A0A3Q0KHK4_SCHMA Loading...

DUF1604 domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KHK4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,104 aa.

						>A0A3Q0KHK4_SCHMA|A0A3Q0KHK4
MSSPVDPEEYSFVAYGDPFSDDENEQSRFRGLALGKRKAIPSAYENRVLNEKGRPMRFHGAFTGGFSAGYFNSVGSKEGFKPKSFHSSRKNRQRDLDEKFAQHPEDFMDDEDFGEFGIAPRRIRPTHEFDDTHVRDTLQIALGDQSVIPQAGSLLKGLIVATRGTLAERLLRRLGWKNAHSTLLNDDTVEDTNQRKFPDDTEAITGTNECFGGEKDSSPTMFAQISFVAKTNTFGLGYSPLDPEIAMGRRKLNSNDAEDIWSNRHPEESISALLHRQQKIRNENEFDLKSGLKRRGITGHAFGVGALEEEDADVYEQDRLAEYDWEIGDGESNDDEDEDEEQAEIEAARLGRLSSTMKTKSQVNSSSTERTKIIDGWTAPSQHRSSQKLNKSSSDALPGFRSESTKQNELKTHPIQVPLPPGYIPVFNPRCISTCDNKESITSNASNHPYAKHDAISRARLLQEDSVYEKLDPIQQLRLKAAAAGLPVPALVSKSSAEQQSNQSEKSNELAVFTTSNPTAGLMKIFKMDSNKQARFEAYQVLVRRGFAHEDAYHRCSTLLDLNNEEKEREANSFQALIKMNQMTNTNNTSQIDPVNMNNDTMICQTSTPTSTITTISSNPSDRLMPLSNKLPLHKQQLISSKLALRFRSAGCMDISKELTEEEEKAQRARVESLDTVEPRDHAVATESYGALTRRRLKWHPDKLLCKRINVPDPYPDSTFVGCPDDRRPRNPFRHKFGKHGKSRFSDSSTANEFSIFDLLDVNTTGSIQKLNSSNATSVERQLSSESNSSDSDSNDPSGTMPELCANNTPYRTEMTGTTFQSRGKALFATLFRSIEQGKTTETTDNVMENNNNSLIEKVQPADKISHDITNEIVNESNTRVIGPALPKIGIDVLTDHTDKPPMDLFKSIFASDEELSSSSLSDNDVDNDNNNNKDREKDDLTIQRDSKPNSIEPSNDQPELFKVHALFSHLFEPNGDMRGPLSGLTQMTTRPEVSSKVPTSSQNNLNPDLLYGPDLPPNFTPTSDKANPISVTKDQEEASRSTLSDDILFVESHLVNRSSAKHKKSKNSKRKHKTKHKKQHKSKKVSRKAPISSSDSNSSDTSD
					

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(Predicted Aligned Error values between residue pairs)

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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	38.1	Very low	44.6	Very low	146 Å²	146	127.2 Å²	127.2	72%	0.719	70%	0.703	S	S	*	*				0	48	0	-66.9	-87.5	153.3	0	0	113.1	F1020 T1021 P1022 T1023	M1-F1020 PolarHBondContact N-O 2.87Å; M1-T1021 WeakPolarHBondContact CA-O 3.46Å; M1-T1021 VanDerWaalsContact CE-O 3.25Å; M1-T1021 WeakPolarHBondContact CE-O 3.07Å; M1-T1021 VanDerWaalsContact CG-O 3.24Å; M1-T1021 WeakPolarHBondContact CG-O 3.4Å; M1-T1021 PolarHBondContact N-O 3.12Å; M1-P1022 VanDerWaalsContact SD-C 3.58Å; M1-P1022 WeakPolarHBondContact SD-CA 3.23Å; M1-T1023 PolarHBondContact SD-N 3.44Å; M1-T1023 PolarHBondContact SD-OG1 2.74Å
2	S	40.4	Very low	45.6	Very low	92 Å²	92	132.1 Å²	132.1	64%	0.643	71%	0.712	S	S	*	*			trans	-149.3	162.4	146.9	-154.2	0	0	0	0	106.8
3	S	46.2	Very low	46.6	Very low	69 Å²	69	130.4 Å²	130.4	48%	0.483	71%	0.709	S	S	.	*	P	Polyproline II helix	trans	-75.5	147	176.6	46.7	0	0	0	0	110.8	V5	S3-V5 PolarHBondContact O-N 2.81Å
4	P	46	Very low	48.1	Very low	98 Å²	98	125.4 Å²	125.4	64%	0.636	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-61	128.9	161.3	29	-32.5	0	0	0	107.8
5	V	44	Very low	48.3	Very low	129 Å²	129	133.8 Å²	133.8	78%	0.782	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-94.9	130.8	170.5	177.5	0	0	0	0	106.8	S3	S3-V5 PolarHBondContact O-N 2.81Å
6	D	44.7	Very low	49.9	Very low	127 Å²	127	130.1 Å²	130.1	68%	0.679	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-66.1	137.8	-176.3	-64.6	-70.8	0	0	0	111.6	E8	D6-E8 HydrophobicContact CB-CG 4.36Å; D6-E8 PolarHBondContact O-N 3.45Å
7	P	47.4	Very low	51.3	Low	129 Å²	129	127.4 Å²	127.4	84%	0.838	70%	0.701	S	S	*	*	S	Bend	trans	-79.6	57.8	174.8	34.8	-36	0	0	0	111
8	E	41.8	Very low	52.3	Low	175 Å²	175	126.8 Å²	126.8	82%	0.818	70%	0.704	S	S	*	*			trans	-112.3	26.5	-179.9	-65.4	-156.1	162.5	0	0	113.9	D6	D6-E8 HydrophobicContact CB-CG 4.36Å; D6-E8 PolarHBondContact O-N 3.45Å
9	E	44.2	Very low	52.8	Low	143 Å²	143	130.3 Å²	130.3	67%	0.668	71%	0.712	S	S	*	*			trans	-153.6	134.5	163	-100.4	160.4	-153.1	0	0	106.3
10	Y	40.5	Very low	52.8	Low	186 Å²	186	128.2 Å²	128.2	73%	0.729	71%	0.707	S	S	*	*			cis	-131.4	137	14.5	-57.7	-88.9	0	0	0	111
11	S	57	Low	52.9	Low	105 Å²	105	128 Å²	128	73%	0.734	71%	0.705	S	S	*	*			trans	-115.5	63.6	174.7	177	0	0	0	0	111
12	F	56.7	Low	53.5	Low	186 Å²	186	126.8 Å²	126.8	82%	0.816	70%	0.702	S	S	*	*			trans	-66.7	133.1	168.5	49	-95.3	0	0	0	109.9
13	V	59.3	Low	54.2	Low	110 Å²	110	127.3 Å²	127.3	67%	0.667	69%	0.694	S	S	*	*			trans	-108.4	125.3	175.7	179.9	0	0	0	0	107	D17	V13-D17 HydrophobicContact CG1-CB 3.75Å
14	A	67.7	Low	54.5	Low	61 Å²	61	128.9 Å²	128.9	50%	0.504	70%	0.697	S	S	.	*			trans	-73.5	148.1	177.8	0	0	0	0	0	110.5	G16 D17	A14-G16 VanDerWaalsContact C-N 3.31Å; A14-G16 PolarHBondContact O-N 3.44Å; A14-D17 PolarHBondContact N-OD2 3.08Å; A14-D17 PolarHBondContact O-N 3.4Å
15	Y	51.2	Low	55.1	Low	251 Å²	251	132 Å²	132	98%	0.984	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	86.4	179.5	-155.3	-81.9	0	0	0	110.2
16	G	73.9	Confident	55.7	Low	74 Å²	74	133.6 Å²	133.6	76%	0.763	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	141.2	-9	-171.3	0	0	0	0	0	114.6	A14	A14-G16 VanDerWaalsContact C-N 3.31Å; A14-G16 PolarHBondContact O-N 3.44Å
17	D	72.3	Confident	56.2	Low	84 Å²	84	130.1 Å²	130.1	45%	0.449	69%	0.687	S	S	.	*	P	Polyproline II helix	trans	-59	132.3	175.8	-87	-38.7	0	0	0	111.7	V13 A14	V13-D17 HydrophobicContact CG1-CB 3.75Å; A14-D17 PolarHBondContact N-OD2 3.08Å; A14-D17 PolarHBondContact O-N 3.4Å
18	P	69.8	Low	56.5	Low	117 Å²	117	130.8 Å²	130.8	76%	0.76	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-72.4	132.3	-179.8	28.9	-33.9	0	0	0	111.5	S20	P18-S20 PolarHBondContact O-N 2.92Å
19	F	61.5	Low	57.2	Low	193 Å²	193	130.1 Å²	130.1	85%	0.846	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-60.3	135.5	169.2	-61.1	-79.4	0	0	0	110.5	D21	F19-D21 PolarHBondContact O-N 2.98Å; F19-D21 VanDerWaalsContact O-N 3.14Å
20	S	53.3	Low	57.7	Low	89 Å²	89	132.4 Å²	132.4	62%	0.622	67%	0.67	S	S	*	*			trans	-71.5	104.9	174.2	55.6	0	0	0	0	110.3	P18 D22	P18-S20 PolarHBondContact O-N 2.92Å; S20-D22 PolarHBondContact O-N 2.88Å
21	D	55.5	Low	58.5	Low	125 Å²	125	124.9 Å²	124.9	67%	0.668	65%	0.649	S	S	*	*			trans	-61.3	-8.1	-177.5	-82.3	-41.2	0	0	0	114.8	F19 E23 K698	F19-D21 PolarHBondContact O-N 2.98Å; F19-D21 VanDerWaalsContact O-N 3.14Å; D21-E23 PolarHBondContact O-N 3.49Å; D21-K698 IonicContact OD2-NZ 3.14Å
22	D	51.1	Low	58.3	Low	120 Å²	120	124.8 Å²	124.8	64%	0.642	64%	0.64	S	S	*	*			trans	-68.7	13.1	-173.8	-64.7	-48.3	0	0	0	115.8	S20 N24 S27	S20-D22 PolarHBondContact O-N 2.88Å; D22-N24 PolarHBondContact O-N 3.06Å; D22-S27 WeakPolarHBondContact O-CB 3.42Å; D22-S27 PolarHBondContact O-OG 3.12Å
23	E	54.3	Low	58.2	Low	103 Å²	103	120 Å²	120	48%	0.481	64%	0.635	S	S	.	*			trans	-72.9	48.5	171.8	-81.9	-145.8	-164.3	0	0	113.6	D21 R28	D21-E23 PolarHBondContact O-N 3.49Å; E23-R28 IonicContact OE2-CZ 2.77Å; E23-R28 IonicContact OE2-NE 3.71Å; E23-R28 PolarHBondContact OE2-NE 2.9Å; E23-R28 IonicContact OE2-NH2 2.67Å; E23-R28 PolarHBondContact OE2-NH2 2.85Å
24	N	51.8	Low	58.1	Low	102 Å²	102	120.6 Å²	120.6	55%	0.545	63%	0.634	S	S	.	*			trans	-56.1	148.2	160.9	-70.1	-39.2	0	0	0	109.9	D22 Q26 S27 R28	D22-N24 PolarHBondContact O-N 3.06Å; N24-Q26 PolarHBondContact O-N 3.18Å; N24-Q26 VanDerWaalsContact O-N 3.12Å; N24-S27 CarbonylContact O-C 3.57Å; N24-S27 WeakPolarHBondContact O-CA 3.27Å; N24-S27 VanDerWaalsContact O-CB 3.24Å; N24-S27 WeakPolarHBondContact O-CB 3.41Å; N24-S27 PolarHBondContact O-N 2.85Å; N24-R28 PolarHBondContact O-N 3.39Å
25	E	59.1	Low	57.1	Low	164 Å²	164	121.2 Å²	121.2	77%	0.766	65%	0.646	S	S	*	*	H	α-helix	trans	-60.1	-28.7	177.8	-64.8	-171.8	131.1	0	0	112.4	R28 F29	E25-R28 WeakPolarHBondContact O-CB 3.23Å; E25-R28 PolarHBondContact O-N 2.75Å; E25-F29 PolarHBondContact O-N 3.48Å
26	Q	55.9	Low	57.1	Low	161 Å²	161	118.4 Å²	118.4	75%	0.752	64%	0.639	S	S	*	*	H	α-helix	trans	-68.7	-35	171.9	-61.8	173.8	4	0	0	112.4	N24 F29 R30	N24-Q26 PolarHBondContact O-N 3.18Å; N24-Q26 VanDerWaalsContact O-N 3.12Å; Q26-F29 PolarHBondContact O-N 3.26Å; Q26-R30 PolarHBondContact O-N 3.38Å
27	S	56.4	Low	55.6	Low	54 Å²	54	123.5 Å²	123.5	38%	0.378	64%	0.635	S	S	.	*	H	α-helix	trans	-67.1	-41.1	170.2	-55	0	0	0	0	111	D22 N24 F29 R30 G31	D22-S27 WeakPolarHBondContact O-CB 3.42Å; D22-S27 PolarHBondContact O-OG 3.12Å; N24-S27 CarbonylContact O-C 3.57Å; N24-S27 WeakPolarHBondContact O-CA 3.27Å; N24-S27 VanDerWaalsContact O-CB 3.24Å; N24-S27 WeakPolarHBondContact O-CB 3.41Å; N24-S27 PolarHBondContact O-N 2.85Å; S27-F29 VanDerWaalsContact C-N 3.35Å; S27-F29 PolarHBondContact O-N 2.93Å; S27-R30 PolarHBondContact O-N 3.25Å; S27-G31 PolarHBondContact O-N 2.71Å
28	R	53.9	Low	54.7	Low	143 Å²	143	128 Å²	128	54%	0.54	65%	0.65	S	S	.	*	H	α-helix	trans	-60.8	-42.3	172	-70.9	-178.4	171.3	169.6	-0.4	111.6	E23 N24 E25 G31 L32	E23-R28 IonicContact OE2-CZ 2.77Å; E23-R28 IonicContact OE2-NE 3.71Å; E23-R28 PolarHBondContact OE2-NE 2.9Å; E23-R28 IonicContact OE2-NH2 2.67Å; E23-R28 PolarHBondContact OE2-NH2 2.85Å; N24-R28 PolarHBondContact O-N 3.39Å; E25-R28 WeakPolarHBondContact O-CB 3.23Å; E25-R28 PolarHBondContact O-N 2.75Å; R28-G31 CarbonylContact O-C 3.44Å; R28-G31 PolarHBondContact O-N 3.49Å; R28-L32 WeakPolarHBondContact O-CG 3.41Å; R28-L32 PolarHBondContact O-N 3.07Å
29	F	54.8	Low	53.9	Low	162 Å²	162	126.8 Å²	126.8	71%	0.711	65%	0.65	S	S	*	*	H	α-helix	trans	-65.6	-39.7	176.4	-139.1	-85.7	0	0	0	112.2	E25 Q26 S27 L32 A33	E25-F29 PolarHBondContact O-N 3.48Å; Q26-F29 PolarHBondContact O-N 3.26Å; S27-F29 VanDerWaalsContact C-N 3.35Å; S27-F29 PolarHBondContact O-N 2.93Å; F29-L32 PolarHBondContact O-N 3.03Å; F29-A33 PolarHBondContact O-N 3.48Å
30	R	55.5	Low	53.5	Low	191 Å²	191	123.9 Å²	123.9	72%	0.721	64%	0.642	S	S	*	*	H	α-helix	trans	-65.5	-38.6	171.1	-81.6	-170.3	170.5	-157.9	-1.4	112.9	Q26 S27 L32 A33 L34	Q26-R30 PolarHBondContact O-N 3.38Å; S27-R30 PolarHBondContact O-N 3.25Å; R30-L32 PolarHBondContact O-N 3.22Å; R30-A33 PolarHBondContact O-N 3.42Å; R30-A33 VanDerWaalsContact O-N 3.16Å; R30-L34 WeakPolarHBondContact O-CB 3.26Å; R30-L34 PolarHBondContact O-N 2.93Å
31	G	56.4	Low	53.5	Low	28 Å²	28	122.5 Å²	122.5	29%	0.289	63%	0.631	S	S	.	*	H	α-helix	trans	-73.2	-6.4	175.7	0	0	0	0	0	115	S27 R28 L34	S27-G31 PolarHBondContact O-N 2.71Å; R28-G31 CarbonylContact O-C 3.44Å; R28-G31 PolarHBondContact O-N 3.49Å; G31-L34 CarbonylContact C-O 3.55Å
32	L	54.1	Low	53.4	Low	103 Å²	103	119 Å²	119	54%	0.539	62%	0.616	S	S	.	*	H	α-helix	trans	-92.9	-30.7	166.1	-69.9	169.6	0	0	0	112	R28 F29 R30	R28-L32 WeakPolarHBondContact O-CG 3.41Å; R28-L32 PolarHBondContact O-N 3.07Å; F29-L32 PolarHBondContact O-N 3.03Å; R30-L32 PolarHBondContact O-N 3.22Å
33	A	54.3	Low	53.5	Low	86 Å²	86	117.1 Å²	117.1	71%	0.711	62%	0.618	S	S	*	*	H	α-helix	trans	-81.3	-35	176.2	0	0	0	0	0	113.1	F29 R30	F29-A33 PolarHBondContact O-N 3.48Å; R30-A33 PolarHBondContact O-N 3.42Å; R30-A33 VanDerWaalsContact O-N 3.16Å
34	L	56.6	Low	53.6	Low	122 Å²	122	119.4 Å²	119.4	64%	0.639	62%	0.623	S	S	*	*	S	Bend	trans	-100.5	106.9	170.5	-64.5	168.6	0	0	0	107.3	R30 G31 K36	R30-L34 WeakPolarHBondContact O-CB 3.26Å; R30-L34 PolarHBondContact O-N 2.93Å; G31-L34 CarbonylContact C-O 3.55Å; L34-K36 PolarHBondContact O-N 3.29Å
35	G	46.4	Very low	54	Low	73 Å²	73	120.3 Å²	120.3	75%	0.753	62%	0.624	S	S	*	*			trans	-62.7	11.5	-167.2	0	0	0	0	0	118	R37	G35-R37 PolarHBondContact O-N 3.05Å
36	K	52.5	Low	54.2	Low	193 Å²	193	118 Å²	118	84%	0.839	62%	0.617	S	S	*	*			trans	-76.8	59.4	176.1	-61.1	-165	175.8	-163	0	111.7	L34 K38	L34-K36 PolarHBondContact O-N 3.29Å; K36-K38 PolarHBondContact O-N 3.48Å
37	R	42.4	Very low	54.5	Low	180 Å²	180	116.4 Å²	116.4	68%	0.679	60%	0.604	S	S	*	*			trans	-71.7	108.9	167.6	-60.2	-174.8	77.1	151.4	5	107.6	G35 A39	G35-R37 PolarHBondContact O-N 3.05Å; R37-A39 PolarHBondContact O-N 3.32Å
38	K	52.5	Low	55	Low	179 Å²	179	117.5 Å²	117.5	78%	0.778	61%	0.608	S	S	*	*			trans	-53.3	127.7	156.7	-73.3	-172.3	175.9	-174.3	0	106.6	K36 I40	K36-K38 PolarHBondContact O-N 3.48Å; K38-I40 PolarHBondContact O-N 3.26Å
39	A	52.5	Low	55.8	Low	92 Å²	92	115.1 Å²	115.1	76%	0.76	61%	0.606	S	S	*	*			trans	-66.1	101.8	175.4	0	0	0	0	0	107.8	R37 P41	R37-A39 PolarHBondContact O-N 3.32Å; A39-P41 WeakPolarHBondContact O-CD 3.3Å; A39-P41 VanDerWaalsContact O-N 3.13Å
40	I	53.8	Low	56.5	Low	131 Å²	131	110.8 Å²	110.8	67%	0.672	59%	0.59	S	S	*	*			trans	-60.3	114.8	167.9	-59	172.3	0	0	0	105.1	K38 S42	K38-I40 PolarHBondContact O-N 3.26Å; I40-S42 PolarHBondContact O-N 3.29Å
41	P	53.1	Low	57.3	Low	61 Å²	61	110.2 Å²	110.2	40%	0.396	60%	0.596	S	S	.	*			trans	-60.4	133.5	-178.1	-17.6	29.3	0	0	0	108.2	A39 E45 N46	A39-P41 WeakPolarHBondContact O-CD 3.3Å; A39-P41 VanDerWaalsContact O-N 3.13Å; P41-E45 HydrophobicContact CB-CB 3.98Å; P41-N46 WeakPolarHBondContact CB-OD1 3.45Å; P41-N46 PolarHBondContact O-ND2 2.99Å
42	S	53	Low	58	Low	50 Å²	50	116.2 Å²	116.2	35%	0.35	61%	0.614	S	S	.	*			trans	-57.9	158.1	-179.9	68.3	0	0	0	0	110	I40 Y44 E45 N46	I40-S42 PolarHBondContact O-N 3.29Å; S42-Y44 PolarHBondContact O-N 2.7Å; S42-Y44 PolarHBondContact OG-N 2.67Å; S42-E45 WeakPolarHBondContact CA-OE2 3.43Å; S42-E45 WeakPolarHBondContact CB-OE2 3.48Å; S42-E45 PolarHBondContact N-OE2 3.1Å; S42-E45 PolarHBondContact O-N 2.68Å; S42-E45 VanDerWaalsContact OG-CD 3.31Å; S42-E45 PolarHBondContact OG-N 3.33Å; S42-E45 PolarHBondContact OG-OE2 3.23Å; S42-N46 PolarHBondContact O-N 2.88Å; S42-N46 VanDerWaalsContact O-N 3.16Å
43	A	53.5	Low	58.7	Low	82 Å²	82	113.9 Å²	113.9	68%	0.678	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	14.5	173.1	0	0	0	0	0	113.7	R47	A43-R47 VanDerWaalsContact O-CZ 3.25Å; A43-R47 PolarHBondContact O-NE 3.21Å; A43-R47 PolarHBondContact O-NH2 3.47Å
44	Y	57.6	Low	59.4	Low	151 Å²	151	118.2 Å²	118.2	59%	0.592	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	-42.6	167.1	151.9	-109.4	0	0	0	111.3	S42 R47	S42-Y44 PolarHBondContact O-N 2.7Å; S42-Y44 PolarHBondContact OG-N 2.67Å; Y44-R47 WeakPolarHBondContact O-CB 3.12Å; Y44-R47 WeakPolarHBondContact O-CG 3.14Å
45	E	60.4	Low	59.8	Low	120 Å²	120	115 Å²	115	56%	0.561	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-35.3	179.4	-71.7	142.2	154.5	0	0	112.8	P41 S42 R47	P41-E45 HydrophobicContact CB-CB 3.98Å; S42-E45 WeakPolarHBondContact CA-OE2 3.43Å; S42-E45 WeakPolarHBondContact CB-OE2 3.48Å; S42-E45 PolarHBondContact N-OE2 3.1Å; S42-E45 PolarHBondContact O-N 2.68Å; S42-E45 VanDerWaalsContact OG-CD 3.31Å; S42-E45 PolarHBondContact OG-N 3.33Å; S42-E45 PolarHBondContact OG-OE2 3.23Å; E45-R47 PolarHBondContact O-N 3.41Å
46	N	62.5	Low	60.8	Low	117 Å²	117	115.7 Å²	115.7	63%	0.626	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	19.8	173.2	-77.9	-29.6	0	0	0	114	P41 S42	P41-N46 WeakPolarHBondContact CB-OD1 3.45Å; P41-N46 PolarHBondContact O-ND2 2.99Å; S42-N46 PolarHBondContact O-N 2.88Å; S42-N46 VanDerWaalsContact O-N 3.16Å
47	R	61.2	Low	61	Low	127 Å²	127	115.7 Å²	115.7	48%	0.479	58%	0.578	S	S	.	*	S	Bend	trans	-104.2	113.1	173.5	-57.3	-178.4	-168.6	-165.4	2.1	107.8	A43 Y44 E45 L49 P55	A43-R47 VanDerWaalsContact O-CZ 3.25Å; A43-R47 PolarHBondContact O-NE 3.21Å; A43-R47 PolarHBondContact O-NH2 3.47Å; Y44-R47 WeakPolarHBondContact O-CB 3.12Å; Y44-R47 WeakPolarHBondContact O-CG 3.14Å; E45-R47 PolarHBondContact O-N 3.41Å; R47-L49 WeakPolarHBondContact O-CD2 3.04Å; R47-L49 PolarHBondContact O-N 2.77Å; R47-P55 HydrophobicContact CB-CB 3.96Å; R47-P55 HydrophobicContact CB-CG 4.34Å; R47-P55 HydrophobicContact CG-CB 4.45Å
48	V	68	Low	61.7	Low	77 Å²	77	114 Å²	114	47%	0.467	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-48.1	132.7	168.1	174.6	0	0	0	0	108.5	M56 F58	V48-M56 HydrophobicContact CB-CB 4.32Å; V48-M56 HydrophobicContact CB-SD 4.32Å; V48-M56 HydrophobicContact CG1-CB 4.29Å; V48-M56 HydrophobicContact CG1-SD 3.73Å; V48-M56 WeakPolarHBondContact O-CB 3.5Å; V48-M56 PolarHBondContact O-N 3.16Å; V48-F58 HydrophobicContact CB-CE2 3.96Å; V48-F58 HydrophobicContact CB-CZ 3.9Å; V48-F58 HydrophobicContact CG1-CZ 4.45Å; V48-F58 HydrophobicContact CG2-CE2 3.91Å; V48-F58 HydrophobicContact CG2-CZ 3.74Å
49	L	70.8	Confident	61.4	Low	93 Å²	93	109.2 Å²	109.2	49%	0.487	56%	0.556	S	S	.	*	B	Isolated β-bridge	trans	-99.1	141.9	-179.4	-58	-179.4	0	0	0	109	R47 R54 P55	R47-L49 WeakPolarHBondContact O-CD2 3.04Å; R47-L49 PolarHBondContact O-N 2.77Å; L49-R54 WeakPolarHBondContact CA-O 3.48Å; L49-P55 HydrophobicContact CD2-CG 4.19Å
50	N	68.5	Low	61.1	Low	70 Å²	70	107.7 Å²	107.7	37%	0.374	55%	0.55	S	S	.	.	P	Polyproline II helix	trans	-75	169.4	164.9	65.6	21.8	0	0	0	110.8	K52 G53 R54	N50-K52 PolarHBondContact O-N 2.88Å; N50-K52 PolarHBondContact OD1-N 3.39Å; N50-K52 VanDerWaalsContact OD1-N 3.17Å; N50-G53 PolarHBondContact O-N 2.91Å; N50-R54 PolarHBondContact N-O 3.46Å; N50-R54 PolarHBondContact OD1-N 3.46Å; N50-R54 VanDerWaalsContact OD1-N 3.1Å; N50-R54 PolarHBondContact OD1-O 3.15Å
51	E	73.6	Confident	61.1	Low	180 Å²	180	106.3 Å²	106.3	84%	0.841	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-46.9	-22.1	176.9	-51.8	171.1	149.8	0	0	115
52	K	70.7	Confident	60.9	Low	153 Å²	153	111.2 Å²	111.2	67%	0.665	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	18.7	-176	-67.8	146.8	-176.7	111.5	0	111.8	N50 R54	N50-K52 PolarHBondContact O-N 2.88Å; N50-K52 PolarHBondContact OD1-N 3.39Å; N50-K52 VanDerWaalsContact OD1-N 3.17Å; K52-R54 VanDerWaalsContact C-N 3.27Å; K52-R54 PolarHBondContact O-N 3.13Å
53	G	68.4	Low	61	Low	54 Å²	54	114.9 Å²	114.9	56%	0.557	59%	0.594	S	S	*	*	S	Bend	trans	68.1	18.7	175.1	0	0	0	0	0	114.7	N50	N50-G53 PolarHBondContact O-N 2.91Å
54	R	68.6	Low	60.9	Low	178 Å²	178	113.8 Å²	113.8	67%	0.672	59%	0.59	S	S	*	*	S	Bend	trans	-107.8	143.3	-177.3	-61	-178.8	-176.5	-174.1	-0	111	L49 N50 K52 M56	L49-R54 WeakPolarHBondContact CA-O 3.48Å; N50-R54 PolarHBondContact N-O 3.46Å; N50-R54 PolarHBondContact OD1-N 3.46Å; N50-R54 VanDerWaalsContact OD1-N 3.1Å; N50-R54 PolarHBondContact OD1-O 3.15Å; K52-R54 VanDerWaalsContact C-N 3.27Å; K52-R54 PolarHBondContact O-N 3.13Å; R54-M56 PolarHBondContact O-N 2.93Å
55	P	66.4	Low	60.5	Low	53 Å²	53	107.9 Å²	107.9	34%	0.344	58%	0.575	S	S	.	*	B	Isolated β-bridge	trans	-49.5	113.9	172.4	-32.5	38.5	0	0	0	113.4	R47 L49 R57	R47-P55 HydrophobicContact CB-CB 3.96Å; R47-P55 HydrophobicContact CB-CG 4.34Å; R47-P55 HydrophobicContact CG-CB 4.45Å; L49-P55 HydrophobicContact CD2-CG 4.19Å; P55-R57 PolarHBondContact O-N 3.35Å
56	M	66	Low	60	Low	89 Å²	89	111.4 Å²	111.4	44%	0.438	59%	0.589	S	S	.	*			trans	-61.2	121.4	165.4	-176.6	179	173.9	0	0	107.9	V48 R54 F58	V48-M56 HydrophobicContact CB-CB 4.32Å; V48-M56 HydrophobicContact CB-SD 4.32Å; V48-M56 HydrophobicContact CG1-CB 4.29Å; V48-M56 HydrophobicContact CG1-SD 3.73Å; V48-M56 WeakPolarHBondContact O-CB 3.5Å; V48-M56 PolarHBondContact O-N 3.16Å; R54-M56 PolarHBondContact O-N 2.93Å; M56-F58 HydrophobicContact CE-CD1 4Å; M56-F58 HydrophobicContact CE-CE1 3.67Å; M56-F58 HydrophobicContact CE-CZ 4.33Å; M56-F58 PolarHBondContact O-N 2.97Å; M56-F58 HydrophobicContact SD-CE1 4.03Å; M56-F58 HydrophobicContact SD-CZ 4.08Å
57	R	56.8	Low	59.4	Low	193 Å²	193	108.9 Å²	108.9	73%	0.728	58%	0.58	S	S	*	*			trans	-89.5	101.1	171.2	-72.6	176.9	61.3	-165.3	-4.9	107.4	P55 H59	P55-R57 PolarHBondContact O-N 3.35Å; R57-H59 PolarHBondContact O-CE1 3.47Å; R57-H59 PolarHBondContact O-N 2.85Å; R57-H59 PolarHBondContact O-ND1 3.34Å
58	F	57	Low	59	Low	144 Å²	144	105.6 Å²	105.6	63%	0.632	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-57.4	122.1	165.3	-66.5	-76.4	0	0	0	109	V48 M56	V48-F58 HydrophobicContact CB-CE2 3.96Å; V48-F58 HydrophobicContact CB-CZ 3.9Å; V48-F58 HydrophobicContact CG1-CZ 4.45Å; V48-F58 HydrophobicContact CG2-CE2 3.91Å; V48-F58 HydrophobicContact CG2-CZ 3.74Å; M56-F58 HydrophobicContact CE-CD1 4Å; M56-F58 HydrophobicContact CE-CE1 3.67Å; M56-F58 HydrophobicContact CE-CZ 4.33Å; M56-F58 PolarHBondContact O-N 2.97Å; M56-F58 HydrophobicContact SD-CE1 4.03Å; M56-F58 HydrophobicContact SD-CZ 4.08Å
59	H	47.6	Very low	58.6	Low	78 Å²	78	103 Å²	103	36%	0.361	57%	0.569	S	S	.	*	P	Polyproline II helix	trans	-96.4	150.5	165.8	-63.5	77.6	0	0	0	107.3	R57 G65	R57-H59 PolarHBondContact O-CE1 3.47Å; R57-H59 PolarHBondContact O-N 2.85Å; R57-H59 PolarHBondContact O-ND1 3.34Å; H59-G65 WeakPolarHBondContact CB-O 3.22Å
60	G	45.9	Very low	57.7	Low	61 Å²	61	104.7 Å²	104.7	63%	0.629	57%	0.57	S	S	*	*	S	Bend	trans	-74.1	143	-149.9	0	0	0	0	0	116.9	F62	G60-F62 PolarHBondContact O-N 3.01Å
61	A	52.5	Low	57.1	Low	101 Å²	101	110 Å²	110	84%	0.835	59%	0.59	S	S	*	*	S	Bend	trans	60.8	-25	161.8	0	0	0	0	0	119.5
62	F	49.2	Very low	56.3	Low	165 Å²	165	108.3 Å²	108.3	72%	0.724	59%	0.587	S	S	*	*	S	Bend	trans	-133.7	141.1	-178.6	-55.6	-82.6	0	0	0	110.3	G60 G64 G65	G60-F62 PolarHBondContact O-N 3.01Å; F62-G64 PolarHBondContact O-N 3.25Å; F62-G65 PolarHBondContact O-N 3.43Å; F62-G65 VanDerWaalsContact O-N 3.11Å
63	T	54.9	Low	55.7	Low	127 Å²	127	102.6 Å²	102.6	78%	0.779	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-24.1	174.7	44.4	0	0	0	0	112.8	G65	T63-G65 VanDerWaalsContact C-N 3.29Å; T63-G65 PolarHBondContact O-N 3.49Å
64	G	52.8	Low	55	Low	58 Å²	58	104.3 Å²	104.3	60%	0.598	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	16.1	172	0	0	0	0	0	115.8	F62 F66	F62-G64 PolarHBondContact O-N 3.25Å; G64-F66 PolarHBondContact O-N 2.81Å
65	G	48.8	Very low	54.5	Low	27 Å²	27	99 Å²	99	28%	0.278	57%	0.567	S	S	.	*	S	Bend	trans	-75.7	75.8	-178	0	0	0	0	0	114	H59 F62 T63 S67	H59-G65 WeakPolarHBondContact CB-O 3.22Å; F62-G65 PolarHBondContact O-N 3.43Å; F62-G65 VanDerWaalsContact O-N 3.11Å; T63-G65 VanDerWaalsContact C-N 3.29Å; T63-G65 PolarHBondContact O-N 3.49Å; G65-S67 PolarHBondContact O-N 2.93Å
66	F	48.7	Very low	54.4	Low	194 Å²	194	98.9 Å²	98.9	85%	0.851	57%	0.567	S	S	*	*			trans	3.1	81.2	178.2	-65.8	-72.8	0	0	0	116	G64 A68	G64-F66 PolarHBondContact O-N 2.81Å; F66-A68 PolarHBondContact O-N 3.11Å
67	S	51.6	Low	54.6	Low	64 Å²	64	102 Å²	102	45%	0.448	58%	0.578	S	S	.	*			trans	-64.7	95.9	171.9	171.5	0	0	0	0	109.4	G65 G69	G65-S67 PolarHBondContact O-N 2.93Å; S67-G69 PolarHBondContact O-N 3.41Å
68	A	52.7	Low	55	Low	58 Å²	58	99 Å²	99	48%	0.479	57%	0.572	S	S	.	*			trans	-69.9	91.9	-176.9	0	0	0	0	0	110.1	F66 N72	F66-A68 PolarHBondContact O-N 3.11Å; A68-N72 HydrophobicContact CB-CB 4.44Å
69	G	58.6	Low	55.3	Low	23 Å²	23	93 Å²	93	24%	0.237	55%	0.552	C	S	.	*	H	α-helix	trans	-60.2	-174.3	-174.9	0	0	0	0	0	114.6	S67 F71 N72 S73	S67-G69 PolarHBondContact O-N 3.41Å; G69-F71 CarbonylContact O-C 3.33Å; G69-F71 PolarHBondContact O-N 3.19Å; G69-N72 CarbonylContact O-C 3.52Å; G69-N72 VanDerWaalsContact O-CA 3.32Å; G69-N72 WeakPolarHBondContact O-CA 3.43Å; G69-N72 PolarHBondContact O-N 3.37Å; G69-S73 CarbonylContact C-O 3.58Å; G69-S73 WeakPolarHBondContact CA-O 3.31Å; G69-S73 PolarHBondContact O-N 3.13Å
70	Y	52.9	Low	55.9	Low	128 Å²	128	94.5 Å²	94.5	50%	0.502	56%	0.557	S	S	.	*	H	α-helix	trans	-21	88.1	-170.9	-165	-88.7	0	0	0	116.5	S73 K77	Y70-S73 PolarHBondContact N-O 3.24Å; Y70-S73 PolarHBondContact O-OG 3.3Å; Y70-K77 HydrophobicContact CD1-CB 4.06Å; Y70-K77 HydrophobicContact CD1-CG 4.18Å; Y70-K77 HydrophobicContact CD2-CB 4.31Å; Y70-K77 HydrophobicContact CE1-CB 4.09Å; Y70-K77 HydrophobicContact CE1-CG 3.77Å; Y70-K77 HydrophobicContact CE2-CB 4.31Å; Y70-K77 HydrophobicContact CG-CB 4.19Å
71	F	55.2	Low	56.9	Low	181 Å²	181	98.2 Å²	98.2	79%	0.794	56%	0.556	S	S	*	*	H	α-helix	trans	58.8	52.5	-173.9	-62	-93.8	0	0	0	115.1	G69	G69-F71 CarbonylContact O-C 3.33Å; G69-F71 PolarHBondContact O-N 3.19Å
72	N	57.6	Low	57.5	Low	145 Å²	145	97.8 Å²	97.8	78%	0.775	55%	0.545	S	S	*	.	H	α-helix	trans	63.7	32	-176.5	-57.7	0.8	0	0	0	114.8	A68 G69	A68-N72 HydrophobicContact CB-CB 4.44Å; G69-N72 CarbonylContact O-C 3.52Å; G69-N72 VanDerWaalsContact O-CA 3.32Å; G69-N72 WeakPolarHBondContact O-CA 3.43Å; G69-N72 PolarHBondContact O-N 3.37Å
73	S	58.4	Low	58.4	Low	34 Å²	34	96.7 Å²	96.7	24%	0.238	54%	0.539	C	S	.	.			trans	-120.1	128.1	170.8	69.8	0	0	0	0	112.4	G69 Y70 S76	G69-S73 CarbonylContact C-O 3.58Å; G69-S73 WeakPolarHBondContact CA-O 3.31Å; G69-S73 PolarHBondContact O-N 3.13Å; Y70-S73 PolarHBondContact N-O 3.24Å; Y70-S73 PolarHBondContact O-OG 3.3Å; S73-S76 PolarHBondContact OG-O 2.84Å
74	V	52.4	Low	58.9	Low	89 Å²	89	94.5 Å²	94.5	54%	0.539	53%	0.53	S	S	.	.	S	Bend	trans	-54.3	146.3	175.4	-74.8	0	0	0	0	113.2	S76 G79 F80	V74-S76 VanDerWaalsContact C-N 3.32Å; V74-S76 PolarHBondContact O-N 2.95Å; V74-G79 CarbonylContact O-C 3.57Å; V74-G79 VanDerWaalsContact O-CA 3.24Å; V74-G79 WeakPolarHBondContact O-CA 3.47Å; V74-F80 HydrophobicContact CB-CB 4.33Å; V74-F80 HydrophobicContact CG2-CB 3.49Å; V74-F80 VanDerWaalsContact CG2-CB 3.49Å; V74-F80 PolarHBondContact O-N 2.95Å; V74-F80 VanDerWaalsContact O-N 3.1Å
75	G	58.6	Low	59.4	Low	67 Å²	67	100 Å²	100	69%	0.691	54%	0.537	S	S	*	.	S	Bend	trans	71.8	-61.5	170.8	0	0	0	0	0	116.8
76	S	64	Low	60.1	Low	50 Å²	50	105.9 Å²	105.9	35%	0.35	56%	0.557	S	S	.	*	S	Bend	trans	-150.7	175.5	-165.1	84.5	0	0	0	0	114.7	S73 V74 E78 G79	S73-S76 PolarHBondContact OG-O 2.84Å; V74-S76 VanDerWaalsContact C-N 3.32Å; V74-S76 PolarHBondContact O-N 2.95Å; S76-E78 PolarHBondContact O-N 2.74Å; S76-E78 VanDerWaalsContact O-N 3.15Å; S76-E78 PolarHBondContact OG-N 3.17Å; S76-G79 PolarHBondContact O-N 2.7Å; S76-G79 PolarHBondContact OG-N 3.15Å; S76-G79 PolarHBondContact OG-O 3.15Å
77	K	70.5	Confident	60.5	Low	156 Å²	156	101.9 Å²	101.9	68%	0.678	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.6	-24.6	167.4	172.8	-178.1	171.4	-158.7	0	112.8	Y70	Y70-K77 HydrophobicContact CD1-CB 4.06Å; Y70-K77 HydrophobicContact CD1-CG 4.18Å; Y70-K77 HydrophobicContact CD2-CB 4.31Å; Y70-K77 HydrophobicContact CE1-CB 4.09Å; Y70-K77 HydrophobicContact CE1-CG 3.77Å; Y70-K77 HydrophobicContact CE2-CB 4.31Å; Y70-K77 HydrophobicContact CG-CB 4.19Å
78	E	64.4	Low	60.7	Low	129 Å²	129	101 Å²	101	60%	0.603	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	9.3	-179.4	-46.6	-158.3	145	0	0	112.9	S76 K81	S76-E78 PolarHBondContact O-N 2.74Å; S76-E78 VanDerWaalsContact O-N 3.15Å; S76-E78 PolarHBondContact OG-N 3.17Å; E78-K81 HydrophobicContact CB-CD 4.32Å; E78-K81 IonicContact OE2-NZ 2.7Å; E78-K81 PolarHBondContact OE2-NZ 3Å
79	G	63.5	Low	61.1	Low	19 Å²	19	110.1 Å²	110.1	20%	0.196	57%	0.569	C	S	.	*			trans	74.9	-172.1	-172.2	0	0	0	0	0	113.7	V74 S76	V74-G79 CarbonylContact O-C 3.57Å; V74-G79 VanDerWaalsContact O-CA 3.24Å; V74-G79 WeakPolarHBondContact O-CA 3.47Å; S76-G79 PolarHBondContact O-N 2.7Å; S76-G79 PolarHBondContact OG-N 3.15Å; S76-G79 PolarHBondContact OG-O 3.15Å
80	F	61.5	Low	61.3	Low	109 Å²	109	119 Å²	119	48%	0.478	60%	0.601	S	S	.	*			trans	-76.8	117.3	162.1	172.3	-100.4	0	0	0	108.2	V74 P82	V74-F80 HydrophobicContact CB-CB 4.33Å; V74-F80 HydrophobicContact CG2-CB 3.49Å; V74-F80 VanDerWaalsContact CG2-CB 3.49Å; V74-F80 PolarHBondContact O-N 2.95Å; V74-F80 VanDerWaalsContact O-N 3.1Å; F80-P82 HydrophobicContact CD1-CG 4.44Å; F80-P82 HydrophobicContact CE1-CB 3.77Å; F80-P82 HydrophobicContact CE1-CG 4.02Å; F80-P82 HydrophobicContact CZ-CB 4.15Å; F80-P82 WeakPolarHBondContact O-CD 3.49Å
81	K	66.2	Low	61.5	Low	138 Å²	138	114.6 Å²	114.6	60%	0.6	59%	0.587	S	S	*	*			trans	-109.2	97.2	175.6	-76.2	-179.5	172.8	176.2	0	108.8	E78 K83	E78-K81 HydrophobicContact CB-CD 4.32Å; E78-K81 IonicContact OE2-NZ 2.7Å; E78-K81 PolarHBondContact OE2-NZ 3Å; K81-K83 PolarHBondContact O-N 2.89Å
82	P	66.4	Low	61.7	Low	92 Å²	92	115.3 Å²	115.3	60%	0.597	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-61.7	137.5	176.3	25.2	-32.1	0	0	0	110	F80 S84	F80-P82 HydrophobicContact CD1-CG 4.44Å; F80-P82 HydrophobicContact CE1-CB 3.77Å; F80-P82 HydrophobicContact CE1-CG 4.02Å; F80-P82 HydrophobicContact CZ-CB 4.15Å; F80-P82 WeakPolarHBondContact O-CD 3.49Å; P82-S84 PolarHBondContact O-N 3.11Å
83	K	66	Low	61.7	Low	142 Å²	142	116 Å²	116	62%	0.617	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-52.7	127.3	175.2	-164.8	170.9	177.3	177	0	109	K81 F85 D106	K81-K83 PolarHBondContact O-N 2.89Å; K83-F85 PolarHBondContact O-N 2.99Å; K83-F85 VanDerWaalsContact O-N 3.1Å; K83-D106 IonicContact NZ-OD1 2.66Å; K83-D106 PolarHBondContact NZ-OD1 2.74Å
84	S	65.9	Low	61.6	Low	82 Å²	82	123 Å²	123	57%	0.573	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-60.7	116.2	-166.6	55.3	0	0	0	0	112	P82 H86	P82-S84 PolarHBondContact O-N 3.11Å; S84-H86 PolarHBondContact O-N 3.48Å; S84-H86 PolarHBondContact O-ND1 2.88Å; S84-H86 PolarHBondContact OG-CE1 2.97Å; S84-H86 VanDerWaalsContact OG-CE1 3.27Å
85	F	64.7	Low	61.7	Low	173 Å²	173	122.5 Å²	122.5	76%	0.759	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-62	124.7	-179.1	71.5	-87.1	0	0	0	110.9	K83 S87	K83-F85 PolarHBondContact O-N 2.99Å; K83-F85 VanDerWaalsContact O-N 3.1Å; F85-S87 PolarHBondContact O-N 3.25Å
86	H	61.6	Low	61.8	Low	151 Å²	151	126 Å²	126	70%	0.699	60%	0.6	S	S	*	*			trans	-101.4	78.1	176.5	-68.4	-24.1	0	0	0	109.4	S84 S88	S84-H86 PolarHBondContact O-N 3.48Å; S84-H86 PolarHBondContact O-ND1 2.88Å; S84-H86 PolarHBondContact OG-CE1 2.97Å; S84-H86 VanDerWaalsContact OG-CE1 3.27Å; H86-S88 PolarHBondContact O-N 2.87Å; H86-S88 PolarHBondContact O-OG 3.12Å; H86-S88 VanDerWaalsContact O-OG 3.09Å
87	S	58.5	Low	61.5	Low	109 Å²	109	130.3 Å²	130.3	76%	0.762	62%	0.619	S	S	*	*			trans	-65.7	95	174.8	-177.6	0	0	0	0	110.1	F85	F85-S87 PolarHBondContact O-N 3.25Å
88	S	56.3	Low	60.9	Low	46 Å²	46	129.4 Å²	129.4	32%	0.322	62%	0.617	S	S	.	*			trans	-139.3	77.9	-170.7	56.4	0	0	0	0	113.1	H86 K90 N91	H86-S88 PolarHBondContact O-N 2.87Å; H86-S88 PolarHBondContact O-OG 3.12Å; H86-S88 VanDerWaalsContact O-OG 3.09Å; S88-K90 PolarHBondContact O-N 3.42Å; S88-N91 PolarHBondContact O-N 2.87Å; S88-N91 WeakPolarHBondContact OG-CB 3.43Å
89	R	60.8	Low	60.5	Low	249 Å²	249	133.5 Å²	133.5	94%	0.94	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.4	-12.1	166.1	-77.6	178.9	167.1	168.4	-5.1	114.6
90	K	61.4	Low	60.3	Low	210 Å²	210	139.8 Å²	139.8	91%	0.913	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.6	-5.2	175.2	-71.9	-170.7	173	-173.2	0	115.2	S88	S88-K90 PolarHBondContact O-N 3.42Å
91	N	57.5	Low	60.5	Low	36 Å²	36	137.9 Å²	137.9	19%	0.193	66%	0.66	C	S	.	*	T	Hydrogen-bonded Turn	trans	-102.3	-6.7	-171.5	-153.2	68.4	0	0	0	115.6	S88 Q93 R94 D95	S88-N91 PolarHBondContact O-N 2.87Å; S88-N91 WeakPolarHBondContact OG-CB 3.43Å; N91-Q93 PolarHBondContact O-N 3.37Å; N91-R94 PolarHBondContact O-N 2.9Å; N91-R94 VanDerWaalsContact OD1-CZ 3.22Å; N91-R94 PolarHBondContact OD1-NE 3.02Å; N91-R94 PolarHBondContact OD1-NH2 2.87Å; N91-D95 VanDerWaalsContact C-OD2 3.27Å; N91-D95 PolarHBondContact ND2-OD1 2.92Å; N91-D95 PolarHBondContact O-N 2.96Å
92	R	59	Low	60.7	Low	196 Å²	196	138.2 Å²	138.2	74%	0.74	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-46.5	-21.8	-179.8	-80.6	-178.3	163.3	-174	-7.2	115.9	D95	R92-D95 VanDerWaalsContact CA-OD2 3.23Å; R92-D95 WeakPolarHBondContact CA-OD2 3.5Å; R92-D95 PolarHBondContact N-OD2 3.43Å
93	Q	58	Low	61.1	Low	159 Å²	159	138.7 Å²	138.7	74%	0.743	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	-31.9	174.8	-154.8	78.3	31.7	0	0	113.4	N91	N91-Q93 PolarHBondContact O-N 3.37Å
94	R	56.9	Low	61.5	Low	181 Å²	181	136.7 Å²	136.7	68%	0.683	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-25.3	177	-69	-167.8	-73.7	179.7	-3.8	112.8	N91 L96 D97	N91-R94 PolarHBondContact O-N 2.9Å; N91-R94 VanDerWaalsContact OD1-CZ 3.22Å; N91-R94 PolarHBondContact OD1-NE 3.02Å; N91-R94 PolarHBondContact OD1-NH2 2.87Å; R94-L96 PolarHBondContact O-N 3.08Å; R94-L96 VanDerWaalsContact O-N 3.12Å; R94-D97 PolarHBondContact O-N 3.27Å
95	D	55	Low	62.2	Low	79 Å²	79	137.1 Å²	137.1	42%	0.422	65%	0.652	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.1	-2	-179.4	-45.4	-28.3	0	0	0	112.8	N91 R92	N91-D95 VanDerWaalsContact C-OD2 3.27Å; N91-D95 PolarHBondContact ND2-OD1 2.92Å; N91-D95 PolarHBondContact O-N 2.96Å; R92-D95 VanDerWaalsContact CA-OD2 3.23Å; R92-D95 WeakPolarHBondContact CA-OD2 3.5Å; R92-D95 PolarHBondContact N-OD2 3.43Å
96	L	59.5	Low	62.8	Low	141 Å²	141	131.9 Å²	131.9	74%	0.738	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-31	178.3	-73.3	168.9	0	0	0	114	R94	R94-L96 PolarHBondContact O-N 3.08Å; R94-L96 VanDerWaalsContact O-N 3.12Å
97	D	58.8	Low	63.2	Low	139 Å²	139	131.2 Å²	131.2	74%	0.743	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	-28.2	-170.6	-59.8	-40.5	0	0	0	112.9	R94	R94-D97 PolarHBondContact O-N 3.27Å
98	E	56.6	Low	64	Low	138 Å²	138	128.3 Å²	128.3	65%	0.645	60%	0.602	S	S	*	*	S	Bend	trans	-130.9	101.8	-178.1	-68.6	-165.8	143.3	0	0	113.3	F100	E98-F100 WeakPolarHBondContact O-CD2 3.35Å; E98-F100 PolarHBondContact O-N 3.03Å
99	K	56.3	Low	65	Low	214 Å²	214	128.9 Å²	128.9	93%	0.93	60%	0.602	S	S	*	*			trans	36.3	16.5	137.4	-64.8	-175.9	178.4	176.8	0	121.9	A101	K99-A101 PolarHBondContact O-N 2.86Å
100	F	58.7	Low	65.6	Low	152 Å²	152	124.2 Å²	124.2	67%	0.667	60%	0.595	S	S	*	*			trans	-97.5	30.8	179	-83.1	-80.1	0	0	0	113.6	E98 Q102	E98-F100 WeakPolarHBondContact O-CD2 3.35Å; E98-F100 PolarHBondContact O-N 3.03Å; F100-Q102 PolarHBondContact O-N 3.2Å
101	A	66.1	Low	66.2	Low	69 Å²	69	120 Å²	120	57%	0.57	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-62.7	126.4	161.9	0	0	0	0	0	108.8	K99 H103	K99-A101 PolarHBondContact O-N 2.86Å; A101-H103 PolarHBondContact O-CD2 2.96Å; A101-H103 VanDerWaalsContact O-CD2 3.24Å; A101-H103 PolarHBondContact O-N 3.27Å
102	Q	71	Confident	67.4	Low	144 Å²	144	119.9 Å²	119.9	67%	0.673	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-72.2	116.3	174.5	-67.3	177.2	-8.7	0	0	108.4	F100 F107	F100-Q102 PolarHBondContact O-N 3.2Å; Q102-F107 HydrophobicContact CB-CE2 4.18Å; Q102-F107 HydrophobicContact CB-CZ 4.46Å
103	H	74	Confident	68.1	Low	102 Å²	102	112.1 Å²	112.1	47%	0.472	55%	0.55	S	S	.	.	P	Polyproline II helix	trans	-83.4	152.8	175.1	-73.3	-95.2	0	0	0	109.6	A101 E105 D106 F107	A101-H103 PolarHBondContact O-CD2 2.96Å; A101-H103 VanDerWaalsContact O-CD2 3.24Å; A101-H103 PolarHBondContact O-N 3.27Å; H103-E105 HydrophobicContact CB-CB 4.22Å; H103-E105 PolarHBondContact O-N 2.67Å; H103-E105 VanDerWaalsContact O-N 3.17Å; H103-D106 PolarHBondContact N-OD2 3.41Å; H103-D106 WeakPolarHBondContact O-CB 3.47Å; H103-D106 PolarHBondContact O-N 3.17Å; H103-F107 WeakPolarHBondContact O-CD2 3.42Å
104	P	75.2	Confident	68.8	Low	100 Å²	100	106 Å²	106	65%	0.649	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-52.8	-34.6	168	-26.3	35.8	0	0	0	111.7	D106 F107 M108	P104-D106 PolarHBondContact O-N 3.19Å; P104-F107 PolarHBondContact O-N 2.96Å; P104-M108 WeakPolarHBondContact O-CG 3.38Å
105	E	80.3	Confident	69.4	Low	92 Å²	92	105.5 Å²	105.5	43%	0.43	54%	0.535	S	S	.	.	G	3₁₀ helix	trans	-58.8	-22.7	173.5	-62.3	-178.9	-116.9	0	0	114.7	H103 F107 F113 R121	H103-E105 HydrophobicContact CB-CB 4.22Å; H103-E105 PolarHBondContact O-N 2.67Å; H103-E105 VanDerWaalsContact O-N 3.17Å; E105-F107 PolarHBondContact O-N 3.07Å; E105-F113 HydrophobicContact CB-CE1 4.32Å; E105-F113 HydrophobicContact CB-CZ 3.84Å; E105-F113 HydrophobicContact CG-CE1 3.98Å; E105-F113 HydrophobicContact CG-CZ 4.03Å; E105-R121 IonicContact OE2-CZ 3.34Å; E105-R121 IonicContact OE2-NE 2.83Å; E105-R121 PolarHBondContact OE2-NE 3.32Å; E105-R121 IonicContact OE2-NH2 2.69Å; E105-R121 PolarHBondContact OE2-NH2 2.97Å
106	D	76.4	Confident	69.9	Low	62 Å²	62	109.9 Å²	109.9	33%	0.332	55%	0.55	S	S	.	*	G	3₁₀ helix	trans	-72.6	-11.6	174.2	-76.8	-75.7	0	0	0	112.8	K83 H103 P104	K83-D106 IonicContact NZ-OD1 2.66Å; K83-D106 PolarHBondContact NZ-OD1 2.74Å; H103-D106 PolarHBondContact N-OD2 3.41Å; H103-D106 WeakPolarHBondContact O-CB 3.47Å; H103-D106 PolarHBondContact O-N 3.17Å; P104-D106 PolarHBondContact O-N 3.19Å
107	F	70.9	Confident	70.4	Confident	137 Å²	137	104.2 Å²	104.2	60%	0.601	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-110.3	-4.5	-178.3	-58.3	-87.9	0	0	0	113.6	Q102 H103 P104 E105	Q102-F107 HydrophobicContact CB-CE2 4.18Å; Q102-F107 HydrophobicContact CB-CZ 4.46Å; H103-F107 WeakPolarHBondContact O-CD2 3.42Å; P104-F107 PolarHBondContact O-N 2.96Å; E105-F107 PolarHBondContact O-N 3.07Å
108	M	76.3	Confident	71.2	Confident	48 Å²	48	104.4 Å²	104.4	24%	0.236	53%	0.526	C	S	.	.	S	Bend	trans	-101.6	152.1	-179.6	-60.1	-178.9	72.4	0	0	109.3	P104 D112 F113 A119	P104-M108 WeakPolarHBondContact O-CG 3.38Å; M108-D112 WeakPolarHBondContact CA-OD2 3.28Å; M108-D112 HydrophobicContact CB-CB 4.01Å; M108-D112 WeakPolarHBondContact CB-OD2 3.3Å; M108-D112 HydrophobicContact CE-CB 3.72Å; M108-F113 HydrophobicContact CB-CE1 4.43Å; M108-F113 HydrophobicContact CB-CE2 4.28Å; M108-F113 HydrophobicContact CB-CZ 3.9Å; M108-A119 HydrophobicContact CE-CB 3.43Å; M108-A119 VanDerWaalsContact CE-CB 3.43Å; M108-A119 HydrophobicContact SD-CB 4.27Å
109	D	76.7	Confident	71.9	Confident	59 Å²	59	99.7 Å²	99.7	32%	0.316	51%	0.51	S	S	.	.			trans	-100.9	179.3	-179.7	75.3	17.5	0	0	0	113.4	E111 D112 F113	D109-E111 PolarHBondContact O-N 3.13Å; D109-E111 WeakPolarHBondContact OD1-CA 3.34Å; D109-E111 VanDerWaalsContact OD1-CB 3.26Å; D109-E111 WeakPolarHBondContact OD1-CB 3.5Å; D109-E111 PolarHBondContact OD1-N 2.96Å; D109-D112 PolarHBondContact N-OD2 3.07Å; D109-D112 WeakPolarHBondContact O-CB 3.14Å; D109-D112 PolarHBondContact O-N 3.18Å; D109-D112 PolarHBondContact OD1-N 2.77Å; D109-D112 VanDerWaalsContact OD1-N 3.13Å; D109-F113 WeakPolarHBondContact O-CD2 3.26Å; D109-F113 WeakPolarHBondContact O-CE2 3.26Å
110	D	73.2	Confident	72.4	Confident	150 Å²	150	92.4 Å²	92.4	80%	0.802	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-14.6	-178.8	-65.9	-48.9	0	0	0	113.2
111	E	74.6	Confident	72.9	Confident	121 Å²	121	92.8 Å²	92.8	57%	0.565	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-40	175.5	-163.6	167.9	161.1	0	0	110.3	D109 F113 G114	D109-E111 PolarHBondContact O-N 3.13Å; D109-E111 WeakPolarHBondContact OD1-CA 3.34Å; D109-E111 VanDerWaalsContact OD1-CB 3.26Å; D109-E111 WeakPolarHBondContact OD1-CB 3.5Å; D109-E111 PolarHBondContact OD1-N 2.96Å; E111-F113 PolarHBondContact O-N 2.95Å; E111-G114 PolarHBondContact O-N 3.14Å
112	D	81.2	Confident	73	Confident	34 Å²	34	98 Å²	98	18%	0.182	49%	0.487	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-29.9	173.8	-87.8	-34	0	0	0	114.4	M108 D109 G117 I118 A119	M108-D112 WeakPolarHBondContact CA-OD2 3.28Å; M108-D112 HydrophobicContact CB-CB 4.01Å; M108-D112 WeakPolarHBondContact CB-OD2 3.3Å; M108-D112 HydrophobicContact CE-CB 3.72Å; D109-D112 PolarHBondContact N-OD2 3.07Å; D109-D112 WeakPolarHBondContact O-CB 3.14Å; D109-D112 PolarHBondContact O-N 3.18Å; D109-D112 PolarHBondContact OD1-N 2.77Å; D109-D112 VanDerWaalsContact OD1-N 3.13Å; D112-G117 CarbonylContact O-C 3.47Å; D112-G117 WeakPolarHBondContact O-CA 3.35Å; D112-I118 PolarHBondContact O-N 3.33Å; D112-I118 VanDerWaalsContact O-N 3.11Å; D112-I118 WeakPolarHBondContact OD1-CB 3.33Å; D112-I118 WeakPolarHBondContact OD1-CD1 3.43Å; D112-I118 WeakPolarHBondContact OD1-CG1 3.36Å; D112-A119 CarbonylContact O-C 3.58Å; D112-A119 PolarHBondContact O-N 3.37Å
113	F	75.2	Confident	72.9	Confident	33 Å²	33	98.9 Å²	98.9	15%	0.145	50%	0.495	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-4	-178	-65.2	-53.7	0	0	0	114.9	E105 M108 D109 E111 R121	E105-F113 HydrophobicContact CB-CE1 4.32Å; E105-F113 HydrophobicContact CB-CZ 3.84Å; E105-F113 HydrophobicContact CG-CE1 3.98Å; E105-F113 HydrophobicContact CG-CZ 4.03Å; M108-F113 HydrophobicContact CB-CE1 4.43Å; M108-F113 HydrophobicContact CB-CE2 4.28Å; M108-F113 HydrophobicContact CB-CZ 3.9Å; D109-F113 WeakPolarHBondContact O-CD2 3.26Å; D109-F113 WeakPolarHBondContact O-CE2 3.26Å; E111-F113 PolarHBondContact O-N 2.95Å; F113-R121 HydrophobicContact CB-CG 3.97Å; F113-R121 HydrophobicContact CD1-CG 3.4Å; F113-R121 VanDerWaalsContact CD1-CG 3.4Å; F113-R121 HydrophobicContact CE1-CG 4.15Å; F113-R121 HydrophobicContact CG-CG 3.91Å
114	G	71.7	Confident	72.4	Confident	30 Å²	30	102.4 Å²	102.4	31%	0.309	50%	0.504	S	S	.	.	S	Bend	trans	-65.9	171.2	-178.8	0	0	0	0	0	114.1	E111 F116 G117	E111-G114 PolarHBondContact O-N 3.14Å; G114-F116 PolarHBondContact O-N 3.37Å; G114-F116 VanDerWaalsContact O-N 3.14Å; G114-G117 PolarHBondContact O-N 2.86Å
115	E	70.4	Confident	72.1	Confident	172 Å²	172	100.7 Å²	100.7	80%	0.804	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-26	177.2	-176	166.8	-157.8	0	0	113.1
116	F	65.1	Low	71.5	Confident	170 Å²	170	100.6 Å²	100.6	75%	0.746	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114	13.3	176.1	-51	-76.5	0	0	0	113.1	G114	G114-F116 PolarHBondContact O-N 3.37Å; G114-F116 VanDerWaalsContact O-N 3.14Å
117	G	70.1	Confident	71	Confident	23 Å²	23	105 Å²	105	24%	0.237	52%	0.517	C	S	.	.	S	Bend	trans	-77.5	173.3	-179.2	0	0	0	0	0	113.3	D112 G114 A119	D112-G117 CarbonylContact O-C 3.47Å; D112-G117 WeakPolarHBondContact O-CA 3.35Å; G114-G117 PolarHBondContact O-N 2.86Å; G117-A119 VanDerWaalsContact C-N 3.34Å; G117-A119 PolarHBondContact O-N 3.4Å
118	I	75.2	Confident	70.8	Confident	142 Å²	142	104.3 Å²	104.3	73%	0.728	52%	0.515	S	S	*	.	S	Bend	trans	-71.5	-28.6	-175.5	-55.9	-175.7	0	0	0	111.9	D112	D112-I118 PolarHBondContact O-N 3.33Å; D112-I118 VanDerWaalsContact O-N 3.11Å; D112-I118 WeakPolarHBondContact OD1-CB 3.33Å; D112-I118 WeakPolarHBondContact OD1-CD1 3.43Å; D112-I118 WeakPolarHBondContact OD1-CG1 3.36Å
119	A	70.4	Confident	70.2	Confident	39 Å²	39	103.4 Å²	103.4	32%	0.322	51%	0.51	S	S	.	.	S	Bend	trans	-138.1	79.9	174.8	0	0	0	0	0	112.2	M108 D112 G117 R121	M108-A119 HydrophobicContact CE-CB 3.43Å; M108-A119 VanDerWaalsContact CE-CB 3.43Å; M108-A119 HydrophobicContact SD-CB 4.27Å; D112-A119 CarbonylContact O-C 3.58Å; D112-A119 PolarHBondContact O-N 3.37Å; G117-A119 VanDerWaalsContact C-N 3.34Å; G117-A119 PolarHBondContact O-N 3.4Å; A119-R121 PolarHBondContact O-N 2.85Å; A119-R121 VanDerWaalsContact O-N 3.16Å
120	P	67.7	Low	69.8	Low	62 Å²	62	102.6 Å²	102.6	40%	0.403	51%	0.506	S	S	.	.			trans	-59.7	121.4	173.5	25.1	-34.3	0	0	0	110.3	R122	P120-R122 PolarHBondContact O-N 3.17Å
121	R	68.5	Low	69.5	Low	160 Å²	160	97.5 Å²	97.5	60%	0.604	48%	0.478	S	S	*	.	S	Bend	trans	-57.8	-13.6	-165.5	-55.7	-175.1	97.9	135.6	7	116.1	E105 F113 A119	E105-R121 IonicContact OE2-CZ 3.34Å; E105-R121 IonicContact OE2-NE 2.83Å; E105-R121 PolarHBondContact OE2-NE 3.32Å; E105-R121 IonicContact OE2-NH2 2.69Å; E105-R121 PolarHBondContact OE2-NH2 2.97Å; F113-R121 HydrophobicContact CB-CG 3.97Å; F113-R121 HydrophobicContact CD1-CG 3.4Å; F113-R121 VanDerWaalsContact CD1-CG 3.4Å; F113-R121 HydrophobicContact CE1-CG 4.15Å; F113-R121 HydrophobicContact CG-CG 3.91Å; A119-R121 PolarHBondContact O-N 2.85Å; A119-R121 VanDerWaalsContact O-N 3.16Å
122	R	69	Low	69.1	Low	178 Å²	178	94.7 Å²	94.7	67%	0.672	47%	0.47	S	S	*	.	S	Bend	trans	-159.8	113.5	176.2	-179.5	172	56.8	-175.7	-2.9	110.6	P120 R124	P120-R122 PolarHBondContact O-N 3.17Å; R122-R124 HydrophobicContact CG-CG 4.11Å; R122-R124 PolarHBondContact O-N 3.07Å
123	I	67.9	Low	68.3	Low	163 Å²	163	97.9 Å²	97.9	84%	0.836	48%	0.483	S	S	*	.			trans	-58.9	118.9	165.4	-56.5	173.9	0	0	0	107.8
124	R	65.5	Low	67.9	Low	176 Å²	176	98.3 Å²	98.3	66%	0.664	49%	0.488	S	S	*	.			trans	-115.6	147.2	171.4	-75	-170.4	-79.5	176.2	-0.7	109.5	R122	R122-R124 HydrophobicContact CG-CG 4.11Å; R122-R124 PolarHBondContact O-N 3.07Å
125	P	67.1	Low	67.5	Low	64 Å²	64	104.4 Å²	104.4	42%	0.416	50%	0.502	S	S	.	.			trans	-59.2	149.5	163.5	28.3	-34	0	0	0	109.4	F129 D130	P125-F129 HydrophobicContact CB-CB 4.04Å; P125-D130 HydrophobicContact CG-CB 4.09Å
126	T	68.6	Low	67.3	Low	89 Å²	89	100.2 Å²	100.2	55%	0.546	49%	0.485	S	S	.	.			trans	-68	156.5	167.4	64.2	0	0	0	0	109.6	E128 F129 D130	T126-E128 PolarHBondContact O-N 2.82Å; T126-F129 PolarHBondContact O-N 3.14Å; T126-D130 PolarHBondContact O-N 3.35Å
127	H	66.6	Low	67.4	Low	156 Å²	156	96.2 Å²	96.2	72%	0.722	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-43.9	-36.7	-179.3	164.7	-105.8	0	0	0	114	F129 D130	H127-F129 PolarHBondContact O-N 3.14Å; H127-D130 PolarHBondContact O-N 2.97Å
128	E	65.8	Low	67.1	Low	121 Å²	121	96.1 Å²	96.1	57%	0.565	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-64.9	-16	179.2	-59.4	177.7	-171	0	0	115.6	T126 R173	T126-E128 PolarHBondContact O-N 2.82Å; E128-R173 IonicContact OE2-CZ 2.84Å; E128-R173 IonicContact OE2-NH1 3.36Å; E128-R173 PolarHBondContact OE2-NH1 3.1Å; E128-R173 IonicContact OE2-NH2 3.46Å; E128-R173 PolarHBondContact OE2-NH2 3.47Å
129	F	63.9	Low	66.7	Low	30 Å²	30	93.4 Å²	93.4	13%	0.132	45%	0.453	C	S	.	.	G	3₁₀ helix	trans	-114.4	-3.6	178.6	-64.2	-93.5	0	0	0	112.9	P125 T126 H127 D131 L166 L170	P125-F129 HydrophobicContact CB-CB 4.04Å; T126-F129 PolarHBondContact O-N 3.14Å; H127-F129 PolarHBondContact O-N 3.14Å; F129-D131 PolarHBondContact O-N 3.33Å; F129-D131 VanDerWaalsContact O-N 3.17Å; F129-L166 HydrophobicContact CB-CD1 4.34Å; F129-L170 HydrophobicContact CE1-CB 4.48Å
130	D	67.7	Low	66.6	Low	41 Å²	41	98.4 Å²	98.4	22%	0.219	47%	0.473	C	S	.	.			trans	-91.8	77.1	-169.7	-161.1	-4.6	0	0	0	113.4	P125 T126 H127 T132 H133	P125-D130 HydrophobicContact CG-CB 4.09Å; T126-D130 PolarHBondContact O-N 3.35Å; H127-D130 PolarHBondContact O-N 2.97Å; D130-T132 PolarHBondContact O-N 2.98Å; D130-T132 VanDerWaalsContact OD1-CB 3.3Å; D130-T132 WeakPolarHBondContact OD1-CB 3.06Å; D130-T132 WeakPolarHBondContact OD1-CG2 3.29Å; D130-T132 PolarHBondContact OD1-N 3.24Å; D130-T132 PolarHBondContact OD1-OG1 3.08Å; D130-T132 PolarHBondContact OD2-OG1 2.91Å; D130-H133 PolarHBondContact O-ND1 3.29Å; D130-H133 VanDerWaalsContact O-ND1 3.07Å; D130-H133 IonicContact OD2-CE1 3.15Å
131	D	66.8	Low	66.4	Low	43 Å²	43	99.4 Å²	99.4	23%	0.23	49%	0.486	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	5.4	174.3	-81.9	16.2	0	0	0	114.4	F129 R135 K156 R169	F129-D131 PolarHBondContact O-N 3.33Å; F129-D131 VanDerWaalsContact O-N 3.17Å; D131-R135 PolarHBondContact O-N 3.1Å; D131-K156 PolarHBondContact O-NZ 2.99Å; D131-R169 IonicContact OD1-CZ 3.65Å; D131-R169 IonicContact OD1-NH1 2.75Å; D131-R169 PolarHBondContact OD1-NH1 3.25Å; D131-R169 IonicContact OD1-NH2 3.15Å; D131-R169 PolarHBondContact OD1-NH2 3.17Å; D131-R169 IonicContact OD2-CZ 3.39Å; D131-R169 IonicContact OD2-NH1 2.64Å; D131-R169 PolarHBondContact OD2-NH1 2.86Å; D131-R169 IonicContact OD2-NH2 2.68Å; D131-R169 PolarHBondContact OD2-NH2 3.47Å
132	T	66	Low	66.1	Low	63 Å²	63	94.8 Å²	94.8	39%	0.387	47%	0.474	S	S	.	.	H	α-helix	trans	-71	-39	175.1	57.8	0	0	0	0	112.5	D130 V134 R135 D136	D130-T132 PolarHBondContact O-N 2.98Å; D130-T132 VanDerWaalsContact OD1-CB 3.3Å; D130-T132 WeakPolarHBondContact OD1-CB 3.06Å; D130-T132 WeakPolarHBondContact OD1-CG2 3.29Å; D130-T132 PolarHBondContact OD1-N 3.24Å; D130-T132 PolarHBondContact OD1-OG1 3.08Å; D130-T132 PolarHBondContact OD2-OG1 2.91Å; T132-V134 PolarHBondContact O-N 3Å; T132-V134 VanDerWaalsContact O-N 3.09Å; T132-R135 CarbonylContact O-C 3.58Å; T132-R135 VanDerWaalsContact O-CA 3.32Å; T132-R135 WeakPolarHBondContact O-CA 3.31Å; T132-R135 WeakPolarHBondContact O-CB 3.47Å; T132-R135 PolarHBondContact O-N 3.08Å; T132-D136 PolarHBondContact O-N 3.47Å
133	H	65.6	Low	65.5	Low	100 Å²	100	88.1 Å²	88.1	46%	0.463	46%	0.46	S	S	.	.	H	α-helix	trans	-54.8	-33.7	175.7	-56.8	85.9	0	0	0	112.4	D130 T137	D130-H133 PolarHBondContact O-ND1 3.29Å; D130-H133 VanDerWaalsContact O-ND1 3.07Å; D130-H133 IonicContact OD2-CE1 3.15Å; H133-T137 WeakPolarHBondContact O-CB 3.48Å; H133-T137 WeakPolarHBondContact O-CG2 3.02Å; H133-T137 PolarHBondContact O-N 2.94Å; H133-T137 PolarHBondContact O-OG1 3.33Å
134	V	65.5	Low	65	Low	42 Å²	42	86.8 Å²	86.8	26%	0.255	45%	0.454	S	S	.	.	H	α-helix	trans	-76.9	-28.5	174.5	-168.6	0	0	0	0	112.3	T132 T137 L138 V160	T132-V134 PolarHBondContact O-N 3Å; T132-V134 VanDerWaalsContact O-N 3.09Å; V134-T137 WeakPolarHBondContact CA-OG1 3.41Å; V134-T137 PolarHBondContact O-OG1 3.35Å; V134-L138 HydrophobicContact CG1-CD1 4.06Å; V134-L138 HydrophobicContact CG1-CG 4.39Å; V134-L138 VanDerWaalsContact O-CB 3.25Å; V134-L138 WeakPolarHBondContact O-CB 3.46Å; V134-L138 WeakPolarHBondContact O-CD1 3.37Å; V134-L138 WeakPolarHBondContact O-CG 3.37Å; V134-L138 PolarHBondContact O-N 3.47Å; V134-V160 HydrophobicContact CB-CG2 4.11Å; V134-V160 HydrophobicContact CG1-CG2 3.6Å; V134-V160 HydrophobicContact CG2-CG2 4.29Å
135	R	64	Low	64.6	Low	159 Å²	159	87 Å²	87	60%	0.6	46%	0.463	S	S	*	.	H	α-helix	trans	-66	-48.1	170.5	-172.7	-169	-177.6	101.9	7.3	110.4	D131 T132 L138 Q139	D131-R135 PolarHBondContact O-N 3.1Å; T132-R135 CarbonylContact O-C 3.58Å; T132-R135 VanDerWaalsContact O-CA 3.32Å; T132-R135 WeakPolarHBondContact O-CA 3.31Å; T132-R135 WeakPolarHBondContact O-CB 3.47Å; T132-R135 PolarHBondContact O-N 3.08Å; R135-L138 PolarHBondContact O-N 3.03Å; R135-Q139 WeakPolarHBondContact O-CB 3.19Å; R135-Q139 PolarHBondContact O-N 2.76Å
136	D	66.1	Low	64.1	Low	84 Å²	84	86.2 Å²	86.2	45%	0.449	46%	0.459	S	S	.	.	H	α-helix	trans	-72.4	-43.1	-171.7	-61.6	-3.1	0	0	0	110.6	T132 L138 Q139 I140	T132-D136 PolarHBondContact O-N 3.47Å; D136-L138 VanDerWaalsContact C-N 3.34Å; D136-L138 PolarHBondContact O-N 2.98Å; D136-Q139 PolarHBondContact O-N 3.36Å; D136-I140 WeakPolarHBondContact O-CB 3.26Å; D136-I140 WeakPolarHBondContact O-CD1 3.48Å; D136-I140 VanDerWaalsContact O-CG1 3.24Å; D136-I140 WeakPolarHBondContact O-CG1 3.21Å; D136-I140 PolarHBondContact O-N 3.3Å
137	T	67.8	Low	64	Low	86 Å²	86	89 Å²	89	53%	0.528	48%	0.476	S	S	.	.	H	α-helix	trans	-62.4	-36.4	171.6	49.6	0	0	0	0	112.9	H133 V134 A141	H133-T137 WeakPolarHBondContact O-CB 3.48Å; H133-T137 WeakPolarHBondContact O-CG2 3.02Å; H133-T137 PolarHBondContact O-N 2.94Å; H133-T137 PolarHBondContact O-OG1 3.33Å; V134-T137 WeakPolarHBondContact CA-OG1 3.41Å; V134-T137 PolarHBondContact O-OG1 3.35Å; T137-A141 WeakPolarHBondContact O-CB 3.26Å; T137-A141 PolarHBondContact O-N 2.87Å
138	L	64.2	Low	63.8	Low	20 Å²	20	86.8 Å²	86.8	11%	0.105	47%	0.468	C	S	.	.	H	α-helix	trans	-69.3	-37.9	172.6	-74.9	174.1	0	0	0	112.6	V134 R135 D136 A141 L142 K156 I159	V134-L138 HydrophobicContact CG1-CD1 4.06Å; V134-L138 HydrophobicContact CG1-CG 4.39Å; V134-L138 VanDerWaalsContact O-CB 3.25Å; V134-L138 WeakPolarHBondContact O-CB 3.46Å; V134-L138 WeakPolarHBondContact O-CD1 3.37Å; V134-L138 WeakPolarHBondContact O-CG 3.37Å; V134-L138 PolarHBondContact O-N 3.47Å; R135-L138 PolarHBondContact O-N 3.03Å; D136-L138 VanDerWaalsContact C-N 3.34Å; D136-L138 PolarHBondContact O-N 2.98Å; L138-A141 PolarHBondContact O-N 3.33Å; L138-L142 HydrophobicContact CB-CD1 4.39Å; L138-L142 HydrophobicContact CD2-CD1 4.46Å; L138-L142 VanDerWaalsContact O-CB 3.27Å; L138-L142 WeakPolarHBondContact O-CB 3.5Å; L138-L142 WeakPolarHBondContact O-CG 3.24Å; L138-L142 PolarHBondContact O-N 2.81Å; L138-K156 HydrophobicContact CD1-CB 4.02Å; L138-I159 HydrophobicContact CD2-CD1 3.68Å
139	Q	65.5	Low	63.5	Low	85 Å²	85	86.2 Å²	86.2	40%	0.397	48%	0.475	S	S	.	.	H	α-helix	trans	-68.3	-38.5	178	-168.6	165.9	-7.6	0	0	111.2	R135 D136 G143 D144	R135-Q139 WeakPolarHBondContact O-CB 3.19Å; R135-Q139 PolarHBondContact O-N 2.76Å; D136-Q139 PolarHBondContact O-N 3.36Å; Q139-G143 VanDerWaalsContact O-CA 3.3Å; Q139-G143 WeakPolarHBondContact O-CA 3.35Å; Q139-G143 PolarHBondContact O-N 2.84Å; Q139-D144 WeakPolarHBondContact CG-OD1 3.45Å; Q139-D144 PolarHBondContact NE2-OD1 3.03Å
140	I	68.1	Low	63.5	Low	144 Å²	144	92 Å²	92	74%	0.738	50%	0.502	S	S	*	.	H	α-helix	trans	-65	-43.4	171.3	-67.1	163.2	0	0	0	111.3	D136	D136-I140 WeakPolarHBondContact O-CB 3.26Å; D136-I140 WeakPolarHBondContact O-CD1 3.48Å; D136-I140 VanDerWaalsContact O-CG1 3.24Å; D136-I140 WeakPolarHBondContact O-CG1 3.21Å; D136-I140 PolarHBondContact O-N 3.3Å
141	A	64.4	Low	63.4	Low	83 Å²	83	90.4 Å²	90.4	69%	0.686	50%	0.495	S	S	*	.	H	α-helix	trans	-77.8	-27.2	-175.4	0	0	0	0	0	114.8	T137 L138	T137-A141 WeakPolarHBondContact O-CB 3.26Å; T137-A141 PolarHBondContact O-N 2.87Å; L138-A141 PolarHBondContact O-N 3.33Å
142	L	61.9	Low	63.3	Low	64 Å²	64	89.9 Å²	89.9	34%	0.335	50%	0.5	S	S	.	.	H	α-helix	trans	-95.9	-24.4	177.9	-69.5	161.8	0	0	0	113	L138 L155	L138-L142 HydrophobicContact CB-CD1 4.39Å; L138-L142 HydrophobicContact CD2-CD1 4.46Å; L138-L142 VanDerWaalsContact O-CB 3.27Å; L138-L142 WeakPolarHBondContact O-CB 3.5Å; L138-L142 WeakPolarHBondContact O-CG 3.24Å; L138-L142 PolarHBondContact O-N 2.81Å; L142-L155 HydrophobicContact CD1-CD1 3.73Å; L142-L155 HydrophobicContact CD2-CD1 3.61Å; L142-L155 HydrophobicContact CG-CD1 4.28Å
143	G	56.9	Low	63.4	Low	37 Å²	37	90.8 Å²	90.8	38%	0.381	51%	0.509	S	S	.	.			trans	65.6	165.2	-166	0	0	0	0	0	112.8	Q139 Q145	Q139-G143 VanDerWaalsContact O-CA 3.3Å; Q139-G143 WeakPolarHBondContact O-CA 3.35Å; Q139-G143 PolarHBondContact O-N 2.84Å; G143-Q145 PolarHBondContact O-N 3.36Å
144	D	58	Low	63.4	Low	135 Å²	135	91 Å²	91	72%	0.722	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	19.4	178	-66.6	-42.1	0	0	0	113.7	Q139	Q139-D144 WeakPolarHBondContact CG-OD1 3.45Å; Q139-D144 PolarHBondContact NE2-OD1 3.03Å
145	Q	56.2	Low	63.5	Low	181 Å²	181	91.7 Å²	91.7	85%	0.846	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.3	40.1	-173.4	-62.7	-169	5.4	0	0	113.9	G143 V147	G143-Q145 PolarHBondContact O-N 3.36Å; Q145-V147 PolarHBondContact O-N 2.83Å
146	S	57.6	Low	63.6	Low	48 Å²	48	87.4 Å²	87.4	34%	0.336	50%	0.5	S	S	.	.			trans	-66.7	120.1	169.4	66.1	0	0	0	0	111.3	I148 A151	S146-I148 PolarHBondContact O-N 3.32Å; S146-I148 PolarHBondContact OG-O 2.95Å; S146-A151 WeakPolarHBondContact OG-CB 3.47Å
147	V	65.6	Low	63.5	Low	147 Å²	147	85.4 Å²	85.4	89%	0.891	50%	0.499	S	S	*	.	S	Bend	trans	-57.5	-23.4	-178.9	-178.3	0	0	0	0	113.3	Q145 P149	Q145-V147 PolarHBondContact O-N 2.83Å; V147-P149 WeakPolarHBondContact O-CD 3.23Å
148	I	61.9	Low	63.5	Low	109 Å²	109	87.7 Å²	87.7	56%	0.559	51%	0.508	S	S	*	.	S	Bend	trans	-89.2	117.2	174.2	-62.6	167.7	0	0	0	109	S146 Q150 A151	S146-I148 PolarHBondContact O-N 3.32Å; S146-I148 PolarHBondContact OG-O 2.95Å; I148-Q150 PolarHBondContact O-N 3.49Å; I148-A151 HydrophobicContact CB-CB 4.13Å; I148-A151 HydrophobicContact CG2-CB 4.33Å; I148-A151 WeakPolarHBondContact O-CB 3.39Å; I148-A151 PolarHBondContact O-N 2.86Å
149	P	60.1	Low	63.6	Low	109 Å²	109	91.7 Å²	91.7	71%	0.708	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	136.6	171.4	-24	34.6	0	0	0	110.9	V147 A151	V147-P149 WeakPolarHBondContact O-CD 3.23Å; P149-A151 VanDerWaalsContact C-N 3.27Å; P149-A151 PolarHBondContact O-N 2.98Å
150	Q	63.6	Low	63.5	Low	151 Å²	151	88.9 Å²	88.9	71%	0.706	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	15.9	-177.9	-46.1	-179.6	-0.1	0	0	115.9	I148 G152 S153 L154	I148-Q150 PolarHBondContact O-N 3.49Å; Q150-G152 VanDerWaalsContact C-N 3.3Å; Q150-G152 PolarHBondContact O-N 3.31Å; Q150-S153 WeakPolarHBondContact O-CA 3.32Å; Q150-S153 VanDerWaalsContact O-CB 3.27Å; Q150-S153 WeakPolarHBondContact O-CB 3.5Å; Q150-S153 PolarHBondContact O-N 3.43Å; Q150-L154 PolarHBondContact O-N 2.83Å
151	A	66	Low	63	Low	8 Å²	8	85.3 Å²	85.3	7%	0.066	51%	0.509	C	S	.	.	H	α-helix	trans	-50.1	-45.1	179.3	0	0	0	0	0	113.8	S146 I148 P149 S153 L154 L155	S146-A151 WeakPolarHBondContact OG-CB 3.47Å; I148-A151 HydrophobicContact CB-CB 4.13Å; I148-A151 HydrophobicContact CG2-CB 4.33Å; I148-A151 WeakPolarHBondContact O-CB 3.39Å; I148-A151 PolarHBondContact O-N 2.86Å; P149-A151 VanDerWaalsContact C-N 3.27Å; P149-A151 PolarHBondContact O-N 2.98Å; A151-S153 PolarHBondContact O-N 3.32Å; A151-L154 PolarHBondContact O-N 3.06Å; A151-L155 WeakPolarHBondContact O-CB 3.45Å; A151-L155 WeakPolarHBondContact O-CG 3.44Å; A151-L155 PolarHBondContact O-N 2.93Å
152	G	65.5	Low	62.6	Low	33 Å²	33	87 Å²	87	34%	0.34	51%	0.511	S	S	.	.	H	α-helix	trans	-62.2	-24.1	177	0	0	0	0	0	114.5	Q150 K156	Q150-G152 VanDerWaalsContact C-N 3.3Å; Q150-G152 PolarHBondContact O-N 3.31Å; G152-K156 WeakPolarHBondContact O-CB 3.41Å; G152-K156 PolarHBondContact O-N 3.06Å; G152-K156 VanDerWaalsContact O-N 3.09Å
153	S	67	Low	62.5	Low	82 Å²	82	92.9 Å²	92.9	57%	0.573	53%	0.529	S	S	*	.	H	α-helix	trans	-76.8	-46.9	173.5	-164.7	0	0	0	0	111.2	Q150 A151 K156 G157	Q150-S153 WeakPolarHBondContact O-CA 3.32Å; Q150-S153 VanDerWaalsContact O-CB 3.27Å; Q150-S153 WeakPolarHBondContact O-CB 3.5Å; Q150-S153 PolarHBondContact O-N 3.43Å; A151-S153 PolarHBondContact O-N 3.32Å; S153-K156 PolarHBondContact O-N 2.86Å; S153-G157 PolarHBondContact O-N 2.79Å; S153-G157 VanDerWaalsContact O-N 3.09Å
154	L	66.8	Low	62.9	Low	104 Å²	104	92.3 Å²	92.3	55%	0.545	52%	0.522	S	S	.	.	H	α-helix	trans	-63.8	-44.8	177.9	-62.4	174.5	0	0	0	111.5	Q150 A151 G157 L158	Q150-L154 PolarHBondContact O-N 2.83Å; A151-L154 PolarHBondContact O-N 3.06Å; L154-G157 PolarHBondContact O-N 2.69Å; L154-L158 PolarHBondContact O-N 3.38Å
155	L	67.5	Low	63.8	Low	56 Å²	56	90.1 Å²	90.1	29%	0.293	51%	0.514	S	S	.	.	H	α-helix	trans	-70.2	-34.7	177.9	-69.5	169.4	0	0	0	112	L142 A151 G157 L158 I159	L142-L155 HydrophobicContact CD1-CD1 3.73Å; L142-L155 HydrophobicContact CD2-CD1 3.61Å; L142-L155 HydrophobicContact CG-CD1 4.28Å; A151-L155 WeakPolarHBondContact O-CB 3.45Å; A151-L155 WeakPolarHBondContact O-CG 3.44Å; A151-L155 PolarHBondContact O-N 2.93Å; L155-G157 VanDerWaalsContact C-N 3.28Å; L155-G157 PolarHBondContact O-N 3.28Å; L155-L158 HydrophobicContact CD2-CD1 4.35Å; L155-L158 PolarHBondContact O-N 3.39Å; L155-L158 VanDerWaalsContact O-N 3.12Å; L155-I159 HydrophobicContact CB-CD1 4.27Å; L155-I159 WeakPolarHBondContact O-CB 3.07Å; L155-I159 WeakPolarHBondContact O-CG1 3.49Å; L155-I159 PolarHBondContact O-N 2.94Å
156	K	65.1	Low	64.5	Low	69 Å²	69	85.8 Å²	85.8	30%	0.3	50%	0.496	S	S	.	.	H	α-helix	trans	-58.2	-41.3	168.6	177.4	164.4	179.7	158.5	0	111.5	D131 L138 G152 S153 L158 V160	D131-K156 PolarHBondContact O-NZ 2.99Å; L138-K156 HydrophobicContact CD1-CB 4.02Å; G152-K156 WeakPolarHBondContact O-CB 3.41Å; G152-K156 PolarHBondContact O-N 3.06Å; G152-K156 VanDerWaalsContact O-N 3.09Å; S153-K156 PolarHBondContact O-N 2.86Å; K156-L158 VanDerWaalsContact C-N 3.26Å; K156-L158 PolarHBondContact O-N 3.32Å; K156-V160 HydrophobicContact CG-CB 4.5Å; K156-V160 HydrophobicContact CG-CG2 3.98Å; K156-V160 VanDerWaalsContact O-CB 3.29Å; K156-V160 WeakPolarHBondContact O-CB 3.46Å; K156-V160 PolarHBondContact O-N 3.08Å
157	G	63.7	Low	65.2	Low	42 Å²	42	86.2 Å²	86.2	43%	0.433	50%	0.502	S	S	.	.	H	α-helix	trans	-68.1	-18.4	176.2	0	0	0	0	0	115.5	S153 L154 L155 T162	S153-G157 PolarHBondContact O-N 2.79Å; S153-G157 VanDerWaalsContact O-N 3.09Å; L154-G157 PolarHBondContact O-N 2.69Å; L155-G157 VanDerWaalsContact C-N 3.28Å; L155-G157 PolarHBondContact O-N 3.28Å; G157-T162 WeakPolarHBondContact O-CG2 3.38Å
158	L	68.1	Low	65.6	Low	135 Å²	135	81.5 Å²	81.5	71%	0.707	47%	0.471	S	S	*	.	H	α-helix	trans	-94.9	-36.4	176.1	-76	161	0	0	0	112.8	L154 L155 K156	L154-L158 PolarHBondContact O-N 3.38Å; L155-L158 HydrophobicContact CD2-CD1 4.35Å; L155-L158 PolarHBondContact O-N 3.39Å; L155-L158 VanDerWaalsContact O-N 3.12Å; K156-L158 VanDerWaalsContact C-N 3.26Å; K156-L158 PolarHBondContact O-N 3.32Å
159	I	65.3	Low	66.2	Low	103 Å²	103	78.4 Å²	78.4	53%	0.528	45%	0.452	S	S	.	.	H	α-helix	trans	-92	-40.1	-172.5	-66	165.8	0	0	0	111.2	L138 L155 A161	L138-I159 HydrophobicContact CD2-CD1 3.68Å; L155-I159 HydrophobicContact CB-CD1 4.27Å; L155-I159 WeakPolarHBondContact O-CB 3.07Å; L155-I159 WeakPolarHBondContact O-CG1 3.49Å; L155-I159 PolarHBondContact O-N 2.94Å; I159-A161 VanDerWaalsContact C-N 3.29Å; I159-A161 PolarHBondContact O-N 3.35Å
160	V	64.5	Low	66.9	Low	27 Å²	27	77 Å²	77	16%	0.164	44%	0.438	C	S	.	.	S	Bend	trans	-78.6	87.1	163.4	-174.2	0	0	0	0	107.2	V134 K156 T162	V134-V160 HydrophobicContact CB-CG2 4.11Å; V134-V160 HydrophobicContact CG1-CG2 3.6Å; V134-V160 HydrophobicContact CG2-CG2 4.29Å; K156-V160 HydrophobicContact CG-CB 4.5Å; K156-V160 HydrophobicContact CG-CG2 3.98Å; K156-V160 VanDerWaalsContact O-CB 3.29Å; K156-V160 WeakPolarHBondContact O-CB 3.46Å; K156-V160 PolarHBondContact O-N 3.08Å; V160-T162 PolarHBondContact O-N 3.31Å; V160-T162 VanDerWaalsContact O-N 3.15Å
161	A	58.2	Low	67.7	Low	68 Å²	68	73.2 Å²	73.2	56%	0.562	42%	0.423	S	S	*	.			trans	-44.1	124.1	173.1	0	0	0	0	0	109.5	I159 R163	I159-A161 VanDerWaalsContact C-N 3.29Å; I159-A161 PolarHBondContact O-N 3.35Å; A161-R163 PolarHBondContact O-N 3.05Å
162	T	55.2	Low	68.3	Low	120 Å²	120	78.9 Å²	78.9	74%	0.736	44%	0.442	S	S	*	.			trans	-73	64	-154	43.5	0	0	0	0	114.5	G157 V160 G164	G157-T162 WeakPolarHBondContact O-CG2 3.38Å; V160-T162 PolarHBondContact O-N 3.31Å; V160-T162 VanDerWaalsContact O-N 3.15Å; T162-G164 PolarHBondContact O-N 3.3Å
163	R	59.7	Low	68.8	Low	187 Å²	187	84.6 Å²	84.6	71%	0.706	45%	0.454	S	S	*	.			trans	-72.9	52.9	171.6	-65.9	-180	174.1	-170.3	-1.9	111	A161 R169	A161-R163 PolarHBondContact O-N 3.05Å; R163-R169 WeakPolarHBondContact O-CG 3.16Å; R163-R169 PolarHBondContact O-NE 3.1Å
164	G	66.4	Low	69.5	Low	24 Å²	24	86.1 Å²	86.1	25%	0.247	46%	0.455	C	S	.	.			trans	62.5	-174.2	177.2	0	0	0	0	0	115.6	T162 E168	T162-G164 PolarHBondContact O-N 3.3Å; G164-E168 WeakPolarHBondContact CA-OE2 3.17Å
165	T	75.1	Confident	70.1	Confident	90 Å²	90	83.7 Å²	83.7	55%	0.552	46%	0.455	S	S	*	.			trans	-72.1	165.1	165.8	62.5	0	0	0	0	110.6	A167 E168 R169	T165-A167 PolarHBondContact O-N 3.02Å; T165-E168 PolarHBondContact O-N 3.49Å; T165-E168 PolarHBondContact OG1-N 2.86Å; T165-R169 PolarHBondContact O-N 2.85Å
166	L	72.2	Confident	70.4	Confident	90 Å²	90	88.8 Å²	88.8	47%	0.471	47%	0.47	S	S	.	.	H	α-helix	trans	-54.7	-39.7	171.1	-178.1	152.1	0	0	0	111.4	F129 E168 R169 L170	F129-L166 HydrophobicContact CB-CD1 4.34Å; L166-E168 PolarHBondContact O-N 3.09Å; L166-R169 PolarHBondContact O-N 3.15Å; L166-L170 VanDerWaalsContact O-CB 3.31Å; L166-L170 WeakPolarHBondContact O-CB 3.36Å; L166-L170 PolarHBondContact O-N 3.16Å
167	A	71	Confident	70.9	Confident	56 Å²	56	94.5 Å²	94.5	46%	0.463	50%	0.495	S	S	.	.	H	α-helix	trans	-61.1	-41.5	174.2	0	0	0	0	0	112.1	T165 L170 L171	T165-A167 PolarHBondContact O-N 3.02Å; A167-L170 PolarHBondContact O-N 3.32Å; A167-L171 WeakPolarHBondContact O-CB 3.28Å; A167-L171 VanDerWaalsContact O-CG 3.22Å; A167-L171 WeakPolarHBondContact O-CG 3.37Å; A167-L171 PolarHBondContact O-N 3.43Å
168	E	74.5	Confident	70.8	Confident	49 Å²	49	95.7 Å²	95.7	23%	0.229	49%	0.491	C	S	.	.	H	α-helix	trans	-68.2	-39.2	175.8	-166	-176.3	167.6	0	0	112.5	G164 T165 L166 L170 L171 R172 N178	G164-E168 WeakPolarHBondContact CA-OE2 3.17Å; T165-E168 PolarHBondContact O-N 3.49Å; T165-E168 PolarHBondContact OG1-N 2.86Å; L166-E168 PolarHBondContact O-N 3.09Å; E168-L170 VanDerWaalsContact C-N 3.32Å; E168-L170 PolarHBondContact O-N 3.29Å; E168-L171 PolarHBondContact O-N 3.32Å; E168-R172 HydrophobicContact CG-CG 4.49Å; E168-R172 WeakPolarHBondContact O-CB 3.46Å; E168-R172 VanDerWaalsContact O-CG 3.22Å; E168-R172 WeakPolarHBondContact O-CG 3.25Å; E168-R172 PolarHBondContact O-N 3.15Å; E168-R172 IonicContact OE1-CZ 3.05Å; E168-R172 VanDerWaalsContact OE1-CZ 3.31Å; E168-R172 IonicContact OE1-NE 3.65Å; E168-R172 PolarHBondContact OE1-NE 3.43Å; E168-R172 VanDerWaalsContact OE1-NE 3.14Å; E168-R172 IonicContact OE1-NH2 2.74Å; E168-R172 PolarHBondContact OE1-NH2 2.99Å; E168-N178 PolarHBondContact OE1-ND2 3.46Å
169	R	74.3	Confident	70.3	Confident	43 Å²	43	93 Å²	93	16%	0.162	49%	0.488	C	S	.	.	H	α-helix	trans	-61.3	-42.4	173	-63.3	-177.1	-157.5	162.3	15	111.5	D131 R163 T165 L166 R173	D131-R169 IonicContact OD1-CZ 3.65Å; D131-R169 IonicContact OD1-NH1 2.75Å; D131-R169 PolarHBondContact OD1-NH1 3.25Å; D131-R169 IonicContact OD1-NH2 3.15Å; D131-R169 PolarHBondContact OD1-NH2 3.17Å; D131-R169 IonicContact OD2-CZ 3.39Å; D131-R169 IonicContact OD2-NH1 2.64Å; D131-R169 PolarHBondContact OD2-NH1 2.86Å; D131-R169 IonicContact OD2-NH2 2.68Å; D131-R169 PolarHBondContact OD2-NH2 3.47Å; R163-R169 WeakPolarHBondContact O-CG 3.16Å; R163-R169 PolarHBondContact O-NE 3.1Å; T165-R169 PolarHBondContact O-N 2.85Å; L166-R169 PolarHBondContact O-N 3.15Å; R169-R173 WeakPolarHBondContact O-CG 3.36Å; R169-R173 PolarHBondContact O-N 2.93Å
170	L	76.3	Confident	69.6	Low	80 Å²	80	96.4 Å²	96.4	42%	0.419	50%	0.502	S	S	.	.	H	α-helix	trans	-66.4	-46.9	178.2	-173	126.9	0	0	0	111.2	F129 L166 A167 E168 R172 R173 L174	F129-L170 HydrophobicContact CE1-CB 4.48Å; L166-L170 VanDerWaalsContact O-CB 3.31Å; L166-L170 WeakPolarHBondContact O-CB 3.36Å; L166-L170 PolarHBondContact O-N 3.16Å; A167-L170 PolarHBondContact O-N 3.32Å; E168-L170 VanDerWaalsContact C-N 3.32Å; E168-L170 PolarHBondContact O-N 3.29Å; L170-R172 PolarHBondContact O-N 3.47Å; L170-R173 PolarHBondContact O-N 3.45Å; L170-L174 HydrophobicContact CD2-CD1 3.68Å; L170-L174 HydrophobicContact CG-CD1 4.31Å; L170-L174 WeakPolarHBondContact O-CB 3.45Å; L170-L174 VanDerWaalsContact O-CG 3.31Å; L170-L174 WeakPolarHBondContact O-CG 3.43Å; L170-L174 PolarHBondContact O-N 3.3Å
171	L	80.3	Confident	68.7	Low	72 Å²	72	98.8 Å²	98.8	38%	0.377	52%	0.52	S	S	.	.	H	α-helix	trans	-57.9	-47.8	173.3	-75.5	168.3	0	0	0	111.7	A167 E168 R173 L174 G175 W176	A167-L171 WeakPolarHBondContact O-CB 3.28Å; A167-L171 VanDerWaalsContact O-CG 3.22Å; A167-L171 WeakPolarHBondContact O-CG 3.37Å; A167-L171 PolarHBondContact O-N 3.43Å; E168-L171 PolarHBondContact O-N 3.32Å; L171-R173 VanDerWaalsContact C-N 3.33Å; L171-R173 PolarHBondContact O-N 3.25Å; L171-L174 CarbonylContact O-C 3.5Å; L171-L174 WeakPolarHBondContact O-CA 3.46Å; L171-L174 WeakPolarHBondContact O-CB 3.29Å; L171-L174 PolarHBondContact O-N 3.45Å; L171-L174 VanDerWaalsContact O-N 3.1Å; L171-G175 PolarHBondContact O-N 3.09Å; L171-G175 VanDerWaalsContact O-N 3.15Å; L171-W176 HydrophobicContact CB-CB 4.01Å; L171-W176 HydrophobicContact CB-CG 4.2Å; L171-W176 HydrophobicContact CD2-CD2 4.03Å; L171-W176 HydrophobicContact CD2-CG 3.86Å; L171-W176 WeakPolarHBondContact O-CB 3.47Å; L171-W176 VanDerWaalsContact O-CD1 3.32Å; L171-W176 PolarHBondContact O-N 3.37Å
172	R	78.8	Confident	67.6	Low	126 Å²	126	101.1 Å²	101.1	48%	0.475	53%	0.527	S	S	.	.	H	α-helix	trans	-58.5	-41.6	175.9	-72.7	172.1	-177.5	-147.4	11	112.2	E168 L170 G175 W176	E168-R172 HydrophobicContact CG-CG 4.49Å; E168-R172 WeakPolarHBondContact O-CB 3.46Å; E168-R172 VanDerWaalsContact O-CG 3.22Å; E168-R172 WeakPolarHBondContact O-CG 3.25Å; E168-R172 PolarHBondContact O-N 3.15Å; E168-R172 IonicContact OE1-CZ 3.05Å; E168-R172 VanDerWaalsContact OE1-CZ 3.31Å; E168-R172 IonicContact OE1-NE 3.65Å; E168-R172 PolarHBondContact OE1-NE 3.43Å; E168-R172 VanDerWaalsContact OE1-NE 3.14Å; E168-R172 IonicContact OE1-NH2 2.74Å; E168-R172 PolarHBondContact OE1-NH2 2.99Å; L170-R172 PolarHBondContact O-N 3.47Å; R172-G175 PolarHBondContact O-N 3.2Å; R172-W176 WeakPolarHBondContact CA-O 3.49Å
173	R	75.9	Confident	66.7	Low	154 Å²	154	103.4 Å²	103.4	58%	0.581	53%	0.534	S	S	*	.	H	α-helix	trans	-71.8	-27	175.4	-73.6	174.7	72.4	151.5	5.3	113.5	E128 R169 L170 L171 G175	E128-R173 IonicContact OE2-CZ 2.84Å; E128-R173 IonicContact OE2-NH1 3.36Å; E128-R173 PolarHBondContact OE2-NH1 3.1Å; E128-R173 IonicContact OE2-NH2 3.46Å; E128-R173 PolarHBondContact OE2-NH2 3.47Å; R169-R173 WeakPolarHBondContact O-CG 3.36Å; R169-R173 PolarHBondContact O-N 2.93Å; L170-R173 PolarHBondContact O-N 3.45Å; L171-R173 VanDerWaalsContact C-N 3.33Å; L171-R173 PolarHBondContact O-N 3.25Å; R173-G175 PolarHBondContact O-N 3.32Å
174	L	81	Confident	65.6	Low	114 Å²	114	102.3 Å²	102.3	60%	0.597	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-1.8	167.1	-69.6	171.1	0	0	0	113.2	L170 L171	L170-L174 HydrophobicContact CD2-CD1 3.68Å; L170-L174 HydrophobicContact CG-CD1 4.31Å; L170-L174 WeakPolarHBondContact O-CB 3.45Å; L170-L174 VanDerWaalsContact O-CG 3.31Å; L170-L174 WeakPolarHBondContact O-CG 3.43Å; L170-L174 PolarHBondContact O-N 3.3Å; L171-L174 CarbonylContact O-C 3.5Å; L171-L174 WeakPolarHBondContact O-CA 3.46Å; L171-L174 WeakPolarHBondContact O-CB 3.29Å; L171-L174 PolarHBondContact O-N 3.45Å; L171-L174 VanDerWaalsContact O-N 3.1Å
175	G	78.8	Confident	64	Low	53 Å²	53	108.7 Å²	108.7	55%	0.546	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	96.3	4	176.4	0	0	0	0	0	115.4	L171 R172 R173 K177	L171-G175 PolarHBondContact O-N 3.09Å; L171-G175 VanDerWaalsContact O-N 3.15Å; R172-G175 PolarHBondContact O-N 3.2Å; R173-G175 PolarHBondContact O-N 3.32Å; G175-K177 PolarHBondContact O-N 2.79Å
176	W	74.7	Confident	62.3	Low	162 Å²	162	111.2 Å²	111.2	61%	0.614	58%	0.58	S	S	*	*			trans	-73.4	107.8	176.4	-64.2	72.7	0	0	0	110.1	L171 R172	L171-W176 HydrophobicContact CB-CB 4.01Å; L171-W176 HydrophobicContact CB-CG 4.2Å; L171-W176 HydrophobicContact CD2-CD2 4.03Å; L171-W176 HydrophobicContact CD2-CG 3.86Å; L171-W176 WeakPolarHBondContact O-CB 3.47Å; L171-W176 VanDerWaalsContact O-CD1 3.32Å; L171-W176 PolarHBondContact O-N 3.37Å; R172-W176 WeakPolarHBondContact CA-O 3.49Å
177	K	74.1	Confident	60.6	Low	189 Å²	189	115 Å²	115	82%	0.822	60%	0.6	S	S	*	*			trans	-84.3	135.9	171.7	-59.1	178.6	70.6	172.5	0	108.9	G175 A179	G175-K177 PolarHBondContact O-N 2.79Å; K177-A179 PolarHBondContact O-N 3.26Å
178	N	63.6	Low	59.2	Low	67 Å²	67	117.7 Å²	117.7	36%	0.358	61%	0.611	S	S	.	*			trans	-65.7	128.8	176.2	-70.2	2	0	0	0	109.3	E168 H180 S181	E168-N178 PolarHBondContact OE1-ND2 3.46Å; N178-H180 PolarHBondContact O-N 3.21Å; N178-S181 PolarHBondContact O-N 2.77Å; N178-S181 PolarHBondContact O-OG 3.24Å
179	A	56.9	Low	57.4	Low	78 Å²	78	121.4 Å²	121.4	65%	0.645	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-6.4	-176.4	0	0	0	0	0	114.9	K177	K177-A179 PolarHBondContact O-N 3.26Å
180	H	50.3	Low	55.6	Low	175 Å²	175	127 Å²	127	81%	0.81	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.4	16.2	177.1	-54.6	-51.2	0	0	0	113.2	N178	N178-H180 PolarHBondContact O-N 3.21Å
181	S	44.8	Very low	53.5	Low	77 Å²	77	129.3 Å²	129.3	54%	0.538	68%	0.678	S	S	.	*			trans	-113.4	57.2	171.8	71	0	0	0	0	111	N178	N178-S181 PolarHBondContact O-N 2.77Å; N178-S181 PolarHBondContact O-OG 3.24Å
182	T	36.3	Very low	51.6	Low	118 Å²	118	133 Å²	133	72%	0.724	70%	0.703	S	S	*	*			trans	-88.9	144.4	160.7	41.2	0	0	0	0	109.2
183	L	35.7	Very low	49.4	Very low	167 Å²	167	132.9 Å²	132.9	87%	0.874	71%	0.712	S	S	*	*	S	Bend	trans	57.6	67	178.4	-53.5	-175.1	0	0	0	117.2
184	L	36.2	Very low	47.7	Very low	165 Å²	165	132.3 Å²	132.3	86%	0.864	72%	0.716	S	S	*	*	S	Bend	trans	-154.8	133.4	132.3	-81.3	-165.1	0	0	0	108.5
185	N	33.2	Very low	45.4	Very low	157 Å²	157	137.1 Å²	137.1	84%	0.84	73%	0.727	S	S	*	*			trans	94.1	78.2	-171	-56.8	-5.5	0	0	0	114.5
186	D	38.7	Very low	43.4	Very low	143 Å²	143	144.1 Å²	144.1	77%	0.765	74%	0.742	S	S	*	*			trans	-149.6	86.4	159.3	-144.7	0.2	0	0	0	107.9	T188	D186-T188 PolarHBondContact O-N 3.06Å
187	D	37.9	Very low	41.5	Very low	169 Å²	169	145.7 Å²	145.7	90%	0.904	75%	0.753	S	S	*	*			trans	-83.3	58.1	-174.8	-77.9	-45.4	0	0	0	111.4
188	T	41.4	Very low	39.9	Very low	113 Å²	113	142.1 Å²	142.1	69%	0.693	75%	0.75	S	S	*	*			trans	-126.8	125.4	166.7	55	0	0	0	0	110.9	D186	D186-T188 PolarHBondContact O-N 3.06Å
189	V	37.2	Very low	38.5	Very low	128 Å²	128	145.9 Å²	145.9	78%	0.776	77%	0.77	S	S	*	*			trans	-73.6	139.2	-176.9	-175.2	0	0	0	0	110.4
190	E	35.7	Very low	37.9	Very low	161 Å²	161	148.6 Å²	148.6	75%	0.752	77%	0.774	S	S	*	*				-176.7	153.5	122.6	-89.4	-40.1	143.8	0	0	112.6
191	D	32.6	Very low	37.5	Very low	128 Å²	128	145.8 Å²	145.8	68%	0.684	77%	0.769	S	S	*	*			trans	-27	132.9	-174.8	-86.1	-34.9	0	0	0	120.4
192	T	40.2	Very low	37.2	Very low	148 Å²	148	151 Å²	151	91%	0.908	78%	0.784	S	S	*	*				-157.7	141.3	118.3	1.2	0	0	0	0	112.6
193	N	33	Very low	37.3	Very low	124 Å²	124	149.1 Å²	149.1	66%	0.663	78%	0.781	S	S	*	*			trans	-111.8	134.5	-170.5	-119.2	-72	0	0	0	112.9
194	Q	38.8	Very low	37.4	Very low	143 Å²	143	148.1 Å²	148.1	67%	0.668	78%	0.775	S	S	*	*			trans	61.9	111.3	157.8	-47.8	170.9	28.7	0	0	119.7
195	R	33.8	Very low	37.3	Very low	215 Å²	215	146.8 Å²	146.8	81%	0.811	77%	0.774	S	S	*	*				176.6	116.1	101.5	-91.9	151.6	-164.8	-154.1	2.3	115.3
196	K	35.9	Very low	37.3	Very low	199 Å²	199	143 Å²	143	87%	0.865	77%	0.773	S	S	*	*			trans	52.5	114.2	134.4	-62.5	-172.6	173.3	-170.9	0	121.9
197	F	36.3	Very low	36.9	Very low	195 Å²	195	142.3 Å²	142.3	86%	0.855	77%	0.773	S	S	*	*			trans	-73.5	164.9	138.2	-61.2	-89.6	0	0	0	110
198	P	39.7	Very low	36.7	Very low	115 Å²	115	141.2 Å²	141.2	75%	0.747	77%	0.768	S	S	*	*				-114.4	167.7	63.4	6.3	16.6	0	0	0	113.1
199	D	34.4	Very low	36.3	Very low	145 Å²	145	144.6 Å²	144.6	78%	0.775	78%	0.776	S	S	*	*			cis	89.7	161.8	30.2	-141.1	-10.4	0	0	0	114.7
200	D	43.8	Very low	36	Very low	136 Å²	136	143.3 Å²	143.3	73%	0.727	77%	0.771	S	S	*	*			trans	98.6	66.2	-179.6	-58.8	-11.1	0	0	0	119.3
201	T	41.9	Very low	35.8	Very low	115 Å²	115	145.2 Å²	145.2	71%	0.706	78%	0.778	S	S	*	*				51.5	134	122.2	58.2	0	0	0	0	125.7
202	E	38.6	Very low	35.7	Very low	186 Å²	186	143 Å²	143	87%	0.869	79%	0.785	S	S	*	*			trans	66.4	121.5	135.6	-62.2	-83	147.6	0	0	121.7
203	A	39.2	Very low	35.3	Very low	80 Å²	80	139.7 Å²	139.7	66%	0.661	78%	0.78	S	S	*	*				169.3	154.2	112.9	0	0	0	0	0	115.1
204	I	38.1	Very low	35.3	Very low	146 Å²	146	141.3 Å²	141.3	75%	0.749	78%	0.784	S	S	*	*			trans	58.7	94.6	152.5	-64.6	155.9	0	0	0	116.4
205	T	32.3	Very low	35	Very low	136 Å²	136	142 Å²	142	83%	0.834	79%	0.785	S	S	*	*				48.6	83.2	83.1	73.2	0	0	0	0	115.4
206	G	32.9	Very low	35.1	Very low	79 Å²	79	139.3 Å²	139.3	81%	0.814	79%	0.786	S	S	*	*			trans	-151.1	141.5	170.2	0	0	0	0	0	111.5
207	T	31.8	Very low	35.1	Very low	127 Å²	127	135.5 Å²	135.5	78%	0.779	79%	0.785	S	S	*	*			trans	-91.7	137.8	-178.5	50.1	0	0	0	0	112.6
208	N	33	Very low	35.3	Very low	146 Å²	146	130.4 Å²	130.4	78%	0.781	77%	0.773	S	S	*	*			trans	80.2	148.7	159.8	-48.1	-22.4	0	0	0	118.5
209	E	33.6	Very low	35.4	Very low	184 Å²	184	130.7 Å²	130.7	86%	0.86	78%	0.775	S	S	*	*			trans	68.8	97.9	161	-45.8	-149.2	173.4	0	0	120.1
210	C	31.2	Very low	35.6	Very low	102 Å²	102	127.6 Å²	127.6	69%	0.689	76%	0.761	S	S	*	*				42	113.9	124.4	-155.5	0	0	0	0	120
211	F	30.8	Very low	35.6	Very low	201 Å²	201	130.2 Å²	130.2	88%	0.882	77%	0.772	S	S	*	*				175.6	138.3	104.4	-107.2	-75.8	0	0	0	113.9
212	G	30.8	Very low	35.9	Very low	81 Å²	81	131.1 Å²	131.1	84%	0.835	77%	0.766	S	S	*	*			trans	77.5	154	149.7	0	0	0	0	0	118.6
213	G	31	Very low	36.4	Very low	79 Å²	79	126.4 Å²	126.4	81%	0.814	76%	0.759	S	S	*	*			trans	120.3	56.5	173.2	0	0	0	0	0	116.5
214	E	33.4	Very low	36.7	Very low	157 Å²	157	131 Å²	131	73%	0.734	77%	0.767	S	S	*	*			trans	24.2	145	136.1	-78.3	-165	109.6	0	0	123.8
215	K	32.9	Very low	37.2	Very low	158 Å²	158	130 Å²	130	69%	0.687	76%	0.762	S	S	*	*			trans	93	147.5	148	-72	148.1	-176.4	148.7	0	119.9
216	D	35.1	Very low	38	Very low	158 Å²	158	127.7 Å²	127.7	85%	0.845	75%	0.751	S	S	*	*			trans	66.4	41.5	163.6	-54.5	-12.8	0	0	0	119.7	S218	D216-S218 PolarHBondContact O-N 2.93Å
217	S	36.7	Very low	38.7	Very low	119 Å²	119	133.2 Å²	133.2	83%	0.832	75%	0.753	S	S	*	*			trans	-75.4	100.4	164.2	56.5	0	0	0	0	112
218	S	40.4	Very low	39.9	Very low	89 Å²	89	131.4 Å²	131.4	62%	0.622	74%	0.741	S	S	*	*			trans	-58	143.2	165.5	61.4	0	0	0	0	111.5	D216 T220	D216-S218 PolarHBondContact O-N 2.93Å; S218-T220 PolarHBondContact O-N 3.33Å
219	P	42.2	Very low	40.8	Very low	121 Å²	121	128.7 Å²	128.7	79%	0.786	74%	0.74	S	S	*	*			trans	-66.9	101.5	-175.1	27.5	-35.2	0	0	0	111.5	M221	P219-M221 PolarHBondContact O-N 3.3Å; P219-M221 VanDerWaalsContact O-N 3.08Å
220	T	38.4	Very low	41.8	Very low	79 Å²	79	123.4 Å²	123.4	49%	0.485	71%	0.714	S	S	.	*			trans	-67.3	103.9	172.3	31.7	0	0	0	0	109.8	S218 F222	S218-T220 PolarHBondContact O-N 3.33Å; T220-F222 VanDerWaalsContact CB-CE1 3.47Å; T220-F222 HydrophobicContact CG2-CD1 4.29Å; T220-F222 HydrophobicContact CG2-CE1 3.51Å; T220-F222 HydrophobicContact CG2-CZ 3.82Å; T220-F222 PolarHBondContact O-N 3.24Å
221	M	43.8	Very low	43.2	Very low	191 Å²	191	125.2 Å²	125.2	94%	0.941	72%	0.722	S	S	*	*			trans	-71.3	36.3	-179.1	-65.8	-164.6	-68.1	0	0	114.5	P219	P219-M221 PolarHBondContact O-N 3.3Å; P219-M221 VanDerWaalsContact O-N 3.08Å
222	F	47.7	Very low	44.8	Very low	134 Å²	134	119.4 Å²	119.4	59%	0.588	70%	0.7	S	S	*	*			trans	-104.5	124.6	163.3	50.6	-105.8	0	0	0	109.5	T220 Q224	T220-F222 VanDerWaalsContact CB-CE1 3.47Å; T220-F222 HydrophobicContact CG2-CD1 4.29Å; T220-F222 HydrophobicContact CG2-CE1 3.51Å; T220-F222 HydrophobicContact CG2-CZ 3.82Å; T220-F222 PolarHBondContact O-N 3.24Å; F222-Q224 PolarHBondContact O-N 3.41Å
223	A	49.3	Very low	46.8	Very low	87 Å²	87	121.9 Å²	121.9	72%	0.719	70%	0.699	S	S	*	*			trans	-67.3	127.7	163.2	0	0	0	0	0	108.3	I225	A223-I225 VanDerWaalsContact C-N 3.34Å; A223-I225 PolarHBondContact O-N 2.87Å
224	Q	45.6	Very low	48.3	Very low	176 Å²	176	122.8 Å²	122.8	82%	0.822	68%	0.681	S	S	*	*			trans	-77.1	83.2	-179.3	-173	171.4	-15	0	0	110.3	F222 S226	F222-Q224 PolarHBondContact O-N 3.41Å; Q224-S226 PolarHBondContact O-N 3.49Å
225	I	47.7	Very low	49.6	Very low	127 Å²	127	117.8 Å²	117.8	65%	0.651	67%	0.671	S	S	*	*			trans	-65.9	106.2	-177.3	-57	175.8	0	0	0	110.1	A223 F227	A223-I225 VanDerWaalsContact C-N 3.34Å; A223-I225 PolarHBondContact O-N 2.87Å; I225-F227 PolarHBondContact O-N 3.12Å
226	S	49.3	Very low	51	Low	87 Å²	87	117.9 Å²	117.9	61%	0.608	68%	0.678	S	S	*	*			trans	-78.5	119.1	173.4	66.7	0	0	0	0	111.2	Q224 V228	Q224-S226 PolarHBondContact O-N 3.49Å; S226-V228 PolarHBondContact O-N 3.33Å
227	F	48.1	Very low	52.1	Low	195 Å²	195	114 Å²	114	86%	0.855	68%	0.676	S	S	*	*			trans	-77.8	62.1	176.5	-66.7	-80.9	0	0	0	112.7	I225	I225-F227 PolarHBondContact O-N 3.12Å
228	V	56.7	Low	53.1	Low	88 Å²	88	114.4 Å²	114.4	53%	0.533	66%	0.66	S	S	.	*			trans	-85.6	128.2	166.7	-177.3	0	0	0	0	108.3	S226 K230	S226-V228 PolarHBondContact O-N 3.33Å; V228-K230 PolarHBondContact O-N 3.01Å; V228-K230 VanDerWaalsContact O-N 3.07Å
229	A	52	Low	53.9	Low	90 Å²	90	114.4 Å²	114.4	74%	0.744	66%	0.66	S	S	*	*			trans	-59	113.3	179.2	0	0	0	0	0	110.6	T231	A229-T231 PolarHBondContact O-N 3.16Å
230	K	54.7	Low	54.8	Low	72 Å²	72	113.4 Å²	113.4	31%	0.313	65%	0.654	S	S	.	*			trans	-78.3	117	-171.2	-165.6	166.2	-172.1	176.2	0	110.7	V228 N232 F234 G235 L236 Y238	V228-K230 PolarHBondContact O-N 3.01Å; V228-K230 VanDerWaalsContact O-N 3.07Å; K230-N232 WeakPolarHBondContact CE-OD1 3.32Å; K230-N232 WeakPolarHBondContact CG-OD1 3.39Å; K230-F234 WeakPolarHBondContact CD-O 3.39Å; K230-F234 WeakPolarHBondContact CE-O 3.41Å; K230-F234 PolarHBondContact NZ-O 3.23Å; K230-G235 PolarHBondContact NZ-O 3.48Å; K230-L236 HydrophobicContact CB-CD2 4.29Å; K230-L236 HydrophobicContact CD-CD2 4.41Å; K230-Y238 PolarHBondContact NZ-O 3.24Å
231	T	60.1	Low	56.2	Low	141 Å²	141	116.6 Å²	116.6	87%	0.865	67%	0.667	S	S	*	*			trans	-94.5	-1.7	-174.9	50.6	0	0	0	0	114.1	A229	A229-T231 PolarHBondContact O-N 3.16Å
232	N	64.7	Low	57.3	Low	79 Å²	79	110.4 Å²	110.4	42%	0.422	64%	0.638	S	S	.	*	S	Bend	trans	-113.9	145	-179.9	49.4	-16.9	0	0	0	111.7	K230 F234	K230-N232 WeakPolarHBondContact CE-OD1 3.32Å; K230-N232 WeakPolarHBondContact CG-OD1 3.39Å; N232-F234 PolarHBondContact O-N 3.47Å
233	T	72.6	Confident	58.3	Low	133 Å²	133	107.7 Å²	107.7	82%	0.816	63%	0.634	S	S	*	*	S	Bend	trans	-72.3	-6.2	-170.8	48.5	0	0	0	0	115.4
234	F	62.8	Low	59.3	Low	97 Å²	97	107.7 Å²	107.7	43%	0.425	62%	0.619	S	S	.	*	S	Bend	trans	-77.4	132.4	173.6	-56.2	-75.6	0	0	0	110.4	K230 N232 Y238	K230-F234 WeakPolarHBondContact CD-O 3.39Å; K230-F234 WeakPolarHBondContact CE-O 3.41Å; K230-F234 PolarHBondContact NZ-O 3.23Å; N232-F234 PolarHBondContact O-N 3.47Å; F234-Y238 HydrophobicContact CB-CD1 3.43Å; F234-Y238 VanDerWaalsContact CB-CD1 3.43Å; F234-Y238 HydrophobicContact CB-CE1 4.07Å; F234-Y238 HydrophobicContact CB-CG 3.85Å; F234-Y238 HydrophobicContact CD1-CD1 4.23Å; F234-Y238 HydrophobicContact CD1-CE1 4.02Å; F234-Y238 HydrophobicContact CD2-CD1 4.41Å; F234-Y238 HydrophobicContact CD2-CE1 4.39Å; F234-Y238 AromaticContact CG-CD1 3.79Å; F234-Y238 HydrophobicContact CG-CD1 3.79Å; F234-Y238 AromaticContact CG-CE1 3.91Å; F234-Y238 HydrophobicContact CG-CE1 3.91Å
235	G	61.6	Low	60.3	Low	52 Å²	52	102.6 Å²	102.6	54%	0.536	60%	0.596	S	S	.	*	P	Polyproline II helix	trans	-50.4	159.2	-170.9	0	0	0	0	0	115.9	K230 G237 Y238	K230-G235 PolarHBondContact NZ-O 3.48Å; G235-G237 PolarHBondContact O-N 2.99Å; G235-Y238 VanDerWaalsContact O-CB 3.24Å; G235-Y238 WeakPolarHBondContact O-CB 3.27Å; G235-Y238 PolarHBondContact O-N 3.46Å
236	L	62.1	Low	61.1	Low	160 Å²	160	99.5 Å²	99.5	84%	0.838	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.1	135.1	178.2	-70.3	167.9	0	0	0	110.9	K230 Y238	K230-L236 HydrophobicContact CB-CD2 4.29Å; K230-L236 HydrophobicContact CD-CD2 4.41Å; L236-Y238 VanDerWaalsContact C-N 3.29Å; L236-Y238 PolarHBondContact O-N 3.32Å
237	G	57.7	Low	62.2	Low	77 Å²	77	100.8 Å²	100.8	79%	0.794	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	80.6	-13.9	-174.5	0	0	0	0	0	116.4	G235 S239	G235-G237 PolarHBondContact O-N 2.99Å; G237-S239 PolarHBondContact O-N 2.85Å; G237-S239 VanDerWaalsContact O-N 3.15Å
238	Y	57.2	Low	62.9	Low	127 Å²	127	94.4 Å²	94.4	50%	0.498	58%	0.577	S	S	.	*			trans	-67.6	114.2	177	-175.9	-90.3	0	0	0	112.2	K230 F234 G235 L236 P240	K230-Y238 PolarHBondContact NZ-O 3.24Å; F234-Y238 HydrophobicContact CB-CD1 3.43Å; F234-Y238 VanDerWaalsContact CB-CD1 3.43Å; F234-Y238 HydrophobicContact CB-CE1 4.07Å; F234-Y238 HydrophobicContact CB-CG 3.85Å; F234-Y238 HydrophobicContact CD1-CD1 4.23Å; F234-Y238 HydrophobicContact CD1-CE1 4.02Å; F234-Y238 HydrophobicContact CD2-CD1 4.41Å; F234-Y238 HydrophobicContact CD2-CE1 4.39Å; F234-Y238 AromaticContact CG-CD1 3.79Å; F234-Y238 HydrophobicContact CG-CD1 3.79Å; F234-Y238 AromaticContact CG-CE1 3.91Å; F234-Y238 HydrophobicContact CG-CE1 3.91Å; G235-Y238 VanDerWaalsContact O-CB 3.24Å; G235-Y238 WeakPolarHBondContact O-CB 3.27Å; G235-Y238 PolarHBondContact O-N 3.46Å; L236-Y238 VanDerWaalsContact C-N 3.29Å; L236-Y238 PolarHBondContact O-N 3.32Å; Y238-P240 HydrophobicContact CE1-CB 4.35Å
239	S	57.1	Low	63.6	Low	90 Å²	90	98.9 Å²	98.9	63%	0.629	58%	0.584	S	S	*	*			trans	-107.6	140.5	158.4	50.3	0	0	0	0	109.5	G237	G237-S239 PolarHBondContact O-N 2.85Å; G237-S239 VanDerWaalsContact O-N 3.15Å
240	P	61.4	Low	64.1	Low	100 Å²	100	99.9 Å²	99.9	65%	0.649	57%	0.569	S	S	*	*			trans	-71	147.3	175.4	30.4	-34.2	0	0	0	111	Y238 D242	Y238-P240 HydrophobicContact CE1-CB 4.35Å; P240-D242 PolarHBondContact O-N 3.39Å
241	L	67.4	Low	64	Low	146 Å²	146	104 Å²	104	76%	0.764	59%	0.587	S	S	*	*			trans	-72.4	116.7	-179.4	-156.8	76.5	0	0	0	110.4	P243 A246	L241-P243 WeakPolarHBondContact O-CD 3.4Å; L241-A246 HydrophobicContact CD2-CB 3.71Å; L241-A246 HydrophobicContact CG-CB 4.1Å
242	D	67.8	Low	63.9	Low	61 Å²	61	102 Å²	102	33%	0.326	57%	0.57	S	S	.	*			trans	-64.3	114.4	-176.4	-178.2	14.8	0	0	0	111.1	P240 E244 I245 A246 R250	P240-D242 PolarHBondContact O-N 3.39Å; D242-E244 VanDerWaalsContact C-N 3.25Å; D242-E244 PolarHBondContact O-N 3.36Å; D242-E244 VanDerWaalsContact O-N 3.16Å; D242-I245 HydrophobicContact CB-CB 4.44Å; D242-I245 HydrophobicContact CB-CD1 4.12Å; D242-I245 HydrophobicContact CB-CG1 4.25Å; D242-I245 PolarHBondContact O-N 2.83Å; D242-I245 WeakPolarHBondContact OD2-CD1 3.49Å; D242-I245 WeakPolarHBondContact OD2-CG1 3.22Å; D242-A246 PolarHBondContact O-N 3.39Å; D242-R250 IonicContact OD1-NH2 3.49Å; D242-R250 PolarHBondContact OD1-NH2 2.76Å; D242-R250 IonicContact OD2-CZ 2.71Å; D242-R250 IonicContact OD2-NH1 2.81Å; D242-R250 PolarHBondContact OD2-NH1 3.05Å; D242-R250 IonicContact OD2-NH2 3.69Å; D242-R250 PolarHBondContact OD2-NH2 2.74Å
243	P	69.1	Low	63.2	Low	76 Å²	76	102.9 Å²	102.9	49%	0.494	58%	0.575	S	S	.	*	H	α-helix	trans	-65.4	-23.8	-166.8	23.8	-35.1	0	0	0	114	L241 M247	L241-P243 WeakPolarHBondContact O-CD 3.4Å; P243-M247 HydrophobicContact CB-CE 3.98Å; P243-M247 VanDerWaalsContact O-CB 3.22Å; P243-M247 WeakPolarHBondContact O-CB 3.39Å; P243-M247 WeakPolarHBondContact O-CE 3.49Å; P243-M247 WeakPolarHBondContact O-CG 3.49Å; P243-M247 PolarHBondContact O-N 3Å
244	E	69	Low	62.2	Low	87 Å²	87	101.5 Å²	101.5	41%	0.407	57%	0.571	S	S	.	*	H	α-helix	trans	-76.8	-30.4	175.5	-64.8	-174	166.9	0	0	112.9	D242 G248 R249 R250	D242-E244 VanDerWaalsContact C-N 3.25Å; D242-E244 PolarHBondContact O-N 3.36Å; D242-E244 VanDerWaalsContact O-N 3.16Å; E244-G248 CarbonylContact O-C 3.09Å; E244-G248 PolarHBondContact O-N 3.05Å; E244-R249 HydrophobicContact CB-CB 4.22Å; E244-R249 PolarHBondContact O-N 3.28Å; E244-R250 HydrophobicContact CB-CB 4.39Å; E244-R250 PolarHBondContact O-N 3.29Å; E244-R250 VanDerWaalsContact O-N 3.07Å; E244-R250 IonicContact OE2-CZ 3.56Å; E244-R250 IonicContact OE2-NE 3.13Å; E244-R250 PolarHBondContact OE2-NE 3.19Å; E244-R250 IonicContact OE2-NH2 3.55Å; E244-R250 PolarHBondContact OE2-NH2 2.84Å
245	I	68	Low	61.5	Low	69 Å²	69	102.9 Å²	102.9	35%	0.354	58%	0.582	S	S	.	*	H	α-helix	trans	-76	-46.1	172.3	-57.8	178.3	0	0	0	108.8	D242 M247 G248 I260	D242-I245 HydrophobicContact CB-CB 4.44Å; D242-I245 HydrophobicContact CB-CD1 4.12Å; D242-I245 HydrophobicContact CB-CG1 4.25Å; D242-I245 PolarHBondContact O-N 2.83Å; D242-I245 WeakPolarHBondContact OD2-CD1 3.49Å; D242-I245 WeakPolarHBondContact OD2-CG1 3.22Å; I245-M247 VanDerWaalsContact C-N 3.34Å; I245-M247 PolarHBondContact O-N 3.34Å; I245-G248 PolarHBondContact O-N 2.93Å; I245-I260 HydrophobicContact CD1-CD1 4.26Å
246	A	64.1	Low	60.8	Low	63 Å²	63	103.3 Å²	103.3	52%	0.521	57%	0.572	S	S	.	*	H	α-helix	trans	-62.8	-35	179.2	0	0	0	0	0	113.6	L241 D242	L241-A246 HydrophobicContact CD2-CB 3.71Å; L241-A246 HydrophobicContact CG-CB 4.1Å; D242-A246 PolarHBondContact O-N 3.39Å
247	M	71.9	Confident	60.1	Low	113 Å²	113	97.5 Å²	97.5	56%	0.557	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	1.7	172.1	-70.1	-171.3	-86.6	0	0	114	P243 I245 R249	P243-M247 HydrophobicContact CB-CE 3.98Å; P243-M247 VanDerWaalsContact O-CB 3.22Å; P243-M247 WeakPolarHBondContact O-CB 3.39Å; P243-M247 WeakPolarHBondContact O-CE 3.49Å; P243-M247 WeakPolarHBondContact O-CG 3.49Å; P243-M247 PolarHBondContact O-N 3Å; I245-M247 VanDerWaalsContact C-N 3.34Å; I245-M247 PolarHBondContact O-N 3.34Å; M247-R249 HydrophobicContact CB-CG 4.04Å; M247-R249 PolarHBondContact O-N 2.64Å; M247-R249 PolarHBondContact SD-NH2 2.87Å; M247-R249 VanDerWaalsContact SD-NH2 3.36Å
248	G	63.7	Low	59.4	Low	61 Å²	61	100.3 Å²	100.3	63%	0.629	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	24.3	-179.8	0	0	0	0	0	115	E244 I245	E244-G248 CarbonylContact O-C 3.09Å; E244-G248 PolarHBondContact O-N 3.05Å; I245-G248 PolarHBondContact O-N 2.93Å
249	R	70.6	Confident	58.9	Low	182 Å²	182	97.9 Å²	97.9	69%	0.687	54%	0.536	S	S	*	.	S	Bend	trans	-76.6	-31.3	174.6	-58.7	-177.8	-172.5	-130.8	3.5	111.7	E244 M247	E244-R249 HydrophobicContact CB-CB 4.22Å; E244-R249 PolarHBondContact O-N 3.28Å; M247-R249 HydrophobicContact CB-CG 4.04Å; M247-R249 PolarHBondContact O-N 2.64Å; M247-R249 PolarHBondContact SD-NH2 2.87Å; M247-R249 VanDerWaalsContact SD-NH2 3.36Å
250	R	62	Low	58.4	Low	111 Å²	111	97.9 Å²	97.9	42%	0.419	53%	0.528	S	S	.	.	S	Bend	trans	-105.6	141.6	169	-116.6	-175.9	-66.3	124	-3.8	109.8	D242 E244	D242-R250 IonicContact OD1-NH2 3.49Å; D242-R250 PolarHBondContact OD1-NH2 2.76Å; D242-R250 IonicContact OD2-CZ 2.71Å; D242-R250 IonicContact OD2-NH1 2.81Å; D242-R250 PolarHBondContact OD2-NH1 3.05Å; D242-R250 IonicContact OD2-NH2 3.69Å; D242-R250 PolarHBondContact OD2-NH2 2.74Å; E244-R250 HydrophobicContact CB-CB 4.39Å; E244-R250 PolarHBondContact O-N 3.29Å; E244-R250 VanDerWaalsContact O-N 3.07Å; E244-R250 IonicContact OE2-CZ 3.56Å; E244-R250 IonicContact OE2-NE 3.13Å; E244-R250 PolarHBondContact OE2-NE 3.19Å; E244-R250 IonicContact OE2-NH2 3.55Å; E244-R250 PolarHBondContact OE2-NH2 2.84Å
251	K	54.1	Low	57.6	Low	159 Å²	159	103.3 Å²	103.3	69%	0.691	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-100.6	130.8	174	-162.9	180	-174.3	-176.7	0	108.7	N253	K251-N253 PolarHBondContact O-N 3.12Å
252	L	56.9	Low	56.6	Low	98 Å²	98	99.1 Å²	99.1	51%	0.513	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-69.7	123.8	179.7	-172.1	72.1	0	0	0	110.7	D256 I260	L252-D256 HydrophobicContact CD1-CB 3.71Å; L252-I260 HydrophobicContact CD1-CD1 3.44Å; L252-I260 VanDerWaalsContact CD1-CD1 3.44Å
253	N	50.5	Low	55.1	Low	98 Å²	98	101.6 Å²	101.6	52%	0.524	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-92	160.6	169.3	-50.7	-74.8	0	0	0	110.1	K251 N255 D256	K251-N253 PolarHBondContact O-N 3.12Å; N253-N255 PolarHBondContact O-N 3.21Å; N253-N255 VanDerWaalsContact O-N 3.13Å; N253-D256 VanDerWaalsContact CB-OD2 3.27Å; N253-D256 WeakPolarHBondContact CB-OD2 3.48Å; N253-D256 PolarHBondContact N-OD2 3.29Å; N253-D256 PolarHBondContact ND2-OD2 2.97Å; N253-D256 PolarHBondContact O-N 3.25Å; N253-D256 VanDerWaalsContact O-N 3.16Å
254	S	51.3	Low	53.9	Low	104 Å²	104	105.9 Å²	105.9	73%	0.727	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-31	-179.9	47.4	0	0	0	0	113.9
255	N	47.4	Very low	52.5	Low	126 Å²	126	106.8 Å²	106.8	67%	0.674	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-23.9	-174.2	-54.3	10.6	0	0	0	111.4	N253 A257	N253-N255 PolarHBondContact O-N 3.21Å; N253-N255 VanDerWaalsContact O-N 3.13Å; N255-A257 PolarHBondContact O-N 3.32Å
256	D	48.5	Very low	51.5	Low	61 Å²	61	108.1 Å²	108.1	33%	0.326	56%	0.555	S	S	.	*	H	α-helix	trans	-72.8	-15.6	178.2	-50.6	-22.4	0	0	0	111.7	L252 N253 D259 I260	L252-D256 HydrophobicContact CD1-CB 3.71Å; N253-D256 VanDerWaalsContact CB-OD2 3.27Å; N253-D256 WeakPolarHBondContact CB-OD2 3.48Å; N253-D256 PolarHBondContact N-OD2 3.29Å; N253-D256 PolarHBondContact ND2-OD2 2.97Å; N253-D256 PolarHBondContact O-N 3.25Å; N253-D256 VanDerWaalsContact O-N 3.16Å; D256-D259 PolarHBondContact O-N 2.99Å; D256-I260 WeakPolarHBondContact O-CG1 3.29Å; D256-I260 PolarHBondContact O-N 3.5Å
257	A	45.5	Very low	50.6	Low	39 Å²	39	112.3 Å²	112.3	32%	0.322	56%	0.564	S	S	.	*	H	α-helix	trans	-70.8	-39.9	-174.9	0	0	0	0	0	113.2	N255 D259	N255-A257 PolarHBondContact O-N 3.32Å; A257-D259 VanDerWaalsContact C-N 3.35Å
258	E	44.6	Very low	49.4	Very low	136 Å²	136	113.1 Å²	113.1	64%	0.636	57%	0.567	S	S	*	*	H	α-helix	trans	-69.1	-37.9	170.5	-65.3	-62.4	138.9	0	0	110.5	I260 W261 S262	E258-I260 VanDerWaalsContact C-N 3.33Å; E258-I260 PolarHBondContact O-N 3.21Å; E258-W261 PolarHBondContact O-N 3.09Å; E258-W261 VanDerWaalsContact O-N 3.13Å; E258-S262 PolarHBondContact O-N 3.35Å
259	D	45	Very low	48.6	Very low	76 Å²	76	112.3 Å²	112.3	41%	0.406	55%	0.551	S	S	.	*	H	α-helix	trans	-74.2	-19.3	-175.7	-94.4	4.9	0	0	0	114.5	D256 A257 W261 S262 N263	D256-D259 PolarHBondContact O-N 2.99Å; A257-D259 VanDerWaalsContact C-N 3.35Å; D259-W261 PolarHBondContact O-N 2.92Å; D259-S262 WeakPolarHBondContact CA-OG 3.31Å; D259-S262 PolarHBondContact O-N 3.01Å; D259-S262 PolarHBondContact OD1-OG 2.83Å; D259-N263 WeakPolarHBondContact CB-ND2 3.38Å; D259-N263 WeakPolarHBondContact O-CB 3.35Å; D259-N263 PolarHBondContact O-N 3.04Å; D259-N263 PolarHBondContact OD2-ND2 3.39Å
260	I	47.4	Very low	47.8	Very low	90 Å²	90	111 Å²	111	46%	0.462	56%	0.556	S	S	.	*	H	α-helix	trans	-61.4	-23.7	167.9	-83.1	170.2	0	0	0	112.7	I245 L252 D256 E258	I245-I260 HydrophobicContact CD1-CD1 4.26Å; L252-I260 HydrophobicContact CD1-CD1 3.44Å; L252-I260 VanDerWaalsContact CD1-CD1 3.44Å; D256-I260 WeakPolarHBondContact O-CG1 3.29Å; D256-I260 PolarHBondContact O-N 3.5Å; E258-I260 VanDerWaalsContact C-N 3.33Å; E258-I260 PolarHBondContact O-N 3.21Å
261	W	44.6	Very low	47.5	Very low	213 Å²	213	109.5 Å²	109.5	81%	0.807	56%	0.563	S	S	*	*	H	α-helix	trans	-100.9	-13.7	175	-63.1	-37.1	0	0	0	113.7	E258 D259	E258-W261 PolarHBondContact O-N 3.09Å; E258-W261 VanDerWaalsContact O-N 3.13Å; D259-W261 PolarHBondContact O-N 2.92Å
262	S	45.5	Very low	47.8	Very low	59 Å²	59	103.2 Å²	103.2	41%	0.413	54%	0.541	S	S	.	.	H	α-helix	trans	-103.2	-39.2	-174	89.2	0	0	0	0	114	E258 D259 R264	E258-S262 PolarHBondContact O-N 3.35Å; D259-S262 WeakPolarHBondContact CA-OG 3.31Å; D259-S262 PolarHBondContact O-N 3.01Å; D259-S262 PolarHBondContact OD1-OG 2.83Å; S262-R264 PolarHBondContact O-N 3.36Å
263	N	38.2	Very low	47.8	Very low	113 Å²	113	102.9 Å²	102.9	60%	0.604	54%	0.539	S	S	*	.			trans	-88.4	106.3	-160.9	-85.8	-29.4	0	0	0	113.5	D259	D259-N263 WeakPolarHBondContact CB-ND2 3.38Å; D259-N263 WeakPolarHBondContact O-CB 3.35Å; D259-N263 PolarHBondContact O-N 3.04Å; D259-N263 PolarHBondContact OD2-ND2 3.39Å
264	R	43	Very low	48.4	Very low	166 Å²	166	102.5 Å²	102.5	63%	0.626	54%	0.536	S	S	*	.			trans	-56.3	140.1	159.5	-84.1	166.9	-102.6	-93.1	-8.4	110.6	S262	S262-R264 PolarHBondContact O-N 3.36Å
265	H	38.9	Very low	48.9	Very low	106 Å²	106	103.6 Å²	103.6	49%	0.491	53%	0.53	S	S	.	.			trans	-57.2	136.3	169.7	-171.9	-108	0	0	0	110	E267 E268	H265-E267 PolarHBondContact O-N 3.49Å; H265-E267 VanDerWaalsContact O-N 3.14Å; H265-E268 HydrophobicContact CB-CB 4.48Å; H265-E268 HydrophobicContact CB-CG 4.19Å; H265-E268 WeakPolarHBondContact O-CA 3.37Å; H265-E268 PolarHBondContact O-N 3.27Å
266	P	47.3	Very low	49.4	Very low	97 Å²	97	106.2 Å²	106.2	63%	0.63	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-60.9	-29.2	-173.3	21.1	-33	0	0	0	113.5	E268 S269	P266-E268 PolarHBondContact O-N 3.13Å; P266-S269 VanDerWaalsContact O-CB 3.3Å; P266-S269 WeakPolarHBondContact O-CB 3.24Å; P266-S269 PolarHBondContact O-N 3.18Å; P266-S269 PolarHBondContact O-OG 2.98Å
267	E	45.3	Very low	50.1	Low	150 Å²	150	108.2 Å²	108.2	70%	0.701	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-78.1	-4.6	175.7	-52.6	-171.2	-178.8	0	0	114	H265 A272	H265-E267 PolarHBondContact O-N 3.49Å; H265-E267 VanDerWaalsContact O-N 3.14Å; E267-A272 WeakPolarHBondContact O-CB 3.49Å
268	E	46.6	Very low	50.8	Low	131 Å²	131	111 Å²	111	61%	0.612	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-104	6.2	171.2	-60.4	-168.5	148.5	0	0	112.6	H265 P266	H265-E268 HydrophobicContact CB-CB 4.48Å; H265-E268 HydrophobicContact CB-CG 4.19Å; H265-E268 WeakPolarHBondContact O-CA 3.37Å; H265-E268 PolarHBondContact O-N 3.27Å; P266-E268 PolarHBondContact O-N 3.13Å
269	S	48.3	Very low	51.5	Low	44 Å²	44	110.5 Å²	110.5	31%	0.308	54%	0.54	S	S	.	.	S	Bend	trans	-59.5	152.4	170.3	62.5	0	0	0	0	111.7	P266 S271 A272 L273	P266-S269 VanDerWaalsContact O-CB 3.3Å; P266-S269 WeakPolarHBondContact O-CB 3.24Å; P266-S269 PolarHBondContact O-N 3.18Å; P266-S269 PolarHBondContact O-OG 2.98Å; S269-S271 PolarHBondContact O-N 3.45Å; S269-S271 VanDerWaalsContact O-N 3.15Å; S269-A272 PolarHBondContact O-N 3.11Å; S269-A272 WeakPolarHBondContact OG-CB 3.39Å; S269-A272 PolarHBondContact OG-N 3.17Å; S269-L273 PolarHBondContact O-N 2.82Å
270	I	52	Low	51.8	Low	154 Å²	154	112.7 Å²	112.7	79%	0.79	55%	0.55	S	S	*	.	H	α-helix	trans	-54.3	-37.5	176.9	-60.6	172.6	0	0	0	110.5	L273 L274	I270-L273 PolarHBondContact O-N 3.45Å; I270-L274 WeakPolarHBondContact O-CB 3.44Å; I270-L274 PolarHBondContact O-N 2.91Å
271	S	57.1	Low	51.9	Low	79 Å²	79	118.1 Å²	118.1	55%	0.552	57%	0.565	S	S	*	*	H	α-helix	trans	-63.8	-42.6	175.1	-51.5	0	0	0	0	113.2	S269 L274 H275	S269-S271 PolarHBondContact O-N 3.45Å; S269-S271 VanDerWaalsContact O-N 3.15Å; S271-L274 PolarHBondContact O-N 2.81Å; S271-H275 PolarHBondContact O-N 3.27Å; S271-H275 VanDerWaalsContact O-N 3.09Å; S271-H275 PolarHBondContact O-ND1 3.1Å
272	A	60.1	Low	52.2	Low	28 Å²	28	114 Å²	114	23%	0.231	56%	0.559	C	S	.	*	H	α-helix	trans	-71.1	-36.7	175.8	0	0	0	0	0	112	E267 S269 L274 H275 R276	E267-A272 WeakPolarHBondContact O-CB 3.49Å; S269-A272 PolarHBondContact O-N 3.11Å; S269-A272 WeakPolarHBondContact OG-CB 3.39Å; S269-A272 PolarHBondContact OG-N 3.17Å; A272-L274 VanDerWaalsContact C-N 3.34Å; A272-L274 PolarHBondContact O-N 3.26Å; A272-H275 PolarHBondContact O-N 3.23Å; A272-R276 WeakPolarHBondContact O-CB 3.38Å; A272-R276 PolarHBondContact O-N 2.94Å
273	L	56.3	Low	52	Low	90 Å²	90	117.1 Å²	117.1	47%	0.471	57%	0.567	S	S	.	*	H	α-helix	trans	-64.7	-37.8	173.8	-164.6	151.8	0	0	0	111.4	S269 I270 R276 Q277	S269-L273 PolarHBondContact O-N 2.82Å; I270-L273 PolarHBondContact O-N 3.45Å; L273-R276 PolarHBondContact O-N 2.74Å; L273-Q277 HydrophobicContact CD2-CG 4.13Å; L273-Q277 WeakPolarHBondContact O-CG 3.42Å; L273-Q277 PolarHBondContact O-N 3.42Å
274	L	64	Low	51.9	Low	90 Å²	90	119.3 Å²	119.3	47%	0.471	58%	0.578	S	S	.	*	H	α-helix	trans	-63.4	-45.8	172.2	-169.8	73.8	0	0	0	111.8	I270 S271 A272 R276 Q277 Q278	I270-L274 WeakPolarHBondContact O-CB 3.44Å; I270-L274 PolarHBondContact O-N 2.91Å; S271-L274 PolarHBondContact O-N 2.81Å; A272-L274 VanDerWaalsContact C-N 3.34Å; A272-L274 PolarHBondContact O-N 3.26Å; L274-R276 VanDerWaalsContact C-N 3.31Å; L274-R276 PolarHBondContact O-N 2.83Å; L274-Q277 PolarHBondContact O-N 3.16Å; L274-Q278 WeakPolarHBondContact O-CG 3.43Å; L274-Q278 PolarHBondContact O-N 3.05Å
275	H	60.7	Low	51.7	Low	127 Å²	127	120.3 Å²	120.3	59%	0.588	59%	0.59	S	S	*	*	H	α-helix	trans	-61.7	-38.7	174	-78.1	78.4	0	0	0	111.8	S271 A272 Q278 K279	S271-H275 PolarHBondContact O-N 3.27Å; S271-H275 VanDerWaalsContact O-N 3.09Å; S271-H275 PolarHBondContact O-ND1 3.1Å; A272-H275 PolarHBondContact O-N 3.23Å; H275-Q278 PolarHBondContact O-N 2.83Å; H275-K279 WeakPolarHBondContact O-CB 3.31Å; H275-K279 PolarHBondContact O-N 2.87Å
276	R	59.5	Low	51.4	Low	181 Å²	181	124 Å²	124	68%	0.683	61%	0.605	S	S	*	*	H	α-helix	trans	-66.5	-40.4	175.6	-169.9	174.1	-179.3	174.6	0.9	112	A272 L273 L274 K279 I280	A272-R276 WeakPolarHBondContact O-CB 3.38Å; A272-R276 PolarHBondContact O-N 2.94Å; L273-R276 PolarHBondContact O-N 2.74Å; L274-R276 VanDerWaalsContact C-N 3.31Å; L274-R276 PolarHBondContact O-N 2.83Å; R276-K279 PolarHBondContact O-N 3.26Å; R276-I280 HydrophobicContact CG-CD1 3.92Å; R276-I280 WeakPolarHBondContact O-CB 3.28Å; R276-I280 WeakPolarHBondContact O-CD1 3.49Å; R276-I280 VanDerWaalsContact O-CG1 3.23Å; R276-I280 WeakPolarHBondContact O-CG1 3.48Å; R276-I280 PolarHBondContact O-N 2.8Å
277	Q	62.5	Low	51.1	Low	104 Å²	104	125 Å²	125	49%	0.486	61%	0.605	S	S	.	*	H	α-helix	trans	-65.4	-36.5	172.6	-77	-174.2	-1.8	0	0	112.6	L273 L274 R281	L273-Q277 HydrophobicContact CD2-CG 4.13Å; L273-Q277 WeakPolarHBondContact O-CG 3.42Å; L273-Q277 PolarHBondContact O-N 3.42Å; L274-Q277 PolarHBondContact O-N 3.16Å; Q277-R281 WeakPolarHBondContact O-CB 3.5Å; Q277-R281 WeakPolarHBondContact O-CG 3.42Å; Q277-R281 PolarHBondContact O-N 3.34Å
278	Q	59.9	Low	51.5	Low	97 Å²	97	125 Å²	125	45%	0.453	61%	0.609	S	S	.	*	H	α-helix	trans	-67.5	-41	173.4	-73.1	175.4	-7.2	0	0	111.7	L274 H275 R281 N282	L274-Q278 WeakPolarHBondContact O-CG 3.43Å; L274-Q278 PolarHBondContact O-N 3.05Å; H275-Q278 PolarHBondContact O-N 2.83Å; Q278-R281 PolarHBondContact O-N 2.75Å; Q278-N282 PolarHBondContact O-N 2.74Å; Q278-N282 PolarHBondContact O-ND2 2.88Å; Q278-N282 PolarHBondContact O-OD1 3.01Å
279	K	58.9	Low	51.5	Low	126 Å²	126	128 Å²	128	55%	0.548	62%	0.62	S	S	.	*	H	α-helix	trans	-63.4	-48	174.7	-167.3	175.6	-178.3	-177.8	0	112	H275 R276 R281 N282 E283	H275-K279 WeakPolarHBondContact O-CB 3.31Å; H275-K279 PolarHBondContact O-N 2.87Å; R276-K279 PolarHBondContact O-N 3.26Å; K279-R281 PolarHBondContact O-N 2.94Å; K279-N282 PolarHBondContact O-N 2.86Å; K279-E283 VanDerWaalsContact CE-CD 3.49Å; K279-E283 WeakPolarHBondContact CE-OE1 3.42Å; K279-E283 WeakPolarHBondContact CE-OE2 3.37Å; K279-E283 VanDerWaalsContact CG-OE1 3.28Å; K279-E283 WeakPolarHBondContact CG-OE1 3.38Å; K279-E283 IonicContact NZ-OE1 3.96Å; K279-E283 PolarHBondContact O-N 3.43Å
280	I	52.5	Low	51.1	Low	121 Å²	121	130.5 Å²	130.5	62%	0.621	64%	0.638	S	S	*	*	H	α-helix	trans	-61.4	-27.1	176.3	-69.2	166.9	0	0	0	112.2	R276	R276-I280 HydrophobicContact CG-CD1 3.92Å; R276-I280 WeakPolarHBondContact O-CB 3.28Å; R276-I280 WeakPolarHBondContact O-CD1 3.49Å; R276-I280 VanDerWaalsContact O-CG1 3.23Å; R276-I280 WeakPolarHBondContact O-CG1 3.48Å; R276-I280 PolarHBondContact O-N 2.8Å
281	R	49.2	Very low	50.5	Low	204 Å²	204	126.7 Å²	126.7	77%	0.77	64%	0.636	S	S	*	*	H	α-helix	trans	-78.9	-17.1	173.7	-87.7	-179.5	162.5	163.9	-3.4	114.9	Q277 Q278 K279	Q277-R281 WeakPolarHBondContact O-CB 3.5Å; Q277-R281 WeakPolarHBondContact O-CG 3.42Å; Q277-R281 PolarHBondContact O-N 3.34Å; Q278-R281 PolarHBondContact O-N 2.75Å; K279-R281 PolarHBondContact O-N 2.94Å
282	N	49.8	Very low	50.2	Low	128 Å²	128	130.2 Å²	130.2	68%	0.684	65%	0.648	S	S	*	*	H	α-helix	trans	-103	-19.3	-174.6	-67.9	-8.2	0	0	0	113	Q278 K279	Q278-N282 PolarHBondContact O-N 2.74Å; Q278-N282 PolarHBondContact O-ND2 2.88Å; Q278-N282 PolarHBondContact O-OD1 3.01Å; K279-N282 PolarHBondContact O-N 2.86Å
283	E	42.3	Very low	49.3	Very low	124 Å²	124	138 Å²	138	58%	0.579	68%	0.677	S	S	*	*			trans	-103.6	89.1	-178.2	-73.8	168.5	-145.6	0	0	110.5	K279 E285	K279-E283 VanDerWaalsContact CE-CD 3.49Å; K279-E283 WeakPolarHBondContact CE-OE1 3.42Å; K279-E283 WeakPolarHBondContact CE-OE2 3.37Å; K279-E283 VanDerWaalsContact CG-OE1 3.28Å; K279-E283 WeakPolarHBondContact CG-OE1 3.38Å; K279-E283 IonicContact NZ-OE1 3.96Å; K279-E283 PolarHBondContact O-N 3.43Å; E283-E285 VanDerWaalsContact C-N 3.3Å; E283-E285 PolarHBondContact O-N 2.83Å
284	N	35.5	Very low	49	Very low	159 Å²	159	142.5 Å²	142.5	85%	0.85	69%	0.687	S	S	*	*			trans	-75.3	60	-173.9	-73.7	-49.4	0	0	0	114.4
285	E	38.6	Very low	48	Very low	187 Å²	187	148.6 Å²	148.6	87%	0.874	70%	0.704	S	S	*	*			trans	-148.3	89.5	173.2	-160.6	160.8	-156	0	0	112.6	E283	E283-E285 VanDerWaalsContact C-N 3.3Å; E283-E285 PolarHBondContact O-N 2.83Å
286	F	33.6	Very low	47.2	Very low	182 Å²	182	145.4 Å²	145.4	80%	0.798	71%	0.706	S	S	*	*			trans	-143.5	90.8	175.5	-160	-89.9	0	0	0	111.1	L288	F286-L288 HydrophobicContact CD1-CD1 4.29Å; F286-L288 HydrophobicContact CD1-CG 4.39Å; F286-L288 HydrophobicContact CE1-CG 4.37Å
287	D	41.3	Very low	46.8	Very low	118 Å²	118	145 Å²	145	63%	0.631	72%	0.715	S	S	*	*			trans	-94.5	120.2	179	-168.7	-0.6	0	0	0	110.8	K289	D287-K289 PolarHBondContact O-N 3.34Å
288	L	52	Low	46.3	Very low	152 Å²	152	144.6 Å²	144.6	80%	0.796	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	17.1	-169.2	-71.9	89.2	0	0	0	114.3	F286	F286-L288 HydrophobicContact CD1-CD1 4.29Å; F286-L288 HydrophobicContact CD1-CG 4.39Å; F286-L288 HydrophobicContact CE1-CG 4.37Å
289	K	47.9	Very low	45.8	Very low	193 Å²	193	142.5 Å²	142.5	84%	0.839	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	3.7	-176.4	-63.7	-163.8	175	-167.7	0	115.2	D287	D287-K289 PolarHBondContact O-N 3.34Å
290	S	38.9	Very low	45.2	Very low	97 Å²	97	144.6 Å²	144.6	68%	0.678	74%	0.736	S	S	*	*	S	Bend	trans	-124.6	114.3	171.7	52.9	0	0	0	0	110.6
291	G	41	Very low	45.1	Very low	73 Å²	73	141.7 Å²	141.7	75%	0.753	73%	0.73	S	S	*	*			trans	-66.5	132.3	-178.4	0	0	0	0	0	112.3	K293	G291-K293 PolarHBondContact O-N 3.41Å
292	L	49.1	Very low	44.6	Very low	154 Å²	154	142.7 Å²	142.7	81%	0.806	74%	0.74	S	S	*	*			trans	-72.8	92.4	-179.3	-176.5	68.4	0	0	0	111	R294	L292-R294 PolarHBondContact O-N 3.34Å
293	K	42.3	Very low	44.8	Very low	192 Å²	192	140.5 Å²	140.5	84%	0.835	75%	0.747	S	S	*	*			trans	-58.2	106.2	176.2	-70.4	-156	172.9	-150.7	0	111.4	G291	G291-K293 PolarHBondContact O-N 3.41Å
294	R	50.6	Low	45.2	Very low	183 Å²	183	139.7 Å²	139.7	69%	0.691	75%	0.751	S	S	*	*			trans	-91.1	103.7	175.3	-64	-169.1	-58.8	153	4.8	109.9	L292 G296	L292-R294 PolarHBondContact O-N 3.34Å; R294-G296 PolarHBondContact O-N 3.05Å
295	R	41.2	Very low	45.8	Very low	219 Å²	219	134.7 Å²	134.7	83%	0.826	74%	0.737	S	S	*	*			trans	-60.5	118.4	175.1	-61.3	164	77.4	178.2	6.7	109.7
296	G	45	Very low	46.4	Very low	60 Å²	60	130.1 Å²	130.1	62%	0.619	73%	0.731	S	S	*	*			trans	-167.2	77.3	-174.5	0	0	0	0	0	117.2	R294	R294-G296 PolarHBondContact O-N 3.05Å
297	I	49.9	Very low	47.5	Very low	173 Å²	173	127.5 Å²	127.5	89%	0.887	73%	0.725	S	S	*	*			trans	54.6	84.9	156.1	-43.4	177.8	0	0	0	115.8
298	T	52.7	Low	48	Very low	95 Å²	95	127 Å²	127	58%	0.583	72%	0.719	S	S	*	*			trans	-85.8	130.3	165.3	47.2	0	0	0	0	111.1
299	G	48.9	Very low	48.2	Very low	52 Å²	52	127.2 Å²	127.2	54%	0.536	72%	0.716	S	S	.	*			trans	-99.3	96.4	-166.9	0	0	0	0	0	114.6	A301	G299-A301 PolarHBondContact O-N 3.19Å
300	H	46	Very low	48.7	Very low	171 Å²	171	127 Å²	127	79%	0.792	72%	0.717	S	S	*	*			trans	-69.2	88.4	171.7	-72.8	31.6	0	0	0	111.7
301	A	52	Low	49.7	Very low	60 Å²	60	126.3 Å²	126.3	50%	0.496	71%	0.706	S	S	.	*			trans	-141.3	147.2	172.1	0	0	0	0	0	111.2	G299 G303 V304	G299-A301 PolarHBondContact O-N 3.19Å; A301-G303 PolarHBondContact O-N 2.81Å; A301-G303 VanDerWaalsContact O-N 3.17Å; A301-V304 HydrophobicContact CB-CG2 3.93Å; A301-V304 WeakPolarHBondContact O-CG2 3.21Å; A301-V304 PolarHBondContact O-N 2.93Å
302	F	39	Very low	50.6	Low	224 Å²	224	126.5 Å²	126.5	98%	0.982	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.1	118.9	-175.8	-67.4	-87.8	0	0	0	111.7
303	G	52.4	Low	51.3	Low	82 Å²	82	124 Å²	124	85%	0.845	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	96.6	0.7	176.2	0	0	0	0	0	116.6	A301	A301-G303 PolarHBondContact O-N 2.81Å; A301-G303 VanDerWaalsContact O-N 3.17Å
304	V	52.3	Low	52.3	Low	108 Å²	108	120.2 Å²	120.2	66%	0.655	68%	0.681	S	S	*	*			trans	-130	25.5	-179	-67.6	0	0	0	0	114.3	A301	A301-V304 HydrophobicContact CB-CG2 3.93Å; A301-V304 WeakPolarHBondContact O-CG2 3.21Å; A301-V304 PolarHBondContact O-N 2.93Å
305	G	48.1	Very low	52.5	Low	54 Å²	54	121 Å²	121	56%	0.557	69%	0.685	S	S	*	*			trans	-111.2	31.8	179	0	0	0	0	0	114.6
306	A	51	Low	53.6	Low	91 Å²	91	117.2 Å²	117.2	75%	0.752	68%	0.677	S	S	*	*	S	Bend	trans	-110.7	41.1	178.5	0	0	0	0	0	111.2
307	L	55.5	Low	54.4	Low	127 Å²	127	123 Å²	123	67%	0.665	69%	0.688	S	S	*	*			trans	-166.3	60.2	177.5	-158.7	76.8	0	0	0	108.7	D311	L307-D311 WeakPolarHBondContact CA-OD2 3.36Å; L307-D311 PolarHBondContact N-OD2 3.18Å
308	E	52.3	Low	55.1	Low	108 Å²	108	119.8 Å²	119.8	51%	0.505	67%	0.672	S	S	.	*			trans	-74.4	159.5	173.5	-60.4	-150.8	134.2	0	0	110.9	E310 D311	E308-E310 PolarHBondContact O-N 3.41Å; E308-D311 PolarHBondContact N-OD2 3.02Å; E308-D311 PolarHBondContact O-N 3.39Å
309	E	57.3	Low	55.6	Low	156 Å²	156	123.4 Å²	123.4	73%	0.729	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	5.7	177.3	-62.5	-169.6	149.2	0	0	113.7
310	E	57.1	Low	56.5	Low	187 Å²	187	126.8 Å²	126.8	87%	0.874	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.5	-6.8	174.9	-57.7	-168.4	171.1	0	0	112.8	E308 A312	E308-E310 PolarHBondContact O-N 3.41Å; E310-A312 PolarHBondContact O-N 3.45Å
311	D	59.6	Low	57.6	Low	83 Å²	83	123 Å²	123	44%	0.444	68%	0.679	S	S	.	*	S	Bend	trans	-69.1	126	162.4	-72.3	-46.4	0	0	0	108	L307 E308 D313	L307-D311 WeakPolarHBondContact CA-OD2 3.36Å; L307-D311 PolarHBondContact N-OD2 3.18Å; E308-D311 PolarHBondContact N-OD2 3.02Å; E308-D311 PolarHBondContact O-N 3.39Å; D311-D313 PolarHBondContact O-N 3.4Å
312	A	60.7	Low	58.3	Low	77 Å²	77	126.4 Å²	126.4	64%	0.636	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-59.9	136.7	168.2	0	0	0	0	0	108.8	E310 V314	E310-A312 PolarHBondContact O-N 3.45Å; A312-V314 PolarHBondContact O-N 3.38Å; A312-V314 VanDerWaalsContact O-N 3.14Å
313	D	64	Low	59.4	Low	101 Å²	101	121.9 Å²	121.9	54%	0.54	66%	0.662	S	S	.	*	P	Polyproline II helix	trans	-56.6	123.5	-172.3	-152.5	-20.6	0	0	0	108.3	D311 Y315 E316	D311-D313 PolarHBondContact O-N 3.4Å; D313-Y315 PolarHBondContact O-N 3.39Å; D313-E316 HydrophobicContact CB-CB 3.93Å; D313-E316 WeakPolarHBondContact O-CB 3.48Å; D313-E316 PolarHBondContact O-N 3.32Å
314	V	63	Low	60.5	Low	113 Å²	113	124.9 Å²	124.9	69%	0.685	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-5.8	-175.4	-179.4	0	0	0	0	111.6	A312	A312-V314 PolarHBondContact O-N 3.38Å; A312-V314 VanDerWaalsContact O-N 3.14Å
315	Y	55.4	Low	61.4	Low	199 Å²	199	128.6 Å²	128.6	78%	0.78	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117	10	171.6	-53.1	-81.1	0	0	0	113.1	D313 Q317	D313-Y315 PolarHBondContact O-N 3.39Å; Y315-Q317 PolarHBondContact O-N 3.28Å
316	E	64.4	Low	62.5	Low	141 Å²	141	133.9 Å²	133.9	66%	0.659	67%	0.671	S	S	*	*	S	Bend	trans	-61.7	129.6	167.9	-140.6	174.7	-167.8	0	0	107.6	D313 D318	D313-E316 HydrophobicContact CB-CB 3.93Å; D313-E316 WeakPolarHBondContact O-CB 3.48Å; D313-E316 PolarHBondContact O-N 3.32Å; E316-D318 PolarHBondContact O-N 2.94Å
317	Q	60.6	Low	63.1	Low	182 Å²	182	138.2 Å²	138.2	85%	0.85	68%	0.68	S	S	*	*			trans	-80.6	96.2	-169.7	-68.9	175.2	-36.1	0	0	108.9	Y315 R319	Y315-Q317 PolarHBondContact O-N 3.28Å; Q317-R319 PolarHBondContact O-N 3.03Å
318	D	66	Low	62.9	Low	104 Å²	104	134.6 Å²	134.6	56%	0.556	67%	0.673	S	S	*	*			trans	-34	126.4	168.6	-72.1	-23.3	0	0	0	109.4	E316 L320 Y323	E316-D318 PolarHBondContact O-N 2.94Å; D318-L320 PolarHBondContact O-N 3.19Å; D318-Y323 HydrophobicContact CB-CE2 3.58Å; D318-Y323 PolarHBondContact OD2-OH 3.47Å
319	R	62	Low	62.7	Low	172 Å²	172	137.7 Å²	137.7	65%	0.649	69%	0.693	S	S	*	*			trans	-71.4	128.1	-178.1	-64.1	167.2	161.1	-174	1.5	107.4	Q317 A321 E322	Q317-R319 PolarHBondContact O-N 3.03Å; R319-A321 PolarHBondContact O-N 2.9Å; R319-E322 WeakPolarHBondContact CB-OE2 3.14Å; R319-E322 WeakPolarHBondContact CD-OE1 3.24Å; R319-E322 PolarHBondContact N-OE2 3.32Å; R319-E322 WeakPolarHBondContact O-CB 3.35Å; R319-E322 PolarHBondContact O-N 3.22Å
320	L	68.5	Low	62.3	Low	123 Å²	123	133.9 Å²	133.9	64%	0.644	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.5	-19.3	174.3	-64.2	167.9	0	0	0	112.7	D318 E322 W325	D318-L320 PolarHBondContact O-N 3.19Å; L320-E322 VanDerWaalsContact C-N 3.35Å; L320-W325 HydrophobicContact CB-CH2 4.35Å; L320-W325 HydrophobicContact CB-CZ2 3.95Å; L320-W325 VanDerWaalsContact O-CE2 3.28Å; L320-W325 WeakPolarHBondContact O-CZ2 3.06Å; L320-W325 PolarHBondContact O-NE1 2.83Å
321	A	68.1	Low	61.7	Low	91 Å²	91	134.6 Å²	134.6	75%	0.752	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-10.9	173.3	0	0	0	0	0	115.3	R319	R319-A321 PolarHBondContact O-N 2.9Å
322	E	66.4	Low	61.4	Low	131 Å²	131	134.8 Å²	134.8	61%	0.612	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.3	-13	175.8	-76.1	133.8	-150.7	0	0	112.6	R319 L320	R319-E322 WeakPolarHBondContact CB-OE2 3.14Å; R319-E322 WeakPolarHBondContact CD-OE1 3.24Å; R319-E322 PolarHBondContact N-OE2 3.32Å; R319-E322 WeakPolarHBondContact O-CB 3.35Å; R319-E322 PolarHBondContact O-N 3.22Å; L320-E322 VanDerWaalsContact C-N 3.35Å
323	Y	64	Low	60.9	Low	129 Å²	129	138.3 Å²	138.3	51%	0.506	72%	0.715	S	S	.	*	S	Bend	trans	-76.5	139.2	166.6	-78.2	-88.7	0	0	0	110.9	D318 W325	D318-Y323 HydrophobicContact CB-CE2 3.58Å; D318-Y323 PolarHBondContact OD2-OH 3.47Å; Y323-W325 PolarHBondContact O-NE1 2.94Å; Y323-W325 VanDerWaalsContact O-NE1 3.15Å
324	D	74.4	Confident	60.6	Low	145 Å²	145	139.6 Å²	139.6	78%	0.775	72%	0.721	S	S	*	*			trans	-79.4	128	173.4	-149.4	-27.6	0	0	0	110.4	E326	D324-E326 PolarHBondContact OD1-N 2.87Å
325	W	70.6	Confident	60.4	Low	186 Å²	186	141.3 Å²	141.3	71%	0.705	73%	0.727	S	S	*	*			trans	-95.5	-11.3	-172.9	-60.6	77	0	0	0	112.3	L320 Y323	L320-W325 HydrophobicContact CB-CH2 4.35Å; L320-W325 HydrophobicContact CB-CZ2 3.95Å; L320-W325 VanDerWaalsContact O-CE2 3.28Å; L320-W325 WeakPolarHBondContact O-CZ2 3.06Å; L320-W325 PolarHBondContact O-NE1 2.83Å; Y323-W325 PolarHBondContact O-NE1 2.94Å; Y323-W325 VanDerWaalsContact O-NE1 3.15Å
326	E	71.7	Confident	60.5	Low	166 Å²	166	140 Å²	140	78%	0.776	73%	0.728	S	S	*	*			trans	-102.3	95.5	-173.1	-61.1	-164.5	179.7	0	0	111.1	D324 G328	D324-E326 PolarHBondContact OD1-N 2.87Å; E326-G328 VanDerWaalsContact C-N 3.26Å; E326-G328 PolarHBondContact O-N 3.39Å
327	I	63	Low	60.2	Low	182 Å²	182	139.2 Å²	139.2	93%	0.933	73%	0.728	S	S	*	*			trans	-75.5	81.5	170.5	-58	176.6	0	0	0	108.3
328	G	52.4	Low	60.2	Low	51 Å²	51	137.4 Å²	137.4	53%	0.526	72%	0.72	S	S	.	*	S	Bend	trans	-175.3	125.8	177.5	0	0	0	0	0	115.4	E326 G330	E326-G328 VanDerWaalsContact C-N 3.26Å; E326-G328 PolarHBondContact O-N 3.39Å; G328-G330 PolarHBondContact O-N 3.39Å
329	D	47.9	Very low	60.3	Low	173 Å²	173	138.3 Å²	138.3	93%	0.925	73%	0.725	S	S	*	*			trans	59.6	48	139.3	-48.9	-11.6	0	0	0	118.3
330	G	47.6	Very low	60.6	Low	75 Å²	75	137.6 Å²	137.6	77%	0.773	73%	0.729	S	S	*	*			trans	-91.3	106.3	162.5	0	0	0	0	0	112.3	G328	G328-G330 PolarHBondContact O-N 3.39Å
331	E	46.4	Very low	60.6	Low	203 Å²	203	138.1 Å²	138.1	95%	0.949	73%	0.728	S	S	*	*			trans	-85.3	107.3	173.4	-64.6	-179.7	175.4	0	0	110.4
332	S	52.2	Low	60.9	Low	87 Å²	87	139 Å²	139	61%	0.608	72%	0.717	S	S	*	*			trans	-125.9	145.8	171.1	56.9	0	0	0	0	111.6
333	N	50.5	Low	61.2	Low	151 Å²	151	135.4 Å²	135.4	81%	0.807	71%	0.709	S	S	*	*			trans	-90.4	108.3	-173.9	-36.9	-85.5	0	0	0	109.8
334	D	57.7	Low	61.6	Low	127 Å²	127	136.3 Å²	136.3	68%	0.679	72%	0.718	S	S	*	*			trans	-104.1	6.8	178.7	-59.3	-24.8	0	0	0	112.2	E336	D334-E336 PolarHBondContact O-N 2.9Å
335	D	58.1	Low	61.5	Low	150 Å²	150	134.3 Å²	134.3	80%	0.802	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-2.7	-172.4	-69.4	-44.9	0	0	0	115
336	E	58.3	Low	61.7	Low	170 Å²	170	131.8 Å²	131.8	79%	0.794	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	-18.2	-175.3	-65.9	-171.3	175.7	0	0	114.4	D334	D334-E336 PolarHBondContact O-N 2.9Å
337	D	57.6	Low	61.8	Low	126 Å²	126	126.2 Å²	126.2	67%	0.674	68%	0.684	S	S	*	*	S	Bend	trans	-79.1	-22.5	-176.5	-79.7	-9.4	0	0	0	113.5	D339	D337-D339 VanDerWaalsContact C-N 3.35Å; D337-D339 PolarHBondContact O-N 3.45Å
338	E	61	Low	62.1	Low	143 Å²	143	121.3 Å²	121.3	67%	0.668	67%	0.671	S	S	*	*	H	α-helix	trans	-68	-28.4	-176.4	-73.2	-161	170.6	0	0	113.7	Q342	E338-Q342 WeakPolarHBondContact O-CG 3.48Å; E338-Q342 PolarHBondContact O-NE2 3.35Å
339	D	68	Low	63	Low	124 Å²	124	129.1 Å²	129.1	66%	0.663	69%	0.685	S	S	*	*	H	α-helix	trans	-76.6	-32.9	-175.4	-85.6	-9.1	0	0	0	112.6	D337 A343	D337-D339 VanDerWaalsContact C-N 3.35Å; D337-D339 PolarHBondContact O-N 3.45Å; D339-A343 PolarHBondContact O-N 3.22Å; D339-A343 VanDerWaalsContact O-N 3.1Å
340	E	69.2	Low	63.9	Low	156 Å²	156	127.2 Å²	127.2	73%	0.729	67%	0.674	S	S	*	*	H	α-helix	trans	-79.6	-36	-176.5	-168.4	129.8	-130.1	0	0	112.3	Q342 A343 E344	E340-Q342 VanDerWaalsContact C-N 3.29Å; E340-Q342 PolarHBondContact O-N 3.17Å; E340-A343 WeakPolarHBondContact O-CB 3.33Å; E340-A343 PolarHBondContact O-N 3.26Å; E340-A343 VanDerWaalsContact O-N 3.17Å; E340-E344 PolarHBondContact O-N 3.16Å
341	E	67.7	Low	63.7	Low	135 Å²	135	126.8 Å²	126.8	63%	0.631	67%	0.669	S	S	*	*	H	α-helix	trans	-61.7	-39.6	170.9	-171.3	-178.6	-174.9	0	0	111	A343 E344 I345	E341-A343 VanDerWaalsContact C-N 3.33Å; E341-A343 PolarHBondContact O-N 3.27Å; E341-E344 PolarHBondContact O-N 3.17Å; E341-I345 HydrophobicContact CG-CD1 3.99Å; E341-I345 VanDerWaalsContact O-CG1 3.26Å; E341-I345 WeakPolarHBondContact O-CG1 3.43Å; E341-I345 PolarHBondContact O-N 3.24Å
342	Q	74	Confident	63.9	Low	110 Å²	110	127.1 Å²	127.1	51%	0.514	66%	0.662	S	S	.	*	H	α-helix	trans	-65.9	-35.8	175.8	-72.3	175.3	78.4	0	0	112	E338 E340 I345 E346	E338-Q342 WeakPolarHBondContact O-CG 3.48Å; E338-Q342 PolarHBondContact O-NE2 3.35Å; E340-Q342 VanDerWaalsContact C-N 3.29Å; E340-Q342 PolarHBondContact O-N 3.17Å; Q342-I345 PolarHBondContact O-N 3.26Å; Q342-E346 PolarHBondContact O-N 2.89Å
343	A	73.5	Confident	63.2	Low	54 Å²	54	131.4 Å²	131.4	45%	0.446	68%	0.677	S	S	.	*	H	α-helix	trans	-67.2	-41.8	174.7	0	0	0	0	0	112.9	D339 E340 E341 E346 A347	D339-A343 PolarHBondContact O-N 3.22Å; D339-A343 VanDerWaalsContact O-N 3.1Å; E340-A343 WeakPolarHBondContact O-CB 3.33Å; E340-A343 PolarHBondContact O-N 3.26Å; E340-A343 VanDerWaalsContact O-N 3.17Å; E341-A343 VanDerWaalsContact C-N 3.33Å; E341-A343 PolarHBondContact O-N 3.27Å; A343-E346 PolarHBondContact O-N 3.09Å; A343-A347 WeakPolarHBondContact O-CB 3.27Å; A343-A347 PolarHBondContact O-N 3.31Å
344	E	71.5	Confident	63	Low	148 Å²	148	129.5 Å²	129.5	69%	0.692	68%	0.675	S	S	*	*	H	α-helix	trans	-64.5	-39.3	173.8	-75.2	-149.1	124.6	0	0	112.1	E340 E341 E346 A347 A348	E340-E344 PolarHBondContact O-N 3.16Å; E341-E344 PolarHBondContact O-N 3.17Å; E344-E346 PolarHBondContact O-N 3.19Å; E344-A347 PolarHBondContact O-N 3.48Å; E344-A348 WeakPolarHBondContact O-CB 3.39Å; E344-A348 PolarHBondContact O-N 3.15Å
345	I	72.8	Confident	62.2	Low	104 Å²	104	128.9 Å²	128.9	53%	0.533	68%	0.681	S	S	.	*	H	α-helix	trans	-64.8	-38.6	177.1	-69.7	167.9	0	0	0	111.5	E341 Q342 R349	E341-I345 HydrophobicContact CG-CD1 3.99Å; E341-I345 VanDerWaalsContact O-CG1 3.26Å; E341-I345 WeakPolarHBondContact O-CG1 3.43Å; E341-I345 PolarHBondContact O-N 3.24Å; Q342-I345 PolarHBondContact O-N 3.26Å; I345-R349 WeakPolarHBondContact O-CB 3.25Å; I345-R349 PolarHBondContact O-N 3.21Å; I345-R349 VanDerWaalsContact O-N 3.13Å
346	E	74.8	Confident	61.7	Low	133 Å²	133	128.3 Å²	128.3	62%	0.621	68%	0.683	S	S	*	*	H	α-helix	trans	-70.1	-37.7	171.8	-71.6	-140.9	132.3	0	0	112.8	Q342 A343 E344 R349 L350	Q342-E346 PolarHBondContact O-N 2.89Å; A343-E346 PolarHBondContact O-N 3.09Å; E344-E346 PolarHBondContact O-N 3.19Å; E346-R349 WeakPolarHBondContact O-CB 3.43Å; E346-R349 PolarHBondContact O-N 2.89Å; E346-L350 PolarHBondContact O-N 3.25Å
347	A	73.3	Confident	60.6	Low	49 Å²	49	128.8 Å²	128.8	41%	0.405	69%	0.687	S	S	.	*	H	α-helix	trans	-63.2	-43	176.4	0	0	0	0	0	112.1	A343 E344 R349 L350 G351	A343-A347 WeakPolarHBondContact O-CB 3.27Å; A343-A347 PolarHBondContact O-N 3.31Å; E344-A347 PolarHBondContact O-N 3.48Å; A347-R349 VanDerWaalsContact C-N 3.34Å; A347-R349 PolarHBondContact O-N 3.27Å; A347-L350 PolarHBondContact O-N 2.91Å; A347-G351 PolarHBondContact O-N 3.14Å
348	A	69.9	Low	59.9	Low	79 Å²	79	132.3 Å²	132.3	65%	0.653	70%	0.697	S	S	*	*	H	α-helix	trans	-60.7	-42.1	172.8	0	0	0	0	0	111.6	E344 L350 G351	E344-A348 WeakPolarHBondContact O-CB 3.39Å; E344-A348 PolarHBondContact O-N 3.15Å; A348-L350 PolarHBondContact O-N 3.21Å; A348-G351 PolarHBondContact O-N 3.08Å
349	R	70.8	Confident	58.8	Low	215 Å²	215	131.4 Å²	131.4	81%	0.811	70%	0.701	S	S	*	*	H	α-helix	trans	-64.5	-25	176.8	-174.3	174.8	-178.3	154.7	2.6	113.7	I345 E346 A347	I345-R349 WeakPolarHBondContact O-CB 3.25Å; I345-R349 PolarHBondContact O-N 3.21Å; I345-R349 VanDerWaalsContact O-N 3.13Å; E346-R349 WeakPolarHBondContact O-CB 3.43Å; E346-R349 PolarHBondContact O-N 2.89Å; A347-R349 VanDerWaalsContact C-N 3.34Å; A347-R349 PolarHBondContact O-N 3.27Å
350	L	66.5	Low	57.2	Low	133 Å²	133	135 Å²	135	70%	0.696	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	4.6	177.8	-67.6	176.3	0	0	0	114.3	E346 A347 A348 R352	E346-L350 PolarHBondContact O-N 3.25Å; A347-L350 PolarHBondContact O-N 2.91Å; A348-L350 PolarHBondContact O-N 3.21Å; L350-R352 VanDerWaalsContact C-N 3.32Å; L350-R352 PolarHBondContact O-N 2.69Å
351	G	44.7	Very low	55.8	Low	65 Å²	65	133.7 Å²	133.7	67%	0.67	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.2	24.8	166.9	0	0	0	0	0	115.7	A347 A348	A347-G351 PolarHBondContact O-N 3.14Å; A348-G351 PolarHBondContact O-N 3.08Å
352	R	49.3	Very low	54.2	Low	211 Å²	211	135.6 Å²	135.6	80%	0.796	73%	0.728	S	S	*	*			trans	-103.5	88.8	-178.2	-76.2	-172.6	169.6	-162.9	-1.7	112.5	L350 S354	L350-R352 VanDerWaalsContact C-N 3.32Å; L350-R352 PolarHBondContact O-N 2.69Å; R352-S354 PolarHBondContact O-N 3.44Å; R352-S354 VanDerWaalsContact O-N 3.17Å
353	L	37.3	Very low	52.6	Low	177 Å²	177	137.2 Å²	137.2	93%	0.927	74%	0.744	S	S	*	*			trans	-75.1	97.6	169.8	-60.3	177	0	0	0	110.5
354	S	47	Very low	50.7	Low	110 Å²	110	141.6 Å²	141.6	77%	0.769	76%	0.76	S	S	*	*			trans	-92.7	96.6	179.7	55.2	0	0	0	0	112.9	R352	R352-S354 PolarHBondContact O-N 3.44Å; R352-S354 VanDerWaalsContact O-N 3.17Å
355	S	41.5	Very low	49.3	Very low	114 Å²	114	140.7 Å²	140.7	80%	0.797	77%	0.77	S	S	*	*			trans	-83.4	119.5	174.5	60.3	0	0	0	0	112.7
356	T	46.6	Very low	47.4	Very low	138 Å²	138	141.5 Å²	141.5	85%	0.847	79%	0.786	S	S	*	*			trans	-137.5	103	170.8	49.8	0	0	0	0	113.2
357	M	35.8	Very low	45.8	Very low	181 Å²	181	141.1 Å²	141.1	89%	0.892	80%	0.797	S	S	*	*			trans	-93	143.1	170.5	-48.5	-178.2	89	0	0	111
358	K	42.7	Very low	44	Very low	200 Å²	200	145.3 Å²	145.3	87%	0.87	82%	0.818	S	S	*	*			trans	-164.1	87.2	164.4	-111	154.1	-171.4	175.5	0	116.5
359	T	38.1	Very low	42.4	Very low	123 Å²	123	150.8 Å²	150.8	76%	0.755	83%	0.83	S	S	*	*			trans	27.6	113.6	137.2	57.4	0	0	0	0	122.8
360	K	35	Very low	40.6	Very low	200 Å²	200	151.6 Å²	151.6	87%	0.87	83%	0.833	S	S	*	*			trans	52	125.3	130.2	-63.6	-178.6	175.7	179.9	0	122
361	S	39.1	Very low	39.1	Very low	128 Å²	128	152.1 Å²	152.1	90%	0.895	84%	0.842	S	S	*	*				178.9	174.7	99.9	47.8	0	0	0	0	113.2
362	Q	34.9	Very low	38.8	Very low	176 Å²	176	157.4 Å²	157.4	82%	0.822	85%	0.847	S	S	*	*			trans	-93.5	155.7	-164.8	-63.9	177.5	-41.6	0	0	115.7
363	V	40.3	Very low	38.2	Very low	143 Å²	143	155 Å²	155	87%	0.867	85%	0.848	S	S	*	*				-166.2	149.8	123.7	138.9	0	0	0	0	109.3
364	N	33.8	Very low	38.1	Very low	146 Å²	146	153.7 Å²	153.7	78%	0.781	84%	0.84	S	S	*	*			trans	-107.6	136.1	-171.3	-59.2	-5.9	0	0	0	113.9
365	S	41.2	Very low	37.7	Very low	129 Å²	129	156 Å²	156	90%	0.902	84%	0.844	S	S	*	*			trans	-156.5	159.5	148.5	60.3	0	0	0	0	110
366	S	33.8	Very low	37.4	Very low	122 Å²	122	153.8 Å²	153.8	85%	0.853	84%	0.84	S	S	*	*			trans	-117.2	127.5	-163.7	57.3	0	0	0	0	114.5
367	S	40.4	Very low	36.8	Very low	124 Å²	124	159 Å²	159	87%	0.867	84%	0.844	S	S	*	*			trans	-148.7	145.8	155.6	54.5	0	0	0	0	111.2
368	T	34.5	Very low	36.9	Very low	137 Å²	137	156.4 Å²	156.4	84%	0.84	84%	0.838	S	S	*	*			trans	-68	132	179.1	-32.5	0	0	0	0	111.7
369	E	37.8	Very low	37	Very low	195 Å²	195	150.9 Å²	150.9	91%	0.911	83%	0.83	S	S	*	*			trans	-166.6	174.7	146.1	-114.8	155.3	-146.2	0	0	112.4
370	R	32.5	Very low	36.9	Very low	231 Å²	231	151.5 Å²	151.5	87%	0.872	84%	0.836	S	S	*	*			trans	-95.4	138.8	-167.1	-60	161.8	166.8	164	-10.1	111.8
371	T	33.9	Very low	37	Very low	144 Å²	144	146.9 Å²	146.9	88%	0.883	83%	0.829	S	S	*	*			trans	-176	171.5	133.7	18.1	0	0	0	0	113.8
372	K	39.3	Very low	36.9	Very low	176 Å²	176	149.1 Å²	149.1	77%	0.765	83%	0.826	S	S	*	*			trans	-59.5	175.6	-174.9	-51.1	162.1	-175.3	172.3	0	114.5
373	I	36	Very low	36.8	Very low	162 Å²	162	149.8 Å²	149.8	83%	0.831	83%	0.828	S	S	*	*			trans	103	120.8	157.4	-53.3	157.5	0	0	0	118.5
374	I	35.3	Very low	36.3	Very low	148 Å²	148	153.4 Å²	153.4	76%	0.759	83%	0.826	S	S	*	*			trans	12.7	142	144.6	-81	165.4	0	0	0	123.1
375	D	38.9	Very low	36.4	Very low	159 Å²	159	151.9 Å²	151.9	85%	0.85	83%	0.827	S	S	*	*			trans	52.6	95.1	157	-66.9	-2.3	0	0	0	122.9
376	G	35.7	Very low	36.1	Very low	68 Å²	68	150.5 Å²	150.5	70%	0.701	82%	0.817	S	S	*	*				114.2	137.4	124.6	0	0	0	0	0	121.2
377	W	33.3	Very low	36.3	Very low	246 Å²	246	154 Å²	154	93%	0.932	82%	0.82	S	S	*	*			trans	70.3	100.9	159.4	-63.3	89.9	0	0	0	121.5
378	T	38.8	Very low	35.9	Very low	127 Å²	127	157.3 Å²	157.3	78%	0.779	82%	0.819	S	S	*	*				28.4	138.1	121	-46.1	0	0	0	0	120.5
379	A	43.8	Very low	35.7	Very low	84 Å²	84	158.5 Å²	158.5	69%	0.694	82%	0.819	S	S	*	*			cis	-179.9	166.5	-20	0	0	0	0	0	108
380	P	37.3	Very low	35.3	Very low	137 Å²	137	156 Å²	156	89%	0.89	81%	0.812	S	S	*	*			trans	-138.9	158.5	148.1	37.9	-25	0	0	0	114.7
381	S	35.6	Very low	35.4	Very low	102 Å²	102	154.9 Å²	154.9	71%	0.713	81%	0.814	S	S	*	*			trans	-128.4	148.3	-177.6	72.9	0	0	0	0	114.2
382	Q	37	Very low	35.4	Very low	176 Å²	176	152.5 Å²	152.5	82%	0.822	80%	0.803	S	S	*	*			trans	68.9	123.6	165.6	-52.1	-169.4	21.9	0	0	118.4
383	H	33.7	Very low	35.3	Very low	189 Å²	189	149.5 Å²	149.5	88%	0.875	80%	0.804	S	S	*	*				-143.8	140.6	110.3	-129.3	-87.9	0	0	0	111.3
384	R	30.1	Very low	35.2	Very low	219 Å²	219	146.8 Å²	146.8	83%	0.826	80%	0.8	S	S	*	*			trans	-114.7	126.1	178.1	-163.8	-173.2	-157.8	-157.1	9.1	108.4
385	S	35.9	Very low	35.5	Very low	115 Å²	115	148 Å²	148	80%	0.804	81%	0.808	S	S	*	*			trans	-137.8	92.1	176	58.4	0	0	0	0	111.2
386	S	34.5	Very low	35.3	Very low	99 Å²	99	144.9 Å²	144.9	69%	0.692	80%	0.804	S	S	*	*			trans	-79.6	118.9	177	-49.1	0	0	0	0	110.8
387	Q	38	Very low	35.5	Very low	195 Å²	195	149.9 Å²	149.9	91%	0.911	81%	0.813	S	S	*	*			trans	-134.1	146.8	158.5	-74.6	-155.7	-2.5	0	0	112.4
388	K	31.4	Very low	35.6	Very low	195 Å²	195	144.5 Å²	144.5	85%	0.848	81%	0.81	S	S	*	*			trans	-72.6	150.7	179.4	-54.2	162.3	-179.9	173.1	0	109.6
389	L	30.9	Very low	35.7	Very low	162 Å²	162	141.7 Å²	141.7	85%	0.848	81%	0.807	S	S	*	*				-177.9	157.2	107.7	-96.9	161.4	0	0	0	112.2
390	N	29.4	Very low	35.3	Very low	142 Å²	142	147.6 Å²	147.6	76%	0.759	82%	0.817	S	S	*	*			trans	-95.7	138.1	-176.5	2.2	-104.4	0	0	0	112.1
391	K	34.5	Very low	35	Very low	207 Å²	207	152.3 Å²	152.3	90%	0.9	82%	0.817	S	S	*	*			trans	-156.9	170.8	132	-140.4	64.8	-176.7	-179.8	0	112.9
392	S	33.9	Very low	34.9	Very low	94 Å²	94	153.3 Å²	153.3	66%	0.657	82%	0.824	S	S	*	*			trans	-119.3	138.2	-166.6	52.1	0	0	0	0	112.2
393	S	36.6	Very low	34.8	Very low	113 Å²	113	154 Å²	154	79%	0.79	83%	0.827	S	S	*	*			trans	-164.4	102.6	145.8	-4.7	0	0	0	0	110.3
394	S	35.6	Very low	34.8	Very low	106 Å²	106	149.8 Å²	149.8	74%	0.741	82%	0.819	S	S	*	*				19.2	119.3	122.5	57	0	0	0	0	119.9
395	D	40.4	Very low	34.9	Very low	174 Å²	174	145.2 Å²	145.2	93%	0.93	82%	0.816	S	S	*	*				-148.3	156.5	116.5	-100.7	-33.1	0	0	0	109
396	A	34.5	Very low	34.9	Very low	93 Å²	93	149.6 Å²	149.6	77%	0.769	82%	0.82	S	S	*	*			trans	-144	138.5	-167.1	0	0	0	0	0	113.9
397	L	40	Very low	34.8	Very low	172 Å²	172	153.2 Å²	153.2	90%	0.901	83%	0.826	S	S	*	*			trans	-105.5	133.3	162.9	-71.9	173.1	0	0	0	109.6
398	P	35.5	Very low	34.4	Very low	133 Å²	133	150.5 Å²	150.5	86%	0.864	82%	0.818	S	S	*	*	S	Bend	trans	-80.9	134.3	-176.4	32	-34	0	0	0	111.6
399	G	40.9	Very low	34.4	Very low	69 Å²	69	150.1 Å²	150.1	71%	0.711	82%	0.819	S	S	*	*	S	Bend	trans	179.3	-40	174.2	0	0	0	0	0	113.7
400	F	35	Very low	34.3	Very low	207 Å²	207	150.4 Å²	150.4	91%	0.908	82%	0.821	S	S	*	*			trans	-119.9	106.3	179	-73.8	-91.4	0	0	0	111.7
401	R	31.8	Very low	34.4	Very low	237 Å²	237	152.3 Å²	152.3	89%	0.894	82%	0.822	S	S	*	*			trans	-134	104.7	161.8	-86.9	-168.4	171.5	-157.1	-0.1	109.1
402	S	33.6	Very low	34.2	Very low	122 Å²	122	149.4 Å²	149.4	85%	0.853	82%	0.822	S	S	*	*			trans	-83.2	113.4	162.5	-58.9	0	0	0	0	108.1
403	E	35.7	Very low	34.1	Very low	191 Å²	191	152.5 Å²	152.5	89%	0.893	83%	0.826	S	S	*	*			trans	-82.5	120.6	-177.1	-165	159.4	-114.2	0	0	110.5
404	S	33	Very low	34.1	Very low	101 Å²	101	152.5 Å²	152.5	71%	0.706	82%	0.823	S	S	*	*			trans	-101.9	158.5	-176.8	62	0	0	0	0	112.4
405	T	32	Very low	34.2	Very low	122 Å²	122	155.1 Å²	155.1	75%	0.748	83%	0.827	S	S	*	*			trans	83.9	83.2	165.8	-41.8	0	0	0	0	116.5
406	K	36.9	Very low	34	Very low	208 Å²	208	155.3 Å²	155.3	90%	0.904	82%	0.822	S	S	*	*				-132	150.5	120.7	-70.8	-164.7	179	175.3	0	109.7
407	Q	31.5	Very low	34.4	Very low	174 Å²	174	156.6 Å²	156.6	81%	0.813	82%	0.821	S	S	*	*			trans	-92.9	171.9	-179.7	-66.6	168.6	-49.2	0	0	110.9
408	N	29.8	Very low	34.7	Very low	138 Å²	138	154.1 Å²	154.1	74%	0.738	82%	0.815	S	S	*	*	S	Bend	trans	89.4	134.9	169.2	-52.9	-8.1	0	0	0	117.4
409	E	30.8	Very low	35.3	Very low	188 Å²	188	153.4 Å²	153.4	88%	0.879	80%	0.803	S	S	*	*			trans	48.5	76.3	152	-63.2	-179.4	-148	0	0	119
410	L	28.3	Very low	35.8	Very low	168 Å²	168	154.3 Å²	154.3	88%	0.88	80%	0.796	S	S	*	*			trans	-126	112.4	159.4	-81.6	170.8	0	0	0	111.9
411	K	31.6	Very low	36.3	Very low	182 Å²	182	151.2 Å²	151.2	79%	0.791	80%	0.797	S	S	*	*			trans	-68.2	133.8	166.6	-64.8	175.7	179.7	179.2	0	108.5	H413	K411-H413 PolarHBondContact O-CD2 2.86Å; K411-H413 PolarHBondContact O-N 2.79Å
412	T	31.3	Very low	37.2	Very low	145 Å²	145	143.4 Å²	143.4	89%	0.89	79%	0.79	S	S	*	*			trans	-75.3	86.5	-177.7	50.3	0	0	0	0	111.5
413	H	31.6	Very low	37.7	Very low	160 Å²	160	144.7 Å²	144.7	74%	0.741	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-72.1	139.4	163.9	-68.3	-82.7	0	0	0	110	K411	K411-H413 PolarHBondContact O-CD2 2.86Å; K411-H413 PolarHBondContact O-N 2.79Å
414	P	36.7	Very low	38.5	Very low	112 Å²	112	142.5 Å²	142.5	73%	0.727	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-68.3	137.1	177	28.3	-34.1	0	0	0	110.8	Q416	P414-Q416 PolarHBondContact O-N 3.48Å
415	I	37.1	Very low	39.1	Very low	162 Å²	162	140.7 Å²	140.7	83%	0.831	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-68	117.1	177.1	-61.5	171.7	0	0	0	108.8
416	Q	35.3	Very low	39.8	Very low	177 Å²	177	141.6 Å²	141.6	83%	0.827	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-83.5	120.3	173.9	-67.1	-175.9	-8.2	0	0	109.9	P414	P414-Q416 PolarHBondContact O-N 3.48Å
417	V	43.3	Very low	39.9	Very low	121 Å²	121	139.1 Å²	139.1	73%	0.733	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-84.6	118.5	168.8	179.9	0	0	0	0	108	L419	V417-L419 PolarHBondContact O-N 3.03Å
418	P	47.1	Very low	40.4	Very low	120 Å²	120	135.3 Å²	135.3	78%	0.779	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-72.8	122.1	179.7	28.9	-33.2	0	0	0	110.5
419	L	47.7	Very low	41.1	Very low	117 Å²	117	134 Å²	134	61%	0.613	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-78.3	148.7	173.5	-73.2	163.2	0	0	0	110.8	V417 Y423	V417-L419 PolarHBondContact O-N 3.03Å; L419-Y423 HydrophobicContact CD1-CD1 3.95Å; L419-Y423 HydrophobicContact CD1-CE1 4.34Å; L419-Y423 HydrophobicContact CD2-CD1 4.17Å; L419-Y423 HydrophobicContact CD2-CE1 4.42Å; L419-Y423 HydrophobicContact CG-CD1 4.48Å
420	P	50.8	Low	41.8	Very low	89 Å²	89	135.5 Å²	135.5	58%	0.578	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-60.5	144.9	179	-24.3	34.7	0	0	0	113	G422 Y423	P420-G422 PolarHBondContact O-N 3.03Å; P420-Y423 PolarHBondContact O-N 2.79Å; P420-Y423 VanDerWaalsContact O-N 3.17Å
421	P	47	Very low	42.3	Very low	141 Å²	141	132.2 Å²	132.2	92%	0.916	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55	123.2	173.5	-24.9	34.5	0	0	0	111.5
422	G	50.3	Low	42.6	Very low	73 Å²	73	129.5 Å²	129.5	75%	0.753	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	105.2	-7.3	-178.1	0	0	0	0	0	115.6	P420 I424	P420-G422 PolarHBondContact O-N 3.03Å; G422-I424 PolarHBondContact O-N 2.97Å; G422-I424 VanDerWaalsContact O-N 3.14Å
423	Y	43.6	Very low	42.9	Very low	149 Å²	149	127.9 Å²	127.9	58%	0.584	71%	0.71	S	S	*	*			trans	-74.9	102	173.8	-169.2	-94.9	0	0	0	111.5	L419 P420 P425	L419-Y423 HydrophobicContact CD1-CD1 3.95Å; L419-Y423 HydrophobicContact CD1-CE1 4.34Å; L419-Y423 HydrophobicContact CD2-CD1 4.17Å; L419-Y423 HydrophobicContact CD2-CE1 4.42Å; L419-Y423 HydrophobicContact CG-CD1 4.48Å; P420-Y423 PolarHBondContact O-N 2.79Å; P420-Y423 VanDerWaalsContact O-N 3.17Å; Y423-P425 HydrophobicContact CD1-CG 4.49Å; Y423-P425 HydrophobicContact CE1-CB 3.98Å; Y423-P425 HydrophobicContact CE1-CG 4.3Å; Y423-P425 WeakPolarHBondContact O-CD 3.45Å
424	I	53	Low	42.9	Very low	145 Å²	145	125.4 Å²	125.4	74%	0.744	71%	0.706	S	S	*	*			trans	-105.7	100.3	176.9	-56.3	175.6	0	0	0	109.1	G422 V426	G422-I424 PolarHBondContact O-N 2.97Å; G422-I424 VanDerWaalsContact O-N 3.14Å; I424-V426 PolarHBondContact O-N 3.01Å
425	P	46	Very low	42.6	Very low	64 Å²	64	125.9 Å²	125.9	42%	0.416	71%	0.711	S	S	.	*			trans	-75.4	114.5	176.8	29.7	-32.6	0	0	0	110.5	Y423 F427	Y423-P425 HydrophobicContact CD1-CG 4.49Å; Y423-P425 HydrophobicContact CE1-CB 3.98Å; Y423-P425 HydrophobicContact CE1-CG 4.3Å; Y423-P425 WeakPolarHBondContact O-CD 3.45Å; P425-F427 VanDerWaalsContact C-N 3.31Å; P425-F427 HydrophobicContact CB-CD2 3.79Å; P425-F427 HydrophobicContact CB-CE2 3.79Å; P425-F427 PolarHBondContact O-N 3.04Å
426	V	45.6	Very low	42.3	Very low	141 Å²	141	124.8 Å²	124.8	86%	0.855	71%	0.707	S	S	*	*			trans	-78.5	78	-179	-173	0	0	0	0	110.5	I424	I424-V426 PolarHBondContact O-N 3.01Å
427	F	38.5	Very low	42.2	Very low	156 Å²	156	123.9 Å²	123.9	68%	0.684	71%	0.708	S	S	*	*			trans	-107.5	143.3	171.7	-67.7	-60.7	0	0	0	111.8	P425	P425-F427 VanDerWaalsContact C-N 3.31Å; P425-F427 HydrophobicContact CB-CD2 3.79Å; P425-F427 HydrophobicContact CB-CE2 3.79Å; P425-F427 PolarHBondContact O-N 3.04Å
428	N	42	Very low	41.8	Very low	94 Å²	94	127.3 Å²	127.3	50%	0.503	71%	0.713	S	S	.	*			trans	-66.6	124.7	174.6	179.5	-14.5	0	0	0	109.2	R430 C431	N428-R430 PolarHBondContact O-N 2.97Å; N428-R430 PolarHBondContact OD1-N 3.23Å; N428-R430 VanDerWaalsContact OD1-N 3.12Å; N428-C431 WeakPolarHBondContact O-CB 3.35Å; N428-C431 PolarHBondContact O-N 3.41Å
429	P	46.2	Very low	40.8	Very low	109 Å²	109	130.9 Å²	130.9	71%	0.708	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-62.8	-14.8	-175.6	24.4	-34.6	0	0	0	114	C431	P429-C431 PolarHBondContact O-N 2.7Å
430	R	45.4	Very low	40.1	Very low	220 Å²	220	130.8 Å²	130.8	83%	0.83	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-73.5	-7.8	172.6	-65	-175.1	176.1	169.8	-0.9	114.2	N428	N428-R430 PolarHBondContact O-N 2.97Å; N428-R430 PolarHBondContact OD1-N 3.23Å; N428-R430 VanDerWaalsContact OD1-N 3.12Å
431	C	38	Very low	39	Very low	99 Å²	99	134.5 Å²	134.5	67%	0.669	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-90	4.5	-179.7	-60.3	0	0	0	0	114.1	N428 P429	N428-C431 WeakPolarHBondContact O-CB 3.35Å; N428-C431 PolarHBondContact O-N 3.41Å; P429-C431 PolarHBondContact O-N 2.7Å
432	I	37.4	Very low	38.3	Very low	125 Å²	125	134.7 Å²	134.7	64%	0.641	74%	0.74	S	S	*	*			trans	-116.3	88.4	-174.7	-51.5	177.5	0	0	0	109.9	T434	I432-T434 HydrophobicContact CG2-CG2 4.45Å
433	S	38.9	Very low	37.3	Very low	112 Å²	112	135.7 Å²	135.7	78%	0.783	74%	0.736	S	S	*	*			trans	-88.3	101.3	171	58.3	0	0	0	0	110.6	C435	S433-C435 PolarHBondContact O-N 3.27Å
434	T	32	Very low	36.6	Very low	108 Å²	108	136.3 Å²	136.3	66%	0.663	75%	0.749	S	S	*	*			trans	-72.7	115.7	175.8	46.4	0	0	0	0	111.3	I432 D436	I432-T434 HydrophobicContact CG2-CG2 4.45Å; T434-D436 VanDerWaalsContact C-N 3.26Å; T434-D436 PolarHBondContact O-N 2.98Å
435	C	30	Very low	35.5	Very low	122 Å²	122	133.8 Å²	133.8	82%	0.824	75%	0.75	S	S	*	*			trans	-82.8	62.6	177.8	59.2	0	0	0	0	112.7	S433 N437	S433-C435 PolarHBondContact O-N 3.27Å; C435-N437 PolarHBondContact O-N 3.28Å; C435-N437 VanDerWaalsContact O-N 3.11Å
436	D	30.7	Very low	35	Very low	138 Å²	138	136.2 Å²	136.2	74%	0.738	77%	0.768	S	S	*	*			trans	-75.4	89.7	172.7	-84.2	-7.3	0	0	0	110.9	T434	T434-D436 VanDerWaalsContact C-N 3.26Å; T434-D436 PolarHBondContact O-N 2.98Å
437	N	33.8	Very low	34.3	Very low	159 Å²	159	136.1 Å²	136.1	85%	0.85	76%	0.763	S	S	*	*			trans	-107.6	107.8	169.3	-85.3	-32.9	0	0	0	110.5	C435	C435-N437 PolarHBondContact O-N 3.28Å; C435-N437 VanDerWaalsContact O-N 3.11Å
438	K	33.2	Very low	34.2	Very low	193 Å²	193	137.1 Å²	137.1	84%	0.839	77%	0.77	S	S	*	*			trans	-79.9	138.9	175.2	-70.2	172.2	-178.6	166.7	0	110.6	S440	K438-S440 PolarHBondContact O-N 3.36Å
439	E	26.9	Very low	33.9	Very low	194 Å²	194	137 Å²	137	91%	0.907	77%	0.774	S	S	*	*			trans	-64.7	128.8	171.9	-59	171.2	136.3	0	0	110.2
440	S	32	Very low	33.3	Very low	116 Å²	116	143.6 Å²	143.6	81%	0.811	79%	0.786	S	S	*	*			trans	-142.2	128	160	61.6	0	0	0	0	109.7	K438	K438-S440 PolarHBondContact O-N 3.36Å
441	I	27.7	Very low	33	Very low	166 Å²	166	137.4 Å²	137.4	85%	0.851	78%	0.783	S	S	*	*			trans	-105	113.1	-172.6	-60.9	167.9	0	0	0	108.4
442	T	33.8	Very low	33.5	Very low	145 Å²	145	142.1 Å²	142.1	89%	0.89	79%	0.792	S	S	*	*			trans	-138.8	149.8	156.7	50.9	0	0	0	0	110.3
443	S	29.3	Very low	33.9	Very low	94 Å²	94	142.7 Å²	142.7	66%	0.657	79%	0.791	S	S	*	*			trans	-108.5	141.3	-171.1	53.2	0	0	0	0	111.7
444	N	29.3	Very low	34.7	Very low	163 Å²	163	142.3 Å²	142.3	87%	0.872	78%	0.78	S	S	*	*				-179.2	159.2	111.1	-90.4	-34.6	0	0	0	114.7
445	A	30.1	Very low	35.8	Very low	91 Å²	91	140.1 Å²	140.1	75%	0.752	77%	0.773	S	S	*	*			trans	-57.9	148.3	-168	0	0	0	0	0	118.3
446	S	34.7	Very low	37.5	Very low	116 Å²	116	140.4 Å²	140.4	81%	0.811	77%	0.765	S	S	*	*				-164.5	135.3	118.4	29.6	0	0	0	0	114.7
447	N	30.9	Very low	39.1	Very low	139 Å²	139	136.5 Å²	136.5	74%	0.743	75%	0.749	S	S	*	*			trans	-8.4	129.2	163.9	-46.3	-31.2	0	0	0	120.3
448	H	35.3	Very low	40	Very low	177 Å²	177	135.9 Å²	135.9	82%	0.819	74%	0.735	S	S	*	*				-176.2	167.9	89.4	-104	-44.6	0	0	0	112.3
449	P	37.2	Very low	41.1	Very low	92 Å²	92	129.7 Å²	129.7	60%	0.597	72%	0.719	S	S	*	*			trans	-140.3	126.7	-133.4	36.8	-13.7	0	0	0	117.3
450	Y	33.4	Very low	42.6	Very low	246 Å²	246	130 Å²	130	97%	0.965	71%	0.712	S	S	*	*			trans	-140.7	74.4	161.8	-81.9	-69.9	0	0	0	113.2
451	A	38.6	Very low	43.6	Very low	91 Å²	91	131.7 Å²	131.7	75%	0.752	71%	0.711	S	S	*	*			trans	-103	125.6	164.1	0	0	0	0	0	109.6	H453	A451-H453 PolarHBondContact O-N 3.07Å
452	K	48.8	Very low	44.8	Very low	197 Å²	197	131 Å²	131	86%	0.857	71%	0.709	S	S	*	*			trans	-81.9	113.4	-175.2	-67.4	179.6	-178.9	177.2	0	110.8
453	H	45.3	Very low	45.7	Very low	138 Å²	138	131 Å²	131	64%	0.639	70%	0.699	S	S	*	*			trans	-63.2	138	172	-77.2	-82.7	0	0	0	112.1	A451 R458	A451-H453 PolarHBondContact O-N 3.07Å; H453-R458 VanDerWaalsContact O-CZ 3.27Å; H453-R458 PolarHBondContact O-NE 3.22Å; H453-R458 PolarHBondContact O-NH2 3.49Å
454	D	54.8	Low	46.3	Very low	103 Å²	103	134.9 Å²	134.9	55%	0.551	71%	0.706	S	S	*	*			trans	-73.5	158.1	179.2	-177.8	37.9	0	0	0	112.6	I456 S457 R458	D454-I456 VanDerWaalsContact C-N 3.27Å; D454-I456 PolarHBondContact O-N 2.78Å; D454-S457 PolarHBondContact N-OG 3.06Å; D454-S457 PolarHBondContact O-N 3.37Å; D454-S457 PolarHBondContact O-OG 3.31Å; D454-R458 PolarHBondContact O-N 3.21Å
455	A	56.2	Low	47.3	Very low	62 Å²	62	134.5 Å²	134.5	51%	0.512	70%	0.704	S	S	.	*	H	α-helix	trans	-53.7	-40.1	-174.5	0	0	0	0	0	113.2	S457 R458 A459	A455-S457 VanDerWaalsContact C-N 3.31Å; A455-S457 PolarHBondContact O-N 2.9Å; A455-R458 PolarHBondContact O-N 3.24Å; A455-R458 VanDerWaalsContact O-N 3.1Å; A455-A459 PolarHBondContact O-N 2.88Å
456	I	66.2	Low	48.6	Very low	129 Å²	129	133.9 Å²	133.9	66%	0.662	69%	0.694	S	S	*	*	H	α-helix	trans	-61.7	-40	178.5	-58.3	175.1	0	0	0	111	D454 R458 A459 R460	D454-I456 VanDerWaalsContact C-N 3.27Å; D454-I456 PolarHBondContact O-N 2.78Å; I456-R458 VanDerWaalsContact C-N 3.34Å; I456-A459 PolarHBondContact O-N 3.05Å; I456-R460 PolarHBondContact O-N 3.28Å
457	S	63.5	Low	49.9	Very low	55 Å²	55	133.2 Å²	133.2	39%	0.385	69%	0.685	S	S	.	*	H	α-helix	trans	-73.3	-22.2	176.6	55.1	0	0	0	0	113.9	D454 A455	D454-S457 PolarHBondContact N-OG 3.06Å; D454-S457 PolarHBondContact O-N 3.37Å; D454-S457 PolarHBondContact O-OG 3.31Å; A455-S457 VanDerWaalsContact C-N 3.31Å; A455-S457 PolarHBondContact O-N 2.9Å
458	R	51.9	Low	51.6	Low	147 Å²	147	130.6 Å²	130.6	56%	0.555	67%	0.665	S	S	*	*	H	α-helix	trans	-77.4	-39.4	172.1	-57	180	-151.6	164.9	9.8	111.8	H453 D454 A455 I456 R460 L461	H453-R458 VanDerWaalsContact O-CZ 3.27Å; H453-R458 PolarHBondContact O-NE 3.22Å; H453-R458 PolarHBondContact O-NH2 3.49Å; D454-R458 PolarHBondContact O-N 3.21Å; A455-R458 PolarHBondContact O-N 3.24Å; A455-R458 VanDerWaalsContact O-N 3.1Å; I456-R458 VanDerWaalsContact C-N 3.34Å; R458-R460 VanDerWaalsContact C-N 3.31Å; R458-R460 PolarHBondContact O-N 2.93Å; R458-L461 PolarHBondContact O-N 3.23Å; R458-L461 VanDerWaalsContact O-N 3.12Å
459	A	57.2	Low	53.3	Low	63 Å²	63	130.2 Å²	130.2	52%	0.521	66%	0.664	S	S	.	*	H	α-helix	trans	-61.1	-37.4	178.7	0	0	0	0	0	112.8	A455 I456 L461 L462	A455-A459 PolarHBondContact O-N 2.88Å; I456-A459 PolarHBondContact O-N 3.05Å; A459-L461 PolarHBondContact O-N 2.92Å; A459-L462 PolarHBondContact O-N 3.46Å
460	R	58.7	Low	54.9	Low	199 Å²	199	133.4 Å²	133.4	75%	0.751	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-67.6	-18.7	176.7	-173.3	172.2	-73.1	168.8	-2.2	113.9	I456 R458	I456-R460 PolarHBondContact O-N 3.28Å; R458-R460 VanDerWaalsContact C-N 3.31Å; R458-R460 PolarHBondContact O-N 2.93Å
461	L	53.1	Low	56.7	Low	152 Å²	152	124.1 Å²	124.1	80%	0.796	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-90.1	-1.8	179.7	-158.7	67.8	0	0	0	113.1	R458 A459	R458-L461 PolarHBondContact O-N 3.23Å; R458-L461 VanDerWaalsContact O-N 3.12Å; A459-L461 PolarHBondContact O-N 2.92Å
462	L	53.3	Low	58.8	Low	152 Å²	152	124.5 Å²	124.5	80%	0.796	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-111.8	21.6	-177.3	-71.5	168.7	0	0	0	112.9	A459	A459-L462 PolarHBondContact O-N 3.46Å
463	Q	51.9	Low	60.4	Low	146 Å²	146	119.4 Å²	119.4	68%	0.682	61%	0.612	S	S	*	*			trans	-100.2	23.1	-179.1	-57.8	-169.2	-96.5	0	0	113.4
464	E	42.8	Very low	61.7	Low	175 Å²	175	118.4 Å²	118.4	82%	0.818	61%	0.61	S	S	*	*			trans	-124.2	111.6	179.8	-65.1	-172.9	-175.9	0	0	111	S466	E464-S466 PolarHBondContact O-N 3.38Å
465	D	49.8	Very low	62.7	Low	154 Å²	154	118 Å²	118	82%	0.824	61%	0.605	S	S	*	*			trans	-72.2	11.6	-159.6	-56.7	-67.5	0	0	0	116.8	V467	D465-V467 PolarHBondContact O-N 2.94Å
466	S	57.9	Low	64.1	Low	78 Å²	78	117.3 Å²	117.3	55%	0.545	59%	0.591	S	S	.	*	S	Bend	trans	-82.7	-7.8	-160	-157.2	0	0	0	0	117.1	E464 K470	E464-S466 PolarHBondContact O-N 3.38Å; S466-K470 WeakPolarHBondContact O-CE 3.36Å; S466-K470 PolarHBondContact O-NZ 3.16Å; S466-K470 PolarHBondContact OG-NZ 3.02Å
467	V	60.3	Low	64.6	Low	102 Å²	102	117.1 Å²	117.1	62%	0.618	59%	0.59	S	S	*	*	S	Bend	trans	-106.1	-34.3	-167.8	-174.5	0	0	0	0	113.5	D465 E469 K470	D465-V467 PolarHBondContact O-N 2.94Å; V467-E469 PolarHBondContact O-N 2.89Å; V467-K470 PolarHBondContact O-N 2.7Å; V467-K470 VanDerWaalsContact O-N 3.17Å
468	Y	66.9	Low	65.1	Low	84 Å²	84	118.5 Å²	118.5	33%	0.329	59%	0.587	S	S	.	*	G	3₁₀ helix	trans	-64	-38.6	-170.6	-177.1	-86.3	0	0	0	113.2	K470 L471 Q476 L479 K480	Y468-K470 PolarHBondContact O-N 2.95Å; Y468-L471 PolarHBondContact O-N 3.09Å; Y468-Q476 HydrophobicContact CE1-CG 4.18Å; Y468-L479 HydrophobicContact CD2-CD2 3.88Å; Y468-L479 HydrophobicContact CE2-CB 4.45Å; Y468-L479 HydrophobicContact CE2-CD2 3.77Å; Y468-K480 VanDerWaalsContact OH-CE 3.25Å; Y468-K480 WeakPolarHBondContact OH-CE 3.25Å
469	E	70.7	Confident	66.2	Low	169 Å²	169	115.9 Å²	115.9	79%	0.79	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-68.9	-15.8	179.5	-61.4	-168.3	133.4	0	0	114.1	V467	V467-E469 PolarHBondContact O-N 2.89Å
470	K	72.3	Confident	67.3	Low	160 Å²	160	118.9 Å²	118.9	70%	0.696	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-91.3	-0.9	-177.2	-64.6	173.5	-177.7	144.5	0	113.7	S466 V467 Y468	S466-K470 WeakPolarHBondContact O-CE 3.36Å; S466-K470 PolarHBondContact O-NZ 3.16Å; S466-K470 PolarHBondContact OG-NZ 3.02Å; V467-K470 PolarHBondContact O-N 2.7Å; V467-K470 VanDerWaalsContact O-N 3.17Å; Y468-K470 PolarHBondContact O-N 2.95Å
471	L	71.3	Confident	67.9	Low	50 Å²	50	110.6 Å²	110.6	26%	0.262	56%	0.559	S	S	.	*	S	Bend	trans	-85.9	143	176.7	-62.9	170.3	0	0	0	110.7	Y468 Q475 Q476 L479	Y468-L471 PolarHBondContact O-N 3.09Å; L471-Q475 HydrophobicContact CB-CB 4.18Å; L471-Q476 HydrophobicContact CB-CG 3.96Å; L471-Q476 PolarHBondContact O-NE2 2.91Å; L471-L479 HydrophobicContact CD1-CD2 4.31Å
472	D	82.2	Confident	68.9	Low	100 Å²	100	106.4 Å²	106.4	54%	0.535	55%	0.547	S	S	.	.			trans	-50.8	146.8	173.5	-99.4	-35.2	0	0	0	111.8	I474 Q475 Q476	D472-I474 PolarHBondContact O-N 2.7Å; D472-Q475 HydrophobicContact CB-CB 4.15Å; D472-Q475 HydrophobicContact CB-CG 3.91Å; D472-Q475 CarbonylContact O-C 3.46Å; D472-Q475 WeakPolarHBondContact O-CA 3.38Å; D472-Q475 WeakPolarHBondContact O-CB 3.41Å; D472-Q475 PolarHBondContact O-N 2.94Å; D472-Q476 PolarHBondContact O-N 3.02Å
473	P	81.4	Confident	69.9	Low	90 Å²	90	103.6 Å²	103.6	58%	0.584	55%	0.545	S	S	*	.	H	α-helix	trans	-54.2	-33	176.7	-27.8	35.5	0	0	0	113.8	L477	P473-L477 WeakPolarHBondContact O-CD1 3.28Å; P473-L477 PolarHBondContact O-N 3.05Å
474	I	74.4	Confident	71.1	Confident	117 Å²	117	100 Å²	100	60%	0.6	54%	0.54	S	S	*	.	H	α-helix	trans	-69.4	-39.6	174.5	-60.9	174.4	0	0	0	111	D472 L477 R478	D472-I474 PolarHBondContact O-N 2.7Å; I474-L477 PolarHBondContact O-N 2.92Å; I474-R478 WeakPolarHBondContact O-CB 3.37Å; I474-R478 VanDerWaalsContact O-CG 3.28Å; I474-R478 WeakPolarHBondContact O-CG 3.49Å; I474-R478 PolarHBondContact O-N 2.85Å
475	Q	75.5	Confident	72.1	Confident	95 Å²	95	94.8 Å²	94.8	44%	0.444	53%	0.534	S	S	.	.	H	α-helix	trans	-70.2	-39.2	175.6	-64.8	179.6	13.7	0	0	111.2	L471 D472 R478 L479	L471-Q475 HydrophobicContact CB-CB 4.18Å; D472-Q475 HydrophobicContact CB-CB 4.15Å; D472-Q475 HydrophobicContact CB-CG 3.91Å; D472-Q475 CarbonylContact O-C 3.46Å; D472-Q475 WeakPolarHBondContact O-CA 3.38Å; D472-Q475 WeakPolarHBondContact O-CB 3.41Å; D472-Q475 PolarHBondContact O-N 2.94Å; Q475-R478 PolarHBondContact O-N 3.45Å; Q475-L479 WeakPolarHBondContact O-CB 3.29Å; Q475-L479 PolarHBondContact O-N 3.38Å
476	Q	84	Confident	73.3	Confident	46 Å²	46	92.7 Å²	92.7	22%	0.215	52%	0.522	C	S	.	.	H	α-helix	trans	-61.4	-42.6	171.1	-67.3	-173.9	31.5	0	0	112.2	Y468 L471 D472 L479 K480	Y468-Q476 HydrophobicContact CE1-CG 4.18Å; L471-Q476 HydrophobicContact CB-CG 3.96Å; L471-Q476 PolarHBondContact O-NE2 2.91Å; D472-Q476 PolarHBondContact O-N 3.02Å; Q476-L479 PolarHBondContact O-N 2.82Å; Q476-K480 WeakPolarHBondContact O-CB 3.22Å; Q476-K480 WeakPolarHBondContact O-CG 3.22Å; Q476-K480 PolarHBondContact O-N 2.76Å
477	L	77.2	Confident	73.6	Confident	125 Å²	125	94.9 Å²	94.9	65%	0.654	53%	0.534	S	S	*	.	H	α-helix	trans	-63	-40.9	173.3	-106.7	85.3	0	0	0	111.7	P473 I474 K480 A481	P473-L477 WeakPolarHBondContact O-CD1 3.28Å; P473-L477 PolarHBondContact O-N 3.05Å; I474-L477 PolarHBondContact O-N 2.92Å; L477-K480 PolarHBondContact O-N 3.16Å; L477-A481 VanDerWaalsContact O-CB 3.31Å; L477-A481 WeakPolarHBondContact O-CB 3.41Å; L477-A481 PolarHBondContact O-N 3.16Å
478	R	73.8	Confident	74.1	Confident	84 Å²	84	93 Å²	93	32%	0.317	52%	0.523	S	S	.	.	H	α-helix	trans	-64.5	-41.4	175.6	-75	178.4	160.7	-121.1	-14.5	112.1	I474 Q475 A481 A482 V488 P489	I474-R478 WeakPolarHBondContact O-CB 3.37Å; I474-R478 VanDerWaalsContact O-CG 3.28Å; I474-R478 WeakPolarHBondContact O-CG 3.49Å; I474-R478 PolarHBondContact O-N 2.85Å; Q475-R478 PolarHBondContact O-N 3.45Å; R478-A481 PolarHBondContact O-N 3.13Å; R478-A482 WeakPolarHBondContact O-CB 3.46Å; R478-A482 PolarHBondContact O-N 2.78Å; R478-V488 HydrophobicContact CG-CG1 3.91Å; R478-P489 PolarHBondContact NH2-O 2.74Å
479	L	76.3	Confident	73.8	Confident	92 Å²	92	93.8 Å²	93.8	48%	0.482	54%	0.539	S	S	.	.	H	α-helix	trans	-66.2	-41	176.1	-140.8	78.4	0	0	0	111.3	Y468 L471 Q475 Q476 A483	Y468-L479 HydrophobicContact CD2-CD2 3.88Å; Y468-L479 HydrophobicContact CE2-CB 4.45Å; Y468-L479 HydrophobicContact CE2-CD2 3.77Å; L471-L479 HydrophobicContact CD1-CD2 4.31Å; Q475-L479 WeakPolarHBondContact O-CB 3.29Å; Q475-L479 PolarHBondContact O-N 3.38Å; Q476-L479 PolarHBondContact O-N 2.82Å; L479-A483 WeakPolarHBondContact O-CB 3.39Å; L479-A483 PolarHBondContact O-N 3.05Å
480	K	78.8	Confident	72.9	Confident	127 Å²	127	90.3 Å²	90.3	55%	0.552	54%	0.538	S	S	*	.	H	α-helix	trans	-63.6	-42.6	172.9	-80.2	171.1	170.3	168.2	0	112.7	Y468 Q476 L477 A483 A484	Y468-K480 VanDerWaalsContact OH-CE 3.25Å; Y468-K480 WeakPolarHBondContact OH-CE 3.25Å; Q476-K480 WeakPolarHBondContact O-CB 3.22Å; Q476-K480 WeakPolarHBondContact O-CG 3.22Å; Q476-K480 PolarHBondContact O-N 2.76Å; L477-K480 PolarHBondContact O-N 3.16Å; K480-A483 PolarHBondContact O-N 3.49Å; K480-A484 VanDerWaalsContact O-CB 3.27Å; K480-A484 WeakPolarHBondContact O-CB 3.41Å; K480-A484 PolarHBondContact O-N 3.4Å
481	A	73	Confident	71.9	Confident	24 Å²	24	88.5 Å²	88.5	20%	0.198	54%	0.536	C	S	.	.	H	α-helix	trans	-66.2	-42.7	177.2	0	0	0	0	0	112	L477 R478 A484 G485 L486 V488	L477-A481 VanDerWaalsContact O-CB 3.31Å; L477-A481 WeakPolarHBondContact O-CB 3.41Å; L477-A481 PolarHBondContact O-N 3.16Å; R478-A481 PolarHBondContact O-N 3.13Å; A481-A484 CarbonylContact O-C 2.99Å; A481-A484 PolarHBondContact O-N 3.13Å; A481-G485 PolarHBondContact O-N 3.46Å; A481-L486 HydrophobicContact CB-CB 4.39Å; A481-L486 PolarHBondContact O-N 2.99Å; A481-V488 HydrophobicContact CB-CG2 3.61Å
482	A	73.3	Confident	70.6	Confident	65 Å²	65	92.2 Å²	92.2	54%	0.537	56%	0.56	S	S	.	*	H	α-helix	trans	-64.1	-43.8	174.2	0	0	0	0	0	112.1	R478 A484 G485	R478-A482 WeakPolarHBondContact O-CB 3.46Å; R478-A482 PolarHBondContact O-N 2.78Å; A482-A484 PolarHBondContact O-N 2.9Å; A482-G485 PolarHBondContact O-N 3.04Å
483	A	74.2	Confident	68.6	Low	93 Å²	93	92.6 Å²	92.6	77%	0.769	57%	0.571	S	S	*	*	H	α-helix	trans	-65.1	-23.9	174.3	0	0	0	0	0	113.3	L479 K480	L479-A483 WeakPolarHBondContact O-CB 3.39Å; L479-A483 PolarHBondContact O-N 3.05Å; K480-A483 PolarHBondContact O-N 3.49Å
484	A	76.3	Confident	66.2	Low	69 Å²	69	98 Å²	98	57%	0.57	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	5.2	172.5	0	0	0	0	0	113.9	K480 A481 A482 L486	K480-A484 VanDerWaalsContact O-CB 3.27Å; K480-A484 WeakPolarHBondContact O-CB 3.41Å; K480-A484 PolarHBondContact O-N 3.4Å; A481-A484 CarbonylContact O-C 2.99Å; A481-A484 PolarHBondContact O-N 3.13Å; A482-A484 PolarHBondContact O-N 2.9Å; A484-L486 VanDerWaalsContact C-N 3.27Å; A484-L486 HydrophobicContact CB-CD1 4.41Å; A484-L486 PolarHBondContact O-N 3.4Å
485	G	64.7	Low	64.5	Low	67 Å²	67	98.1 Å²	98.1	69%	0.691	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	70.3	14.8	179	0	0	0	0	0	115.3	A481 A482	A481-G485 PolarHBondContact O-N 3.46Å; A482-G485 PolarHBondContact O-N 3.04Å
486	L	73.9	Confident	62.4	Low	110 Å²	110	99.4 Å²	99.4	58%	0.576	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-84.7	135.5	-179.9	-70.8	167.6	0	0	0	111.2	A481 A484 V488	A481-L486 HydrophobicContact CB-CB 4.39Å; A481-L486 PolarHBondContact O-N 2.99Å; A484-L486 VanDerWaalsContact C-N 3.27Å; A484-L486 HydrophobicContact CB-CD1 4.41Å; A484-L486 PolarHBondContact O-N 3.4Å; L486-V488 PolarHBondContact O-N 2.56Å
487	P	66	Low	60.1	Low	124 Å²	124	102.2 Å²	102.2	81%	0.805	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-69.9	117.5	179.4	27.6	-33.7	0	0	0	111.4
488	V	69.3	Low	57.9	Low	61 Å²	61	103.9 Å²	103.9	37%	0.37	65%	0.651	S	S	.	*	P	Polyproline II helix	trans	-99.8	123	179.2	176.5	0	0	0	0	110.2	R478 A481 L486	R478-V488 HydrophobicContact CG-CG1 3.91Å; A481-V488 HydrophobicContact CB-CG2 3.61Å; L486-V488 PolarHBondContact O-N 2.56Å
489	P	60.4	Low	56	Low	102 Å²	102	107.2 Å²	107.2	66%	0.662	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-61.3	142.5	176.2	-25.3	35.1	0	0	0	113.7	R478	R478-P489 PolarHBondContact NH2-O 2.74Å
490	A	52.7	Low	54.1	Low	95 Å²	95	112 Å²	112	79%	0.785	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-59.9	144.9	175.4	0	0	0	0	0	111.8
491	L	51.4	Low	51.8	Low	122 Å²	122	110.4 Å²	110.4	64%	0.639	70%	0.695	S	S	*	*			trans	-94.2	112.3	176.8	-125.9	174	0	0	0	108.4	S493	L491-S493 PolarHBondContact O-N 3.39Å
492	V	44.1	Very low	49.7	Very low	129 Å²	129	116 Å²	116	78%	0.782	72%	0.722	S	S	*	*			trans	-80	102.2	175.1	-179.3	0	0	0	0	108.7	K494	V492-K494 PolarHBondContact O-N 3.43Å
493	S	39.3	Very low	47.9	Very low	108 Å²	108	121.4 Å²	121.4	76%	0.755	74%	0.736	S	S	*	*			trans	-72.4	120.6	176.2	36.9	0	0	0	0	111.1	L491	L491-S493 PolarHBondContact O-N 3.39Å
494	K	32.2	Very low	45.9	Very low	203 Å²	203	122.1 Å²	122.1	88%	0.883	74%	0.735	S	S	*	*			trans	-90.2	122.3	164.5	-63.8	179.8	-179.3	179.7	0	108.4	V492	V492-K494 PolarHBondContact O-N 3.43Å
495	S	38	Very low	43.9	Very low	120 Å²	120	127 Å²	127	84%	0.839	75%	0.746	S	S	*	*			trans	-109.5	142	167.7	48.2	0	0	0	0	110.2
496	S	31.8	Very low	42.5	Very low	121 Å²	121	133.4 Å²	133.4	85%	0.846	76%	0.755	S	S	*	*			trans	-96.4	142.4	-165.1	-49.6	0	0	0	0	113.3
497	A	34.9	Very low	40.6	Very low	105 Å²	105	133.8 Å²	133.8	87%	0.868	77%	0.767	S	S	*	*			trans	-145.9	147.5	151.2	0	0	0	0	0	108
498	E	32.1	Very low	39	Very low	160 Å²	160	135.4 Å²	135.4	75%	0.748	77%	0.769	S	S	*	*			trans	-111.2	161.5	-158.7	-76.3	-168.6	77.1	0	0	115.6
499	Q	32.9	Very low	37.3	Very low	155 Å²	155	141 Å²	141	72%	0.724	79%	0.791	S	S	*	*			trans	58.1	101.7	151.6	-67.7	160.7	46.5	0	0	118.5
500	Q	37.3	Very low	35.8	Very low	192 Å²	192	144.6 Å²	144.6	90%	0.897	80%	0.803	S	S	*	*				-162.5	113.1	103.5	-102.9	167.3	37	0	0	113.8
501	S	29.6	Very low	34.8	Very low	94 Å²	94	144.2 Å²	144.2	66%	0.657	80%	0.8	S	S	*	*			trans	22.8	127.5	149.9	58.8	0	0	0	0	123
502	N	29.9	Very low	33.7	Very low	140 Å²	140	144.4 Å²	144.4	75%	0.749	81%	0.807	S	S	*	*			trans	100.2	101	131.6	-67.2	-8.3	0	0	0	122.4
503	Q	35.8	Very low	32.9	Very low	180 Å²	180	148 Å²	148	84%	0.841	81%	0.812	S	S	*	*				103.6	145.9	129.5	-68.3	178	17.9	0	0	121.1
504	S	32.5	Very low	32.4	Very low	108 Å²	108	148.3 Å²	148.3	76%	0.755	81%	0.81	S	S	*	*			trans	67.1	68	168.9	-165.1	0	0	0	0	119.2
505	E	32.6	Very low	32.3	Very low	170 Å²	170	145.2 Å²	145.2	79%	0.794	81%	0.808	S	S	*	*				40.6	109.1	112	-60.5	178.7	-163.6	0	0	120.3
506	K	35.5	Very low	32	Very low	203 Å²	203	144.7 Å²	144.7	88%	0.883	80%	0.804	S	S	*	*				-164.6	148.6	100.9	-101.4	153.7	-172.1	166.4	0	111.9
507	S	35.6	Very low	32.2	Very low	118 Å²	118	145.7 Å²	145.7	83%	0.825	80%	0.8	S	S	*	*			trans	-92.2	149.1	-165.5	39.7	0	0	0	0	114.1
508	N	31.3	Very low	32.5	Very low	157 Å²	157	145.8 Å²	145.8	84%	0.84	79%	0.792	S	S	*	*			trans	-78.2	147.2	158.3	-56.2	-73.4	0	0	0	109.3
509	E	33.6	Very low	33.2	Very low	180 Å²	180	141.1 Å²	141.1	84%	0.841	77%	0.774	S	S	*	*			trans	-149.6	131.6	147	-159.4	157.9	-145	0	0	111.8	A511	E509-A511 PolarHBondContact O-N 2.97Å
510	L	29.1	Very low	34.1	Very low	176 Å²	176	138.8 Å²	138.8	92%	0.921	78%	0.781	S	S	*	*			trans	-83.5	92	170.5	-97.2	68	0	0	0	108.7
511	A	30.9	Very low	35.5	Very low	87 Å²	87	132.3 Å²	132.3	72%	0.719	77%	0.766	S	S	*	*			trans	-93.9	106.7	176.2	0	0	0	0	0	112	E509	E509-A511 PolarHBondContact O-N 2.97Å
512	V	29.5	Very low	37.8	Very low	127 Å²	127	129 Å²	129	77%	0.77	74%	0.741	S	S	*	*			trans	32.7	131.4	138.4	-174.6	0	0	0	0	119.4	T514	V512-T514 PolarHBondContact O-N 3.16Å
513	F	27.7	Very low	40.3	Very low	204 Å²	204	124.4 Å²	124.4	90%	0.895	72%	0.715	S	S	*	*	S	Bend	trans	-39.4	102.7	162.8	-66.3	-103.1	0	0	0	114.5
514	T	28.6	Very low	42.6	Very low	115 Å²	115	121.2 Å²	121.2	71%	0.706	70%	0.699	S	S	*	*			trans	-173.6	137.8	138.2	14.4	0	0	0	0	113.6	V512 S516	V512-T514 PolarHBondContact O-N 3.16Å; T514-S516 PolarHBondContact O-N 2.8Å
515	T	29.2	Very low	45.1	Very low	138 Å²	138	119.6 Å²	119.6	85%	0.847	68%	0.681	S	S	*	*			trans	36.4	75.9	149.6	58.1	0	0	0	0	119.9
516	S	31.1	Very low	47.7	Very low	109 Å²	109	113.2 Å²	113.2	76%	0.762	65%	0.651	S	S	*	*	S	Bend	trans	-161.9	145.2	141.9	48	0	0	0	0	113.2	T514	T514-S516 PolarHBondContact O-N 2.8Å
517	N	35.7	Very low	49.7	Very low	141 Å²	141	112.5 Å²	112.5	75%	0.754	65%	0.647	S	S	*	*			trans	32.4	86.5	166.3	-66.5	-11.6	0	0	0	119	T519	N517-T519 VanDerWaalsContact C-N 3.29Å; N517-T519 PolarHBondContact O-N 3.27Å
518	P	42	Very low	52	Low	108 Å²	108	115.2 Å²	115.2	70%	0.701	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-74.1	-9.1	-179.3	31.7	-36.9	0	0	0	115.5
519	T	47.8	Very low	54.6	Low	62 Å²	62	111.8 Å²	111.8	38%	0.38	63%	0.631	S	S	.	*	G	3₁₀ helix	trans	-90.5	-6.2	-162.9	-22.1	0	0	0	0	115.1	N517 G521 L522 E537	N517-T519 VanDerWaalsContact C-N 3.29Å; N517-T519 PolarHBondContact O-N 3.27Å; T519-G521 VanDerWaalsContact C-N 3.32Å; T519-G521 PolarHBondContact O-N 3.22Å; T519-L522 HydrophobicContact CG2-CD1 4.27Å; T519-E537 WeakPolarHBondContact CG2-OE2 3.47Å
520	A	50.3	Low	57.1	Low	105 Å²	105	107.7 Å²	107.7	87%	0.868	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-71.7	-18.5	-169.1	0	0	0	0	0	115.2
521	G	67.7	Low	59.8	Low	56 Å²	56	105.1 Å²	105.1	58%	0.577	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-117.8	17.5	-176.2	0	0	0	0	0	115.3	T519 R544	T519-G521 VanDerWaalsContact C-N 3.32Å; T519-G521 PolarHBondContact O-N 3.22Å; G521-R544 PolarHBondContact O-NH2 2.91Å
522	L	77.5	Confident	62.6	Low	25 Å²	25	102.9 Å²	102.9	13%	0.131	58%	0.583	C	S	.	*	S	Bend	trans	-97.6	137.2	-177.7	-54.5	-178.8	0	0	0	111.2	T519 K524 E537 Q540 V541	T519-L522 HydrophobicContact CG2-CD1 4.27Å; L522-K524 PolarHBondContact O-N 3.33Å; L522-E537 HydrophobicContact CB-CG 4.01Å; L522-E537 HydrophobicContact CD1-CB 3.76Å; L522-E537 HydrophobicContact CD1-CG 3.9Å; L522-Q540 HydrophobicContact CD2-CB 4.13Å; L522-V541 HydrophobicContact CD1-CG2 4.1Å; L522-V541 HydrophobicContact CD2-CG2 4.11Å
523	M	81.3	Confident	65.5	Low	43 Å²	43	97.7 Å²	97.7	21%	0.212	55%	0.551	C	S	.	*			trans	-68.2	131.6	179.4	-68.5	-153.5	-61.2	0	0	111.7	I525 Q533 F536 Q540 L577 N581	M523-I525 HydrophobicContact CB-CD1 4.23Å; M523-I525 HydrophobicContact CB-CG1 4.22Å; M523-I525 HydrophobicContact CE-CD1 3.73Å; M523-I525 HydrophobicContact SD-CD1 4.17Å; M523-Q533 PolarHBondContact O-NE2 2.7Å; M523-F536 HydrophobicContact CB-CE1 3.97Å; M523-F536 HydrophobicContact CE-CE1 4.32Å; M523-F536 HydrophobicContact CE-CZ 3.94Å; M523-Q540 PolarHBondContact O-NE2 3.06Å; M523-Q540 VanDerWaalsContact O-NE2 3.11Å; M523-L577 WeakPolarHBondContact CE-O 3.37Å; M523-N581 HydrophobicContact CE-CB 3.76Å; M523-N581 HydrophobicContact SD-CB 3.76Å; M523-N581 VanDerWaalsContact SD-CG 3.56Å; M523-N581 PolarHBondContact SD-ND2 2.82Å
524	K	85.5	Confident	68.5	Low	113 Å²	113	90.8 Å²	90.8	49%	0.491	53%	0.531	S	S	.	.			trans	-111.6	87.7	-179.5	-55.8	-155	176.9	-144.4	0	111.9	L522 E537	L522-K524 PolarHBondContact O-N 3.33Å; K524-E537 WeakPolarHBondContact CE-OE1 3.43Å; K524-E537 IonicContact NZ-OE1 3.05Å; K524-E537 PolarHBondContact NZ-OE1 3.17Å; K524-E537 IonicContact NZ-OE2 3.74Å
525	I	85.3	Confident	71.4	Confident	75 Å²	75	86.5 Å²	86.5	39%	0.385	50%	0.502	S	S	.	.			trans	-105.4	-44.1	-170.3	-60.7	-175.1	0	0	0	110.6	M523 K527 F536 L577	M523-I525 HydrophobicContact CB-CD1 4.23Å; M523-I525 HydrophobicContact CB-CG1 4.22Å; M523-I525 HydrophobicContact CE-CD1 3.73Å; M523-I525 HydrophobicContact SD-CD1 4.17Å; I525-K527 PolarHBondContact O-N 3.26Å; I525-F536 HydrophobicContact CB-CE1 4.39Å; I525-F536 HydrophobicContact CD1-CE1 3.94Å; I525-F536 HydrophobicContact CD1-CZ 4.25Å; I525-F536 HydrophobicContact CG1-CE1 4.16Å; I525-L577 HydrophobicContact CD1-CB 4.31Å; I525-L577 HydrophobicContact CD1-CD1 4.05Å; I525-L577 HydrophobicContact CD1-CD2 3.9Å; I525-L577 HydrophobicContact CD1-CG 4.3Å; I525-L577 HydrophobicContact CG2-CD1 4.11Å; I525-L577 HydrophobicContact CG2-CD2 4.47Å
526	F	85.5	Confident	74.4	Confident	35 Å²	35	80 Å²	80	15%	0.154	46%	0.462	C	S	.	.			trans	-86.1	58	-175.8	-58.3	-73.2	0	0	0	111.8	M528 D529 K532 Q533 F536 F574 L577	F526-M528 PolarHBondContact O-N 2.91Å; F526-M528 VanDerWaalsContact O-N 3.16Å; F526-D529 CarbonylContact O-C 3.56Å; F526-D529 PolarHBondContact O-N 3.02Å; F526-K532 HydrophobicContact CB-CB 4.26Å; F526-K532 HydrophobicContact CB-CG 4.21Å; F526-K532 HydrophobicContact CD1-CD 3.8Å; F526-K532 HydrophobicContact CD1-CG 3.97Å; F526-K532 HydrophobicContact CD2-CG 4.03Å; F526-K532 HydrophobicContact CE1-CD 4.05Å; F526-K532 HydrophobicContact CE1-CG 4.35Å; F526-K532 HydrophobicContact CE2-CG 4.39Å; F526-K532 HydrophobicContact CG-CB 4.38Å; F526-K532 HydrophobicContact CG-CD 4.16Å; F526-K532 HydrophobicContact CG-CG 3.8Å; F526-Q533 HydrophobicContact CB-CB 4.04Å; F526-F536 HydrophobicContact CD2-CB 3.86Å; F526-F536 AromaticContact CD2-CD1 3.99Å; F526-F536 HydrophobicContact CD2-CD1 3.99Å; F526-F536 AromaticContact CD2-CG 4Å; F526-F536 HydrophobicContact CD2-CG 4Å; F526-F536 HydrophobicContact CE2-CB 3.92Å; F526-F536 AromaticContact CE2-CD1 3.94Å; F526-F536 HydrophobicContact CE2-CD1 3.94Å; F526-F536 HydrophobicContact CE2-CD2 4.13Å; F526-F536 HydrophobicContact CE2-CE1 4.5Å; F526-F536 AromaticContact CE2-CG 3.73Å; F526-F536 HydrophobicContact CE2-CG 3.73Å; F526-F574 HydrophobicContact CD2-CE1 4.23Å; F526-F574 AromaticContact CE2-CD1 3.81Å; F526-F574 HydrophobicContact CE2-CD1 3.81Å; F526-F574 AromaticContact CE2-CE1 3.45Å; F526-F574 HydrophobicContact CE2-CE1 3.45Å; F526-F574 VanDerWaalsContact CE2-CE1 3.45Å; F526-F574 HydrophobicContact CE2-CZ 4.49Å; F526-F574 AromaticContact CZ-CD1 3.98Å; F526-F574 HydrophobicContact CZ-CD1 3.98Å; F526-F574 AromaticContact CZ-CE1 3.77Å; F526-F574 HydrophobicContact CZ-CE1 3.77Å; F526-L577 HydrophobicContact CE1-CD1 4.43Å; F526-L577 HydrophobicContact CE2-CD1 3.72Å; F526-L577 HydrophobicContact CZ-CD1 3.45Å; F526-L577 VanDerWaalsContact CZ-CD1 3.45Å
527	K	79	Confident	77.3	Confident	188 Å²	188	76.2 Å²	76.2	82%	0.817	43%	0.433	S	S	*	.	S	Bend	trans	-62.3	-21.4	-175.8	-67.3	-174.3	-179.9	-179	0	114.7	I525	I525-K527 PolarHBondContact O-N 3.26Å
528	M	83.5	Confident	80	Confident	176 Å²	176	71.5 Å²	71.5	87%	0.867	41%	0.413	S	S	*	.	S	Bend	trans	-80.9	-44.1	175.6	-157.6	70.9	72.8	0	0	111.5	F526 S530	F526-M528 PolarHBondContact O-N 2.91Å; F526-M528 VanDerWaalsContact O-N 3.16Å; M528-S530 PolarHBondContact O-N 3.29Å
529	D	85.2	Confident	82.4	Confident	85 Å²	85	66.5 Å²	66.5	46%	0.455	38%	0.38	S	S	.	.			trans	-101	83.7	-171.8	-63.7	-32.5	0	0	0	111.1	F526 N531 K532 Q533	F526-D529 CarbonylContact O-C 3.56Å; F526-D529 PolarHBondContact O-N 3.02Å; D529-N531 PolarHBondContact O-N 2.9Å; D529-N531 VanDerWaalsContact O-N 3.13Å; D529-K532 HydrophobicContact CB-CB 3.49Å; D529-K532 VanDerWaalsContact CB-CB 3.49Å; D529-K532 HydrophobicContact CB-CD 4.33Å; D529-K532 HydrophobicContact CB-CG 4.48Å; D529-K532 WeakPolarHBondContact O-CA 3.35Å; D529-K532 WeakPolarHBondContact O-CB 3.46Å; D529-K532 PolarHBondContact O-N 3.03Å; D529-Q533 PolarHBondContact O-N 2.66Å
530	S	86.7	Confident	84.4	Confident	94 Å²	94	63.7 Å²	63.7	66%	0.657	36%	0.363	S	S	*	.	H	α-helix	trans	-51.5	-40.9	-178.9	-172.4	0	0	0	0	113.2	M528 K532 Q533 A534	M528-S530 PolarHBondContact O-N 3.29Å; S530-K532 PolarHBondContact O-N 3.25Å; S530-Q533 PolarHBondContact O-N 3.33Å; S530-A534 WeakPolarHBondContact O-CB 3.38Å; S530-A534 PolarHBondContact O-N 2.98Å
531	N	86.7	Confident	86.4	Confident	121 Å²	121	60.6 Å²	60.6	65%	0.647	33%	0.333	S	S	*	.	H	α-helix	trans	-65.7	-35.2	177.3	-70.2	-21	0	0	0	112.9	D529 R535	D529-N531 PolarHBondContact O-N 2.9Å; D529-N531 VanDerWaalsContact O-N 3.13Å; N531-R535 PolarHBondContact O-N 2.88Å; N531-R535 VanDerWaalsContact O-N 3.15Å; N531-R535 PolarHBondContact O-NH1 2.91Å
532	K	89.2	Confident	87.5	Confident	41 Å²	41	59.1 Å²	59.1	18%	0.178	31%	0.312	C	S	.	.	H	α-helix	trans	-75.2	-38.1	176.8	-172.2	161.8	-171.7	147.9	0	111.5	F526 D529 S530 A534 R535 F536 E570 F574	F526-K532 HydrophobicContact CB-CB 4.26Å; F526-K532 HydrophobicContact CB-CG 4.21Å; F526-K532 HydrophobicContact CD1-CD 3.8Å; F526-K532 HydrophobicContact CD1-CG 3.97Å; F526-K532 HydrophobicContact CD2-CG 4.03Å; F526-K532 HydrophobicContact CE1-CD 4.05Å; F526-K532 HydrophobicContact CE1-CG 4.35Å; F526-K532 HydrophobicContact CE2-CG 4.39Å; F526-K532 HydrophobicContact CG-CB 4.38Å; F526-K532 HydrophobicContact CG-CD 4.16Å; F526-K532 HydrophobicContact CG-CG 3.8Å; D529-K532 HydrophobicContact CB-CB 3.49Å; D529-K532 VanDerWaalsContact CB-CB 3.49Å; D529-K532 HydrophobicContact CB-CD 4.33Å; D529-K532 HydrophobicContact CB-CG 4.48Å; D529-K532 WeakPolarHBondContact O-CA 3.35Å; D529-K532 WeakPolarHBondContact O-CB 3.46Å; D529-K532 PolarHBondContact O-N 3.03Å; S530-K532 PolarHBondContact O-N 3.25Å; K532-A534 VanDerWaalsContact C-N 3.34Å; K532-R535 PolarHBondContact O-N 2.98Å; K532-F536 WeakPolarHBondContact O-CB 3.48Å; K532-F536 PolarHBondContact O-N 3.48Å; K532-E570 VanDerWaalsContact CD-OE1 3.29Å; K532-E570 WeakPolarHBondContact CD-OE1 3.49Å; K532-E570 WeakPolarHBondContact CE-OE1 3.27Å; K532-E570 VanDerWaalsContact CG-OE1 3.31Å; K532-E570 WeakPolarHBondContact CG-OE1 3.36Å; K532-E570 IonicContact NZ-OE1 2.84Å; K532-E570 PolarHBondContact NZ-OE1 2.96Å; K532-F574 HydrophobicContact CG-CE1 4.05Å; K532-F574 HydrophobicContact CG-CZ 4.14Å
533	Q	90.7	Very high	88	Confident	17 Å²	17	59.2 Å²	59.2	8%	0.079	31%	0.314	C	S	.	.	H	α-helix	trans	-62.2	-41.4	172	-176	53	43.1	0	0	111.4	M523 F526 D529 S530 F536 E537	M523-Q533 PolarHBondContact O-NE2 2.7Å; F526-Q533 HydrophobicContact CB-CB 4.04Å; D529-Q533 PolarHBondContact O-N 2.66Å; S530-Q533 PolarHBondContact O-N 3.33Å; Q533-F536 PolarHBondContact O-N 2.84Å; Q533-E537 VanDerWaalsContact NE2-CG 3.32Å; Q533-E537 PolarHBondContact NE2-OE1 3.38Å; Q533-E537 WeakPolarHBondContact O-CG 3.4Å; Q533-E537 PolarHBondContact O-N 3.01Å
534	A	89.3	Confident	88.3	Confident	59 Å²	59	64.1 Å²	64.1	49%	0.488	33%	0.33	S	S	.	.	H	α-helix	trans	-61.8	-44.9	174.2	0	0	0	0	0	112.4	S530 K532 F536 E537 A538	S530-A534 WeakPolarHBondContact O-CB 3.38Å; S530-A534 PolarHBondContact O-N 2.98Å; K532-A534 VanDerWaalsContact C-N 3.34Å; A534-F536 VanDerWaalsContact C-N 3.34Å; A534-F536 PolarHBondContact O-N 3.45Å; A534-E537 PolarHBondContact O-N 3.32Å; A534-A538 PolarHBondContact O-N 3.34Å
535	R	90.1	Very high	88.4	Confident	26 Å²	26	67.3 Å²	67.3	10%	0.098	34%	0.339	C	S	.	.	H	α-helix	trans	-60.6	-41.4	172.5	-71.9	-165.4	-63.2	-82.3	6.9	112.3	N531 K532 A538 Y539 C556 L560 E570 F574	N531-R535 PolarHBondContact O-N 2.88Å; N531-R535 VanDerWaalsContact O-N 3.15Å; N531-R535 PolarHBondContact O-NH1 2.91Å; K532-R535 PolarHBondContact O-N 2.98Å; R535-A538 PolarHBondContact O-N 3.35Å; R535-Y539 VanDerWaalsContact O-CB 3.24Å; R535-Y539 WeakPolarHBondContact O-CB 3.25Å; R535-Y539 PolarHBondContact O-N 2.78Å; R535-C556 WeakPolarHBondContact CD-O 3.36Å; R535-L560 HydrophobicContact CG-CD1 4.24Å; R535-L560 VanDerWaalsContact NH1-CD1 3.26Å; R535-E570 IonicContact CZ-OE1 2.7Å; R535-E570 IonicContact CZ-OE2 3.93Å; R535-E570 IonicContact NE-OE1 3.87Å; R535-E570 IonicContact NE-OE2 2.84Å; R535-E570 PolarHBondContact NE-OE2 3.01Å; R535-E570 IonicContact NH2-OE1 3.45Å; R535-E570 PolarHBondContact NH2-OE1 2.95Å; R535-E570 IonicContact NH2-OE2 3.2Å; R535-E570 PolarHBondContact NH2-OE2 3.38Å; R535-F574 HydrophobicContact CB-CE2 3.92Å; R535-F574 HydrophobicContact CB-CZ 3.99Å
536	F	93.2	Very high	88.4	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-69.2	-33.2	178.8	-174.2	-124.6	0	0	0	113	M523 I525 F526 K532 Q533 A534 Y539 Q540 F574 L577 I578	M523-F536 HydrophobicContact CB-CE1 3.97Å; M523-F536 HydrophobicContact CE-CE1 4.32Å; M523-F536 HydrophobicContact CE-CZ 3.94Å; I525-F536 HydrophobicContact CB-CE1 4.39Å; I525-F536 HydrophobicContact CD1-CE1 3.94Å; I525-F536 HydrophobicContact CD1-CZ 4.25Å; I525-F536 HydrophobicContact CG1-CE1 4.16Å; F526-F536 HydrophobicContact CD2-CB 3.86Å; F526-F536 AromaticContact CD2-CD1 3.99Å; F526-F536 HydrophobicContact CD2-CD1 3.99Å; F526-F536 AromaticContact CD2-CG 4Å; F526-F536 HydrophobicContact CD2-CG 4Å; F526-F536 HydrophobicContact CE2-CB 3.92Å; F526-F536 AromaticContact CE2-CD1 3.94Å; F526-F536 HydrophobicContact CE2-CD1 3.94Å; F526-F536 HydrophobicContact CE2-CD2 4.13Å; F526-F536 HydrophobicContact CE2-CE1 4.5Å; F526-F536 AromaticContact CE2-CG 3.73Å; F526-F536 HydrophobicContact CE2-CG 3.73Å; K532-F536 WeakPolarHBondContact O-CB 3.48Å; K532-F536 PolarHBondContact O-N 3.48Å; Q533-F536 PolarHBondContact O-N 2.84Å; A534-F536 VanDerWaalsContact C-N 3.34Å; A534-F536 PolarHBondContact O-N 3.45Å; F536-Y539 HydrophobicContact CD2-CD1 4.31Å; F536-Y539 HydrophobicContact CE2-CD1 4.45Å; F536-Q540 VanDerWaalsContact CD1-NE2 3.3Å; F536-Q540 HydrophobicContact CE1-CG 4.46Å; F536-Q540 HydrophobicContact CE2-CG 4.29Å; F536-Q540 HydrophobicContact CZ-CG 4.23Å; F536-Q540 WeakPolarHBondContact O-CB 3.38Å; F536-Q540 VanDerWaalsContact O-CG 3.26Å; F536-Q540 WeakPolarHBondContact O-CG 3.49Å; F536-Q540 PolarHBondContact O-N 3.47Å; F536-Q540 PolarHBondContact O-NE2 2.74Å; F536-F574 HydrophobicContact CB-CD1 4.39Å; F536-F574 HydrophobicContact CB-CE1 3.9Å; F536-F574 HydrophobicContact CB-CE2 4.17Å; F536-F574 HydrophobicContact CB-CZ 3.79Å; F536-F574 HydrophobicContact CD2-CB 4.09Å; F536-F574 AromaticContact CD2-CD1 3.67Å; F536-F574 HydrophobicContact CD2-CD1 3.67Å; F536-F574 HydrophobicContact CD2-CD2 4.1Å; F536-F574 HydrophobicContact CD2-CE1 4.07Å; F536-F574 HydrophobicContact CD2-CE2 4.46Å; F536-F574 AromaticContact CD2-CG 3.69Å; F536-F574 HydrophobicContact CD2-CG 3.69Å; F536-F574 HydrophobicContact CD2-CZ 4.45Å; F536-F574 HydrophobicContact CE2-CB 4.29Å; F536-F574 HydrophobicContact CE2-CD1 4.37Å; F536-F574 HydrophobicContact CE2-CG 4.34Å; F536-F574 HydrophobicContact CG-CD1 4.34Å; F536-F574 HydrophobicContact CG-CE1 4.3Å; F536-L577 HydrophobicContact CE2-CB 4.07Å; F536-L577 HydrophobicContact CE2-CD1 4.28Å; F536-L577 HydrophobicContact CZ-CB 3.79Å; F536-L577 HydrophobicContact CZ-CD1 4.09Å; F536-I578 HydrophobicContact CE2-CG1 4.43Å
537	E	91.9	Very high	88.5	Confident	31 Å²	31	68.6 Å²	68.6	15%	0.145	36%	0.361	C	S	.	.	H	α-helix	trans	-68.1	-44	172.1	-76.4	-179	-157.8	0	0	111.3	T519 L522 K524 Q533 A534 Q540 V541	T519-E537 WeakPolarHBondContact CG2-OE2 3.47Å; L522-E537 HydrophobicContact CB-CG 4.01Å; L522-E537 HydrophobicContact CD1-CB 3.76Å; L522-E537 HydrophobicContact CD1-CG 3.9Å; K524-E537 WeakPolarHBondContact CE-OE1 3.43Å; K524-E537 IonicContact NZ-OE1 3.05Å; K524-E537 PolarHBondContact NZ-OE1 3.17Å; K524-E537 IonicContact NZ-OE2 3.74Å; Q533-E537 VanDerWaalsContact NE2-CG 3.32Å; Q533-E537 PolarHBondContact NE2-OE1 3.38Å; Q533-E537 WeakPolarHBondContact O-CG 3.4Å; Q533-E537 PolarHBondContact O-N 3.01Å; A534-E537 PolarHBondContact O-N 3.32Å; E537-Q540 WeakPolarHBondContact O-CB 3.26Å; E537-Q540 PolarHBondContact O-N 3.31Å; E537-V541 WeakPolarHBondContact O-CG2 3.16Å; E537-V541 PolarHBondContact O-N 3.12Å; E537-V541 VanDerWaalsContact O-N 3.13Å
538	A	90.8	Very high	89	Confident	42 Å²	42	62.1 Å²	62.1	35%	0.347	34%	0.343	S	S	.	.	H	α-helix	trans	-64	-43.5	174.6	0	0	0	0	0	112.3	A534 R535 Q540 V541 L542 C556	A534-A538 PolarHBondContact O-N 3.34Å; R535-A538 PolarHBondContact O-N 3.35Å; A538-Q540 PolarHBondContact O-N 3.41Å; A538-V541 WeakPolarHBondContact O-CB 3.48Å; A538-V541 PolarHBondContact O-N 2.89Å; A538-V541 VanDerWaalsContact O-N 3.08Å; A538-L542 PolarHBondContact O-N 3.2Å; A538-C556 HydrophobicContact CB-CB 4.4Å; A538-C556 WeakPolarHBondContact CB-SG 3.22Å
539	Y	93.1	Very high	89.1	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.008	31%	0.313	C	S	.	.	H	α-helix	trans	-58.7	-47.2	175	178.4	-99.5	0	0	0	111.6	R535 F536 V541 L542 V543 H549 A552 C556 F574 I578	R535-Y539 VanDerWaalsContact O-CB 3.24Å; R535-Y539 WeakPolarHBondContact O-CB 3.25Å; R535-Y539 PolarHBondContact O-N 2.78Å; F536-Y539 HydrophobicContact CD2-CD1 4.31Å; F536-Y539 HydrophobicContact CE2-CD1 4.45Å; Y539-V541 PolarHBondContact O-N 3.44Å; Y539-L542 PolarHBondContact O-N 2.78Å; Y539-L542 VanDerWaalsContact O-N 3.14Å; Y539-V543 HydrophobicContact CD1-CG2 4.27Å; Y539-V543 HydrophobicContact CD2-CG2 4.47Å; Y539-V543 HydrophobicContact CE1-CG2 3.95Å; Y539-V543 HydrophobicContact CE2-CG2 4.18Å; Y539-V543 WeakPolarHBondContact O-CG2 2.94Å; Y539-V543 PolarHBondContact O-N 3.1Å; Y539-H549 WeakPolarHBondContact CE2-O 3.24Å; Y539-H549 PolarHBondContact OH-CD2 3.17Å; Y539-A552 HydrophobicContact CD2-CB 3.84Å; Y539-A552 HydrophobicContact CE2-CB 3.87Å; Y539-C556 PolarHBondContact N-SG 3.21Å; Y539-F574 HydrophobicContact CD1-CB 3.77Å; Y539-F574 HydrophobicContact CD1-CD2 4.05Å; Y539-F574 HydrophobicContact CD1-CG 4.3Å; Y539-F574 HydrophobicContact CD2-CD2 4.13Å; Y539-F574 HydrophobicContact CE1-CB 3.55Å; Y539-F574 HydrophobicContact CE2-CB 4.39Å; Y539-F574 HydrophobicContact CG-CB 4.28Å; Y539-F574 AromaticContact CG-CD2 3.79Å; Y539-F574 HydrophobicContact CG-CD2 3.79Å; Y539-F574 HydrophobicContact CG-CG 4.49Å; Y539-I578 HydrophobicContact CD1-CD1 3.72Å; Y539-I578 HydrophobicContact CE1-CD1 3.46Å; Y539-I578 VanDerWaalsContact CE1-CD1 3.46Å; Y539-I578 HydrophobicContact CE1-CG1 4.13Å
540	Q	91.2	Very high	89.1	Confident	3 Å²	3	59.7 Å²	59.7	1%	0.014	33%	0.326	C	S	.	.	H	α-helix	trans	-59.5	-26.7	174.3	-89.5	-175.6	81.1	0	0	114.3	L522 M523 F536 E537 A538 R544 I578	L522-Q540 HydrophobicContact CD2-CB 4.13Å; M523-Q540 PolarHBondContact O-NE2 3.06Å; M523-Q540 VanDerWaalsContact O-NE2 3.11Å; F536-Q540 VanDerWaalsContact CD1-NE2 3.3Å; F536-Q540 HydrophobicContact CE1-CG 4.46Å; F536-Q540 HydrophobicContact CE2-CG 4.29Å; F536-Q540 HydrophobicContact CZ-CG 4.23Å; F536-Q540 WeakPolarHBondContact O-CB 3.38Å; F536-Q540 VanDerWaalsContact O-CG 3.26Å; F536-Q540 WeakPolarHBondContact O-CG 3.49Å; F536-Q540 PolarHBondContact O-N 3.47Å; F536-Q540 PolarHBondContact O-NE2 2.74Å; E537-Q540 WeakPolarHBondContact O-CB 3.26Å; E537-Q540 PolarHBondContact O-N 3.31Å; A538-Q540 PolarHBondContact O-N 3.41Å; Q540-R544 WeakPolarHBondContact O-CB 3.31Å; Q540-R544 WeakPolarHBondContact O-CD 3.16Å; Q540-R544 VanDerWaalsContact O-CG 3.23Å; Q540-R544 WeakPolarHBondContact O-CG 3.43Å; Q540-R544 PolarHBondContact O-N 2.9Å; Q540-R544 PolarHBondContact O-NH1 3.05Å; Q540-I578 HydrophobicContact CG-CD1 4.2Å
541	V	90.8	Very high	89.1	Confident	41 Å²	41	58.8 Å²	58.8	25%	0.248	32%	0.315	C	S	.	.	H	α-helix	trans	-82.1	-37.8	174.5	169.5	0	0	0	0	111.1	L522 E537 A538 Y539 R545	L522-V541 HydrophobicContact CD1-CG2 4.1Å; L522-V541 HydrophobicContact CD2-CG2 4.11Å; E537-V541 WeakPolarHBondContact O-CG2 3.16Å; E537-V541 PolarHBondContact O-N 3.12Å; E537-V541 VanDerWaalsContact O-N 3.13Å; A538-V541 WeakPolarHBondContact O-CB 3.48Å; A538-V541 PolarHBondContact O-N 2.89Å; A538-V541 VanDerWaalsContact O-N 3.08Å; Y539-V541 PolarHBondContact O-N 3.44Å; V541-R545 WeakPolarHBondContact O-CB 3.39Å; V541-R545 VanDerWaalsContact O-CG 3.32Å; V541-R545 WeakPolarHBondContact O-CG 3.3Å; V541-R545 PolarHBondContact O-N 3.35Å; V541-R545 VanDerWaalsContact O-N 3.08Å
542	L	91	Very high	89.3	Confident	24 Å²	24	53 Å²	53	13%	0.126	28%	0.284	C	S	.	.	H	α-helix	trans	-70.2	-42.9	177.2	-68.8	179.6	0	0	0	112.7	A538 Y539 R544 R545 G546 F547 A552 R555 C556	A538-L542 PolarHBondContact O-N 3.2Å; Y539-L542 PolarHBondContact O-N 2.78Å; Y539-L542 VanDerWaalsContact O-N 3.14Å; L542-R544 VanDerWaalsContact C-N 3.33Å; L542-R544 PolarHBondContact O-N 3.06Å; L542-R545 CarbonylContact O-C 3.57Å; L542-R545 WeakPolarHBondContact O-CA 3.19Å; L542-R545 WeakPolarHBondContact O-CB 3.26Å; L542-R545 PolarHBondContact O-N 3.39Å; L542-G546 PolarHBondContact O-N 2.81Å; L542-F547 HydrophobicContact CB-CB 4.39Å; L542-F547 HydrophobicContact CB-CD2 4.1Å; L542-F547 HydrophobicContact CD2-CD2 3.74Å; L542-F547 HydrophobicContact CD2-CE2 3.88Å; L542-F547 HydrophobicContact CG-CD2 4.5Å; L542-F547 WeakPolarHBondContact O-CD2 3.18Å; L542-F547 PolarHBondContact O-N 3.04Å; L542-A552 HydrophobicContact CB-CB 3.75Å; L542-A552 HydrophobicContact CD1-CB 4.49Å; L542-R555 HydrophobicContact CD1-CB 3.52Å; L542-R555 HydrophobicContact CD1-CG 4.43Å; L542-C556 VanDerWaalsContact CD1-SG 3.59Å
543	V	89.4	Confident	89.4	Confident	28 Å²	28	51.8 Å²	51.8	17%	0.17	28%	0.278	C	S	.	.	H	α-helix	trans	-63.1	-39.7	174.5	176.2	0	0	0	0	110.9	Y539 R545 G546 A552 I578	Y539-V543 HydrophobicContact CD1-CG2 4.27Å; Y539-V543 HydrophobicContact CD2-CG2 4.47Å; Y539-V543 HydrophobicContact CE1-CG2 3.95Å; Y539-V543 HydrophobicContact CE2-CG2 4.18Å; Y539-V543 WeakPolarHBondContact O-CG2 2.94Å; Y539-V543 PolarHBondContact O-N 3.1Å; V543-R545 PolarHBondContact O-N 2.98Å; V543-G546 PolarHBondContact O-N 3.46Å; V543-G546 VanDerWaalsContact O-N 3.09Å; V543-A552 HydrophobicContact CG2-CB 3.76Å; V543-I578 HydrophobicContact CB-CD1 4.02Å; V543-I578 HydrophobicContact CG1-CD1 4.07Å; V543-I578 HydrophobicContact CG2-CD1 4.07Å
544	R	86.9	Confident	89.2	Confident	145 Å²	145	57.5 Å²	57.5	55%	0.547	30%	0.304	S	S	.	.	H	α-helix	trans	-66.2	-18.8	171.8	-78.7	-179.4	178.4	98.3	-17.1	114.3	G521 Q540 L542	G521-R544 PolarHBondContact O-NH2 2.91Å; Q540-R544 WeakPolarHBondContact O-CB 3.31Å; Q540-R544 WeakPolarHBondContact O-CD 3.16Å; Q540-R544 VanDerWaalsContact O-CG 3.23Å; Q540-R544 WeakPolarHBondContact O-CG 3.43Å; Q540-R544 PolarHBondContact O-N 2.9Å; Q540-R544 PolarHBondContact O-NH1 3.05Å; L542-R544 VanDerWaalsContact C-N 3.33Å; L542-R544 PolarHBondContact O-N 3.06Å
545	R	87.2	Confident	89.1	Confident	181 Å²	181	61.2 Å²	61.2	68%	0.683	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	2.8	172.8	-77.2	172.9	172	170.9	-2.3	113.4	V541 L542 V543 F547	V541-R545 WeakPolarHBondContact O-CB 3.39Å; V541-R545 VanDerWaalsContact O-CG 3.32Å; V541-R545 WeakPolarHBondContact O-CG 3.3Å; V541-R545 PolarHBondContact O-N 3.35Å; V541-R545 VanDerWaalsContact O-N 3.08Å; L542-R545 CarbonylContact O-C 3.57Å; L542-R545 WeakPolarHBondContact O-CA 3.19Å; L542-R545 WeakPolarHBondContact O-CB 3.26Å; L542-R545 PolarHBondContact O-N 3.39Å; V543-R545 PolarHBondContact O-N 2.98Å; R545-F547 HydrophobicContact CB-CD2 4.06Å; R545-F547 HydrophobicContact CB-CE2 4.17Å
546	G	85.6	Confident	88.9	Confident	70 Å²	70	60.8 Å²	60.8	72%	0.722	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.1	13.5	177	0	0	0	0	0	115.4	L542 V543	L542-G546 PolarHBondContact O-N 2.81Å; V543-G546 PolarHBondContact O-N 3.46Å; V543-G546 VanDerWaalsContact O-N 3.09Å
547	F	88.3	Confident	88.4	Confident	66 Å²	66	61.2 Å²	61.2	29%	0.289	31%	0.309	S	S	.	.			trans	-70.7	146.4	170.5	-72.5	-77.4	0	0	0	111.3	L542 R545 D551 A552	L542-F547 HydrophobicContact CB-CB 4.39Å; L542-F547 HydrophobicContact CB-CD2 4.1Å; L542-F547 HydrophobicContact CD2-CD2 3.74Å; L542-F547 HydrophobicContact CD2-CE2 3.88Å; L542-F547 HydrophobicContact CG-CD2 4.5Å; L542-F547 WeakPolarHBondContact O-CD2 3.18Å; L542-F547 PolarHBondContact O-N 3.04Å; R545-F547 HydrophobicContact CB-CD2 4.06Å; R545-F547 HydrophobicContact CB-CE2 4.17Å; F547-D551 HydrophobicContact CB-CB 4.3Å; F547-D551 HydrophobicContact CD1-CB 4.38Å; F547-A552 HydrophobicContact CB-CB 4.26Å
548	A	88	Confident	87.4	Confident	52 Å²	52	64.7 Å²	64.7	43%	0.43	33%	0.333	S	S	.	.			trans	-58.3	154.9	170.2	0	0	0	0	0	110.7	E550 D551 A552	A548-E550 VanDerWaalsContact C-N 3.27Å; A548-E550 PolarHBondContact O-N 3.09Å; A548-D551 HydrophobicContact CB-CB 4.25Å; A548-D551 PolarHBondContact O-N 3.05Å; A548-A552 VanDerWaalsContact O-CB 3.22Å; A548-A552 WeakPolarHBondContact O-CB 3.36Å; A548-A552 PolarHBondContact O-N 3.4Å
549	H	87.1	Confident	86.2	Confident	52 Å²	52	70.4 Å²	70.4	24%	0.241	36%	0.357	C	S	.	.	H	α-helix	trans	-64.6	-34	-175.5	-76.1	58	0	0	0	112.3	Y539 Y553 Q575	Y539-H549 WeakPolarHBondContact CE2-O 3.24Å; Y539-H549 PolarHBondContact OH-CD2 3.17Å; H549-Y553 PolarHBondContact O-N 3.25Å; H549-Y553 VanDerWaalsContact O-N 3.09Å; H549-Q575 PolarHBondContact CD2-NE2 3.36Å
550	E	84.9	Confident	85	Confident	158 Å²	158	73 Å²	73	74%	0.738	37%	0.371	S	S	*	.	H	α-helix	trans	-67.5	-53.1	174.6	-70.1	150.3	-133.5	0	0	111.3	A548 A552 Y553 H554	A548-E550 VanDerWaalsContact C-N 3.27Å; A548-E550 PolarHBondContact O-N 3.09Å; E550-A552 VanDerWaalsContact C-N 3.29Å; E550-A552 PolarHBondContact O-N 3.21Å; E550-Y553 PolarHBondContact O-N 2.92Å; E550-Y553 VanDerWaalsContact O-N 3.15Å; E550-H554 PolarHBondContact O-N 3.13Å
551	D	87.1	Confident	84.1	Confident	76 Å²	76	81.2 Å²	81.2	41%	0.406	42%	0.415	S	S	.	.	H	α-helix	trans	-52.4	-46.1	173.5	-87.6	-27.7	0	0	0	112.5	F547 A548 Y553 H554 R555	F547-D551 HydrophobicContact CB-CB 4.3Å; F547-D551 HydrophobicContact CD1-CB 4.38Å; A548-D551 HydrophobicContact CB-CB 4.25Å; A548-D551 PolarHBondContact O-N 3.05Å; D551-Y553 VanDerWaalsContact C-N 3.35Å; D551-H554 PolarHBondContact O-N 3.27Å; D551-R555 WeakPolarHBondContact O-CB 3.48Å; D551-R555 WeakPolarHBondContact O-CD 3.36Å; D551-R555 WeakPolarHBondContact O-CG 3.38Å; D551-R555 PolarHBondContact O-N 3.38Å
552	A	90.1	Very high	83.2	Confident	0 Å²	0	80.9 Å²	80.9	0%	0	41%	0.411	C	S	.	.	H	α-helix	trans	-65.2	-38.4	-178.7	0	0	0	0	0	111.6	Y539 L542 V543 F547 A548 E550 C556	Y539-A552 HydrophobicContact CD2-CB 3.84Å; Y539-A552 HydrophobicContact CE2-CB 3.87Å; L542-A552 HydrophobicContact CB-CB 3.75Å; L542-A552 HydrophobicContact CD1-CB 4.49Å; V543-A552 HydrophobicContact CG2-CB 3.76Å; F547-A552 HydrophobicContact CB-CB 4.26Å; A548-A552 VanDerWaalsContact O-CB 3.22Å; A548-A552 WeakPolarHBondContact O-CB 3.36Å; A548-A552 PolarHBondContact O-N 3.4Å; E550-A552 VanDerWaalsContact C-N 3.29Å; E550-A552 PolarHBondContact O-N 3.21Å; A552-C556 PolarHBondContact O-SG 3.22Å
553	Y	90.8	Very high	82.9	Confident	14 Å²	14	84.5 Å²	84.5	6%	0.055	43%	0.431	C	S	.	.	H	α-helix	trans	-71.7	-48.4	174.8	-175	-97.2	0	0	0	111.6	H549 E550 D551 R555 C556 S557 K567 E570 A571 F574	H549-Y553 PolarHBondContact O-N 3.25Å; H549-Y553 VanDerWaalsContact O-N 3.09Å; E550-Y553 PolarHBondContact O-N 2.92Å; E550-Y553 VanDerWaalsContact O-N 3.15Å; D551-Y553 VanDerWaalsContact C-N 3.35Å; Y553-R555 VanDerWaalsContact C-N 3.32Å; Y553-R555 PolarHBondContact O-N 3.08Å; Y553-C556 CarbonylContact O-C 3.6Å; Y553-C556 PolarHBondContact O-N 2.95Å; Y553-S557 WeakPolarHBondContact O-CB 3.42Å; Y553-S557 PolarHBondContact O-N 2.73Å; Y553-S557 PolarHBondContact OH-OG 3.19Å; Y553-K567 HydrophobicContact CE1-CB 3.98Å; Y553-K567 HydrophobicContact CE1-CG 4.3Å; Y553-K567 WeakPolarHBondContact CE1-O 3.47Å; Y553-E570 HydrophobicContact CE2-CB 4.08Å; Y553-E570 HydrophobicContact CE2-CG 3.87Å; Y553-E570 PolarHBondContact OH-OE2 3.15Å; Y553-A571 HydrophobicContact CD1-CB 3.75Å; Y553-A571 HydrophobicContact CD2-CB 3.87Å; Y553-A571 HydrophobicContact CE1-CB 4.2Å; Y553-A571 HydrophobicContact CE2-CB 4.31Å; Y553-A571 HydrophobicContact CG-CB 3.59Å; Y553-F574 AromaticContact CD2-CD2 3.91Å; Y553-F574 HydrophobicContact CD2-CD2 3.91Å; Y553-F574 HydrophobicContact CD2-CE2 4.22Å; Y553-F574 HydrophobicContact CE2-CD2 4.11Å; Y553-F574 HydrophobicContact CE2-CE2 4.04Å
554	H	87.2	Confident	82.5	Confident	137 Å²	137	89.1 Å²	89.1	63%	0.634	46%	0.455	S	S	*	.	H	α-helix	trans	-51.9	-51.1	178.8	-108.6	-73.5	0	0	0	111.5	E550 D551 C556 S557 T558	E550-H554 PolarHBondContact O-N 3.13Å; D551-H554 PolarHBondContact O-N 3.27Å; H554-C556 PolarHBondContact O-N 3.39Å; H554-S557 PolarHBondContact O-N 2.78Å; H554-S557 VanDerWaalsContact O-N 3.07Å; H554-T558 VanDerWaalsContact O-CG2 3.26Å; H554-T558 WeakPolarHBondContact O-CG2 3.47Å; H554-T558 PolarHBondContact O-N 3.1Å
555	R	86.3	Confident	82.2	Confident	137 Å²	137	87.4 Å²	87.4	52%	0.517	45%	0.453	S	S	.	.	H	α-helix	trans	-63	-19.7	179.4	-70	167.4	-172.9	-114.6	0.8	114.5	L542 D551 Y553	L542-R555 HydrophobicContact CD1-CB 3.52Å; L542-R555 HydrophobicContact CD1-CG 4.43Å; D551-R555 WeakPolarHBondContact O-CB 3.48Å; D551-R555 WeakPolarHBondContact O-CD 3.36Å; D551-R555 WeakPolarHBondContact O-CG 3.38Å; D551-R555 PolarHBondContact O-N 3.38Å; Y553-R555 VanDerWaalsContact C-N 3.32Å; Y553-R555 PolarHBondContact O-N 3.08Å
556	C	86.1	Confident	82	Confident	18 Å²	18	82.8 Å²	82.8	12%	0.122	44%	0.439	C	S	.	.	H	α-helix	trans	-98	-13.9	175.5	-61.7	0	0	0	0	113.4	R535 A538 Y539 L542 A552 Y553 H554	R535-C556 WeakPolarHBondContact CD-O 3.36Å; A538-C556 HydrophobicContact CB-CB 4.4Å; A538-C556 WeakPolarHBondContact CB-SG 3.22Å; Y539-C556 PolarHBondContact N-SG 3.21Å; L542-C556 VanDerWaalsContact CD1-SG 3.59Å; A552-C556 PolarHBondContact O-SG 3.22Å; Y553-C556 CarbonylContact O-C 3.6Å; Y553-C556 PolarHBondContact O-N 2.95Å; H554-C556 PolarHBondContact O-N 3.39Å
557	S	82.4	Confident	82	Confident	8 Å²	8	82 Å²	82	6%	0.056	42%	0.416	C	S	.	.	H	α-helix	trans	-108.9	-2.8	-177.9	-174.1	0	0	0	0	114	Y553 H554 L559 L560 K567	Y553-S557 WeakPolarHBondContact O-CB 3.42Å; Y553-S557 PolarHBondContact O-N 2.73Å; Y553-S557 PolarHBondContact OH-OG 3.19Å; H554-S557 PolarHBondContact O-N 2.78Å; H554-S557 VanDerWaalsContact O-N 3.07Å; S557-L559 PolarHBondContact O-N 3.41Å; S557-L559 VanDerWaalsContact O-N 3.08Å; S557-L560 PolarHBondContact O-N 2.69Å; S557-K567 WeakPolarHBondContact OG-CE 3.4Å
558	T	70.7	Confident	81.8	Confident	105 Å²	105	85 Å²	85	64%	0.644	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-18.3	-178.7	45.6	0	0	0	0	115.2	H554	H554-T558 VanDerWaalsContact O-CG2 3.26Å; H554-T558 WeakPolarHBondContact O-CG2 3.47Å; H554-T558 PolarHBondContact O-N 3.1Å
559	L	65.9	Low	81.7	Confident	161 Å²	161	89.4 Å²	89.4	84%	0.843	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	11.9	-172.3	-120.9	72	0	0	0	114.5	S557	S557-L559 PolarHBondContact O-N 3.41Å; S557-L559 VanDerWaalsContact O-N 3.08Å
560	L	69.3	Low	81.9	Confident	58 Å²	58	87 Å²	87	30%	0.304	43%	0.425	S	S	.	.			trans	-139.4	130.9	-168.2	-77.4	149.1	0	0	0	114.4	R535 S557 L562 K567	R535-L560 HydrophobicContact CG-CD1 4.24Å; R535-L560 VanDerWaalsContact NH1-CD1 3.26Å; S557-L560 PolarHBondContact O-N 2.69Å; L560-L562 HydrophobicContact CB-CD1 4.5Å; L560-L562 HydrophobicContact CB-CG 4.31Å; L560-L562 PolarHBondContact O-N 2.99Å; L560-K567 WeakPolarHBondContact O-CE 3.43Å; L560-K567 PolarHBondContact O-NZ 3.22Å
561	D	70.7	Confident	82.1	Confident	174 Å²	174	80.7 Å²	80.7	93%	0.93	40%	0.4	S	S	*	.			trans	-80.3	45.6	177.7	-59.8	-41	0	0	0	113.2
562	L	73.3	Confident	82.2	Confident	35 Å²	35	81 Å²	81	18%	0.183	40%	0.401	C	S	.	.			trans	-73.8	143.4	168.9	-64.8	171.4	0	0	0	110.5	L560 E566 K567	L560-L562 HydrophobicContact CB-CD1 4.5Å; L560-L562 HydrophobicContact CB-CG 4.31Å; L560-L562 PolarHBondContact O-N 2.99Å; L562-E566 HydrophobicContact CD2-CG 4.48Å; L562-K567 HydrophobicContact CB-CD 4.37Å; L562-K567 HydrophobicContact CB-CG 3.86Å; L562-K567 WeakPolarHBondContact O-CE 3.28Å; L562-K567 PolarHBondContact O-NZ 3.21Å
563	N	83.1	Confident	82.1	Confident	100 Å²	100	82.7 Å²	82.7	54%	0.535	41%	0.413	S	S	.	.			trans	-63.4	153.2	174.5	-170.3	15.1	0	0	0	111	E565 E566 K567	N563-E565 PolarHBondContact O-N 3.42Å; N563-E566 PolarHBondContact O-N 3.39Å; N563-K567 PolarHBondContact O-N 3.28Å
564	N	81.4	Confident	82.2	Confident	125 Å²	125	82 Å²	82	67%	0.668	41%	0.411	S	S	*	.	H	α-helix	trans	-60.7	-42.3	-173.2	-73	-16.6	0	0	0	112.7	E566 K567 E568	N564-E566 VanDerWaalsContact C-N 3.26Å; N564-E566 PolarHBondContact O-N 2.81Å; N564-K567 WeakPolarHBondContact O-CB 3.25Å; N564-K567 PolarHBondContact O-N 3.35Å; N564-E568 PolarHBondContact O-N 3.45Å
565	E	80.2	Confident	82.4	Confident	108 Å²	108	78.2 Å²	78.2	51%	0.505	39%	0.393	S	S	.	.	H	α-helix	trans	-59.9	-36	173.2	-60.5	174	-158.7	0	0	112.9	N563 E568 R569	N563-E565 PolarHBondContact O-N 3.42Å; E565-E568 PolarHBondContact O-N 3.05Å; E565-R569 WeakPolarHBondContact O-CB 3.37Å; E565-R569 VanDerWaalsContact O-CG 3.29Å; E565-R569 WeakPolarHBondContact O-CG 3.49Å; E565-R569 PolarHBondContact O-N 2.87Å; E565-R569 IonicContact OE2-CZ 3.97Å; E565-R569 IonicContact OE2-NH1 3.35Å; E565-R569 PolarHBondContact OE2-NH1 2.8Å; E565-R569 IonicContact OE2-NH2 3.27Å; E565-R569 PolarHBondContact OE2-NH2 3.27Å
566	E	83.2	Confident	82.5	Confident	85 Å²	85	74.4 Å²	74.4	40%	0.397	39%	0.391	S	S	.	.	H	α-helix	trans	-76.3	-35	-178	-173.7	166.3	-159.8	0	0	111.2	L562 N563 N564 E568 R569 E570	L562-E566 HydrophobicContact CD2-CG 4.48Å; N563-E566 PolarHBondContact O-N 3.39Å; N564-E566 VanDerWaalsContact C-N 3.26Å; N564-E566 PolarHBondContact O-N 2.81Å; E566-E568 VanDerWaalsContact C-N 3.33Å; E566-R569 PolarHBondContact O-N 3.39Å; E566-E570 VanDerWaalsContact O-CB 3.28Å; E566-E570 WeakPolarHBondContact O-CB 3.42Å; E566-E570 PolarHBondContact O-N 2.77Å
567	K	85.5	Confident	82.6	Confident	53 Å²	53	75.4 Å²	75.4	23%	0.23	40%	0.395	C	S	.	.	H	α-helix	trans	-58.4	-44.2	167	-76.3	169.3	165.9	137.4	0	111.2	Y553 S557 L560 L562 N563 N564 A571	Y553-K567 HydrophobicContact CE1-CB 3.98Å; Y553-K567 HydrophobicContact CE1-CG 4.3Å; Y553-K567 WeakPolarHBondContact CE1-O 3.47Å; S557-K567 WeakPolarHBondContact OG-CE 3.4Å; L560-K567 WeakPolarHBondContact O-CE 3.43Å; L560-K567 PolarHBondContact O-NZ 3.22Å; L562-K567 HydrophobicContact CB-CD 4.37Å; L562-K567 HydrophobicContact CB-CG 3.86Å; L562-K567 WeakPolarHBondContact O-CE 3.28Å; L562-K567 PolarHBondContact O-NZ 3.21Å; N563-K567 PolarHBondContact O-N 3.28Å; N564-K567 WeakPolarHBondContact O-CB 3.25Å; N564-K567 PolarHBondContact O-N 3.35Å; K567-A571 WeakPolarHBondContact O-CB 3.43Å; K567-A571 PolarHBondContact O-N 3.06Å
568	E	85	Confident	82.8	Confident	129 Å²	129	75.9 Å²	75.9	60%	0.603	40%	0.396	S	S	*	.	H	α-helix	trans	-68.2	-47.4	176.8	-163.4	-168.5	151.8	0	0	112.6	N564 E565 E566 E570 A571 N572	N564-E568 PolarHBondContact O-N 3.45Å; E565-E568 PolarHBondContact O-N 3.05Å; E566-E568 VanDerWaalsContact C-N 3.33Å; E568-E570 VanDerWaalsContact C-N 3.26Å; E568-E570 PolarHBondContact O-N 3.33Å; E568-A571 PolarHBondContact O-N 2.85Å; E568-N572 WeakPolarHBondContact O-CB 3.33Å; E568-N572 PolarHBondContact O-N 3.1Å; E568-N572 PolarHBondContact O-ND2 3.36Å
569	R	86.2	Confident	83.4	Confident	144 Å²	144	76 Å²	76	54%	0.543	39%	0.388	S	S	.	.	H	α-helix	trans	-56.3	-40.9	174.8	-76.7	-172.9	-72.7	-100.5	3	111.4	E565 E566 S573	E565-R569 WeakPolarHBondContact O-CB 3.37Å; E565-R569 VanDerWaalsContact O-CG 3.29Å; E565-R569 WeakPolarHBondContact O-CG 3.49Å; E565-R569 PolarHBondContact O-N 2.87Å; E565-R569 IonicContact OE2-CZ 3.97Å; E565-R569 IonicContact OE2-NH1 3.35Å; E565-R569 PolarHBondContact OE2-NH1 2.8Å; E565-R569 IonicContact OE2-NH2 3.27Å; E565-R569 PolarHBondContact OE2-NH2 3.27Å; E566-R569 PolarHBondContact O-N 3.39Å; R569-S573 WeakPolarHBondContact O-CB 3.38Å; R569-S573 PolarHBondContact O-N 3.24Å
570	E	89.8	Confident	84.1	Confident	2 Å²	2	74.1 Å²	74.1	1%	0.009	38%	0.376	C	S	.	.	H	α-helix	trans	-70.8	-46.5	177.3	-171	168.6	-90.6	0	0	112.6	K532 R535 Y553 E566 E568 N572 S573 F574	K532-E570 VanDerWaalsContact CD-OE1 3.29Å; K532-E570 WeakPolarHBondContact CD-OE1 3.49Å; K532-E570 WeakPolarHBondContact CE-OE1 3.27Å; K532-E570 VanDerWaalsContact CG-OE1 3.31Å; K532-E570 WeakPolarHBondContact CG-OE1 3.36Å; K532-E570 IonicContact NZ-OE1 2.84Å; K532-E570 PolarHBondContact NZ-OE1 2.96Å; R535-E570 IonicContact CZ-OE1 2.7Å; R535-E570 IonicContact CZ-OE2 3.93Å; R535-E570 IonicContact NE-OE1 3.87Å; R535-E570 IonicContact NE-OE2 2.84Å; R535-E570 PolarHBondContact NE-OE2 3.01Å; R535-E570 IonicContact NH2-OE1 3.45Å; R535-E570 PolarHBondContact NH2-OE1 2.95Å; R535-E570 IonicContact NH2-OE2 3.2Å; R535-E570 PolarHBondContact NH2-OE2 3.38Å; Y553-E570 HydrophobicContact CE2-CB 4.08Å; Y553-E570 HydrophobicContact CE2-CG 3.87Å; Y553-E570 PolarHBondContact OH-OE2 3.15Å; E566-E570 VanDerWaalsContact O-CB 3.28Å; E566-E570 WeakPolarHBondContact O-CB 3.42Å; E566-E570 PolarHBondContact O-N 2.77Å; E568-E570 VanDerWaalsContact C-N 3.26Å; E568-E570 PolarHBondContact O-N 3.33Å; E570-N572 VanDerWaalsContact C-N 3.32Å; E570-N572 PolarHBondContact O-N 2.81Å; E570-S573 WeakPolarHBondContact O-CA 3.14Å; E570-S573 WeakPolarHBondContact O-CB 3.46Å; E570-S573 PolarHBondContact O-N 3.06Å; E570-S573 PolarHBondContact O-OG 2.99Å; E570-F574 VanDerWaalsContact CD-CZ 3.5Å; E570-F574 HydrophobicContact CG-CD1 3.93Å; E570-F574 HydrophobicContact CG-CD2 4.4Å; E570-F574 HydrophobicContact CG-CE1 3.48Å; E570-F574 VanDerWaalsContact CG-CE1 3.48Å; E570-F574 HydrophobicContact CG-CE2 4.01Å; E570-F574 HydrophobicContact CG-CG 4.37Å; E570-F574 HydrophobicContact CG-CZ 3.53Å; E570-F574 PolarHBondContact O-N 3.47Å
571	A	90	Very high	84.3	Confident	25 Å²	25	73.7 Å²	73.7	21%	0.207	38%	0.375	C	S	.	.	H	α-helix	trans	-56.1	-46	176.4	0	0	0	0	0	112	Y553 K567 E568 S573 F574 Q575	Y553-A571 HydrophobicContact CD1-CB 3.75Å; Y553-A571 HydrophobicContact CD2-CB 3.87Å; Y553-A571 HydrophobicContact CE1-CB 4.2Å; Y553-A571 HydrophobicContact CE2-CB 4.31Å; Y553-A571 HydrophobicContact CG-CB 3.59Å; K567-A571 WeakPolarHBondContact O-CB 3.43Å; K567-A571 PolarHBondContact O-N 3.06Å; E568-A571 PolarHBondContact O-N 2.85Å; A571-S573 PolarHBondContact O-N 2.91Å; A571-F574 PolarHBondContact O-N 2.97Å; A571-Q575 PolarHBondContact O-N 3.37Å
572	N	89.4	Confident	84.2	Confident	83 Å²	83	70.9 Å²	70.9	44%	0.444	36%	0.356	S	S	.	.	H	α-helix	trans	-61.6	-41.9	174.6	-77.8	-36.4	0	0	0	111.7	E568 E570 A576	E568-N572 WeakPolarHBondContact O-CB 3.33Å; E568-N572 PolarHBondContact O-N 3.1Å; E568-N572 PolarHBondContact O-ND2 3.36Å; E570-N572 VanDerWaalsContact C-N 3.32Å; E570-N572 PolarHBondContact O-N 2.81Å; N572-A576 WeakPolarHBondContact O-CB 3.48Å; N572-A576 PolarHBondContact O-N 2.81Å
573	S	88.9	Confident	83.3	Confident	36 Å²	36	75.9 Å²	75.9	25%	0.252	38%	0.38	S	S	.	.	H	α-helix	trans	-63.3	-42.7	175.6	80.9	0	0	0	0	112.5	R569 E570 A571 A576 L577	R569-S573 WeakPolarHBondContact O-CB 3.38Å; R569-S573 PolarHBondContact O-N 3.24Å; E570-S573 WeakPolarHBondContact O-CA 3.14Å; E570-S573 WeakPolarHBondContact O-CB 3.46Å; E570-S573 PolarHBondContact O-N 3.06Å; E570-S573 PolarHBondContact O-OG 2.99Å; A571-S573 PolarHBondContact O-N 2.91Å; S573-A576 PolarHBondContact O-N 3.18Å; S573-L577 VanDerWaalsContact O-CG 3.27Å; S573-L577 WeakPolarHBondContact O-CG 3.24Å; S573-L577 PolarHBondContact O-N 3.15Å
574	F	92.8	Very high	81.8	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-68	-40.5	-179.5	-73.5	6.5	0	0	0	111.5	F526 K532 R535 F536 Y539 Y553 E570 A571 L577 I578	F526-F574 HydrophobicContact CD2-CE1 4.23Å; F526-F574 AromaticContact CE2-CD1 3.81Å; F526-F574 HydrophobicContact CE2-CD1 3.81Å; F526-F574 AromaticContact CE2-CE1 3.45Å; F526-F574 HydrophobicContact CE2-CE1 3.45Å; F526-F574 VanDerWaalsContact CE2-CE1 3.45Å; F526-F574 HydrophobicContact CE2-CZ 4.49Å; F526-F574 AromaticContact CZ-CD1 3.98Å; F526-F574 HydrophobicContact CZ-CD1 3.98Å; F526-F574 AromaticContact CZ-CE1 3.77Å; F526-F574 HydrophobicContact CZ-CE1 3.77Å; K532-F574 HydrophobicContact CG-CE1 4.05Å; K532-F574 HydrophobicContact CG-CZ 4.14Å; R535-F574 HydrophobicContact CB-CE2 3.92Å; R535-F574 HydrophobicContact CB-CZ 3.99Å; F536-F574 HydrophobicContact CB-CD1 4.39Å; F536-F574 HydrophobicContact CB-CE1 3.9Å; F536-F574 HydrophobicContact CB-CE2 4.17Å; F536-F574 HydrophobicContact CB-CZ 3.79Å; F536-F574 HydrophobicContact CD2-CB 4.09Å; F536-F574 AromaticContact CD2-CD1 3.67Å; F536-F574 HydrophobicContact CD2-CD1 3.67Å; F536-F574 HydrophobicContact CD2-CD2 4.1Å; F536-F574 HydrophobicContact CD2-CE1 4.07Å; F536-F574 HydrophobicContact CD2-CE2 4.46Å; F536-F574 AromaticContact CD2-CG 3.69Å; F536-F574 HydrophobicContact CD2-CG 3.69Å; F536-F574 HydrophobicContact CD2-CZ 4.45Å; F536-F574 HydrophobicContact CE2-CB 4.29Å; F536-F574 HydrophobicContact CE2-CD1 4.37Å; F536-F574 HydrophobicContact CE2-CG 4.34Å; F536-F574 HydrophobicContact CG-CD1 4.34Å; F536-F574 HydrophobicContact CG-CE1 4.3Å; Y539-F574 HydrophobicContact CD1-CB 3.77Å; Y539-F574 HydrophobicContact CD1-CD2 4.05Å; Y539-F574 HydrophobicContact CD1-CG 4.3Å; Y539-F574 HydrophobicContact CD2-CD2 4.13Å; Y539-F574 HydrophobicContact CE1-CB 3.55Å; Y539-F574 HydrophobicContact CE2-CB 4.39Å; Y539-F574 HydrophobicContact CG-CB 4.28Å; Y539-F574 AromaticContact CG-CD2 3.79Å; Y539-F574 HydrophobicContact CG-CD2 3.79Å; Y539-F574 HydrophobicContact CG-CG 4.49Å; Y553-F574 AromaticContact CD2-CD2 3.91Å; Y553-F574 HydrophobicContact CD2-CD2 3.91Å; Y553-F574 HydrophobicContact CD2-CE2 4.22Å; Y553-F574 HydrophobicContact CE2-CD2 4.11Å; Y553-F574 HydrophobicContact CE2-CE2 4.04Å; E570-F574 VanDerWaalsContact CD-CZ 3.5Å; E570-F574 HydrophobicContact CG-CD1 3.93Å; E570-F574 HydrophobicContact CG-CD2 4.4Å; E570-F574 HydrophobicContact CG-CE1 3.48Å; E570-F574 VanDerWaalsContact CG-CE1 3.48Å; E570-F574 HydrophobicContact CG-CE2 4.01Å; E570-F574 HydrophobicContact CG-CG 4.37Å; E570-F574 HydrophobicContact CG-CZ 3.53Å; E570-F574 PolarHBondContact O-N 3.47Å; A571-F574 PolarHBondContact O-N 2.97Å; F574-L577 PolarHBondContact O-N 2.87Å; F574-I578 PolarHBondContact O-N 2.93Å; F574-I578 VanDerWaalsContact O-N 3.16Å
575	Q	90.9	Very high	80.1	Confident	57 Å²	57	73.5 Å²	73.5	27%	0.266	37%	0.37	S	S	.	.	H	α-helix	trans	-62.1	-45.6	173.3	177.1	176.4	101.7	0	0	111.5	H549 A571 L577 I578 K579	H549-Q575 PolarHBondContact CD2-NE2 3.36Å; A571-Q575 PolarHBondContact O-N 3.37Å; Q575-L577 VanDerWaalsContact C-N 3.33Å; Q575-L577 PolarHBondContact O-N 3.14Å; Q575-I578 PolarHBondContact O-N 3.43Å; Q575-K579 VanDerWaalsContact CD-NZ 3.31Å; Q575-K579 HydrophobicContact CG-CD 3.94Å; Q575-K579 HydrophobicContact CG-CG 4.41Å; Q575-K579 WeakPolarHBondContact O-CG 3.49Å; Q575-K579 PolarHBondContact O-N 3.3Å
576	A	88	Confident	78.4	Confident	56 Å²	56	73 Å²	73	46%	0.463	37%	0.374	S	S	.	.	H	α-helix	trans	-60.2	-42.5	179.3	0	0	0	0	0	112	N572 S573 K579 M580	N572-A576 WeakPolarHBondContact O-CB 3.48Å; N572-A576 PolarHBondContact O-N 2.81Å; S573-A576 PolarHBondContact O-N 3.18Å; A576-K579 PolarHBondContact O-N 2.88Å; A576-M580 WeakPolarHBondContact O-CB 3.3Å; A576-M580 PolarHBondContact O-N 3.4Å
577	L	88.2	Confident	76.3	Confident	39 Å²	39	74.5 Å²	74.5	20%	0.204	39%	0.385	C	S	.	.	H	α-helix	trans	-66.4	-36.7	178.5	-67.9	173.3	0	0	0	113.1	M523 I525 F526 F536 S573 F574 Q575 N581	M523-L577 WeakPolarHBondContact CE-O 3.37Å; I525-L577 HydrophobicContact CD1-CB 4.31Å; I525-L577 HydrophobicContact CD1-CD1 4.05Å; I525-L577 HydrophobicContact CD1-CD2 3.9Å; I525-L577 HydrophobicContact CD1-CG 4.3Å; I525-L577 HydrophobicContact CG2-CD1 4.11Å; I525-L577 HydrophobicContact CG2-CD2 4.47Å; F526-L577 HydrophobicContact CE1-CD1 4.43Å; F526-L577 HydrophobicContact CE2-CD1 3.72Å; F526-L577 HydrophobicContact CZ-CD1 3.45Å; F526-L577 VanDerWaalsContact CZ-CD1 3.45Å; F536-L577 HydrophobicContact CE2-CB 4.07Å; F536-L577 HydrophobicContact CE2-CD1 4.28Å; F536-L577 HydrophobicContact CZ-CB 3.79Å; F536-L577 HydrophobicContact CZ-CD1 4.09Å; S573-L577 VanDerWaalsContact O-CG 3.27Å; S573-L577 WeakPolarHBondContact O-CG 3.24Å; S573-L577 PolarHBondContact O-N 3.15Å; F574-L577 PolarHBondContact O-N 2.87Å; Q575-L577 VanDerWaalsContact C-N 3.33Å; Q575-L577 PolarHBondContact O-N 3.14Å; L577-N581 PolarHBondContact O-N 3Å
578	I	86.5	Confident	73.9	Confident	18 Å²	18	78.6 Å²	78.6	9%	0.092	41%	0.409	C	S	.	.	H	α-helix	trans	-68.4	-45.6	172.9	-70.1	-168.5	0	0	0	111.2	F536 Y539 Q540 V543 F574 Q575 M580 N581 Q582	F536-I578 HydrophobicContact CE2-CG1 4.43Å; Y539-I578 HydrophobicContact CD1-CD1 3.72Å; Y539-I578 HydrophobicContact CE1-CD1 3.46Å; Y539-I578 VanDerWaalsContact CE1-CD1 3.46Å; Y539-I578 HydrophobicContact CE1-CG1 4.13Å; Q540-I578 HydrophobicContact CG-CD1 4.2Å; V543-I578 HydrophobicContact CB-CD1 4.02Å; V543-I578 HydrophobicContact CG1-CD1 4.07Å; V543-I578 HydrophobicContact CG2-CD1 4.07Å; F574-I578 PolarHBondContact O-N 2.93Å; F574-I578 VanDerWaalsContact O-N 3.16Å; Q575-I578 PolarHBondContact O-N 3.43Å; I578-M580 VanDerWaalsContact C-N 3.31Å; I578-M580 PolarHBondContact O-N 3.14Å; I578-N581 PolarHBondContact O-N 3.41Å; I578-Q582 WeakPolarHBondContact O-CG 3.2Å; I578-Q582 PolarHBondContact O-N 3.1Å; I578-Q582 VanDerWaalsContact O-N 3.1Å
579	K	84.2	Confident	71.4	Confident	109 Å²	109	78.5 Å²	78.5	47%	0.474	42%	0.418	S	S	.	.	H	α-helix	trans	-57.4	-43.2	176.5	-74.8	174.9	174.4	174	0	111.8	Q575 A576 N581 Q582 M583	Q575-K579 VanDerWaalsContact CD-NZ 3.31Å; Q575-K579 HydrophobicContact CG-CD 3.94Å; Q575-K579 HydrophobicContact CG-CG 4.41Å; Q575-K579 WeakPolarHBondContact O-CG 3.49Å; Q575-K579 PolarHBondContact O-N 3.3Å; A576-K579 PolarHBondContact O-N 2.88Å; K579-N581 PolarHBondContact O-N 2.88Å; K579-Q582 PolarHBondContact O-N 3.17Å; K579-M583 PolarHBondContact O-N 2.83Å; K579-M583 VanDerWaalsContact O-N 3.13Å
580	M	78.7	Confident	68.9	Low	121 Å²	121	76.9 Å²	76.9	60%	0.596	43%	0.428	S	S	*	.	H	α-helix	trans	-61.3	-42.5	178.3	-171.3	175.1	-176.5	0	0	112.6	A576 I578 M583 T584	A576-M580 WeakPolarHBondContact O-CB 3.3Å; A576-M580 PolarHBondContact O-N 3.4Å; I578-M580 VanDerWaalsContact C-N 3.31Å; I578-M580 PolarHBondContact O-N 3.14Å; M580-M583 WeakPolarHBondContact O-CB 3.39Å; M580-M583 PolarHBondContact O-N 2.96Å; M580-T584 PolarHBondContact O-N 2.75Å; M580-T584 PolarHBondContact O-OG1 2.95Å
581	N	73.9	Confident	66.4	Low	49 Å²	49	86.1 Å²	86.1	26%	0.262	47%	0.472	S	S	.	.	H	α-helix	trans	-70.4	-31.5	178.6	-172.3	22.4	0	0	0	112.9	M523 L577 I578 K579 M583 T584 N585	M523-N581 HydrophobicContact CE-CB 3.76Å; M523-N581 HydrophobicContact SD-CB 3.76Å; M523-N581 VanDerWaalsContact SD-CG 3.56Å; M523-N581 PolarHBondContact SD-ND2 2.82Å; L577-N581 PolarHBondContact O-N 3Å; I578-N581 PolarHBondContact O-N 3.41Å; K579-N581 PolarHBondContact O-N 2.88Å; N581-M583 VanDerWaalsContact C-N 3.35Å; N581-T584 WeakPolarHBondContact CA-OG1 3.46Å; N581-T584 PolarHBondContact O-N 3.3Å; N581-T584 PolarHBondContact O-OG1 3.38Å; N581-N585 PolarHBondContact O-N 3.11Å; N581-N585 PolarHBondContact O-ND2 2.67Å; N581-N585 PolarHBondContact OD1-ND2 2.9Å
582	Q	68.4	Low	63.7	Low	115 Å²	115	92.2 Å²	92.2	54%	0.537	50%	0.499	S	S	.	.	H	α-helix	trans	-62.1	-46.2	170.7	-68.3	174.5	9.1	0	0	110.3	I578 K579 T584 N585 T586	I578-Q582 WeakPolarHBondContact O-CG 3.2Å; I578-Q582 PolarHBondContact O-N 3.1Å; I578-Q582 VanDerWaalsContact O-N 3.1Å; K579-Q582 PolarHBondContact O-N 3.17Å; Q582-T584 VanDerWaalsContact C-N 3.27Å; Q582-T584 PolarHBondContact O-N 3.02Å; Q582-N585 PolarHBondContact O-N 3.14Å; Q582-T586 PolarHBondContact O-N 2.7Å
583	M	55.1	Low	61	Low	140 Å²	140	95.8 Å²	95.8	69%	0.69	52%	0.518	S	S	*	.	H	α-helix	trans	-63.1	-25.7	179.6	-143.9	80.1	-179.7	0	0	114.5	K579 M580 N581 T586 N587	K579-M583 PolarHBondContact O-N 2.83Å; K579-M583 VanDerWaalsContact O-N 3.13Å; M580-M583 WeakPolarHBondContact O-CB 3.39Å; M580-M583 PolarHBondContact O-N 2.96Å; N581-M583 VanDerWaalsContact C-N 3.35Å; M583-T586 PolarHBondContact O-OG1 2.99Å; M583-N587 PolarHBondContact O-ND2 3.23Å; M583-N587 VanDerWaalsContact O-ND2 3.11Å
584	T	52.5	Low	58.4	Low	72 Å²	72	98.9 Å²	98.9	44%	0.442	54%	0.537	S	S	.	.	H	α-helix	trans	-84	-29.1	177.5	46.9	0	0	0	0	113.5	M580 N581 Q582	M580-T584 PolarHBondContact O-N 2.75Å; M580-T584 PolarHBondContact O-OG1 2.95Å; N581-T584 WeakPolarHBondContact CA-OG1 3.46Å; N581-T584 PolarHBondContact O-N 3.3Å; N581-T584 PolarHBondContact O-OG1 3.38Å; Q582-T584 VanDerWaalsContact C-N 3.27Å; Q582-T584 PolarHBondContact O-N 3.02Å
585	N	45	Very low	55.6	Low	102 Å²	102	105.4 Å²	105.4	55%	0.545	58%	0.577	S	S	.	*	H	α-helix	trans	-80.9	-24.1	-178.3	-73.6	-64.2	0	0	0	113.3	N581 Q582 N587	N581-N585 PolarHBondContact O-N 3.11Å; N581-N585 PolarHBondContact O-ND2 2.67Å; N581-N585 PolarHBondContact OD1-ND2 2.9Å; Q582-N585 PolarHBondContact O-N 3.14Å; N585-N587 PolarHBondContact O-N 3.44Å
586	T	43.9	Very low	52.8	Low	97 Å²	97	108.8 Å²	108.8	60%	0.595	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-12.3	176.5	48.6	0	0	0	0	114.4	Q582 M583	Q582-T586 PolarHBondContact O-N 2.7Å; M583-T586 PolarHBondContact O-OG1 2.99Å
587	N	38.9	Very low	50.1	Low	117 Å²	117	113.2 Å²	113.2	63%	0.626	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	2.2	-171.4	-58.3	-22.2	0	0	0	114.2	M583 N585	M583-N587 PolarHBondContact O-ND2 3.23Å; M583-N587 VanDerWaalsContact O-ND2 3.11Å; N585-N587 PolarHBondContact O-N 3.44Å
588	N	35.2	Very low	47.4	Very low	139 Å²	139	117.6 Å²	117.6	74%	0.743	63%	0.634	S	S	*	*	S	Bend	trans	-117.8	10.8	-176.3	-75.8	-33.7	0	0	0	114
589	T	32	Very low	45	Very low	128 Å²	128	124.3 Å²	124.3	79%	0.785	67%	0.67	S	S	*	*			trans	-131.8	93.3	173.6	-62.1	0	0	0	0	109.8
590	S	34.4	Very low	42.4	Very low	109 Å²	109	126.7 Å²	126.7	76%	0.762	69%	0.688	S	S	*	*			trans	-143.8	66.2	176.8	62	0	0	0	0	110.8
591	Q	36.7	Very low	40.3	Very low	197 Å²	197	127.7 Å²	127.7	92%	0.921	70%	0.7	S	S	*	*			trans	-89	150.8	148.8	-79.3	-164.4	-14.8	0	0	109.1
592	I	33.5	Very low	38.2	Very low	153 Å²	153	133.1 Å²	133.1	79%	0.785	73%	0.726	S	S	*	*			trans	-91.3	136	-163.6	-64.9	157.9	0	0	0	109.5
593	D	32.7	Very low	36.5	Very low	157 Å²	157	135.3 Å²	135.3	84%	0.84	74%	0.74	S	S	*	*			trans	-155.7	135.7	133.5	-99.9	-31	0	0	0	110
594	P	35.2	Very low	35.1	Very low	101 Å²	101	133.4 Å²	133.4	66%	0.656	74%	0.74	S	S	*	*			trans	-87.8	163.3	176.7	35.9	-34.7	0	0	0	112
595	V	34	Very low	34.2	Very low	137 Å²	137	138.9 Å²	138.9	83%	0.83	76%	0.76	S	S	*	*			trans	167.3	111.8	133.2	154.9	0	0	0	0	112.7
596	N	31.2	Very low	33.4	Very low	128 Å²	128	140.3 Å²	140.3	68%	0.684	77%	0.773	S	S	*	*			trans	53.6	95.7	136	-164.1	86.3	0	0	0	122.6
597	M	31.7	Very low	33	Very low	149 Å²	149	141.5 Å²	141.5	73%	0.734	79%	0.785	S	S	*	*				47.3	135.3	114.4	-62.6	-61.7	175.1	0	0	123.2
598	N	30.7	Very low	32.5	Very low	132 Å²	132	142.2 Å²	142.2	71%	0.706	79%	0.793	S	S	*	*			trans	73.2	127.5	149.6	-61.7	6.4	0	0	0	120.4
599	N	36.3	Very low	32.6	Very low	159 Å²	159	141.1 Å²	141.1	85%	0.85	79%	0.794	S	S	*	*				-169.5	129.9	111.2	-91.4	-19.6	0	0	0	111.7
600	D	30.4	Very low	32.4	Very low	159 Å²	159	141 Å²	141	85%	0.85	79%	0.793	S	S	*	*			trans	-82.7	142.3	164.2	-60.5	-75.4	0	0	0	110.6
601	T	34.9	Very low	32.3	Very low	141 Å²	141	141.1 Å²	141.1	87%	0.865	79%	0.794	S	S	*	*			trans	-150.7	130.6	154.9	-59	0	0	0	0	110.2
602	M	29.3	Very low	31.9	Very low	163 Å²	163	138 Å²	138	80%	0.803	79%	0.788	S	S	*	*			trans	-80.2	145.8	179.4	-63.4	-149	174.7	0	0	113.1
603	I	32.2	Very low	31.9	Very low	161 Å²	161	137.3 Å²	137.3	83%	0.826	79%	0.785	S	S	*	*			trans	-131.3	121.2	142.3	-63.4	-175.2	0	0	0	108.1
604	C	26.5	Very low	31.7	Very low	101 Å²	101	135.7 Å²	135.7	68%	0.682	78%	0.781	S	S	*	*			trans	-87.2	131.2	173.7	-60.5	0	0	0	0	109.9
605	Q	33.1	Very low	31.5	Very low	187 Å²	187	136.8 Å²	136.8	87%	0.874	79%	0.786	S	S	*	*			trans	-136.2	142.3	154.4	-72.6	-160.8	-4.7	0	0	110.2
606	T	27.7	Very low	31.5	Very low	132 Å²	132	136.9 Å²	136.9	81%	0.81	78%	0.78	S	S	*	*			trans	-114.6	118.3	-159.6	51.1	0	0	0	0	112.2
607	S	36.2	Very low	31.5	Very low	121 Å²	121	135.3 Å²	135.3	85%	0.846	78%	0.78	S	S	*	*			trans	-160.5	140.3	150.6	44.5	0	0	0	0	111
608	T	29.3	Very low	31.6	Very low	132 Å²	132	132.8 Å²	132.8	81%	0.81	78%	0.776	S	S	*	*			trans	-113.2	153.9	169.8	56.6	0	0	0	0	106.8
609	P	35.7	Very low	31.8	Very low	116 Å²	116	131.9 Å²	131.9	75%	0.753	77%	0.772	S	S	*	*				-140.6	136.6	73.9	34.7	-16.5	0	0	0	116.4
610	T	27.7	Very low	31.9	Very low	126 Å²	126	130.3 Å²	130.3	77%	0.773	77%	0.77	S	S	*	*			trans	28	105	130.8	-44.1	0	0	0	0	119.3
611	S	34.1	Very low	32.3	Very low	111 Å²	111	127.5 Å²	127.5	78%	0.776	76%	0.763	S	S	*	*			trans	-140.2	140.2	140.1	56.6	0	0	0	0	109.4
612	T	28.3	Very low	32.5	Very low	131 Å²	131	127.5 Å²	127.5	80%	0.804	76%	0.758	S	S	*	*			trans	-99.4	102.9	-161.9	-33.4	0	0	0	0	111.5
613	I	32.6	Very low	32.9	Very low	140 Å²	140	129.9 Å²	129.9	72%	0.718	76%	0.758	S	S	*	*			trans	-130.8	115.4	168.3	-59.1	-178.8	0	0	0	108.6	T615	I613-T615 HydrophobicContact CG2-CG2 4.27Å; I613-T615 PolarHBondContact O-N 3Å
614	T	28.3	Very low	33.1	Very low	122 Å²	122	130.3 Å²	130.3	75%	0.748	76%	0.761	S	S	*	*			trans	-78.3	81.1	-177.6	-50.4	0	0	0	0	110.8	I616	T614-I616 HydrophobicContact CG2-CG1 4.49Å; T614-I616 PolarHBondContact O-N 3.38Å
615	T	32	Very low	33.4	Very low	124 Å²	124	131.8 Å²	131.8	76%	0.761	76%	0.759	S	S	*	*			trans	-73.5	93.3	175.6	41.4	0	0	0	0	111.1	I613 S617	I613-T615 HydrophobicContact CG2-CG2 4.27Å; I613-T615 PolarHBondContact O-N 3Å; T615-S617 PolarHBondContact O-N 3.23Å
616	I	33.1	Very low	33.9	Very low	139 Å²	139	127.3 Å²	127.3	71%	0.713	75%	0.747	S	S	*	*			trans	-64.1	104.1	173	-61.2	179.3	0	0	0	109.1	T614 S618	T614-I616 HydrophobicContact CG2-CG1 4.49Å; T614-I616 PolarHBondContact O-N 3.38Å; I616-S618 PolarHBondContact O-N 3.49Å; I616-S618 PolarHBondContact O-OG 2.92Å; I616-S618 VanDerWaalsContact O-OG 3.09Å
617	S	31.5	Very low	34.5	Very low	96 Å²	96	128.5 Å²	128.5	67%	0.671	75%	0.747	S	S	*	*			trans	-62.8	98	175.3	-176.1	0	0	0	0	110.2	T615	T615-S617 PolarHBondContact O-N 3.23Å
618	S	34.4	Very low	35.2	Very low	95 Å²	95	125.3 Å²	125.3	66%	0.664	73%	0.725	S	S	*	*			trans	-106.6	112.1	-174.4	32.7	0	0	0	0	109.5	I616 P620	I616-S618 PolarHBondContact O-N 3.49Å; I616-S618 PolarHBondContact O-OG 2.92Å; I616-S618 VanDerWaalsContact O-OG 3.09Å; S618-P620 WeakPolarHBondContact O-CD 3.31Å
619	N	34.2	Very low	36.1	Very low	113 Å²	113	124.4 Å²	124.4	60%	0.604	72%	0.715	S	S	*	*			trans	-65.2	123.5	169.7	-75.9	-28.5	0	0	0	108.3	S621	N619-S621 PolarHBondContact O-N 3.18Å
620	P	39.4	Very low	37.4	Very low	126 Å²	126	128.1 Å²	128.1	82%	0.818	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	9.3	-173.4	31.1	-36.5	0	0	0	114.3	S618	S618-P620 WeakPolarHBondContact O-CD 3.31Å
621	S	38.9	Very low	39	Very low	101 Å²	101	124.5 Å²	124.5	71%	0.706	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-24.5	-174.8	-56.3	0	0	0	0	114.3	N619 R623	N619-S621 PolarHBondContact O-N 3.18Å; S621-R623 VanDerWaalsContact C-N 3.34Å; S621-R623 PolarHBondContact O-N 2.81Å
622	D	38.5	Very low	41	Very low	140 Å²	140	123.2 Å²	123.2	75%	0.749	68%	0.684	S	S	*	*			trans	-88.5	3.1	-167.1	-58.8	-31.6	0	0	0	113.9	L624	D622-L624 PolarHBondContact O-N 3.42Å
623	R	37.1	Very low	43.1	Very low	213 Å²	213	122.5 Å²	122.5	80%	0.804	68%	0.675	S	S	*	*	S	Bend	trans	-79.2	103	168.5	-81.5	-165	176.8	-139.7	-1.9	110.5	S621 M625	S621-R623 VanDerWaalsContact C-N 3.34Å; S621-R623 PolarHBondContact O-N 2.81Å; R623-M625 PolarHBondContact O-N 3.2Å
624	L	35.6	Very low	44.9	Very low	171 Å²	171	122.1 Å²	122.1	90%	0.895	67%	0.669	S	S	*	*			trans	-43.4	106.6	166.9	-66	172.1	0	0	0	110.8	D622	D622-L624 PolarHBondContact O-N 3.42Å
625	M	33.8	Very low	46.7	Very low	132 Å²	132	120.4 Å²	120.4	65%	0.65	65%	0.651	S	S	*	*			trans	-66.7	129.7	176.3	-74.3	-72.3	107.9	0	0	109.6	R623 L627	R623-M625 PolarHBondContact O-N 3.2Å; M625-L627 PolarHBondContact O-N 3.35Å
626	P	43	Very low	48.7	Very low	93 Å²	93	116.9 Å²	116.9	60%	0.604	63%	0.626	S	S	*	*			trans	-61.3	138.7	174.5	25.6	-33.4	0	0	0	110.1	S628	P626-S628 PolarHBondContact O-N 2.84Å
627	L	40	Very low	50.7	Low	157 Å²	157	115.7 Å²	115.7	82%	0.822	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-59.7	-7.9	-171.2	-66.5	167.4	0	0	0	115.1	M625 N629 K630	M625-L627 PolarHBondContact O-N 3.35Å; L627-N629 PolarHBondContact O-N 2.87Å; L627-N629 VanDerWaalsContact O-N 3.09Å; L627-K630 PolarHBondContact O-N 3.45Å
628	S	51.4	Low	52.7	Low	53 Å²	53	115.7 Å²	115.7	37%	0.371	61%	0.61	S	S	.	*	G	3₁₀ helix	trans	-42.5	-40.8	174.8	-169.3	0	0	0	0	114.2	P626 K630 L631 Q636	P626-S628 PolarHBondContact O-N 2.84Å; S628-K630 PolarHBondContact O-N 3.39Å; S628-L631 WeakPolarHBondContact O-CB 3.47Å; S628-L631 PolarHBondContact O-N 2.67Å; S628-Q636 PolarHBondContact O-NE2 3.29Å; S628-Q636 PolarHBondContact OG-NE2 2.76Å
629	N	48.4	Very low	54.4	Low	114 Å²	114	115 Å²	115	61%	0.61	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-70.9	-2.7	-172.2	-67	-9.1	0	0	0	114.8	L627	L627-N629 PolarHBondContact O-N 2.87Å; L627-N629 VanDerWaalsContact O-N 3.09Å
630	K	62.2	Low	56.3	Low	193 Å²	193	112.9 Å²	112.9	84%	0.839	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-86.2	-6.3	169.1	-68.1	-68.2	-173.2	178.6	0	113.5	L627 S628	L627-K630 PolarHBondContact O-N 3.45Å; S628-K630 PolarHBondContact O-N 3.39Å
631	L	62.3	Low	57.8	Low	51 Å²	51	109.4 Å²	109.4	27%	0.267	57%	0.571	S	S	.	*	S	Bend	trans	-117.9	134.6	-167.4	-148.1	72.7	0	0	0	112.2	S628 K635 Q636 I639	S628-L631 WeakPolarHBondContact O-CB 3.47Å; S628-L631 PolarHBondContact O-N 2.67Å; L631-K635 HydrophobicContact CD1-CD 4.07Å; L631-K635 HydrophobicContact CD2-CB 3.51Å; L631-K635 HydrophobicContact CD2-CD 4.35Å; L631-K635 HydrophobicContact CG-CB 3.68Å; L631-K635 HydrophobicContact CG-CD 4Å; L631-K635 HydrophobicContact CG-CG 4.47Å; L631-Q636 HydrophobicContact CB-CG 4.37Å; L631-Q636 PolarHBondContact O-NE2 2.8Å; L631-I639 HydrophobicContact CD2-CD1 3.4Å
632	P	75.4	Confident	59.6	Low	83 Å²	83	111.2 Å²	111.2	54%	0.539	57%	0.566	S	S	.	*			trans	-55.9	145.5	177	-28.8	35.6	0	0	0	113.9	H634 K635 Q636	P632-H634 VanDerWaalsContact C-N 3.32Å; P632-H634 PolarHBondContact O-N 3.3Å; P632-H634 VanDerWaalsContact O-N 3.14Å; P632-K635 WeakPolarHBondContact O-CA 3.45Å; P632-K635 WeakPolarHBondContact O-CB 3.22Å; P632-K635 PolarHBondContact O-N 2.87Å; P632-Q636 PolarHBondContact O-N 3.49Å; P632-Q636 VanDerWaalsContact O-N 3.08Å
633	L	73.1	Confident	61.2	Low	117 Å²	117	108.7 Å²	108.7	61%	0.613	55%	0.552	S	S	*	*	H	α-helix	trans	-51.1	-42.6	-171.4	-174.2	66.5	0	0	0	114.4	K635 Q636 Q637	L633-K635 VanDerWaalsContact C-N 3.3Å; L633-K635 PolarHBondContact O-N 3.14Å; L633-Q636 WeakPolarHBondContact O-CB 3.46Å; L633-Q636 PolarHBondContact O-N 2.93Å; L633-Q636 VanDerWaalsContact O-N 3.14Å; L633-Q637 WeakPolarHBondContact O-CG 3.05Å; L633-Q637 PolarHBondContact O-N 3.04Å
634	H	69.5	Low	62.9	Low	131 Å²	131	101.5 Å²	101.5	61%	0.606	54%	0.538	S	S	*	.	H	α-helix	trans	-57.9	-40.5	174.6	165.7	-122.4	0	0	0	112.6	P632 Q637 L638	P632-H634 VanDerWaalsContact C-N 3.32Å; P632-H634 PolarHBondContact O-N 3.3Å; P632-H634 VanDerWaalsContact O-N 3.14Å; H634-Q637 PolarHBondContact O-N 3.42Å; H634-L638 PolarHBondContact O-N 3.32Å
635	K	66.3	Low	64.4	Low	86 Å²	86	99.8 Å²	99.8	37%	0.374	53%	0.529	S	S	.	.	H	α-helix	trans	-72.9	-33.1	176.3	-62.9	-168.6	179.1	-171.8	0	111.8	L631 P632 L633 Q637 L638 I639	L631-K635 HydrophobicContact CD1-CD 4.07Å; L631-K635 HydrophobicContact CD2-CB 3.51Å; L631-K635 HydrophobicContact CD2-CD 4.35Å; L631-K635 HydrophobicContact CG-CB 3.68Å; L631-K635 HydrophobicContact CG-CD 4Å; L631-K635 HydrophobicContact CG-CG 4.47Å; P632-K635 WeakPolarHBondContact O-CA 3.45Å; P632-K635 WeakPolarHBondContact O-CB 3.22Å; P632-K635 PolarHBondContact O-N 2.87Å; L633-K635 VanDerWaalsContact C-N 3.3Å; L633-K635 PolarHBondContact O-N 3.14Å; K635-Q637 VanDerWaalsContact C-N 3.33Å; K635-L638 PolarHBondContact O-N 2.86Å; K635-I639 WeakPolarHBondContact O-CG1 3.34Å; K635-I639 PolarHBondContact O-N 3.32Å
636	Q	74.3	Confident	65.9	Low	50 Å²	50	103.3 Å²	103.3	23%	0.234	54%	0.535	C	S	.	.	H	α-helix	trans	-60.9	-42.6	170.3	-64.4	-179.5	-11.3	0	0	111.1	S628 L631 P632 L633 I639 S640	S628-Q636 PolarHBondContact O-NE2 3.29Å; S628-Q636 PolarHBondContact OG-NE2 2.76Å; L631-Q636 HydrophobicContact CB-CG 4.37Å; L631-Q636 PolarHBondContact O-NE2 2.8Å; P632-Q636 PolarHBondContact O-N 3.49Å; P632-Q636 VanDerWaalsContact O-N 3.08Å; L633-Q636 WeakPolarHBondContact O-CB 3.46Å; L633-Q636 PolarHBondContact O-N 2.93Å; L633-Q636 VanDerWaalsContact O-N 3.14Å; Q636-I639 PolarHBondContact O-N 3.15Å; Q636-S640 WeakPolarHBondContact O-CB 3.22Å; Q636-S640 PolarHBondContact O-N 3.21Å; Q636-S640 PolarHBondContact O-OG 2.97Å
637	Q	75.9	Confident	66.7	Low	114 Å²	114	106.3 Å²	106.3	53%	0.533	54%	0.539	S	S	.	.	H	α-helix	trans	-65.8	-37	175	-70.4	173.5	-27.3	0	0	113	L633 H634 K635 S640 S641	L633-Q637 WeakPolarHBondContact O-CG 3.05Å; L633-Q637 PolarHBondContact O-N 3.04Å; H634-Q637 PolarHBondContact O-N 3.42Å; K635-Q637 VanDerWaalsContact C-N 3.33Å; Q637-S640 WeakPolarHBondContact CA-OG 3.32Å; Q637-S640 PolarHBondContact O-OG 2.84Å; Q637-S641 WeakPolarHBondContact O-CB 2.98Å; Q637-S641 PolarHBondContact O-N 3.44Å; Q637-S641 PolarHBondContact O-OG 3.09Å
638	L	73	Confident	67.6	Low	97 Å²	97	107.1 Å²	107.1	51%	0.508	53%	0.531	S	S	.	.	H	α-helix	trans	-67.2	-39.7	174.9	-160.9	79.7	0	0	0	111.7	H634 K635 S641 K642	H634-L638 PolarHBondContact O-N 3.32Å; K635-L638 PolarHBondContact O-N 2.86Å; L638-S641 PolarHBondContact O-OG 2.86Å; L638-K642 WeakPolarHBondContact O-CB 2.98Å; L638-K642 VanDerWaalsContact O-CG 3.25Å; L638-K642 WeakPolarHBondContact O-CG 3.48Å; L638-K642 PolarHBondContact O-N 2.95Å
639	I	70.5	Confident	67.7	Low	81 Å²	81	108.6 Å²	108.6	42%	0.415	54%	0.541	S	S	.	.	H	α-helix	trans	-68.7	-45.3	174.5	-70	175.5	0	0	0	110.5	L631 K635 Q636 S641 K642 L643	L631-I639 HydrophobicContact CD2-CD1 3.4Å; K635-I639 WeakPolarHBondContact O-CG1 3.34Å; K635-I639 PolarHBondContact O-N 3.32Å; Q636-I639 PolarHBondContact O-N 3.15Å; I639-S641 VanDerWaalsContact C-N 3.35Å; I639-S641 PolarHBondContact O-N 2.8Å; I639-K642 PolarHBondContact O-N 2.71Å; I639-L643 HydrophobicContact CG2-CD1 3.67Å; I639-L643 HydrophobicContact CG2-CG 4.13Å; I639-L643 WeakPolarHBondContact O-CB 3.39Å; I639-L643 VanDerWaalsContact O-CG 3.29Å; I639-L643 WeakPolarHBondContact O-CG 3.35Å; I639-L643 PolarHBondContact O-N 3.31Å
640	S	73.4	Confident	68.1	Low	68 Å²	68	107.8 Å²	107.8	48%	0.476	55%	0.551	S	S	.	*	H	α-helix	trans	-66	-35.3	-179.3	68.8	0	0	0	0	112.6	Q636 Q637 A644	Q636-S640 WeakPolarHBondContact O-CB 3.22Å; Q636-S640 PolarHBondContact O-N 3.21Å; Q636-S640 PolarHBondContact O-OG 2.97Å; Q637-S640 WeakPolarHBondContact CA-OG 3.32Å; Q637-S640 PolarHBondContact O-OG 2.84Å; S640-A644 WeakPolarHBondContact O-CB 3.35Å; S640-A644 PolarHBondContact O-N 2.96Å
641	S	72.1	Confident	67.9	Low	53 Å²	53	102.3 Å²	102.3	37%	0.371	55%	0.549	S	S	.	.	H	α-helix	trans	-68.6	-45.3	171.8	54.6	0	0	0	0	112.7	Q637 L638 I639 L643 A644 L645	Q637-S641 WeakPolarHBondContact O-CB 2.98Å; Q637-S641 PolarHBondContact O-N 3.44Å; Q637-S641 PolarHBondContact O-OG 3.09Å; L638-S641 PolarHBondContact O-OG 2.86Å; I639-S641 VanDerWaalsContact C-N 3.35Å; I639-S641 PolarHBondContact O-N 2.8Å; S641-L643 VanDerWaalsContact C-N 3.29Å; S641-L643 PolarHBondContact O-N 3.34Å; S641-A644 PolarHBondContact O-N 2.83Å; S641-L645 WeakPolarHBondContact O-CG 3.49Å; S641-L645 PolarHBondContact O-N 3.01Å
642	K	74.9	Confident	67.7	Low	139 Å²	139	104.8 Å²	104.8	60%	0.604	57%	0.569	S	S	*	*	H	α-helix	trans	-60.5	-35.7	174.1	-75.6	-76.7	-174	-179.5	0	112.7	L638 I639 R646	L638-K642 WeakPolarHBondContact O-CB 2.98Å; L638-K642 VanDerWaalsContact O-CG 3.25Å; L638-K642 WeakPolarHBondContact O-CG 3.48Å; L638-K642 PolarHBondContact O-N 2.95Å; I639-K642 PolarHBondContact O-N 2.71Å; K642-R646 PolarHBondContact O-N 3.48Å
643	L	73.6	Confident	66.3	Low	86 Å²	86	105.7 Å²	105.7	45%	0.45	57%	0.567	S	S	.	*	H	α-helix	trans	-76.3	-42.7	175.4	-70.3	176.9	0	0	0	112	I639 S641 L645 R646 F647	I639-L643 HydrophobicContact CG2-CD1 3.67Å; I639-L643 HydrophobicContact CG2-CG 4.13Å; I639-L643 WeakPolarHBondContact O-CB 3.39Å; I639-L643 VanDerWaalsContact O-CG 3.29Å; I639-L643 WeakPolarHBondContact O-CG 3.35Å; I639-L643 PolarHBondContact O-N 3.31Å; S641-L643 VanDerWaalsContact C-N 3.29Å; S641-L643 PolarHBondContact O-N 3.34Å; L643-L645 PolarHBondContact O-N 3.14Å; L643-R646 PolarHBondContact O-N 2.98Å; L643-F647 HydrophobicContact CB-CD2 4.43Å; L643-F647 HydrophobicContact CD2-CD2 3.73Å; L643-F647 HydrophobicContact CD2-CE2 3.64Å; L643-F647 PolarHBondContact O-N 2.77Å
644	A	72.4	Confident	65.1	Low	62 Å²	62	104.8 Å²	104.8	51%	0.512	56%	0.563	S	S	.	*	H	α-helix	trans	-62.2	-31.7	177.6	0	0	0	0	0	112.7	S640 S641 R648	S640-A644 WeakPolarHBondContact O-CB 3.35Å; S640-A644 PolarHBondContact O-N 2.96Å; S641-A644 PolarHBondContact O-N 2.83Å; A644-R648 WeakPolarHBondContact O-CG 2.76Å
645	L	67.3	Low	64.5	Low	135 Å²	135	104.8 Å²	104.8	71%	0.707	57%	0.566	S	S	*	*	H	α-helix	trans	-72.1	-29.9	172.6	-71.3	168.5	0	0	0	113.3	S641 L643	S641-L645 WeakPolarHBondContact O-CG 3.49Å; S641-L645 PolarHBondContact O-N 3.01Å; L643-L645 PolarHBondContact O-N 3.14Å
646	R	65.5	Low	64.1	Low	206 Å²	206	105.9 Å²	105.9	78%	0.777	59%	0.585	S	S	*	*	H	α-helix	trans	-95.7	-29.2	-177.8	-82	-173.3	163.4	-172.5	-5.7	115.1	K642 L643	K642-R646 PolarHBondContact O-N 3.48Å; L643-R646 PolarHBondContact O-N 2.98Å
647	F	59.7	Low	63.4	Low	157 Å²	157	110.8 Å²	110.8	69%	0.689	61%	0.605	S	S	*	*			trans	-120.5	58.1	-175.1	-63.4	-79.9	0	0	0	109.6	L643 S649	L643-F647 HydrophobicContact CB-CD2 4.43Å; L643-F647 HydrophobicContact CD2-CD2 3.73Å; L643-F647 HydrophobicContact CD2-CE2 3.64Å; L643-F647 PolarHBondContact O-N 2.77Å; F647-S649 PolarHBondContact O-N 3.35Å
648	R	59.1	Low	62.6	Low	173 Å²	173	113.8 Å²	113.8	65%	0.653	62%	0.619	S	S	*	*			trans	-71	119.1	170.5	-62	-179.2	75.7	175.4	1	107.9	A644 A650	A644-R648 WeakPolarHBondContact O-CG 2.76Å; R648-A650 PolarHBondContact O-N 3.47Å
649	S	53.3	Low	62.1	Low	84 Å²	84	113.3 Å²	113.3	59%	0.587	62%	0.617	S	S	*	*			trans	-63.2	133.8	171.6	177.3	0	0	0	0	109.6	F647 G651 C652	F647-S649 PolarHBondContact O-N 3.35Å; S649-G651 PolarHBondContact O-N 2.96Å; S649-G651 VanDerWaalsContact O-N 3.16Å; S649-G651 PolarHBondContact OG-N 3.18Å; S649-C652 WeakPolarHBondContact O-CB 3.28Å; S649-C652 PolarHBondContact O-N 2.93Å
650	A	56.5	Low	62.4	Low	98 Å²	98	113.1 Å²	113.1	81%	0.81	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-56.5	-30.7	177.6	0	0	0	0	0	112.5	R648 C652	R648-A650 PolarHBondContact O-N 3.47Å; A650-C652 PolarHBondContact O-N 2.89Å
651	G	58.2	Low	62.5	Low	78 Å²	78	117.3 Å²	117.3	80%	0.804	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-78.6	13.3	175.6	0	0	0	0	0	115.7	S649	S649-G651 PolarHBondContact O-N 2.96Å; S649-G651 VanDerWaalsContact O-N 3.16Å; S649-G651 PolarHBondContact OG-N 3.18Å
652	C	57.4	Low	62.7	Low	102 Å²	102	122.6 Å²	122.6	69%	0.689	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-123.3	16	-178.2	-161.3	0	0	0	0	113.1	S649 A650	S649-C652 WeakPolarHBondContact O-CB 3.28Å; S649-C652 PolarHBondContact O-N 2.93Å; A650-C652 PolarHBondContact O-N 2.89Å
653	M	46.9	Very low	62.9	Low	102 Å²	102	120.6 Å²	120.6	50%	0.502	64%	0.643	S	S	.	*			trans	-96.4	111.6	170.5	-73.7	-173.4	65	0	0	111.4	I655	M653-I655 HydrophobicContact CB-CG1 3.78Å; M653-I655 HydrophobicContact CE-CG1 4.3Å; M653-I655 PolarHBondContact O-N 3.25Å
654	D	47.4	Very low	62.9	Low	99 Å²	99	120.1 Å²	120.1	53%	0.529	64%	0.639	S	S	.	*			trans	-63.6	87.8	142.6	-77.3	-20.6	0	0	0	106.8	S656 K657	D654-S656 PolarHBondContact O-N 2.71Å; D654-K657 HydrophobicContact CB-CB 4.48Å; D654-K657 HydrophobicContact CB-CD 4.07Å; D654-K657 HydrophobicContact CB-CG 4.28Å; D654-K657 PolarHBondContact O-N 2.92Å; D654-K657 VanDerWaalsContact O-N 3.15Å; D654-K657 IonicContact OD2-NZ 2.68Å; D654-K657 PolarHBondContact OD2-NZ 3.47Å
655	I	57.1	Low	63.3	Low	130 Å²	130	123.9 Å²	123.9	67%	0.667	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	-23.9	177.1	-55.9	175.1	0	0	0	110.2	M653 K657	M653-I655 HydrophobicContact CB-CG1 3.78Å; M653-I655 HydrophobicContact CE-CG1 4.3Å; M653-I655 PolarHBondContact O-N 3.25Å; I655-K657 PolarHBondContact O-N 3.46Å; I655-K657 VanDerWaalsContact O-N 3.15Å
656	S	56.7	Low	64	Low	109 Å²	109	120.3 Å²	120.3	76%	0.762	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	9.5	174.7	51.7	0	0	0	0	115.9	D654	D654-S656 PolarHBondContact O-N 2.71Å
657	K	59.9	Low	64.3	Low	153 Å²	153	115.3 Å²	115.3	67%	0.665	62%	0.619	S	S	*	*			trans	-119.6	63.9	171.8	-71.8	174.8	-176.1	149.8	0	110.8	D654 I655	D654-K657 HydrophobicContact CB-CB 4.48Å; D654-K657 HydrophobicContact CB-CD 4.07Å; D654-K657 HydrophobicContact CB-CG 4.28Å; D654-K657 PolarHBondContact O-N 2.92Å; D654-K657 VanDerWaalsContact O-N 3.15Å; D654-K657 IonicContact OD2-NZ 2.68Å; D654-K657 PolarHBondContact OD2-NZ 3.47Å; I655-K657 PolarHBondContact O-N 3.46Å; I655-K657 VanDerWaalsContact O-N 3.15Å
658	E	60.1	Low	64.8	Low	177 Å²	177	114.4 Å²	114.4	83%	0.827	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-58.2	135.9	157.9	-64.2	178.8	156.1	0	0	108.6
659	L	63	Low	65.7	Low	87 Å²	87	108.8 Å²	108.8	46%	0.455	60%	0.602	S	S	.	*	P	Polyproline II helix	trans	-67	144	169.8	-78.5	160.5	0	0	0	108.2	E663	L659-E663 HydrophobicContact CB-CB 4.49Å; L659-E663 HydrophobicContact CD2-CB 4.05Å
660	T	74.8	Confident	66.7	Low	77 Å²	77	114 Å²	114	47%	0.472	61%	0.608	S	S	.	*	P	Polyproline II helix	trans	-64.2	146.8	171.1	57.5	0	0	0	0	109.9	E662 E663 E664	T660-E662 PolarHBondContact O-N 3.39Å; T660-E663 PolarHBondContact N-OE2 3.05Å; T660-E663 PolarHBondContact O-N 3.49Å; T660-E663 VanDerWaalsContact OG1-CG 3.27Å; T660-E663 WeakPolarHBondContact OG1-CG 3.32Å; T660-E663 PolarHBondContact OG1-N 3.02Å; T660-E663 PolarHBondContact OG1-OE2 2.83Å; T660-E664 PolarHBondContact O-N 2.92Å
661	E	76	Confident	67.2	Low	157 Å²	157	111.6 Å²	111.6	73%	0.734	58%	0.583	S	S	*	*	H	α-helix	trans	-54.3	-32.3	-179.7	-166.5	-168.8	155.1	0	0	111.4	K665	E661-K665 WeakPolarHBondContact O-CB 3.34Å; E661-K665 PolarHBondContact O-N 3.07Å
662	E	77.2	Confident	67.6	Low	164 Å²	164	113.8 Å²	113.8	77%	0.766	57%	0.573	S	S	*	*	H	α-helix	trans	-65.1	-43	173.4	-59.9	-167.4	161.2	0	0	113.2	T660 A666	T660-E662 PolarHBondContact O-N 3.39Å; E662-A666 VanDerWaalsContact O-CB 3.23Å; E662-A666 WeakPolarHBondContact O-CB 3.12Å; E662-A666 PolarHBondContact O-N 3.32Å
663	E	78.9	Confident	68.2	Low	97 Å²	97	113.3 Å²	113.3	45%	0.453	57%	0.571	S	S	.	*	H	α-helix	trans	-70.7	-37.6	177	-73.2	171.4	117.7	0	0	112.5	L659 T660 A666 Q667	L659-E663 HydrophobicContact CB-CB 4.49Å; L659-E663 HydrophobicContact CD2-CB 4.05Å; T660-E663 PolarHBondContact N-OE2 3.05Å; T660-E663 PolarHBondContact O-N 3.49Å; T660-E663 VanDerWaalsContact OG1-CG 3.27Å; T660-E663 WeakPolarHBondContact OG1-CG 3.32Å; T660-E663 PolarHBondContact OG1-N 3.02Å; T660-E663 PolarHBondContact OG1-OE2 2.83Å; E663-A666 PolarHBondContact O-N 3.39Å; E663-Q667 WeakPolarHBondContact O-CB 3.35Å; E663-Q667 VanDerWaalsContact O-CG 3.3Å; E663-Q667 WeakPolarHBondContact O-CG 3.36Å; E663-Q667 PolarHBondContact O-N 2.89Å; E663-Q667 PolarHBondContact O-NE2 2.69Å
664	E	74	Confident	69	Low	75 Å²	75	113.2 Å²	113.2	35%	0.35	57%	0.572	S	S	.	*	H	α-helix	trans	-67	-42.7	175.5	-162.9	-168.2	159	0	0	110.6	T660 Q667 R668	T660-E664 PolarHBondContact O-N 2.92Å; E664-Q667 WeakPolarHBondContact O-CB 3.42Å; E664-Q667 PolarHBondContact O-N 3.07Å; E664-R668 PolarHBondContact O-N 2.91Å; E664-R668 IonicContact OE1-CZ 3.08Å; E664-R668 IonicContact OE1-NH1 2.7Å; E664-R668 PolarHBondContact OE1-NH1 2.97Å; E664-R668 IonicContact OE1-NH2 3.92Å; E664-R668 PolarHBondContact OE1-NH2 3Å; E664-R668 IonicContact OE2-NH1 3.96Å
665	K	80.8	Confident	69.6	Low	142 Å²	142	117 Å²	117	62%	0.617	59%	0.592	S	S	*	*	H	α-helix	trans	-65.7	-38.7	173.9	-173.5	173.7	-173.5	170	0	112.6	E661 Q667 R668 A669	E661-K665 WeakPolarHBondContact O-CB 3.34Å; E661-K665 PolarHBondContact O-N 3.07Å; K665-Q667 VanDerWaalsContact C-N 3.33Å; K665-R668 PolarHBondContact O-N 3.27Å; K665-A669 WeakPolarHBondContact O-CB 3.04Å; K665-A669 PolarHBondContact O-N 3.49Å
666	A	80.7	Confident	69.8	Low	60 Å²	60	112.9 Å²	112.9	50%	0.496	57%	0.573	S	S	.	*	H	α-helix	trans	-65.5	-36.1	173.2	0	0	0	0	0	112	E662 E663 R670	E662-A666 VanDerWaalsContact O-CB 3.23Å; E662-A666 WeakPolarHBondContact O-CB 3.12Å; E662-A666 PolarHBondContact O-N 3.32Å; E663-A666 PolarHBondContact O-N 3.39Å; A666-R670 VanDerWaalsContact O-CB 3.26Å; A666-R670 WeakPolarHBondContact O-CB 3.31Å; A666-R670 PolarHBondContact O-N 2.93Å
667	Q	72.4	Confident	70.1	Confident	100 Å²	100	114.8 Å²	114.8	47%	0.467	58%	0.579	S	S	.	*	H	α-helix	trans	-66.1	-47.6	171.9	-76.3	172	71.9	0	0	111.4	E663 E664 K665 A669 R670 V671	E663-Q667 WeakPolarHBondContact O-CB 3.35Å; E663-Q667 VanDerWaalsContact O-CG 3.3Å; E663-Q667 WeakPolarHBondContact O-CG 3.36Å; E663-Q667 PolarHBondContact O-N 2.89Å; E663-Q667 PolarHBondContact O-NE2 2.69Å; E664-Q667 WeakPolarHBondContact O-CB 3.42Å; E664-Q667 PolarHBondContact O-N 3.07Å; K665-Q667 VanDerWaalsContact C-N 3.33Å; Q667-A669 PolarHBondContact O-N 3.48Å; Q667-R670 PolarHBondContact O-N 2.89Å; Q667-V671 VanDerWaalsContact O-CB 3.31Å; Q667-V671 WeakPolarHBondContact O-CB 3.23Å; Q667-V671 WeakPolarHBondContact O-CG2 3.46Å; Q667-V671 PolarHBondContact O-N 2.85Å
668	R	70.8	Confident	70.8	Confident	139 Å²	139	110.8 Å²	110.8	53%	0.525	56%	0.563	S	S	.	*	H	α-helix	trans	-56.6	-49.7	174.3	-75.2	-169.9	176.4	96.8	14.6	112.6	E664 K665 R670 V671 E672	E664-R668 PolarHBondContact O-N 2.91Å; E664-R668 IonicContact OE1-CZ 3.08Å; E664-R668 IonicContact OE1-NH1 2.7Å; E664-R668 PolarHBondContact OE1-NH1 2.97Å; E664-R668 IonicContact OE1-NH2 3.92Å; E664-R668 PolarHBondContact OE1-NH2 3Å; E664-R668 IonicContact OE2-NH1 3.96Å; K665-R668 PolarHBondContact O-N 3.27Å; R668-R670 VanDerWaalsContact C-N 3.33Å; R668-R670 PolarHBondContact O-N 3.21Å; R668-V671 WeakPolarHBondContact O-CB 3.01Å; R668-V671 PolarHBondContact O-N 3.12Å; R668-V671 VanDerWaalsContact O-N 3.12Å; R668-E672 WeakPolarHBondContact O-CB 3.46Å; R668-E672 PolarHBondContact O-N 3.37Å
669	A	77.3	Confident	71.6	Confident	55 Å²	55	106.5 Å²	106.5	46%	0.455	55%	0.551	S	S	.	*	H	α-helix	trans	-62.9	-38.1	179.5	0	0	0	0	0	112.5	K665 Q667 V671 S673	K665-A669 WeakPolarHBondContact O-CB 3.04Å; K665-A669 PolarHBondContact O-N 3.49Å; Q667-A669 PolarHBondContact O-N 3.48Å; A669-V671 VanDerWaalsContact C-N 3.33Å; A669-S673 WeakPolarHBondContact O-CB 3.41Å; A669-S673 PolarHBondContact O-N 3.05Å
670	R	75.4	Confident	72.2	Confident	193 Å²	193	106.1 Å²	106.1	73%	0.728	54%	0.543	S	S	*	.	H	α-helix	trans	-64.6	-38.8	173.8	-177.7	178.4	-176.1	167	3.3	112	A666 Q667 R668 S673 L674	A666-R670 VanDerWaalsContact O-CB 3.26Å; A666-R670 WeakPolarHBondContact O-CB 3.31Å; A666-R670 PolarHBondContact O-N 2.93Å; Q667-R670 PolarHBondContact O-N 2.89Å; R668-R670 VanDerWaalsContact C-N 3.33Å; R668-R670 PolarHBondContact O-N 3.21Å; R670-S673 PolarHBondContact O-N 3.28Å; R670-S673 PolarHBondContact O-OG 3.43Å; R670-L674 WeakPolarHBondContact O-CD1 3.49Å
671	V	65.8	Low	72.4	Confident	47 Å²	47	105.5 Å²	105.5	29%	0.285	54%	0.537	S	S	.	.	H	α-helix	trans	-69.6	-43.6	179.1	160.3	0	0	0	0	111.6	Q667 R668 A669 S673 L674 A685	Q667-V671 VanDerWaalsContact O-CB 3.31Å; Q667-V671 WeakPolarHBondContact O-CB 3.23Å; Q667-V671 WeakPolarHBondContact O-CG2 3.46Å; Q667-V671 PolarHBondContact O-N 2.85Å; R668-V671 WeakPolarHBondContact O-CB 3.01Å; R668-V671 PolarHBondContact O-N 3.12Å; R668-V671 VanDerWaalsContact O-N 3.12Å; A669-V671 VanDerWaalsContact C-N 3.33Å; V671-S673 VanDerWaalsContact C-N 3.27Å; V671-S673 PolarHBondContact O-N 3.45Å; V671-L674 WeakPolarHBondContact O-CD1 3.39Å; V671-L674 PolarHBondContact O-N 3.37Å; V671-A685 HydrophobicContact CG1-CB 3.71Å; V671-A685 WeakPolarHBondContact CG1-O 3.38Å
672	E	67.5	Low	72.4	Confident	125 Å²	125	101.4 Å²	101.4	58%	0.584	52%	0.518	S	S	*	.	H	α-helix	trans	-65.8	-27.9	174.8	-170.7	172	-152.4	0	0	112.3	R668 L674	R668-E672 WeakPolarHBondContact O-CB 3.46Å; R668-E672 PolarHBondContact O-N 3.37Å; E672-L674 PolarHBondContact O-N 2.9Å
673	S	70.2	Confident	72.7	Confident	92 Å²	92	93.6 Å²	93.6	64%	0.643	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	1.3	176.1	76	0	0	0	0	115.8	A669 R670 V671 D675	A669-S673 WeakPolarHBondContact O-CB 3.41Å; A669-S673 PolarHBondContact O-N 3.05Å; R670-S673 PolarHBondContact O-N 3.28Å; R670-S673 PolarHBondContact O-OG 3.43Å; V671-S673 VanDerWaalsContact C-N 3.27Å; V671-S673 PolarHBondContact O-N 3.45Å; S673-D675 PolarHBondContact O-N 3Å
674	L	62.9	Low	72.7	Confident	100 Å²	100	92 Å²	92	52%	0.524	48%	0.478	S	S	.	.	S	Bend	trans	-85.1	108.5	171.9	-78.7	113.6	0	0	0	111.1	R670 V671 E672 T676	R670-L674 WeakPolarHBondContact O-CD1 3.49Å; V671-L674 WeakPolarHBondContact O-CD1 3.39Å; V671-L674 PolarHBondContact O-N 3.37Å; E672-L674 PolarHBondContact O-N 2.9Å; L674-T676 VanDerWaalsContact C-N 3.26Å; L674-T676 HydrophobicContact CB-CG2 4.2Å; L674-T676 PolarHBondContact O-N 3.27Å; L674-T676 PolarHBondContact O-OG1 3.28Å
675	D	60.7	Low	72.8	Confident	177 Å²	177	90 Å²	90	95%	0.947	47%	0.474	S	S	*	.			trans	-58.7	85.3	164.8	-93.3	-31.1	0	0	0	110.6	S673	S673-D675 PolarHBondContact O-N 3Å
676	T	59.9	Low	72.8	Confident	44 Å²	44	85.9 Å²	85.9	27%	0.27	46%	0.461	S	S	.	.			trans	-94.1	120.3	177.6	43.9	0	0	0	0	109.6	L674 E678 D681 H682	L674-T676 VanDerWaalsContact C-N 3.26Å; L674-T676 HydrophobicContact CB-CG2 4.2Å; L674-T676 PolarHBondContact O-N 3.27Å; L674-T676 PolarHBondContact O-OG1 3.28Å; T676-E678 VanDerWaalsContact C-N 3.26Å; T676-E678 PolarHBondContact O-N 3.23Å; T676-D681 HydrophobicContact CG2-CB 3.96Å; T676-H682 VanDerWaalsContact OG1-CA 3.28Å; T676-H682 WeakPolarHBondContact OG1-CA 3.41Å; T676-H682 WeakPolarHBondContact OG1-CB 3.38Å; T676-H682 PolarHBondContact OG1-N 3.15Å; T676-H682 VanDerWaalsContact OG1-N 3.1Å
677	V	63.9	Low	72.7	Confident	149 Å²	149	89.3 Å²	89.3	90%	0.903	47%	0.467	S	S	*	.	S	Bend	trans	-65.1	-27.3	-169.8	-178.4	0	0	0	0	113
678	E	74.3	Confident	73.1	Confident	70 Å²	70	87.3 Å²	87.3	33%	0.327	46%	0.464	S	S	.	.	S	Bend	trans	-101.2	132.5	172	-73.8	-172.7	-144.9	0	0	111.2	T676 R680 D681 H682	T676-E678 VanDerWaalsContact C-N 3.26Å; T676-E678 PolarHBondContact O-N 3.23Å; E678-R680 HydrophobicContact CB-CB 4.27Å; E678-R680 PolarHBondContact O-N 3.05Å; E678-R680 IonicContact OE2-CZ 3.55Å; E678-R680 IonicContact OE2-NH1 2.7Å; E678-R680 PolarHBondContact OE2-NH1 3.17Å; E678-D681 PolarHBondContact O-N 2.87Å; E678-H682 PolarHBondContact O-N 3.1Å
679	P	77.5	Confident	73.5	Confident	87 Å²	87	88.3 Å²	88.3	57%	0.565	47%	0.469	S	S	*	.	H	α-helix	trans	-54.9	-22.9	169.1	-29.1	37.1	0	0	0	114.2	A683 L692	P679-A683 VanDerWaalsContact O-CB 3.26Å; P679-A683 WeakPolarHBondContact O-CB 3.41Å; P679-A683 PolarHBondContact O-N 2.64Å; P679-L692 HydrophobicContact CB-CD1 3.94Å; P679-L692 HydrophobicContact CB-CD2 4.3Å; P679-L692 HydrophobicContact CB-CG 4.37Å
680	R	76.2	Confident	73.8	Confident	78 Å²	78	87 Å²	87	29%	0.294	46%	0.46	S	S	.	.	H	α-helix	trans	-62.3	-46.4	170.1	170.1	174.2	-60.5	112.4	-0.5	112.2	E678 A683 V684 R694	E678-R680 HydrophobicContact CB-CB 4.27Å; E678-R680 PolarHBondContact O-N 3.05Å; E678-R680 IonicContact OE2-CZ 3.55Å; E678-R680 IonicContact OE2-NH1 2.7Å; E678-R680 PolarHBondContact OE2-NH1 3.17Å; R680-A683 PolarHBondContact O-N 3.17Å; R680-V684 WeakPolarHBondContact O-CG2 3.49Å; R680-V684 PolarHBondContact O-N 3.2Å; R680-R694 PolarHBondContact NH2-O 2.81Å
681	D	77.4	Confident	74	Confident	65 Å²	65	82.3 Å²	82.3	35%	0.348	46%	0.464	S	S	.	.	H	α-helix	trans	-71.8	-36.6	-176.7	-76.3	-10.6	0	0	0	109.9	T676 E678 V684 A685	T676-D681 HydrophobicContact CG2-CB 3.96Å; E678-D681 PolarHBondContact O-N 2.87Å; D681-V684 PolarHBondContact O-N 3.37Å; D681-A685 VanDerWaalsContact O-CB 3.3Å; D681-A685 WeakPolarHBondContact O-CB 3.09Å; D681-A685 PolarHBondContact O-N 2.99Å
682	H	77.3	Confident	74.7	Confident	70 Å²	70	84.8 Å²	84.8	32%	0.324	47%	0.474	S	S	.	.	H	α-helix	trans	-59.2	-46	167.7	-169.6	-76.3	0	0	0	111.4	T676 E678 V684 A685 T686	T676-H682 VanDerWaalsContact OG1-CA 3.28Å; T676-H682 WeakPolarHBondContact OG1-CA 3.41Å; T676-H682 WeakPolarHBondContact OG1-CB 3.38Å; T676-H682 PolarHBondContact OG1-N 3.15Å; T676-H682 VanDerWaalsContact OG1-N 3.1Å; E678-H682 PolarHBondContact O-N 3.1Å; H682-V684 VanDerWaalsContact C-N 3.33Å; H682-V684 PolarHBondContact O-N 3.28Å; H682-A685 WeakPolarHBondContact O-CA 3.24Å; H682-A685 WeakPolarHBondContact O-CB 3.26Å; H682-A685 PolarHBondContact O-N 2.9Å; H682-A685 VanDerWaalsContact O-N 3.12Å; H682-T686 PolarHBondContact O-N 3.13Å; H682-T686 PolarHBondContact O-OG1 3.25Å; H682-T686 VanDerWaalsContact O-OG1 3.11Å
683	A	82.4	Confident	75.3	Confident	1 Å²	1	80.2 Å²	80.2	1%	0.008	46%	0.455	C	S	.	.	H	α-helix	trans	-67.9	-30.4	-179.4	0	0	0	0	0	113.6	P679 R680 S688 L692 T693	P679-A683 VanDerWaalsContact O-CB 3.26Å; P679-A683 WeakPolarHBondContact O-CB 3.41Å; P679-A683 PolarHBondContact O-N 2.64Å; R680-A683 PolarHBondContact O-N 3.17Å; A683-S688 VanDerWaalsContact CA-OG 3.26Å; A683-S688 WeakPolarHBondContact CA-OG 3.42Å; A683-S688 CarbonylContact O-C 3.4Å; A683-S688 WeakPolarHBondContact O-CA 3.47Å; A683-S688 PolarHBondContact O-N 3.16Å; A683-S688 PolarHBondContact O-OG 2.84Å; A683-L692 HydrophobicContact CB-CB 4.13Å; A683-L692 HydrophobicContact CB-CD2 3.8Å; A683-L692 HydrophobicContact CB-CG 3.9Å; A683-T693 HydrophobicContact CB-CG2 3.7Å
684	V	78.8	Confident	75.9	Confident	64 Å²	64	85 Å²	85	39%	0.388	46%	0.459	S	S	.	.	H	α-helix	trans	-73.3	-34.8	170.1	170.1	0	0	0	0	111.2	R680 D681 H682 E687 Y689 T693	R680-V684 WeakPolarHBondContact O-CG2 3.49Å; R680-V684 PolarHBondContact O-N 3.2Å; D681-V684 PolarHBondContact O-N 3.37Å; H682-V684 VanDerWaalsContact C-N 3.33Å; H682-V684 PolarHBondContact O-N 3.28Å; V684-E687 PolarHBondContact O-N 3.48Å; V684-Y689 HydrophobicContact CG1-CE1 4.49Å; V684-Y689 HydrophobicContact CG2-CE1 4.43Å; V684-T693 HydrophobicContact CG2-CG2 3.71Å
685	A	77.3	Confident	76.7	Confident	31 Å²	31	85.1 Å²	85.1	26%	0.256	45%	0.453	S	S	.	.	H	α-helix	trans	-63.7	-55.4	175.2	0	0	0	0	0	110.2	V671 D681 H682 E687	V671-A685 HydrophobicContact CG1-CB 3.71Å; V671-A685 WeakPolarHBondContact CG1-O 3.38Å; D681-A685 VanDerWaalsContact O-CB 3.3Å; D681-A685 WeakPolarHBondContact O-CB 3.09Å; D681-A685 PolarHBondContact O-N 2.99Å; H682-A685 WeakPolarHBondContact O-CA 3.24Å; H682-A685 WeakPolarHBondContact O-CB 3.26Å; H682-A685 PolarHBondContact O-N 2.9Å; H682-A685 VanDerWaalsContact O-N 3.12Å; A685-E687 PolarHBondContact O-N 3.2Å
686	T	81	Confident	77.7	Confident	56 Å²	56	88.4 Å²	88.4	34%	0.344	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	19.1	178.1	60.7	0	0	0	0	114.5	H682 S688	H682-T686 PolarHBondContact O-N 3.13Å; H682-T686 PolarHBondContact O-OG1 3.25Å; H682-T686 VanDerWaalsContact O-OG1 3.11Å; T686-S688 PolarHBondContact O-N 3.11Å; T686-S688 PolarHBondContact OG1-OG 3.07Å
687	E	78.5	Confident	78.7	Confident	132 Å²	132	88.9 Å²	88.9	62%	0.617	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	13.4	178.7	-54.1	-169.9	136.7	0	0	115.8	V684 A685 Y689	V684-E687 PolarHBondContact O-N 3.48Å; A685-E687 PolarHBondContact O-N 3.2Å; E687-Y689 VanDerWaalsContact C-N 3.31Å; E687-Y689 HydrophobicContact CB-CE2 4.21Å; E687-Y689 WeakPolarHBondContact O-CD2 3.5Å; E687-Y689 WeakPolarHBondContact O-CE2 3.4Å; E687-Y689 PolarHBondContact O-N 3.37Å
688	S	80.5	Confident	79.8	Confident	59 Å²	59	87.3 Å²	87.3	41%	0.413	43%	0.433	S	S	.	.			trans	-81.7	66.8	-177	54.7	0	0	0	0	112.7	A683 T686 G690	A683-S688 VanDerWaalsContact CA-OG 3.26Å; A683-S688 WeakPolarHBondContact CA-OG 3.42Å; A683-S688 CarbonylContact O-C 3.4Å; A683-S688 WeakPolarHBondContact O-CA 3.47Å; A683-S688 PolarHBondContact O-N 3.16Å; A683-S688 PolarHBondContact O-OG 2.84Å; T686-S688 PolarHBondContact O-N 3.11Å; T686-S688 PolarHBondContact OG1-OG 3.07Å; S688-G690 PolarHBondContact O-N 3.17Å
689	Y	79	Confident	80.4	Confident	159 Å²	159	90.8 Å²	90.8	62%	0.624	44%	0.443	S	S	*	.			trans	-66.9	122.6	178.6	-55.8	-71.9	0	0	0	112	V684 E687 T693	V684-Y689 HydrophobicContact CG1-CE1 4.49Å; V684-Y689 HydrophobicContact CG2-CE1 4.43Å; E687-Y689 VanDerWaalsContact C-N 3.31Å; E687-Y689 HydrophobicContact CB-CE2 4.21Å; E687-Y689 WeakPolarHBondContact O-CD2 3.5Å; E687-Y689 WeakPolarHBondContact O-CE2 3.4Å; E687-Y689 PolarHBondContact O-N 3.37Å; Y689-T693 HydrophobicContact CD1-CG2 4.26Å
690	G	82.3	Confident	81	Confident	27 Å²	27	87.9 Å²	87.9	28%	0.278	42%	0.422	S	S	.	.	S	Bend	trans	-174.2	-150.7	-173.1	0	0	0	0	0	113.5	S688 L692 T693 R694	S688-G690 PolarHBondContact O-N 3.17Å; G690-L692 PolarHBondContact O-N 3.17Å; G690-T693 PolarHBondContact N-OG1 3.09Å; G690-T693 PolarHBondContact O-N 2.59Å; G690-T693 PolarHBondContact O-OG1 3.26Å; G690-R694 VanDerWaalsContact O-CG 3.31Å; G690-R694 WeakPolarHBondContact O-CG 3.4Å; G690-R694 PolarHBondContact O-N 2.92Å
691	A	81.3	Confident	81.6	Confident	96 Å²	96	84.9 Å²	84.9	79%	0.793	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-35.7	175.8	0	0	0	0	0	112.3	R694	A691-R694 PolarHBondContact O-N 2.93Å
692	L	78.8	Confident	82.2	Confident	98 Å²	98	84.9 Å²	84.9	51%	0.513	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-30.4	-177.7	-162.9	53.8	0	0	0	113.2	P679 A683 G690	P679-L692 HydrophobicContact CB-CD1 3.94Å; P679-L692 HydrophobicContact CB-CD2 4.3Å; P679-L692 HydrophobicContact CB-CG 4.37Å; A683-L692 HydrophobicContact CB-CB 4.13Å; A683-L692 HydrophobicContact CB-CD2 3.8Å; A683-L692 HydrophobicContact CB-CG 3.9Å; G690-L692 PolarHBondContact O-N 3.17Å
693	T	82.1	Confident	82.7	Confident	29 Å²	29	85.1 Å²	85.1	18%	0.178	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-18.5	178	63	0	0	0	0	113.6	A683 V684 Y689 G690	A683-T693 HydrophobicContact CB-CG2 3.7Å; V684-T693 HydrophobicContact CG2-CG2 3.71Å; Y689-T693 HydrophobicContact CD1-CG2 4.26Å; G690-T693 PolarHBondContact N-OG1 3.09Å; G690-T693 PolarHBondContact O-N 2.59Å; G690-T693 PolarHBondContact O-OG1 3.26Å
694	R	82.7	Confident	83	Confident	193 Å²	193	89.7 Å²	89.7	73%	0.728	44%	0.437	S	S	*	.			trans	-70.6	149.4	177.6	-72.1	168.4	-172.5	-156.9	-0.4	111.4	R680 G690 A691	R680-R694 PolarHBondContact NH2-O 2.81Å; G690-R694 VanDerWaalsContact O-CG 3.31Å; G690-R694 WeakPolarHBondContact O-CG 3.4Å; G690-R694 PolarHBondContact O-N 2.92Å; A691-R694 PolarHBondContact O-N 2.93Å
695	R	78.8	Confident	83.5	Confident	103 Å²	103	89.7 Å²	89.7	39%	0.389	44%	0.435	S	S	.	.			trans	-128.4	140.3	171.5	73.9	-171.4	-160.9	142.1	13.8	110.1	L697 D726	R695-L697 VanDerWaalsContact CZ-CD1 3.48Å; R695-D726 IonicContact CZ-OD1 2.67Å; R695-D726 IonicContact CZ-OD2 3.19Å; R695-D726 IonicContact NH1-OD1 2.74Å; R695-D726 PolarHBondContact NH1-OD1 3.49Å; R695-D726 IonicContact NH1-OD2 3.65Å; R695-D726 IonicContact NH2-OD1 3.76Å; R695-D726 PolarHBondContact NH2-OD1 2.93Å; R695-D726 IonicContact NH2-OD2 3.67Å; R695-D726 PolarHBondContact NH2-OD2 2.87Å
696	R	81.4	Confident	84.2	Confident	246 Å²	246	88.7 Å²	88.7	93%	0.928	43%	0.425	S	S	*	.			trans	-116.7	138.1	167.6	-72	-179.4	174.1	171.5	-3.2	106.9
697	L	81.4	Confident	84.6	Confident	53 Å²	53	93.5 Å²	93.5	28%	0.277	44%	0.441	S	S	.	.			trans	-139.6	145.7	-176.5	-59	171.4	0	0	0	107.8	R695 W699 C723 D725	R695-L697 VanDerWaalsContact CZ-CD1 3.48Å; L697-W699 PolarHBondContact O-N 3.36Å; L697-W699 VanDerWaalsContact O-N 3.08Å; L697-C723 HydrophobicContact CB-CB 4Å; L697-C723 HydrophobicContact CD1-CB 4.03Å; L697-D725 HydrophobicContact CD2-CB 3.95Å
698	K	87.1	Confident	85.2	Confident	117 Å²	117	97.2 Å²	97.2	51%	0.509	45%	0.45	S	S	.	.			trans	-81.5	90.1	178.5	-69.6	-165.9	174.7	-168.4	0	110.4	D21 H700 P724 D725	D21-K698 IonicContact OD2-NZ 3.14Å; K698-H700 PolarHBondContact O-CE1 3.4Å; K698-H700 PolarHBondContact O-N 3.22Å; K698-H700 PolarHBondContact O-ND1 3.02Å; K698-P724 WeakPolarHBondContact O-CD 3.25Å; K698-D725 PolarHBondContact N-OD2 3.15Å
699	W	87.1	Confident	85.8	Confident	142 Å²	142	99.6 Å²	99.6	54%	0.538	46%	0.457	S	S	.	.			trans	-72.2	126.5	177.3	-177	66.4	0	0	0	111.7	L697 P701 L705 G722	L697-W699 PolarHBondContact O-N 3.36Å; L697-W699 VanDerWaalsContact O-N 3.08Å; W699-P701 HydrophobicContact CE3-CB 4.35Å; W699-P701 HydrophobicContact CH2-CB 3.83Å; W699-P701 HydrophobicContact CZ2-CB 4.32Å; W699-P701 HydrophobicContact CZ3-CB 3.83Å; W699-L705 HydrophobicContact CH2-CD2 3.63Å; W699-L705 HydrophobicContact CZ2-CD2 4.26Å; W699-G722 CarbonylContact C-O 3.53Å; W699-G722 WeakPolarHBondContact CA-O 3.12Å
700	H	89.9	Confident	86.3	Confident	26 Å²	26	99.1 Å²	99.1	12%	0.12	47%	0.465	C	S	.	.	B	Isolated β-bridge	trans	-100.9	113	175.2	-65.6	55.6	0	0	0	108.1	K698 Y715 F720 G722	K698-H700 PolarHBondContact O-CE1 3.4Å; K698-H700 PolarHBondContact O-N 3.22Å; K698-H700 PolarHBondContact O-ND1 3.02Å; H700-Y715 HydrophobicContact CB-CD2 4.14Å; H700-Y715 AromaticContact CD2-CD1 3.99Å; H700-Y715 AromaticContact CD2-CD2 3.59Å; H700-Y715 AromaticContact CD2-CG 3.47Å; H700-Y715 VanDerWaalsContact CD2-CG 3.47Å; H700-Y715 AromaticContact CG-CD2 3.74Å; H700-Y715 AromaticContact NE2-CD1 3.77Å; H700-Y715 AromaticContact NE2-CG 3.77Å; H700-F720 HydrophobicContact CB-CD1 4.47Å; H700-F720 VanDerWaalsContact CB-O 3.29Å; H700-F720 WeakPolarHBondContact CB-O 3.14Å; H700-G722 PolarHBondContact N-O 3.44Å; H700-G722 PolarHBondContact O-N 2.93Å
701	P	89.5	Confident	86.6	Confident	15 Å²	15	101.8 Å²	101.8	10%	0.097	48%	0.476	C	S	.	.			trans	-70	159.9	178.6	29.8	-35.7	0	0	0	112	W699 L705 C706 P714	W699-P701 HydrophobicContact CE3-CB 4.35Å; W699-P701 HydrophobicContact CH2-CB 3.83Å; W699-P701 HydrophobicContact CZ2-CB 4.32Å; W699-P701 HydrophobicContact CZ3-CB 3.83Å; P701-L705 HydrophobicContact CB-CD2 4.4Å; P701-C706 WeakPolarHBondContact CG-SG 3.47Å; P701-P714 HydrophobicContact CG-CG 3.82Å
702	D	88.8	Confident	87	Confident	66 Å²	66	102.5 Å²	102.5	35%	0.353	47%	0.472	S	S	.	.			trans	-67.2	139.3	167.3	-177.9	-5	0	0	0	109.8	L704 L705 C706 V721	D702-L704 PolarHBondContact O-N 3.02Å; D702-L704 PolarHBondContact OD1-N 3.11Å; D702-L705 HydrophobicContact CB-CB 4.09Å; D702-L705 WeakPolarHBondContact O-CA 3.3Å; D702-L705 VanDerWaalsContact O-CB 3.3Å; D702-L705 WeakPolarHBondContact O-CB 3.4Å; D702-L705 PolarHBondContact O-N 3.46Å; D702-C706 PolarHBondContact O-N 3.39Å; D702-C706 PolarHBondContact O-SG 3.46Å; D702-V721 HydrophobicContact CB-CG1 4.08Å; D702-V721 HydrophobicContact CB-CG2 4.39Å
703	K	88	Confident	87.5	Confident	74 Å²	74	99.6 Å²	99.6	32%	0.322	46%	0.457	S	S	.	.	H	α-helix	trans	-61.2	-27.8	174.5	-47.3	-157.8	171.6	178.8	0	111.7	K707 D713 P716 S718	K703-K707 WeakPolarHBondContact O-CB 3.29Å; K703-K707 VanDerWaalsContact O-CG 3.25Å; K703-K707 WeakPolarHBondContact O-CG 3.48Å; K703-K707 PolarHBondContact O-N 3.42Å; K703-D713 WeakPolarHBondContact CD-OD2 3.35Å; K703-D713 WeakPolarHBondContact CE-OD2 3.41Å; K703-D713 VanDerWaalsContact CG-OD2 3.26Å; K703-D713 WeakPolarHBondContact CG-OD2 3.41Å; K703-D713 IonicContact NZ-OD2 3.46Å; K703-P716 PolarHBondContact NZ-O 3.04Å; K703-S718 WeakPolarHBondContact CE-O 3.19Å; K703-S718 PolarHBondContact NZ-O 3.19Å
704	L	89.3	Confident	87.8	Confident	98 Å²	98	101.9 Å²	101.9	51%	0.513	47%	0.473	S	S	.	.	H	α-helix	trans	-71.6	-31.7	170.1	-63.5	176.4	0	0	0	112.9	D702 R708	D702-L704 PolarHBondContact O-N 3.02Å; D702-L704 PolarHBondContact OD1-N 3.11Å; L704-R708 WeakPolarHBondContact O-CB 3.47Å; L704-R708 VanDerWaalsContact O-CG 3.28Å; L704-R708 WeakPolarHBondContact O-CG 3.33Å; L704-R708 PolarHBondContact O-N 3.22Å
705	L	89.2	Confident	88.1	Confident	64 Å²	64	96.6 Å²	96.6	34%	0.335	45%	0.453	S	S	.	.	H	α-helix	trans	-71.2	-46.2	176.3	-173.5	67.6	0	0	0	110.7	W699 P701 D702 K707 R708 I709	W699-L705 HydrophobicContact CH2-CD2 3.63Å; W699-L705 HydrophobicContact CZ2-CD2 4.26Å; P701-L705 HydrophobicContact CB-CD2 4.4Å; D702-L705 HydrophobicContact CB-CB 4.09Å; D702-L705 WeakPolarHBondContact O-CA 3.3Å; D702-L705 VanDerWaalsContact O-CB 3.3Å; D702-L705 WeakPolarHBondContact O-CB 3.4Å; D702-L705 PolarHBondContact O-N 3.46Å; L705-K707 VanDerWaalsContact C-N 3.33Å; L705-K707 PolarHBondContact O-N 3.15Å; L705-R708 PolarHBondContact O-N 2.8Å; L705-R708 VanDerWaalsContact O-N 3.09Å; L705-I709 HydrophobicContact CD1-CD1 3.78Å; L705-I709 HydrophobicContact CD1-CG1 4.33Å; L705-I709 HydrophobicContact CG-CD1 3.85Å; L705-I709 WeakPolarHBondContact O-CG1 3.5Å; L705-I709 PolarHBondContact O-N 2.9Å
706	C	90.9	Very high	88.4	Confident	9 Å²	9	95.4 Å²	95.4	6%	0.061	46%	0.459	C	S	.	.	H	α-helix	trans	-55	-49	175	-56.9	0	0	0	0	111	P701 D702 R708 I709 N710 V711 D713	P701-C706 WeakPolarHBondContact CG-SG 3.47Å; D702-C706 PolarHBondContact O-N 3.39Å; D702-C706 PolarHBondContact O-SG 3.46Å; C706-R708 PolarHBondContact O-N 2.95Å; C706-I709 PolarHBondContact O-N 2.81Å; C706-N710 PolarHBondContact O-N 3.26Å; C706-V711 CarbonylContact C-O 3.52Å; C706-V711 WeakPolarHBondContact CB-O 3.35Å; C706-V711 PolarHBondContact O-N 2.93Å; C706-V711 VanDerWaalsContact O-O 3.12Å; C706-D713 HydrophobicContact CB-CB 4.26Å
707	K	89.7	Confident	88.6	Confident	157 Å²	157	91.2 Å²	91.2	68%	0.683	46%	0.455	S	S	*	.	H	α-helix	trans	-59.9	-37.8	174.7	-74.7	175.4	-179.9	-174.7	0	113.9	K703 L705	K703-K707 WeakPolarHBondContact O-CB 3.29Å; K703-K707 VanDerWaalsContact O-CG 3.25Å; K703-K707 WeakPolarHBondContact O-CG 3.48Å; K703-K707 PolarHBondContact O-N 3.42Å; L705-K707 VanDerWaalsContact C-N 3.33Å; L705-K707 PolarHBondContact O-N 3.15Å
708	R	91.5	Very high	88.7	Confident	211 Å²	211	89.9 Å²	89.9	80%	0.796	45%	0.45	S	S	*	.	H	α-helix	trans	-74.2	-31.6	179.5	-80.2	174.2	175.3	168.3	-0	113.7	L704 L705 C706 N710	L704-R708 WeakPolarHBondContact O-CB 3.47Å; L704-R708 VanDerWaalsContact O-CG 3.28Å; L704-R708 WeakPolarHBondContact O-CG 3.33Å; L704-R708 PolarHBondContact O-N 3.22Å; L705-R708 PolarHBondContact O-N 2.8Å; L705-R708 VanDerWaalsContact O-N 3.09Å; C706-R708 PolarHBondContact O-N 2.95Å; R708-N710 VanDerWaalsContact C-N 3.31Å
709	I	93	Very high	88.4	Confident	108 Å²	108	91.4 Å²	91.4	55%	0.554	47%	0.469	S	S	*	.	H	α-helix	trans	-88.9	-4	178.2	-56.5	176.6	0	0	0	110.9	L705 C706 V711	L705-I709 HydrophobicContact CD1-CD1 3.78Å; L705-I709 HydrophobicContact CD1-CG1 4.33Å; L705-I709 HydrophobicContact CG-CD1 3.85Å; L705-I709 WeakPolarHBondContact O-CG1 3.5Å; L705-I709 PolarHBondContact O-N 2.9Å; C706-I709 PolarHBondContact O-N 2.81Å; I709-V711 VanDerWaalsContact C-N 3.29Å; I709-V711 HydrophobicContact CB-CG2 4.47Å; I709-V711 HydrophobicContact CG2-CG2 3.88Å; I709-V711 PolarHBondContact O-N 3.46Å
710	N	88.8	Confident	88.2	Confident	150 Å²	150	87.5 Å²	87.5	80%	0.802	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	39.9	-175.5	-164.9	55.6	0	0	0	113	C706 R708	C706-N710 PolarHBondContact O-N 3.26Å; R708-N710 VanDerWaalsContact C-N 3.31Å
711	V	89.9	Confident	87.9	Confident	82 Å²	82	87.8 Å²	87.8	50%	0.497	46%	0.46	S	S	.	.			trans	-114.2	136.7	176.7	172.5	0	0	0	0	108.2	C706 I709	C706-V711 CarbonylContact C-O 3.52Å; C706-V711 WeakPolarHBondContact CB-O 3.35Å; C706-V711 PolarHBondContact O-N 2.93Å; C706-V711 VanDerWaalsContact O-O 3.12Å; I709-V711 VanDerWaalsContact C-N 3.29Å; I709-V711 HydrophobicContact CB-CG2 4.47Å; I709-V711 HydrophobicContact CG2-CG2 3.88Å; I709-V711 PolarHBondContact O-N 3.46Å
712	P	89.5	Confident	87.7	Confident	111 Å²	111	87.6 Å²	87.6	72%	0.721	46%	0.461	S	S	*	.			trans	-55	140.5	173.3	-25.7	35.2	0	0	0	111.8	P714	P712-P714 VanDerWaalsContact O-CD 3.31Å; P712-P714 WeakPolarHBondContact O-CD 3.21Å
713	D	87.8	Confident	87.4	Confident	38 Å²	38	86.1 Å²	86.1	20%	0.203	46%	0.455	C	S	.	.			trans	-64.6	117.9	173.5	179.9	-4.3	0	0	0	109.2	K703 C706 Y715 P716	K703-D713 WeakPolarHBondContact CD-OD2 3.35Å; K703-D713 WeakPolarHBondContact CE-OD2 3.41Å; K703-D713 VanDerWaalsContact CG-OD2 3.26Å; K703-D713 WeakPolarHBondContact CG-OD2 3.41Å; K703-D713 IonicContact NZ-OD2 3.46Å; C706-D713 HydrophobicContact CB-CB 4.26Å; D713-Y715 PolarHBondContact O-N 2.7Å; D713-Y715 PolarHBondContact OD1-N 3.46Å; D713-P716 WeakPolarHBondContact O-CD 3.16Å
714	P	88.9	Confident	86.6	Confident	77 Å²	77	84.9 Å²	84.9	50%	0.5	45%	0.454	S	S	.	.	S	Bend	trans	-74.4	-12.1	-178.4	30.5	-34.8	0	0	0	113.4	P701 P712	P701-P714 HydrophobicContact CG-CG 3.82Å; P712-P714 VanDerWaalsContact O-CD 3.31Å; P712-P714 WeakPolarHBondContact O-CD 3.21Å
715	Y	89	Confident	85.4	Confident	81 Å²	81	84.9 Å²	84.9	32%	0.318	46%	0.455	S	S	.	.			trans	-134.1	61	179.6	-57.5	-74.4	0	0	0	111.1	H700 D713 D717 S718	H700-Y715 HydrophobicContact CB-CD2 4.14Å; H700-Y715 AromaticContact CD2-CD1 3.99Å; H700-Y715 AromaticContact CD2-CD2 3.59Å; H700-Y715 AromaticContact CD2-CG 3.47Å; H700-Y715 VanDerWaalsContact CD2-CG 3.47Å; H700-Y715 AromaticContact CG-CD2 3.74Å; H700-Y715 AromaticContact NE2-CD1 3.77Å; H700-Y715 AromaticContact NE2-CG 3.77Å; D713-Y715 PolarHBondContact O-N 2.7Å; D713-Y715 PolarHBondContact OD1-N 3.46Å; Y715-D717 PolarHBondContact O-N 2.91Å; Y715-D717 VanDerWaalsContact O-N 3.16Å; Y715-S718 WeakPolarHBondContact CB-OG 3.32Å; Y715-S718 WeakPolarHBondContact O-CB 3.37Å; Y715-S718 PolarHBondContact O-N 2.79Å; Y715-S718 PolarHBondContact O-OG 3.31Å
716	P	85	Confident	83.9	Confident	78 Å²	78	84.6 Å²	84.6	51%	0.506	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-27	-169.9	28.2	-36	0	0	0	113.5	K703 D713	K703-P716 PolarHBondContact NZ-O 3.04Å; D713-P716 WeakPolarHBondContact O-CD 3.16Å
717	D	86.5	Confident	82	Confident	159 Å²	159	94 Å²	94	85%	0.85	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-13.9	177.7	-54.8	-39.2	0	0	0	113	Y715	Y715-D717 PolarHBondContact O-N 2.91Å; Y715-D717 VanDerWaalsContact O-N 3.16Å
718	S	82.3	Confident	80	Confident	24 Å²	24	92.7 Å²	92.7	17%	0.168	48%	0.479	C	S	.	.			trans	-75.7	142.4	-178.6	75.4	0	0	0	0	111.9	K703 Y715	K703-S718 WeakPolarHBondContact CE-O 3.19Å; K703-S718 PolarHBondContact NZ-O 3.19Å; Y715-S718 WeakPolarHBondContact CB-OG 3.32Å; Y715-S718 WeakPolarHBondContact O-CB 3.37Å; Y715-S718 PolarHBondContact O-N 2.79Å; Y715-S718 PolarHBondContact O-OG 3.31Å
719	T	81.6	Confident	77.6	Confident	149 Å²	149	88.3 Å²	88.3	91%	0.914	48%	0.477	S	S	*	.			trans	-103.5	0.7	169.4	52.5	0	0	0	0	112.4
720	F	82.7	Confident	75.1	Confident	61 Å²	61	94.6 Å²	94.6	27%	0.268	49%	0.494	S	S	.	.			trans	-106.3	132.3	-175.2	174.8	-89.3	0	0	0	110.5	H700 G722 C723 P724	H700-F720 HydrophobicContact CB-CD1 4.47Å; H700-F720 VanDerWaalsContact CB-O 3.29Å; H700-F720 WeakPolarHBondContact CB-O 3.14Å; F720-G722 VanDerWaalsContact CE1-C 3.4Å; F720-C723 VanDerWaalsContact CE1-C 3.42Å; F720-P724 HydrophobicContact CD1-CB 4.37Å; F720-P724 HydrophobicContact CD1-CG 3.76Å; F720-P724 HydrophobicContact CE1-CB 4.1Å; F720-P724 HydrophobicContact CE1-CG 3.65Å; F720-P724 VanDerWaalsContact CE1-N 3.27Å
721	V	84.7	Confident	72.6	Confident	32 Å²	32	92.8 Å²	92.8	19%	0.194	49%	0.485	C	S	.	.			trans	-114	140.8	175.5	175.9	0	0	0	0	107.9	D702 N763	D702-V721 HydrophobicContact CB-CG1 4.08Å; D702-V721 HydrophobicContact CB-CG2 4.39Å; V721-N763 PolarHBondContact O-ND2 3.19Å
722	G	85.4	Confident	70.4	Confident	11 Å²	11	93.5 Å²	93.5	11%	0.113	49%	0.491	C	S	.	.	B	Isolated β-bridge	trans	107.4	-152.5	-175.3	0	0	0	0	0	113	W699 H700 F720	W699-G722 CarbonylContact C-O 3.53Å; W699-G722 WeakPolarHBondContact CA-O 3.12Å; H700-G722 PolarHBondContact N-O 3.44Å; H700-G722 PolarHBondContact O-N 2.93Å; F720-G722 VanDerWaalsContact CE1-C 3.4Å
723	C	81.4	Confident	68.1	Low	35 Å²	35	96.3 Å²	96.3	24%	0.236	49%	0.492	C	S	.	.			trans	-107.7	115.7	178	-64.7	0	0	0	0	110.8	L697 F720 D725	L697-C723 HydrophobicContact CB-CB 4Å; L697-C723 HydrophobicContact CD1-CB 4.03Å; F720-C723 VanDerWaalsContact CE1-C 3.42Å; C723-D725 VanDerWaalsContact C-N 3.27Å; C723-D725 PolarHBondContact O-N 3.45Å
724	P	70.9	Confident	66	Low	47 Å²	47	103.3 Å²	103.3	31%	0.305	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-63.8	-35.3	-176.4	-20.8	30.9	0	0	0	112.8	K698 F720 D726	K698-P724 WeakPolarHBondContact O-CD 3.25Å; F720-P724 HydrophobicContact CD1-CB 4.37Å; F720-P724 HydrophobicContact CD1-CG 3.76Å; F720-P724 HydrophobicContact CE1-CB 4.1Å; F720-P724 HydrophobicContact CE1-CG 3.65Å; F720-P724 VanDerWaalsContact CE1-N 3.27Å; P724-D726 VanDerWaalsContact C-N 3.27Å; P724-D726 PolarHBondContact O-N 3.39Å
725	D	64	Low	63.9	Low	98 Å²	98	108.2 Å²	108.2	52%	0.524	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	-75.4	-10.3	-168.8	-44.2	-57.4	0	0	0	113.7	L697 K698 C723 R727	L697-D725 HydrophobicContact CD2-CB 3.95Å; K698-D725 PolarHBondContact N-OD2 3.15Å; C723-D725 VanDerWaalsContact C-N 3.27Å; C723-D725 PolarHBondContact O-N 3.45Å; D725-R727 PolarHBondContact O-N 3.09Å
726	D	58.3	Low	62	Low	59 Å²	59	113.1 Å²	113.1	32%	0.316	55%	0.554	S	S	.	*	G	3₁₀ helix	trans	-71.1	-6.9	178.5	-99.9	-27.4	0	0	0	113.2	R695 P724 R728	R695-D726 IonicContact CZ-OD1 2.67Å; R695-D726 IonicContact CZ-OD2 3.19Å; R695-D726 IonicContact NH1-OD1 2.74Å; R695-D726 PolarHBondContact NH1-OD1 3.49Å; R695-D726 IonicContact NH1-OD2 3.65Å; R695-D726 IonicContact NH2-OD1 3.76Å; R695-D726 PolarHBondContact NH2-OD1 2.93Å; R695-D726 IonicContact NH2-OD2 3.67Å; R695-D726 PolarHBondContact NH2-OD2 2.87Å; P724-D726 VanDerWaalsContact C-N 3.27Å; P724-D726 PolarHBondContact O-N 3.39Å; D726-R728 VanDerWaalsContact C-N 3.35Å; D726-R728 PolarHBondContact O-N 3.12Å
727	R	51.2	Low	59.8	Low	207 Å²	207	118.5 Å²	118.5	78%	0.781	57%	0.57	S	S	*	*	S	Bend	trans	-74.8	84.7	167.4	-71.3	-174.3	176	175.9	2.7	111	D725	D725-R727 PolarHBondContact O-N 3.09Å
728	R	47	Very low	57.5	Low	129 Å²	129	114.6 Å²	114.6	49%	0.487	57%	0.568	S	S	.	*			trans	-43	128	164.9	-77.2	-175	165	-169.9	-8.1	110.1	D726 R730 E753	D726-R728 VanDerWaalsContact C-N 3.35Å; D726-R728 PolarHBondContact O-N 3.12Å; R728-R730 PolarHBondContact O-N 3.4Å; R728-R730 VanDerWaalsContact O-N 3.1Å; R728-E753 WeakPolarHBondContact CD-OE2 3.15Å; R728-E753 IonicContact CZ-OE2 2.67Å; R728-E753 IonicContact NE-OE2 2.7Å; R728-E753 IonicContact NH1-OE1 3.31Å; R728-E753 PolarHBondContact NH1-OE1 3.34Å; R728-E753 VanDerWaalsContact NH1-OE1 3.13Å; R728-E753 IonicContact NH1-OE2 3.15Å; R728-E753 PolarHBondContact NH1-OE2 3.03Å
729	P	42.1	Very low	55.7	Low	118 Å²	118	122.2 Å²	122.2	77%	0.766	60%	0.598	S	S	*	*			trans	-65.3	116.3	-174.6	25.2	-33.4	0	0	0	109.8	N731	P729-N731 PolarHBondContact O-N 3.31Å; P729-N731 VanDerWaalsContact O-N 3.07Å
730	R	40.4	Very low	53.6	Low	241 Å²	241	124.2 Å²	124.2	91%	0.909	60%	0.596	S	S	*	*			trans	-55.4	121.2	172.5	-80.2	-161.5	-63.2	-118.8	-0.2	108.7	R728	R728-R730 PolarHBondContact O-N 3.4Å; R728-R730 VanDerWaalsContact O-N 3.1Å
731	N	35.8	Very low	51.4	Low	112 Å²	112	125 Å²	125	60%	0.599	62%	0.621	S	S	*	*			trans	-39.3	114.8	-166	-173.8	-14	0	0	0	112.9	P729 F733 R734	P729-N731 PolarHBondContact O-N 3.31Å; P729-N731 VanDerWaalsContact O-N 3.07Å; N731-F733 PolarHBondContact O-N 3.2Å; N731-F733 WeakPolarHBondContact OD1-CD2 3.34Å; N731-F733 PolarHBondContact OD1-N 2.84Å; N731-R734 PolarHBondContact O-N 3.09Å
732	P	43.5	Very low	49	Very low	96 Å²	96	134.4 Å²	134.4	62%	0.623	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-64.1	-11.6	-168.2	23.8	-34.3	0	0	0	114.4	R734 H735	P732-R734 PolarHBondContact O-N 2.68Å; P732-H735 PolarHBondContact O-N 2.79Å
733	F	41.5	Very low	46.8	Very low	170 Å²	170	139 Å²	139	75%	0.746	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-61	-19.7	176.5	-83	-90.4	0	0	0	114.9	N731 H735	N731-F733 PolarHBondContact O-N 3.2Å; N731-F733 WeakPolarHBondContact OD1-CD2 3.34Å; N731-F733 PolarHBondContact OD1-N 2.84Å; F733-H735 PolarHBondContact O-N 2.63Å
734	R	43	Very low	44.5	Very low	185 Å²	185	147.8 Å²	147.8	70%	0.698	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-67.9	-12.5	176	-85.2	-169.4	81.6	160.4	3.7	114.7	N731 P732 D747	N731-R734 PolarHBondContact O-N 3.09Å; P732-R734 PolarHBondContact O-N 2.68Å; R734-D747 IonicContact CZ-OD2 2.82Å; R734-D747 IonicContact NH1-OD2 2.76Å; R734-D747 IonicContact NH2-OD2 3.19Å; R734-D747 PolarHBondContact NH2-OD2 3.43Å
735	H	46.5	Very low	42.9	Very low	181 Å²	181	154.7 Å²	154.7	84%	0.838	74%	0.744	S	S	*	*	G	3₁₀ helix	trans	-86	0.4	-175.3	-95.7	-66.4	0	0	0	116.5	P732 F733	P732-H735 PolarHBondContact O-N 2.79Å; F733-H735 PolarHBondContact O-N 2.63Å
736	K	47.9	Very low	41.4	Very low	184 Å²	184	155.2 Å²	155.2	80%	0.8	76%	0.756	S	S	*	*	G	3₁₀ helix	trans	-103.1	-3.3	-175.9	-77	-170.8	174.8	-179	0	116.6
737	F	39.3	Very low	40.2	Very low	190 Å²	190	157.7 Å²	157.7	83%	0.833	77%	0.769	S	S	*	*	S	Bend	trans	-128.5	138.4	174.2	-66.5	-82.7	0	0	0	110.1
738	G	38.1	Very low	39.6	Very low	78 Å²	78	153.6 Å²	153.6	80%	0.804	77%	0.772	S	S	*	*			trans	94.6	59.7	178	0	0	0	0	0	115.7
739	K	45.4	Very low	39.2	Very low	184 Å²	184	152.5 Å²	152.5	80%	0.8	78%	0.784	S	S	*	*			trans	-70.1	166.8	137	-74.5	-176	177.8	179.5	0	107.9
740	H	37.1	Very low	38.9	Very low	190 Å²	190	151.9 Å²	151.9	88%	0.88	78%	0.778	S	S	*	*			trans	70.4	120.8	-176.8	-29.5	-71.1	0	0	0	113.5
741	G	35.5	Very low	38.9	Very low	77 Å²	77	145 Å²	145	79%	0.794	77%	0.772	S	S	*	*			trans	135.1	79.8	176.2	0	0	0	0	0	114.6	S743	G741-S743 VanDerWaalsContact C-N 3.32Å; G741-S743 PolarHBondContact O-N 2.93Å; G741-S743 VanDerWaalsContact O-N 3.1Å
742	K	35.1	Very low	39	Very low	230 Å²	230	147.4 Å²	147.4	100%	1	79%	0.785	S	S	*	*			trans	-77.5	84	163	-75.3	-176.5	177.7	178.8	0	108.8
743	S	38.9	Very low	39.1	Very low	109 Å²	109	149.5 Å²	149.5	76%	0.762	79%	0.787	S	S	*	*			trans	-125.8	142.1	170.8	-163.6	0	0	0	0	111.7	G741	G741-S743 VanDerWaalsContact C-N 3.32Å; G741-S743 PolarHBondContact O-N 2.93Å; G741-S743 VanDerWaalsContact O-N 3.1Å
744	R	33.8	Very low	39.3	Very low	219 Å²	219	147 Å²	147	83%	0.826	78%	0.776	S	S	*	*			trans	-85.1	176.8	160.5	-65.8	172.8	176.2	157.8	-2.7	108.5
745	F	35.4	Very low	39.8	Very low	192 Å²	192	140.2 Å²	140.2	84%	0.842	76%	0.757	S	S	*	*	S	Bend	trans	82.4	136.9	175.5	-55.7	-76.9	0	0	0	118.6
746	S	33.2	Very low	40.1	Very low	109 Å²	109	137.2 Å²	137.2	76%	0.762	75%	0.746	S	S	*	*			trans	40.9	104.3	151.7	59.3	0	0	0	0	120.3
747	D	34	Very low	40.1	Very low	111 Å²	111	132.9 Å²	132.9	59%	0.594	73%	0.727	S	S	*	*			trans	-158.6	77.5	147.7	-152.6	28.5	0	0	0	110.8	R734	R734-D747 IonicContact CZ-OD2 2.82Å; R734-D747 IonicContact NH1-OD2 2.76Å; R734-D747 IonicContact NH2-OD2 3.19Å; R734-D747 PolarHBondContact NH2-OD2 3.43Å
748	S	38.7	Very low	41	Very low	121 Å²	121	127.1 Å²	127.1	85%	0.846	71%	0.705	S	S	*	*			trans	-136.1	27.4	-172.8	72.2	0	0	0	0	114.6
749	S	37.3	Very low	41.9	Very low	105 Å²	105	129.3 Å²	129.3	73%	0.734	70%	0.698	S	S	*	*	S	Bend	trans	-112.9	1.2	-170.4	54	0	0	0	0	115.2
750	T	37.4	Very low	42.1	Very low	106 Å²	106	126.4 Å²	126.4	65%	0.65	69%	0.69	S	S	*	*			trans	-138.9	158.2	-178.2	54.8	0	0	0	0	112
751	A	39.6	Very low	42.6	Very low	95 Å²	95	119.8 Å²	119.8	79%	0.785	66%	0.661	S	S	*	*			trans	62.8	82	-162.8	0	0	0	0	0	111.7
752	N	38.7	Very low	43.4	Very low	163 Å²	163	121.1 Å²	121.1	87%	0.872	65%	0.654	S	S	*	*				51.8	69.4	63.5	-99	16.7	0	0	0	113.1
753	E	44	Very low	44.1	Very low	140 Å²	140	114 Å²	114	65%	0.654	63%	0.626	S	S	*	*			trans	-164.9	144.7	133.8	-103.2	163.3	-158.7	0	0	108.5	R728	R728-E753 WeakPolarHBondContact CD-OE2 3.15Å; R728-E753 IonicContact CZ-OE2 2.67Å; R728-E753 IonicContact NE-OE2 2.7Å; R728-E753 IonicContact NH1-OE1 3.31Å; R728-E753 PolarHBondContact NH1-OE1 3.34Å; R728-E753 VanDerWaalsContact NH1-OE1 3.13Å; R728-E753 IonicContact NH1-OE2 3.15Å; R728-E753 PolarHBondContact NH1-OE2 3.03Å
754	F	45.6	Very low	44.5	Very low	118 Å²	118	110.9 Å²	110.9	52%	0.518	60%	0.603	S	S	.	*			trans	-141	115	-179.7	-179.2	-92	0	0	0	108.2	L759	F754-L759 HydrophobicContact CE1-CD1 3.9Å; F754-L759 HydrophobicContact CE1-CG 4.5Å; F754-L759 HydrophobicContact CZ-CD1 3.94Å; F754-L759 HydrophobicContact CZ-CG 4.06Å
755	S	53.7	Low	44.8	Very low	43 Å²	43	104.1 Å²	104.1	30%	0.301	59%	0.586	S	S	.	*			trans	-88.4	143.7	-178.3	-172	0	0	0	0	110.6	F757 D758	S755-F757 PolarHBondContact O-N 3.01Å; S755-F757 PolarHBondContact OG-N 2.7Å; S755-D758 WeakPolarHBondContact CB-OD1 3.39Å; S755-D758 WeakPolarHBondContact CB-OD2 3.1Å; S755-D758 PolarHBondContact N-OD2 3.37Å; S755-D758 WeakPolarHBondContact O-CB 3.39Å; S755-D758 PolarHBondContact O-N 3.2Å; S755-D758 VanDerWaalsContact O-N 3.12Å
756	I	53.5	Low	45	Very low	117 Å²	117	97.7 Å²	97.7	60%	0.6	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-60.8	-24.8	169.2	-88.3	172.8	0	0	0	111.3
757	F	48.4	Very low	45.4	Very low	93 Å²	93	96.6 Å²	96.6	41%	0.408	57%	0.566	S	S	.	*	G	3₁₀ helix	trans	-77.8	-17.9	177.9	-60.4	-78.4	0	0	0	113.5	S755 L759 L760 D761	S755-F757 PolarHBondContact O-N 3.01Å; S755-F757 PolarHBondContact OG-N 2.7Å; F757-L759 PolarHBondContact O-N 2.92Å; F757-L760 HydrophobicContact CD1-CD1 4.1Å; F757-L760 PolarHBondContact O-N 3.17Å; F757-D761 PolarHBondContact O-N 2.88Å
758	D	58.1	Low	45.7	Very low	69 Å²	69	96.4 Å²	96.4	37%	0.369	56%	0.564	S	S	.	*	G	3₁₀ helix	trans	-63.7	-23.2	174.9	-57.2	-24.4	0	0	0	111.9	S755 T764	S755-D758 WeakPolarHBondContact CB-OD1 3.39Å; S755-D758 WeakPolarHBondContact CB-OD2 3.1Å; S755-D758 PolarHBondContact N-OD2 3.37Å; S755-D758 WeakPolarHBondContact O-CB 3.39Å; S755-D758 PolarHBondContact O-N 3.2Å; S755-D758 VanDerWaalsContact O-N 3.12Å; D758-T764 PolarHBondContact O-OG1 3.17Å
759	L	56.9	Low	45.8	Very low	125 Å²	125	98 Å²	98	65%	0.654	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-80.9	-14.1	174.1	-74.2	149.9	0	0	0	113.5	F754 F757	F754-L759 HydrophobicContact CE1-CD1 3.9Å; F754-L759 HydrophobicContact CE1-CG 4.5Å; F754-L759 HydrophobicContact CZ-CD1 3.94Å; F754-L759 HydrophobicContact CZ-CG 4.06Å; F757-L759 PolarHBondContact O-N 2.92Å
760	L	49.8	Very low	45.8	Very low	123 Å²	123	101.3 Å²	101.3	64%	0.644	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	-19.6	-179.2	-64.2	174	0	0	0	112.4	F757 V762	F757-L760 HydrophobicContact CD1-CD1 4.1Å; F757-L760 PolarHBondContact O-N 3.17Å; L760-V762 PolarHBondContact O-N 3.42Å
761	D	46.7	Very low	45.7	Very low	51 Å²	51	102.4 Å²	102.4	27%	0.273	56%	0.561	S	S	.	*			trans	-73.7	94.5	172.1	-177.1	12.4	0	0	0	111	F757 N763 T764	F757-D761 PolarHBondContact O-N 2.88Å; D761-N763 PolarHBondContact O-N 2.97Å; D761-N763 VanDerWaalsContact OD1-CB 3.28Å; D761-N763 WeakPolarHBondContact OD1-CB 3.39Å; D761-N763 PolarHBondContact OD1-N 2.85Å; D761-N763 PolarHBondContact OD1-ND2 2.87Å; D761-T764 HydrophobicContact CB-CG2 3.97Å; D761-T764 PolarHBondContact O-N 2.89Å; D761-T764 PolarHBondContact O-OG1 3.37Å; D761-T764 WeakPolarHBondContact OD2-CG2 3.24Å
762	V	53.4	Low	45.5	Very low	104 Å²	104	104.6 Å²	104.6	63%	0.63	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.9	-24.7	173.2	-74	0	0	0	0	113.7	L760 T765	L760-V762 PolarHBondContact O-N 3.42Å; V762-T765 WeakPolarHBondContact O-CB 3.45Å; V762-T765 WeakPolarHBondContact O-CG2 3.47Å; V762-T765 PolarHBondContact O-OG1 3.36Å
763	N	48	Very low	45.3	Very low	80 Å²	80	100.7 Å²	100.7	43%	0.428	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-21.1	-178.7	-52.6	-78.8	0	0	0	113.3	V721 D761 T765	V721-N763 PolarHBondContact O-ND2 3.19Å; D761-N763 PolarHBondContact O-N 2.97Å; D761-N763 VanDerWaalsContact OD1-CB 3.28Å; D761-N763 WeakPolarHBondContact OD1-CB 3.39Å; D761-N763 PolarHBondContact OD1-N 2.85Å; D761-N763 PolarHBondContact OD1-ND2 2.87Å; N763-T765 PolarHBondContact O-N 3.21Å
764	T	47.7	Very low	44.8	Very low	44 Å²	44	98.7 Å²	98.7	27%	0.27	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-27.9	174.2	63.1	0	0	0	0	112.5	D758 D761 G766 S767	D758-T764 PolarHBondContact O-OG1 3.17Å; D761-T764 HydrophobicContact CB-CG2 3.97Å; D761-T764 PolarHBondContact O-N 2.89Å; D761-T764 PolarHBondContact O-OG1 3.37Å; D761-T764 WeakPolarHBondContact OD2-CG2 3.24Å; T764-G766 VanDerWaalsContact C-N 3.25Å; T764-G766 PolarHBondContact O-N 3.23Å; T764-S767 PolarHBondContact O-N 3.14Å
765	T	40	Very low	44.2	Very low	78 Å²	78	101 Å²	101	48%	0.479	56%	0.564	S	S	.	*	H	α-helix	trans	-57.2	-36.3	-172.7	65.9	0	0	0	0	113	V762 N763 S767 I768	V762-T765 WeakPolarHBondContact O-CB 3.45Å; V762-T765 WeakPolarHBondContact O-CG2 3.47Å; V762-T765 PolarHBondContact O-OG1 3.36Å; N763-T765 PolarHBondContact O-N 3.21Å; T765-S767 VanDerWaalsContact C-N 3.32Å; T765-S767 PolarHBondContact O-N 3.33Å; T765-I768 PolarHBondContact O-N 3.19Å
766	G	39.8	Very low	43.2	Very low	56 Å²	56	103.9 Å²	103.9	58%	0.577	59%	0.59	S	S	*	*	H	α-helix	trans	-67.7	-25.3	178.8	0	0	0	0	0	114.5	T764	T764-G766 VanDerWaalsContact C-N 3.25Å; T764-G766 PolarHBondContact O-N 3.23Å
767	S	41.9	Very low	42.1	Very low	87 Å²	87	104.9 Å²	104.9	61%	0.608	60%	0.602	S	S	*	*	H	α-helix	trans	-81.1	-30.9	177.7	-168.2	0	0	0	0	112.6	T764 T765	T764-S767 PolarHBondContact O-N 3.14Å; T765-S767 VanDerWaalsContact C-N 3.32Å; T765-S767 PolarHBondContact O-N 3.33Å
768	I	41.4	Very low	41.4	Very low	107 Å²	107	105.7 Å²	105.7	55%	0.549	62%	0.619	S	S	.	*	H	α-helix	trans	-72.4	-32.5	-172	-64.6	170.2	0	0	0	111.5	T765 K770	T765-I768 PolarHBondContact O-N 3.19Å; I768-K770 VanDerWaalsContact C-N 3.3Å; I768-K770 PolarHBondContact O-N 3.2Å
769	Q	39.3	Very low	40.3	Very low	155 Å²	155	108.4 Å²	108.4	72%	0.724	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-70.7	-24.2	-178.2	-60.5	-171.7	14.2	0	0	113.4	L771	Q769-L771 VanDerWaalsContact C-N 3.26Å; Q769-L771 PolarHBondContact O-N 3.25Å
770	K	37.4	Very low	39	Very low	174 Å²	174	109.2 Å²	109.2	76%	0.757	64%	0.639	S	S	*	*	G	3₁₀ helix	trans	-81	2.2	-174.5	-146.4	169.8	-173	172.8	0	114.6	I768	I768-K770 VanDerWaalsContact C-N 3.3Å; I768-K770 PolarHBondContact O-N 3.2Å
771	L	36.1	Very low	38.2	Very low	129 Å²	129	115 Å²	115	68%	0.675	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-99.6	-9.9	-177.3	-63.7	173.9	0	0	0	114.1	Q769	Q769-L771 VanDerWaalsContact C-N 3.26Å; Q769-L771 PolarHBondContact O-N 3.25Å
772	N	34.7	Very low	37.3	Very low	141 Å²	141	119.8 Å²	119.8	75%	0.754	67%	0.673	S	S	*	*	S	Bend	trans	-99.9	26	-174.6	-66.5	-35	0	0	0	113.7
773	S	35.6	Very low	36.3	Very low	81 Å²	81	123.3 Å²	123.3	57%	0.566	69%	0.687	S	S	*	*	S	Bend	trans	-131.7	32.9	-172.3	65.8	0	0	0	0	114.7
774	S	32.7	Very low	35.5	Very low	98 Å²	98	124.6 Å²	124.6	69%	0.685	70%	0.702	S	S	*	*			trans	-147.9	77.5	175.5	60.1	0	0	0	0	112.3
775	N	33.4	Very low	35	Very low	166 Å²	166	128.1 Å²	128.1	89%	0.888	73%	0.728	S	S	*	*			trans	-158.9	84.2	162.6	-102.5	-22.8	0	0	0	109.6
776	A	32.6	Very low	34.6	Very low	104 Å²	104	133.2 Å²	133.2	86%	0.86	75%	0.747	S	S	*	*			trans	-137.4	95.7	169.2	0	0	0	0	0	107.3
777	T	30.8	Very low	34.5	Very low	137 Å²	137	136.2 Å²	136.2	84%	0.84	76%	0.759	S	S	*	*			trans	-76.2	133.7	-177.8	47.4	0	0	0	0	111.2
778	S	33.8	Very low	34	Very low	111 Å²	111	139.3 Å²	139.3	78%	0.776	77%	0.769	S	S	*	*			trans	-152.8	115.1	157.1	-153.5	0	0	0	0	113.4
779	V	34.2	Very low	33.7	Very low	125 Å²	125	139.7 Å²	139.7	76%	0.758	78%	0.781	S	S	*	*			trans	49.2	104.2	152.6	-170.7	0	0	0	0	118.8
780	E	28.9	Very low	33.5	Very low	143 Å²	143	136.5 Å²	136.5	67%	0.668	78%	0.776	S	S	*	*			trans	-68.1	140.4	157.4	170	179.9	-148	0	0	112.5	Q782	E780-Q782 HydrophobicContact CG-CG 4.18Å; E780-Q782 WeakPolarHBondContact OE1-CG 3.49Å; E780-Q782 PolarHBondContact OE1-NE2 2.94Å
781	R	33.1	Very low	33.4	Very low	243 Å²	243	135.2 Å²	135.2	92%	0.917	78%	0.777	S	S	*	*			trans	-141.3	115.8	141.3	-74.8	-162.2	179.3	-173.4	0.4	109.7
782	Q	28.7	Very low	33.4	Very low	153 Å²	153	134.3 Å²	134.3	72%	0.715	78%	0.781	S	S	*	*			trans	-77.2	154.6	168	-53.2	-177.4	20.1	0	0	110.3	E780	E780-Q782 HydrophobicContact CG-CG 4.18Å; E780-Q782 WeakPolarHBondContact OE1-CG 3.49Å; E780-Q782 PolarHBondContact OE1-NE2 2.94Å
783	L	33.2	Very low	33.5	Very low	178 Å²	178	135 Å²	135	93%	0.932	79%	0.785	S	S	*	*				-165.5	151	125.7	-104.4	166.2	0	0	0	109.7
784	S	31	Very low	33.7	Very low	107 Å²	107	135.8 Å²	135.8	75%	0.748	79%	0.791	S	S	*	*			trans	-119.9	137	-167	55.2	0	0	0	0	112.5
785	S	35.8	Very low	33.9	Very low	117 Å²	117	138.3 Å²	138.3	82%	0.818	80%	0.796	S	S	*	*			trans	-169.6	127.2	139.8	56.2	0	0	0	0	113.5
786	E	33.3	Very low	34.1	Very low	185 Å²	185	137.3 Å²	137.3	86%	0.864	79%	0.791	S	S	*	*			trans	-26	144.6	156.1	-55.5	163.4	160.7	0	0	117.7
787	S	36.2	Very low	34.8	Very low	119 Å²	119	137 Å²	137	83%	0.832	78%	0.781	S	S	*	*				-175.3	167.7	122.2	31.4	0	0	0	0	111.5
788	N	32.3	Very low	34.9	Very low	152 Å²	152	136.5 Å²	136.5	81%	0.813	78%	0.783	S	S	*	*			trans	-112.2	178	-166.3	-65.3	-70.1	0	0	0	113.3
789	S	35.5	Very low	35	Very low	116 Å²	116	134.5 Å²	134.5	81%	0.811	78%	0.779	S	S	*	*			trans	75.4	154.5	154.4	75.7	0	0	0	0	118.2
790	S	34.4	Very low	35.1	Very low	87 Å²	87	135.2 Å²	135.2	61%	0.608	78%	0.784	S	S	*	*			cis	-173.1	145.4	-28.4	51.3	0	0	0	0	110.9
791	D	34.6	Very low	35.4	Very low	148 Å²	148	136.2 Å²	136.2	79%	0.791	79%	0.791	S	S	*	*			trans	63.7	160.9	148.7	-55	-22.4	0	0	0	123.1
792	S	37.2	Very low	35.9	Very low	109 Å²	109	129.3 Å²	129.3	76%	0.762	78%	0.777	S	S	*	*			trans	74.8	96.1	159.8	55.6	0	0	0	0	121.3
793	D	35.8	Very low	36.3	Very low	155 Å²	155	129.6 Å²	129.6	83%	0.829	78%	0.779	S	S	*	*				25.2	130.5	118.5	-52.6	-30.3	0	0	0	120.6
794	S	39.3	Very low	36.3	Very low	98 Å²	98	127.3 Å²	127.3	69%	0.685	77%	0.767	S	S	*	*				157.8	147.9	95.9	56.5	0	0	0	0	114.6
795	N	37.3	Very low	36.2	Very low	151 Å²	151	127.6 Å²	127.6	81%	0.807	77%	0.768	S	S	*	*			trans	57.8	153.6	144.1	-61.7	-7.1	0	0	0	121.3
796	D	37.7	Very low	36	Very low	146 Å²	146	125.5 Å²	125.5	78%	0.781	76%	0.757	S	S	*	*			cis	-158	-154.2	-31.9	-148.6	0.8	0	0	0	107.1
797	P	48	Very low	36	Very low	98 Å²	98	123.4 Å²	123.4	64%	0.636	75%	0.752	S	S	*	*			trans	-128.6	-172.3	-138.8	41.1	-19.7	0	0	0	117.8
798	S	32.3	Very low	35.9	Very low	126 Å²	126	125.2 Å²	125.2	88%	0.881	75%	0.752	S	S	*	*			trans	100.3	146.4	146.8	80.8	0	0	0	0	121.8
799	G	36.3	Very low	35.9	Very low	68 Å²	68	124.1 Å²	124.1	70%	0.701	75%	0.751	S	S	*	*			trans	113.5	141.9	166.2	0	0	0	0	0	116.1
800	T	35.9	Very low	36.1	Very low	141 Å²	141	123 Å²	123	87%	0.865	74%	0.741	S	S	*	*			cis	-156	136.3	-11.4	-63.5	0	0	0	0	112.1
801	M	36.3	Very low	36.2	Very low	164 Å²	164	129.1 Å²	129.1	81%	0.808	75%	0.753	S	S	*	*			trans	-34	-179.3	157.9	-72.5	-73.8	-88.8	0	0	119
802	P	43.7	Very low	35.9	Very low	98 Å²	98	131.5 Å²	131.5	64%	0.636	75%	0.75	S	S	*	*			cis	-144.1	-147.9	-28.3	35.3	-11.3	0	0	0	114.4
803	E	36	Very low	35.8	Very low	159 Å²	159	132.6 Å²	132.6	74%	0.743	75%	0.753	S	S	*	*			trans	94.8	141.4	158.3	-56.3	-138.5	129.9	0	0	118.7
804	L	33.1	Very low	35.6	Very low	129 Å²	129	130.2 Å²	130.2	68%	0.675	74%	0.737	S	S	*	*			cis	-164.4	156.9	-11.2	-110	-179.3	0	0	0	112
805	C	29.2	Very low	35.4	Very low	114 Å²	114	133 Å²	133	77%	0.77	74%	0.741	S	S	*	*			trans	62.6	155.7	149.8	-75.4	0	0	0	0	122.3
806	A	32.4	Very low	35.4	Very low	73 Å²	73	132 Å²	132	60%	0.603	74%	0.741	S	S	*	*			cis	-169.8	144.3	-18.1	0	0	0	0	0	114.6
807	N	31.9	Very low	35	Very low	141 Å²	141	128.3 Å²	128.3	75%	0.754	74%	0.737	S	S	*	*			trans	54.4	111.3	139.1	-53.4	-8.5	0	0	0	123.2
808	N	34.8	Very low	34.4	Very low	156 Å²	156	130.6 Å²	130.6	83%	0.834	75%	0.749	S	S	*	*				165	155.6	98.9	-86.8	-39.5	0	0	0	115.7
809	T	32.7	Very low	34.2	Very low	130 Å²	130	130.5 Å²	130.5	80%	0.798	74%	0.743	S	S	*	*			trans	-120.7	-166.9	-179.3	56.2	0	0	0	0	109.5
810	P	40	Very low	34	Very low	92 Å²	92	136.8 Å²	136.8	60%	0.597	75%	0.752	S	S	*	*			cis	-145.7	-154.2	8.7	41.9	-17.3	0	0	0	116.7
811	Y	34.7	Very low	33.8	Very low	216 Å²	216	138.5 Å²	138.5	85%	0.847	75%	0.75	S	S	*	*			trans	80.5	113.5	178.6	-54	-73	0	0	0	115.6
812	R	29.7	Very low	33.9	Very low	197 Å²	197	135.8 Å²	135.8	74%	0.743	75%	0.747	S	S	*	*			cis	91.2	106.8	21	-162.6	-172	-171.9	-152.5	2	116.6	E814	R812-E814 HydrophobicContact CG-CG 3.69Å; R812-E814 IonicContact CZ-OE1 2.63Å; R812-E814 IonicContact NE-OE1 3.49Å; R812-E814 PolarHBondContact NE-OE1 3.48Å; R812-E814 IonicContact NH2-OE1 2.79Å; R812-E814 PolarHBondContact NH2-OE1 3.27Å
813	T	34	Very low	33.3	Very low	132 Å²	132	143.5 Å²	143.5	81%	0.81	76%	0.763	S	S	*	*			trans	-175	100.5	137.7	-71.9	0	0	0	0	105.9
814	E	32.7	Very low	33.3	Very low	105 Å²	105	138.8 Å²	138.8	49%	0.491	76%	0.757	S	S	.	*				70.3	106.4	64.5	-60.7	-82.3	-156.8	0	0	114	R812	R812-E814 HydrophobicContact CG-CG 3.69Å; R812-E814 IonicContact CZ-OE1 2.63Å; R812-E814 IonicContact NE-OE1 3.49Å; R812-E814 PolarHBondContact NE-OE1 3.48Å; R812-E814 IonicContact NH2-OE1 2.79Å; R812-E814 PolarHBondContact NH2-OE1 3.27Å
815	M	35.1	Very low	33.4	Very low	157 Å²	157	143.3 Å²	143.3	77%	0.773	77%	0.772	S	S	*	*				-176.5	120.8	126.3	-86.1	-37.9	133.3	0	0	111.4
816	T	37.1	Very low	33.9	Very low	131 Å²	131	141.1 Å²	141.1	80%	0.804	76%	0.761	S	S	*	*			trans	45.6	127.8	152.1	59.1	0	0	0	0	119.9
817	G	30.1	Very low	34.2	Very low	68 Å²	68	143.9 Å²	143.9	70%	0.701	77%	0.765	S	S	*	*			cis	92.5	134.7	26.1	0	0	0	0	0	110.7
818	T	35.1	Very low	34.3	Very low	145 Å²	145	146 Å²	146	89%	0.89	77%	0.768	S	S	*	*			cis	-152.4	164.6	22.7	49.2	0	0	0	0	113.2
819	T	27.3	Very low	34.5	Very low	124 Å²	124	142.2 Å²	142.2	76%	0.761	76%	0.759	S	S	*	*			trans	-87.3	146	173.6	-62.2	0	0	0	0	111.3
820	F	31.7	Very low	34.9	Very low	201 Å²	201	139.5 Å²	139.5	88%	0.882	74%	0.742	S	S	*	*			trans	-145.3	144.4	156.4	-126.2	-84	0	0	0	113.6
821	Q	31.4	Very low	34.8	Very low	177 Å²	177	140.9 Å²	140.9	83%	0.827	74%	0.744	S	S	*	*			trans	-95.5	135.2	-178.1	-60.1	173.1	1.3	0	0	111.5
822	S	38.4	Very low	35	Very low	106 Å²	106	139.5 Å²	139.5	74%	0.741	74%	0.743	S	S	*	*			trans	-149.8	136.8	159.4	60.2	0	0	0	0	108.5
823	R	31	Very low	35.6	Very low	260 Å²	260	139.8 Å²	139.8	98%	0.981	74%	0.743	S	S	*	*				53.9	72.2	54.7	-78.7	-172.2	162.3	173.9	-4.6	112.6
824	G	36.1	Very low	35.9	Very low	60 Å²	60	137.5 Å²	137.5	62%	0.619	73%	0.733	S	S	*	*			trans	-140.5	15.1	-176.2	0	0	0	0	0	117.3	A826	G824-A826 PolarHBondContact O-N 3.43Å
825	K	37.1	Very low	36.2	Very low	225 Å²	225	139.2 Å²	139.2	98%	0.978	74%	0.744	S	S	*	*	S	Bend	trans	-74	53.6	174.3	-75.2	-166.5	176.4	-173.3	0	112.9
826	A	39.8	Very low	36.5	Very low	67 Å²	67	140.4 Å²	140.4	55%	0.554	75%	0.748	S	S	*	*			trans	-179.2	93.2	163	0	0	0	0	0	112	G824	G824-A826 PolarHBondContact O-N 3.43Å
827	L	36.9	Very low	36.3	Very low	132 Å²	132	142.7 Å²	142.7	69%	0.691	75%	0.75	S	S	*	*	S	Bend	trans	-137.1	-45.6	163.4	-89.5	174.1	0	0	0	112.5	A829 T830	L827-A829 VanDerWaalsContact C-N 3.28Å; L827-A829 PolarHBondContact O-N 3.25Å; L827-T830 PolarHBondContact O-N 3.1Å
828	F	34.3	Very low	36.5	Very low	185 Å²	185	143.3 Å²	143.3	81%	0.811	76%	0.755	S	S	*	*	H	α-helix	trans	-71.9	-17.5	177.6	-69.5	-76.1	0	0	0	114.6	T830	F828-T830 VanDerWaalsContact C-N 3.34Å
829	A	38.7	Very low	36.6	Very low	77 Å²	77	145.4 Å²	145.4	64%	0.636	75%	0.752	S	S	*	*	H	α-helix	trans	-77.5	-17.7	172.3	0	0	0	0	0	113.5	L827	L827-A829 VanDerWaalsContact C-N 3.28Å; L827-A829 PolarHBondContact O-N 3.25Å
830	T	42.9	Very low	36.9	Very low	73 Å²	73	145.7 Å²	145.7	45%	0.448	75%	0.754	S	S	.	*	H	α-helix	trans	-88.6	-33.4	-175.3	-35.9	0	0	0	0	111.9	L827 F828 F832 R833 S834	L827-T830 PolarHBondContact O-N 3.1Å; F828-T830 VanDerWaalsContact C-N 3.34Å; T830-F832 PolarHBondContact O-N 3.46Å; T830-R833 PolarHBondContact O-N 2.66Å; T830-S834 PolarHBondContact O-OG 2.94Å
831	L	37.4	Very low	37.2	Very low	121 Å²	121	142.5 Å²	142.5	63%	0.634	75%	0.751	S	S	*	*	H	α-helix	trans	-65.7	-32.4	-177	-95.2	160.7	0	0	0	114
832	F	38.7	Very low	37.4	Very low	187 Å²	187	142.6 Å²	142.6	82%	0.82	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	-8.5	175.1	-84.5	-83.4	0	0	0	114.5	T830	T830-F832 PolarHBondContact O-N 3.46Å
833	R	42.2	Very low	37.2	Very low	202 Å²	202	143 Å²	143	76%	0.762	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-6.4	177.9	-167.4	165.6	179.6	160.4	1.6	113.6	T830	T830-R833 PolarHBondContact O-N 2.66Å
834	S	39.5	Very low	37.4	Very low	85 Å²	85	136.1 Å²	136.1	59%	0.594	74%	0.737	S	S	*	*	S	Bend	trans	-101.2	13.7	-168.4	-55.1	0	0	0	0	114.6	T830	T830-S834 PolarHBondContact O-OG 2.94Å
835	I	40.3	Very low	37.4	Very low	140 Å²	140	139.5 Å²	139.5	72%	0.718	74%	0.741	S	S	*	*	S	Bend	trans	-112.5	-16	-172.7	-67.1	177.6	0	0	0	113.3
836	E	40	Very low	37.5	Very low	183 Å²	183	135 Å²	135	86%	0.855	73%	0.727	S	S	*	*	S	Bend	trans	-108.3	-0.1	-174.3	-64.8	-168.8	130.3	0	0	115.7
837	Q	34.3	Very low	37.3	Very low	179 Å²	179	137.4 Å²	137.4	84%	0.836	74%	0.735	S	S	*	*			trans	-129.2	93.4	-178	-64.5	-170	-11.8	0	0	111.2
838	G	33.3	Very low	37.3	Very low	80 Å²	80	138.2 Å²	138.2	83%	0.825	74%	0.737	S	S	*	*			trans	-170.8	37.8	-170.9	0	0	0	0	0	116.5
839	K	36.7	Very low	37.4	Very low	190 Å²	190	136.1 Å²	136.1	83%	0.826	73%	0.729	S	S	*	*			trans	-141.7	129.2	171	-88.4	-177.6	176	173.6	0	111.2
840	T	35.6	Very low	37.3	Very low	130 Å²	130	137.8 Å²	137.8	80%	0.798	73%	0.728	S	S	*	*			trans	60.1	139	160.8	58.3	0	0	0	0	117.4
841	T	36.6	Very low	37	Very low	133 Å²	133	140.4 Å²	140.4	82%	0.816	74%	0.739	S	S	*	*			cis	-155.9	168.6	-8.5	5	0	0	0	0	110.2
842	E	36.3	Very low	37	Very low	179 Å²	179	140.8 Å²	140.8	84%	0.836	74%	0.742	S	S	*	*			trans	-58	145.9	-179.2	-74.5	171.1	-171.2	0	0	117.6
843	T	33.4	Very low	36.8	Very low	114 Å²	114	138.6 Å²	138.6	70%	0.699	74%	0.739	S	S	*	*			trans	80.1	96.3	130.5	-60.3	0	0	0	0	122
844	T	35.1	Very low	36.3	Very low	116 Å²	116	134.1 Å²	134.1	71%	0.712	74%	0.739	S	S	*	*			trans	65.6	162.8	134.6	72.7	0	0	0	0	123.3
845	D	37.3	Very low	36	Very low	132 Å²	132	136.9 Å²	136.9	71%	0.706	75%	0.746	S	S	*	*			trans	85.3	135.2	167.6	-65.5	29.4	0	0	0	117.2
846	N	37.6	Very low	35.8	Very low	130 Å²	130	136.9 Å²	136.9	70%	0.695	75%	0.746	S	S	*	*			cis	-166.5	179.8	-19.8	-113.6	-41	0	0	0	109.4
847	V	36.8	Very low	35.5	Very low	117 Å²	117	134.2 Å²	134.2	71%	0.709	73%	0.733	S	S	*	*			trans	80.7	104.8	160.6	-170.2	0	0	0	0	119.8
848	M	37.3	Very low	35.5	Very low	150 Å²	150	133.4 Å²	133.4	74%	0.739	73%	0.727	S	S	*	*				48.1	150.4	123.7	-56.4	171.2	114	0	0	121.5
849	E	35.7	Very low	35.6	Very low	140 Å²	140	135.8 Å²	135.8	65%	0.654	73%	0.725	S	S	*	*			cis	-159.7	142.5	-3.9	-120.7	-172.9	137.9	0	0	114.2
850	N	37.2	Very low	35.8	Very low	113 Å²	113	135.3 Å²	135.3	60%	0.604	73%	0.726	S	S	*	*				37.4	115.1	129.3	-67.2	-19.3	0	0	0	123.1
851	N	36.4	Very low	36.2	Very low	128 Å²	128	134.4 Å²	134.4	68%	0.684	72%	0.722	S	S	*	*				94.8	136	112.7	-69.7	-12.8	0	0	0	124.8
852	N	36.5	Very low	36.1	Very low	129 Å²	129	132.2 Å²	132.2	69%	0.69	72%	0.718	S	S	*	*			trans	84.1	100.7	138.8	-66.5	-11.2	0	0	0	122.9
853	N	35.1	Very low	36.3	Very low	140 Å²	140	130 Å²	130	75%	0.749	71%	0.712	S	S	*	*				52	112.8	115	-63.1	-9.4	0	0	0	121.8
854	S	31.7	Very low	36.6	Very low	109 Å²	109	132.7 Å²	132.7	76%	0.762	71%	0.714	S	S	*	*				88.4	152	122.6	77.6	0	0	0	0	122
855	L	32.6	Very low	36.8	Very low	143 Å²	143	135 Å²	135	75%	0.749	72%	0.72	S	S	*	*			trans	92.2	114.6	138.6	-154.3	70	0	0	0	119.8
856	I	35.5	Very low	36.9	Very low	140 Å²	140	132.3 Å²	132.3	72%	0.718	71%	0.712	S	S	*	*			trans	69.1	150	146.4	-76.4	176.1	0	0	0	117.7
857	E	33.9	Very low	37.2	Very low	126 Å²	126	133.9 Å²	133.9	59%	0.589	71%	0.714	S	S	*	*			cis	-175.9	162.5	-22.8	-161.7	-161.2	175.1	0	0	109.5
858	K	34.4	Very low	37.3	Very low	162 Å²	162	133.9 Å²	133.9	70%	0.704	71%	0.711	S	S	*	*			trans	73.7	160.6	151.9	-89.2	167	-173.4	130	0	122.4
859	V	36.9	Very low	37.5	Very low	130 Å²	130	133.4 Å²	133.4	79%	0.788	71%	0.71	S	S	*	*			trans	81.4	83.6	163.8	-155.2	0	0	0	0	120.6
860	Q	40.5	Very low	37.6	Very low	180 Å²	180	131.5 Å²	131.5	84%	0.841	71%	0.707	S	S	*	*				31.4	154.4	115.1	-67.1	-86.7	-3.3	0	0	122.9
861	P	42.4	Very low	37.7	Very low	112 Å²	112	132.9 Å²	132.9	73%	0.727	72%	0.715	S	S	*	*			trans	-129.6	-164	-161.2	45.3	-28.4	0	0	0	116.2
862	A	36	Very low	37.7	Very low	87 Å²	87	134.9 Å²	134.9	72%	0.719	72%	0.72	S	S	*	*			trans	106.1	128.1	147.8	0	0	0	0	0	120.2
863	D	39.1	Very low	37.7	Very low	133 Å²	133	135.8 Å²	135.8	71%	0.711	72%	0.723	S	S	*	*			trans	160.2	154.4	142	-92.8	-20.4	0	0	0	108.3
864	K	40.8	Very low	37.7	Very low	170 Å²	170	134.8 Å²	134.8	74%	0.739	72%	0.722	S	S	*	*			cis	166.7	-175.8	-22.9	-104.7	-167	-160	100.7	0	104.7
865	I	38.8	Very low	37.9	Very low	164 Å²	164	136.3 Å²	136.3	84%	0.841	72%	0.722	S	S	*	*			trans	77.8	132.9	166	-55.7	170.2	0	0	0	114.8
866	S	40.6	Very low	37.8	Very low	76 Å²	76	138 Å²	138	53%	0.531	73%	0.726	S	S	.	*			cis	174.9	174	-34.4	44.6	0	0	0	0	110.1
867	H	42.4	Very low	37.8	Very low	162 Å²	162	136.4 Å²	136.4	75%	0.75	73%	0.727	S	S	*	*			trans	74	146.7	159.7	-61.4	-53.6	0	0	0	117.9
868	D	39.8	Very low	37.7	Very low	118 Å²	118	137.1 Å²	137.1	63%	0.631	74%	0.735	S	S	*	*			cis	-170.1	171.9	-22.6	-129	-43.5	0	0	0	112.8
869	I	41.4	Very low	37.6	Very low	140 Å²	140	135.4 Å²	135.4	72%	0.718	74%	0.738	S	S	*	*			trans	63.5	146.8	148.8	-68.6	162.1	0	0	0	120
870	T	38.2	Very low	37.5	Very low	99 Å²	99	140.3 Å²	140.3	61%	0.607	74%	0.743	S	S	*	*			cis	-169.3	158.3	-38.5	49.8	0	0	0	0	109.3
871	N	39	Very low	37.5	Very low	143 Å²	143	137.7 Å²	137.7	77%	0.765	74%	0.738	S	S	*	*			trans	65	160.8	151.5	-62	-4.5	0	0	0	118.8
872	E	35.5	Very low	37.2	Very low	170 Å²	170	140.8 Å²	140.8	79%	0.794	75%	0.747	S	S	*	*			cis	-168.8	-168.3	-38	-148.7	177.7	-148.6	0	0	106.2
873	I	36.3	Very low	37.2	Very low	148 Å²	148	139.5 Å²	139.5	76%	0.759	74%	0.743	S	S	*	*			trans	70.8	103.2	172.6	-49.7	176.4	0	0	0	114
874	V	36.1	Very low	37.2	Very low	119 Å²	119	139.7 Å²	139.7	72%	0.721	75%	0.751	S	S	*	*				97	134.5	56.7	164.5	0	0	0	0	113.7
875	N	35	Very low	36.8	Very low	141 Å²	141	136.1 Å²	136.1	75%	0.754	75%	0.753	S	S	*	*			trans	73.9	112.9	170.8	-68.1	-4.1	0	0	0	121.3
876	E	31.2	Very low	36.7	Very low	178 Å²	178	136.5 Å²	136.5	83%	0.832	76%	0.756	S	S	*	*				38.8	136	129.6	-57	-171.8	151.9	0	0	123.5
877	S	34.6	Very low	36.4	Very low	107 Å²	107	138.2 Å²	138.2	75%	0.748	77%	0.765	S	S	*	*			trans	90.3	138.2	155.5	84	0	0	0	0	120.7
878	N	32.6	Very low	36.1	Very low	141 Å²	141	140.3 Å²	140.3	75%	0.754	77%	0.772	S	S	*	*			trans	66	86.6	149.5	-58.5	-30.5	0	0	0	122.3
879	T	33.1	Very low	35.9	Very low	126 Å²	126	141.9 Å²	141.9	77%	0.773	78%	0.779	S	S	*	*				39.4	108	120	49.4	0	0	0	0	121.6
880	R	34.3	Very low	35.5	Very low	233 Å²	233	138.4 Å²	138.4	88%	0.879	78%	0.778	S	S	*	*			trans	-158.3	113.2	147.5	-169.6	169.2	-67.7	-155	-0.4	108.5
881	V	40.1	Very low	35.3	Very low	124 Å²	124	141.3 Å²	141.3	75%	0.752	79%	0.788	S	S	*	*				76.3	97.5	50.8	-174.7	0	0	0	0	114
882	I	36.2	Very low	35.1	Very low	177 Å²	177	141.6 Å²	141.6	91%	0.908	79%	0.79	S	S	*	*			trans	-138.1	124	153.5	-52.8	173.9	0	0	0	102
883	G	37.1	Very low	35.1	Very low	61 Å²	61	139.3 Å²	139.3	63%	0.629	79%	0.787	S	S	*	*			cis	132.7	148.3	24.9	0	0	0	0	0	106.1
884	P	38.2	Very low	35.1	Very low	136 Å²	136	139.1 Å²	139.1	88%	0.883	79%	0.787	S	S	*	*			cis	-101.2	178.1	8.8	40.1	-34.7	0	0	0	113.8
885	A	32.3	Very low	34.9	Very low	96 Å²	96	138.6 Å²	138.6	79%	0.793	78%	0.784	S	S	*	*			trans	-124.6	152.6	175.4	0	0	0	0	0	111.7
886	L	37	Very low	34.8	Very low	171 Å²	171	138 Å²	138	90%	0.895	78%	0.781	S	S	*	*			trans	-126.6	154.5	166.7	-83	170.9	0	0	0	109.6
887	P	34.7	Very low	35.3	Very low	112 Å²	112	138.8 Å²	138.8	73%	0.727	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-83.8	148.5	-150	31.1	-36.7	0	0	0	114.8
888	K	35.9	Very low	35.4	Very low	206 Å²	206	140.1 Å²	140.1	90%	0.896	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-87.8	122.7	159.4	-67.3	-176.7	177.9	-177.4	0	109.3
889	I	35.4	Very low	35.9	Very low	151 Å²	151	141.4 Å²	141.4	77%	0.774	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-91.6	137.4	152.4	-110.2	63.4	0	0	0	107
890	G	31.8	Very low	36.5	Very low	68 Å²	68	144.8 Å²	144.8	70%	0.701	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-101.6	153.7	175.3	0	0	0	0	0	111.7
891	I	35.8	Very low	37.9	Very low	159 Å²	159	139.1 Å²	139.1	82%	0.815	79%	0.792	S	S	*	*			trans	-140.1	121.2	162.7	-50.8	179.1	0	0	0	106.3
892	D	32.9	Very low	39.1	Very low	149 Å²	149	139.2 Å²	139.2	80%	0.797	80%	0.795	S	S	*	*			trans	-86	-151.9	176.9	-63.5	-64.1	0	0	0	111.3
893	V	35.4	Very low	40.6	Very low	122 Å²	122	137.9 Å²	137.9	74%	0.739	79%	0.787	S	S	*	*			trans	82.6	97.1	-179.7	-167.2	0	0	0	0	111.4
894	L	36.3	Very low	42	Very low	144 Å²	144	138.7 Å²	138.7	75%	0.754	78%	0.777	S	S	*	*				56.3	137.2	83.1	-76.7	88.5	0	0	0	112.9
895	T	32.9	Very low	43.5	Very low	108 Å²	108	138 Å²	138	66%	0.663	77%	0.766	S	S	*	*			cis	-158.7	166.6	-7.4	8.2	0	0	0	0	106.7
896	D	33.7	Very low	44.5	Very low	130 Å²	130	140.7 Å²	140.7	70%	0.695	76%	0.759	S	S	*	*			trans	34.8	126.1	155.7	-53.1	-17.2	0	0	0	120.1
897	H	40.1	Very low	46	Very low	194 Å²	194	139.5 Å²	139.5	90%	0.898	75%	0.747	S	S	*	*				-167.4	157.6	112.1	-83.1	-24.7	0	0	0	110
898	T	37.4	Very low	47.6	Very low	135 Å²	135	136.6 Å²	136.6	83%	0.828	73%	0.729	S	S	*	*			trans	-84.8	122.8	-170.6	53.5	0	0	0	0	113
899	D	43.8	Very low	49.1	Very low	167 Å²	167	131.7 Å²	131.7	89%	0.893	71%	0.712	S	S	*	*			trans	-139.2	110	153.9	-94.5	-45.1	0	0	0	108.8
900	K	46.1	Very low	50.4	Low	198 Å²	198	133 Å²	133	86%	0.861	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-69.1	142.1	169.6	-90.4	-179.5	174	176.9	0	108.5
901	P	61.8	Low	51.5	Low	113 Å²	113	132.7 Å²	132.7	73%	0.734	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-57.6	139.8	168.8	26.8	-34	0	0	0	109.1	M903	P901-M903 PolarHBondContact O-N 3.29Å; P901-M903 VanDerWaalsContact O-N 3.16Å
902	P	66.8	Low	51.8	Low	126 Å²	126	130.7 Å²	130.7	82%	0.818	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-60	123.4	179.6	24.8	-33.2	0	0	0	109.2	D904	P902-D904 PolarHBondContact O-N 3.37Å
903	M	68.1	Low	52.5	Low	149 Å²	149	132 Å²	132	73%	0.734	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-59.9	123.5	177.6	-176.6	162.8	63.7	0	0	109	P901 L905	P901-M903 PolarHBondContact O-N 3.29Å; P901-M903 VanDerWaalsContact O-N 3.16Å; M903-L905 PolarHBondContact O-N 3.24Å
904	D	65.2	Low	53.3	Low	79 Å²	79	134.5 Å²	134.5	42%	0.422	71%	0.714	S	S	.	*	P	Polyproline II helix	trans	-58	120.4	178.8	177	4.8	0	0	0	109.5	P902 F906 K907 S908	P902-D904 PolarHBondContact O-N 3.37Å; D904-F906 PolarHBondContact O-N 2.76Å; D904-F906 PolarHBondContact OD1-N 3.25Å; D904-K907 HydrophobicContact CB-CB 4.17Å; D904-K907 HydrophobicContact CB-CD 4.38Å; D904-K907 HydrophobicContact CB-CG 4.05Å; D904-K907 WeakPolarHBondContact O-CA 3.27Å; D904-K907 WeakPolarHBondContact O-CB 3.3Å; D904-K907 PolarHBondContact O-N 2.93Å; D904-S908 PolarHBondContact O-N 3.04Å; D904-S908 VanDerWaalsContact O-N 3.09Å
905	L	69.8	Low	53.8	Low	122 Å²	122	136.6 Å²	136.6	64%	0.639	72%	0.72	S	S	*	*	H	α-helix	trans	-60.3	-33.3	-175.4	-158	76.1	0	0	0	111	M903 K907 S908 I909	M903-L905 PolarHBondContact O-N 3.24Å; L905-K907 VanDerWaalsContact C-N 3.31Å; L905-K907 PolarHBondContact O-N 3.2Å; L905-S908 WeakPolarHBondContact CA-OG 3.35Å; L905-S908 PolarHBondContact O-N 2.91Å; L905-S908 PolarHBondContact O-OG 3.48Å; L905-I909 HydrophobicContact CG-CD1 4.29Å; L905-I909 WeakPolarHBondContact O-CD1 3.41Å; L905-I909 VanDerWaalsContact O-CG1 3.25Å; L905-I909 WeakPolarHBondContact O-CG1 3.42Å; L905-I909 PolarHBondContact O-N 3.42Å; L905-I909 VanDerWaalsContact O-N 3.15Å
906	F	53.1	Low	54	Low	151 Å²	151	140.2 Å²	140.2	66%	0.662	73%	0.734	S	S	*	*	H	α-helix	trans	-70.2	-26.5	175.6	-67.1	-81	0	0	0	112.6	D904 F910	D904-F906 PolarHBondContact O-N 2.76Å; D904-F906 PolarHBondContact OD1-N 3.25Å; F906-F910 WeakPolarHBondContact O-CD2 3.45Å
907	K	68.2	Low	54.3	Low	146 Å²	146	139.6 Å²	139.6	64%	0.635	74%	0.74	S	S	*	*	H	α-helix	trans	-74.4	-40.6	170.1	-71.5	-167.4	173.6	-164.6	0	111.9	D904 L905 I909 F910 A911	D904-K907 HydrophobicContact CB-CB 4.17Å; D904-K907 HydrophobicContact CB-CD 4.38Å; D904-K907 HydrophobicContact CB-CG 4.05Å; D904-K907 WeakPolarHBondContact O-CA 3.27Å; D904-K907 WeakPolarHBondContact O-CB 3.3Å; D904-K907 PolarHBondContact O-N 2.93Å; L905-K907 VanDerWaalsContact C-N 3.31Å; L905-K907 PolarHBondContact O-N 3.2Å; K907-I909 PolarHBondContact O-N 2.67Å; K907-F910 PolarHBondContact O-N 3.09Å; K907-A911 WeakPolarHBondContact O-CB 3.39Å; K907-A911 PolarHBondContact O-N 3.29Å; K907-A911 VanDerWaalsContact O-N 3.1Å
908	S	69.1	Low	54.1	Low	51 Å²	51	135.8 Å²	135.8	36%	0.357	74%	0.735	S	S	.	*	H	α-helix	trans	-70.2	-11.9	177	52.6	0	0	0	0	114.9	D904 L905	D904-S908 PolarHBondContact O-N 3.04Å; D904-S908 VanDerWaalsContact O-N 3.09Å; L905-S908 WeakPolarHBondContact CA-OG 3.35Å; L905-S908 PolarHBondContact O-N 2.91Å; L905-S908 PolarHBondContact O-OG 3.48Å
909	I	66.4	Low	54.2	Low	103 Å²	103	134.7 Å²	134.7	53%	0.528	73%	0.733	S	S	.	*	H	α-helix	trans	-88.8	-19.3	175.1	-71.1	163.5	0	0	0	112	L905 K907	L905-I909 HydrophobicContact CG-CD1 4.29Å; L905-I909 WeakPolarHBondContact O-CD1 3.41Å; L905-I909 VanDerWaalsContact O-CG1 3.25Å; L905-I909 WeakPolarHBondContact O-CG1 3.42Å; L905-I909 PolarHBondContact O-N 3.42Å; L905-I909 VanDerWaalsContact O-N 3.15Å; K907-I909 PolarHBondContact O-N 2.67Å
910	F	64.2	Low	53.9	Low	179 Å²	179	131.4 Å²	131.4	79%	0.785	72%	0.723	S	S	*	*	S	Bend	trans	-126.9	17.4	-175.8	-65.2	-66.7	0	0	0	113.8	F906 K907	F906-F910 WeakPolarHBondContact O-CD2 3.45Å; K907-F910 PolarHBondContact O-N 3.09Å
911	A	54.5	Low	53.7	Low	62 Å²	62	129.8 Å²	129.8	51%	0.512	72%	0.723	S	S	.	*	S	Bend	trans	-122.8	116.7	175.6	0	0	0	0	0	110.2	K907	K907-A911 WeakPolarHBondContact O-CB 3.39Å; K907-A911 PolarHBondContact O-N 3.29Å; K907-A911 VanDerWaalsContact O-N 3.1Å
912	S	41.6	Very low	52.7	Low	117 Å²	117	128.3 Å²	128.3	82%	0.818	72%	0.716	S	S	*	*			trans	62.8	96.7	171.2	-57.5	0	0	0	0	116.6
913	D	47	Very low	51.5	Low	175 Å²	175	127.1 Å²	127.1	94%	0.936	70%	0.702	S	S	*	*	S	Bend	trans	-123.2	17.4	154.5	-147.3	19.1	0	0	0	110.9
914	E	52.6	Low	50.2	Low	175 Å²	175	127 Å²	127	82%	0.818	71%	0.705	S	S	*	*	S	Bend	trans	-125.5	153.8	169.7	-67.4	179.4	162.9	0	0	107.4
915	E	46.9	Very low	49.1	Very low	189 Å²	189	130.5 Å²	130.5	88%	0.883	72%	0.723	S	S	*	*			trans	62.6	75.1	-168.2	-65.2	-172.2	-137.7	0	0	116.7
916	L	37.9	Very low	47.8	Very low	183 Å²	183	130.1 Å²	130.1	96%	0.958	73%	0.726	S	S	*	*			trans	-159.2	88.7	133	-89.5	-158	0	0	0	111.2
917	S	39.9	Very low	47.4	Very low	118 Å²	118	130 Å²	130	83%	0.825	73%	0.732	S	S	*	*			trans	-117.3	119.4	169.4	-85.8	0	0	0	0	112.2
918	S	36.3	Very low	46.1	Very low	113 Å²	113	129 Å²	129	79%	0.79	73%	0.734	S	S	*	*			trans	73.3	136.9	162.2	75.3	0	0	0	0	120.4
919	S	37.8	Very low	44.7	Very low	113 Å²	113	132.2 Å²	132.2	79%	0.79	75%	0.747	S	S	*	*			trans	68.9	152.5	165.3	74.7	0	0	0	0	119.7
920	S	39.4	Very low	43.3	Very low	97 Å²	97	133.2 Å²	133.2	68%	0.678	75%	0.753	S	S	*	*				175.1	150.3	-62.3	49.8	0	0	0	0	110.8
921	L	41.3	Very low	42	Very low	164 Å²	164	130.6 Å²	130.6	86%	0.859	75%	0.747	S	S	*	*			trans	69.9	155.1	172.3	-54.6	175.8	0	0	0	115.7
922	S	41.5	Very low	41.2	Very low	83 Å²	83	133.7 Å²	133.7	58%	0.58	76%	0.756	S	S	*	*			cis	-162.6	157.3	-30.4	55.4	0	0	0	0	110.2
923	D	40.9	Very low	41.1	Very low	100 Å²	100	135 Å²	135	54%	0.535	75%	0.753	S	S	.	*				174.7	166.4	119.2	-88.3	3.3	0	0	0	111.3	K938	D923-K938 IonicContact OD1-NZ 3.69Å; D923-K938 WeakPolarHBondContact OD2-CE 3.27Å; D923-K938 IonicContact OD2-NZ 2.67Å; D923-K938 PolarHBondContact OD2-NZ 3.22Å
924	N	40.4	Very low	40.7	Very low	148 Å²	148	134.9 Å²	134.9	79%	0.791	75%	0.745	S	S	*	*			trans	-125.4	170.1	-165.1	-52.6	-88.4	0	0	0	111.2
925	D	41.5	Very low	40.3	Very low	151 Å²	151	131.6 Å²	131.6	81%	0.807	73%	0.732	S	S	*	*				-166.8	145.2	126.1	-108.5	-21.7	0	0	0	114.1
926	V	43.8	Very low	40.2	Very low	115 Å²	115	131.2 Å²	131.2	70%	0.697	72%	0.723	S	S	*	*			trans	52.8	121.6	147.1	-178.7	0	0	0	0	117.6
927	D	44.3	Very low	40.4	Very low	147 Å²	147	129.4 Å²	129.4	79%	0.786	71%	0.709	S	S	*	*				-157.7	142.8	50.6	-139.9	-22.2	0	0	0	116
928	N	40	Very low	40.5	Very low	125 Å²	125	129.6 Å²	129.6	67%	0.668	70%	0.696	S	S	*	*			trans	65	142.7	150.6	-155.9	37.8	0	0	0	124.7
929	D	40.6	Very low	40.7	Very low	119 Å²	119	129.8 Å²	129.8	64%	0.636	69%	0.688	S	S	*	*			trans	51	117.4	167.6	-75.5	-50.6	0	0	0	118.9
930	N	37.9	Very low	40.8	Very low	124 Å²	124	131.3 Å²	131.3	66%	0.663	69%	0.687	S	S	*	*			cis	-164.8	126.2	26.2	-147.2	-72.4	0	0	0	113.5
931	N	36.7	Very low	40.9	Very low	124 Å²	124	133.2 Å²	133.2	66%	0.663	69%	0.689	S	S	*	*			trans	52.3	115.8	155.5	-82.2	-67.1	0	0	0	123.7
932	N	36.1	Very low	40.5	Very low	128 Å²	128	131.1 Å²	131.1	68%	0.684	68%	0.683	S	S	*	*			trans	65.5	108.1	140.6	-50.9	-37.5	0	0	0	119.2
933	N	40	Very low	40.2	Very low	144 Å²	144	133.5 Å²	133.5	77%	0.77	69%	0.688	S	S	*	*				-162.9	126.7	55.3	-80.6	-65.4	0	0	0	113.8
934	K	39	Very low	40.1	Very low	173 Å²	173	135.1 Å²	135.1	75%	0.752	69%	0.692	S	S	*	*			trans	43	111.2	140.4	-59.9	-162.8	173.3	-173.1	0	120.1
935	D	43.9	Very low	39.9	Very low	105 Å²	105	137.2 Å²	137.2	56%	0.561	69%	0.689	S	S	*	*				104.1	160.6	79.1	-73	-27.3	0	0	0	109.7
936	R	44.4	Very low	39.6	Very low	182 Å²	182	136.5 Å²	136.5	69%	0.687	69%	0.685	S	S	*	*			cis	-175.5	169.8	-19.1	-90.1	175.4	-156.4	-75.1	-23.1	106.1
937	E	42.5	Very low	39.2	Very low	144 Å²	144	136.4 Å²	136.4	67%	0.673	69%	0.69	S	S	*	*			cis	-176.7	169.8	-16.9	-96.4	160.5	-179.5	0	0	106.5
938	K	42.2	Very low	38.9	Very low	123 Å²	123	139 Å²	139	54%	0.535	69%	0.694	S	S	.	*			cis	-167.7	176.3	-48.2	-147.4	-179	171.3	-83.3	0	109.2	D923	D923-K938 IonicContact OD1-NZ 3.69Å; D923-K938 WeakPolarHBondContact OD2-CE 3.27Å; D923-K938 IonicContact OD2-NZ 2.67Å; D923-K938 PolarHBondContact OD2-NZ 3.22Å
939	D	40.8	Very low	39	Very low	117 Å²	117	137.8 Å²	137.8	63%	0.626	69%	0.693	S	S	*	*			trans	71.7	113.5	148.2	-63.9	-23	0	0	0	124.1
940	D	39.3	Very low	38.8	Very low	145 Å²	145	139.2 Å²	139.2	78%	0.775	70%	0.701	S	S	*	*				84.8	152.2	113.9	-129.8	-1	0	0	0	126
941	L	41	Very low	38.7	Very low	136 Å²	136	138.5 Å²	138.5	71%	0.712	71%	0.705	S	S	*	*			trans	61.3	106.8	157	-62.1	170	0	0	0	125.2
942	T	34	Very low	38.8	Very low	120 Å²	120	140.4 Å²	140.4	74%	0.736	71%	0.714	S	S	*	*				52.9	152.1	117.3	-23.8	0	0	0	0	124
943	I	35	Very low	38.6	Very low	134 Å²	134	142.7 Å²	142.7	69%	0.687	72%	0.72	S	S	*	*			trans	99.2	100.9	154.8	-61.5	-172.5	0	0	0	119.7
944	Q	39	Very low	38.8	Very low	134 Å²	134	141 Å²	141	63%	0.626	72%	0.717	S	S	*	*			trans	62	127.2	132.3	-60.1	177.2	41.5	0	0	124.6
945	R	36.7	Very low	38.8	Very low	192 Å²	192	138.5 Å²	138.5	73%	0.725	72%	0.721	S	S	*	*				73.6	113.8	126.9	-69.3	177.1	174.5	131.3	-1.5	122.6
946	D	34.3	Very low	38.4	Very low	136 Å²	136	140.8 Å²	140.8	73%	0.727	73%	0.734	S	S	*	*				76.5	122.5	123	-51.8	-26.9	0	0	0	123.6
947	S	36.4	Very low	38.4	Very low	113 Å²	113	140 Å²	140	79%	0.79	74%	0.743	S	S	*	*			trans	86.9	112.2	142.8	71.9	0	0	0	0	123.1
948	K	36.2	Very low	38	Very low	202 Å²	202	140.5 Å²	140.5	88%	0.878	75%	0.745	S	S	*	*				35.4	158.1	121.1	-75.3	-173.5	176.1	179.3	0	121.7
949	P	43.7	Very low	38	Very low	99 Å²	99	140.6 Å²	140.6	64%	0.643	76%	0.759	S	S	*	*			cis	-145.7	-164	-31.5	41.1	-20.9	0	0	0	114.8
950	N	36.4	Very low	37.8	Very low	149 Å²	149	142.4 Å²	142.4	80%	0.797	76%	0.763	S	S	*	*			trans	90.8	111.8	150.6	-69.8	-2.1	0	0	0	123.3
951	S	34.7	Very low	37.6	Very low	108 Å²	108	142.4 Å²	142.4	76%	0.755	76%	0.763	S	S	*	*				77.9	118.9	121.5	-160.6	0	0	0	0	122.4
952	I	38.6	Very low	37.4	Very low	165 Å²	165	144 Å²	144	85%	0.846	76%	0.764	S	S	*	*				175	150.3	115.4	-88	162	0	0	0	111.3
953	E	33.1	Very low	37.9	Very low	176 Å²	176	148.6 Å²	148.6	82%	0.822	77%	0.774	S	S	*	*			trans	-112.1	-167	-175.7	-116.3	-167.6	164.7	0	0	111
954	P	44	Very low	38.3	Very low	108 Å²	108	147.2 Å²	147.2	70%	0.701	77%	0.771	S	S	*	*			cis	-135.8	178.8	-39.7	38	-21.9	0	0	0	113.7
955	S	38.8	Very low	38.6	Very low	121 Å²	121	149 Å²	149	85%	0.846	78%	0.78	S	S	*	*			trans	-169.1	148.2	145.2	57.4	0	0	0	0	113.9
956	N	35.7	Very low	39.4	Very low	153 Å²	153	143.8 Å²	143.8	82%	0.818	78%	0.777	S	S	*	*			trans	-87.1	160.1	-174.8	-80.1	-21.4	0	0	0	115.3
957	D	44.4	Very low	39.9	Very low	166 Å²	166	144.6 Å²	144.6	89%	0.888	78%	0.781	S	S	*	*				-167.3	161	109.9	-94.3	-16.4	0	0	0	112.4
958	Q	34.7	Very low	40.1	Very low	154 Å²	154	146.6 Å²	146.6	72%	0.72	78%	0.776	S	S	*	*			trans	-145.6	169.9	-168.1	-142.9	-156.4	44.5	0	0	111.4
959	P	40.4	Very low	40.5	Very low	125 Å²	125	141.9 Å²	141.9	81%	0.812	77%	0.768	S	S	*	*				-148.3	-176.4	81.2	38.7	-18.2	0	0	0	116.6
960	E	37	Very low	40.7	Very low	154 Å²	154	145.3 Å²	145.3	72%	0.72	78%	0.775	S	S	*	*			trans	-85.3	170.8	-167.3	-41.9	-179.3	125.8	0	0	117.2
961	L	34.9	Very low	40.9	Very low	146 Å²	146	144.1 Å²	144.1	76%	0.764	77%	0.768	S	S	*	*				-153.9	128.6	123.1	-138.5	72.3	0	0	0	114.8
962	F	37.9	Very low	41.3	Very low	169 Å²	169	148.4 Å²	148.4	74%	0.741	77%	0.773	S	S	*	*			trans	48.5	99.7	163.2	-57.6	-46.3	0	0	0	122	V964	F962-V964 HydrophobicContact CB-CG2 4.2Å
963	K	43.1	Very low	41.6	Very low	216 Å²	216	147.9 Å²	147.9	94%	0.939	77%	0.767	S	S	*	*			trans	-106.9	126	140.7	-85.5	178	175.1	172.7	0	109.2
964	V	44.9	Very low	42.5	Very low	105 Å²	105	145.5 Å²	145.5	64%	0.636	77%	0.767	S	S	*	*			trans	-120.4	-18.9	-175.6	-159.9	0	0	0	0	113.7	F962 A966	F962-V964 HydrophobicContact CB-CG2 4.2Å; V964-A966 PolarHBondContact O-N 2.78Å
965	H	44.6	Very low	42.2	Very low	173 Å²	173	147.1 Å²	147.1	80%	0.801	77%	0.77	S	S	*	*	G	3₁₀ helix	trans	-87.9	2.5	-166.7	-121.2	-76.5	0	0	0	116.6
966	A	54.3	Low	42.2	Very low	82 Å²	82	145 Å²	145	68%	0.678	77%	0.767	S	S	*	*	G	3₁₀ helix	trans	-87.3	0.8	-174.9	0	0	0	0	0	115.1	V964	V964-A966 PolarHBondContact O-N 2.78Å
967	L	44.6	Very low	42.4	Very low	153 Å²	153	144.7 Å²	144.7	80%	0.801	77%	0.766	S	S	*	*	G	3₁₀ helix	trans	-101	-3.9	-173.4	-78.4	168.4	0	0	0	115.3
968	F	39.3	Very low	42.4	Very low	155 Å²	155	144.9 Å²	144.9	68%	0.68	76%	0.763	S	S	*	*	S	Bend	trans	-103.5	-4.2	-176.3	-79.1	-78	0	0	0	115	H970	F968-H970 PolarHBondContact O-N 2.91Å; F968-H970 VanDerWaalsContact O-N 3.08Å
969	S	46	Very low	42.8	Very low	102 Å²	102	148.5 Å²	148.5	71%	0.713	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	17	-173.7	49.9	0	0	0	0	115.5
970	H	47	Very low	42.8	Very low	171 Å²	171	146.2 Å²	146.2	79%	0.792	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.8	9.3	-171.4	-127.6	-55.3	0	0	0	116.3	F968	F968-H970 PolarHBondContact O-N 2.91Å; F968-H970 VanDerWaalsContact O-N 3.08Å
971	L	41.8	Very low	42.9	Very low	125 Å²	125	144.4 Å²	144.4	65%	0.654	77%	0.771	S	S	*	*	S	Bend	trans	-109.5	-2.4	-163.8	-142.2	73.8	0	0	0	116.9
972	F	42.5	Very low	43	Very low	198 Å²	198	145.7 Å²	145.7	87%	0.868	78%	0.778	S	S	*	*			trans	-141.2	66.6	-177.8	-75.4	-73.8	0	0	0	114
973	E	44.2	Very low	42.8	Very low	153 Å²	153	143.1 Å²	143.1	72%	0.715	78%	0.781	S	S	*	*			trans	-95	123.6	156.3	-74.9	-171.5	-177.4	0	0	110.7	N975	E973-N975 PolarHBondContact OE2-ND2 2.81Å
974	P	51.4	Low	42.6	Very low	127 Å²	127	136.5 Å²	136.5	83%	0.825	77%	0.774	S	S	*	*			trans	-101.1	81.3	164.9	35.3	-28	0	0	0	110.5	G976	P974-G976 PolarHBondContact O-N 2.8Å
975	N	39.4	Very low	42.2	Very low	141 Å²	141	139.2 Å²	139.2	75%	0.754	78%	0.784	S	S	*	*			trans	-66.6	128	171.6	-74.8	-64.5	0	0	0	110.4	E973	E973-N975 PolarHBondContact OE2-ND2 2.81Å
976	G	39.1	Very low	41.9	Very low	77 Å²	77	136.2 Å²	136.2	79%	0.794	78%	0.778	S	S	*	*			trans	-152.6	65.9	-170.1	0	0	0	0	0	113.7	P974	P974-G976 PolarHBondContact O-N 2.8Å
977	D	40	Very low	40.9	Very low	147 Å²	147	140.9 Å²	140.9	79%	0.786	79%	0.786	S	S	*	*			trans	-79.4	119.1	179.7	173.3	24.4	0	0	0	112.7
978	M	44.3	Very low	40.5	Very low	170 Å²	170	142 Å²	142	84%	0.837	79%	0.789	S	S	*	*			trans	-149	89.6	163.7	-84.4	-58.8	-92.9	0	0	113.3
979	R	41.2	Very low	40.2	Very low	229 Å²	229	139.8 Å²	139.8	86%	0.864	79%	0.788	S	S	*	*			trans	33.1	126.9	138.2	-65.5	178.6	166.2	-165.4	-4.5	121.1
980	G	42.4	Very low	39.8	Very low	77 Å²	77	140.6 Å²	140.6	79%	0.794	79%	0.789	S	S	*	*			trans	166.1	103.4	146.3	0	0	0	0	0	117.4
981	P	38	Very low	39.2	Very low	117 Å²	117	143.4 Å²	143.4	76%	0.76	79%	0.792	S	S	*	*			trans	-111.6	132.4	178	36.5	-27.7	0	0	0	115.4
982	L	37.2	Very low	38.9	Very low	173 Å²	173	142.8 Å²	142.8	91%	0.906	80%	0.796	S	S	*	*			trans	-142.4	113.8	163.7	-71.6	169	0	0	0	106.4
983	S	34	Very low	38.3	Very low	115 Å²	115	142.1 Å²	142.1	80%	0.804	80%	0.796	S	S	*	*			cis	81.9	96.1	46.7	-60.8	0	0	0	0	114.3
984	G	38.1	Very low	37.9	Very low	76 Å²	76	141 Å²	141	78%	0.784	80%	0.799	S	S	*	*			trans	151.3	134.3	175.8	0	0	0	0	0	110.2
985	L	37.4	Very low	37	Very low	163 Å²	163	140.1 Å²	140.1	85%	0.853	80%	0.796	S	S	*	*			cis	-148.1	142.2	4.3	-172.7	67.4	0	0	0	111.6
986	T	37.8	Very low	36.8	Very low	109 Å²	109	138.1 Å²	138.1	67%	0.669	79%	0.793	S	S	*	*			trans	-3.1	116.4	160.4	-28.5	0	0	0	0	117.5
987	Q	34.2	Very low	36.6	Very low	181 Å²	181	144.2 Å²	144.2	85%	0.846	80%	0.797	S	S	*	*				54.6	126.7	78.8	-77.7	-166	15	0	0	117.6
988	M	34.8	Very low	36.3	Very low	176 Å²	176	143.8 Å²	143.8	87%	0.867	80%	0.8	S	S	*	*			trans	162.1	165.3	137.4	-92.4	-174.2	180	0	0	111.3
989	T	33.1	Very low	35.9	Very low	108 Å²	108	141.3 Å²	141.3	66%	0.663	80%	0.796	S	S	*	*				-163.7	156.1	-75.3	-175.8	0	0	0	0	110.9
990	T	39.1	Very low	35.6	Very low	119 Å²	119	136.4 Å²	136.4	73%	0.73	79%	0.792	S	S	*	*			trans	65.4	159.9	173.7	74.3	0	0	0	0	116.8
991	R	33.3	Very low	35.1	Very low	230 Å²	230	137.9 Å²	137.9	87%	0.868	79%	0.79	S	S	*	*			cis	-161.5	160.8	-17.4	-118.2	177	170.1	175.1	-4.4	109
992	P	35.8	Very low	35	Very low	113 Å²	113	137.3 Å²	137.3	73%	0.734	79%	0.789	S	S	*	*			trans	-101.1	176.1	173.4	38.6	-33.9	0	0	0	115.2
993	E	29.6	Very low	35.1	Very low	184 Å²	184	137.3 Å²	137.3	86%	0.86	79%	0.785	S	S	*	*			trans	86.6	160.1	162.2	-59.2	-149.6	142.3	0	0	122.3
994	V	36.5	Very low	35.1	Very low	129 Å²	129	137.3 Å²	137.3	78%	0.782	78%	0.776	S	S	*	*			trans	92.6	86.1	160.5	-163.5	0	0	0	0	120.5
995	S	32.1	Very low	34.9	Very low	109 Å²	109	139.8 Å²	139.8	76%	0.762	77%	0.771	S	S	*	*				63.1	160.3	117.4	-150.7	0	0	0	0	124.6
996	S	35.2	Very low	34.9	Very low	98 Å²	98	139 Å²	139	69%	0.685	77%	0.767	S	S	*	*			trans	65.2	116.4	168.7	52.5	0	0	0	0	118
997	K	33.6	Very low	34.8	Very low	205 Å²	205	141.1 Å²	141.1	89%	0.891	77%	0.774	S	S	*	*				73.9	111.5	69.1	-77.9	-171.9	175.8	-177.4	0	115
998	V	34.5	Very low	35.2	Very low	139 Å²	139	137.6 Å²	137.6	84%	0.842	77%	0.767	S	S	*	*				171.9	138.6	122.5	151.6	0	0	0	0	109.9
999	P	36.9	Very low	35.6	Very low	117 Å²	117	136.3 Å²	136.3	76%	0.76	76%	0.763	S	S	*	*			trans	-114.9	150.6	-178.5	39.7	-31	0	0	0	115.5
1000	T	33.1	Very low	35.9	Very low	127 Å²	127	139.3 Å²	139.3	78%	0.779	77%	0.774	S	S	*	*			trans	-150	119	155.8	49	0	0	0	0	107.7
1001	S	33.3	Very low	36.2	Very low	108 Å²	108	141.5 Å²	141.5	76%	0.755	78%	0.781	S	S	*	*			cis	83.7	88.1	48	77.9	0	0	0	0	115.2
1002	S	36.1	Very low	36.5	Very low	105 Å²	105	138.7 Å²	138.7	73%	0.734	77%	0.771	S	S	*	*			trans	-173.1	120.3	142.7	55	0	0	0	0	112.9
1003	Q	39.1	Very low	37	Very low	173 Å²	173	135.6 Å²	135.6	81%	0.808	76%	0.76	S	S	*	*			trans	58.6	138.2	130.1	-68.2	-179.5	-7.9	0	0	120.4
1004	N	34.2	Very low	38.4	Very low	115 Å²	115	133.1 Å²	133.1	62%	0.615	76%	0.76	S	S	*	*			cis	-144.3	147.8	9.7	-92.4	-38.5	0	0	0	112.8
1005	N	34.3	Very low	39.1	Very low	128 Å²	128	132.7 Å²	132.7	68%	0.684	75%	0.754	S	S	*	*			trans	38.9	122.3	137.1	-48	-13.9	0	0	0	118.9
1006	L	35.5	Very low	39.7	Very low	147 Å²	147	135.5 Å²	135.5	77%	0.77	76%	0.759	S	S	*	*			cis	58.9	109.1	45.8	-55	174.3	0	0	0	114.7
1007	N	37.5	Very low	41.2	Very low	152 Å²	152	136.2 Å²	136.2	81%	0.813	76%	0.761	S	S	*	*				-159.9	136	98.4	-100.2	3.5	0	0	0	111.1
1008	P	42.4	Very low	42.4	Very low	107 Å²	107	132.1 Å²	132.1	70%	0.695	76%	0.756	S	S	*	*			trans	-93.4	145.6	163.3	36.1	-29.7	0	0	0	110.7
1009	D	43	Very low	42.5	Very low	150 Å²	150	131.9 Å²	131.9	80%	0.802	75%	0.75	S	S	*	*			trans	-157.7	170.2	168	-117.8	-39.9	0	0	0	110.9
1010	L	39.3	Very low	42.8	Very low	170 Å²	170	135 Å²	135	89%	0.89	75%	0.752	S	S	*	*			trans	67.5	55.7	176.2	-68.4	138	0	0	0	116.4
1011	L	44.4	Very low	43	Very low	165 Å²	165	133.5 Å²	133.5	86%	0.864	74%	0.742	S	S	*	*			trans	-68.3	114.3	137.8	169	75.1	0	0	0	108.7
1012	Y	40.9	Very low	43.2	Very low	171 Å²	171	131.4 Å²	131.4	67%	0.671	73%	0.726	S	S	*	*			trans	-170.2	143.1	142	-131.5	-108.4	0	0	0	112.8	D1015	Y1012-D1015 VanDerWaalsContact CE1-OD2 3.24Å; Y1012-D1015 WeakPolarHBondContact CE1-OD2 3.45Å; Y1012-D1015 PolarHBondContact OH-OD2 3.43Å
1013	G	45.4	Very low	43.3	Very low	49 Å²	49	131.3 Å²	131.3	51%	0.505	72%	0.721	S	S	.	*			trans	-111.9	162.6	162.6	0	0	0	0	0	109.7	D1015	G1013-D1015 PolarHBondContact O-N 2.89Å
1014	P	59.6	Low	43.2	Very low	131 Å²	131	127.4 Å²	127.4	85%	0.851	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-67.1	129.5	-173.6	26.9	-34.3	0	0	0	112.8
1015	D	51.1	Low	43.4	Very low	121 Å²	121	127.6 Å²	127.6	65%	0.647	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-70.4	148.8	171.9	-80.6	-38.9	0	0	0	111.9	Y1012 G1013	Y1012-D1015 VanDerWaalsContact CE1-OD2 3.24Å; Y1012-D1015 WeakPolarHBondContact CE1-OD2 3.45Å; Y1012-D1015 PolarHBondContact OH-OD2 3.43Å; G1013-D1015 PolarHBondContact O-N 2.89Å
1016	L	44.9	Very low	43.7	Very low	167 Å²	167	130.3 Å²	130.3	87%	0.874	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-90	140	178.8	-73.2	163.4	0	0	0	112
1017	P	65.9	Low	43.8	Very low	113 Å²	113	127.2 Å²	127.2	73%	0.734	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-75.7	153.7	-178.8	30.5	-35.3	0	0	0	113.7
1018	P	59.2	Low	43.7	Very low	119 Å²	119	127.8 Å²	127.8	77%	0.773	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-85.8	157.1	-171.3	33.6	-36.9	0	0	0	116.2
1019	N	36.4	Very low	43.7	Very low	135 Å²	135	128.3 Å²	128.3	72%	0.722	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-78.9	146.3	-175.7	-71.9	-47.8	0	0	0	115.4
1020	F	42.4	Very low	43.3	Very low	183 Å²	183	129.4 Å²	129.4	80%	0.803	73%	0.726	S	S	*	*			trans	-144.6	132.1	159.8	-90.3	-81	0	0	0	114	M1	M1-F1020 PolarHBondContact N-O 2.87Å
1021	T	38.2	Very low	43.1	Very low	95 Å²	95	126.3 Å²	126.3	58%	0.583	72%	0.719	S	S	*	*			trans	-74.2	172.8	-166.2	47.4	0	0	0	0	116.4	M1	M1-T1021 WeakPolarHBondContact CA-O 3.46Å; M1-T1021 VanDerWaalsContact CE-O 3.25Å; M1-T1021 WeakPolarHBondContact CE-O 3.07Å; M1-T1021 VanDerWaalsContact CG-O 3.24Å; M1-T1021 WeakPolarHBondContact CG-O 3.4Å; M1-T1021 PolarHBondContact N-O 3.12Å
1022	P	38.4	Very low	42.8	Very low	63 Å²	63	124.6 Å²	124.6	41%	0.409	72%	0.715	S	S	.	*			trans	-103.8	156.1	-180	35.3	-31.7	0	0	0	119.6	M1	M1-P1022 VanDerWaalsContact SD-C 3.58Å; M1-P1022 WeakPolarHBondContact SD-CA 3.23Å
1023	T	38.3	Very low	42.7	Very low	104 Å²	104	122 Å²	122	64%	0.638	72%	0.717	S	S	*	*			trans	-149.7	136.2	157.1	53.4	0	0	0	0	104.8	M1	M1-T1023 PolarHBondContact SD-N 3.44Å; M1-T1023 PolarHBondContact SD-OG1 2.74Å
1024	S	35.2	Very low	42.1	Very low	91 Å²	91	127.4 Å²	127.4	64%	0.636	73%	0.726	S	S	*	*			cis	142.1	156.1	12.3	61	0	0	0	0	105.2
1025	D	39.5	Very low	41.4	Very low	118 Å²	118	126.8 Å²	126.8	63%	0.631	72%	0.716	S	S	*	*			trans	73.5	144	169.9	-56	-64.5	0	0	0	119.1
1026	K	39.5	Very low	40.8	Very low	185 Å²	185	127.2 Å²	127.2	80%	0.804	71%	0.714	S	S	*	*			cis	-169.1	168.4	-30.3	-120.9	177.3	-162.4	115.7	0	111.1
1027	A	37.5	Very low	40.5	Very low	83 Å²	83	126.6 Å²	126.6	69%	0.686	71%	0.707	S	S	*	*			trans	79	89.2	151.2	0	0	0	0	0	123
1028	N	37.1	Very low	39.1	Very low	164 Å²	164	129.6 Å²	129.6	88%	0.877	71%	0.711	S	S	*	*				66.5	156.2	115.8	-67.4	13.4	0	0	0	125.2
1029	P	40.7	Very low	38.1	Very low	117 Å²	117	128.3 Å²	128.3	76%	0.76	71%	0.71	S	S	*	*			trans	-122.9	-169.6	-169	44.2	-28	0	0	0	115.4
1030	I	34.7	Very low	38.2	Very low	173 Å²	173	126.8 Å²	126.8	89%	0.887	71%	0.71	S	S	*	*			trans	-131.3	159.3	174.7	-64.9	-179.1	0	0	0	110.7
1031	S	35.4	Very low	37.9	Very low	106 Å²	106	129 Å²	129	74%	0.741	71%	0.713	S	S	*	*			trans	-131.3	-159.1	-162.7	58.6	0	0	0	0	114.9
1032	V	38.9	Very low	37.8	Very low	129 Å²	129	129.2 Å²	129.2	78%	0.782	72%	0.718	S	S	*	*			trans	84.7	132.9	177.3	174.8	0	0	0	0	114.5
1033	T	39.2	Very low	37.7	Very low	115 Å²	115	132.3 Å²	132.3	71%	0.706	74%	0.736	S	S	*	*			cis	-156.9	165.2	-13.4	25.9	0	0	0	0	107.9
1034	K	33.1	Very low	37.5	Very low	164 Å²	164	134.1 Å²	134.1	71%	0.713	74%	0.741	S	S	*	*			cis	102.9	164.4	21.5	-153.5	-126.1	154.2	-144	0	114.1
1035	D	42.9	Very low	37.4	Very low	117 Å²	117	135 Å²	135	63%	0.626	75%	0.748	S	S	*	*			trans	82.1	138.8	-176.5	-55.7	-23.3	0	0	0	115.4
1036	Q	40.2	Very low	37.3	Very low	130 Å²	130	136 Å²	136	61%	0.607	75%	0.753	S	S	*	*			cis	-172.4	142.4	-16.2	-110.3	-171.8	-74.3	0	0	106.5
1037	E	38	Very low	37.4	Very low	155 Å²	155	134.5 Å²	134.5	72%	0.724	75%	0.754	S	S	*	*			trans	53.1	149.4	146.8	-75.8	138.7	-130.4	0	0	122.5
1038	E	37	Very low	37.3	Very low	175 Å²	175	137.5 Å²	137.5	82%	0.818	76%	0.757	S	S	*	*			cis	-157.8	159.3	-2.9	-141.8	-178.2	-165.5	0	0	111.8
1039	A	36.7	Very low	37.3	Very low	92 Å²	92	136.6 Å²	136.6	76%	0.76	75%	0.751	S	S	*	*			trans	57.2	139.9	156.9	0	0	0	0	0	121.5
1040	S	39.1	Very low	36.8	Very low	103 Å²	103	140.6 Å²	140.6	72%	0.72	76%	0.757	S	S	*	*			cis	-169.2	166.1	-6.9	57.5	0	0	0	0	113.4
1041	R	36	Very low	37	Very low	231 Å²	231	137.6 Å²	137.6	87%	0.872	75%	0.746	S	S	*	*			trans	90.1	113.6	161.5	-64.2	-174	170	-175.1	-3.8	121
1042	S	36.7	Very low	36.8	Very low	98 Å²	98	140.6 Å²	140.6	69%	0.685	75%	0.749	S	S	*	*			trans	54.1	106.5	150.2	52.9	0	0	0	0	119.3
1043	T	36.2	Very low	36.8	Very low	128 Å²	128	138.6 Å²	138.6	79%	0.785	74%	0.74	S	S	*	*				69.6	129.5	57.6	73.9	0	0	0	0	113.8
1044	L	34.3	Very low	36.7	Very low	142 Å²	142	141.5 Å²	141.5	74%	0.743	75%	0.745	S	S	*	*			cis	-150.7	146.6	4.7	-157.4	113.1	0	0	0	110.5	D1046	L1044-D1046 WeakPolarHBondContact CD2-OD2 3.21Å
1045	S	33.8	Very low	36.8	Very low	110 Å²	110	141.1 Å²	141.1	77%	0.769	75%	0.75	S	S	*	*			trans	-156.1	109.1	175.9	55.2	0	0	0	0	109
1046	D	37.3	Very low	36.6	Very low	138 Å²	138	142.4 Å²	142.4	74%	0.738	76%	0.762	S	S	*	*			trans	-126.2	105.1	179.1	-71.4	-48.3	0	0	0	110	L1044	L1044-D1046 WeakPolarHBondContact CD2-OD2 3.21Å
1047	D	39.9	Very low	36.2	Very low	154 Å²	154	143.1 Å²	143.1	82%	0.824	77%	0.77	S	S	*	*			trans	-73.6	-160.5	151	-75.1	-57.7	0	0	0	109.3
1048	I	35.7	Very low	36.3	Very low	146 Å²	146	147.8 Å²	147.8	75%	0.749	78%	0.781	S	S	*	*			trans	85	99.6	155.9	-58.7	178.6	0	0	0	116.8
1049	L	36.7	Very low	36.2	Very low	145 Å²	145	144.5 Å²	144.5	76%	0.759	78%	0.777	S	S	*	*			trans	64.3	112.7	141.6	-56.9	174.1	0	0	0	119.8	V1051	L1049-V1051 HydrophobicContact CB-CG2 4.31Å
1050	F	30.6	Very low	36.4	Very low	202 Å²	202	145.8 Å²	145.8	89%	0.886	78%	0.781	S	S	*	*			trans	-79.2	131.9	144.8	-129.9	-102.9	0	0	0	109.2
1051	V	38.9	Very low	36.4	Very low	110 Å²	110	144.8 Å²	144.8	67%	0.667	78%	0.779	S	S	*	*			trans	-115.1	110.6	176.1	176.1	0	0	0	0	109	L1049	L1049-V1051 HydrophobicContact CB-CG2 4.31Å
1052	E	32.7	Very low	36.5	Very low	169 Å²	169	142.8 Å²	142.8	79%	0.79	78%	0.776	S	S	*	*			trans	-78.3	124.6	178.4	-165.1	92.9	-144.3	0	0	110.2
1053	S	37.4	Very low	36.7	Very low	87 Å²	87	147 Å²	147	61%	0.608	79%	0.785	S	S	*	*			trans	-154.1	98.8	172.4	48	0	0	0	0	115.3
1054	H	38.5	Very low	36.7	Very low	175 Å²	175	150.2 Å²	150.2	81%	0.81	79%	0.788	S	S	*	*			trans	55.3	110.8	141.4	-47.9	-49.9	0	0	0	121.9
1055	L	35.2	Very low	37.1	Very low	156 Å²	156	153.5 Å²	153.5	82%	0.817	80%	0.797	S	S	*	*			trans	12.9	122.4	133.7	-82.3	63.4	0	0	0	119.3
1056	V	38.2	Very low	37.3	Very low	145 Å²	145	153.5 Å²	153.5	88%	0.879	80%	0.797	S	S	*	*			trans	-139.3	132.2	131.9	-177.2	0	0	0	0	110.5
1057	N	32.5	Very low	37.6	Very low	144 Å²	144	157 Å²	157	77%	0.77	81%	0.805	S	S	*	*			trans	-70.2	160.8	176.3	-76.4	-61.4	0	0	0	113.8
1058	R	38	Very low	37.4	Very low	253 Å²	253	156.8 Å²	156.8	96%	0.955	80%	0.804	S	S	*	*			trans	-178.5	77.3	-155.9	-49.7	164.2	-172.1	-163.7	3.6	113.1
1059	S	36.2	Very low	37.7	Very low	106 Å²	106	155.4 Å²	155.4	74%	0.741	81%	0.807	S	S	*	*			trans	-90.9	172.9	-175.2	59.3	0	0	0	0	114.5
1060	S	40.5	Very low	38	Very low	120 Å²	120	157.4 Å²	157.4	84%	0.839	81%	0.81	S	S	*	*			trans	83.1	152.2	176.1	83.7	0	0	0	0	117.1
1061	A	40	Very low	38.5	Very low	81 Å²	81	159.7 Å²	159.7	67%	0.669	81%	0.813	S	S	*	*			cis	-162.6	147.7	-28.6	0	0	0	0	0	111.9
1062	K	37.1	Very low	38.7	Very low	189 Å²	189	162.7 Å²	162.7	82%	0.822	82%	0.816	S	S	*	*			trans	29.5	118.6	149.8	-57.7	173.7	-177.3	176.3	0	118.8
1063	H	40.1	Very low	39.1	Very low	187 Å²	187	162.4 Å²	162.4	87%	0.866	82%	0.815	S	S	*	*				-167.5	128.6	105.2	-113	-77.4	0	0	0	114.4
1064	K	37.2	Very low	39.3	Very low	196 Å²	196	168 Å²	168	85%	0.852	83%	0.828	S	S	*	*			trans	-76.5	145.6	163.6	-80.7	178	175.4	177.2	0	110.1
1065	K	42.5	Very low	39.1	Very low	211 Å²	211	165.7 Å²	165.7	92%	0.917	83%	0.827	S	S	*	*			trans	-150.9	96.1	152.9	-141.2	167.2	-168.1	170	0	112
1066	S	37.9	Very low	39.4	Very low	110 Å²	110	167 Å²	167	77%	0.769	83%	0.826	S	S	*	*			trans	-84.1	140.6	173.8	48.6	0	0	0	0	111.6
1067	K	43.3	Very low	39.6	Very low	212 Å²	212	167.9 Å²	167.9	92%	0.922	82%	0.82	S	S	*	*			trans	-138.2	129.1	152	-77.4	-160.9	173.3	-172.2	0	109.8
1068	N	35.9	Very low	40.2	Very low	149 Å²	149	169.6 Å²	169.6	80%	0.797	82%	0.82	S	S	*	*			trans	-112	139	178.7	-171.1	-6.3	0	0	0	107.8
1069	S	43.4	Very low	40.4	Very low	117 Å²	117	165.5 Å²	165.5	82%	0.818	81%	0.81	S	S	*	*			trans	-156	96.2	-179.7	-178.3	0	0	0	0	111.8
1070	K	42.4	Very low	41	Very low	187 Å²	187	167.1 Å²	167.1	81%	0.813	81%	0.805	S	S	*	*			trans	-72.3	141.6	170	-58.8	172.4	-179	175	0	110.3
1071	R	40.3	Very low	41.1	Very low	250 Å²	250	168.8 Å²	168.8	94%	0.943	80%	0.8	S	S	*	*			trans	-154.6	144.3	147.3	-122.5	170.4	176.9	173	-1.8	112
1072	K	42.7	Very low	41.2	Very low	172 Å²	172	175 Å²	175	75%	0.748	81%	0.812	S	S	*	*			trans	-113	163.8	-176.3	-62.1	-175.8	179	-176.3	0	111.2
1073	H	42.5	Very low	41.4	Very low	164 Å²	164	171.5 Å²	171.5	76%	0.759	81%	0.811	S	S	*	*			trans	68	151.6	166	-46.8	-67.3	0	0	0	114.1
1074	K	41.3	Very low	41.6	Very low	204 Å²	204	172.4 Å²	172.4	89%	0.887	81%	0.812	S	S	*	*			cis	-157.3	157.4	32.2	-144.7	163.2	-170.6	174.1	0	110.7
1075	T	34.2	Very low	42	Very low	127 Å²	127	172.6 Å²	172.6	78%	0.779	81%	0.813	S	S	*	*			trans	-83.9	154.5	169.8	47.6	0	0	0	0	111.9
1076	K	40.9	Very low	42.1	Very low	183 Å²	183	168.7 Å²	168.7	80%	0.796	81%	0.807	S	S	*	*			trans	167.5	120.4	133.2	-92.4	179.9	178.7	-173	0	114.2
1077	H	43.1	Very low	42.4	Very low	164 Å²	164	168.7 Å²	168.7	76%	0.759	81%	0.807	S	S	*	*			trans	44.9	152.5	140.3	-60.2	-64.5	0	0	0	125.9
1078	K	44.5	Very low	42.2	Very low	179 Å²	179	170 Å²	170	78%	0.778	81%	0.806	S	S	*	*			trans	100.8	100.7	131.4	-97.6	170.2	-177.2	176.2	0	120.7
1079	K	43.5	Very low	42.6	Very low	168 Å²	168	173 Å²	173	73%	0.73	81%	0.812	S	S	*	*				88.4	129.7	111.3	-102.6	-165	177.7	-164.9	0	122
1080	Q	46.7	Very low	42.4	Very low	139 Å²	139	171.8 Å²	171.8	65%	0.65	81%	0.809	S	S	*	*			trans	104.9	111.8	134.7	-59.1	-104.4	-62.6	0	0	122
1081	H	42.9	Very low	42.8	Very low	155 Å²	155	168.3 Å²	168.3	72%	0.718	81%	0.805	S	S	*	*			trans	16.7	140.6	144.9	-41.2	-91	0	0	0	122.9
1082	K	43.1	Very low	42.9	Very low	212 Å²	212	163.5 Å²	163.5	92%	0.922	80%	0.797	S	S	*	*				-163.6	159.5	101.6	-108.8	163.4	-176.7	167	0	113.8
1083	S	41	Very low	42.8	Very low	115 Å²	115	160.4 Å²	160.4	80%	0.804	80%	0.797	S	S	*	*			trans	-136.7	147.1	-174.4	56.6	0	0	0	0	113.4
1084	K	45	Very low	42.8	Very low	206 Å²	206	157.3 Å²	157.3	90%	0.896	79%	0.794	S	S	*	*			trans	-155.9	122.3	163.5	-70.3	-178.4	-179.4	175.1	0	105.6
1085	K	44.3	Very low	43	Very low	200 Å²	200	151.8 Å²	151.8	87%	0.87	78%	0.78	S	S	*	*			cis	89.4	140.5	28.7	-160.1	-179.8	-178.5	177.3	0	113.5
1086	V	45.3	Very low	43.4	Very low	130 Å²	130	153 Å²	153	79%	0.788	78%	0.782	S	S	*	*			trans	86.5	133	173.9	-174.2	0	0	0	0	115
1087	S	43.2	Very low	43.6	Very low	110 Å²	110	148.4 Å²	148.4	77%	0.769	77%	0.773	S	S	*	*			cis	-164.7	162.5	-23.1	55.5	0	0	0	0	113.1
1088	R	39.9	Very low	43.5	Very low	238 Å²	238	147.9 Å²	147.9	90%	0.898	78%	0.776	S	S	*	*			trans	-73.5	151.4	178.4	-55.4	164.3	174.4	156	-5.5	114.6
1089	K	44.5	Very low	43.5	Very low	214 Å²	214	144.4 Å²	144.4	93%	0.93	77%	0.774	S	S	*	*				-177.6	168.3	125.3	-101.6	174.9	-179.7	-174.1	0	112.8
1090	A	38.8	Very low	43.8	Very low	90 Å²	90	140.4 Å²	140.4	74%	0.744	77%	0.768	S	S	*	*			trans	-155.7	-159.5	-174	0	0	0	0	0	109.1
1091	P	50.8	Low	44.2	Very low	114 Å²	114	140.6 Å²	140.6	74%	0.74	77%	0.773	S	S	*	*				-118.6	-155.3	-64.6	33.4	-15.1	0	0	0	111.3
1092	I	42.1	Very low	44.7	Very low	150 Å²	150	138.9 Å²	138.9	77%	0.769	77%	0.773	S	S	*	*			trans	138.8	129.1	143.1	-71.6	155.5	0	0	0	115.9
1093	S	41.5	Very low	45.1	Very low	106 Å²	106	133.6 Å²	133.6	74%	0.741	76%	0.763	S	S	*	*			trans	53	153	156.3	66.1	0	0	0	0	122
1094	S	42.2	Very low	45.7	Very low	100 Å²	100	139.3 Å²	139.3	70%	0.699	79%	0.785	S	S	*	*			cis	-172.5	-178.4	-11.7	50.7	0	0	0	0	111.6
1095	S	44.6	Very low	45.7	Very low	87 Å²	87	136 Å²	136	61%	0.608	78%	0.779	S	S	*	*			trans	76.8	121.5	149.1	33.4	0	0	0	0	122
1096	D	43.2	Very low	45.8	Very low	153 Å²	153	132.6 Å²	132.6	82%	0.818	78%	0.775	S	S	*	*			trans	71.7	146.5	133.6	-52.7	-12.8	0	0	0	121.2
1097	S	44.9	Very low	45.8	Very low	86 Å²	86	132.8 Å²	132.8	60%	0.601	77%	0.774	S	S	*	*			cis	-169.7	163.7	-16.2	53.4	0	0	0	0	111.4
1098	N	41.8	Very low	45.9	Very low	153 Å²	153	134.1 Å²	134.1	82%	0.818	77%	0.774	S	S	*	*			trans	64.4	161.3	163.4	-52.1	-32	0	0	0	116.9
1099	S	45.2	Very low	46.3	Very low	107 Å²	107	127.6 Å²	127.6	75%	0.748	77%	0.766	S	S	*	*			cis	-168.2	-175	-31	68	0	0	0	0	106.3
1100	S	47.9	Very low	46.4	Very low	84 Å²	84	121.9 Å²	121.9	59%	0.587	76%	0.756	S	S	*	*			cis	-170.9	155.4	-4.4	24.4	0	0	0	0	108.2
1101	D	55.3	Low	47	Very low	143 Å²	143	124.1 Å²	124.1	77%	0.765	76%	0.756	S	S	*	*			trans	66	147.9	152.3	-58.9	-12.2	0	0	0	120.2
1102	T	54.2	Low	46.7	Very low	118 Å²	118	124.9 Å²	124.9	72%	0.724	76%	0.758	S	S	*	*			cis	-162.6	153	-8.1	18.1	0	0	0	0	110.9
1103	S	51.9	Low	47.1	Very low	101 Å²	101	122.8 Å²	122.8	71%	0.706	76%	0.757	S	S	*	*			trans	17.5	127.5	152.9	60.9	0	0	0	0	121.6
1104	D	52.3	Low	47.6	Very low	236 Å²	236	124.4 Å²	124.4	100%	1.262	76%	0.758	S	S	*	*				-142.1	0	80	-121.9	8.2	0	0	0	110.1

Retrieved 1,104 of 1,104 residues in 854 ms (Link to these results)

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