V764 P773 S777 A780 F781 Y784	G763-F775 CarbonylContact C-O 3.33Å; G763-F775 WeakPolarHBondContact CA-O 3.49Å; V764-F775 HydrophobicContact CG2-CB 3.99Å; V764-F775 PolarHBondContact N-O 3.01Å; V764-F775 PolarHBondContact O-N 2.75Å; P773-F775 HydrophobicContact CG-CE1 3.92Å; P773-F775 HydrophobicContact CG-CE2 3.9Å; P773-F775 HydrophobicContact CG-CZ 3.52Å; P773-F775 WeakPolarHBondContact O-CD2 3.5Å; P773-F775 WeakPolarHBondContact O-CE2 3.35Å; F775-S777 PolarHBondContact O-N 3.28Å; F775-A780 HydrophobicContact CB-CB 4.28Å; F775-F781 HydrophobicContact CB-CB 4.07Å; F775-F781 HydrophobicContact CD1-CB 4.5Å; F775-F781 HydrophobicContact CD2-CB 3.92Å; F775-F781 AromaticContact CD2-CD2 3.61Å; F775-F781 HydrophobicContact CD2-CD2 3.61Å; F775-F781 HydrophobicContact CD2-CG 4.25Å; F775-F781 HydrophobicContact CE2-CB 4.47Å; F775-F781 AromaticContact CE2-CD2 3.58Å; F775-F781 HydrophobicContact CE2-CD2 3.58Å; F775-F781 HydrophobicContact CE2-CE2 4.29Å; F775-F781 HydrophobicContact CE2-CG 4.44Å; F775-F781 HydrophobicContact CG-CB 3.91Å; F775-F781 HydrophobicContact CG-CD2 4.44Å; F775-F781 HydrophobicContact CZ-CD2 4.4Å; F775-Y784 VanDerWaalsContact CE1-CB 3.41Å; F775-Y784 HydrophobicContact CE1-CD1 4.01Å; F775-Y784 AromaticContact CE1-CD2 3.94Å; F775-Y784 HydrophobicContact CE1-CD2 3.94Å; F775-Y784 AromaticContact CE1-CG 3.53Å; F775-Y784 HydrophobicContact CE1-CG 3.53Å; F775-Y784 AromaticContact CZ-CD1 3.73Å; F775-Y784 HydrophobicContact CZ-CD1 3.73Å; F775-Y784 HydrophobicContact CZ-CD2 4.36Å; F775-Y784 HydrophobicContact CZ-CE1 4.3Å; F775-Y784 AromaticContact CZ-CG 3.77Å; F775-Y784 HydrophobicContact CZ-CG 3.77Å
776	P	90.8	Very high	88.7	Confident	77 Å²	77	39.5 Å²	39.5	50%	0.5	24%	0.241	S	C	.	.	S	Bend	trans	-72.2	-13.3	-178.4	29.5	-36.4	0	0	0	114.1	M756 A780	M756-P776 HydrophobicContact CE-CB 4.21Å; M756-P776 HydrophobicContact SD-CB 4.03Å; P776-A780 HydrophobicContact CG-CB 3.97Å
777	S	92.1	Very high	88.4	Confident	47 Å²	47	45.4 Å²	45.4	33%	0.329	27%	0.268	S	S	.	.	S	Bend	trans	-161.1	164.9	175.2	70.6	0	0	0	0	111.7	V764 F775 A779 A780 F781	V764-S777 WeakPolarHBondContact CG2-O 3.5Å; F775-S777 PolarHBondContact O-N 3.28Å; S777-A779 PolarHBondContact O-N 3.36Å; S777-A779 PolarHBondContact OG-N 3.01Å; S777-A780 PolarHBondContact O-N 3.42Å; S777-A780 VanDerWaalsContact O-N 3.14Å; S777-A780 PolarHBondContact OG-N 3.27Å; S777-F781 PolarHBondContact O-N 3.26Å
778	L	93.7	Very high	88.4	Confident	15 Å²	15	46.3 Å²	46.3	8%	0.079	28%	0.275	C	S	.	.	H	α-helix	trans	-60.5	-33.7	174.2	-164.3	68	0	0	0	112.5	W687 Y688 I711 F721 I751 F781 V782	W687-L778 HydrophobicContact CZ3-CD2 4.02Å; W687-L778 HydrophobicContact CZ3-CG 4.22Å; Y688-L778 HydrophobicContact CD2-CD2 3.64Å; Y688-L778 HydrophobicContact CE2-CD2 3.82Å; Y688-L778 HydrophobicContact CG-CD2 4.42Å; I711-L778 HydrophobicContact CB-CD2 4.48Å; I711-L778 HydrophobicContact CD1-CD1 3.96Å; I711-L778 HydrophobicContact CD1-CD2 4.31Å; I711-L778 HydrophobicContact CD1-CG 4.15Å; I711-L778 HydrophobicContact CG2-CD1 4.25Å; I711-L778 HydrophobicContact CG2-CD2 3.94Å; F721-L778 HydrophobicContact CD2-CD1 4.33Å; I751-L778 HydrophobicContact CD1-CD1 3.89Å; I751-L778 HydrophobicContact CG2-CD1 4.39Å; L778-F781 PolarHBondContact O-N 3.08Å; L778-V782 WeakPolarHBondContact O-CG2 3.04Å; L778-V782 PolarHBondContact O-N 3.5Å
779	A	93.4	Very high	88.5	Confident	2 Å²	2	48.6 Å²	48.6	2%	0.017	27%	0.273	C	S	.	.	H	α-helix	trans	-66.7	-39.2	174.8	0	0	0	0	0	112	M677 V680 L681 S777 V782 H783	M677-A779 HydrophobicContact CE-CB 4.37Å; V680-A779 HydrophobicContact CG1-CB 4.1Å; L681-A779 HydrophobicContact CD2-CB 3.66Å; L681-A779 HydrophobicContact CG-CB 4.33Å; S777-A779 PolarHBondContact O-N 3.36Å; S777-A779 PolarHBondContact OG-N 3.01Å; A779-V782 PolarHBondContact O-N 2.74Å; A779-H783 WeakPolarHBondContact O-CB 3.48Å; A779-H783 PolarHBondContact O-N 3.19Å
780	A	92.3	Very high	88.7	Confident	18 Å²	18	49.9 Å²	49.9	15%	0.149	29%	0.29	C	S	.	.	H	α-helix	trans	-67.8	-39.4	175	0	0	0	0	0	112.3	F775 P776 S777 H783 Y784	F775-A780 HydrophobicContact CB-CB 4.28Å; P776-A780 HydrophobicContact CG-CB 3.97Å; S777-A780 PolarHBondContact O-N 3.42Å; S777-A780 VanDerWaalsContact O-N 3.14Å; S777-A780 PolarHBondContact OG-N 3.27Å; A780-H783 PolarHBondContact O-N 3.42Å; A780-Y784 PolarHBondContact O-N 3.5Å; A780-Y784 VanDerWaalsContact O-N 3.1Å
781	F	94.7	Very high	89.3	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-58	-47.5	171.8	170.7	-86.5	0	0	0	111.6	L723 I751 V764 L766 F775 S777 L778 H785	L723-F781 HydrophobicContact CD2-CE1 4.07Å; L723-F781 HydrophobicContact CD2-CZ 4.09Å; I751-F781 HydrophobicContact CD1-CD1 3.87Å; I751-F781 HydrophobicContact CD1-CE1 3.49Å; I751-F781 VanDerWaalsContact CD1-CE1 3.49Å; I751-F781 HydrophobicContact CD1-CE2 4.43Å; I751-F781 HydrophobicContact CD1-CZ 3.81Å; I751-F781 HydrophobicContact CG1-CE1 4.34Å; I751-F781 HydrophobicContact CG1-CZ 4.16Å; V764-F781 HydrophobicContact CG2-CB 3.95Å; L766-F781 HydrophobicContact CB-CE2 4.3Å; L766-F781 HydrophobicContact CD1-CE2 4.26Å; L766-F781 HydrophobicContact CD1-CZ 4.07Å; F775-F781 HydrophobicContact CB-CB 4.07Å; F775-F781 HydrophobicContact CD1-CB 4.5Å; F775-F781 HydrophobicContact CD2-CB 3.92Å; F775-F781 AromaticContact CD2-CD2 3.61Å; F775-F781 HydrophobicContact CD2-CD2 3.61Å; F775-F781 HydrophobicContact CD2-CG 4.25Å; F775-F781 HydrophobicContact CE2-CB 4.47Å; F775-F781 AromaticContact CE2-CD2 3.58Å; F775-F781 HydrophobicContact CE2-CD2 3.58Å; F775-F781 HydrophobicContact CE2-CE2 4.29Å; F775-F781 HydrophobicContact CE2-CG 4.44Å; F775-F781 HydrophobicContact CG-CB 3.91Å; F775-F781 HydrophobicContact CG-CD2 4.44Å; F775-F781 HydrophobicContact CZ-CD2 4.4Å; S777-F781 PolarHBondContact O-N 3.26Å; L778-F781 PolarHBondContact O-N 3.08Å; F781-H785 AromaticContact CD2-CE1 3.82Å; F781-H785 AromaticContact CD2-ND1 3.65Å; F781-H785 AromaticContact CE1-ND1 3.91Å; F781-H785 AromaticContact CE2-CE1 3.31Å; F781-H785 WeakPolarHBondContact CE2-CE1 3.5Å; F781-H785 AromaticContact CE2-ND1 3.39Å; F781-H785 WeakPolarHBondContact CE2-ND1 3.19Å; F781-H785 AromaticContact CZ-CE1 3.72Å; F781-H785 AromaticContact CZ-ND1 3.52Å; F781-H785 WeakPolarHBondContact O-CB 3.43Å; F781-H785 PolarHBondContact O-N 2.72Å; F781-H785 VanDerWaalsContact O-N 3.08Å; F781-H785 PolarHBondContact O-ND1 3.32Å
782	V	94.7	Very high	90.1	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-66.3	-44.4	178.6	167.9	0	0	0	0	111.4	V680 W687 F709 I711 L778 A779 Y784 H785 I786 L796 L798	V680-V782 HydrophobicContact CG1-CB 3.99Å; V680-V782 HydrophobicContact CG1-CG1 3.7Å; V680-V782 HydrophobicContact CG2-CG1 4.34Å; W687-V782 HydrophobicContact CE3-CG2 4.14Å; W687-V782 HydrophobicContact CH2-CB 4.3Å; W687-V782 HydrophobicContact CH2-CG2 3.88Å; W687-V782 HydrophobicContact CZ2-CB 4.38Å; W687-V782 HydrophobicContact CZ2-CG1 4.17Å; W687-V782 HydrophobicContact CZ2-CG2 4.32Å; W687-V782 HydrophobicContact CZ3-CG2 3.77Å; F709-V782 HydrophobicContact CE2-CG1 4.23Å; F709-V782 HydrophobicContact CE2-CG2 3.98Å; F709-V782 HydrophobicContact CZ-CG1 3.74Å; F709-V782 HydrophobicContact CZ-CG2 4.34Å; I711-V782 HydrophobicContact CD1-CG2 3.71Å; L778-V782 WeakPolarHBondContact O-CG2 3.04Å; L778-V782 PolarHBondContact O-N 3.5Å; A779-V782 PolarHBondContact O-N 2.74Å; V782-Y784 VanDerWaalsContact C-N 3.32Å; V782-Y784 PolarHBondContact O-N 3.36Å; V782-H785 PolarHBondContact O-N 2.94Å; V782-H785 VanDerWaalsContact O-N 3.12Å; V782-I786 HydrophobicContact CG1-CD1 3.69Å; V782-I786 HydrophobicContact CG1-CG1 4.32Å; V782-I786 VanDerWaalsContact O-CD1 3.32Å; V782-I786 WeakPolarHBondContact O-CD1 3.42Å; V782-I786 VanDerWaalsContact O-CG1 3.28Å; V782-I786 WeakPolarHBondContact O-CG1 3.3Å; V782-I786 PolarHBondContact O-N 3.38Å; V782-L796 HydrophobicContact CG2-CD1 4.37Å; V782-L798 HydrophobicContact CG1-CD2 4.32Å
783	H	93.8	Very high	90.4	Very high	18 Å²	18	41 Å²	41	8%	0.083	23%	0.228	C	C	.	.	H	α-helix	trans	-57.5	-43.2	178.5	-171.9	-110.9	0	0	0	112.8	D673 G676 M677 V680 A779 A780 H787	D673-H783 IonicContact OD1-CE1 2.77Å; D673-H783 PolarHBondContact OD1-CE1 3.48Å; G676-H783 WeakPolarHBondContact CA-NE2 3.34Å; M677-H783 HydrophobicContact CG-CB 4.49Å; M677-H783 PolarHBondContact N-CD2 2.69Å; M677-H783 PolarHBondContact N-NE2 2.85Å; M677-H783 HydrophobicContact SD-CB 3.43Å; M677-H783 WeakPolarHBondContact SD-CB 3.44Å; M677-H783 VanDerWaalsContact SD-CG 3.52Å; V680-H783 HydrophobicContact CG2-CB 4.06Å; A779-H783 WeakPolarHBondContact O-CB 3.48Å; A779-H783 PolarHBondContact O-N 3.19Å; A780-H783 PolarHBondContact O-N 3.42Å; H783-H787 AromaticContact CD2-CE1 3.86Å; H783-H787 AromaticContact CE1-CE1 3.89Å; H783-H787 AromaticContact NE2-CE1 3.41Å; H783-H787 PolarHBondContact NE2-CE1 3.46Å; H783-H787 AromaticContact NE2-ND1 3.93Å; H783-H787 PolarHBondContact O-ND1 3.11Å
784	Y	92.5	Very high	90.5	Very high	77 Å²	77	39 Å²	39	30%	0.302	22%	0.215	S	C	.	.	H	α-helix	trans	-62.9	-49.1	173.2	-178.8	-86.7	0	0	0	111.7	F775 A780 V782 I786 H787 K788	F775-Y784 VanDerWaalsContact CE1-CB 3.41Å; F775-Y784 HydrophobicContact CE1-CD1 4.01Å; F775-Y784 AromaticContact CE1-CD2 3.94Å; F775-Y784 HydrophobicContact CE1-CD2 3.94Å; F775-Y784 AromaticContact CE1-CG 3.53Å; F775-Y784 HydrophobicContact CE1-CG 3.53Å; F775-Y784 AromaticContact CZ-CD1 3.73Å; F775-Y784 HydrophobicContact CZ-CD1 3.73Å; F775-Y784 HydrophobicContact CZ-CD2 4.36Å; F775-Y784 HydrophobicContact CZ-CE1 4.3Å; F775-Y784 AromaticContact CZ-CG 3.77Å; F775-Y784 HydrophobicContact CZ-CG 3.77Å; A780-Y784 PolarHBondContact O-N 3.5Å; A780-Y784 VanDerWaalsContact O-N 3.1Å; V782-Y784 VanDerWaalsContact C-N 3.32Å; V782-Y784 PolarHBondContact O-N 3.36Å; Y784-I786 VanDerWaalsContact C-N 3.25Å; Y784-I786 PolarHBondContact O-N 3.3Å; Y784-H787 PolarHBondContact O-N 3.46Å; Y784-K788 HydrophobicContact CD1-CB 4.45Å; Y784-K788 HydrophobicContact CE1-CB 4.01Å; Y784-K788 HydrophobicContact CE2-CD 4.05Å; Y784-K788 PolarHBondContact O-N 3.05Å
785	H	92	Very high	90.7	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-72.7	-12	-173.6	-80.6	97.2	0	0	0	115.4	D772 F781 V782 K788 Q789 L792 T795 L796	D772-H785 IonicContact OD1-CE1 3.47Å; D772-H785 IonicContact OD1-NE2 2.61Å; D772-H785 IonicContact OD2-CE1 3.99Å; D772-H785 PolarHBondContact OD2-CE1 3.19Å; D772-H785 VanDerWaalsContact OD2-CE1 3.31Å; D772-H785 IonicContact OD2-NE2 2.69Å; F781-H785 AromaticContact CD2-CE1 3.82Å; F781-H785 AromaticContact CD2-ND1 3.65Å; F781-H785 AromaticContact CE1-ND1 3.91Å; F781-H785 AromaticContact CE2-CE1 3.31Å; F781-H785 WeakPolarHBondContact CE2-CE1 3.5Å; F781-H785 AromaticContact CE2-ND1 3.39Å; F781-H785 WeakPolarHBondContact CE2-ND1 3.19Å; F781-H785 AromaticContact CZ-CE1 3.72Å; F781-H785 AromaticContact CZ-ND1 3.52Å; F781-H785 WeakPolarHBondContact O-CB 3.43Å; F781-H785 PolarHBondContact O-N 2.72Å; F781-H785 VanDerWaalsContact O-N 3.08Å; F781-H785 PolarHBondContact O-ND1 3.32Å; V782-H785 PolarHBondContact O-N 2.94Å; V782-H785 VanDerWaalsContact O-N 3.12Å; H785-K788 CarbonylContact C-O 3.56Å; H785-K788 VanDerWaalsContact CA-O 3.27Å; H785-K788 WeakPolarHBondContact CA-O 3.35Å; H785-Q789 PolarHBondContact CD2-O 3.04Å; H785-L792 HydrophobicContact CB-CD1 4.14Å; H785-L792 VanDerWaalsContact CD2-CD1 3.48Å; H785-L792 WeakPolarHBondContact CD2-CD1 3.35Å; H785-T795 WeakPolarHBondContact O-CA 3.2Å; H785-L796 HydrophobicContact CB-CD1 3.59Å; H785-L796 HydrophobicContact CB-CG 3.83Å; H785-L796 PolarHBondContact O-N 3.23Å
786	I	92.2	Very high	90.9	Very high	38 Å²	38	38.2 Å²	38.2	20%	0.195	21%	0.212	C	C	.	.	H	α-helix	trans	-73.6	-43.6	166.5	-67.7	153.1	0	0	0	110.9	V680 V782 Y784 T795 L796 L798	V680-I786 HydrophobicContact CG2-CD1 3.57Å; V782-I786 HydrophobicContact CG1-CD1 3.69Å; V782-I786 HydrophobicContact CG1-CG1 4.32Å; V782-I786 VanDerWaalsContact O-CD1 3.32Å; V782-I786 WeakPolarHBondContact O-CD1 3.42Å; V782-I786 VanDerWaalsContact O-CG1 3.28Å; V782-I786 WeakPolarHBondContact O-CG1 3.3Å; V782-I786 PolarHBondContact O-N 3.38Å; Y784-I786 VanDerWaalsContact C-N 3.25Å; Y784-I786 PolarHBondContact O-N 3.3Å; I786-T795 WeakPolarHBondContact O-CG2 3.36Å; I786-L796 WeakPolarHBondContact CA-O 3.3Å; I786-L796 HydrophobicContact CG1-CB 4.05Å; I786-L798 HydrophobicContact CD1-CD1 3.81Å; I786-L798 HydrophobicContact CD1-CD2 3.65Å; I786-L798 HydrophobicContact CD1-CG 3.47Å; I786-L798 VanDerWaalsContact CD1-CG 3.47Å; I786-L798 HydrophobicContact CG1-CG 4.19Å
787	H	87.6	Confident	91	Very high	123 Å²	123	39.7 Å²	39.7	57%	0.569	21%	0.207	S	C	*	.	H	α-helix	trans	-85.4	-27.7	-175.3	-65.7	99.8	0	0	0	113.5	H783 Y784	H783-H787 AromaticContact CD2-CE1 3.86Å; H783-H787 AromaticContact CE1-CE1 3.89Å; H783-H787 AromaticContact NE2-CE1 3.41Å; H783-H787 PolarHBondContact NE2-CE1 3.46Å; H783-H787 AromaticContact NE2-ND1 3.93Å; H783-H787 PolarHBondContact O-ND1 3.11Å; Y784-H787 PolarHBondContact O-N 3.46Å
788	K	88.1	Confident	90.8	Very high	127 Å²	127	38.4 Å²	38.4	55%	0.552	20%	0.197	S	C	*	.			trans	-135.2	135.5	-179.7	-69.3	-176.8	178.1	177.9	0	110.2	Y784 H785 G790	Y784-K788 HydrophobicContact CD1-CB 4.45Å; Y784-K788 HydrophobicContact CE1-CB 4.01Å; Y784-K788 HydrophobicContact CE2-CD 4.05Å; Y784-K788 PolarHBondContact O-N 3.05Å; H785-K788 CarbonylContact C-O 3.56Å; H785-K788 VanDerWaalsContact CA-O 3.27Å; H785-K788 WeakPolarHBondContact CA-O 3.35Å; K788-G790 PolarHBondContact O-N 2.85Å
789	Q	85.7	Confident	90.2	Very high	97 Å²	97	40 Å²	40	45%	0.453	21%	0.208	S	C	.	.			trans	-60.8	-29.9	178	174	170.1	-15.8	0	0	112.8	H785 A791 L792 P793 T795	H785-Q789 PolarHBondContact CD2-O 3.04Å; Q789-A791 PolarHBondContact O-N 3.07Å; Q789-L792 WeakPolarHBondContact CG-O 3.44Å; Q789-L792 PolarHBondContact NE2-O 2.82Å; Q789-L792 WeakPolarHBondContact O-CB 3.18Å; Q789-L792 PolarHBondContact O-N 2.94Å; Q789-P793 PolarHBondContact NE2-O 2.96Å; Q789-T795 HydrophobicContact CB-CG2 4.2Å
790	G	85.7	Confident	88.7	Confident	42 Å²	42	46 Å²	46	43%	0.433	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	-126.7	177.7	0	0	0	0	0	111.6	K788	K788-G790 PolarHBondContact O-N 2.85Å
791	A	86.5	Confident	86.7	Confident	9 Å²	9	50.9 Å²	50.9	7%	0.074	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-11.6	176.1	0	0	0	0	0	114.8	L766 F769 D772 Q789	L766-A791 HydrophobicContact CD2-CB 3.59Å; F769-A791 HydrophobicContact CB-CB 3.64Å; F769-A791 HydrophobicContact CD1-CB 3.64Å; F769-A791 HydrophobicContact CD2-CB 4.39Å; F769-A791 HydrophobicContact CE1-CB 4.35Å; F769-A791 HydrophobicContact CG-CB 3.65Å; D772-A791 HydrophobicContact CB-CB 4.24Å; Q789-A791 PolarHBondContact O-N 3.07Å
792	L	90.7	Very high	83.9	Confident	4 Å²	4	54.3 Å²	54.3	2%	0.021	28%	0.278	C	S	.	.	S	Bend	trans	-81.4	163.5	-172	-58	177.1	0	0	0	112.7	L723 L725 F749 L766 H785 Q789 C794 L796	L723-L792 HydrophobicContact CD2-CD1 4.06Å; L723-L792 HydrophobicContact CD2-CD2 3.84Å; L725-L792 HydrophobicContact CD2-CB 4.06Å; L725-L792 HydrophobicContact CD2-CD1 4.24Å; F749-L792 HydrophobicContact CD1-CD2 4.38Å; F749-L792 HydrophobicContact CD2-CD2 4.08Å; F749-L792 HydrophobicContact CE2-CD2 4.31Å; F749-L792 HydrophobicContact CG-CD2 4.14Å; L766-L792 HydrophobicContact CD1-CD2 4.43Å; L766-L792 HydrophobicContact CD2-CD2 3.76Å; H785-L792 HydrophobicContact CB-CD1 4.14Å; H785-L792 VanDerWaalsContact CD2-CD1 3.48Å; H785-L792 WeakPolarHBondContact CD2-CD1 3.35Å; Q789-L792 WeakPolarHBondContact CG-O 3.44Å; Q789-L792 PolarHBondContact NE2-O 2.82Å; Q789-L792 WeakPolarHBondContact O-CB 3.18Å; Q789-L792 PolarHBondContact O-N 2.94Å; L792-C794 VanDerWaalsContact C-N 3.3Å; L792-C794 PolarHBondContact O-N 3.49Å; L792-L796 HydrophobicContact CD1-CD1 4.41Å; L792-L796 HydrophobicContact CD1-CD2 3.8Å; L792-L796 HydrophobicContact CD1-CG 4.03Å
793	P	86.5	Confident	80.9	Confident	34 Å²	34	59.6 Å²	59.6	22%	0.221	31%	0.306	C	S	.	.	S	Bend	trans	-74.7	-11.6	177.5	-22.9	37.5	0	0	0	115.7	I727 F749 Q789	I727-P793 HydrophobicContact CD1-CB 3.89Å; I727-P793 HydrophobicContact CD1-CG 3.69Å; I727-P793 HydrophobicContact CG1-CB 4.09Å; I727-P793 HydrophobicContact CG1-CG 4.38Å; I727-P793 HydrophobicContact CG2-CB 4.3Å; F749-P793 VanDerWaalsContact CZ-CD 3.43Å; F749-P793 HydrophobicContact CZ-CG 3.71Å; Q789-P793 PolarHBondContact NE2-O 2.96Å
794	C	88.8	Confident	77.9	Confident	15 Å²	15	66 Å²	66	10%	0.101	34%	0.336	C	S	.	.	S	Bend	trans	-159.1	168.2	169	61.4	0	0	0	0	109.7	L792	L792-C794 VanDerWaalsContact C-N 3.3Å; L792-C794 PolarHBondContact O-N 3.49Å
795	T	92.5	Very high	75	Confident	58 Å²	58	66.9 Å²	66.9	36%	0.356	35%	0.35	S	S	.	.			trans	-64.3	153.7	169.2	40.3	0	0	0	0	111.9	G707 H785 I786 Q789	G707-T795 VanDerWaalsContact CA-O 3.3Å; G707-T795 WeakPolarHBondContact CA-O 3.25Å; H785-T795 WeakPolarHBondContact O-CA 3.2Å; I786-T795 WeakPolarHBondContact O-CG2 3.36Å; Q789-T795 HydrophobicContact CB-CG2 4.2Å
796	L	94.7	Very high	72.2	Confident	2 Å²	2	72.8 Å²	72.8	1%	0.01	38%	0.381	C	S	.	.			trans	-78.5	141.6	170.9	-58.5	-176.9	0	0	0	110.4	F709 L725 V782 H785 I786 L792	F709-L796 HydrophobicContact CB-CD2 3.85Å; F709-L796 HydrophobicContact CD1-CB 3.84Å; F709-L796 HydrophobicContact CD1-CD1 4.42Å; F709-L796 HydrophobicContact CD1-CD2 4.02Å; F709-L796 HydrophobicContact CD1-CG 4.3Å; F709-L796 HydrophobicContact CD2-CD1 4.14Å; F709-L796 HydrophobicContact CD2-CD2 4.31Å; F709-L796 HydrophobicContact CE1-CB 3.86Å; F709-L796 HydrophobicContact CE1-CD1 4.37Å; F709-L796 HydrophobicContact CE2-CD1 4.07Å; F709-L796 HydrophobicContact CG-CB 4.44Å; F709-L796 HydrophobicContact CG-CD1 4.32Å; F709-L796 HydrophobicContact CG-CD2 3.81Å; F709-L796 HydrophobicContact CG-CG 4.4Å; F709-L796 HydrophobicContact CZ-CB 4.44Å; F709-L796 HydrophobicContact CZ-CD1 4.2Å; L725-L796 HydrophobicContact CD1-CD2 3.68Å; L725-L796 HydrophobicContact CD2-CD2 4.15Å; L725-L796 HydrophobicContact CG-CD2 4.46Å; V782-L796 HydrophobicContact CG2-CD1 4.37Å; H785-L796 HydrophobicContact CB-CD1 3.59Å; H785-L796 HydrophobicContact CB-CG 3.83Å; H785-L796 PolarHBondContact O-N 3.23Å; I786-L796 WeakPolarHBondContact CA-O 3.3Å; I786-L796 HydrophobicContact CG1-CB 4.05Å; L792-L796 HydrophobicContact CD1-CD1 4.41Å; L792-L796 HydrophobicContact CD1-CD2 3.8Å; L792-L796 HydrophobicContact CD1-CG 4.03Å
797	R	91.8	Very high	69.4	Low	108 Å²	108	77.7 Å²	77.7	41%	0.408	40%	0.401	S	S	.	.			trans	-113.7	120	173.4	-69.7	166.9	77.3	179.7	-2	109.1	E705 P706 G707 F709	E705-R797 IonicContact OE2-CZ 2.85Å; E705-R797 IonicContact OE2-NH1 2.69Å; E705-R797 PolarHBondContact OE2-NH1 2.91Å; E705-R797 IonicContact OE2-NH2 3.96Å; E705-R797 PolarHBondContact OE2-NH2 2.93Å; P706-R797 WeakPolarHBondContact O-CD 3.42Å; P706-R797 PolarHBondContact O-NH1 3.37Å; G707-R797 PolarHBondContact O-N 2.86Å; F709-R797 WeakPolarHBondContact CE1-O 3.35Å
798	L	89.6	Confident	66.7	Low	20 Å²	20	78.8 Å²	78.8	11%	0.105	41%	0.411	C	S	.	.			trans	-62.2	143.7	171.3	-71.7	-179.5	0	0	0	110.6	Q679 V680 T683 F709 V782 I786 L800	Q679-L798 HydrophobicContact CG-CD1 3.93Å; V680-L798 HydrophobicContact CG2-CD1 4.04Å; V680-L798 HydrophobicContact CG2-CD2 4.44Å; T683-L798 HydrophobicContact CG2-CB 4.48Å; T683-L798 HydrophobicContact CG2-CD1 4.32Å; T683-L798 WeakPolarHBondContact OG1-CD2 3.29Å; F709-L798 HydrophobicContact CE1-CD2 4.47Å; F709-L798 HydrophobicContact CZ-CD2 4.35Å; V782-L798 HydrophobicContact CG1-CD2 4.32Å; I786-L798 HydrophobicContact CD1-CD1 3.81Å; I786-L798 HydrophobicContact CD1-CD2 3.65Å; I786-L798 HydrophobicContact CD1-CG 3.47Å; I786-L798 VanDerWaalsContact CD1-CG 3.47Å; I786-L798 HydrophobicContact CG1-CG 4.19Å; L798-L800 PolarHBondContact O-N 2.83Å; L798-L800 VanDerWaalsContact O-N 3.17Å
799	P	81.1	Confident	64.1	Low	48 Å²	48	81.4 Å²	81.4	31%	0.312	43%	0.425	S	S	.	.			trans	-54.6	118.9	168.6	-27	36.6	0	0	0	111.5	F801	P799-F801 HydrophobicContact CB-CE1 4.45Å; P799-F801 PolarHBondContact O-N 2.66Å
800	L	61.5	Low	61.8	Low	127 Å²	127	85.1 Å²	85.1	67%	0.665	44%	0.443	S	S	*	.			trans	-80.4	113.9	-176.7	-68.5	173.8	0	0	0	111.6	L798 T802	L798-L800 PolarHBondContact O-N 2.83Å; L798-L800 VanDerWaalsContact O-N 3.17Å; L800-T802 VanDerWaalsContact C-N 3.29Å; L800-T802 PolarHBondContact O-N 3.16Å
801	F	50.9	Low	59	Low	121 Å²	121	93.3 Å²	93.3	53%	0.531	46%	0.46	S	S	.	.			trans	-82.8	66.9	171.2	-49.7	-45.8	0	0	0	112	T683 Y686 P799	T683-F801 HydrophobicContact CG2-CD2 4.46Å; T683-F801 HydrophobicContact CG2-CE2 3.47Å; T683-F801 VanDerWaalsContact CG2-CE2 3.47Å; T683-F801 HydrophobicContact CG2-CZ 3.71Å; Y686-F801 AromaticContact CD2-CE1 3.67Å; Y686-F801 HydrophobicContact CD2-CE1 3.67Å; Y686-F801 AromaticContact CD2-CZ 3.38Å; Y686-F801 HydrophobicContact CD2-CZ 3.38Å; Y686-F801 HydrophobicContact CE1-CE1 4.45Å; Y686-F801 AromaticContact CE2-CE1 3.43Å; Y686-F801 HydrophobicContact CE2-CE1 3.43Å; Y686-F801 VanDerWaalsContact CE2-CE1 3.43Å; Y686-F801 HydrophobicContact CE2-CE2 4.3Å; Y686-F801 AromaticContact CE2-CZ 3.24Å; Y686-F801 HydrophobicContact CE2-CZ 3.24Å; Y686-F801 HydrophobicContact CG-CE1 4.25Å; Y686-F801 HydrophobicContact CG-CZ 4.32Å; Y686-F801 AromaticContact CZ-CE1 3.88Å; P799-F801 HydrophobicContact CB-CE1 4.45Å; P799-F801 PolarHBondContact O-N 2.66Å
802	T	34.7	Very low	56.4	Low	73 Å²	73	99.1 Å²	99.1	45%	0.448	50%	0.495	S	S	.	.			trans	-84.7	132.8	163	59.1	0	0	0	0	109.3	L800 Q804 T805	L800-T802 VanDerWaalsContact C-N 3.29Å; L800-T802 PolarHBondContact O-N 3.16Å; T802-Q804 PolarHBondContact O-N 3.2Å; T802-T805 PolarHBondContact O-OG1 3.27Å
803	N	32.7	Very low	53.6	Low	111 Å²	111	105.1 Å²	105.1	59%	0.594	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	15.2	179.9	-84.7	-64.3	0	0	0	114.2
804	Q	29.3	Very low	51	Low	152 Å²	152	109.8 Å²	109.8	71%	0.71	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.1	-23.7	-167.4	-63.9	-179.4	-3.9	0	0	114	T802 L806 F807	T802-Q804 PolarHBondContact O-N 3.2Å; Q804-L806 VanDerWaalsContact C-N 3.26Å; Q804-L806 PolarHBondContact O-N 3.13Å; Q804-F807 PolarHBondContact O-N 3.41Å
805	T	32.9	Very low	48.2	Very low	96 Å²	96	116.5 Å²	116.5	59%	0.589	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-18.4	-177.8	44.8	0	0	0	0	114	T802 F807	T802-T805 PolarHBondContact O-OG1 3.27Å; T805-F807 VanDerWaalsContact C-N 3.33Å; T805-F807 PolarHBondContact O-N 3.33Å
806	L	33.7	Very low	45.2	Very low	123 Å²	123	121.7 Å²	121.7	64%	0.644	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	6.7	177.6	-92.3	165	0	0	0	115	Q804	Q804-L806 VanDerWaalsContact C-N 3.26Å; Q804-L806 PolarHBondContact O-N 3.13Å
807	F	32.2	Very low	42.2	Very low	141 Å²	141	129.4 Å²	129.4	62%	0.618	65%	0.651	S	S	*	*	S	Bend	trans	-118.4	-13.2	-176.4	-111.4	-101.1	0	0	0	115.9	Q804 T805	Q804-F807 PolarHBondContact O-N 3.41Å; T805-F807 VanDerWaalsContact C-N 3.33Å; T805-F807 PolarHBondContact O-N 3.33Å
808	N	30.5	Very low	39.4	Very low	147 Å²	147	130 Å²	130	79%	0.786	67%	0.666	S	S	*	*	S	Bend	trans	-117.1	16.2	-167.8	-74.2	-8.4	0	0	0	115.5
809	Q	35.1	Very low	36.6	Very low	182 Å²	182	133.9 Å²	133.9	85%	0.85	69%	0.691	S	S	*	*	S	Bend	trans	-124.2	1.5	175.9	-70.9	-167.5	-5.7	0	0	115.5
810	Q	35.5	Very low	34	Very low	175 Å²	175	142.4 Å²	142.4	82%	0.818	72%	0.718	S	S	*	*	S	Bend	trans	-120.1	31	-178.3	-72.2	-176.2	-24	0	0	113.7
811	R	29	Very low	32.4	Very low	214 Å²	214	139.4 Å²	139.4	81%	0.808	72%	0.718	S	S	*	*			trans	-143.2	53.9	179.8	-153.4	-172.9	-68.1	-153.8	-1.1	115.9
812	T	30	Very low	31.5	Very low	130 Å²	130	138.9 Å²	138.9	80%	0.798	72%	0.72	S	S	*	*	S	Bend	trans	-148.7	140.1	159.1	18.6	0	0	0	0	110.9
813	T	33.3	Very low	31.4	Very low	130 Å²	130	143.6 Å²	143.6	80%	0.798	74%	0.737	S	S	*	*			trans	53.3	76.1	161.3	56.9	0	0	0	0	118.7	N815	T813-N815 PolarHBondContact O-N 3.37Å
814	V	30.5	Very low	31.3	Very low	133 Å²	133	142.7 Å²	142.7	81%	0.806	74%	0.738	S	S	*	*				-0.7	111.1	128.2	-175.4	0	0	0	0	116.1
815	N	31.4	Very low	31.4	Very low	155 Å²	155	139.6 Å²	139.6	83%	0.829	73%	0.733	S	S	*	*				-173	170.5	125	-96.4	-20.2	0	0	0	110.3	T813	T813-N815 PolarHBondContact O-N 3.37Å
816	E	29.2	Very low	31.2	Very low	167 Å²	167	140.6 Å²	140.6	78%	0.78	73%	0.734	S	S	*	*			trans	-95.2	177.7	-155.4	-54.5	-175.2	138.9	0	0	116.3
817	Q	32.6	Very low	31	Very low	164 Å²	164	139.3 Å²	139.3	77%	0.766	72%	0.724	S	S	*	*			trans	90.4	97.9	156.8	-63	175.2	33.6	0	0	119.2
818	T	32.1	Very low	30.9	Very low	120 Å²	120	138.4 Å²	138.4	74%	0.736	73%	0.73	S	S	*	*				87.7	88.6	121.4	-50.9	0	0	0	0	118.8
819	V	30.4	Very low	31.1	Very low	103 Å²	103	138 Å²	138	62%	0.624	73%	0.727	S	S	*	*				97.5	133.1	125.7	166.4	0	0	0	0	120.4
820	Y	26.9	Very low	30.7	Very low	227 Å²	227	135.3 Å²	135.3	89%	0.89	72%	0.718	S	S	*	*			trans	57	77	171.5	-52.7	-37.4	0	0	0	118.5
821	G	28.7	Very low	30.3	Very low	64 Å²	64	131.5 Å²	131.5	66%	0.66	71%	0.708	S	S	*	*			trans	-140.1	114	164.1	0	0	0	0	0	113.8
822	L	31.8	Very low	30.5	Very low	109 Å²	109	127 Å²	127	57%	0.571	71%	0.705	S	S	*	*			trans	41.4	89	141.6	-52.2	179.1	0	0	0	119.1	L700	L700-L822 HydrophobicContact CD2-CD2 3.84Å
823	E	32	Very low	31.4	Very low	172 Å²	172	125.3 Å²	125.3	80%	0.804	69%	0.694	S	S	*	*			trans	-111.6	141.7	167.9	-89.7	-65.2	138.2	0	0	112.5
824	P	31	Very low	33.1	Very low	93 Å²	93	123.2 Å²	123.2	60%	0.604	68%	0.678	S	S	*	*			trans	-110.8	153.4	-168.5	38.1	-28.2	0	0	0	116.3
825	S	29.9	Very low	35.5	Very low	87 Å²	87	119 Å²	119	61%	0.608	65%	0.653	S	S	*	*	S	Bend	trans	77.4	129.7	157	78.4	0	0	0	0	120.1
826	L	29.6	Very low	38.2	Very low	116 Å²	116	113 Å²	113	61%	0.607	62%	0.62	S	S	*	*			trans	58.2	54.4	154	-56.8	179.4	0	0	0	118	K685	K685-L826 HydrophobicContact CD-CD2 4.47Å
827	Q	30.3	Very low	41.1	Very low	96 Å²	96	107.4 Å²	107.4	45%	0.449	60%	0.599	S	S	.	*			trans	-88.2	133	141.3	-78.9	-169.4	4	0	0	110.7	I829 N834	Q827-I829 VanDerWaalsContact C-N 3.31Å; Q827-I829 HydrophobicContact CB-CG1 3.82Å; Q827-I829 PolarHBondContact O-N 3.02Å; Q827-N834 PolarHBondContact NE2-OD1 2.84Å
828	T	29.6	Very low	43.9	Very low	122 Å²	122	99.7 Å²	99.7	75%	0.748	56%	0.563	S	S	*	*			trans	-57.3	98.9	142.8	-62.8	0	0	0	0	107.2	L830	T828-L830 CarbonylContact O-C 3.57Å; T828-L830 PolarHBondContact O-N 2.88Å
829	I	34.6	Very low	46.8	Very low	140 Å²	140	95.7 Å²	95.7	72%	0.718	54%	0.537	S	S	*	.	S	Bend	trans	-90.4	73.3	172.1	-52.5	174	0	0	0	106.8	Q827	Q827-I829 VanDerWaalsContact C-N 3.31Å; Q827-I829 HydrophobicContact CB-CG1 3.82Å; Q827-I829 PolarHBondContact O-N 3.02Å
830	L	26.6	Very low	49.7	Very low	125 Å²	125	90.8 Å²	90.8	65%	0.654	51%	0.508	S	S	*	.	S	Bend		-46.8	111	80.6	-126.7	72.9	0	0	0	115.9	T828 T832	T828-L830 CarbonylContact O-C 3.57Å; T828-L830 PolarHBondContact O-N 2.88Å; L830-T832 PolarHBondContact O-N 3.12Å
831	P	28	Very low	52.9	Low	95 Å²	95	80.1 Å²	80.1	62%	0.617	47%	0.466	S	S	*	.	S	Bend	trans	-59.1	141.2	170.3	27.6	-33.9	0	0	0	109.3
832	T	33	Very low	56	Low	119 Å²	119	77.5 Å²	77.5	73%	0.73	44%	0.436	S	S	*	.	S	Bend	trans	77.1	88.4	-167.4	73.6	0	0	0	0	115.7	L830	L830-T832 PolarHBondContact O-N 3.12Å
833	T	48.1	Very low	58.9	Low	95 Å²	95	72.4 Å²	72.4	58%	0.583	41%	0.41	S	S	*	.				168.7	131.2	115.2	38.1	0	0	0	0	111.1	T835	T833-T835 VanDerWaalsContact C-N 3.28Å; T833-T835 PolarHBondContact O-N 3.34Å
834	N	68.3	Low	61.8	Low	86 Å²	86	64.4 Å²	64.4	46%	0.46	37%	0.373	S	S	.	.			trans	-75.1	71.2	178.4	-71.7	-1.3	0	0	0	111.8	Q827 P887 I977	Q827-N834 PolarHBondContact NE2-OD1 2.84Å; N834-P887 HydrophobicContact CB-CG 3.92Å; N834-P887 VanDerWaalsContact O-CD 3.23Å; N834-P887 WeakPolarHBondContact O-CD 3.3Å; N834-P887 WeakPolarHBondContact O-CG 3.43Å; N834-I977 HydrophobicContact CB-CD1 3.95Å
835	T	82.3	Confident	64.9	Low	43 Å²	43	62.1 Å²	62.1	26%	0.264	36%	0.36	S	S	.	.			trans	-124.4	141.9	-179.4	72	0	0	0	0	113	T833 V885 I886	T833-T835 VanDerWaalsContact C-N 3.28Å; T833-T835 PolarHBondContact O-N 3.34Å; T835-V885 VanDerWaalsContact CA-O 3.3Å; T835-V885 WeakPolarHBondContact CA-O 3.28Å; T835-V885 VanDerWaalsContact CB-O 3.29Å; T835-V885 WeakPolarHBondContact CB-O 3.19Å; T835-I886 HydrophobicContact CG2-CB 4.21Å; T835-I886 HydrophobicContact CG2-CG1 3.91Å; T835-I886 HydrophobicContact CG2-CG2 4.06Å
836	M	87.6	Confident	67.9	Low	31 Å²	31	58.6 Å²	58.6	15%	0.153	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	145.5	174.6	179.3	172.2	174.2	0	0	109.3	T838 K884 V885 L970 F973	M836-T838 WeakPolarHBondContact CE-OG1 3.47Å; M836-K884 CarbonylContact O-C 3.56Å; M836-K884 WeakPolarHBondContact O-CA 3.14Å; M836-V885 PolarHBondContact N-O 3.13Å; M836-V885 PolarHBondContact O-N 2.88Å; M836-L970 HydrophobicContact CE-CB 4.12Å; M836-L970 HydrophobicContact CE-CD1 4.17Å; M836-L970 HydrophobicContact SD-CD1 4.23Å; M836-F973 HydrophobicContact CB-CD1 3.51Å; M836-F973 HydrophobicContact CB-CD2 4.07Å; M836-F973 HydrophobicContact CB-CE1 3.42Å; M836-F973 VanDerWaalsContact CB-CE1 3.42Å; M836-F973 HydrophobicContact CB-CE2 3.99Å; M836-F973 HydrophobicContact CB-CG 3.85Å; M836-F973 HydrophobicContact CB-CZ 3.68Å; M836-F973 HydrophobicContact CG-CD1 4.33Å; M836-F973 HydrophobicContact CG-CG 4.34Å; M836-F973 HydrophobicContact SD-CB 3.41Å; M836-F973 WeakPolarHBondContact SD-CB 2.97Å; M836-F973 HydrophobicContact SD-CD1 3.91Å; M836-F973 HydrophobicContact SD-CD2 4Å; M836-F973 HydrophobicContact SD-CG 3.49Å; M836-F973 WeakPolarHBondContact SD-CG 2.7Å
837	S	89.6	Confident	70.9	Confident	48 Å²	48	57.4 Å²	57.4	34%	0.336	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	139.2	169.8	-167.1	0	0	0	0	108.8	Q882 I883	S837-Q882 WeakPolarHBondContact OG-CG 3.21Å; S837-I883 CarbonylContact C-O 3.42Å; S837-I883 WeakPolarHBondContact CA-O 3.48Å
838	T	91.7	Very high	73.7	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.012	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	139.1	-173.2	-80.2	0	0	0	0	109.9	M836 M840 I883 H965 L970	M836-T838 WeakPolarHBondContact CE-OG1 3.47Å; T838-M840 HydrophobicContact CG2-CE 3.51Å; T838-M840 HydrophobicContact CG2-CG 4.13Å; T838-I883 PolarHBondContact N-O 3.01Å; T838-I883 PolarHBondContact O-N 3.2Å; T838-H965 HydrophobicContact CG2-CB 3.68Å; T838-H965 PolarHBondContact OG1-ND1 3.37Å; T838-L970 HydrophobicContact CG2-CB 4.43Å; T838-L970 HydrophobicContact CG2-CD2 4.09Å
839	D	92.2	Very high	76.3	Confident	36 Å²	36	52.1 Å²	52.1	19%	0.193	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	136.3	-180	-64	-35.9	0	0	0	110.9	V881 Q882 K896	D839-V881 WeakPolarHBondContact CA-O 3.4Å; D839-Q882 WeakPolarHBondContact OD1-CA 3.47Å; D839-Q882 VanDerWaalsContact OD1-CB 3.3Å; D839-Q882 WeakPolarHBondContact OD1-CB 3.36Å; D839-Q882 WeakPolarHBondContact OD1-CG 3.47Å; D839-K896 WeakPolarHBondContact OD1-CE 3.44Å; D839-K896 IonicContact OD1-NZ 3.23Å; D839-K896 PolarHBondContact OD1-NZ 2.99Å; D839-K896 WeakPolarHBondContact OD2-CE 3.4Å; D839-K896 IonicContact OD2-NZ 3.99Å; D839-K896 PolarHBondContact OD2-NZ 3.13Å
840	M	92.7	Very high	78.4	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	154.3	-174.6	-74.4	-73.7	151.9	0	0	110.3	T838 V881 I883 L939 F958 H965 A967 L970	T838-M840 HydrophobicContact CG2-CE 3.51Å; T838-M840 HydrophobicContact CG2-CG 4.13Å; M840-V881 HydrophobicContact CB-CG2 4.31Å; M840-V881 PolarHBondContact N-O 3.08Å; M840-V881 WeakPolarHBondContact O-CG2 3.49Å; M840-V881 PolarHBondContact O-N 3.04Å; M840-I883 HydrophobicContact CB-CD1 3.8Å; M840-I883 HydrophobicContact CB-CG1 4.16Å; M840-I883 HydrophobicContact CG-CD1 3.79Å; M840-I883 HydrophobicContact CG-CG1 4.28Å; M840-L939 HydrophobicContact CE-CD2 4.34Å; M840-L939 HydrophobicContact CG-CD2 4.43Å; M840-L939 HydrophobicContact SD-CD2 3.75Å; M840-F958 HydrophobicContact CB-CB 4.27Å; M840-H965 WeakPolarHBondContact CE-O 3.28Å; M840-A967 HydrophobicContact CE-CB 4.39Å; M840-L970 HydrophobicContact CE-CD2 4.31Å; M840-L970 HydrophobicContact CG-CD2 4.1Å
841	L	92.7	Very high	81.3	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.021	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	112.4	167.9	-173.8	72.7	0	0	0	109.5	L843 R878 F923 L928 F958 C959 I961	L841-L843 HydrophobicContact CD2-CD2 3.6Å; L841-L843 HydrophobicContact CG-CD2 3.97Å; L841-R878 HydrophobicContact CD1-CG 3.76Å; L841-R878 HydrophobicContact CD2-CG 4.28Å; L841-R878 VanDerWaalsContact CD2-CZ 3.44Å; L841-R878 HydrophobicContact CG-CG 4.17Å; L841-F923 HydrophobicContact CD2-CD1 4.32Å; L841-F923 HydrophobicContact CD2-CE1 4.01Å; L841-L928 HydrophobicContact CD2-CD1 3.97Å; L841-L928 HydrophobicContact CD2-CD2 4.17Å; L841-L928 HydrophobicContact CD2-CG 4.25Å; L841-F958 CarbonylContact O-C 3.4Å; L841-F958 WeakPolarHBondContact O-CA 3.43Å; L841-C959 HydrophobicContact CB-CB 4.21Å; L841-C959 PolarHBondContact N-O 2.91Å; L841-C959 PolarHBondContact O-N 2.82Å; L841-I961 HydrophobicContact CB-CB 4.28Å; L841-I961 HydrophobicContact CB-CD1 4.21Å; L841-I961 HydrophobicContact CD1-CD1 4.2Å
842	Y	94.3	Very high	84	Confident	9 Å²	9	51.9 Å²	51.9	4%	0.035	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	126.8	168.4	176.5	-118.1	0	0	0	109.6	G844 S845 K877 R878 C879 W902 Y956 F958	Y842-G844 VanDerWaalsContact CE2-C 3.46Å; Y842-G844 WeakPolarHBondContact CE2-O 3.31Å; Y842-G844 VanDerWaalsContact CZ-C 3.44Å; Y842-S845 VanDerWaalsContact OH-CB 3.31Å; Y842-S845 WeakPolarHBondContact OH-CB 3.37Å; Y842-S845 PolarHBondContact OH-N 2.66Å; Y842-K877 WeakPolarHBondContact CD1-O 3.3Å; Y842-R878 VanDerWaalsContact O-CA 3.29Å; Y842-R878 WeakPolarHBondContact O-CA 3.48Å; Y842-C879 WeakPolarHBondContact CB-O 3.42Å; Y842-C879 PolarHBondContact N-O 2.8Å; Y842-C879 PolarHBondContact O-N 3.49Å; Y842-C879 VanDerWaalsContact O-N 3.13Å; Y842-W902 HydrophobicContact CD1-CH2 4.11Å; Y842-W902 HydrophobicContact CD1-CZ3 4.1Å; Y842-W902 AromaticContact CE1-CH2 3.64Å; Y842-W902 HydrophobicContact CE1-CH2 3.64Å; Y842-W902 HydrophobicContact CE1-CZ2 4.39Å; Y842-W902 HydrophobicContact CE1-CZ3 4.07Å; Y842-W902 HydrophobicContact CE2-CH2 4.22Å; Y842-W902 HydrophobicContact CG-CZ3 4.49Å; Y842-W902 AromaticContact CZ-CH2 3.68Å; Y842-Y956 HydrophobicContact CE2-CD1 4.08Å; Y842-F958 AromaticContact CD2-CD1 3.77Å; Y842-F958 HydrophobicContact CD2-CD1 3.77Å; Y842-F958 AromaticContact CD2-CE1 3.55Å; Y842-F958 HydrophobicContact CD2-CE1 3.55Å; Y842-F958 HydrophobicContact CD2-CZ 4.13Å; Y842-F958 HydrophobicContact CE2-CE1 4.34Å; Y842-F958 HydrophobicContact CG-CD1 4.37Å; Y842-F958 HydrophobicContact CG-CE1 4.31Å
843	L	93.7	Very high	86.6	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.01	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-33.8	178.9	-60.3	-170.6	0	0	0	112.2	L841 I864 L875 F923 V957 C959	L841-L843 HydrophobicContact CD2-CD2 3.6Å; L841-L843 HydrophobicContact CG-CD2 3.97Å; L843-I864 HydrophobicContact CB-CG2 3.76Å; L843-I864 HydrophobicContact CD1-CG2 4.2Å; L843-L875 HydrophobicContact CB-CD1 3.99Å; L843-L875 HydrophobicContact CD2-CD1 4.27Å; L843-F923 HydrophobicContact CD1-CB 4.03Å; L843-F923 HydrophobicContact CD1-CD1 4.03Å; L843-F923 HydrophobicContact CD1-CD2 3.68Å; L843-F923 HydrophobicContact CD1-CE1 4.46Å; L843-F923 HydrophobicContact CD1-CE2 4.15Å; L843-F923 HydrophobicContact CD1-CG 3.62Å; L843-F923 HydrophobicContact CD2-CD1 3.68Å; L843-F923 HydrophobicContact CD2-CD2 4.39Å; L843-F923 HydrophobicContact CD2-CE1 3.5Å; L843-F923 VanDerWaalsContact CD2-CE1 3.5Å; L843-F923 HydrophobicContact CD2-CE2 4.24Å; L843-F923 HydrophobicContact CD2-CG 4.14Å; L843-F923 HydrophobicContact CD2-CZ 3.81Å; L843-V957 HydrophobicContact CB-CB 4.46Å; L843-V957 HydrophobicContact CB-CG1 4.32Å; L843-V957 HydrophobicContact CD1-CG1 4.11Å; L843-V957 PolarHBondContact N-O 3.44Å; L843-C959 HydrophobicContact CD1-CB 4Å; L843-C959 HydrophobicContact CD2-CB 4.11Å; L843-C959 HydrophobicContact CG-CB 4.03Å
844	G	93.1	Very high	88.8	Confident	3 Å²	3	47.2 Å²	47.2	3%	0.031	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	157	-174.1	176.7	0	0	0	0	0	114.3	Y842 V957	Y842-G844 VanDerWaalsContact CE2-C 3.46Å; Y842-G844 WeakPolarHBondContact CE2-O 3.31Å; Y842-G844 VanDerWaalsContact CZ-C 3.44Å; G844-V957 PolarHBondContact N-O 2.87Å; G844-V957 PolarHBondContact O-N 2.79Å
845	S	94	Very high	90	Very high	46 Å²	46	47.9 Å²	47.9	32%	0.322	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	133.9	177.8	62.2	0	0	0	0	111.1	Y842 V955	Y842-S845 VanDerWaalsContact OH-CB 3.31Å; Y842-S845 WeakPolarHBondContact OH-CB 3.37Å; Y842-S845 PolarHBondContact OH-N 2.66Å; S845-V955 CarbonylContact C-O 3.52Å; S845-V955 VanDerWaalsContact CA-O 3.27Å; S845-V955 WeakPolarHBondContact CA-O 3.17Å
846	V	93.6	Very high	90.5	Very high	12 Å²	12	45.9 Å²	45.9	7%	0.073	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	130.4	-179.9	173.7	0	0	0	0	110.4	V848 K863 I864 V954 V955	V846-V848 HydrophobicContact CG1-CG1 4.03Å; V846-K863 HydrophobicContact CG1-CB 4.16Å; V846-K863 HydrophobicContact CG1-CD 3.37Å; V846-K863 HydrophobicContact CG1-CG 4.42Å; V846-K863 HydrophobicContact CG2-CB 4.07Å; V846-I864 HydrophobicContact CG2-CD1 3.68Å; V846-I864 HydrophobicContact CG2-CG1 3.66Å; V846-V954 WeakPolarHBondContact O-CA 3.39Å; V846-V955 PolarHBondContact N-O 2.98Å; V846-V955 PolarHBondContact O-N 3.18Å
847	E	92.2	Very high	90.9	Very high	91 Å²	91	44.4 Å²	44.4	43%	0.425	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	133	173.3	-51.5	-168.5	165	0	0	109.1	K863 K945 R947	E847-K863 PolarHBondContact O-NZ 3.4Å; E847-K945 IonicContact OE1-NZ 3.38Å; E847-K945 PolarHBondContact OE1-NZ 3.1Å; E847-K945 IonicContact OE2-NZ 3.89Å; E847-K945 PolarHBondContact OE2-NZ 3.14Å; E847-R947 IonicContact OE2-NH1 2.75Å
848	V	90.3	Very high	91.2	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	129.2	-178.8	-62	0	0	0	0	110.5	V846 R850 L851 A856 R859 N953 V955	V846-V848 HydrophobicContact CG1-CG1 4.03Å; V848-R850 PolarHBondContact O-N 2.87Å; V848-L851 HydrophobicContact CB-CB 4.43Å; V848-L851 HydrophobicContact CG2-CB 4.29Å; V848-A856 HydrophobicContact CG2-CB 3.98Å; V848-R859 HydrophobicContact CG1-CG 4.18Å; V848-N953 HydrophobicContact CG2-CB 4.03Å; V848-N953 PolarHBondContact N-O 3.5Å; V848-N953 PolarHBondContact O-N 3.41Å; V848-V955 HydrophobicContact CG1-CG2 4.08Å; V848-V955 HydrophobicContact CG2-CG2 3.87Å
849	D	84	Confident	91.3	Very high	107 Å²	107	50.2 Å²	50.2	57%	0.572	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	113.4	-174.8	-46.3	-80.5	0	0	0	110.2	L851	D849-L851 PolarHBondContact O-N 2.92Å
850	R	78.6	Confident	91.5	Very high	220 Å²	220	48.5 Å²	48.5	83%	0.83	23%	0.229	S	C	*	.	S	Bend	trans	57.8	-5.3	175.1	-54.3	-178.8	-178.4	-178.5	-0.4	117.7	V848	V848-R850 PolarHBondContact O-N 2.87Å
851	L	86.8	Confident	91.6	Very high	55 Å²	55	48.5 Å²	48.5	29%	0.288	23%	0.229	S	C	.	.			trans	-71.6	138.7	175.1	-69.1	168.7	0	0	0	110.5	V848 D849 N855 A856 R859 N953	V848-L851 HydrophobicContact CB-CB 4.43Å; V848-L851 HydrophobicContact CG2-CB 4.29Å; D849-L851 PolarHBondContact O-N 2.92Å; L851-N855 HydrophobicContact CD2-CB 4.34Å; L851-A856 HydrophobicContact CB-CB 4.05Å; L851-R859 HydrophobicContact CD1-CB 4.39Å; L851-N953 PolarHBondContact O-ND2 3.2Å
852	E	84.8	Confident	91.7	Very high	80 Å²	80	49.4 Å²	49.4	37%	0.374	24%	0.239	S	C	.	.			trans	-124.4	170.9	177.8	-68.9	-175.4	175.9	0	0	110.2	N855 A856 L912 N953 R982	E852-N855 PolarHBondContact O-N 3.36Å; E852-A856 PolarHBondContact O-N 2.93Å; E852-A856 VanDerWaalsContact O-N 3.1Å; E852-L912 HydrophobicContact CG-CD1 4.33Å; E852-N953 VanDerWaalsContact CG-ND2 3.31Å; E852-N953 WeakPolarHBondContact CG-ND2 3.31Å; E852-R982 IonicContact OE2-NH1 3.68Å
853	N	89	Confident	91.7	Very high	29 Å²	29	53.1 Å²	53.1	16%	0.155	26%	0.256	C	S	.	.	H	α-helix	trans	49.9	-147.2	172.6	-55.5	14.3	0	0	0	114.5	N855 A856 A857 W913 R982 D983	N853-N855 PolarHBondContact O-N 2.95Å; N853-N855 VanDerWaalsContact O-N 3.14Å; N853-A856 WeakPolarHBondContact O-CB 3.31Å; N853-A856 PolarHBondContact O-N 2.77Å; N853-A857 PolarHBondContact O-N 2.82Å; N853-W913 HydrophobicContact CB-CG 4.32Å; N853-R982 VanDerWaalsContact CG-O 3.28Å; N853-R982 VanDerWaalsContact ND2-CB 3.33Å; N853-R982 WeakPolarHBondContact ND2-CB 3.33Å; N853-R982 PolarHBondContact ND2-O 2.69Å; N853-R982 VanDerWaalsContact ND2-O 3.1Å; N853-D983 PolarHBondContact ND2-O 2.8Å
854	M	92.8	Very high	91.7	Very high	88 Å²	88	53.3 Å²	53.3	43%	0.433	26%	0.257	S	S	.	.	H	α-helix	trans	-47.1	-38.6	177.3	-161.9	176.8	67	0	0	113.7	A857 I858 W913 P918	M854-A857 WeakPolarHBondContact O-CB 3.48Å; M854-A857 PolarHBondContact O-N 3.09Å; M854-I858 HydrophobicContact CG-CD1 4.27Å; M854-I858 WeakPolarHBondContact O-CG1 3.06Å; M854-I858 PolarHBondContact O-N 3.1Å; M854-W913 HydrophobicContact CB-CZ2 4.27Å; M854-W913 HydrophobicContact CG-CZ2 4.33Å; M854-P918 HydrophobicContact CB-CG 4.44Å; M854-P918 HydrophobicContact CG-CB 3.5Å; M854-P918 HydrophobicContact CG-CG 3.28Å; M854-P918 HydrophobicContact SD-CB 3.86Å; M854-P918 HydrophobicContact SD-CG 4.25Å
855	N	93.7	Very high	91.6	Very high	100 Å²	100	54.5 Å²	54.5	54%	0.535	26%	0.262	S	S	.	.	H	α-helix	trans	-69.3	-35.4	-178.8	-68.3	-37.6	0	0	0	113	L851 E852 N853 R859	L851-N855 HydrophobicContact CD2-CB 4.34Å; E852-N855 PolarHBondContact O-N 3.36Å; N853-N855 PolarHBondContact O-N 2.95Å; N853-N855 VanDerWaalsContact O-N 3.14Å; N855-R859 PolarHBondContact O-N 3.34Å
856	A	93.9	Very high	91.5	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-64.9	-46.9	169.9	0	0	0	0	0	110.7	V848 L851 E852 N853 I858 R859 G860 V942 V955	V848-A856 HydrophobicContact CG2-CB 3.98Å; L851-A856 HydrophobicContact CB-CB 4.05Å; E852-A856 PolarHBondContact O-N 2.93Å; E852-A856 VanDerWaalsContact O-N 3.1Å; N853-A856 WeakPolarHBondContact O-CB 3.31Å; N853-A856 PolarHBondContact O-N 2.77Å; A856-I858 PolarHBondContact O-N 3.42Å; A856-R859 PolarHBondContact O-N 2.98Å; A856-G860 PolarHBondContact O-N 3.05Å; A856-V942 HydrophobicContact CB-CB 4.44Å; A856-V942 HydrophobicContact CB-CG1 3.7Å; A856-V942 HydrophobicContact CB-CG2 3.81Å; A856-V955 HydrophobicContact CB-CG2 4.11Å; A856-V955 WeakPolarHBondContact O-CG2 3.41Å
857	A	95.4	Very high	91.3	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-57.3	-50.7	-179.8	0	0	0	0	0	112.3	N853 M854 R859 G860 I861 W913 P918 A940 V942	N853-A857 PolarHBondContact O-N 2.82Å; M854-A857 WeakPolarHBondContact O-CB 3.48Å; M854-A857 PolarHBondContact O-N 3.09Å; A857-R859 PolarHBondContact O-N 2.71Å; A857-G860 PolarHBondContact O-N 3.44Å; A857-G860 VanDerWaalsContact O-N 3.14Å; A857-I861 HydrophobicContact CB-CD1 4.47Å; A857-I861 WeakPolarHBondContact O-CB 3.39Å; A857-I861 VanDerWaalsContact O-CG1 3.3Å; A857-I861 WeakPolarHBondContact O-CG1 3.48Å; A857-I861 PolarHBondContact O-N 3.12Å; A857-W913 HydrophobicContact CB-CE3 3.96Å; A857-W913 HydrophobicContact CB-CH2 3.62Å; A857-W913 HydrophobicContact CB-CZ2 4.39Å; A857-W913 HydrophobicContact CB-CZ3 3.38Å; A857-P918 HydrophobicContact CB-CG 4.44Å; A857-A940 HydrophobicContact CB-CB 4.11Å; A857-V942 HydrophobicContact CB-CG2 4.42Å
858	I	95.4	Very high	91.1	Very high	41 Å²	41	55.2 Å²	55.2	21%	0.21	27%	0.274	C	S	.	.	H	α-helix	trans	-53.3	-51.2	178.4	-69.1	164.6	0	0	0	111.4	M854 A856 G862 P918 E919 R921	M854-I858 HydrophobicContact CG-CD1 4.27Å; M854-I858 WeakPolarHBondContact O-CG1 3.06Å; M854-I858 PolarHBondContact O-N 3.1Å; A856-I858 PolarHBondContact O-N 3.42Å; I858-G862 PolarHBondContact O-N 3.11Å; I858-P918 HydrophobicContact CD1-CB 4Å; I858-P918 HydrophobicContact CD1-CG 4.36Å; I858-P918 HydrophobicContact CG1-CB 3.82Å; I858-P918 HydrophobicContact CG1-CG 3.83Å; I858-E919 HydrophobicContact CG1-CG 4.38Å; I858-E919 HydrophobicContact CG2-CG 4.39Å; I858-E919 VanDerWaalsContact CG2-OE1 3.26Å; I858-E919 WeakPolarHBondContact CG2-OE1 3.49Å; I858-R921 PolarHBondContact O-NH2 3.22Å
859	R	94.9	Very high	90.8	Very high	131 Å²	131	63.2 Å²	63.2	49%	0.494	31%	0.311	S	S	.	.	H	α-helix	trans	-67.5	-36.9	179.2	173.5	173.5	-86.4	-148.6	-6.1	112.5	V848 L851 N855 A856 A857 K863	V848-R859 HydrophobicContact CG1-CG 4.18Å; L851-R859 HydrophobicContact CD1-CB 4.39Å; N855-R859 PolarHBondContact O-N 3.34Å; A856-R859 PolarHBondContact O-N 2.98Å; A857-R859 PolarHBondContact O-N 2.71Å; R859-K863 HydrophobicContact CG-CD 4.28Å; R859-K863 WeakPolarHBondContact O-CB 3.39Å; R859-K863 WeakPolarHBondContact O-CG 3.39Å; R859-K863 PolarHBondContact O-N 3.34Å; R859-K863 VanDerWaalsContact O-N 3.11Å
860	G	95	Very high	90.7	Very high	0 Å²	0	63 Å²	63	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-64.4	-50.6	178	0	0	0	0	0	111.9	A856 A857 K863 I864	A856-G860 PolarHBondContact O-N 3.05Å; A857-G860 PolarHBondContact O-N 3.44Å; A857-G860 VanDerWaalsContact O-N 3.14Å; G860-K863 PolarHBondContact O-N 2.86Å; G860-I864 WeakPolarHBondContact O-CG1 3.35Å; G860-I864 PolarHBondContact O-N 3.06Å; G860-I864 VanDerWaalsContact O-N 3.11Å
861	I	95.6	Very high	90.7	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-64.8	-47.7	178.5	-64.2	165.4	0	0	0	110.4	A857 K863 I864 L865 D917 I938 A940 V957	A857-I861 HydrophobicContact CB-CD1 4.47Å; A857-I861 WeakPolarHBondContact O-CB 3.39Å; A857-I861 VanDerWaalsContact O-CG1 3.3Å; A857-I861 WeakPolarHBondContact O-CG1 3.48Å; A857-I861 PolarHBondContact O-N 3.12Å; I861-K863 VanDerWaalsContact C-N 3.31Å; I861-K863 PolarHBondContact O-N 3.47Å; I861-I864 PolarHBondContact O-N 3.27Å; I861-L865 HydrophobicContact CG2-CD1 3.8Å; I861-L865 HydrophobicContact CG2-CG 4.14Å; I861-L865 WeakPolarHBondContact O-CG 3.24Å; I861-L865 PolarHBondContact O-N 3.36Å; I861-D917 HydrophobicContact CD1-CB 3.77Å; I861-D917 WeakPolarHBondContact CD1-OD1 3.4Å; I861-I938 HydrophobicContact CD1-CG2 3.94Å; I861-I938 HydrophobicContact CG1-CG2 4Å; I861-I938 HydrophobicContact CG2-CD1 4.04Å; I861-I938 HydrophobicContact CG2-CG2 3.96Å; I861-A940 HydrophobicContact CD1-CB 3.87Å; I861-A940 HydrophobicContact CG1-CB 4.17Å; I861-V957 HydrophobicContact CG1-CG1 4Å; I861-V957 HydrophobicContact CG1-CG2 3.92Å
862	G	94.5	Very high	89.7	Confident	23 Å²	23	60.7 Å²	60.7	24%	0.237	32%	0.32	C	S	.	.	H	α-helix	trans	-57.4	-39.8	177.9	0	0	0	0	0	113.5	I858 S866	I858-G862 PolarHBondContact O-N 3.11Å; G862-S866 WeakPolarHBondContact O-CB 3.35Å; G862-S866 PolarHBondContact O-N 2.99Å
863	K	93.6	Very high	88.7	Confident	87 Å²	87	64.3 Å²	64.3	38%	0.378	34%	0.342	S	S	.	.	H	α-helix	trans	-64.6	-42.2	172.3	-82.3	174.4	166.3	-171.5	0	112.4	V846 E847 R859 G860 I861 L867	V846-K863 HydrophobicContact CG1-CB 4.16Å; V846-K863 HydrophobicContact CG1-CD 3.37Å; V846-K863 HydrophobicContact CG1-CG 4.42Å; V846-K863 HydrophobicContact CG2-CB 4.07Å; E847-K863 PolarHBondContact O-NZ 3.4Å; R859-K863 HydrophobicContact CG-CD 4.28Å; R859-K863 WeakPolarHBondContact O-CB 3.39Å; R859-K863 WeakPolarHBondContact O-CG 3.39Å; R859-K863 PolarHBondContact O-N 3.34Å; R859-K863 VanDerWaalsContact O-N 3.11Å; G860-K863 PolarHBondContact O-N 2.86Å; I861-K863 VanDerWaalsContact C-N 3.31Å; I861-K863 PolarHBondContact O-N 3.47Å; K863-L867 VanDerWaalsContact O-CG 3.3Å; K863-L867 WeakPolarHBondContact O-CG 3.46Å; K863-L867 PolarHBondContact O-N 3.12Å; K863-L867 VanDerWaalsContact O-N 3.07Å
864	I	93.5	Very high	87.7	Confident	7 Å²	7	64 Å²	64	4%	0.036	35%	0.345	C	S	.	.	H	α-helix	trans	-64.9	-42.7	176.7	-70.8	-62.3	0	0	0	111.6	L843 V846 G860 I861 L867 A868 L875 V957	L843-I864 HydrophobicContact CB-CG2 3.76Å; L843-I864 HydrophobicContact CD1-CG2 4.2Å; V846-I864 HydrophobicContact CG2-CD1 3.68Å; V846-I864 HydrophobicContact CG2-CG1 3.66Å; G860-I864 WeakPolarHBondContact O-CG1 3.35Å; G860-I864 PolarHBondContact O-N 3.06Å; G860-I864 VanDerWaalsContact O-N 3.11Å; I861-I864 PolarHBondContact O-N 3.27Å; I864-L867 PolarHBondContact O-N 2.85Å; I864-A868 PolarHBondContact O-N 3.01Å; I864-L875 HydrophobicContact CG2-CD1 3.83Å; I864-L875 HydrophobicContact CG2-CD2 4.34Å; I864-V957 HydrophobicContact CG1-CB 4.21Å; I864-V957 HydrophobicContact CG1-CG2 3.93Å; I864-V957 HydrophobicContact CG2-CG1 4.48Å
865	L	92.1	Very high	87.2	Confident	28 Å²	28	60.4 Å²	60.4	15%	0.147	33%	0.327	C	S	.	.	H	α-helix	trans	-67	-40.9	178.6	-67.1	177.4	0	0	0	112.3	I861 L867 A868 Q869 R921 F923 I938	I861-L865 HydrophobicContact CG2-CD1 3.8Å; I861-L865 HydrophobicContact CG2-CG 4.14Å; I861-L865 WeakPolarHBondContact O-CG 3.24Å; I861-L865 PolarHBondContact O-N 3.36Å; L865-L867 VanDerWaalsContact C-N 3.33Å; L865-L867 PolarHBondContact O-N 3.06Å; L865-A868 WeakPolarHBondContact O-CB 3.46Å; L865-A868 PolarHBondContact O-N 3.38Å; L865-Q869 WeakPolarHBondContact O-CG 3.22Å; L865-Q869 PolarHBondContact O-N 3.3Å; L865-R921 HydrophobicContact CD1-CB 4Å; L865-R921 HydrophobicContact CD1-CG 4.44Å; L865-F923 HydrophobicContact CD2-CD2 3.84Å; L865-I938 HydrophobicContact CD1-CD1 4.06Å; L865-I938 HydrophobicContact CD2-CD1 3.88Å; L865-I938 HydrophobicContact CG-CD1 4.35Å
866	S	91.2	Very high	86.2	Confident	65 Å²	65	60.1 Å²	60.1	46%	0.455	33%	0.331	S	S	.	.	H	α-helix	trans	-62.7	-38.2	173.6	176.3	0	0	0	0	112.3	G862 Q869 T870	G862-S866 WeakPolarHBondContact O-CB 3.35Å; G862-S866 PolarHBondContact O-N 2.99Å; S866-Q869 PolarHBondContact O-N 3.49Å; S866-T870 PolarHBondContact O-N 3.23Å; S866-T870 PolarHBondContact O-OG1 3.34Å
867	L	89.6	Confident	85.4	Confident	72 Å²	72	67 Å²	67	38%	0.377	36%	0.361	S	S	.	.	H	α-helix	trans	-66.1	-41.7	172.1	-71.5	169.7	0	0	0	111.9	K863 I864 L865 Q869 T870 Y871 L875	K863-L867 VanDerWaalsContact O-CG 3.3Å; K863-L867 WeakPolarHBondContact O-CG 3.46Å; K863-L867 PolarHBondContact O-N 3.12Å; K863-L867 VanDerWaalsContact O-N 3.07Å; I864-L867 PolarHBondContact O-N 2.85Å; L865-L867 VanDerWaalsContact C-N 3.33Å; L865-L867 PolarHBondContact O-N 3.06Å; L867-Q869 VanDerWaalsContact C-N 3.27Å; L867-Q869 PolarHBondContact O-N 3.25Å; L867-T870 WeakPolarHBondContact O-CB 3.42Å; L867-T870 PolarHBondContact O-N 3.27Å; L867-Y871 HydrophobicContact CB-CD2 4.43Å; L867-Y871 HydrophobicContact CB-CE2 4.23Å; L867-Y871 HydrophobicContact CD2-CE2 4.13Å; L867-Y871 WeakPolarHBondContact O-CD2 3.13Å; L867-Y871 PolarHBondContact O-N 3.21Å; L867-Y871 VanDerWaalsContact O-N 3.1Å; L867-L875 HydrophobicContact CB-CD2 3.99Å
868	A	87.5	Confident	85	Confident	27 Å²	27	68.9 Å²	68.9	22%	0.223	37%	0.368	C	S	.	.	H	α-helix	trans	-60.9	-34.4	176.5	0	0	0	0	0	112.9	I864 L865 T870 L875 F923	I864-A868 PolarHBondContact O-N 3.01Å; L865-A868 WeakPolarHBondContact O-CB 3.46Å; L865-A868 PolarHBondContact O-N 3.38Å; A868-T870 VanDerWaalsContact C-N 3.27Å; A868-T870 PolarHBondContact O-N 3.29Å; A868-L875 HydrophobicContact CB-CD1 3.96Å; A868-L875 HydrophobicContact CB-CD2 4.36Å; A868-L875 HydrophobicContact CB-CG 3.93Å; A868-F923 HydrophobicContact CB-CE2 3.9Å
869	Q	84.1	Confident	84.7	Confident	167 Å²	167	67.8 Å²	67.8	78%	0.78	36%	0.364	S	S	*	.	H	α-helix	trans	-72.2	-18	172.8	-69.2	170	-12.9	0	0	113.7	L865 S866 L867	L865-Q869 WeakPolarHBondContact O-CG 3.22Å; L865-Q869 PolarHBondContact O-N 3.3Å; S866-Q869 PolarHBondContact O-N 3.49Å; L867-Q869 VanDerWaalsContact C-N 3.27Å; L867-Q869 PolarHBondContact O-N 3.25Å
870	T	83.4	Confident	84.6	Confident	103 Å²	103	63.2 Å²	63.2	63%	0.632	35%	0.348	S	S	*	.	H	α-helix	trans	-94.2	-28.9	-176.5	-54	0	0	0	0	112.5	S866 L867 A868	S866-T870 PolarHBondContact O-N 3.23Å; S866-T870 PolarHBondContact O-OG1 3.34Å; L867-T870 WeakPolarHBondContact O-CB 3.42Å; L867-T870 PolarHBondContact O-N 3.27Å; A868-T870 VanDerWaalsContact C-N 3.27Å; A868-T870 PolarHBondContact O-N 3.29Å
871	Y	77.5	Confident	84.5	Confident	109 Å²	109	63.2 Å²	63.2	43%	0.427	35%	0.348	S	S	.	.			trans	-94.1	112.2	177.8	-66.8	-68.5	0	0	0	111.4	L867 D873 G874 P876	L867-Y871 HydrophobicContact CB-CD2 4.43Å; L867-Y871 HydrophobicContact CB-CE2 4.23Å; L867-Y871 HydrophobicContact CD2-CE2 4.13Å; L867-Y871 WeakPolarHBondContact O-CD2 3.13Å; L867-Y871 PolarHBondContact O-N 3.21Å; L867-Y871 VanDerWaalsContact O-N 3.1Å; Y871-D873 PolarHBondContact O-N 3.01Å; Y871-G874 WeakPolarHBondContact CB-O 3.47Å; Y871-G874 PolarHBondContact O-N 3.27Å; Y871-P876 HydrophobicContact CD2-CG 4.32Å; Y871-P876 HydrophobicContact CE1-CG 4.35Å; Y871-P876 HydrophobicContact CE2-CG 3.88Å
872	S	65.5	Low	84.3	Confident	118 Å²	118	67.2 Å²	67.2	83%	0.825	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-35.7	171.7	49.3	0	0	0	0	113.1	G874	S872-G874 VanDerWaalsContact C-N 3.32Å
873	D	63.4	Low	84.4	Confident	156 Å²	156	66.1 Å²	66.1	83%	0.834	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	10.5	-171.4	-53	6.9	0	0	0	111.6	Y871	Y871-D873 PolarHBondContact O-N 3.01Å
874	G	69.7	Low	84.3	Confident	21 Å²	21	65.9 Å²	65.9	22%	0.216	35%	0.354	C	S	.	.			trans	82.3	179.3	-177.3	0	0	0	0	0	114.8	Y871 S872 P876	Y871-G874 WeakPolarHBondContact CB-O 3.47Å; Y871-G874 PolarHBondContact O-N 3.27Å; S872-G874 VanDerWaalsContact C-N 3.32Å; G874-P876 WeakPolarHBondContact O-CD 3.02Å
875	L	81.5	Confident	84.4	Confident	13 Å²	13	65.5 Å²	65.5	7%	0.068	35%	0.353	C	S	.	.			trans	-66.8	119.1	-175.7	-81.1	159.5	0	0	0	111.9	L843 I864 L867 A868 K877 R878 F923	L843-L875 HydrophobicContact CB-CD1 3.99Å; L843-L875 HydrophobicContact CD2-CD1 4.27Å; I864-L875 HydrophobicContact CG2-CD1 3.83Å; I864-L875 HydrophobicContact CG2-CD2 4.34Å; L867-L875 HydrophobicContact CB-CD2 3.99Å; A868-L875 HydrophobicContact CB-CD1 3.96Å; A868-L875 HydrophobicContact CB-CD2 4.36Å; A868-L875 HydrophobicContact CB-CG 3.93Å; L875-K877 PolarHBondContact O-N 3.18Å; L875-R878 HydrophobicContact CB-CB 4.09Å; L875-R878 WeakPolarHBondContact O-CB 3.39Å; L875-R878 PolarHBondContact O-N 3.15Å; L875-F923 HydrophobicContact CD1-CE2 3.89Å; L875-F923 HydrophobicContact CD1-CZ 4.01Å
876	P	73.6	Confident	84.3	Confident	94 Å²	94	65.8 Å²	65.8	61%	0.61	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	2.8	-171.8	28.7	-37.2	0	0	0	115.3	Y871 G874	Y871-P876 HydrophobicContact CD2-CG 4.32Å; Y871-P876 HydrophobicContact CE1-CG 4.35Å; Y871-P876 HydrophobicContact CE2-CG 3.88Å; G874-P876 WeakPolarHBondContact O-CD 3.02Å
877	K	75.6	Confident	84	Confident	145 Å²	145	64.3 Å²	64.3	63%	0.63	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.4	12.8	174.3	-67.8	-176.2	178.6	175.2	0	112.9	Y842 L875	Y842-K877 WeakPolarHBondContact CD1-O 3.3Å; L875-K877 PolarHBondContact O-N 3.18Å
878	R	87.6	Confident	83.6	Confident	40 Å²	40	69 Å²	69	15%	0.151	36%	0.363	C	S	.	.			trans	-66.9	134.2	176.8	176	-175.3	162.5	132.7	8.8	110.9	L841 Y842 L875 D925 E927	L841-R878 HydrophobicContact CD1-CG 3.76Å; L841-R878 HydrophobicContact CD2-CG 4.28Å; L841-R878 VanDerWaalsContact CD2-CZ 3.44Å; L841-R878 HydrophobicContact CG-CG 4.17Å; Y842-R878 VanDerWaalsContact O-CA 3.29Å; Y842-R878 WeakPolarHBondContact O-CA 3.48Å; L875-R878 HydrophobicContact CB-CB 4.09Å; L875-R878 WeakPolarHBondContact O-CB 3.39Å; L875-R878 PolarHBondContact O-N 3.15Å; R878-D925 IonicContact CZ-OD1 2.8Å; R878-D925 IonicContact CZ-OD2 3.81Å; R878-D925 IonicContact NH1-OD1 3.29Å; R878-D925 PolarHBondContact NH1-OD1 3.35Å; R878-D925 IonicContact NH1-OD2 3.47Å; R878-D925 PolarHBondContact NH1-OD2 3.36Å; R878-D925 IonicContact NH2-OD1 2.75Å; R878-E927 IonicContact CZ-OE2 3.7Å; R878-E927 IonicContact NE-OE2 3.39Å; R878-E927 PolarHBondContact NE-OE2 3.07Å; R878-E927 VanDerWaalsContact NH2-CD 3.27Å; R878-E927 IonicContact NH2-OE1 3.31Å; R878-E927 IonicContact NH2-OE2 3.5Å; R878-E927 PolarHBondContact NH2-OE2 3.31Å
879	C	89.7	Confident	83.6	Confident	17 Å²	17	72.2 Å²	72.2	12%	0.115	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	157.5	168.8	57.6	0	0	0	0	112.4	Y842 E895	Y842-C879 WeakPolarHBondContact CB-O 3.42Å; Y842-C879 PolarHBondContact N-O 2.8Å; Y842-C879 PolarHBondContact O-N 3.49Å; Y842-C879 VanDerWaalsContact O-N 3.13Å; C879-E895 HydrophobicContact CB-CG 4.07Å; C879-E895 WeakPolarHBondContact CB-OE1 3.43Å; C879-E895 PolarHBondContact SG-OE1 2.89Å
880	E	91.3	Very high	83.9	Confident	36 Å²	36	64.2 Å²	64.2	17%	0.168	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	130.3	170.2	-166	-179.6	124.4	0	0	109.6	K896 Y897 I961	E880-K896 HydrophobicContact CG-CD 4.09Å; E880-K896 PolarHBondContact O-N 3.46Å; E880-K896 WeakPolarHBondContact OE1-CD 3.29Å; E880-K896 WeakPolarHBondContact OE1-CE 3.21Å; E880-K896 IonicContact OE1-NZ 3.57Å; E880-K896 PolarHBondContact OE1-NZ 3.4Å; E880-Y897 HydrophobicContact CB-CD2 4.5Å; E880-Y897 HydrophobicContact CB-CE2 3.95Å; E880-Y897 HydrophobicContact CG-CE2 4.29Å; E880-Y897 PolarHBondContact OE1-OH 3.46Å; E880-I961 HydrophobicContact CG-CD1 4.04Å; E880-I961 HydrophobicContact CG-CG2 4.44Å
881	V	93.2	Very high	84.5	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	139.3	-178.9	-64.4	0	0	0	0	111	D839 M840 I883 F893 T894 W902 F958	D839-V881 WeakPolarHBondContact CA-O 3.4Å; M840-V881 HydrophobicContact CB-CG2 4.31Å; M840-V881 PolarHBondContact N-O 3.08Å; M840-V881 WeakPolarHBondContact O-CG2 3.49Å; M840-V881 PolarHBondContact O-N 3.04Å; V881-I883 HydrophobicContact CG2-CD1 4.36Å; V881-I883 HydrophobicContact CG2-CG1 3.99Å; V881-F893 HydrophobicContact CB-CB 4.33Å; V881-F893 HydrophobicContact CG2-CB 4.34Å; V881-T894 CarbonylContact C-O 3.49Å; V881-T894 VanDerWaalsContact CA-O 3.24Å; V881-T894 WeakPolarHBondContact CA-O 3.4Å; V881-W902 HydrophobicContact CG1-CZ3 4.18Å; V881-F958 HydrophobicContact CG2-CD1 3.88Å; V881-F958 HydrophobicContact CG2-CE1 4Å
882	Q	92.9	Very high	85.3	Confident	83 Å²	83	54.4 Å²	54.4	39%	0.388	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	118.5	162	-179.1	170.2	92.7	0	0	109	S837 D839 F893 T894	S837-Q882 WeakPolarHBondContact OG-CG 3.21Å; D839-Q882 WeakPolarHBondContact OD1-CA 3.47Å; D839-Q882 VanDerWaalsContact OD1-CB 3.3Å; D839-Q882 WeakPolarHBondContact OD1-CB 3.36Å; D839-Q882 WeakPolarHBondContact OD1-CG 3.47Å; Q882-F893 CarbonylContact O-C 3.55Å; Q882-F893 WeakPolarHBondContact O-CA 3.05Å; Q882-T894 PolarHBondContact N-O 3.36Å; Q882-T894 PolarHBondContact O-N 3.35Å
883	I	94.9	Very high	86.7	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.005	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	116.4	173.8	-47.1	-165	0	0	0	108.6	S837 T838 M840 V881 I891 F893 F958 L970	S837-I883 CarbonylContact C-O 3.42Å; S837-I883 WeakPolarHBondContact CA-O 3.48Å; T838-I883 PolarHBondContact N-O 3.01Å; T838-I883 PolarHBondContact O-N 3.2Å; M840-I883 HydrophobicContact CB-CD1 3.8Å; M840-I883 HydrophobicContact CB-CG1 4.16Å; M840-I883 HydrophobicContact CG-CD1 3.79Å; M840-I883 HydrophobicContact CG-CG1 4.28Å; V881-I883 HydrophobicContact CG2-CD1 4.36Å; V881-I883 HydrophobicContact CG2-CG1 3.99Å; I883-I891 HydrophobicContact CG2-CG2 3.69Å; I883-F893 HydrophobicContact CG1-CB 4.12Å; I883-F958 HydrophobicContact CD1-CD1 3.7Å; I883-F958 HydrophobicContact CD1-CE1 3.83Å; I883-F958 HydrophobicContact CD1-CG 4.07Å; I883-F958 HydrophobicContact CD1-CZ 4.3Å; I883-L970 HydrophobicContact CB-CD2 4.4Å; I883-L970 HydrophobicContact CD1-CD2 3.96Å; I883-L970 HydrophobicContact CG2-CD2 4.37Å
884	K	93.3	Very high	88.1	Confident	81 Å²	81	42.4 Å²	42.4	35%	0.352	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	128.9	171.3	-171.1	176.7	-178.9	179.2	0	110.4	M836 I886 T892	M836-K884 CarbonylContact O-C 3.56Å; M836-K884 WeakPolarHBondContact O-CA 3.14Å; K884-I886 HydrophobicContact CD-CD1 4.07Å; K884-I886 HydrophobicContact CD-CG1 4.28Å; K884-I886 HydrophobicContact CG-CD1 4.39Å; K884-I886 HydrophobicContact CG-CG1 4.13Å; K884-T892 PolarHBondContact N-O 3.12Å; K884-T892 PolarHBondContact O-N 3.1Å
885	V	94.1	Very high	89.1	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	129	178.1	-174.3	0	0	0	0	109.1	T835 M836 I891 L970 F973 I974 F978	T835-V885 VanDerWaalsContact CA-O 3.3Å; T835-V885 WeakPolarHBondContact CA-O 3.28Å; T835-V885 VanDerWaalsContact CB-O 3.29Å; T835-V885 WeakPolarHBondContact CB-O 3.19Å; M836-V885 PolarHBondContact N-O 3.13Å; M836-V885 PolarHBondContact O-N 2.88Å; V885-I891 HydrophobicContact CG1-CG1 4.35Å; V885-I891 HydrophobicContact CG2-CG1 4.38Å; V885-L970 HydrophobicContact CG2-CD1 3.93Å; V885-F973 HydrophobicContact CB-CD1 4.01Å; V885-F973 HydrophobicContact CB-CE1 3.81Å; V885-F973 HydrophobicContact CG1-CD1 3.93Å; V885-F973 HydrophobicContact CG1-CE1 3.75Å; V885-F973 HydrophobicContact CG2-CD1 4.41Å; V885-I974 HydrophobicContact CG1-CG1 4.31Å; V885-I974 HydrophobicContact CG2-CD1 4.3Å; V885-I974 HydrophobicContact CG2-CG1 3.83Å; V885-F978 HydrophobicContact CG1-CE2 3.9Å
886	I	90.4	Very high	89.2	Confident	33 Å²	33	43.9 Å²	43.9	17%	0.169	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	132.7	-179.4	-53	177.9	0	0	0	108.6	T835 K884 H888 D889 G890	T835-I886 HydrophobicContact CG2-CB 4.21Å; T835-I886 HydrophobicContact CG2-CG1 3.91Å; T835-I886 HydrophobicContact CG2-CG2 4.06Å; K884-I886 HydrophobicContact CD-CD1 4.07Å; K884-I886 HydrophobicContact CD-CG1 4.28Å; K884-I886 HydrophobicContact CG-CD1 4.39Å; K884-I886 HydrophobicContact CG-CG1 4.13Å; I886-H888 PolarHBondContact O-N 2.78Å; I886-D889 HydrophobicContact CB-CB 4.1Å; I886-D889 HydrophobicContact CD1-CB 4.45Å; I886-D889 WeakPolarHBondContact CD1-OD2 3.34Å; I886-D889 HydrophobicContact CG2-CB 4.19Å; I886-G890 PolarHBondContact N-O 2.99Å; I886-G890 CarbonylContact O-C 3.54Å; I886-G890 WeakPolarHBondContact O-CA 3.39Å; I886-G890 PolarHBondContact O-N 2.88Å; I886-G890 VanDerWaalsContact O-O 3.07Å
887	P	84.8	Confident	89.4	Confident	35 Å²	35	48.1 Å²	48.1	23%	0.227	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-36.7	-169.3	-23.7	34.5	0	0	0	114.4	N834 I977 F978	N834-P887 HydrophobicContact CB-CG 3.92Å; N834-P887 VanDerWaalsContact O-CD 3.23Å; N834-P887 WeakPolarHBondContact O-CD 3.3Å; N834-P887 WeakPolarHBondContact O-CG 3.43Å; P887-I977 HydrophobicContact CB-CG2 3.82Å; P887-I977 HydrophobicContact CG-CD1 4.42Å; P887-I977 HydrophobicContact CG-CG2 3.93Å; P887-F978 WeakPolarHBondContact O-CE1 3.29Å
888	H	82	Confident	89.3	Confident	171 Å²	171	46.8 Å²	46.8	79%	0.792	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95	-32.2	-176.4	-55.6	-59.7	0	0	0	113.2	I886	I886-H888 PolarHBondContact O-N 2.78Å
889	D	86.3	Confident	87.8	Confident	93 Å²	93	57.2 Å²	57.2	50%	0.497	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-25.7	178.2	-58.7	-33.4	0	0	0	113.1	I886	I886-D889 HydrophobicContact CB-CB 4.1Å; I886-D889 HydrophobicContact CD1-CB 4.45Å; I886-D889 WeakPolarHBondContact CD1-OD2 3.34Å; I886-D889 HydrophobicContact CG2-CB 4.19Å
890	G	91.7	Very high	86.5	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	95.5	-149.4	-174.4	0	0	0	0	0	113.7	I886 I906	I886-G890 PolarHBondContact N-O 2.99Å; I886-G890 CarbonylContact O-C 3.54Å; I886-G890 WeakPolarHBondContact O-CA 3.39Å; I886-G890 PolarHBondContact O-N 2.88Å; I886-G890 VanDerWaalsContact O-O 3.07Å; G890-I906 WeakPolarHBondContact CA-O 3.34Å
891	I	95.1	Very high	85.5	Confident	0 Å²	0	63 Å²	63	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	128	-179.2	-56.3	175.5	0	0	0	108.8	I883 V885 F893 T905 I906 L911 L941 I974 F978	I883-I891 HydrophobicContact CG2-CG2 3.69Å; V885-I891 HydrophobicContact CG1-CG1 4.35Å; V885-I891 HydrophobicContact CG2-CG1 4.38Å; I891-F893 HydrophobicContact CG2-CD1 4.35Å; I891-T905 CarbonylContact O-C 3.55Å; I891-T905 WeakPolarHBondContact O-CA 3.44Å; I891-I906 PolarHBondContact N-O 3.49Å; I891-I906 PolarHBondContact O-N 2.7Å; I891-L911 HydrophobicContact CD1-CD1 4.09Å; I891-L911 HydrophobicContact CD1-CD2 3.53Å; I891-L911 HydrophobicContact CD1-CG 4.49Å; I891-L911 HydrophobicContact CG1-CD2 4.3Å; I891-L941 HydrophobicContact CD1-CD1 4Å; I891-L941 HydrophobicContact CD1-CD2 4.01Å; I891-L941 HydrophobicContact CG2-CD1 4.03Å; I891-I974 HydrophobicContact CD1-CD1 3.77Å; I891-I974 HydrophobicContact CD1-CG1 3.95Å; I891-I974 HydrophobicContact CD1-CG2 3.87Å; I891-F978 HydrophobicContact CG1-CE2 4.1Å
892	T	94.6	Very high	85.3	Confident	5 Å²	5	67.3 Å²	67.3	3%	0.031	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	123	173.8	-57.4	0	0	0	0	111.6	K884 R903 K904 T905	K884-T892 PolarHBondContact N-O 3.12Å; K884-T892 PolarHBondContact O-N 3.1Å; T892-R903 HydrophobicContact CG2-CG 3.73Å; T892-K904 CarbonylContact C-O 3.45Å; T892-K904 WeakPolarHBondContact CA-O 3.24Å; T892-T905 VanDerWaalsContact CG2-OG1 3.25Å; T892-T905 WeakPolarHBondContact CG2-OG1 3.46Å; T892-T905 WeakPolarHBondContact OG1-CB 3.17Å; T892-T905 VanDerWaalsContact OG1-CG2 3.3Å; T892-T905 WeakPolarHBondContact OG1-CG2 3.19Å; T892-T905 PolarHBondContact OG1-OG1 2.71Å
893	F	94.3	Very high	85.1	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	137.7	171.8	37.1	-76.5	0	0	0	110.8	V881 Q882 I883 I891 W902 R903 K904 I906 L941 Y956 F958	V881-F893 HydrophobicContact CB-CB 4.33Å; V881-F893 HydrophobicContact CG2-CB 4.34Å; Q882-F893 CarbonylContact O-C 3.55Å; Q882-F893 WeakPolarHBondContact O-CA 3.05Å; I883-F893 HydrophobicContact CG1-CB 4.12Å; I891-F893 HydrophobicContact CG2-CD1 4.35Å; F893-W902 AromaticContact CD2-CH2 3.66Å; F893-W902 HydrophobicContact CD2-CH2 3.66Å; F893-W902 AromaticContact CD2-CZ3 3.72Å; F893-W902 HydrophobicContact CD2-CZ3 3.72Å; F893-W902 AromaticContact CE2-CH2 3.57Å; F893-W902 HydrophobicContact CE2-CH2 3.57Å; F893-W902 HydrophobicContact CE2-CZ2 4.31Å; F893-W902 HydrophobicContact CE2-CZ3 4.14Å; F893-R903 WeakPolarHBondContact O-CA 3.29Å; F893-K904 HydrophobicContact CD2-CB 3.86Å; F893-K904 HydrophobicContact CD2-CG 4.37Å; F893-K904 HydrophobicContact CE1-CG 4.26Å; F893-K904 HydrophobicContact CE2-CB 3.56Å; F893-K904 HydrophobicContact CE2-CG 3.59Å; F893-K904 HydrophobicContact CG-CB 4.49Å; F893-K904 HydrophobicContact CZ-CB 3.93Å; F893-K904 HydrophobicContact CZ-CG 3.51Å; F893-K904 PolarHBondContact N-O 2.73Å; F893-K904 PolarHBondContact O-N 3.47Å; F893-I906 HydrophobicContact CE1-CD1 3.64Å; F893-I906 HydrophobicContact CE1-CG1 3.99Å; F893-I906 HydrophobicContact CZ-CD1 4.05Å; F893-I906 HydrophobicContact CZ-CG1 4.38Å; F893-L941 HydrophobicContact CE1-CD1 4.37Å; F893-Y956 HydrophobicContact CE2-CD1 4.03Å; F893-Y956 HydrophobicContact CE2-CE1 4.39Å; F893-Y956 HydrophobicContact CE2-CG 4.35Å; F893-Y956 AromaticContact CZ-CD1 3.84Å; F893-Y956 HydrophobicContact CZ-CD1 3.84Å; F893-Y956 HydrophobicContact CZ-CD2 4.01Å; F893-Y956 HydrophobicContact CZ-CE1 4.19Å; F893-Y956 HydrophobicContact CZ-CE2 4.3Å; F893-Y956 AromaticContact CZ-CG 3.77Å; F893-Y956 HydrophobicContact CZ-CG 3.77Å; F893-F958 HydrophobicContact CB-CE1 4.25Å; F893-F958 HydrophobicContact CD1-CE1 4.35Å; F893-F958 AromaticContact CD1-CZ 3.9Å; F893-F958 HydrophobicContact CD1-CZ 3.9Å; F893-F958 AromaticContact CD2-CE1 3.9Å; F893-F958 HydrophobicContact CD2-CE1 3.9Å; F893-F958 AromaticContact CD2-CZ 3.95Å; F893-F958 HydrophobicContact CD2-CZ 3.95Å; F893-F958 AromaticContact CE1-CZ 3.92Å; F893-F958 HydrophobicContact CE1-CZ 3.92Å; F893-F958 HydrophobicContact CE2-CE1 4.28Å; F893-F958 AromaticContact CE2-CZ 3.94Å; F893-F958 HydrophobicContact CE2-CZ 3.94Å; F893-F958 AromaticContact CG-CE1 3.94Å; F893-F958 HydrophobicContact CG-CE1 3.94Å; F893-F958 AromaticContact CG-CZ 3.93Å; F893-F958 HydrophobicContact CG-CZ 3.93Å; F893-F958 AromaticContact CZ-CZ 3.94Å; F893-F958 HydrophobicContact CZ-CZ 3.94Å
894	T	92.8	Very high	85	Confident	23 Å²	23	74.1 Å²	74.1	14%	0.141	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	121.6	-172.9	-48.6	0	0	0	0	109.4	V881 Q882 V901 W902 R903	V881-T894 CarbonylContact C-O 3.49Å; V881-T894 VanDerWaalsContact CA-O 3.24Å; V881-T894 WeakPolarHBondContact CA-O 3.4Å; Q882-T894 PolarHBondContact N-O 3.36Å; Q882-T894 PolarHBondContact O-N 3.35Å; T894-V901 HydrophobicContact CG2-CG1 3.36Å; T894-W902 WeakPolarHBondContact CA-O 3.3Å; T894-R903 HydrophobicContact CG2-CB 4.31Å; T894-R903 HydrophobicContact CG2-CG 4.4Å; T894-R903 PolarHBondContact OG1-NH1 3.17Å
895	E	92.3	Very high	85	Confident	18 Å²	18	73.2 Å²	73.2	8%	0.084	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	133.8	178.4	175.5	168	-128.4	0	0	111.7	C879 K898 W902	C879-E895 HydrophobicContact CB-CG 4.07Å; C879-E895 WeakPolarHBondContact CB-OE1 3.43Å; C879-E895 PolarHBondContact SG-OE1 2.89Å; E895-K898 HydrophobicContact CG-CB 4.45Å; E895-K898 HydrophobicContact CG-CG 4.35Å; E895-K898 WeakPolarHBondContact OE1-CD 3.5Å; E895-K898 VanDerWaalsContact OE1-CE 3.3Å; E895-K898 WeakPolarHBondContact OE1-CE 3.34Å; E895-K898 IonicContact OE1-NZ 3.64Å; E895-K898 PolarHBondContact OE1-NZ 3.24Å; E895-K898 WeakPolarHBondContact OE2-CD 3.18Å; E895-K898 IonicContact OE2-NZ 2.65Å; E895-W902 HydrophobicContact CB-CB 3.98Å; E895-W902 HydrophobicContact CB-CE3 4.14Å; E895-W902 PolarHBondContact N-O 3.29Å; E895-W902 WeakPolarHBondContact OE2-CB 3.28Å
896	K	82.2	Confident	85.1	Confident	46 Å²	46	73.5 Å²	73.5	20%	0.2	35%	0.345	C	S	.	.	S	Bend	trans	-89.1	161.7	172.7	-63.3	-176.5	-178.6	-178	0	111.5	D839 E880 K898	D839-K896 WeakPolarHBondContact OD1-CE 3.44Å; D839-K896 IonicContact OD1-NZ 3.23Å; D839-K896 PolarHBondContact OD1-NZ 2.99Å; D839-K896 WeakPolarHBondContact OD2-CE 3.4Å; D839-K896 IonicContact OD2-NZ 3.99Å; D839-K896 PolarHBondContact OD2-NZ 3.13Å; E880-K896 HydrophobicContact CG-CD 4.09Å; E880-K896 PolarHBondContact O-N 3.46Å; E880-K896 WeakPolarHBondContact OE1-CD 3.29Å; E880-K896 WeakPolarHBondContact OE1-CE 3.21Å; E880-K896 IonicContact OE1-NZ 3.57Å; E880-K896 PolarHBondContact OE1-NZ 3.4Å; K896-K898 PolarHBondContact O-N 2.86Å
897	Y	79.2	Confident	85.1	Confident	184 Å²	184	78.8 Å²	78.8	72%	0.722	37%	0.367	S	S	*	.	S	Bend	trans	65.4	-10	168.2	-37.4	-61.4	0	0	0	118.1	E880	E880-Y897 HydrophobicContact CB-CD2 4.5Å; E880-Y897 HydrophobicContact CB-CE2 3.95Å; E880-Y897 HydrophobicContact CG-CE2 4.29Å; E880-Y897 PolarHBondContact OE1-OH 3.46Å
898	K	72.7	Confident	85.4	Confident	117 Å²	117	78.7 Å²	78.7	51%	0.509	37%	0.366	S	S	.	.			trans	-90.2	139.5	171.7	-67.2	-161.4	-173.2	134.7	0	113	E895 K896 A900	E895-K898 HydrophobicContact CG-CB 4.45Å; E895-K898 HydrophobicContact CG-CG 4.35Å; E895-K898 WeakPolarHBondContact OE1-CD 3.5Å; E895-K898 VanDerWaalsContact OE1-CE 3.3Å; E895-K898 WeakPolarHBondContact OE1-CE 3.34Å; E895-K898 IonicContact OE1-NZ 3.64Å; E895-K898 PolarHBondContact OE1-NZ 3.24Å; E895-K898 WeakPolarHBondContact OE2-CD 3.18Å; E895-K898 IonicContact OE2-NZ 2.65Å; K896-K898 PolarHBondContact O-N 2.86Å; K898-A900 VanDerWaalsContact C-N 3.29Å; K898-A900 PolarHBondContact O-N 2.94Å
899	R	56.8	Low	85.8	Confident	259 Å²	259	77.5 Å²	77.5	98%	0.977	37%	0.366	S	S	*	.	S	Bend	trans	-58.9	-36.9	177.1	-71.9	-175.8	177.2	179	-0.8	113.1
900	A	61.4	Low	86	Confident	82 Å²	82	75.3 Å²	75.3	68%	0.678	35%	0.354	S	S	*	.	S	Bend	trans	-95	104.2	168.2	0	0	0	0	0	107.9	K898 W902	K898-A900 VanDerWaalsContact C-N 3.29Å; K898-A900 PolarHBondContact O-N 2.94Å; A900-W902 PolarHBondContact O-N 3.48Å; A900-W902 VanDerWaalsContact O-N 3.12Å
901	V	71.7	Confident	86.1	Confident	93 Å²	93	76 Å²	76	56%	0.564	36%	0.357	S	S	*	.			trans	-71.9	104.2	-177.6	178.8	0	0	0	0	109.7	T894 R903	T894-V901 HydrophobicContact CG2-CG1 3.36Å; V901-R903 PolarHBondContact O-N 3.18Å
902	W	87.3	Confident	85.9	Confident	89 Å²	89	77.6 Å²	77.6	34%	0.337	37%	0.366	S	S	.	.			trans	-70.3	127.1	168.7	177.9	79.6	0	0	0	109.9	Y842 V881 F893 T894 E895 A900 K904	Y842-W902 HydrophobicContact CD1-CH2 4.11Å; Y842-W902 HydrophobicContact CD1-CZ3 4.1Å; Y842-W902 AromaticContact CE1-CH2 3.64Å; Y842-W902 HydrophobicContact CE1-CH2 3.64Å; Y842-W902 HydrophobicContact CE1-CZ2 4.39Å; Y842-W902 HydrophobicContact CE1-CZ3 4.07Å; Y842-W902 HydrophobicContact CE2-CH2 4.22Å; Y842-W902 HydrophobicContact CG-CZ3 4.49Å; Y842-W902 AromaticContact CZ-CH2 3.68Å; V881-W902 HydrophobicContact CG1-CZ3 4.18Å; F893-W902 AromaticContact CD2-CH2 3.66Å; F893-W902 HydrophobicContact CD2-CH2 3.66Å; F893-W902 AromaticContact CD2-CZ3 3.72Å; F893-W902 HydrophobicContact CD2-CZ3 3.72Å; F893-W902 AromaticContact CE2-CH2 3.57Å; F893-W902 HydrophobicContact CE2-CH2 3.57Å; F893-W902 HydrophobicContact CE2-CZ2 4.31Å; F893-W902 HydrophobicContact CE2-CZ3 4.14Å; T894-W902 WeakPolarHBondContact CA-O 3.3Å; E895-W902 HydrophobicContact CB-CB 3.98Å; E895-W902 HydrophobicContact CB-CE3 4.14Å; E895-W902 PolarHBondContact N-O 3.29Å; E895-W902 WeakPolarHBondContact OE2-CB 3.28Å; A900-W902 PolarHBondContact O-N 3.48Å; A900-W902 VanDerWaalsContact O-N 3.12Å; W902-K904 HydrophobicContact CH2-CB 4.31Å; W902-K904 HydrophobicContact CZ2-CB 4.04Å
903	R	90.1	Very high	85.9	Confident	149 Å²	149	78.3 Å²	78.3	56%	0.562	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136	132.8	179.9	-176.9	173.3	171.6	97.9	-9.9	109.9	T892 F893 T894 V901	T892-R903 HydrophobicContact CG2-CG 3.73Å; F893-R903 WeakPolarHBondContact O-CA 3.29Å; T894-R903 HydrophobicContact CG2-CB 4.31Å; T894-R903 HydrophobicContact CG2-CG 4.4Å; T894-R903 PolarHBondContact OG1-NH1 3.17Å; V901-R903 PolarHBondContact O-N 3.18Å
904	K	92.6	Very high	85.9	Confident	78 Å²	78	78.5 Å²	78.5	34%	0.339	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	122.6	-178.2	-179.7	64.5	-179.7	-172.2	0	110.4	T892 F893 W902 Y956	T892-K904 CarbonylContact C-O 3.45Å; T892-K904 WeakPolarHBondContact CA-O 3.24Å; F893-K904 HydrophobicContact CD2-CB 3.86Å; F893-K904 HydrophobicContact CD2-CG 4.37Å; F893-K904 HydrophobicContact CE1-CG 4.26Å; F893-K904 HydrophobicContact CE2-CB 3.56Å; F893-K904 HydrophobicContact CE2-CG 3.59Å; F893-K904 HydrophobicContact CG-CB 4.49Å; F893-K904 HydrophobicContact CZ-CB 3.93Å; F893-K904 HydrophobicContact CZ-CG 3.51Å; F893-K904 PolarHBondContact N-O 2.73Å; F893-K904 PolarHBondContact O-N 3.47Å; W902-K904 HydrophobicContact CH2-CB 4.31Å; W902-K904 HydrophobicContact CZ2-CB 4.04Å; K904-Y956 VanDerWaalsContact CE-OH 3.22Å; K904-Y956 WeakPolarHBondContact CE-OH 3.36Å
905	T	93.7	Very high	86	Confident	62 Å²	62	77.7 Å²	77.7	38%	0.38	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	133.7	174.3	-56.5	0	0	0	0	110.4	I891 T892	I891-T905 CarbonylContact O-C 3.55Å; I891-T905 WeakPolarHBondContact O-CA 3.44Å; T892-T905 VanDerWaalsContact CG2-OG1 3.25Å; T892-T905 WeakPolarHBondContact CG2-OG1 3.46Å; T892-T905 WeakPolarHBondContact OG1-CB 3.17Å; T892-T905 VanDerWaalsContact OG1-CG2 3.3Å; T892-T905 WeakPolarHBondContact OG1-CG2 3.19Å; T892-T905 PolarHBondContact OG1-OG1 2.71Å
906	I	94.2	Very high	86.2	Confident	7 Å²	7	79 Å²	79	4%	0.036	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	110.9	168.6	-56.1	170.8	0	0	0	106.4	G890 I891 F893 N910 L911 L941 A943 Y956	G890-I906 WeakPolarHBondContact CA-O 3.34Å; I891-I906 PolarHBondContact N-O 3.49Å; I891-I906 PolarHBondContact O-N 2.7Å; F893-I906 HydrophobicContact CE1-CD1 3.64Å; F893-I906 HydrophobicContact CE1-CG1 3.99Å; F893-I906 HydrophobicContact CZ-CD1 4.05Å; F893-I906 HydrophobicContact CZ-CG1 4.38Å; I906-N910 HydrophobicContact CG2-CB 4.34Å; I906-L911 HydrophobicContact CG2-CB 4.09Å; I906-L911 HydrophobicContact CG2-CD1 4.08Å; I906-L941 HydrophobicContact CD1-CB 4.36Å; I906-L941 HydrophobicContact CD1-CD1 4.08Å; I906-A943 HydrophobicContact CD1-CB 4.06Å; I906-A943 HydrophobicContact CG1-CB 4.41Å; I906-A943 HydrophobicContact CG2-CB 3.84Å; I906-Y956 HydrophobicContact CD1-CD2 3.65Å; I906-Y956 HydrophobicContact CD1-CE2 3.84Å; I906-Y956 HydrophobicContact CG1-CE2 4.27Å
907	K	92.1	Very high	86.8	Confident	143 Å²	143	77.2 Å²	77.2	62%	0.622	37%	0.366	S	S	*	.			trans	-63.9	151.9	173.9	-70.3	-163.6	171.7	-158.7	0	110.8	N909 N910 L911	K907-N909 VanDerWaalsContact C-N 3.33Å; K907-N909 PolarHBondContact O-N 3.07Å; K907-N910 PolarHBondContact O-N 2.66Å; K907-L911 PolarHBondContact O-N 3.43Å
908	P	91	Very high	87.4	Confident	33 Å²	33	70.7 Å²	70.7	21%	0.214	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-51.9	-48.3	-179.4	-26.8	35.7	0	0	0	112.8	N910 L911 F978	P908-N910 PolarHBondContact O-N 3.33Å; P908-L911 PolarHBondContact O-N 3.05Å; P908-F978 HydrophobicContact CB-CD1 4.06Å; P908-F978 HydrophobicContact CB-CE1 3.74Å; P908-F978 HydrophobicContact CG-CD1 4.49Å; P908-F978 HydrophobicContact CG-CE1 3.68Å; P908-F978 HydrophobicContact CG-CZ 4.29Å
909	N	89.3	Confident	88.4	Confident	147 Å²	147	70.1 Å²	70.1	79%	0.786	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-63.9	-9.4	-179.8	-53.9	23.1	0	0	0	114.8	K907	K907-N909 VanDerWaalsContact C-N 3.33Å; K907-N909 PolarHBondContact O-N 3.07Å
910	N	91.3	Very high	90.1	Very high	47 Å²	47	63.5 Å²	63.5	25%	0.251	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-108.6	-5.1	175.7	-72	-11.2	0	0	0	112.6	I906 K907 P908 A943 R944	I906-N910 HydrophobicContact CG2-CB 4.34Å; K907-N910 PolarHBondContact O-N 2.66Å; P908-N910 PolarHBondContact O-N 3.33Å; N910-A943 CarbonylContact O-C 3.4Å; N910-A943 WeakPolarHBondContact O-CA 3.39Å; N910-A943 WeakPolarHBondContact O-CB 3.39Å; N910-R944 PolarHBondContact O-N 3.22Å
911	L	92.5	Very high	91.6	Very high	13 Å²	13	62.4 Å²	62.4	7%	0.068	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	129.6	173.6	-167.8	67.2	0	0	0	108.4	I891 I906 K907 P908 L941 I974 F978 L981	I891-L911 HydrophobicContact CD1-CD1 4.09Å; I891-L911 HydrophobicContact CD1-CD2 3.53Å; I891-L911 HydrophobicContact CD1-CG 4.49Å; I891-L911 HydrophobicContact CG1-CD2 4.3Å; I906-L911 HydrophobicContact CG2-CB 4.09Å; I906-L911 HydrophobicContact CG2-CD1 4.08Å; K907-L911 PolarHBondContact O-N 3.43Å; P908-L911 PolarHBondContact O-N 3.05Å; L911-L941 HydrophobicContact CD1-CB 4.24Å; L911-L941 HydrophobicContact CD1-CD2 4.39Å; L911-I974 HydrophobicContact CD2-CG2 4.14Å; L911-F978 HydrophobicContact CD2-CD2 3.96Å; L911-F978 HydrophobicContact CD2-CE2 4.45Å; L911-F978 HydrophobicContact CD2-CG 4.44Å; L911-L981 HydrophobicContact CB-CD2 4Å; L911-L981 HydrophobicContact CD2-CD1 3.87Å; L911-L981 HydrophobicContact CD2-CD2 3.84Å; L911-L981 HydrophobicContact CD2-CG 4.43Å; L911-L981 HydrophobicContact CG-CD1 4.38Å; L911-L981 HydrophobicContact CG-CD2 3.59Å
912	L	92.2	Very high	92.4	Very high	35 Å²	35	62.3 Å²	62.3	18%	0.183	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	-40.2	-176.7	-59.5	178.3	0	0	0	111.8	E852 V942 R944 N953	E852-L912 HydrophobicContact CG-CD1 4.33Å; L912-V942 HydrophobicContact CB-CB 4.43Å; L912-V942 HydrophobicContact CB-CG1 4.32Å; L912-V942 HydrophobicContact CD1-CG1 4.32Å; L912-V942 PolarHBondContact N-O 3.31Å; L912-R944 HydrophobicContact CD1-CB 4.09Å; L912-R944 HydrophobicContact CD2-CB 4.3Å; L912-R944 HydrophobicContact CG-CB 4.27Å; L912-N953 HydrophobicContact CD1-CB 4.42Å; L912-N953 WeakPolarHBondContact CD1-OD1 3.43Å
913	W	94.2	Very high	92.5	Very high	19 Å²	19	58.5 Å²	58.5	7%	0.072	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	148.2	-177	-176.9	98.2	0	0	0	111.5	N853 M854 A857 G915 L916 P918 A940 V942 R982 D983	N853-W913 HydrophobicContact CB-CG 4.32Å; M854-W913 HydrophobicContact CB-CZ2 4.27Å; M854-W913 HydrophobicContact CG-CZ2 4.33Å; A857-W913 HydrophobicContact CB-CE3 3.96Å; A857-W913 HydrophobicContact CB-CH2 3.62Å; A857-W913 HydrophobicContact CB-CZ2 4.39Å; A857-W913 HydrophobicContact CB-CZ3 3.38Å; W913-G915 VanDerWaalsContact CH2-CA 3.44Å; W913-L916 WeakPolarHBondContact CH2-O 3.42Å; W913-P918 HydrophobicContact CH2-CG 4.06Å; W913-P918 HydrophobicContact CZ2-CG 4.22Å; W913-A940 HydrophobicContact CZ3-CB 4.16Å; W913-V942 HydrophobicContact CB-CB 4Å; W913-V942 HydrophobicContact CB-CG2 4.02Å; W913-V942 HydrophobicContact CD2-CG2 4.44Å; W913-V942 HydrophobicContact CE3-CG2 3.96Å; W913-V942 PolarHBondContact N-O 3.04Å; W913-V942 PolarHBondContact O-N 2.64Å; W913-R982 VanDerWaalsContact CD1-O 3.23Å; W913-D983 PolarHBondContact NE1-OXT 3.03Å
914	C	94.9	Very high	92.1	Very high	4 Å²	4	55.3 Å²	55.3	3%	0.027	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	132.2	169.5	178.1	0	0	0	0	110.1	L941 I974 N975 L981	C914-L941 HydrophobicContact CB-CD2 3.71Å; C914-L941 WeakPolarHBondContact SG-CD2 3.38Å; C914-I974 HydrophobicContact CB-CB 4.43Å; C914-I974 HydrophobicContact CB-CG2 3.54Å; C914-N975 WeakPolarHBondContact CB-OD1 3.06Å; C914-N975 PolarHBondContact O-ND2 2.82Å; C914-L981 HydrophobicContact CB-CD1 4.07Å
915	G	94.9	Very high	91.5	Very high	7 Å²	7	53.2 Å²	53.2	7%	0.072	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.9	170.5	-179.3	0	0	0	0	0	113.2	W913 L939 A940	W913-G915 VanDerWaalsContact CH2-CA 3.44Å; G915-L939 CarbonylContact O-C 3.56Å; G915-L939 WeakPolarHBondContact O-CA 3.44Å; G915-A940 PolarHBondContact N-O 2.99Å; G915-A940 PolarHBondContact O-N 3.27Å
916	L	95.6	Very high	90.7	Very high	45 Å²	45	54 Å²	54	24%	0.236	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	166.4	164.6	-62.3	-179.3	0	0	0	110.2	W913 P918 I938 L939 A967 L968 V971	W913-L916 WeakPolarHBondContact CH2-O 3.42Å; L916-P918 VanDerWaalsContact O-CD 3.28Å; L916-P918 WeakPolarHBondContact O-CD 3.32Å; L916-I938 CarbonylContact C-O 3.41Å; L916-I938 WeakPolarHBondContact CA-O 3.48Å; L916-L939 HydrophobicContact CD2-CB 4.12Å; L916-A967 HydrophobicContact CD2-CB 3.64Å; L916-L968 HydrophobicContact CD1-CB 4.3Å; L916-L968 HydrophobicContact CD1-CD1 4.09Å; L916-V971 HydrophobicContact CD2-CG2 4.15Å; L916-V971 HydrophobicContact CG-CG2 4.44Å
917	D	95.1	Very high	89.9	Confident	8 Å²	8	57.7 Å²	57.7	4%	0.043	30%	0.304	C	S	.	.			trans	-56.8	120.8	174.2	-177.9	41	0	0	0	111.9	I861 E919 N920 R921 I938	I861-D917 HydrophobicContact CD1-CB 3.77Å; I861-D917 WeakPolarHBondContact CD1-OD1 3.4Å; D917-E919 PolarHBondContact O-N 2.65Å; D917-N920 WeakPolarHBondContact O-CA 3.28Å; D917-N920 PolarHBondContact O-N 3.23Å; D917-N920 PolarHBondContact OD2-N 3.23Å; D917-R921 IonicContact OD1-CZ 2.8Å; D917-R921 IonicContact OD1-NE 2.77Å; D917-R921 IonicContact OD1-NH2 3.99Å; D917-R921 PolarHBondContact OD1-NH2 3.2Å; D917-R921 WeakPolarHBondContact OD2-CA 3.48Å; D917-R921 WeakPolarHBondContact OD2-CB 3.48Å; D917-R921 VanDerWaalsContact OD2-CG 3.31Å; D917-R921 WeakPolarHBondContact OD2-CG 3.27Å; D917-R921 IonicContact OD2-CZ 3.84Å; D917-R921 PolarHBondContact OD2-N 3.06Å; D917-R921 IonicContact OD2-NE 3.88Å; D917-R921 PolarHBondContact OD2-NE 3.28Å; D917-R921 IonicContact OD2-NH2 2.66Å; D917-R921 PolarHBondContact OD2-NH2 3.02Å; D917-I938 HydrophobicContact CB-CB 4.03Å; D917-I938 HydrophobicContact CB-CG2 4.32Å; D917-I938 PolarHBondContact N-O 3.35Å
918	P	92.6	Very high	89.4	Confident	48 Å²	48	51 Å²	51	31%	0.312	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-22	-176.9	-23.7	36.9	0	0	0	114.1	M854 A857 I858 W913 L916 N920	M854-P918 HydrophobicContact CB-CG 4.44Å; M854-P918 HydrophobicContact CG-CB 3.5Å; M854-P918 HydrophobicContact CG-CG 3.28Å; M854-P918 HydrophobicContact SD-CB 3.86Å; M854-P918 HydrophobicContact SD-CG 4.25Å; A857-P918 HydrophobicContact CB-CG 4.44Å; I858-P918 HydrophobicContact CD1-CB 4Å; I858-P918 HydrophobicContact CD1-CG 4.36Å; I858-P918 HydrophobicContact CG1-CB 3.82Å; I858-P918 HydrophobicContact CG1-CG 3.83Å; W913-P918 HydrophobicContact CH2-CG 4.06Å; W913-P918 HydrophobicContact CZ2-CG 4.22Å; L916-P918 VanDerWaalsContact O-CD 3.28Å; L916-P918 WeakPolarHBondContact O-CD 3.32Å; P918-N920 VanDerWaalsContact C-N 3.27Å
919	E	93.5	Very high	88.9	Confident	105 Å²	105	55.1 Å²	55.1	49%	0.491	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	6.7	172.7	-66.1	179.4	170.1	0	0	112.2	I858 D917 R921	I858-E919 HydrophobicContact CG1-CG 4.38Å; I858-E919 HydrophobicContact CG2-CG 4.39Å; I858-E919 VanDerWaalsContact CG2-OE1 3.26Å; I858-E919 WeakPolarHBondContact CG2-OE1 3.49Å; D917-E919 PolarHBondContact O-N 2.65Å; E919-R921 HydrophobicContact CB-CG 4.12Å; E919-R921 PolarHBondContact O-N 2.93Å; E919-R921 IonicContact OE2-CZ 3.03Å; E919-R921 IonicContact OE2-NE 3.44Å; E919-R921 IonicContact OE2-NH1 2.97Å; E919-R921 PolarHBondContact OE2-NH1 2.98Å; E919-R921 IonicContact OE2-NH2 2.68Å; E919-R921 PolarHBondContact OE2-NH2 3.14Å
920	N	91.7	Very high	88.3	Confident	119 Å²	119	52.6 Å²	52.6	64%	0.636	28%	0.279	S	S	*	.			trans	48.2	40.7	179.3	-166.4	79.9	0	0	0	113.7	D917 P918	D917-N920 WeakPolarHBondContact O-CA 3.28Å; D917-N920 PolarHBondContact O-N 3.23Å; D917-N920 PolarHBondContact OD2-N 3.23Å; P918-N920 VanDerWaalsContact C-N 3.27Å
921	R	92.4	Very high	87.5	Confident	59 Å²	59	54.8 Å²	54.8	22%	0.223	29%	0.287	C	S	.	.			trans	-82.7	147.1	175.7	-56.9	166	-67.6	-153.2	-14.4	110.4	I858 L865 D917 E919 I938	I858-R921 PolarHBondContact O-NH2 3.22Å; L865-R921 HydrophobicContact CD1-CB 4Å; L865-R921 HydrophobicContact CD1-CG 4.44Å; D917-R921 IonicContact OD1-CZ 2.8Å; D917-R921 IonicContact OD1-NE 2.77Å; D917-R921 IonicContact OD1-NH2 3.99Å; D917-R921 PolarHBondContact OD1-NH2 3.2Å; D917-R921 WeakPolarHBondContact OD2-CA 3.48Å; D917-R921 WeakPolarHBondContact OD2-CB 3.48Å; D917-R921 VanDerWaalsContact OD2-CG 3.31Å; D917-R921 WeakPolarHBondContact OD2-CG 3.27Å; D917-R921 IonicContact OD2-CZ 3.84Å; D917-R921 PolarHBondContact OD2-N 3.06Å; D917-R921 IonicContact OD2-NE 3.88Å; D917-R921 PolarHBondContact OD2-NE 3.28Å; D917-R921 IonicContact OD2-NH2 2.66Å; D917-R921 PolarHBondContact OD2-NH2 3.02Å; E919-R921 HydrophobicContact CB-CG 4.12Å; E919-R921 PolarHBondContact O-N 2.93Å; E919-R921 IonicContact OE2-CZ 3.03Å; E919-R921 IonicContact OE2-NE 3.44Å; E919-R921 IonicContact OE2-NH1 2.97Å; E919-R921 PolarHBondContact OE2-NH1 2.98Å; E919-R921 IonicContact OE2-NH2 2.68Å; E919-R921 PolarHBondContact OE2-NH2 3.14Å; R921-I938 HydrophobicContact CB-CD1 4.4Å; R921-I938 WeakPolarHBondContact O-CD1 3.1Å; R921-I938 WeakPolarHBondContact O-CG1 3.35Å
922	E	89.8	Confident	86.7	Confident	92 Å²	92	55.9 Å²	55.9	43%	0.43	30%	0.301	S	S	.	.	B	Isolated β-bridge	trans	-110.5	136.2	-179.6	-61.8	173	163.2	0	0	110	N924 G935	E922-N924 WeakPolarHBondContact CB-ND2 3.49Å; E922-N924 PolarHBondContact O-N 3.35Å; E922-N924 VanDerWaalsContact O-N 3.12Å; E922-G935 WeakPolarHBondContact OE2-CA 3.33Å
923	F	88.5	Confident	86	Confident	9 Å²	9	54.7 Å²	54.7	4%	0.039	30%	0.295	C	S	.	.			trans	-85.8	90.1	177.9	-179	-103.3	0	0	0	110.1	L841 L843 L865 A868 L875 D925 L928 S936 I938 C959	L841-F923 HydrophobicContact CD2-CD1 4.32Å; L841-F923 HydrophobicContact CD2-CE1 4.01Å; L843-F923 HydrophobicContact CD1-CB 4.03Å; L843-F923 HydrophobicContact CD1-CD1 4.03Å; L843-F923 HydrophobicContact CD1-CD2 3.68Å; L843-F923 HydrophobicContact CD1-CE1 4.46Å; L843-F923 HydrophobicContact CD1-CE2 4.15Å; L843-F923 HydrophobicContact CD1-CG 3.62Å; L843-F923 HydrophobicContact CD2-CD1 3.68Å; L843-F923 HydrophobicContact CD2-CD2 4.39Å; L843-F923 HydrophobicContact CD2-CE1 3.5Å; L843-F923 VanDerWaalsContact CD2-CE1 3.5Å; L843-F923 HydrophobicContact CD2-CE2 4.24Å; L843-F923 HydrophobicContact CD2-CG 4.14Å; L843-F923 HydrophobicContact CD2-CZ 3.81Å; L865-F923 HydrophobicContact CD2-CD2 3.84Å; A868-F923 HydrophobicContact CB-CE2 3.9Å; L875-F923 HydrophobicContact CD1-CE2 3.89Å; L875-F923 HydrophobicContact CD1-CZ 4.01Å; F923-D925 HydrophobicContact CD1-CB 4.09Å; F923-D925 HydrophobicContact CE1-CB 3.46Å; F923-D925 VanDerWaalsContact CE1-CB 3.46Å; F923-D925 HydrophobicContact CZ-CB 3.79Å; F923-L928 HydrophobicContact CD1-CD1 3.73Å; F923-L928 HydrophobicContact CE1-CD1 4.19Å; F923-S936 PolarHBondContact N-O 3.29Å; F923-I938 HydrophobicContact CB-CD1 3.95Å; F923-I938 HydrophobicContact CB-CG1 3.81Å; F923-C959 HydrophobicContact CB-CB 4.34Å; F923-C959 HydrophobicContact CD1-CB 4.37Å
924	N	81.9	Confident	85.2	Confident	82 Å²	82	61.5 Å²	61.5	44%	0.439	32%	0.322	S	S	.	.			trans	-87.3	109.6	179.8	-81.9	-84.5	0	0	0	111	E922	E922-N924 WeakPolarHBondContact CB-ND2 3.49Å; E922-N924 PolarHBondContact O-N 3.35Å; E922-N924 VanDerWaalsContact O-N 3.12Å
925	D	80	Confident	84.4	Confident	33 Å²	33	62 Å²	62	18%	0.176	33%	0.327	C	S	.	.			trans	-139.9	147.3	-176	175	-69.7	0	0	0	110.7	R878 F923 E927 L928 R929	R878-D925 IonicContact CZ-OD1 2.8Å; R878-D925 IonicContact CZ-OD2 3.81Å; R878-D925 IonicContact NH1-OD1 3.29Å; R878-D925 PolarHBondContact NH1-OD1 3.35Å; R878-D925 IonicContact NH1-OD2 3.47Å; R878-D925 PolarHBondContact NH1-OD2 3.36Å; R878-D925 IonicContact NH2-OD1 2.75Å; F923-D925 HydrophobicContact CD1-CB 4.09Å; F923-D925 HydrophobicContact CE1-CB 3.46Å; F923-D925 VanDerWaalsContact CE1-CB 3.46Å; F923-D925 HydrophobicContact CZ-CB 3.79Å; D925-E927 VanDerWaalsContact C-N 3.32Å; D925-E927 PolarHBondContact O-N 2.98Å; D925-E927 PolarHBondContact OD1-N 3.43Å; D925-L928 PolarHBondContact O-N 3.43Å; D925-L928 VanDerWaalsContact O-N 3.16Å; D925-R929 WeakPolarHBondContact O-CG 3.38Å; D925-R929 PolarHBondContact O-N 3.48Å
926	A	76.9	Confident	84.1	Confident	80 Å²	80	62 Å²	62	66%	0.661	33%	0.326	S	S	*	.	H	α-helix	trans	-59.8	-35.6	-172.8	0	0	0	0	0	113.9	L928 R929 S930	A926-L928 VanDerWaalsContact C-N 3.32Å; A926-L928 PolarHBondContact O-N 3.03Å; A926-R929 PolarHBondContact O-N 3.44Å; A926-S930 PolarHBondContact O-N 3.22Å; A926-S930 PolarHBondContact O-OG 3.5Å
927	E	76.9	Confident	84	Confident	84 Å²	84	63.6 Å²	63.6	39%	0.393	33%	0.331	S	S	.	.	H	α-helix	trans	-80.1	-13.4	-178.4	-163.7	-126.3	133.5	0	0	112.7	R878 D925 S930 K931	R878-E927 IonicContact CZ-OE2 3.7Å; R878-E927 IonicContact NE-OE2 3.39Å; R878-E927 PolarHBondContact NE-OE2 3.07Å; R878-E927 VanDerWaalsContact NH2-CD 3.27Å; R878-E927 IonicContact NH2-OE1 3.31Å; R878-E927 IonicContact NH2-OE2 3.5Å; R878-E927 PolarHBondContact NH2-OE2 3.31Å; D925-E927 VanDerWaalsContact C-N 3.32Å; D925-E927 PolarHBondContact O-N 2.98Å; D925-E927 PolarHBondContact OD1-N 3.43Å; E927-S930 PolarHBondContact O-OG 3.17Å; E927-K931 WeakPolarHBondContact O-CD 3.46Å; E927-K931 WeakPolarHBondContact O-CE 3.45Å; E927-K931 WeakPolarHBondContact O-CG 3.5Å; E927-K931 WeakPolarHBondContact OE1-CE 3.49Å; E927-K931 IonicContact OE1-NZ 3.24Å; E927-K931 PolarHBondContact OE1-NZ 2.99Å
928	L	82.4	Confident	84	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-86.7	-42.9	167.1	-69.1	176.9	0	0	0	110.8	L841 F923 D925 A926 S930 K931 G932 M933 I961	L841-L928 HydrophobicContact CD2-CD1 3.97Å; L841-L928 HydrophobicContact CD2-CD2 4.17Å; L841-L928 HydrophobicContact CD2-CG 4.25Å; F923-L928 HydrophobicContact CD1-CD1 3.73Å; F923-L928 HydrophobicContact CE1-CD1 4.19Å; D925-L928 PolarHBondContact O-N 3.43Å; D925-L928 VanDerWaalsContact O-N 3.16Å; A926-L928 VanDerWaalsContact C-N 3.32Å; A926-L928 PolarHBondContact O-N 3.03Å; L928-S930 VanDerWaalsContact C-N 3.29Å; L928-S930 PolarHBondContact O-N 3.5Å; L928-K931 CarbonylContact O-C 3.59Å; L928-K931 WeakPolarHBondContact O-CA 3.42Å; L928-K931 WeakPolarHBondContact O-CB 3.41Å; L928-K931 PolarHBondContact O-N 3.15Å; L928-G932 PolarHBondContact O-N 3.35Å; L928-M933 CarbonylContact C-O 3.55Å; L928-M933 HydrophobicContact CB-CB 4.31Å; L928-M933 HydrophobicContact CD2-SD 4.42Å; L928-M933 WeakPolarHBondContact O-CB 3.06Å; L928-M933 PolarHBondContact O-N 2.93Å; L928-I961 HydrophobicContact CD2-CD1 4.33Å; L928-I961 HydrophobicContact CD2-CG1 3.85Å
929	R	80.3	Confident	84.1	Confident	121 Å²	121	61 Å²	61	46%	0.457	32%	0.315	S	S	.	.	H	α-helix	trans	-63	-33.6	178	-67.3	171.4	69.8	91.7	1.1	112.5	D925 A926 K931 G932 M933 Y934	D925-R929 WeakPolarHBondContact O-CG 3.38Å; D925-R929 PolarHBondContact O-N 3.48Å; A926-R929 PolarHBondContact O-N 3.44Å; R929-K931 VanDerWaalsContact C-N 3.28Å; R929-K931 PolarHBondContact O-N 3.03Å; R929-G932 PolarHBondContact O-N 3.5Å; R929-G932 VanDerWaalsContact O-N 3.15Å; R929-M933 WeakPolarHBondContact CA-O 3.47Å; R929-Y934 HydrophobicContact CB-CE1 4.48Å; R929-Y934 HydrophobicContact CG-CD1 4.38Å
930	S	76.4	Confident	84.2	Confident	93 Å²	93	56 Å²	56	65%	0.65	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-21.6	173	63.6	0	0	0	0	113.8	A926 E927 L928 G932	A926-S930 PolarHBondContact O-N 3.22Å; A926-S930 PolarHBondContact O-OG 3.5Å; E927-S930 PolarHBondContact O-OG 3.17Å; L928-S930 VanDerWaalsContact C-N 3.29Å; L928-S930 PolarHBondContact O-N 3.5Å; S930-G932 PolarHBondContact O-N 3.16Å
931	K	74.9	Confident	84.4	Confident	93 Å²	93	50.4 Å²	50.4	40%	0.404	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	11.9	170.4	-61.8	177.5	-169.1	177.3	0	112.7	E927 L928 R929 M933	E927-K931 WeakPolarHBondContact O-CD 3.46Å; E927-K931 WeakPolarHBondContact O-CE 3.45Å; E927-K931 WeakPolarHBondContact O-CG 3.5Å; E927-K931 WeakPolarHBondContact OE1-CE 3.49Å; E927-K931 IonicContact OE1-NZ 3.24Å; E927-K931 PolarHBondContact OE1-NZ 2.99Å; L928-K931 CarbonylContact O-C 3.59Å; L928-K931 WeakPolarHBondContact O-CA 3.42Å; L928-K931 WeakPolarHBondContact O-CB 3.41Å; L928-K931 PolarHBondContact O-N 3.15Å; R929-K931 VanDerWaalsContact C-N 3.28Å; R929-K931 PolarHBondContact O-N 3.03Å; K931-M933 VanDerWaalsContact C-N 3.27Å; K931-M933 HydrophobicContact CB-CG 4.47Å; K931-M933 PolarHBondContact O-N 3.3Å
932	G	74.9	Confident	84.6	Confident	37 Å²	37	47.6 Å²	47.6	38%	0.381	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.5	9.7	-178.2	0	0	0	0	0	114.6	L928 R929 S930 Y934	L928-G932 PolarHBondContact O-N 3.35Å; R929-G932 PolarHBondContact O-N 3.5Å; R929-G932 VanDerWaalsContact O-N 3.15Å; S930-G932 PolarHBondContact O-N 3.16Å; G932-Y934 VanDerWaalsContact O-CD2 3.23Å; G932-Y934 WeakPolarHBondContact O-CD2 3.17Å; G932-Y934 VanDerWaalsContact O-CE2 3.3Å; G932-Y934 WeakPolarHBondContact O-CE2 3.13Å
933	M	78.6	Confident	84.8	Confident	10 Å²	10	43.4 Å²	43.4	5%	0.049	23%	0.232	C	C	.	.			trans	-91.2	119.8	-178.2	-56.6	-164.8	78.1	0	0	111.2	L928 R929 K931 E960 I961	L928-M933 CarbonylContact C-O 3.55Å; L928-M933 HydrophobicContact CB-CB 4.31Å; L928-M933 HydrophobicContact CD2-SD 4.42Å; L928-M933 WeakPolarHBondContact O-CB 3.06Å; L928-M933 PolarHBondContact O-N 2.93Å; R929-M933 WeakPolarHBondContact CA-O 3.47Å; K931-M933 VanDerWaalsContact C-N 3.27Å; K931-M933 HydrophobicContact CB-CG 4.47Å; K931-M933 PolarHBondContact O-N 3.3Å; M933-E960 HydrophobicContact CE-CG 4.37Å; M933-E960 VanDerWaalsContact CE-O 3.29Å; M933-E960 WeakPolarHBondContact CE-O 3.23Å; M933-I961 WeakPolarHBondContact SD-CA 3.46Å; M933-I961 HydrophobicContact SD-CG1 4.42Å; M933-I961 VanDerWaalsContact SD-O 3.33Å
934	Y	77.1	Confident	84.9	Confident	161 Å²	161	48.2 Å²	48.2	63%	0.631	25%	0.25	S	S	*	.			trans	-119.9	131.5	177	-54.2	-81.4	0	0	0	108.3	R929 G932	R929-Y934 HydrophobicContact CB-CE1 4.48Å; R929-Y934 HydrophobicContact CG-CD1 4.38Å; G932-Y934 VanDerWaalsContact O-CD2 3.23Å; G932-Y934 WeakPolarHBondContact O-CD2 3.17Å; G932-Y934 VanDerWaalsContact O-CE2 3.3Å; G932-Y934 WeakPolarHBondContact O-CE2 3.13Å
935	G	78.3	Confident	85	Confident	14 Å²	14	46.3 Å²	46.3	14%	0.144	24%	0.238	C	C	.	.	S	Bend	trans	67.1	35.6	-179.3	0	0	0	0	0	115.1	E922 K937	E922-G935 WeakPolarHBondContact OE2-CA 3.33Å; G935-K937 PolarHBondContact O-N 2.99Å; G935-K937 VanDerWaalsContact O-N 3.15Å
936	S	88.4	Confident	84.3	Confident	7 Å²	7	52.6 Å²	52.6	5%	0.049	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-55.7	121.7	177.8	-71.3	0	0	0	0	111.5	F923 C959 E960	F923-S936 PolarHBondContact N-O 3.29Å; S936-C959 WeakPolarHBondContact CB-SG 3.3Å; S936-E960 VanDerWaalsContact CB-O 3.28Å; S936-E960 WeakPolarHBondContact CB-O 3.37Å; S936-E960 PolarHBondContact OG-O 3.01Å
937	K	92.8	Very high	83.7	Confident	79 Å²	79	52.7 Å²	52.7	34%	0.343	25%	0.249	S	C	.	.	B	Isolated β-bridge	trans	-72.5	138.3	-174	-68.6	177.3	179.9	175.5	0	111.3	G935 C959 E960 A967	G935-K937 PolarHBondContact O-N 2.99Å; G935-K937 VanDerWaalsContact O-N 3.15Å; K937-C959 WeakPolarHBondContact O-CA 3.39Å; K937-E960 PolarHBondContact O-N 3.47Å; K937-A967 HydrophobicContact CB-CB 4.2Å
938	I	95.2	Very high	82.6	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.01	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	138.3	175.5	-57.3	173.9	0	0	0	109	I861 L865 L916 D917 R921 F923 V957 F958	I861-I938 HydrophobicContact CD1-CG2 3.94Å; I861-I938 HydrophobicContact CG1-CG2 4Å; I861-I938 HydrophobicContact CG2-CD1 4.04Å; I861-I938 HydrophobicContact CG2-CG2 3.96Å; L865-I938 HydrophobicContact CD1-CD1 4.06Å; L865-I938 HydrophobicContact CD2-CD1 3.88Å; L865-I938 HydrophobicContact CG-CD1 4.35Å; L916-I938 CarbonylContact C-O 3.41Å; L916-I938 WeakPolarHBondContact CA-O 3.48Å; D917-I938 HydrophobicContact CB-CB 4.03Å; D917-I938 HydrophobicContact CB-CG2 4.32Å; D917-I938 PolarHBondContact N-O 3.35Å; R921-I938 HydrophobicContact CB-CD1 4.4Å; R921-I938 WeakPolarHBondContact O-CD1 3.1Å; R921-I938 WeakPolarHBondContact O-CG1 3.35Å; F923-I938 HydrophobicContact CB-CD1 3.95Å; F923-I938 HydrophobicContact CB-CG1 3.81Å; I938-V957 HydrophobicContact CG2-CG1 3.61Å; I938-F958 WeakPolarHBondContact CA-O 3.21Å
939	L	95.3	Very high	81.5	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	152.1	169.2	75.5	95.4	0	0	0	110.4	M840 G915 L916 F958 A967 L970 V971	M840-L939 HydrophobicContact CE-CD2 4.34Å; M840-L939 HydrophobicContact CG-CD2 4.43Å; M840-L939 HydrophobicContact SD-CD2 3.75Å; G915-L939 CarbonylContact O-C 3.56Å; G915-L939 WeakPolarHBondContact O-CA 3.44Å; L916-L939 HydrophobicContact CD2-CB 4.12Å; L939-F958 HydrophobicContact CD1-CB 4.13Å; L939-F958 HydrophobicContact CD1-CD2 3.71Å; L939-F958 HydrophobicContact CD1-CG 4.29Å; L939-F958 HydrophobicContact CD2-CB 4.37Å; L939-F958 HydrophobicContact CG-CB 3.99Å; L939-F958 HydrophobicContact CG-CD2 4.45Å; L939-F958 PolarHBondContact N-O 3.45Å; L939-F958 PolarHBondContact O-N 2.84Å; L939-A967 HydrophobicContact CB-CB 4.31Å; L939-A967 HydrophobicContact CD2-CB 3.61Å; L939-L970 HydrophobicContact CD2-CD2 4.16Å; L939-V971 HydrophobicContact CB-CG2 4.19Å
940	A	96.6	Very high	80.6	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	145.2	177	0	0	0	0	0	113.1	A857 I861 W913 G915 V955 Y956	A857-A940 HydrophobicContact CB-CB 4.11Å; I861-A940 HydrophobicContact CD1-CB 3.87Å; I861-A940 HydrophobicContact CG1-CB 4.17Å; W913-A940 HydrophobicContact CZ3-CB 4.16Å; G915-A940 PolarHBondContact N-O 2.99Å; G915-A940 PolarHBondContact O-N 3.27Å; A940-V955 HydrophobicContact CB-CG1 3.83Å; A940-Y956 VanDerWaalsContact CA-O 3.29Å; A940-Y956 WeakPolarHBondContact CA-O 3.45Å
941	L	96	Very high	80	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	118.6	168.6	-56.3	179	0	0	0	108.4	I891 F893 I906 L911 C914 V955 Y956 F958 I974	I891-L941 HydrophobicContact CD1-CD1 4Å; I891-L941 HydrophobicContact CD1-CD2 4.01Å; I891-L941 HydrophobicContact CG2-CD1 4.03Å; F893-L941 HydrophobicContact CE1-CD1 4.37Å; I906-L941 HydrophobicContact CD1-CB 4.36Å; I906-L941 HydrophobicContact CD1-CD1 4.08Å; L911-L941 HydrophobicContact CD1-CB 4.24Å; L911-L941 HydrophobicContact CD1-CD2 4.39Å; C914-L941 HydrophobicContact CB-CD2 3.71Å; C914-L941 WeakPolarHBondContact SG-CD2 3.38Å; L941-V955 WeakPolarHBondContact O-CA 3.44Å; L941-Y956 PolarHBondContact N-O 2.96Å; L941-Y956 PolarHBondContact O-N 3.16Å; L941-F958 HydrophobicContact CD1-CE2 3.77Å; L941-F958 HydrophobicContact CD1-CZ 4.24Å; L941-F958 HydrophobicContact CG-CE2 3.93Å; L941-I974 HydrophobicContact CD2-CD1 4.16Å
942	V	95.3	Very high	80.4	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	123.2	171.3	-171.7	0	0	0	0	107.7	A856 A857 L912 W913 N953 V955	A856-V942 HydrophobicContact CB-CB 4.44Å; A856-V942 HydrophobicContact CB-CG1 3.7Å; A856-V942 HydrophobicContact CB-CG2 3.81Å; A857-V942 HydrophobicContact CB-CG2 4.42Å; L912-V942 HydrophobicContact CB-CB 4.43Å; L912-V942 HydrophobicContact CB-CG1 4.32Å; L912-V942 HydrophobicContact CD1-CG1 4.32Å; L912-V942 PolarHBondContact N-O 3.31Å; W913-V942 HydrophobicContact CB-CB 4Å; W913-V942 HydrophobicContact CB-CG2 4.02Å; W913-V942 HydrophobicContact CD2-CG2 4.44Å; W913-V942 HydrophobicContact CE3-CG2 3.96Å; W913-V942 PolarHBondContact N-O 3.04Å; W913-V942 PolarHBondContact O-N 2.64Å; V942-N953 HydrophobicContact CG1-CB 4.25Å; V942-V955 HydrophobicContact CG2-CG2 4.47Å
943	A	93.8	Very high	81.2	Confident	4 Å²	4	52.1 Å²	52.1	3%	0.033	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	142	-178.8	0	0	0	0	0	112.5	I906 N910 K945 N953 V954 Y956	I906-A943 HydrophobicContact CD1-CB 4.06Å; I906-A943 HydrophobicContact CG1-CB 4.41Å; I906-A943 HydrophobicContact CG2-CB 3.84Å; N910-A943 CarbonylContact O-C 3.4Å; N910-A943 WeakPolarHBondContact O-CA 3.39Å; N910-A943 WeakPolarHBondContact O-CB 3.39Å; A943-K945 PolarHBondContact O-N 3.4Å; A943-N953 WeakPolarHBondContact O-CA 3.49Å; A943-V954 HydrophobicContact CB-CG1 4.25Å; A943-V954 PolarHBondContact N-O 3.08Å; A943-V954 WeakPolarHBondContact O-CG1 3.42Å; A943-V954 PolarHBondContact O-N 3.45Å; A943-Y956 HydrophobicContact CB-CE2 4.25Å
944	R	90.3	Very high	82	Confident	110 Å²	110	51.9 Å²	51.9	42%	0.415	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	119.3	176.3	-165.5	178.7	-175.1	-169	3.4	110.2	N910 L912 Q946 H951 N953	N910-R944 PolarHBondContact O-N 3.22Å; L912-R944 HydrophobicContact CD1-CB 4.09Å; L912-R944 HydrophobicContact CD2-CB 4.3Å; L912-R944 HydrophobicContact CG-CB 4.27Å; R944-Q946 PolarHBondContact O-N 3.29Å; R944-H951 PolarHBondContact NH2-CE1 2.87Å; R944-N953 WeakPolarHBondContact CA-OD1 3.49Å
945	K	84.8	Confident	82.8	Confident	42 Å²	42	44.2 Å²	44.2	18%	0.183	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	91.1	178	-174.7	-175.5	163.4	-158	0	109.1	E847 A943 R947 E952 V954	E847-K945 IonicContact OE1-NZ 3.38Å; E847-K945 PolarHBondContact OE1-NZ 3.1Å; E847-K945 IonicContact OE2-NZ 3.89Å; E847-K945 PolarHBondContact OE2-NZ 3.14Å; A943-K945 PolarHBondContact O-N 3.4Å; K945-R947 VanDerWaalsContact C-N 3.34Å; K945-R947 PolarHBondContact O-N 3.43Å; K945-E952 HydrophobicContact CB-CB 4.24Å; K945-E952 WeakPolarHBondContact CB-O 3.4Å; K945-E952 HydrophobicContact CD-CB 4.35Å; K945-E952 WeakPolarHBondContact CD-OE2 3.47Å; K945-E952 VanDerWaalsContact CE-OE2 3.31Å; K945-E952 WeakPolarHBondContact CE-OE2 3.47Å; K945-E952 PolarHBondContact N-O 3.34Å; K945-E952 IonicContact NZ-OE2 3.34Å; K945-E952 PolarHBondContact NZ-OE2 2.86Å; K945-V954 HydrophobicContact CB-CB 4.5Å; K945-V954 HydrophobicContact CB-CG1 4.14Å
946	Q	64.7	Low	83.7	Confident	164 Å²	164	44.6 Å²	44.6	77%	0.766	19%	0.194	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-66	85.4	-177.9	-169.1	-179.2	7.1	0	0	112.5	R944	R944-Q946 PolarHBondContact O-N 3.29Å
947	R	65	Low	84.1	Confident	82 Å²	82	44.3 Å²	44.3	31%	0.309	19%	0.192	S	C	.	.			trans	-86.4	153.1	157.4	-79.3	177.9	164.5	164.8	-3.6	108.8	E847 K945 W949 E952	E847-R947 IonicContact OE2-NH1 2.75Å; K945-R947 VanDerWaalsContact C-N 3.34Å; K945-R947 PolarHBondContact O-N 3.43Å; R947-W949 PolarHBondContact O-N 3.36Å; R947-E952 WeakPolarHBondContact CD-OE1 3.45Å; R947-E952 WeakPolarHBondContact CD-OE2 3.41Å; R947-E952 IonicContact CZ-OE1 3.33Å; R947-E952 IonicContact CZ-OE2 3.37Å; R947-E952 IonicContact NE-OE1 2.7Å; R947-E952 IonicContact NE-OE2 3.16Å; R947-E952 IonicContact NH1-OE1 3.17Å; R947-E952 PolarHBondContact NH1-OE1 3.12Å; R947-E952 IonicContact NH1-OE2 2.66Å; R947-E952 PolarHBondContact NH1-OE2 2.87Å
948	F	54.4	Low	84.2	Confident	74 Å²	74	40.5 Å²	40.5	33%	0.325	18%	0.176	S	C	.	.	S	Bend	trans	-61.7	-13	-172.1	-86.7	-98.4	0	0	0	116.1	K27 R73 L74 I77	K27-F948 HydrophobicContact CD-CD1 3.73Å; K27-F948 HydrophobicContact CD-CE1 4.42Å; K27-F948 PolarHBondContact NZ-O 3.17Å; R73-F948 HydrophobicContact CB-CE2 3.97Å; R73-F948 HydrophobicContact CB-CZ 4.5Å; R73-F948 WeakPolarHBondContact O-CE2 3.38Å; L74-F948 HydrophobicContact CD1-CZ 4.21Å; L74-F948 HydrophobicContact CD2-CB 4.48Å; L74-F948 HydrophobicContact CD2-CD1 3.85Å; L74-F948 HydrophobicContact CD2-CD2 3.59Å; L74-F948 HydrophobicContact CD2-CE1 3.87Å; L74-F948 HydrophobicContact CD2-CE2 3.63Å; L74-F948 HydrophobicContact CD2-CG 3.7Å; L74-F948 HydrophobicContact CD2-CZ 3.77Å; L74-F948 HydrophobicContact CG-CD2 4.06Å; L74-F948 HydrophobicContact CG-CE1 4.28Å; L74-F948 HydrophobicContact CG-CE2 3.61Å; L74-F948 HydrophobicContact CG-CZ 3.73Å; I77-F948 HydrophobicContact CD1-CB 4.27Å
949	W	58	Low	84.2	Confident	135 Å²	135	40.4 Å²	40.4	51%	0.511	18%	0.175	S	C	.	.	S	Bend	trans	-145.7	-20.5	-168	-59.9	128.4	0	0	0	115.1	K27 R947	K27-W949 HydrophobicContact CB-CH2 4.31Å; K27-W949 HydrophobicContact CB-CZ2 3.5Å; K27-W949 VanDerWaalsContact CB-CZ2 3.5Å; K27-W949 HydrophobicContact CD-CH2 3.97Å; K27-W949 HydrophobicContact CD-CZ2 3.63Å; K27-W949 HydrophobicContact CG-CH2 3.63Å; K27-W949 HydrophobicContact CG-CZ2 3.27Å; K27-W949 VanDerWaalsContact NZ-CE3 3.34Å; R947-W949 PolarHBondContact O-N 3.36Å
950	L	61.2	Low	84	Confident	70 Å²	70	41.7 Å²	41.7	37%	0.366	18%	0.181	S	C	.	.			trans	-113.4	135.5	-179.5	-72.4	89.9	0	0	0	110.3	E952	L950-E952 VanDerWaalsContact C-N 3.27Å; L950-E952 HydrophobicContact CB-CG 4.14Å; L950-E952 HydrophobicContact CD2-CG 4.5Å; L950-E952 PolarHBondContact O-N 2.94Å
951	H	65.4	Low	83.7	Confident	124 Å²	124	42.7 Å²	42.7	57%	0.574	19%	0.186	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	71.8	166.3	-62.6	-8.9	0	0	0	108.3	R944	R944-H951 PolarHBondContact NH2-CE1 2.87Å
952	E	83	Confident	82.9	Confident	13 Å²	13	44.4 Å²	44.4	6%	0.061	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	141.4	165.1	-73.4	164.1	-146.4	0	0	109.2	K945 R947 L950	K945-E952 HydrophobicContact CB-CB 4.24Å; K945-E952 WeakPolarHBondContact CB-O 3.4Å; K945-E952 HydrophobicContact CD-CB 4.35Å; K945-E952 WeakPolarHBondContact CD-OE2 3.47Å; K945-E952 VanDerWaalsContact CE-OE2 3.31Å; K945-E952 WeakPolarHBondContact CE-OE2 3.47Å; K945-E952 PolarHBondContact N-O 3.34Å; K945-E952 IonicContact NZ-OE2 3.34Å; K945-E952 PolarHBondContact NZ-OE2 2.86Å; R947-E952 WeakPolarHBondContact CD-OE1 3.45Å; R947-E952 WeakPolarHBondContact CD-OE2 3.41Å; R947-E952 IonicContact CZ-OE1 3.33Å; R947-E952 IonicContact CZ-OE2 3.37Å; R947-E952 IonicContact NE-OE1 2.7Å; R947-E952 IonicContact NE-OE2 3.16Å; R947-E952 IonicContact NH1-OE1 3.17Å; R947-E952 PolarHBondContact NH1-OE1 3.12Å; R947-E952 IonicContact NH1-OE2 2.66Å; R947-E952 PolarHBondContact NH1-OE2 2.87Å; L950-E952 VanDerWaalsContact C-N 3.27Å; L950-E952 HydrophobicContact CB-CG 4.14Å; L950-E952 HydrophobicContact CD2-CG 4.5Å; L950-E952 PolarHBondContact O-N 2.94Å
953	N	91.8	Very high	81.8	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.011	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	150.9	166.6	-64.6	-33.6	0	0	0	108.6	V848 L851 E852 L912 V942 A943 R944	V848-N953 HydrophobicContact CG2-CB 4.03Å; V848-N953 PolarHBondContact N-O 3.5Å; V848-N953 PolarHBondContact O-N 3.41Å; L851-N953 PolarHBondContact O-ND2 3.2Å; E852-N953 VanDerWaalsContact CG-ND2 3.31Å; E852-N953 WeakPolarHBondContact CG-ND2 3.31Å; L912-N953 HydrophobicContact CD1-CB 4.42Å; L912-N953 WeakPolarHBondContact CD1-OD1 3.43Å; V942-N953 HydrophobicContact CG1-CB 4.25Å; A943-N953 WeakPolarHBondContact O-CA 3.49Å; R944-N953 WeakPolarHBondContact CA-OD1 3.49Å
954	V	94.2	Very high	80.8	Confident	5 Å²	5	54.8 Å²	54.8	3%	0.03	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	129.4	177.5	58.3	0	0	0	0	109	V846 A943 K945 Y956	V846-V954 WeakPolarHBondContact O-CA 3.39Å; A943-V954 HydrophobicContact CB-CG1 4.25Å; A943-V954 PolarHBondContact N-O 3.08Å; A943-V954 WeakPolarHBondContact O-CG1 3.42Å; A943-V954 PolarHBondContact O-N 3.45Å; K945-V954 HydrophobicContact CB-CB 4.5Å; K945-V954 HydrophobicContact CB-CG1 4.14Å; V954-Y956 HydrophobicContact CB-CE2 4.46Å; V954-Y956 HydrophobicContact CG1-CD2 4.41Å; V954-Y956 HydrophobicContact CG1-CE2 3.56Å; V954-Y956 HydrophobicContact CG2-CE1 4.12Å; V954-Y956 HydrophobicContact CG2-CE2 4.13Å
955	V	95.7	Very high	80.2	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	116.8	176.6	-170.1	0	0	0	0	107.5	S845 V846 V848 A856 A940 L941 V942 V957	S845-V955 CarbonylContact C-O 3.52Å; S845-V955 VanDerWaalsContact CA-O 3.27Å; S845-V955 WeakPolarHBondContact CA-O 3.17Å; V846-V955 PolarHBondContact N-O 2.98Å; V846-V955 PolarHBondContact O-N 3.18Å; V848-V955 HydrophobicContact CG1-CG2 4.08Å; V848-V955 HydrophobicContact CG2-CG2 3.87Å; A856-V955 HydrophobicContact CB-CG2 4.11Å; A856-V955 WeakPolarHBondContact O-CG2 3.41Å; A940-V955 HydrophobicContact CB-CG1 3.83Å; L941-V955 WeakPolarHBondContact O-CA 3.44Å; V942-V955 HydrophobicContact CG2-CG2 4.47Å; V955-V957 HydrophobicContact CG1-CG2 4.03Å
956	Y	96.3	Very high	80.2	Confident	22 Å²	22	51.7 Å²	51.7	9%	0.086	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	125	168.9	-62.4	-76.2	0	0	0	108.5	Y842 F893 K904 I906 A940 L941 A943 V954	Y842-Y956 HydrophobicContact CE2-CD1 4.08Å; F893-Y956 HydrophobicContact CE2-CD1 4.03Å; F893-Y956 HydrophobicContact CE2-CE1 4.39Å; F893-Y956 HydrophobicContact CE2-CG 4.35Å; F893-Y956 AromaticContact CZ-CD1 3.84Å; F893-Y956 HydrophobicContact CZ-CD1 3.84Å; F893-Y956 HydrophobicContact CZ-CD2 4.01Å; F893-Y956 HydrophobicContact CZ-CE1 4.19Å; F893-Y956 HydrophobicContact CZ-CE2 4.3Å; F893-Y956 AromaticContact CZ-CG 3.77Å; F893-Y956 HydrophobicContact CZ-CG 3.77Å; K904-Y956 VanDerWaalsContact CE-OH 3.22Å; K904-Y956 WeakPolarHBondContact CE-OH 3.36Å; I906-Y956 HydrophobicContact CD1-CD2 3.65Å; I906-Y956 HydrophobicContact CD1-CE2 3.84Å; I906-Y956 HydrophobicContact CG1-CE2 4.27Å; A940-Y956 VanDerWaalsContact CA-O 3.29Å; A940-Y956 WeakPolarHBondContact CA-O 3.45Å; L941-Y956 PolarHBondContact N-O 2.96Å; L941-Y956 PolarHBondContact O-N 3.16Å; A943-Y956 HydrophobicContact CB-CE2 4.25Å; V954-Y956 HydrophobicContact CB-CE2 4.46Å; V954-Y956 HydrophobicContact CG1-CD2 4.41Å; V954-Y956 HydrophobicContact CG1-CE2 3.56Å; V954-Y956 HydrophobicContact CG2-CE1 4.12Å; V954-Y956 HydrophobicContact CG2-CE2 4.13Å
957	V	96.4	Very high	81.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	129.5	-175.6	-175	0	0	0	0	109.6	L843 G844 I861 I864 I938 V955	L843-V957 HydrophobicContact CB-CB 4.46Å; L843-V957 HydrophobicContact CB-CG1 4.32Å; L843-V957 HydrophobicContact CD1-CG1 4.11Å; L843-V957 PolarHBondContact N-O 3.44Å; G844-V957 PolarHBondContact N-O 2.87Å; G844-V957 PolarHBondContact O-N 2.79Å; I861-V957 HydrophobicContact CG1-CG1 4Å; I861-V957 HydrophobicContact CG1-CG2 3.92Å; I864-V957 HydrophobicContact CG1-CB 4.21Å; I864-V957 HydrophobicContact CG1-CG2 3.93Å; I864-V957 HydrophobicContact CG2-CG1 4.48Å; I938-V957 HydrophobicContact CG2-CG1 3.61Å; V955-V957 HydrophobicContact CG1-CG2 4.03Å
958	F	95.6	Very high	82.8	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	165.5	179	-44.5	-103.3	0	0	0	110.5	M840 L841 Y842 V881 I883 F893 I938 L939 L941	M840-F958 HydrophobicContact CB-CB 4.27Å; L841-F958 CarbonylContact O-C 3.4Å; L841-F958 WeakPolarHBondContact O-CA 3.43Å; Y842-F958 AromaticContact CD2-CD1 3.77Å; Y842-F958 HydrophobicContact CD2-CD1 3.77Å; Y842-F958 AromaticContact CD2-CE1 3.55Å; Y842-F958 HydrophobicContact CD2-CE1 3.55Å; Y842-F958 HydrophobicContact CD2-CZ 4.13Å; Y842-F958 HydrophobicContact CE2-CE1 4.34Å; Y842-F958 HydrophobicContact CG-CD1 4.37Å; Y842-F958 HydrophobicContact CG-CE1 4.31Å; V881-F958 HydrophobicContact CG2-CD1 3.88Å; V881-F958 HydrophobicContact CG2-CE1 4Å; I883-F958 HydrophobicContact CD1-CD1 3.7Å; I883-F958 HydrophobicContact CD1-CE1 3.83Å; I883-F958 HydrophobicContact CD1-CG 4.07Å; I883-F958 HydrophobicContact CD1-CZ 4.3Å; F893-F958 HydrophobicContact CB-CE1 4.25Å; F893-F958 HydrophobicContact CD1-CE1 4.35Å; F893-F958 AromaticContact CD1-CZ 3.9Å; F893-F958 HydrophobicContact CD1-CZ 3.9Å; F893-F958 AromaticContact CD2-CE1 3.9Å; F893-F958 HydrophobicContact CD2-CE1 3.9Å; F893-F958 AromaticContact CD2-CZ 3.95Å; F893-F958 HydrophobicContact CD2-CZ 3.95Å; F893-F958 AromaticContact CE1-CZ 3.92Å; F893-F958 HydrophobicContact CE1-CZ 3.92Å; F893-F958 HydrophobicContact CE2-CE1 4.28Å; F893-F958 AromaticContact CE2-CZ 3.94Å; F893-F958 HydrophobicContact CE2-CZ 3.94Å; F893-F958 AromaticContact CG-CE1 3.94Å; F893-F958 HydrophobicContact CG-CE1 3.94Å; F893-F958 AromaticContact CG-CZ 3.93Å; F893-F958 HydrophobicContact CG-CZ 3.93Å; F893-F958 AromaticContact CZ-CZ 3.94Å; F893-F958 HydrophobicContact CZ-CZ 3.94Å; I938-F958 WeakPolarHBondContact CA-O 3.21Å; L939-F958 HydrophobicContact CD1-CB 4.13Å; L939-F958 HydrophobicContact CD1-CD2 3.71Å; L939-F958 HydrophobicContact CD1-CG 4.29Å; L939-F958 HydrophobicContact CD2-CB 4.37Å; L939-F958 HydrophobicContact CG-CB 3.99Å; L939-F958 HydrophobicContact CG-CD2 4.45Å; L939-F958 PolarHBondContact N-O 3.45Å; L939-F958 PolarHBondContact O-N 2.84Å; L941-F958 HydrophobicContact CD1-CE2 3.77Å; L941-F958 HydrophobicContact CD1-CZ 4.24Å; L941-F958 HydrophobicContact CG-CE2 3.93Å
959	C	93.8	Very high	84.5	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	143.6	-175.5	176.3	0	0	0	0	110.8	L841 L843 F923 S936 K937 I961	L841-C959 HydrophobicContact CB-CB 4.21Å; L841-C959 PolarHBondContact N-O 2.91Å; L841-C959 PolarHBondContact O-N 2.82Å; L843-C959 HydrophobicContact CD1-CB 4Å; L843-C959 HydrophobicContact CD2-CB 4.11Å; L843-C959 HydrophobicContact CG-CB 4.03Å; F923-C959 HydrophobicContact CB-CB 4.34Å; F923-C959 HydrophobicContact CD1-CB 4.37Å; S936-C959 WeakPolarHBondContact CB-SG 3.3Å; K937-C959 WeakPolarHBondContact O-CA 3.39Å; C959-I961 PolarHBondContact O-N 3.27Å
960	E	92.6	Very high	86.2	Confident	27 Å²	27	35.1 Å²	35.1	13%	0.126	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	119.5	-178.9	-163.1	163.2	139.2	0	0	112.1	M933 S936 K937 S966 A967	M933-E960 HydrophobicContact CE-CG 4.37Å; M933-E960 VanDerWaalsContact CE-O 3.29Å; M933-E960 WeakPolarHBondContact CE-O 3.23Å; S936-E960 VanDerWaalsContact CB-O 3.28Å; S936-E960 WeakPolarHBondContact CB-O 3.37Å; S936-E960 PolarHBondContact OG-O 3.01Å; K937-E960 PolarHBondContact O-N 3.47Å; E960-S966 VanDerWaalsContact CD-CA 3.46Å; E960-S966 WeakPolarHBondContact OE1-CB 3.45Å; E960-A967 HydrophobicContact CB-CB 4.31Å; E960-A967 VanDerWaalsContact OE2-CB 3.31Å; E960-A967 WeakPolarHBondContact OE2-CB 3.16Å; E960-A967 PolarHBondContact OE2-N 3.46Å
961	I	89.6	Confident	87.7	Confident	21 Å²	21	32.4 Å²	32.4	11%	0.108	16%	0.162	C	C	.	.			trans	-120	-5.3	179.4	-153.9	176	0	0	0	114.1	L841 E880 L928 M933 C959	L841-I961 HydrophobicContact CB-CB 4.28Å; L841-I961 HydrophobicContact CB-CD1 4.21Å; L841-I961 HydrophobicContact CD1-CD1 4.2Å; E880-I961 HydrophobicContact CG-CD1 4.04Å; E880-I961 HydrophobicContact CG-CG2 4.44Å; L928-I961 HydrophobicContact CD2-CD1 4.33Å; L928-I961 HydrophobicContact CD2-CG1 3.85Å; M933-I961 WeakPolarHBondContact SD-CA 3.46Å; M933-I961 HydrophobicContact SD-CG1 4.42Å; M933-I961 VanDerWaalsContact SD-O 3.33Å; C959-I961 PolarHBondContact O-N 3.27Å
962	D	80.1	Confident	89	Confident	37 Å²	37	29.8 Å²	29.8	20%	0.198	15%	0.147	C	C	.	.			trans	-134	128.3	176.7	-177.7	9.6	0	0	0	111.2	N964 H965	D962-N964 PolarHBondContact O-N 3.06Å; D962-N964 PolarHBondContact OD1-N 3.23Å; D962-N964 PolarHBondContact OD1-ND2 3.02Å; D962-H965 CarbonylContact O-C 3.52Å; D962-H965 PolarHBondContact O-N 2.78Å; D962-H965 IonicContact OD2-CD2 3.52Å; D962-H965 PolarHBondContact OD2-CD2 3.22Å
963	H	71.9	Confident	89.4	Confident	128 Å²	128	31.5 Å²	31.5	59%	0.593	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-24.9	176.5	-58	90.9	0	0	0	112.8
964	N	71.6	Confident	89.4	Confident	94 Å²	94	31.4 Å²	31.4	50%	0.503	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-26.8	177.7	-58.5	-70.8	0	0	0	112.9	D962	D962-N964 PolarHBondContact O-N 3.06Å; D962-N964 PolarHBondContact OD1-N 3.23Å; D962-N964 PolarHBondContact OD1-ND2 3.02Å
965	H	78.2	Confident	89.3	Confident	67 Å²	67	33.6 Å²	33.6	31%	0.31	17%	0.165	S	C	.	.	S	Bend	trans	-128.6	69	-169.6	-71.7	-73	0	0	0	111.2	T838 M840 D962	T838-H965 HydrophobicContact CG2-CB 3.68Å; T838-H965 PolarHBondContact OG1-ND1 3.37Å; M840-H965 WeakPolarHBondContact CE-O 3.28Å; D962-H965 CarbonylContact O-C 3.52Å; D962-H965 PolarHBondContact O-N 2.78Å; D962-H965 IonicContact OD2-CD2 3.52Å; D962-H965 PolarHBondContact OD2-CD2 3.22Å
966	S	85.4	Confident	89	Confident	21 Å²	21	38.8 Å²	38.8	15%	0.147	20%	0.197	C	C	.	.			trans	-60.5	151.1	-177.2	71.4	0	0	0	0	113.8	E960 L968 N969 L970	E960-S966 VanDerWaalsContact CD-CA 3.46Å; E960-S966 WeakPolarHBondContact OE1-CB 3.45Å; S966-L968 PolarHBondContact O-N 3.28Å; S966-N969 PolarHBondContact O-N 2.83Å; S966-N969 PolarHBondContact OG-N 3.43Å; S966-N969 PolarHBondContact OG-ND2 3.25Å; S966-L970 PolarHBondContact O-N 3.34Å
967	A	91.9	Very high	88.6	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-56.3	-36	175.8	0	0	0	0	0	111.6	M840 L916 K937 L939 E960 L970 V971	M840-A967 HydrophobicContact CE-CB 4.39Å; L916-A967 HydrophobicContact CD2-CB 3.64Å; K937-A967 HydrophobicContact CB-CB 4.2Å; L939-A967 HydrophobicContact CB-CB 4.31Å; L939-A967 HydrophobicContact CD2-CB 3.61Å; E960-A967 HydrophobicContact CB-CB 4.31Å; E960-A967 VanDerWaalsContact OE2-CB 3.31Å; E960-A967 WeakPolarHBondContact OE2-CB 3.16Å; E960-A967 PolarHBondContact OE2-N 3.46Å; A967-L970 PolarHBondContact O-N 2.86Å; A967-V971 WeakPolarHBondContact O-CB 3.47Å; A967-V971 VanDerWaalsContact O-CG2 3.29Å; A967-V971 WeakPolarHBondContact O-CG2 3.23Å; A967-V971 PolarHBondContact O-N 3.1Å
968	L	91	Very high	88.2	Confident	36 Å²	36	40.2 Å²	40.2	19%	0.188	21%	0.205	C	C	.	.	H	α-helix	trans	-63.4	-40.6	176.6	178.1	59.9	0	0	0	112.4	L916 S966 R972	L916-L968 HydrophobicContact CD1-CB 4.3Å; L916-L968 HydrophobicContact CD1-CD1 4.09Å; S966-L968 PolarHBondContact O-N 3.28Å; L968-R972 HydrophobicContact CD1-CG 4.43Å; L968-R972 WeakPolarHBondContact O-CB 3.16Å; L968-R972 VanDerWaalsContact O-CG 3.3Å; L968-R972 WeakPolarHBondContact O-CG 2.85Å; L968-R972 PolarHBondContact O-N 3.29Å
969	N	90.9	Very high	87.5	Confident	71 Å²	71	45 Å²	45	38%	0.38	24%	0.236	S	C	.	.	H	α-helix	trans	-69.9	-38.8	179	-72.2	-12.2	0	0	0	111.4	S966 R972 F973	S966-N969 PolarHBondContact O-N 2.83Å; S966-N969 PolarHBondContact OG-N 3.43Å; S966-N969 PolarHBondContact OG-ND2 3.25Å; N969-R972 PolarHBondContact O-N 3.27Å; N969-F973 PolarHBondContact O-N 3.04Å
970	L	92.7	Very high	86.8	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64.3	-45.6	174.5	179.7	61.1	0	0	0	112	M836 T838 M840 I883 V885 L939 S966 A967 F973 I974	M836-L970 HydrophobicContact CE-CB 4.12Å; M836-L970 HydrophobicContact CE-CD1 4.17Å; M836-L970 HydrophobicContact SD-CD1 4.23Å; T838-L970 HydrophobicContact CG2-CB 4.43Å; T838-L970 HydrophobicContact CG2-CD2 4.09Å; M840-L970 HydrophobicContact CE-CD2 4.31Å; M840-L970 HydrophobicContact CG-CD2 4.1Å; I883-L970 HydrophobicContact CB-CD2 4.4Å; I883-L970 HydrophobicContact CD1-CD2 3.96Å; I883-L970 HydrophobicContact CG2-CD2 4.37Å; V885-L970 HydrophobicContact CG2-CD1 3.93Å; L939-L970 HydrophobicContact CD2-CD2 4.16Å; S966-L970 PolarHBondContact O-N 3.34Å; A967-L970 PolarHBondContact O-N 2.86Å; L970-F973 PolarHBondContact O-N 2.96Å; L970-I974 HydrophobicContact CD1-CD1 3.89Å; L970-I974 HydrophobicContact CD1-CG1 4.29Å; L970-I974 HydrophobicContact CG-CD1 3.82Å; L970-I974 WeakPolarHBondContact O-CB 3.44Å; L970-I974 WeakPolarHBondContact O-CD1 3.3Å; L970-I974 VanDerWaalsContact O-CG1 3.27Å; L970-I974 WeakPolarHBondContact O-CG1 3.5Å; L970-I974 PolarHBondContact O-N 3.23Å
971	V	93.9	Very high	86.2	Confident	13 Å²	13	52.5 Å²	52.5	8%	0.079	28%	0.276	C	S	.	.	H	α-helix	trans	-59.4	-46.4	175.2	166.5	0	0	0	0	111.2	L916 L939 A967 F973 I974 N975	L916-V971 HydrophobicContact CD2-CG2 4.15Å; L916-V971 HydrophobicContact CG-CG2 4.44Å; L939-V971 HydrophobicContact CB-CG2 4.19Å; A967-V971 WeakPolarHBondContact O-CB 3.47Å; A967-V971 VanDerWaalsContact O-CG2 3.29Å; A967-V971 WeakPolarHBondContact O-CG2 3.23Å; A967-V971 PolarHBondContact O-N 3.1Å; V971-F973 PolarHBondContact O-N 3.04Å; V971-I974 PolarHBondContact O-N 3.34Å; V971-N975 PolarHBondContact O-N 3.12Å
972	R	91.4	Very high	84.7	Confident	69 Å²	69	59.6 Å²	59.6	26%	0.26	30%	0.302	S	S	.	.	H	α-helix	trans	-56.2	-52	176	-78.3	171.3	172.5	165.9	-2.5	111.4	L968 N969 I974 N975 T976	L968-R972 HydrophobicContact CD1-CG 4.43Å; L968-R972 WeakPolarHBondContact O-CB 3.16Å; L968-R972 VanDerWaalsContact O-CG 3.3Å; L968-R972 WeakPolarHBondContact O-CG 2.85Å; L968-R972 PolarHBondContact O-N 3.29Å; N969-R972 PolarHBondContact O-N 3.27Å; R972-I974 VanDerWaalsContact C-N 3.35Å; R972-I974 PolarHBondContact O-N 3.26Å; R972-N975 PolarHBondContact O-N 3.39Å; R972-T976 PolarHBondContact O-N 3.27Å; R972-T976 PolarHBondContact O-OG1 3.21Å; R972-T976 VanDerWaalsContact O-OG1 3.07Å
973	F	91.4	Very high	83.5	Confident	48 Å²	48	65.6 Å²	65.6	21%	0.211	33%	0.334	C	S	.	.	H	α-helix	trans	-60.4	-42.6	179.6	-173.9	-89.6	0	0	0	112.5	M836 V885 N969 L970 V971 N975 T976 I977	M836-F973 HydrophobicContact CB-CD1 3.51Å; M836-F973 HydrophobicContact CB-CD2 4.07Å; M836-F973 HydrophobicContact CB-CE1 3.42Å; M836-F973 VanDerWaalsContact CB-CE1 3.42Å; M836-F973 HydrophobicContact CB-CE2 3.99Å; M836-F973 HydrophobicContact CB-CG 3.85Å; M836-F973 HydrophobicContact CB-CZ 3.68Å; M836-F973 HydrophobicContact CG-CD1 4.33Å; M836-F973 HydrophobicContact CG-CG 4.34Å; M836-F973 HydrophobicContact SD-CB 3.41Å; M836-F973 WeakPolarHBondContact SD-CB 2.97Å; M836-F973 HydrophobicContact SD-CD1 3.91Å; M836-F973 HydrophobicContact SD-CD2 4Å; M836-F973 HydrophobicContact SD-CG 3.49Å; M836-F973 WeakPolarHBondContact SD-CG 2.7Å; V885-F973 HydrophobicContact CB-CD1 4.01Å; V885-F973 HydrophobicContact CB-CE1 3.81Å; V885-F973 HydrophobicContact CG1-CD1 3.93Å; V885-F973 HydrophobicContact CG1-CE1 3.75Å; V885-F973 HydrophobicContact CG2-CD1 4.41Å; N969-F973 PolarHBondContact O-N 3.04Å; L970-F973 PolarHBondContact O-N 2.96Å; V971-F973 PolarHBondContact O-N 3.04Å; F973-N975 VanDerWaalsContact C-N 3.33Å; F973-N975 PolarHBondContact O-N 2.69Å; F973-T976 PolarHBondContact O-N 3.17Å; F973-I977 HydrophobicContact CD1-CG1 3.93Å; F973-I977 HydrophobicContact CE1-CD1 4.31Å; F973-I977 HydrophobicContact CE1-CG1 3.5Å; F973-I977 HydrophobicContact CE2-CD1 4.45Å; F973-I977 HydrophobicContact CE2-CG1 4.29Å; F973-I977 HydrophobicContact CG-CG1 4.48Å; F973-I977 HydrophobicContact CZ-CD1 4.01Å; F973-I977 HydrophobicContact CZ-CG1 3.7Å; F973-I977 WeakPolarHBondContact O-CG1 3.32Å; F973-I977 PolarHBondContact O-N 3.05Å
974	I	93.1	Very high	84.1	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-59.3	-45.1	176.8	-72.2	165	0	0	0	110.8	V885 I891 L911 C914 L941 L970 V971 R972 I977 F978 L981	V885-I974 HydrophobicContact CG1-CG1 4.31Å; V885-I974 HydrophobicContact CG2-CD1 4.3Å; V885-I974 HydrophobicContact CG2-CG1 3.83Å; I891-I974 HydrophobicContact CD1-CD1 3.77Å; I891-I974 HydrophobicContact CD1-CG1 3.95Å; I891-I974 HydrophobicContact CD1-CG2 3.87Å; L911-I974 HydrophobicContact CD2-CG2 4.14Å; C914-I974 HydrophobicContact CB-CB 4.43Å; C914-I974 HydrophobicContact CB-CG2 3.54Å; L941-I974 HydrophobicContact CD2-CD1 4.16Å; L970-I974 HydrophobicContact CD1-CD1 3.89Å; L970-I974 HydrophobicContact CD1-CG1 4.29Å; L970-I974 HydrophobicContact CG-CD1 3.82Å; L970-I974 WeakPolarHBondContact O-CB 3.44Å; L970-I974 WeakPolarHBondContact O-CD1 3.3Å; L970-I974 VanDerWaalsContact O-CG1 3.27Å; L970-I974 WeakPolarHBondContact O-CG1 3.5Å; L970-I974 PolarHBondContact O-N 3.23Å; V971-I974 PolarHBondContact O-N 3.34Å; R972-I974 VanDerWaalsContact C-N 3.35Å; R972-I974 PolarHBondContact O-N 3.26Å; I974-I977 PolarHBondContact O-N 2.92Å; I974-F978 HydrophobicContact CG2-CD2 4.11Å; I974-F978 WeakPolarHBondContact O-CB 3.31Å; I974-F978 WeakPolarHBondContact O-CD2 3.06Å; I974-F978 PolarHBondContact O-N 2.99Å; I974-L981 HydrophobicContact CG2-CD1 3.98Å
975	N	91.7	Very high	84.7	Confident	51 Å²	51	60.8 Å²	60.8	27%	0.273	31%	0.311	S	S	.	.	H	α-helix	trans	-74.9	-28.1	-177.9	-64.8	4.3	0	0	0	112.1	C914 V971 R972 F973 F978 P979 L981	C914-N975 WeakPolarHBondContact CB-OD1 3.06Å; C914-N975 PolarHBondContact O-ND2 2.82Å; V971-N975 PolarHBondContact O-N 3.12Å; R972-N975 PolarHBondContact O-N 3.39Å; F973-N975 VanDerWaalsContact C-N 3.33Å; F973-N975 PolarHBondContact O-N 2.69Å; N975-F978 CarbonylContact O-C 3.57Å; N975-P979 WeakPolarHBondContact O-CA 3.32Å; N975-L981 WeakPolarHBondContact OD1-CD1 3Å
976	T	89.6	Confident	85.1	Confident	108 Å²	108	60.4 Å²	60.4	66%	0.663	31%	0.311	S	S	*	.	H	α-helix	trans	-66.3	-40.7	168.7	-58.8	0	0	0	0	112.5	R972 F973	R972-T976 PolarHBondContact O-N 3.27Å; R972-T976 PolarHBondContact O-OG1 3.21Å; R972-T976 VanDerWaalsContact O-OG1 3.07Å; F973-T976 PolarHBondContact O-N 3.17Å
977	I	88.1	Confident	85.1	Confident	32 Å²	32	62.8 Å²	62.8	16%	0.164	32%	0.321	C	S	.	.	H	α-helix	trans	-79	-28.5	179.7	-63.5	-56.9	0	0	0	112.3	N834 P887 F973 I974 P979	N834-I977 HydrophobicContact CB-CD1 3.95Å; P887-I977 HydrophobicContact CB-CG2 3.82Å; P887-I977 HydrophobicContact CG-CD1 4.42Å; P887-I977 HydrophobicContact CG-CG2 3.93Å; F973-I977 HydrophobicContact CD1-CG1 3.93Å; F973-I977 HydrophobicContact CE1-CD1 4.31Å; F973-I977 HydrophobicContact CE1-CG1 3.5Å; F973-I977 HydrophobicContact CE2-CD1 4.45Å; F973-I977 HydrophobicContact CE2-CG1 4.29Å; F973-I977 HydrophobicContact CG-CG1 4.48Å; F973-I977 HydrophobicContact CZ-CD1 4.01Å; F973-I977 HydrophobicContact CZ-CG1 3.7Å; F973-I977 WeakPolarHBondContact O-CG1 3.32Å; F973-I977 PolarHBondContact O-N 3.05Å; I974-I977 PolarHBondContact O-N 2.92Å; I977-P979 VanDerWaalsContact C-CD 3.46Å; I977-P979 WeakPolarHBondContact O-CD 3.26Å
978	F	88.8	Confident	84.6	Confident	21 Å²	21	66.7 Å²	66.7	9%	0.092	34%	0.341	C	S	.	.			trans	-123.5	69.2	179.5	-53.3	-64.9	0	0	0	111.7	V885 P887 I891 P908 L911 I974 N975 N980 L981	V885-F978 HydrophobicContact CG1-CE2 3.9Å; P887-F978 WeakPolarHBondContact O-CE1 3.29Å; I891-F978 HydrophobicContact CG1-CE2 4.1Å; P908-F978 HydrophobicContact CB-CD1 4.06Å; P908-F978 HydrophobicContact CB-CE1 3.74Å; P908-F978 HydrophobicContact CG-CD1 4.49Å; P908-F978 HydrophobicContact CG-CE1 3.68Å; P908-F978 HydrophobicContact CG-CZ 4.29Å; L911-F978 HydrophobicContact CD2-CD2 3.96Å; L911-F978 HydrophobicContact CD2-CE2 4.45Å; L911-F978 HydrophobicContact CD2-CG 4.44Å; I974-F978 HydrophobicContact CG2-CD2 4.11Å; I974-F978 WeakPolarHBondContact O-CB 3.31Å; I974-F978 WeakPolarHBondContact O-CD2 3.06Å; I974-F978 PolarHBondContact O-N 2.99Å; N975-F978 CarbonylContact O-C 3.57Å; F978-N980 PolarHBondContact O-N 2.85Å; F978-L981 HydrophobicContact CB-CD1 3.89Å; F978-L981 HydrophobicContact CB-CG 3.92Å; F978-L981 VanDerWaalsContact O-CG 3.26Å; F978-L981 WeakPolarHBondContact O-CG 3.19Å; F978-L981 PolarHBondContact O-N 3.03Å; F978-L981 VanDerWaalsContact O-N 3.14Å
979	P	79.4	Confident	84.2	Confident	100 Å²	100	68.7 Å²	68.7	65%	0.649	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-5.2	-177.8	29.1	-37.3	0	0	0	114.3	N975 I977 L981	N975-P979 WeakPolarHBondContact O-CA 3.32Å; I977-P979 VanDerWaalsContact C-CD 3.46Å; I977-P979 WeakPolarHBondContact O-CD 3.26Å; P979-L981 VanDerWaalsContact C-N 3.34Å
980	N	79	Confident	83.7	Confident	158 Å²	158	68.6 Å²	68.6	85%	0.845	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	1.7	175.3	-67.7	-41.4	0	0	0	113.6	F978 R982	F978-N980 PolarHBondContact O-N 2.85Å; N980-R982 PolarHBondContact O-N 2.8Å
981	L	79.8	Confident	83	Confident	26 Å²	26	73.8 Å²	73.8	14%	0.136	38%	0.376	C	S	.	.			trans	-66.4	129	168.7	-62.6	174.2	0	0	0	108.5	L911 C914 I974 N975 F978 P979	L911-L981 HydrophobicContact CB-CD2 4Å; L911-L981 HydrophobicContact CD2-CD1 3.87Å; L911-L981 HydrophobicContact CD2-CD2 3.84Å; L911-L981 HydrophobicContact CD2-CG 4.43Å; L911-L981 HydrophobicContact CG-CD1 4.38Å; L911-L981 HydrophobicContact CG-CD2 3.59Å; C914-L981 HydrophobicContact CB-CD1 4.07Å; I974-L981 HydrophobicContact CG2-CD1 3.98Å; N975-L981 WeakPolarHBondContact OD1-CD1 3Å; F978-L981 HydrophobicContact CB-CD1 3.89Å; F978-L981 HydrophobicContact CB-CG 3.92Å; F978-L981 VanDerWaalsContact O-CG 3.26Å; F978-L981 WeakPolarHBondContact O-CG 3.19Å; F978-L981 PolarHBondContact O-N 3.03Å; F978-L981 VanDerWaalsContact O-N 3.14Å; P979-L981 VanDerWaalsContact C-N 3.34Å
982	R	59.6	Low	82.1	Confident	170 Å²	170	78.9 Å²	78.9	64%	0.642	40%	0.401	S	S	*	.			trans	-85.5	127.4	179.6	-62.1	172.2	176	171.7	-4.3	108	E852 N853 W913 N980	E852-R982 IonicContact OE2-NH1 3.68Å; N853-R982 VanDerWaalsContact CG-O 3.28Å; N853-R982 VanDerWaalsContact ND2-CB 3.33Å; N853-R982 WeakPolarHBondContact ND2-CB 3.33Å; N853-R982 PolarHBondContact ND2-O 2.69Å; N853-R982 VanDerWaalsContact ND2-O 3.1Å; W913-R982 VanDerWaalsContact CD1-O 3.23Å; N980-R982 PolarHBondContact O-N 2.8Å
983	D	53.7	Low	81.3	Confident	163 Å²	163	79.8 Å²	79.8	87%	0.872	41%	0.414	S	S	*	.			trans	-56.6	0	174.6	-68.3	-53.2	0	0	0	113.5	N853 W913	N853-D983 PolarHBondContact ND2-O 2.8Å; W913-D983 PolarHBondContact NE1-OXT 3.03Å

Retrieved 983 of 983 residues in 1030.4 ms (Link to these results)

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